NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
591719 | 2msl | 25125 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 1.808 0.000 0.855 2 HA MET 1 HA MET 1 1.655 0.735 -1.900 3 HB2 MET 1 2HB MET 1 3.569 1.222 -0.295 4 HB3 MET 1 3HB MET 1 4.047 -0.457 -0.504 5 HG2 MET 1 2HG MET 1 5.004 -0.048 -2.465 6 HG3 MET 1 3HG MET 1 3.624 0.888 -3.036 7 HE1 MET 1 3HE MET 1 4.374 4.418 -2.533 8 HE2 MET 1 1HE MET 1 3.183 3.139 -2.763 9 HE3 MET 1 2HE MET 1 3.580 3.691 -1.136 10 H GLN 2 H GLN 2 1.789 -2.267 -0.150 11 HA GLN 2 HA GLN 2 1.693 -4.444 -0.799 12 HB2 GLN 2 2HB GLN 2 0.683 -3.295 -3.406 13 HB3 GLN 2 3HB GLN 2 0.493 -4.956 -2.861 14 HG2 GLN 2 2HG GLN 2 -0.952 -4.277 -1.082 15 HG3 GLN 2 3HG GLN 2 -0.640 -2.574 -1.416 16 HE21 GLN 2 1HE2 GLN 2 -3.197 -3.627 -1.299 17 HE22 GLN 2 2HE2 GLN 2 -3.905 -3.562 -2.873 18 H ARG 3 H ARG 3 4.186 -3.217 -1.043 19 HA ARG 3 HA ARG 3 5.331 -3.934 -3.597 20 HB2 ARG 3 2HB ARG 3 7.241 -2.842 -2.908 21 HB3 ARG 3 3HB ARG 3 6.018 -2.002 -1.963 22 HG2 ARG 3 2HG ARG 3 7.795 -4.229 -0.988 23 HG3 ARG 3 3HG ARG 3 7.959 -2.514 -0.606 24 HD2 ARG 3 2HD ARG 3 5.563 -4.215 0.071 25 HD3 ARG 3 3HD ARG 3 6.865 -3.817 1.192 26 HE ARG 3 HE ARG 3 5.617 -1.517 0.002 27 HH11 ARG 3 1HH1 ARG 3 5.478 -3.829 2.601 28 HH12 ARG 3 2HH1 ARG 3 4.582 -2.787 3.655 29 HH21 ARG 3 1HH2 ARG 3 4.436 -0.135 1.380 30 HH22 ARG 3 2HH2 ARG 3 3.989 -0.686 2.959 31 H GLY 4 H GLY 4 4.334 -5.734 -1.083 32 HA2 GLY 4 2HA GLY 4 6.019 -7.956 -1.835 33 HA3 GLY 4 3HA GLY 4 6.278 -7.394 -0.190 34 H ILE 5 H ILE 5 4.353 -9.296 -2.246 35 HA ILE 5 HA ILE 5 2.069 -9.447 -0.489 36 HB ILE 5 HB ILE 5 2.836 -11.035 -2.936 37 HG12 ILE 5 2HG1 ILE 5 0.496 -9.171 -2.588 38 HG13 ILE 5 3HG1 ILE 5 2.082 -8.575 -3.066 39 HG21 ILE 5 1HG2 ILE 5 0.350 -11.746 -2.747 40 HG22 ILE 5 2HG2 ILE 5 1.563 -12.583 -1.779 41 HG23 ILE 5 3HG2 ILE 5 0.545 -11.347 -1.040 42 HD11 ILE 5 3HD1 ILE 5 1.543 -10.729 -4.761 43 HD12 ILE 5 1HD1 ILE 5 0.044 -9.806 -4.655 44 HD13 ILE 5 2HD1 ILE 5 1.535 -9.012 -5.161 45 H VAL 6 H VAL 6 1.536 -11.085 0.903 46 HA VAL 6 HA VAL 6 3.583 -13.160 1.348 47 HB VAL 6 HB VAL 6 1.907 -11.972 3.551 48 HG11 VAL 6 1HG1 VAL 6 2.863 -14.182 3.963 49 HG12 VAL 6 2HG1 VAL 6 4.470 -13.564 3.576 50 HG13 VAL 6 3HG1 VAL 6 3.611 -12.962 4.994 51 HG21 VAL 6 3HG2 VAL 6 4.688 -11.161 2.705 52 HG22 VAL 6 1HG2 VAL 6 3.232 -10.170 2.606 53 HG23 VAL 6 2HG2 VAL 6 3.875 -10.637 4.180 54 H TRP 7 H TRP 7 2.858 -15.178 1.233 55 HA TRP 7 HA TRP 7 -0.049 -15.623 1.381 56 HB2 TRP 7 2HB TRP 7 2.111 -17.158 -0.074 57 HB3 TRP 7 3HB TRP 7 0.448 -17.718 0.077 58 HD1 TRP 7 HD1 TRP 7 -0.062 -14.217 -0.319 59 HE1 TRP 7 HE1 TRP 7 -0.422 -13.540 -2.776 60 HE3 TRP 7 HE3 TRP 7 1.702 -18.443 -2.593 61 HZ2 TRP 7 HZ2 TRP 7 -0.013 -14.650 -5.338 62 HZ3 TRP 7 HZ3 TRP 7 1.682 -18.555 -5.050 63 HH2 TRP 7 HH2 TRP 7 0.842 -16.697 -6.393 64 H VAL 8 H VAL 8 -0.695 -17.806 2.190 65 HA VAL 8 HA VAL 8 1.153 -18.883 4.199 66 HB VAL 8 HB VAL 8 -1.747 -18.321 4.811 67 HG11 VAL 8 1HG1 VAL 8 -1.003 -18.747 7.141 68 HG12 VAL 8 2HG1 VAL 8 -0.855 -20.154 6.087 69 HG13 VAL 8 3HG1 VAL 8 0.576 -19.215 6.512 70 HG21 VAL 8 3HG2 VAL 8 -0.983 -16.473 6.195 71 HG22 VAL 8 1HG2 VAL 8 0.682 -16.764 5.692 72 HG23 VAL 8 2HG2 VAL 8 -0.512 -16.219 4.515 73 H VAL 9 H VAL 9 0.857 -21.057 4.711 74 HA VAL 9 HA VAL 9 -1.246 -22.513 3.283 75 HB VAL 9 HB VAL 9 0.683 -22.623 1.803 76 HG11 VAL 9 1HG1 VAL 9 2.507 -24.236 3.197 77 HG12 VAL 9 2HG1 VAL 9 2.735 -22.573 2.653 78 HG13 VAL 9 3HG1 VAL 9 2.117 -22.895 4.273 79 HG21 VAL 9 3HG2 VAL 9 -0.440 -24.582 1.519 80 HG22 VAL 9 1HG2 VAL 9 1.082 -25.234 2.126 81 HG23 VAL 9 2HG2 VAL 9 -0.292 -25.042 3.215 82 H ASP 10 H ASP 10 -2.001 -22.513 5.562 83 HA ASP 10 HA ASP 10 -0.665 -24.615 7.137 84 HB2 ASP 10 2HB ASP 10 -1.811 -23.592 9.116 85 HB3 ASP 10 3HB ASP 10 -0.622 -22.540 8.353 86 H ASP 11 H ASP 11 -2.220 -25.819 8.601 87 HA ASP 11 HA ASP 11 -4.634 -26.487 7.054 88 HB2 ASP 11 2HB ASP 11 -2.596 -28.148 7.816 89 HB3 ASP 11 3HB ASP 11 -3.759 -28.393 9.116 90 H ASP 12 H ASP 12 -4.241 -24.388 9.175 91 HA ASP 12 HA ASP 12 -6.529 -25.189 10.824 92 HB2 ASP 12 2HB ASP 12 -3.819 -24.564 11.762 93 HB3 ASP 12 3HB ASP 12 -5.082 -23.642 12.572 94 H SER 13 H SER 13 -7.823 -23.463 11.571 95 HA SER 13 HA SER 13 -7.895 -21.225 9.788 96 HB2 SER 13 2HB SER 13 -10.060 -21.477 10.336 97 HB3 SER 13 3HB SER 13 -9.656 -22.445 11.754 98 HG SER 13 HG SER 13 -9.398 -20.567 12.935 99 H SER 14 H SER 14 -7.502 -21.509 13.320 100 HA SER 14 HA SER 14 -6.977 -18.805 13.810 101 HB2 SER 14 2HB SER 14 -6.005 -19.572 15.948 102 HB3 SER 14 3HB SER 14 -7.534 -20.378 15.602 103 HG SER 14 HG SER 14 -6.065 -21.922 16.255 104 H ILE 15 H ILE 15 -5.025 -21.239 12.393 105 HA ILE 15 HA ILE 15 -2.493 -20.006 12.987 106 HB ILE 15 HB ILE 15 -3.241 -22.188 11.041 107 HG12 ILE 15 2HG1 ILE 15 -3.458 -22.799 13.407 108 HG13 ILE 15 3HG1 ILE 15 -2.113 -23.654 12.658 109 HG21 ILE 15 1HG2 ILE 15 -0.813 -22.597 10.855 110 HG22 ILE 15 2HG2 ILE 15 -1.297 -21.034 10.197 111 HG23 ILE 15 3HG2 ILE 15 -0.519 -21.123 11.778 112 HD11 ILE 15 3HD1 ILE 15 -0.785 -22.915 14.256 113 HD12 ILE 15 1HD1 ILE 15 -1.087 -21.257 13.735 114 HD13 ILE 15 2HD1 ILE 15 -2.115 -21.998 14.962 115 H ARG 16 H ARG 16 -4.740 -20.073 10.270 116 HA ARG 16 HA ARG 16 -2.995 -18.502 8.587 117 HB2 ARG 16 2HB ARG 16 -4.916 -18.525 7.010 118 HB3 ARG 16 3HB ARG 16 -4.417 -20.132 7.521 119 HG2 ARG 16 2HG ARG 16 -6.273 -20.252 9.069 120 HG3 ARG 16 3HG ARG 16 -6.748 -18.603 8.658 121 HD2 ARG 16 2HD ARG 16 -6.872 -19.503 6.234 122 HD3 ARG 16 3HD ARG 16 -6.917 -21.091 7.000 123 HE ARG 16 HE ARG 16 -9.070 -20.674 7.659 124 HH11 ARG 16 1HH1 ARG 16 -7.575 -17.688 6.675 125 HH12 ARG 16 2HH1 ARG 16 -9.046 -16.774 6.754 126 HH21 ARG 16 1HH2 ARG 16 -11.012 -19.483 7.767 127 HH22 ARG 16 2HH2 ARG 16 -11.000 -17.796 7.376 128 H TRP 17 H TRP 17 -5.855 -17.992 10.574 129 HA TRP 17 HA TRP 17 -6.637 -15.475 9.771 130 HB2 TRP 17 2HB TRP 17 -8.007 -16.530 11.362 131 HB3 TRP 17 3HB TRP 17 -6.660 -16.823 12.459 132 HD1 TRP 17 HD1 TRP 17 -8.878 -13.917 11.209 133 HE1 TRP 17 HE1 TRP 17 -8.911 -12.096 13.028 134 HE3 TRP 17 HE3 TRP 17 -5.490 -15.949 14.455 135 HZ2 TRP 17 HZ2 TRP 17 -7.665 -11.588 15.509 136 HZ3 TRP 17 HZ3 TRP 17 -4.966 -14.731 16.528 137 HH2 TRP 17 HH2 TRP 17 -6.032 -12.596 17.042 138 H VAL 18 H VAL 18 -4.331 -16.209 12.395 139 HA VAL 18 HA VAL 18 -3.577 -13.663 13.079 140 HB VAL 18 HB VAL 18 -1.266 -14.702 13.540 141 HG11 VAL 18 1HG1 VAL 18 -2.039 -15.675 15.541 142 HG12 VAL 18 2HG1 VAL 18 -3.227 -14.435 15.134 143 HG13 VAL 18 3HG1 VAL 18 -3.580 -16.135 14.816 144 HG21 VAL 18 3HG2 VAL 18 -2.522 -16.808 12.018 145 HG22 VAL 18 1HG2 VAL 18 -0.847 -16.648 12.546 146 HG23 VAL 18 2HG2 VAL 18 -2.042 -17.380 13.616 147 H LEU 19 H LEU 19 -2.111 -15.688 10.544 148 HA LEU 19 HA LEU 19 -0.288 -13.695 9.672 149 HB2 LEU 19 2HB LEU 19 -1.283 -16.280 8.548 150 HB3 LEU 19 3HB LEU 19 -0.301 -15.206 7.554 151 HG LEU 19 HG LEU 19 0.620 -16.215 10.235 152 HD11 LEU 19 1HD1 LEU 19 0.187 -18.169 8.903 153 HD12 LEU 19 2HD1 LEU 19 1.927 -17.892 8.968 154 HD13 LEU 19 3HD1 LEU 19 1.020 -17.460 7.519 155 HD21 LEU 19 3HD2 LEU 19 2.244 -14.748 9.827 156 HD22 LEU 19 1HD2 LEU 19 1.672 -14.463 8.183 157 HD23 LEU 19 2HD2 LEU 19 2.759 -15.811 8.517 158 H GLU 20 H GLU 20 -3.623 -14.279 9.068 159 HA GLU 20 HA GLU 20 -3.721 -12.807 6.590 160 HB2 GLU 20 2HB GLU 20 -5.380 -14.645 7.824 161 HB3 GLU 20 3HB GLU 20 -6.258 -13.132 7.999 162 HG2 GLU 20 2HG GLU 20 -5.134 -13.879 5.342 163 HG3 GLU 20 3HG GLU 20 -6.623 -14.635 5.908 164 H ARG 21 H ARG 21 -5.300 -12.268 9.746 165 HA ARG 21 HA ARG 21 -6.111 -9.670 9.352 166 HB2 ARG 21 2HB ARG 21 -6.001 -9.429 11.834 167 HB3 ARG 21 3HB ARG 21 -6.826 -10.886 11.295 168 HG2 ARG 21 2HG ARG 21 -5.407 -12.191 12.391 169 HG3 ARG 21 3HG ARG 21 -4.009 -11.367 11.697 170 HD2 ARG 21 2HD ARG 21 -5.574 -10.062 13.882 171 HD3 ARG 21 3HD ARG 21 -4.410 -11.327 14.275 172 HE ARG 21 HE ARG 21 -3.007 -9.626 12.690 173 HH11 ARG 21 1HH1 ARG 21 -4.887 -9.242 15.595 174 HH12 ARG 21 2HH1 ARG 21 -3.949 -7.909 16.181 175 HH21 ARG 21 1HH2 ARG 21 -1.764 -7.871 13.452 176 HH22 ARG 21 2HH2 ARG 21 -2.174 -7.130 14.961 177 H ALA 22 H ALA 22 -2.921 -10.865 10.139 178 HA ALA 22 HA ALA 22 -1.704 -8.513 11.010 179 HB1 ALA 22 1HB ALA 22 -0.858 -11.121 10.126 180 HB2 ALA 22 2HB ALA 22 0.238 -9.870 9.537 181 HB3 ALA 22 3HB ALA 22 -0.088 -10.015 11.264 182 H LEU 23 H LEU 23 -2.036 -9.802 7.714 183 HA LEU 23 HA LEU 23 -0.813 -7.442 6.568 184 HB2 LEU 23 2HB LEU 23 -2.237 -9.630 5.080 185 HB3 LEU 23 3HB LEU 23 -0.998 -8.531 4.478 186 HG LEU 23 HG LEU 23 -0.436 -10.600 6.589 187 HD11 LEU 23 1HD1 LEU 23 0.320 -12.097 4.903 188 HD12 LEU 23 2HD1 LEU 23 0.041 -10.907 3.633 189 HD13 LEU 23 3HD1 LEU 23 -1.327 -11.625 4.484 190 HD21 LEU 23 3HD2 LEU 23 1.740 -10.017 6.383 191 HD22 LEU 23 1HD2 LEU 23 1.037 -8.478 5.884 192 HD23 LEU 23 2HD2 LEU 23 1.590 -9.630 4.668 193 H ALA 24 H ALA 24 -4.023 -8.792 6.990 194 HA ALA 24 HA ALA 24 -5.524 -7.293 5.239 195 HB1 ALA 24 1HB ALA 24 -6.541 -9.028 6.536 196 HB2 ALA 24 2HB ALA 24 -6.209 -8.168 8.039 197 HB3 ALA 24 3HB ALA 24 -7.376 -7.516 6.889 198 H GLY 25 H GLY 25 -4.076 -6.304 8.279 199 HA2 GLY 25 2HA GLY 25 -5.442 -3.741 8.262 200 HA3 GLY 25 3HA GLY 25 -4.269 -4.293 9.449 201 H ALA 26 H ALA 26 -2.440 -5.054 7.156 202 HA ALA 26 HA ALA 26 -1.236 -2.407 6.884 203 HB1 ALA 26 1HB ALA 26 0.798 -3.495 6.411 204 HB2 ALA 26 2HB ALA 26 0.046 -4.441 7.696 205 HB3 ALA 26 3HB ALA 26 -0.011 -5.015 6.030 206 H GLY 27 H GLY 27 0.262 -2.684 4.611 207 HA2 GLY 27 2HA GLY 27 -1.832 -2.626 2.542 208 HA3 GLY 27 3HA GLY 27 -0.305 -1.758 2.469 209 H LEU 28 H LEU 28 -0.976 -5.168 3.206 210 HA LEU 28 HA LEU 28 0.476 -5.916 0.764 211 HB2 LEU 28 2HB LEU 28 0.955 -7.792 2.895 212 HB3 LEU 28 3HB LEU 28 2.106 -6.945 1.863 213 HG LEU 28 HG LEU 28 0.882 -5.696 4.314 214 HD11 LEU 28 1HD1 LEU 28 2.615 -7.875 4.301 215 HD12 LEU 28 2HD1 LEU 28 2.269 -6.797 5.652 216 HD13 LEU 28 3HD1 LEU 28 3.643 -6.473 4.596 217 HD21 LEU 28 3HD2 LEU 28 2.710 -4.844 2.224 218 HD22 LEU 28 1HD2 LEU 28 3.391 -4.649 3.840 219 HD23 LEU 28 2HD2 LEU 28 1.850 -3.891 3.435 220 H THR 29 H THR 29 -0.335 -7.632 -0.328 221 HA THR 29 HA THR 29 -2.969 -8.454 0.105 222 HB THR 29 HB THR 29 -0.936 -10.064 -1.437 223 HG1 THR 29 HG1 THR 29 -2.356 -7.721 -2.230 224 HG21 THR 29 3HG2 THR 29 -3.918 -9.791 -1.452 225 HG22 THR 29 1HG2 THR 29 -2.930 -11.252 -1.456 226 HG23 THR 29 2HG2 THR 29 -3.067 -10.276 -2.918 227 H CYS 30 H CYS 30 -3.811 -10.551 0.642 228 HA CYS 30 HA CYS 30 -2.042 -12.229 2.274 229 HB2 CYS 30 2HB CYS 30 -3.980 -12.463 3.910 230 HB3 CYS 30 3HB CYS 30 -3.118 -10.930 3.935 231 HG CYS 30 HG CYS 30 -5.694 -10.837 1.848 232 H THR 31 H THR 31 -2.093 -14.208 1.465 233 HA THR 31 HA THR 31 -4.655 -15.251 0.449 234 HB THR 31 HB THR 31 -1.982 -16.038 -0.701 235 HG1 THR 31 HG1 THR 31 -3.753 -13.955 -1.483 236 HG21 THR 31 3HG2 THR 31 -3.961 -17.540 -1.003 237 HG22 THR 31 1HG2 THR 31 -3.278 -16.933 -2.510 238 HG23 THR 31 2HG2 THR 31 -4.760 -16.226 -1.866 239 H THR 32 H THR 32 -5.320 -16.778 1.805 240 HA THR 32 HA THR 32 -3.329 -18.481 3.131 241 HB THR 32 HB THR 32 -4.938 -18.972 4.802 242 HG1 THR 32 HG1 THR 32 -6.904 -17.588 3.276 243 HG21 THR 32 3HG2 THR 32 -4.161 -16.353 4.258 244 HG22 THR 32 1HG2 THR 32 -4.772 -16.975 5.789 245 HG23 THR 32 2HG2 THR 32 -5.880 -16.241 4.630 246 H PHE 33 H PHE 33 -3.179 -20.599 2.702 247 HA PHE 33 HA PHE 33 -5.228 -21.787 0.949 248 HB2 PHE 33 2HB PHE 33 -2.260 -22.362 1.064 249 HB3 PHE 33 3HB PHE 33 -3.416 -23.254 0.079 250 HD1 PHE 33 HD1 PHE 33 -4.634 -22.056 -1.752 251 HD2 PHE 33 HD2 PHE 33 -1.350 -20.326 0.332 252 HE1 PHE 33 HE1 PHE 33 -4.340 -20.428 -3.573 253 HE2 PHE 33 HE2 PHE 33 -1.052 -18.694 -1.485 254 HZ PHE 33 HZ PHE 33 -2.549 -18.744 -3.441 255 H GLU 34 H GLU 34 -4.596 -24.399 1.044 256 HA GLU 34 HA GLU 34 -4.466 -25.179 3.860 257 HB2 GLU 34 2HB GLU 34 -6.424 -26.716 3.497 258 HB3 GLU 34 3HB GLU 34 -6.820 -25.004 3.533 259 HG2 GLU 34 2HG GLU 34 -7.753 -25.137 1.537 260 HG3 GLU 34 3HG GLU 34 -6.263 -25.774 0.845 261 H ASN 35 H ASN 35 -3.023 -25.463 1.103 262 HA ASN 35 HA ASN 35 -2.003 -28.088 1.635 263 HB2 ASN 35 2HB ASN 35 -4.032 -28.662 0.356 264 HB3 ASN 35 3HB ASN 35 -3.485 -27.634 -0.965 265 HD21 ASN 35 1HD2 ASN 35 -3.989 -30.035 -1.745 266 HD22 ASN 35 2HD2 ASN 35 -2.568 -30.997 -1.950 267 H GLY 36 H GLY 36 0.111 -27.827 1.393 268 HA2 GLY 36 2HA GLY 36 1.375 -25.673 0.198 269 HA3 GLY 36 3HA GLY 36 2.139 -27.228 0.498 270 H ASN 37 H ASN 37 0.513 -28.787 -1.233 271 HA ASN 37 HA ASN 37 1.908 -28.468 -3.652 272 HB2 ASN 37 2HB ASN 37 1.163 -30.649 -3.194 273 HB3 ASN 37 3HB ASN 37 -0.477 -30.112 -2.842 274 HD21 ASN 37 1HD2 ASN 37 -1.933 -30.373 -4.372 275 HD22 ASN 37 2HD2 ASN 37 -1.606 -30.632 -6.049 276 H GLU 38 H GLU 38 -0.976 -27.024 -2.475 277 HA GLU 38 HA GLU 38 -1.916 -26.266 -5.121 278 HB2 GLU 38 2HB GLU 38 -3.209 -26.742 -2.738 279 HB3 GLU 38 3HB GLU 38 -3.197 -24.986 -2.819 280 HG2 GLU 38 2HG GLU 38 -4.505 -24.927 -4.713 281 HG3 GLU 38 3HG GLU 38 -4.065 -26.565 -5.194 282 H VAL 39 H VAL 39 0.132 -25.057 -2.688 283 HA VAL 39 HA VAL 39 -0.195 -22.270 -3.459 284 HB VAL 39 HB VAL 39 1.908 -23.348 -1.594 285 HG11 VAL 39 1HG1 VAL 39 2.339 -21.210 -1.099 286 HG12 VAL 39 2HG1 VAL 39 1.464 -20.830 -2.583 287 HG13 VAL 39 3HG1 VAL 39 0.629 -20.786 -1.030 288 HG21 VAL 39 3HG2 VAL 39 -0.981 -23.294 -1.233 289 HG22 VAL 39 1HG2 VAL 39 0.266 -24.089 -0.273 290 HG23 VAL 39 2HG2 VAL 39 -0.116 -22.391 0.011 291 H LEU 40 H LEU 40 2.154 -24.881 -3.771 292 HA LEU 40 HA LEU 40 4.340 -23.537 -4.763 293 HB2 LEU 40 2HB LEU 40 4.788 -25.748 -4.476 294 HB3 LEU 40 3HB LEU 40 3.227 -26.258 -5.118 295 HG LEU 40 HG LEU 40 4.019 -25.915 -7.387 296 HD11 LEU 40 1HD1 LEU 40 6.765 -25.622 -7.172 297 HD12 LEU 40 2HD1 LEU 40 6.112 -24.446 -6.031 298 HD13 LEU 40 3HD1 LEU 40 5.614 -24.403 -7.722 299 HD21 LEU 40 3HD2 LEU 40 4.876 -27.896 -5.620 300 HD22 LEU 40 1HD2 LEU 40 6.311 -27.444 -6.539 301 HD23 LEU 40 2HD2 LEU 40 4.856 -27.974 -7.383 302 H ALA 41 H ALA 41 1.485 -24.658 -6.539 303 HA ALA 41 HA ALA 41 2.417 -23.735 -9.076 304 HB1 ALA 41 1HB ALA 41 -0.483 -24.140 -8.513 305 HB2 ALA 41 2HB ALA 41 0.456 -24.555 -9.947 306 HB3 ALA 41 3HB ALA 41 0.606 -25.528 -8.484 307 H ALA 42 H ALA 42 0.589 -22.336 -6.455 308 HA ALA 42 HA ALA 42 -0.646 -20.205 -7.753 309 HB1 ALA 42 1HB ALA 42 -1.062 -20.867 -5.409 310 HB2 ALA 42 2HB ALA 42 0.501 -20.180 -4.965 311 HB3 ALA 42 3HB ALA 42 -0.774 -19.137 -5.595 312 H LEU 43 H LEU 43 2.663 -20.574 -6.623 313 HA LEU 43 HA LEU 43 3.528 -17.935 -6.787 314 HB2 LEU 43 2HB LEU 43 5.239 -20.253 -7.619 315 HB3 LEU 43 3HB LEU 43 5.720 -18.766 -6.804 316 HG LEU 43 HG LEU 43 4.161 -21.045 -5.586 317 HD11 LEU 43 1HD1 LEU 43 6.437 -21.684 -5.850 318 HD12 LEU 43 2HD1 LEU 43 6.213 -21.227 -4.162 319 HD13 LEU 43 3HD1 LEU 43 7.008 -20.116 -5.278 320 HD21 LEU 43 3HD2 LEU 43 5.286 -18.699 -4.101 321 HD22 LEU 43 1HD2 LEU 43 4.048 -19.850 -3.597 322 HD23 LEU 43 2HD2 LEU 43 3.674 -18.632 -4.817 323 H ALA 44 H ALA 44 3.152 -20.366 -9.305 324 HA ALA 44 HA ALA 44 4.482 -19.024 -11.379 325 HB1 ALA 44 1HB ALA 44 3.375 -20.516 -12.875 326 HB2 ALA 44 2HB ALA 44 3.741 -21.413 -11.401 327 HB3 ALA 44 3HB ALA 44 2.100 -20.839 -11.699 328 H SER 45 H SER 45 1.574 -18.286 -9.788 329 HA SER 45 HA SER 45 0.223 -16.997 -11.951 330 HB2 SER 45 2HB SER 45 -0.957 -17.850 -9.942 331 HB3 SER 45 3HB SER 45 -0.158 -16.614 -8.971 332 HG SER 45 HG SER 45 -1.458 -15.140 -9.759 333 H LYS 46 H LYS 46 1.376 -15.475 -8.950 334 HA LYS 46 HA LYS 46 2.421 -13.252 -10.577 335 HB2 LYS 46 2HB LYS 46 1.731 -11.714 -8.770 336 HB3 LYS 46 3HB LYS 46 0.363 -12.534 -9.511 337 HG2 LYS 46 2HG LYS 46 0.790 -14.226 -7.510 338 HG3 LYS 46 3HG LYS 46 1.469 -12.772 -6.775 339 HD2 LYS 46 2HD LYS 46 -1.244 -12.784 -8.068 340 HD3 LYS 46 3HD LYS 46 -1.012 -13.244 -6.379 341 HE2 LYS 46 2HE LYS 46 -0.984 -11.105 -5.789 342 HE3 LYS 46 3HE LYS 46 0.395 -10.817 -6.848 343 HZ1 LYS 46 3HZ LYS 46 -1.502 -9.386 -7.371 344 HZ2 LYS 46 1HZ LYS 46 -2.449 -10.749 -7.702 345 HZ3 LYS 46 2HZ LYS 46 -1.107 -10.396 -8.669 346 H THR 47 H THR 47 3.080 -15.637 -8.320 347 HA THR 47 HA THR 47 4.908 -16.164 -7.071 348 HB THR 47 HB THR 47 6.707 -14.064 -7.981 349 HG1 THR 47 HG1 THR 47 6.496 -14.315 -10.123 350 HG21 THR 47 3HG2 THR 47 8.177 -15.782 -8.090 351 HG22 THR 47 1HG2 THR 47 7.027 -16.857 -8.883 352 HG23 THR 47 2HG2 THR 47 6.950 -16.617 -7.138 353 HA PRO 48 HA PRO 48 4.154 -13.094 -3.857 354 HB2 PRO 48 2HB PRO 48 4.732 -14.777 -1.807 355 HB3 PRO 48 3HB PRO 48 3.172 -14.777 -2.639 356 HG2 PRO 48 2HG PRO 48 5.520 -16.596 -3.015 357 HG3 PRO 48 3HG PRO 48 3.794 -16.997 -2.943 358 HD2 PRO 48 2HD PRO 48 5.149 -16.807 -5.279 359 HD3 PRO 48 3HD PRO 48 3.431 -16.383 -5.135 360 H ASP 49 H ASP 49 5.479 -12.165 -2.150 361 HA ASP 49 HA ASP 49 8.301 -12.199 -2.875 362 HB2 ASP 49 2HB ASP 49 6.478 -10.230 -1.891 363 HB3 ASP 49 3HB ASP 49 7.801 -10.388 -0.739 364 H VAL 50 H VAL 50 6.274 -13.647 -0.614 365 HA VAL 50 HA VAL 50 8.323 -15.042 0.680 366 HB VAL 50 HB VAL 50 8.893 -12.962 1.777 367 HG11 VAL 50 1HG1 VAL 50 6.216 -12.374 1.606 368 HG12 VAL 50 2HG1 VAL 50 6.445 -12.661 3.332 369 HG13 VAL 50 3HG1 VAL 50 7.419 -11.446 2.502 370 HG21 VAL 50 3HG2 VAL 50 7.457 -14.302 3.986 371 HG22 VAL 50 1HG2 VAL 50 8.541 -15.308 3.025 372 HG23 VAL 50 2HG2 VAL 50 9.160 -13.869 3.836 373 H LEU 51 H LEU 51 7.537 -16.654 2.035 374 HA LEU 51 HA LEU 51 4.637 -16.683 2.506 375 HB2 LEU 51 2HB LEU 51 5.854 -18.188 0.568 376 HB3 LEU 51 3HB LEU 51 5.813 -19.299 1.935 377 HG LEU 51 HG LEU 51 3.275 -17.923 1.348 378 HD11 LEU 51 1HD1 LEU 51 4.282 -20.077 -0.501 379 HD12 LEU 51 2HD1 LEU 51 4.199 -18.365 -0.917 380 HD13 LEU 51 3HD1 LEU 51 2.721 -19.258 -0.560 381 HD21 LEU 51 3HD2 LEU 51 2.380 -19.764 2.297 382 HD22 LEU 51 1HD2 LEU 51 4.010 -19.960 2.942 383 HD23 LEU 51 2HD2 LEU 51 3.516 -20.859 1.507 384 H LEU 52 H LEU 52 3.954 -18.123 4.216 385 HA LEU 52 HA LEU 52 6.094 -18.923 6.062 386 HB2 LEU 52 2HB LEU 52 3.618 -17.865 7.271 387 HB3 LEU 52 3HB LEU 52 5.288 -17.751 7.823 388 HG LEU 52 HG LEU 52 5.400 -16.104 5.701 389 HD11 LEU 52 1HD1 LEU 52 2.552 -16.341 6.446 390 HD12 LEU 52 2HD1 LEU 52 3.294 -15.891 4.911 391 HD13 LEU 52 3HD1 LEU 52 3.175 -14.707 6.212 392 HD21 LEU 52 3HD2 LEU 52 6.007 -14.728 7.332 393 HD22 LEU 52 1HD2 LEU 52 5.388 -15.891 8.505 394 HD23 LEU 52 2HD2 LEU 52 4.341 -14.607 7.901 395 H SER 53 H SER 53 5.853 -21.091 5.747 396 HA SER 53 HA SER 53 3.225 -22.310 5.821 397 HB2 SER 53 2HB SER 53 4.465 -24.428 5.453 398 HB3 SER 53 3HB SER 53 4.867 -23.199 4.253 399 HG SER 53 HG SER 53 6.399 -23.670 6.591 400 H ASP 54 H ASP 54 2.275 -23.120 7.569 401 HA ASP 54 HA ASP 54 3.633 -23.011 10.114 402 HB2 ASP 54 2HB ASP 54 1.237 -22.319 9.779 403 HB3 ASP 54 3HB ASP 54 0.843 -24.019 9.534 404 H ILE 55 H ILE 55 3.205 -25.321 7.691 405 HA ILE 55 HA ILE 55 3.680 -27.541 7.530 406 HB ILE 55 HB ILE 55 5.052 -27.247 10.201 407 HG12 ILE 55 2HG1 ILE 55 6.143 -26.713 7.429 408 HG13 ILE 55 3HG1 ILE 55 5.824 -25.497 8.660 409 HG21 ILE 55 1HG2 ILE 55 6.413 -28.958 8.402 410 HG22 ILE 55 2HG2 ILE 55 5.609 -29.374 9.915 411 HG23 ILE 55 3HG2 ILE 55 4.711 -29.420 8.399 412 HD11 ILE 55 3HD1 ILE 55 7.500 -26.645 10.108 413 HD12 ILE 55 1HD1 ILE 55 7.899 -27.668 8.729 414 HD13 ILE 55 2HD1 ILE 55 8.158 -25.926 8.638 415 H ARG 56 H ARG 56 1.418 -28.012 7.785 416 HA ARG 56 HA ARG 56 0.921 -29.651 10.147 417 HB2 ARG 56 2HB ARG 56 -1.073 -27.585 9.202 418 HB3 ARG 56 3HB ARG 56 -1.257 -28.682 10.565 419 HG2 ARG 56 2HG ARG 56 0.888 -26.581 10.397 420 HG3 ARG 56 3HG ARG 56 -0.679 -26.329 11.167 421 HD2 ARG 56 2HD ARG 56 1.095 -28.621 11.940 422 HD3 ARG 56 3HD ARG 56 1.310 -27.018 12.642 423 HE ARG 56 HE ARG 56 -0.721 -28.907 13.286 424 HH11 ARG 56 1HH1 ARG 56 -0.060 -25.500 13.021 425 HH12 ARG 56 2HH1 ARG 56 -1.266 -25.043 14.179 426 HH21 ARG 56 1HH2 ARG 56 -2.311 -28.319 14.812 427 HH22 ARG 56 2HH2 ARG 56 -2.545 -26.648 15.198 428 H MET 57 H MET 57 1.519 -30.359 7.463 429 HA MET 57 HA MET 57 -1.059 -31.410 6.509 430 HB2 MET 57 2HB MET 57 1.439 -31.457 4.858 431 HB3 MET 57 3HB MET 57 -0.239 -31.412 4.333 432 HG2 MET 57 2HG MET 57 0.303 -29.275 3.865 433 HG3 MET 57 3HG MET 57 -0.143 -29.055 5.555 434 HE1 MET 57 3HE MET 57 2.922 -27.534 3.411 435 HE2 MET 57 1HE MET 57 1.234 -27.235 3.825 436 HE3 MET 57 2HE MET 57 2.520 -26.563 4.827 437 HA PRO 58 HA PRO 58 0.184 -35.465 7.700 438 HB2 PRO 58 2HB PRO 58 -1.437 -36.897 6.059 439 HB3 PRO 58 3HB PRO 58 -2.031 -36.040 7.486 440 HG2 PRO 58 2HG PRO 58 -2.105 -35.209 4.611 441 HG3 PRO 58 3HG PRO 58 -3.368 -35.073 5.848 442 HD2 PRO 58 2HD PRO 58 -1.811 -32.981 5.121 443 HD3 PRO 58 3HD PRO 58 -2.438 -33.177 6.770 444 H GLY 59 H GLY 59 -0.241 -35.041 4.176 445 HA2 GLY 59 2HA GLY 59 1.583 -37.112 3.492 446 HA3 GLY 59 3HA GLY 59 0.958 -35.883 2.402 447 H MET 60 H MET 60 1.908 -33.583 3.062 448 HA MET 60 HA MET 60 4.765 -33.860 2.709 449 HB2 MET 60 2HB MET 60 2.950 -31.445 2.743 450 HB3 MET 60 3HB MET 60 4.684 -31.363 2.464 451 HG2 MET 60 2HG MET 60 3.961 -31.391 0.317 452 HG3 MET 60 3HG MET 60 4.116 -33.125 0.590 453 HE1 MET 60 3HE MET 60 1.626 -30.122 0.023 454 HE2 MET 60 1HE MET 60 2.289 -30.993 -1.360 455 HE3 MET 60 2HE MET 60 0.564 -31.082 -1.007 456 H ASP 61 H ASP 61 6.357 -32.972 4.046 457 HA ASP 61 HA ASP 61 5.572 -32.790 6.852 458 HB2 ASP 61 2HB ASP 61 8.126 -33.344 5.404 459 HB3 ASP 61 3HB ASP 61 8.209 -32.696 7.040 460 H GLY 62 H GLY 62 5.179 -30.616 4.808 461 HA2 GLY 62 2HA GLY 62 5.055 -28.309 5.115 462 HA3 GLY 62 3HA GLY 62 6.137 -28.460 6.492 463 H LEU 63 H LEU 63 8.374 -29.544 5.529 464 HA LEU 63 HA LEU 63 9.441 -27.408 3.902 465 HB2 LEU 63 2HB LEU 63 11.576 -28.863 4.206 466 HB3 LEU 63 3HB LEU 63 10.927 -27.942 5.562 467 HG LEU 63 HG LEU 63 9.946 -29.951 6.498 468 HD11 LEU 63 1HD1 LEU 63 9.296 -31.343 4.800 469 HD12 LEU 63 2HD1 LEU 63 10.772 -32.148 5.331 470 HD13 LEU 63 3HD1 LEU 63 10.794 -31.125 3.895 471 HD21 LEU 63 3HD2 LEU 63 12.184 -31.314 6.647 472 HD22 LEU 63 1HD2 LEU 63 12.050 -29.716 7.380 473 HD23 LEU 63 2HD2 LEU 63 12.847 -29.905 5.818 474 H ALA 64 H ALA 64 8.160 -30.503 3.370 475 HA ALA 64 HA ALA 64 9.575 -31.646 1.350 476 HB1 ALA 64 1HB ALA 64 6.638 -31.432 1.844 477 HB2 ALA 64 2HB ALA 64 7.226 -32.218 0.378 478 HB3 ALA 64 3HB ALA 64 7.699 -32.837 1.961 479 H LEU 65 H LEU 65 6.980 -29.255 0.801 480 HA LEU 65 HA LEU 65 7.764 -28.880 -1.937 481 HB2 LEU 65 2HB LEU 65 5.878 -27.594 -2.167 482 HB3 LEU 65 3HB LEU 65 5.419 -28.661 -0.842 483 HG LEU 65 HG LEU 65 6.436 -25.848 -0.464 484 HD11 LEU 65 1HD1 LEU 65 4.447 -25.162 -1.177 485 HD12 LEU 65 2HD1 LEU 65 3.758 -25.945 0.245 486 HD13 LEU 65 3HD1 LEU 65 3.837 -26.813 -1.288 487 HD21 LEU 65 3HD2 LEU 65 6.750 -26.758 1.588 488 HD22 LEU 65 1HD2 LEU 65 5.567 -28.039 1.324 489 HD23 LEU 65 2HD2 LEU 65 5.026 -26.412 1.734 490 H LEU 66 H LEU 66 8.516 -27.414 1.097 491 HA LEU 66 HA LEU 66 9.355 -24.879 0.154 492 HB2 LEU 66 2HB LEU 66 8.989 -25.989 2.601 493 HB3 LEU 66 3HB LEU 66 10.748 -25.981 2.497 494 HG LEU 66 HG LEU 66 10.142 -23.999 3.622 495 HD11 LEU 66 1HD1 LEU 66 11.852 -23.724 1.880 496 HD12 LEU 66 2HD1 LEU 66 10.923 -22.249 2.142 497 HD13 LEU 66 3HD1 LEU 66 10.594 -23.259 0.735 498 HD21 LEU 66 3HD2 LEU 66 8.053 -23.265 3.416 499 HD22 LEU 66 1HD2 LEU 66 7.838 -24.106 1.880 500 HD23 LEU 66 2HD2 LEU 66 8.553 -22.494 1.909 501 H LYS 67 H LYS 67 10.791 -28.008 0.095 502 HA LYS 67 HA LYS 67 13.513 -27.228 -0.084 503 HB2 LYS 67 2HB LYS 67 12.021 -29.719 -0.882 504 HB3 LYS 67 3HB LYS 67 13.746 -29.540 -1.173 505 HG2 LYS 67 2HG LYS 67 12.423 -29.353 1.526 506 HG3 LYS 67 3HG LYS 67 13.241 -30.782 0.889 507 HD2 LYS 67 2HD LYS 67 14.510 -28.085 1.369 508 HD3 LYS 67 3HD LYS 67 14.697 -29.512 2.392 509 HE2 LYS 67 2HE LYS 67 15.547 -30.672 0.264 510 HE3 LYS 67 3HE LYS 67 15.709 -29.045 -0.395 511 HZ1 LYS 67 3HZ LYS 67 17.241 -28.476 1.313 512 HZ2 LYS 67 1HZ LYS 67 17.757 -29.945 0.652 513 HZ3 LYS 67 2HZ LYS 67 16.965 -29.922 2.146 514 H GLN 68 H GLN 68 10.903 -27.367 -2.366 515 HA GLN 68 HA GLN 68 12.654 -27.165 -4.668 516 HB2 GLN 68 2HB GLN 68 10.788 -27.516 -5.975 517 HB3 GLN 68 3HB GLN 68 10.315 -28.340 -4.495 518 HG2 GLN 68 2HG GLN 68 9.371 -25.879 -3.976 519 HG3 GLN 68 3HG GLN 68 9.240 -25.896 -5.734 520 HE21 GLN 68 1HE2 GLN 68 7.107 -25.828 -3.813 521 HE22 GLN 68 2HE2 GLN 68 6.155 -27.247 -4.066 522 H ILE 69 H ILE 69 10.963 -25.076 -2.517 523 HA ILE 69 HA ILE 69 10.635 -22.822 -4.170 524 HB ILE 69 HB ILE 69 11.041 -22.967 -1.182 525 HG12 ILE 69 2HG1 ILE 69 8.519 -22.669 -2.827 526 HG13 ILE 69 3HG1 ILE 69 9.050 -24.160 -2.055 527 HG21 ILE 69 1HG2 ILE 69 11.330 -20.756 -1.318 528 HG22 ILE 69 2HG2 ILE 69 10.800 -20.701 -2.998 529 HG23 ILE 69 3HG2 ILE 69 9.609 -20.685 -1.698 530 HD11 ILE 69 3HD1 ILE 69 7.578 -21.948 -0.961 531 HD12 ILE 69 1HD1 ILE 69 7.869 -23.552 -0.288 532 HD13 ILE 69 2HD1 ILE 69 9.040 -22.260 -0.024 533 H LYS 70 H LYS 70 13.399 -24.130 -2.527 534 HA LYS 70 HA LYS 70 14.981 -21.735 -2.703 535 HB2 LYS 70 2HB LYS 70 15.490 -24.568 -1.880 536 HB3 LYS 70 3HB LYS 70 16.854 -23.509 -2.214 537 HG2 LYS 70 2HG LYS 70 16.678 -23.032 -0.029 538 HG3 LYS 70 3HG LYS 70 15.417 -21.925 -0.578 539 HD2 LYS 70 2HD LYS 70 13.703 -23.509 -0.057 540 HD3 LYS 70 3HD LYS 70 14.893 -24.773 0.262 541 HE2 LYS 70 2HE LYS 70 15.316 -22.375 1.862 542 HE3 LYS 70 3HE LYS 70 13.740 -23.116 2.137 543 HZ1 LYS 70 3HZ LYS 70 15.942 -24.982 2.056 544 HZ2 LYS 70 1HZ LYS 70 14.656 -24.869 3.151 545 HZ3 LYS 70 2HZ LYS 70 16.016 -23.880 3.338 546 H GLN 71 H GLN 71 14.326 -24.474 -4.720 547 HA GLN 71 HA GLN 71 16.590 -23.933 -6.465 548 HB2 GLN 71 2HB GLN 71 15.290 -26.244 -5.821 549 HB3 GLN 71 3HB GLN 71 14.547 -25.850 -7.365 550 HG2 GLN 71 2HG GLN 71 16.297 -26.684 -8.417 551 HG3 GLN 71 3HG GLN 71 17.332 -25.480 -7.652 552 HE21 GLN 71 1HE2 GLN 71 16.794 -28.717 -8.052 553 HE22 GLN 71 2HE2 GLN 71 17.703 -29.320 -6.713 554 H ARG 72 H ARG 72 13.090 -23.598 -6.423 555 HA ARG 72 HA ARG 72 13.006 -22.616 -9.146 556 HB2 ARG 72 2HB ARG 72 11.051 -23.409 -7.095 557 HB3 ARG 72 3HB ARG 72 10.546 -22.055 -8.097 558 HG2 ARG 72 2HG ARG 72 11.267 -23.579 -10.070 559 HG3 ARG 72 3HG ARG 72 11.124 -24.875 -8.881 560 HD2 ARG 72 2HD ARG 72 8.813 -23.488 -8.473 561 HD3 ARG 72 3HD ARG 72 9.046 -23.288 -10.209 562 HE ARG 72 HE ARG 72 8.221 -25.647 -8.875 563 HH11 ARG 72 1HH1 ARG 72 10.166 -24.529 -11.537 564 HH12 ARG 72 2HH1 ARG 72 9.981 -25.987 -12.455 565 HH21 ARG 72 1HH2 ARG 72 7.971 -27.572 -10.073 566 HH22 ARG 72 2HH2 ARG 72 8.732 -27.717 -11.621 567 H HIS 73 H HIS 73 12.522 -21.308 -5.881 568 HA HIS 73 HA HIS 73 12.963 -18.617 -6.994 569 HB2 HIS 73 2HB HIS 73 11.230 -19.084 -4.583 570 HB3 HIS 73 3HB HIS 73 11.293 -17.677 -5.640 571 HD1 HIS 73 HD1 HIS 73 9.845 -17.711 -7.738 572 HD2 HIS 73 HD2 HIS 73 9.713 -21.260 -5.582 573 HE1 HIS 73 HE1 HIS 73 7.952 -19.033 -8.734 574 HA PRO 74 HA PRO 74 16.161 -19.528 -3.779 575 HB2 PRO 74 2HB PRO 74 18.200 -18.397 -5.170 576 HB3 PRO 74 3HB PRO 74 17.696 -20.075 -5.399 577 HG2 PRO 74 2HG PRO 74 17.029 -17.658 -7.033 578 HG3 PRO 74 3HG PRO 74 17.476 -19.286 -7.575 579 HD2 PRO 74 2HD PRO 74 14.911 -18.422 -7.522 580 HD3 PRO 74 3HD PRO 74 15.353 -20.118 -7.239 581 H MET 75 H MET 75 15.595 -16.607 -5.708 582 HA MET 75 HA MET 75 16.718 -14.881 -3.685 583 HB2 MET 75 2HB MET 75 16.701 -14.505 -6.243 584 HB3 MET 75 3HB MET 75 15.046 -13.959 -6.006 585 HG2 MET 75 2HG MET 75 16.258 -12.489 -4.131 586 HG3 MET 75 3HG MET 75 17.595 -12.676 -5.264 587 HE1 MET 75 3HE MET 75 14.040 -10.115 -5.263 588 HE2 MET 75 1HE MET 75 13.452 -11.565 -6.077 589 HE3 MET 75 2HE MET 75 14.197 -11.690 -4.484 590 H LEU 76 H LEU 76 13.953 -16.573 -3.775 591 HA LEU 76 HA LEU 76 12.222 -14.466 -2.726 592 HB2 LEU 76 2HB LEU 76 11.118 -15.848 -4.279 593 HB3 LEU 76 3HB LEU 76 11.761 -17.317 -3.547 594 HG LEU 76 HG LEU 76 10.326 -16.857 -1.552 595 HD11 LEU 76 1HD1 LEU 76 9.742 -14.659 -1.486 596 HD12 LEU 76 2HD1 LEU 76 8.317 -15.305 -2.299 597 HD13 LEU 76 3HD1 LEU 76 9.591 -14.528 -3.239 598 HD21 LEU 76 3HD2 LEU 76 9.089 -17.283 -4.260 599 HD22 LEU 76 1HD2 LEU 76 8.175 -17.434 -2.759 600 HD23 LEU 76 2HD2 LEU 76 9.551 -18.494 -3.063 601 HA PRO 77 HA PRO 77 13.589 -15.728 1.359 602 HB2 PRO 77 2HB PRO 77 12.303 -13.723 2.663 603 HB3 PRO 77 3HB PRO 77 13.840 -13.491 1.822 604 HG2 PRO 77 2HG PRO 77 11.063 -12.855 0.903 605 HG3 PRO 77 3HG PRO 77 12.542 -11.890 0.745 606 HD2 PRO 77 2HD PRO 77 11.540 -13.367 -1.292 607 HD3 PRO 77 3HD PRO 77 13.281 -13.093 -1.077 608 H VAL 78 H VAL 78 12.633 -17.407 2.310 609 HA VAL 78 HA VAL 78 9.705 -17.358 2.653 610 HB VAL 78 HB VAL 78 11.379 -19.858 2.690 611 HG11 VAL 78 1HG1 VAL 78 8.516 -19.186 2.795 612 HG12 VAL 78 2HG1 VAL 78 8.941 -20.541 1.747 613 HG13 VAL 78 3HG1 VAL 78 9.384 -20.573 3.454 614 HG21 VAL 78 3HG2 VAL 78 10.609 -18.207 0.399 615 HG22 VAL 78 1HG2 VAL 78 11.820 -19.484 0.524 616 HG23 VAL 78 2HG2 VAL 78 10.125 -19.897 0.263 617 H ILE 79 H ILE 79 8.890 -18.499 4.578 618 HA ILE 79 HA ILE 79 10.788 -18.513 6.821 619 HB ILE 79 HB ILE 79 8.015 -17.347 7.031 620 HG12 ILE 79 2HG1 ILE 79 10.641 -15.851 6.918 621 HG13 ILE 79 3HG1 ILE 79 9.522 -15.988 5.566 622 HG21 ILE 79 1HG2 ILE 79 8.711 -16.598 9.203 623 HG22 ILE 79 2HG2 ILE 79 9.026 -18.328 9.077 624 HG23 ILE 79 3HG2 ILE 79 10.353 -17.177 8.924 625 HD11 ILE 79 3HD1 ILE 79 9.478 -14.201 7.832 626 HD12 ILE 79 1HD1 ILE 79 8.599 -14.116 6.306 627 HD13 ILE 79 2HD1 ILE 79 7.953 -15.065 7.645 628 H ILE 80 H ILE 80 10.514 -20.130 8.271 629 HA ILE 80 HA ILE 80 8.374 -22.056 7.698 630 HB ILE 80 HB ILE 80 11.064 -22.354 9.009 631 HG12 ILE 80 2HG1 ILE 80 10.651 -22.507 6.467 632 HG13 ILE 80 3HG1 ILE 80 11.561 -23.805 7.231 633 HG21 ILE 80 1HG2 ILE 80 10.252 -24.832 9.200 634 HG22 ILE 80 2HG2 ILE 80 9.864 -23.667 10.466 635 HG23 ILE 80 3HG2 ILE 80 8.653 -24.091 9.257 636 HD11 ILE 80 3HD1 ILE 80 9.754 -24.420 5.533 637 HD12 ILE 80 1HD1 ILE 80 9.794 -25.304 7.059 638 HD13 ILE 80 2HD1 ILE 80 8.608 -24.022 6.812 639 H MET 81 H MET 81 6.958 -22.740 9.246 640 HA MET 81 HA MET 81 7.202 -21.544 11.923 641 HB2 MET 81 2HB MET 81 4.902 -21.454 10.020 642 HB3 MET 81 3HB MET 81 4.564 -21.551 11.743 643 HG2 MET 81 2HG MET 81 5.424 -19.471 12.173 644 HG3 MET 81 3HG MET 81 6.480 -19.498 10.763 645 HE1 MET 81 3HE MET 81 2.926 -20.272 11.493 646 HE2 MET 81 1HE MET 81 1.963 -19.008 10.728 647 HE3 MET 81 2HE MET 81 2.544 -20.374 9.774 648 H THR 82 H THR 82 6.952 -22.932 13.558 649 HA THR 82 HA THR 82 5.194 -25.097 13.655 650 HB THR 82 HB THR 82 6.387 -26.324 12.062 651 HG1 THR 82 HG1 THR 82 7.727 -27.163 14.415 652 HG21 THR 82 3HG2 THR 82 8.674 -26.306 11.697 653 HG22 THR 82 1HG2 THR 82 9.042 -25.868 13.365 654 HG23 THR 82 2HG2 THR 82 8.387 -24.660 12.260 655 H ALA 83 H ALA 83 8.578 -24.443 14.585 656 HA ALA 83 HA ALA 83 9.505 -24.065 16.645 657 HB1 ALA 83 1HB ALA 83 8.219 -23.392 18.439 658 HB2 ALA 83 2HB ALA 83 7.170 -23.002 17.075 659 HB3 ALA 83 3HB ALA 83 6.882 -24.463 18.019 660 H HIS 84 H HIS 84 6.831 -26.364 17.210 661 HA HIS 84 HA HIS 84 8.284 -28.056 18.906 662 HB2 HIS 84 2HB HIS 84 6.474 -29.598 18.700 663 HB3 HIS 84 3HB HIS 84 5.775 -27.983 18.626 664 HD1 HIS 84 HD1 HIS 84 5.713 -31.147 16.932 665 HD2 HIS 84 HD2 HIS 84 5.302 -27.173 15.789 666 HE1 HIS 84 HE1 HIS 84 4.585 -31.207 14.685 667 H SER 85 H SER 85 7.903 -30.628 17.872 668 HA SER 85 HA SER 85 10.263 -31.282 16.738 669 HB2 SER 85 2HB SER 85 7.610 -32.541 16.811 670 HB3 SER 85 3HB SER 85 8.624 -33.089 15.477 671 HG SER 85 HG SER 85 9.633 -34.253 16.889 672 H ASP 86 H ASP 86 11.104 -29.985 15.173 673 HA ASP 86 HA ASP 86 10.720 -30.505 12.518 674 HB2 ASP 86 2HB ASP 86 8.648 -28.752 13.549 675 HB3 ASP 86 3HB ASP 86 9.562 -27.980 12.256 676 H LEU 87 H LEU 87 11.227 -27.802 14.751 677 HA LEU 87 HA LEU 87 12.907 -26.247 13.169 678 HB2 LEU 87 2HB LEU 87 12.269 -26.485 16.006 679 HB3 LEU 87 3HB LEU 87 13.908 -25.909 15.705 680 HG LEU 87 HG LEU 87 13.121 -23.986 14.568 681 HD11 LEU 87 1HD1 LEU 87 10.732 -23.601 14.119 682 HD12 LEU 87 2HD1 LEU 87 10.380 -25.235 14.680 683 HD13 LEU 87 3HD1 LEU 87 11.369 -24.991 13.241 684 HD21 LEU 87 3HD2 LEU 87 11.653 -22.934 16.251 685 HD22 LEU 87 1HD2 LEU 87 13.007 -23.803 16.975 686 HD23 LEU 87 2HD2 LEU 87 11.394 -24.517 16.984 687 H ASP 88 H ASP 88 13.715 -28.882 15.404 688 HA ASP 88 HA ASP 88 16.442 -28.818 15.388 689 HB2 ASP 88 2HB ASP 88 14.476 -30.698 16.080 690 HB3 ASP 88 3HB ASP 88 15.575 -31.547 14.996 691 H ALA 89 H ALA 89 14.324 -29.935 12.817 692 HA ALA 89 HA ALA 89 16.555 -30.832 11.191 693 HB1 ALA 89 1HB ALA 89 14.139 -30.716 9.695 694 HB2 ALA 89 2HB ALA 89 15.012 -32.135 10.275 695 HB3 ALA 89 3HB ALA 89 13.780 -31.383 11.288 696 H ALA 90 H ALA 90 14.035 -28.323 11.017 697 HA ALA 90 HA ALA 90 14.790 -27.118 8.639 698 HB1 ALA 90 1HB ALA 90 13.830 -24.999 9.761 699 HB2 ALA 90 2HB ALA 90 12.768 -26.385 9.510 700 HB3 ALA 90 3HB ALA 90 13.453 -26.076 11.106 701 H VAL 91 H VAL 91 16.225 -26.879 11.814 702 HA VAL 91 HA VAL 91 17.694 -24.562 11.658 703 HB VAL 91 HB VAL 91 18.440 -27.216 12.879 704 HG11 VAL 91 1HG1 VAL 91 19.997 -25.512 14.221 705 HG12 VAL 91 2HG1 VAL 91 20.547 -26.378 12.785 706 HG13 VAL 91 3HG1 VAL 91 19.996 -24.708 12.652 707 HG21 VAL 91 3HG2 VAL 91 16.555 -25.382 13.626 708 HG22 VAL 91 1HG2 VAL 91 17.335 -26.538 14.707 709 HG23 VAL 91 2HG2 VAL 91 17.951 -24.890 14.585 710 H SER 92 H SER 92 18.857 -27.794 10.684 711 HA SER 92 HA SER 92 21.076 -26.594 9.249 712 HB2 SER 92 2HB SER 92 21.649 -28.573 10.437 713 HB3 SER 92 3HB SER 92 20.260 -29.449 9.794 714 HG SER 92 HG SER 92 22.672 -28.755 8.529 715 H ALA 93 H ALA 93 18.159 -28.464 8.527 716 HA ALA 93 HA ALA 93 18.552 -28.740 5.765 717 HB1 ALA 93 1HB ALA 93 16.072 -28.711 7.461 718 HB2 ALA 93 2HB ALA 93 16.019 -28.966 5.716 719 HB3 ALA 93 3HB ALA 93 16.900 -30.095 6.745 720 H TYR 94 H TYR 94 16.339 -26.458 7.395 721 HA TYR 94 HA TYR 94 15.756 -24.909 5.165 722 HB2 TYR 94 2HB TYR 94 14.781 -24.907 7.610 723 HB3 TYR 94 3HB TYR 94 15.953 -23.617 7.857 724 HD1 TYR 94 HD1 TYR 94 13.844 -24.408 4.884 725 HD2 TYR 94 HD2 TYR 94 14.720 -21.654 8.007 726 HE1 TYR 94 HE1 TYR 94 12.271 -22.796 3.896 727 HE2 TYR 94 HE2 TYR 94 13.148 -20.035 7.028 728 HH TYR 94 HH TYR 94 10.846 -20.774 4.880 729 H GLN 95 H GLN 95 18.625 -25.053 7.037 730 HA GLN 95 HA GLN 95 19.620 -22.447 6.499 731 HB2 GLN 95 2HB GLN 95 20.585 -24.893 7.759 732 HB3 GLN 95 3HB GLN 95 21.845 -24.056 6.862 733 HG2 GLN 95 2HG GLN 95 20.095 -22.614 8.819 734 HG3 GLN 95 3HG GLN 95 21.539 -23.486 9.332 735 HE21 GLN 95 1HE2 GLN 95 20.301 -20.625 8.009 736 HE22 GLN 95 2HE2 GLN 95 21.804 -19.840 7.679 737 H GLN 96 H GLN 96 18.875 -24.772 4.376 738 HA GLN 96 HA GLN 96 21.200 -24.816 2.714 739 HB2 GLN 96 2HB GLN 96 18.363 -25.728 2.417 740 HB3 GLN 96 3HB GLN 96 19.405 -25.656 1.002 741 HG2 GLN 96 2HG GLN 96 19.868 -27.266 3.501 742 HG3 GLN 96 3HG GLN 96 19.418 -27.880 1.911 743 HE21 GLN 96 1HE2 GLN 96 21.008 -26.921 0.154 744 HE22 GLN 96 2HE2 GLN 96 22.678 -27.168 0.520 745 H GLY 97 H GLY 97 20.109 -22.170 3.478 746 HA2 GLY 97 2HA GLY 97 20.549 -20.228 2.104 747 HA3 GLY 97 3HA GLY 97 19.855 -21.096 0.743 748 H ALA 98 H ALA 98 18.450 -20.997 3.960 749 HA ALA 98 HA ALA 98 16.177 -19.497 2.833 750 HB1 ALA 98 1HB ALA 98 14.706 -20.739 4.097 751 HB2 ALA 98 2HB ALA 98 15.937 -21.941 3.709 752 HB3 ALA 98 3HB ALA 98 15.929 -21.168 5.294 753 H PHE 99 H PHE 99 14.969 -18.151 4.399 754 HA PHE 99 HA PHE 99 16.839 -16.583 5.974 755 HB2 PHE 99 2HB PHE 99 15.461 -15.208 4.673 756 HB3 PHE 99 3HB PHE 99 14.023 -16.164 5.016 757 HD1 PHE 99 HD2 PHE 99 16.427 -13.766 6.478 758 HD2 PHE 99 HD1 PHE 99 12.623 -15.645 6.828 759 HE1 PHE 99 HE2 PHE 99 15.823 -12.202 8.278 760 HE2 PHE 99 HE1 PHE 99 12.014 -14.083 8.629 761 HZ PHE 99 HZ PHE 99 13.615 -12.359 9.357 762 H ASP 100 H ASP 100 16.511 -16.033 8.167 763 HA ASP 100 HA ASP 100 16.065 -18.018 9.949 764 HB2 ASP 100 2HB ASP 100 16.925 -15.683 10.427 765 HB3 ASP 100 3HB ASP 100 15.243 -15.170 10.522 766 H TYR 101 H TYR 101 14.397 -19.277 10.402 767 HA TYR 101 HA TYR 101 11.743 -18.618 9.520 768 HB2 TYR 101 2HB TYR 101 11.188 -20.832 10.664 769 HB3 TYR 101 3HB TYR 101 12.319 -20.901 9.318 770 HD1 TYR 101 HD1 TYR 101 12.592 -20.230 12.993 771 HD2 TYR 101 HD2 TYR 101 14.002 -22.434 9.638 772 HE1 TYR 101 HE1 TYR 101 14.227 -21.368 14.435 773 HE2 TYR 101 HE2 TYR 101 15.640 -23.579 11.071 774 HH TYR 101 HH TYR 101 15.654 -23.144 14.557 775 H LEU 102 H LEU 102 9.917 -19.240 11.193 776 HA LEU 102 HA LEU 102 10.488 -18.020 13.798 777 HB2 LEU 102 2HB LEU 102 9.596 -16.165 12.743 778 HB3 LEU 102 3HB LEU 102 8.488 -17.128 11.767 779 HG LEU 102 HG LEU 102 7.265 -17.599 13.975 780 HD11 LEU 102 1HD1 LEU 102 9.310 -15.662 14.822 781 HD12 LEU 102 2HD1 LEU 102 8.430 -16.871 15.756 782 HD13 LEU 102 3HD1 LEU 102 7.669 -15.327 15.373 783 HD21 LEU 102 3HD2 LEU 102 7.312 -15.022 12.465 784 HD22 LEU 102 1HD2 LEU 102 6.246 -15.206 13.858 785 HD23 LEU 102 2HD2 LEU 102 6.090 -16.295 12.479 786 HA PRO 103 HA PRO 103 8.247 -21.739 14.880 787 HB2 PRO 103 2HB PRO 103 8.624 -21.483 17.557 788 HB3 PRO 103 3HB PRO 103 9.875 -22.087 16.464 789 HG2 PRO 103 2HG PRO 103 9.528 -19.346 17.614 790 HG3 PRO 103 3HG PRO 103 11.010 -20.303 17.431 791 HD2 PRO 103 2HD PRO 103 10.339 -18.315 15.719 792 HD3 PRO 103 3HD PRO 103 11.237 -19.757 15.203 793 H LYS 104 H LYS 104 6.196 -22.150 15.586 794 HA LYS 104 HA LYS 104 4.659 -19.839 16.576 795 HB2 LYS 104 2HB LYS 104 2.697 -20.817 15.507 796 HB3 LYS 104 3HB LYS 104 3.984 -20.579 14.332 797 HG2 LYS 104 2HG LYS 104 3.333 -22.670 13.746 798 HG3 LYS 104 3HG LYS 104 4.535 -23.086 14.970 799 HD2 LYS 104 2HD LYS 104 2.950 -23.712 16.508 800 HD3 LYS 104 3HD LYS 104 1.717 -22.647 15.830 801 HE2 LYS 104 2HE LYS 104 1.122 -24.150 14.200 802 HE3 LYS 104 3HE LYS 104 2.707 -24.921 14.182 803 HZ1 LYS 104 3HZ LYS 104 0.615 -25.227 16.266 804 HZ2 LYS 104 1HZ LYS 104 2.172 -25.881 16.371 805 HZ3 LYS 104 2HZ LYS 104 1.117 -26.401 15.156 806 HA PRO 105 HA PRO 105 2.369 -19.719 17.113 807 HB2 PRO 105 2HB PRO 105 1.609 -18.611 19.472 808 HB3 PRO 105 3HB PRO 105 0.740 -19.953 18.716 809 HG2 PRO 105 2HG PRO 105 2.748 -20.007 20.936 810 HG3 PRO 105 3HG PRO 105 1.221 -20.897 20.786 811 HD2 PRO 105 2HD PRO 105 3.624 -22.028 20.258 812 HD3 PRO 105 3HD PRO 105 2.140 -22.492 19.400 813 H PHE 106 H PHE 106 2.479 -17.291 17.704 814 HA PHE 106 HA PHE 106 4.863 -16.396 19.030 815 HB2 PHE 106 2HB PHE 106 5.814 -15.292 16.990 816 HB3 PHE 106 3HB PHE 106 5.915 -17.050 16.970 817 HD1 PHE 106 HD1 PHE 106 3.732 -14.266 15.808 818 HD2 PHE 106 HD2 PHE 106 5.201 -18.199 15.105 819 HE1 PHE 106 HE1 PHE 106 2.585 -14.302 13.631 820 HE2 PHE 106 HE2 PHE 106 4.058 -18.240 12.927 821 HZ PHE 106 HZ PHE 106 2.748 -16.290 12.187 822 H ASP 107 H ASP 107 5.169 -13.907 18.292 823 HA ASP 107 HA ASP 107 2.550 -12.705 18.792 824 HB2 ASP 107 2HB ASP 107 5.160 -11.213 18.819 825 HB3 ASP 107 3HB ASP 107 3.673 -10.854 19.694 826 H ILE 108 H ILE 108 1.438 -11.994 17.107 827 HA ILE 108 HA ILE 108 2.251 -11.804 14.500 828 HB ILE 108 HB ILE 108 0.101 -10.315 15.980 829 HG12 ILE 108 2HG1 ILE 108 -0.315 -12.222 13.713 830 HG13 ILE 108 3HG1 ILE 108 0.130 -12.863 15.291 831 HG21 ILE 108 1HG2 ILE 108 0.853 -10.076 13.078 832 HG22 ILE 108 2HG2 ILE 108 -0.749 -9.670 13.690 833 HG23 ILE 108 3HG2 ILE 108 0.664 -8.787 14.266 834 HD11 ILE 108 3HD1 ILE 108 -2.418 -12.040 14.349 835 HD12 ILE 108 1HD1 ILE 108 -1.987 -12.759 15.901 836 HD13 ILE 108 2HD1 ILE 108 -1.952 -11.006 15.700 837 H ASP 109 H ASP 109 2.662 -9.455 17.057 838 HA ASP 109 HA ASP 109 3.275 -7.188 15.553 839 HB2 ASP 109 2HB ASP 109 2.975 -6.843 17.858 840 HB3 ASP 109 3HB ASP 109 4.116 -8.114 18.288 841 H GLU 110 H GLU 110 5.333 -9.864 16.602 842 HA GLU 110 HA GLU 110 7.704 -8.697 15.449 843 HB2 GLU 110 2HB GLU 110 7.840 -10.117 17.452 844 HB3 GLU 110 3HB GLU 110 7.216 -11.478 16.531 845 HG2 GLU 110 2HG GLU 110 9.594 -11.689 16.759 846 HG3 GLU 110 3HG GLU 110 9.195 -11.367 15.072 847 H ALA 111 H ALA 111 5.254 -10.998 14.513 848 HA ALA 111 HA ALA 111 6.637 -12.168 12.335 849 HB1 ALA 111 1HB ALA 111 3.660 -11.909 12.376 850 HB2 ALA 111 2HB ALA 111 4.662 -13.256 11.835 851 HB3 ALA 111 3HB ALA 111 4.475 -12.933 13.558 852 H VAL 112 H VAL 112 4.140 -9.623 12.437 853 HA VAL 112 HA VAL 112 4.036 -9.026 9.739 854 HB VAL 112 HB VAL 112 3.640 -7.274 12.154 855 HG11 VAL 112 1HG1 VAL 112 4.237 -5.655 10.605 856 HG12 VAL 112 2HG1 VAL 112 3.534 -6.545 9.253 857 HG13 VAL 112 3HG1 VAL 112 2.486 -5.740 10.421 858 HG21 VAL 112 3HG2 VAL 112 1.749 -8.501 10.148 859 HG22 VAL 112 1HG2 VAL 112 1.978 -8.999 11.824 860 HG23 VAL 112 2HG2 VAL 112 1.273 -7.424 11.461 861 H ALA 113 H ALA 113 6.397 -8.062 12.141 862 HA ALA 113 HA ALA 113 7.703 -6.189 10.362 863 HB1 ALA 113 1HB ALA 113 8.729 -5.410 12.193 864 HB2 ALA 113 2HB ALA 113 7.566 -6.396 13.081 865 HB3 ALA 113 3HB ALA 113 9.180 -7.024 12.744 866 H LEU 114 H LEU 114 8.004 -9.522 11.290 867 HA LEU 114 HA LEU 114 10.688 -9.922 10.474 868 HB2 LEU 114 2HB LEU 114 9.566 -11.474 11.954 869 HB3 LEU 114 3HB LEU 114 8.387 -11.856 10.701 870 HG LEU 114 HG LEU 114 10.393 -12.714 9.349 871 HD11 LEU 114 1HD1 LEU 114 12.151 -11.735 10.707 872 HD12 LEU 114 2HD1 LEU 114 12.281 -13.494 10.704 873 HD13 LEU 114 3HD1 LEU 114 11.611 -12.663 12.107 874 HD21 LEU 114 3HD2 LEU 114 8.981 -13.948 11.623 875 HD22 LEU 114 1HD2 LEU 114 10.418 -14.798 11.053 876 HD23 LEU 114 2HD2 LEU 114 9.093 -14.460 9.939 877 H VAL 115 H VAL 115 7.583 -10.201 8.818 878 HA VAL 115 HA VAL 115 8.606 -11.314 6.419 879 HB VAL 115 HB VAL 115 6.252 -11.513 6.916 880 HG11 VAL 115 1HG1 VAL 115 6.140 -8.507 6.687 881 HG12 VAL 115 2HG1 VAL 115 4.752 -9.577 6.889 882 HG13 VAL 115 3HG1 VAL 115 5.958 -9.443 8.170 883 HG21 VAL 115 3HG2 VAL 115 7.297 -10.789 4.467 884 HG22 VAL 115 1HG2 VAL 115 5.701 -11.483 4.753 885 HG23 VAL 115 2HG2 VAL 115 5.895 -9.734 4.643 886 H GLU 116 H GLU 116 8.098 -8.018 7.544 887 HA GLU 116 HA GLU 116 8.559 -6.740 5.059 888 HB2 GLU 116 2HB GLU 116 8.520 -5.870 7.917 889 HB3 GLU 116 3HB GLU 116 9.205 -4.786 6.715 890 HG2 GLU 116 2HG GLU 116 7.181 -4.519 5.615 891 HG3 GLU 116 3HG GLU 116 6.495 -5.983 6.317 892 H ARG 117 H ARG 117 10.647 -8.152 7.403 893 HA ARG 117 HA ARG 117 13.003 -6.683 6.795 894 HB2 ARG 117 2HB ARG 117 12.933 -7.842 8.874 895 HB3 ARG 117 3HB ARG 117 12.538 -9.365 8.090 896 HG2 ARG 117 2HG ARG 117 14.680 -9.861 7.740 897 HG3 ARG 117 3HG ARG 117 15.050 -8.237 7.157 898 HD2 ARG 117 2HD ARG 117 14.822 -7.613 9.693 899 HD3 ARG 117 3HD ARG 117 15.141 -9.331 9.931 900 HE ARG 117 HE ARG 117 17.074 -8.367 8.184 901 HH11 ARG 117 1HH1 ARG 117 16.073 -7.877 11.482 902 HH12 ARG 117 2HH1 ARG 117 17.658 -7.452 12.037 903 HH21 ARG 117 1HH2 ARG 117 19.166 -7.810 8.903 904 HH22 ARG 117 2HH2 ARG 117 19.417 -7.413 10.569 905 H ALA 118 H ALA 118 11.430 -9.449 5.379 906 HA ALA 118 HA ALA 118 13.719 -10.176 3.763 907 HB1 ALA 118 1HB ALA 118 12.676 -12.134 3.811 908 HB2 ALA 118 2HB ALA 118 11.233 -11.398 4.511 909 HB3 ALA 118 3HB ALA 118 11.434 -11.453 2.760 910 H ILE 119 H ILE 119 10.758 -8.346 3.428 911 HA ILE 119 HA ILE 119 11.019 -8.101 0.556 912 HB ILE 119 HB ILE 119 9.132 -6.753 2.491 913 HG12 ILE 119 2HG1 ILE 119 8.405 -8.807 0.423 914 HG13 ILE 119 3HG1 ILE 119 9.025 -9.306 1.993 915 HG21 ILE 119 1HG2 ILE 119 7.862 -6.133 0.444 916 HG22 ILE 119 2HG2 ILE 119 9.419 -5.321 0.592 917 HG23 ILE 119 3HG2 ILE 119 9.235 -6.678 -0.519 918 HD11 ILE 119 3HD1 ILE 119 6.698 -7.440 1.769 919 HD12 ILE 119 1HD1 ILE 119 6.493 -9.188 1.664 920 HD13 ILE 119 2HD1 ILE 119 7.176 -8.465 3.122 921 H SER 120 H SER 120 11.904 -6.314 3.400 922 HA SER 120 HA SER 120 12.434 -3.862 1.962 923 HB2 SER 120 2HB SER 120 11.677 -3.978 4.384 924 HB3 SER 120 3HB SER 120 13.300 -4.545 4.775 925 HG SER 120 HG SER 120 14.130 -2.612 4.198 926 H HIS 121 H HIS 121 14.117 -6.744 2.765 927 HA HIS 121 HA HIS 121 16.760 -5.884 2.888 928 HB2 HIS 121 2HB HIS 121 15.846 -8.228 3.290 929 HB3 HIS 121 3HB HIS 121 15.885 -8.440 1.542 930 HD1 HIS 121 HD1 HIS 121 18.166 -8.798 0.445 931 HD2 HIS 121 HD2 HIS 121 18.379 -8.124 4.539 932 HE1 HIS 121 HE1 HIS 121 20.527 -9.368 1.098 933 H TYR 122 H TYR 122 14.601 -6.062 0.200 934 HA TYR 122 HA TYR 122 16.810 -5.626 -1.685 935 HB2 TYR 122 2HB TYR 122 13.931 -6.131 -2.419 936 HB3 TYR 122 3HB TYR 122 15.360 -6.320 -3.429 937 HD1 TYR 122 HD2 TYR 122 17.081 -8.117 -2.633 938 HD2 TYR 122 HD1 TYR 122 13.017 -7.993 -1.379 939 HE1 TYR 122 HE2 TYR 122 17.202 -10.496 -2.022 940 HE2 TYR 122 HE1 TYR 122 13.127 -10.372 -0.764 941 HH TYR 122 HH TYR 122 15.532 -11.990 -0.103 942 H GLN 123 H GLN 123 13.643 -4.325 -0.748 943 HA GLN 123 HA GLN 123 13.939 -1.990 -2.397 944 HB2 GLN 123 2HB GLN 123 11.830 -3.264 -0.993 945 HB3 GLN 123 3HB GLN 123 11.955 -1.625 -0.368 946 HG2 GLN 123 2HG GLN 123 11.404 -0.666 -2.375 947 HG3 GLN 123 3HG GLN 123 11.963 -2.050 -3.313 948 HE21 GLN 123 1HE2 GLN 123 10.679 -4.119 -2.764 949 HE22 GLN 123 2HE2 GLN 123 8.962 -3.934 -2.741 950 H GLU 124 H GLU 124 13.442 -2.256 1.125 951 HA GLU 124 HA GLU 124 14.170 -0.968 2.856 952 HB2 GLU 124 2HB GLU 124 16.353 -1.986 1.735 953 HB3 GLU 124 3HB GLU 124 16.675 -0.292 1.390 954 HG2 GLU 124 2HG GLU 124 15.907 -0.367 4.071 955 HG3 GLU 124 3HG GLU 124 16.977 -1.750 3.845 Start of MODEL 2 1 H1 MET 1 H MET 1 2.882 0.935 2.052 2 HA MET 1 HA MET 1 1.383 0.183 0.497 3 HB2 MET 1 2HB MET 1 2.073 0.499 -1.756 4 HB3 MET 1 3HB MET 1 2.968 1.666 -0.792 5 HG2 MET 1 2HG MET 1 4.887 0.063 -0.791 6 HG3 MET 1 3HG MET 1 3.984 -0.915 -1.947 7 HE1 MET 1 3HE MET 1 6.943 2.055 -2.661 8 HE2 MET 1 1HE MET 1 6.706 0.663 -1.604 9 HE3 MET 1 2HE MET 1 7.023 0.422 -3.322 10 H GLN 2 H GLN 2 1.401 -1.453 -1.626 11 HA GLN 2 HA GLN 2 1.935 -4.046 -0.401 12 HB2 GLN 2 2HB GLN 2 0.542 -4.924 -2.281 13 HB3 GLN 2 3HB GLN 2 -0.293 -3.772 -1.247 14 HG2 GLN 2 2HG GLN 2 -0.092 -2.047 -2.868 15 HG3 GLN 2 3HG GLN 2 1.001 -3.018 -3.851 16 HE21 GLN 2 1HE2 GLN 2 -0.891 -2.129 -5.293 17 HE22 GLN 2 2HE2 GLN 2 -2.163 -3.265 -5.567 18 H ARG 3 H ARG 3 4.277 -2.917 -1.072 19 HA ARG 3 HA ARG 3 5.115 -3.585 -3.730 20 HB2 ARG 3 2HB ARG 3 7.174 -2.683 -3.163 21 HB3 ARG 3 3HB ARG 3 6.084 -1.804 -2.099 22 HG2 ARG 3 2HG ARG 3 7.691 -4.222 -1.301 23 HG3 ARG 3 3HG ARG 3 8.142 -2.547 -0.974 24 HD2 ARG 3 2HD ARG 3 5.631 -3.910 -0.007 25 HD3 ARG 3 3HD ARG 3 7.074 -3.619 0.963 26 HE ARG 3 HE ARG 3 5.029 -1.725 0.298 27 HH11 ARG 3 1HH1 ARG 3 8.391 -2.103 1.119 28 HH12 ARG 3 2HH1 ARG 3 8.550 -0.500 1.756 29 HH21 ARG 3 1HH2 ARG 3 5.226 0.388 1.133 30 HH22 ARG 3 2HH2 ARG 3 6.749 0.916 1.764 31 H GLY 4 H GLY 4 4.662 -5.349 -0.870 32 HA2 GLY 4 2HA GLY 4 6.065 -7.637 -2.067 33 HA3 GLY 4 3HA GLY 4 6.421 -7.202 -0.402 34 H ILE 5 H ILE 5 4.496 -9.072 -2.398 35 HA ILE 5 HA ILE 5 2.186 -9.213 -0.679 36 HB ILE 5 HB ILE 5 3.017 -10.905 -3.037 37 HG12 ILE 5 2HG1 ILE 5 0.766 -8.904 -2.830 38 HG13 ILE 5 3HG1 ILE 5 2.375 -8.474 -3.400 39 HG21 ILE 5 1HG2 ILE 5 1.621 -12.402 -2.080 40 HG22 ILE 5 2HG2 ILE 5 0.810 -11.183 -1.099 41 HG23 ILE 5 3HG2 ILE 5 0.384 -11.372 -2.799 42 HD11 ILE 5 3HD1 ILE 5 1.794 -10.631 -4.952 43 HD12 ILE 5 1HD1 ILE 5 0.210 -9.880 -4.759 44 HD13 ILE 5 2HD1 ILE 5 1.555 -8.947 -5.417 45 H VAL 6 H VAL 6 1.719 -10.720 0.839 46 HA VAL 6 HA VAL 6 3.775 -12.765 1.372 47 HB VAL 6 HB VAL 6 1.988 -11.562 3.476 48 HG11 VAL 6 1HG1 VAL 6 4.317 -13.416 3.434 49 HG12 VAL 6 2HG1 VAL 6 4.104 -12.351 4.825 50 HG13 VAL 6 3HG1 VAL 6 2.832 -13.490 4.382 51 HG21 VAL 6 3HG2 VAL 6 4.746 -10.677 2.637 52 HG22 VAL 6 1HG2 VAL 6 3.259 -9.730 2.578 53 HG23 VAL 6 2HG2 VAL 6 3.952 -10.187 4.134 54 H TRP 7 H TRP 7 3.074 -14.757 1.023 55 HA TRP 7 HA TRP 7 0.195 -15.307 1.205 56 HB2 TRP 7 2HB TRP 7 2.439 -16.723 -0.235 57 HB3 TRP 7 3HB TRP 7 0.832 -17.420 -0.057 58 HD1 TRP 7 HD1 TRP 7 0.084 -13.947 -0.480 59 HE1 TRP 7 HE1 TRP 7 -0.389 -13.340 -2.936 60 HE3 TRP 7 HE3 TRP 7 2.020 -18.108 -2.732 61 HZ2 TRP 7 HZ2 TRP 7 0.006 -14.475 -5.490 62 HZ3 TRP 7 HZ3 TRP 7 1.933 -18.270 -5.185 63 HH2 TRP 7 HH2 TRP 7 0.946 -16.490 -6.534 64 H VAL 8 H VAL 8 -0.539 -17.243 2.230 65 HA VAL 8 HA VAL 8 1.356 -18.507 4.079 66 HB VAL 8 HB VAL 8 -1.318 -17.357 4.888 67 HG11 VAL 8 1HG1 VAL 8 -0.810 -18.213 7.124 68 HG12 VAL 8 2HG1 VAL 8 -0.941 -19.521 5.947 69 HG13 VAL 8 3HG1 VAL 8 0.646 -18.985 6.498 70 HG21 VAL 8 3HG2 VAL 8 1.361 -16.704 6.073 71 HG22 VAL 8 1HG2 VAL 8 0.739 -15.842 4.666 72 HG23 VAL 8 2HG2 VAL 8 -0.150 -15.802 6.188 73 H VAL 9 H VAL 9 0.891 -20.626 4.618 74 HA VAL 9 HA VAL 9 -1.555 -21.826 3.553 75 HB VAL 9 HB VAL 9 0.218 -22.048 1.807 76 HG11 VAL 9 1HG1 VAL 9 1.554 -23.902 3.770 77 HG12 VAL 9 2HG1 VAL 9 2.110 -23.467 2.153 78 HG13 VAL 9 3HG1 VAL 9 2.101 -22.259 3.438 79 HG21 VAL 9 3HG2 VAL 9 -0.005 -24.811 2.231 80 HG22 VAL 9 1HG2 VAL 9 -1.448 -24.091 2.943 81 HG23 VAL 9 2HG2 VAL 9 -1.052 -23.786 1.251 82 H ASP 10 H ASP 10 -2.412 -23.245 4.930 83 HA ASP 10 HA ASP 10 -0.758 -24.849 6.674 84 HB2 ASP 10 2HB ASP 10 -1.658 -24.066 8.756 85 HB3 ASP 10 3HB ASP 10 -1.037 -22.666 7.886 86 H ASP 11 H ASP 11 -2.657 -25.731 8.447 87 HA ASP 11 HA ASP 11 -4.784 -26.799 6.709 88 HB2 ASP 11 2HB ASP 11 -2.685 -28.269 7.740 89 HB3 ASP 11 3HB ASP 11 -3.980 -28.568 8.895 90 H ASP 12 H ASP 12 -4.143 -24.928 9.315 91 HA ASP 12 HA ASP 12 -6.579 -25.732 10.756 92 HB2 ASP 12 2HB ASP 12 -3.982 -24.671 11.608 93 HB3 ASP 12 3HB ASP 12 -5.354 -23.847 12.342 94 H SER 13 H SER 13 -8.034 -24.077 11.480 95 HA SER 13 HA SER 13 -8.470 -22.067 9.477 96 HB2 SER 13 2HB SER 13 -10.576 -22.469 10.133 97 HB3 SER 13 3HB SER 13 -10.012 -23.349 11.553 98 HG SER 13 HG SER 13 -11.312 -21.309 11.828 99 H SER 14 H SER 14 -7.861 -21.988 12.985 100 HA SER 14 HA SER 14 -7.635 -19.158 13.107 101 HB2 SER 14 2HB SER 14 -7.413 -19.455 15.353 102 HB3 SER 14 3HB SER 14 -7.954 -21.091 14.978 103 HG SER 14 HG SER 14 -6.104 -21.749 15.693 104 H ILE 15 H ILE 15 -5.278 -21.788 12.890 105 HA ILE 15 HA ILE 15 -2.921 -20.416 13.245 106 HB ILE 15 HB ILE 15 -3.539 -22.691 11.366 107 HG12 ILE 15 2HG1 ILE 15 -3.773 -23.199 13.743 108 HG13 ILE 15 3HG1 ILE 15 -2.365 -24.022 13.082 109 HG21 ILE 15 1HG2 ILE 15 -1.603 -22.227 10.352 110 HG22 ILE 15 2HG2 ILE 15 -1.129 -21.072 11.596 111 HG23 ILE 15 3HG2 ILE 15 -0.835 -22.794 11.835 112 HD11 ILE 15 3HD1 ILE 15 -1.141 -23.140 14.692 113 HD12 ILE 15 1HD1 ILE 15 -1.473 -21.534 14.044 114 HD13 ILE 15 2HD1 ILE 15 -2.527 -22.222 15.280 115 H ARG 16 H ARG 16 -4.916 -20.615 10.338 116 HA ARG 16 HA ARG 16 -3.060 -19.059 8.768 117 HB2 ARG 16 2HB ARG 16 -4.342 -19.606 6.965 118 HB3 ARG 16 3HB ARG 16 -4.869 -20.885 8.050 119 HG2 ARG 16 2HG ARG 16 -6.685 -19.115 8.733 120 HG3 ARG 16 3HG ARG 16 -6.312 -18.451 7.142 121 HD2 ARG 16 2HD ARG 16 -6.597 -20.918 6.354 122 HD3 ARG 16 3HD ARG 16 -7.485 -21.102 7.866 123 HE ARG 16 HE ARG 16 -8.423 -18.845 6.447 124 HH11 ARG 16 1HH1 ARG 16 -8.496 -22.325 6.405 125 HH12 ARG 16 2HH1 ARG 16 -10.026 -22.413 5.596 126 HH21 ARG 16 1HH2 ARG 16 -10.437 -18.948 5.381 127 HH22 ARG 16 2HH2 ARG 16 -11.129 -20.491 5.013 128 H TRP 17 H TRP 17 -5.768 -18.466 10.819 129 HA TRP 17 HA TRP 17 -6.516 -15.935 9.749 130 HB2 TRP 17 2HB TRP 17 -8.181 -16.965 11.037 131 HB3 TRP 17 3HB TRP 17 -7.060 -17.367 12.335 132 HD1 TRP 17 HD1 TRP 17 -9.143 -14.457 10.973 133 HE1 TRP 17 HE1 TRP 17 -9.324 -12.652 12.799 134 HE3 TRP 17 HE3 TRP 17 -5.887 -16.426 14.386 135 HZ2 TRP 17 HZ2 TRP 17 -8.231 -12.132 15.348 136 HZ3 TRP 17 HZ3 TRP 17 -5.510 -15.213 16.493 137 HH2 TRP 17 HH2 TRP 17 -6.658 -13.110 16.962 138 H VAL 18 H VAL 18 -4.587 -16.888 12.587 139 HA VAL 18 HA VAL 18 -3.940 -14.429 13.608 140 HB VAL 18 HB VAL 18 -1.932 -15.400 14.530 141 HG11 VAL 18 1HG1 VAL 18 -4.011 -16.096 15.548 142 HG12 VAL 18 2HG1 VAL 18 -4.182 -17.404 14.375 143 HG13 VAL 18 3HG1 VAL 18 -2.870 -17.441 15.554 144 HG21 VAL 18 3HG2 VAL 18 -0.724 -16.595 13.049 145 HG22 VAL 18 1HG2 VAL 18 -1.657 -17.954 13.678 146 HG23 VAL 18 2HG2 VAL 18 -2.152 -17.161 12.183 147 H LEU 19 H LEU 19 -2.646 -15.985 10.747 148 HA LEU 19 HA LEU 19 -0.600 -13.970 10.376 149 HB2 LEU 19 2HB LEU 19 -1.437 -16.452 8.957 150 HB3 LEU 19 3HB LEU 19 -0.492 -15.252 8.078 151 HG LEU 19 HG LEU 19 0.429 -16.427 10.690 152 HD11 LEU 19 1HD1 LEU 19 1.667 -18.075 9.519 153 HD12 LEU 19 2HD1 LEU 19 1.220 -17.397 7.954 154 HD13 LEU 19 3HD1 LEU 19 0.001 -18.191 8.950 155 HD21 LEU 19 3HD2 LEU 19 1.431 -14.298 9.835 156 HD22 LEU 19 1HD2 LEU 19 1.985 -15.196 8.422 157 HD23 LEU 19 2HD2 LEU 19 2.576 -15.626 10.028 158 H GLU 20 H GLU 20 -3.792 -14.729 9.153 159 HA GLU 20 HA GLU 20 -3.745 -12.941 6.947 160 HB2 GLU 20 2HB GLU 20 -5.472 -14.884 7.865 161 HB3 GLU 20 3HB GLU 20 -6.375 -13.402 8.142 162 HG2 GLU 20 2HG GLU 20 -6.062 -12.784 5.790 163 HG3 GLU 20 3HG GLU 20 -5.196 -14.296 5.521 164 H ARG 21 H ARG 21 -5.119 -12.677 10.219 165 HA ARG 21 HA ARG 21 -6.159 -10.106 10.001 166 HB2 ARG 21 2HB ARG 21 -6.108 -10.031 12.429 167 HB3 ARG 21 3HB ARG 21 -6.611 -11.627 11.888 168 HG2 ARG 21 2HG ARG 21 -4.571 -12.601 12.488 169 HG3 ARG 21 3HG ARG 21 -3.761 -11.037 12.602 170 HD2 ARG 21 2HD ARG 21 -6.052 -11.225 14.374 171 HD3 ARG 21 3HD ARG 21 -4.860 -12.485 14.691 172 HE ARG 21 HE ARG 21 -3.356 -10.245 14.532 173 HH11 ARG 21 1HH1 ARG 21 -6.208 -11.081 16.345 174 HH12 ARG 21 2HH1 ARG 21 -5.823 -10.045 17.679 175 HH21 ARG 21 1HH2 ARG 21 -2.838 -8.877 16.281 176 HH22 ARG 21 2HH2 ARG 21 -3.906 -8.790 17.641 177 H ALA 22 H ALA 22 -2.887 -11.168 10.274 178 HA ALA 22 HA ALA 22 -1.784 -8.730 11.264 179 HB1 ALA 22 1HB ALA 22 -0.799 -11.325 10.421 180 HB2 ALA 22 2HB ALA 22 0.253 -10.008 9.902 181 HB3 ALA 22 3HB ALA 22 -0.145 -10.199 11.610 182 H LEU 23 H LEU 23 -1.583 -10.241 8.033 183 HA LEU 23 HA LEU 23 -0.559 -7.929 6.771 184 HB2 LEU 23 2HB LEU 23 -2.073 -10.186 5.475 185 HB3 LEU 23 3HB LEU 23 -0.940 -9.081 4.700 186 HG LEU 23 HG LEU 23 -0.107 -11.001 6.862 187 HD11 LEU 23 1HD1 LEU 23 -1.077 -12.288 5.033 188 HD12 LEU 23 2HD1 LEU 23 0.674 -12.486 5.090 189 HD13 LEU 23 3HD1 LEU 23 -0.055 -11.432 3.878 190 HD21 LEU 23 3HD2 LEU 23 2.035 -10.398 6.380 191 HD22 LEU 23 1HD2 LEU 23 1.223 -8.885 5.978 192 HD23 LEU 23 2HD2 LEU 23 1.668 -10.013 4.697 193 H ALA 24 H ALA 24 -3.825 -9.207 7.156 194 HA ALA 24 HA ALA 24 -5.239 -7.603 5.419 195 HB1 ALA 24 1HB ALA 24 -6.525 -9.220 6.434 196 HB2 ALA 24 2HB ALA 24 -5.916 -8.845 8.047 197 HB3 ALA 24 3HB ALA 24 -7.070 -7.764 7.267 198 H GLY 25 H GLY 25 -3.861 -6.785 8.539 199 HA2 GLY 25 2HA GLY 25 -5.181 -4.200 8.612 200 HA3 GLY 25 3HA GLY 25 -4.045 -4.827 9.797 201 H ALA 26 H ALA 26 -2.189 -5.510 7.490 202 HA ALA 26 HA ALA 26 -0.921 -2.882 7.389 203 HB1 ALA 26 1HB ALA 26 1.087 -4.025 6.770 204 HB2 ALA 26 2HB ALA 26 0.357 -4.894 8.121 205 HB3 ALA 26 3HB ALA 26 0.205 -5.525 6.481 206 H GLY 27 H GLY 27 0.442 -2.635 5.222 207 HA2 GLY 27 2HA GLY 27 -1.566 -2.551 3.107 208 HA3 GLY 27 3HA GLY 27 -0.021 -1.713 3.110 209 H LEU 28 H LEU 28 -0.685 -5.154 3.637 210 HA LEU 28 HA LEU 28 0.725 -5.748 1.126 211 HB2 LEU 28 2HB LEU 28 1.158 -7.695 3.258 212 HB3 LEU 28 3HB LEU 28 2.297 -7.002 2.106 213 HG LEU 28 HG LEU 28 1.371 -5.604 4.612 214 HD11 LEU 28 1HD1 LEU 28 2.916 -6.667 5.808 215 HD12 LEU 28 2HD1 LEU 28 4.133 -6.477 4.547 216 HD13 LEU 28 3HD1 LEU 28 3.005 -7.831 4.486 217 HD21 LEU 28 3HD2 LEU 28 2.288 -3.837 3.618 218 HD22 LEU 28 1HD2 LEU 28 2.928 -4.821 2.301 219 HD23 LEU 28 2HD2 LEU 28 3.845 -4.648 3.798 220 H THR 29 H THR 29 -0.124 -7.361 -0.080 221 HA THR 29 HA THR 29 -2.746 -8.169 0.221 222 HB THR 29 HB THR 29 -0.680 -9.861 -1.182 223 HG1 THR 29 HG1 THR 29 -2.045 -7.762 -2.471 224 HG21 THR 29 3HG2 THR 29 -2.747 -10.942 -1.290 225 HG22 THR 29 1HG2 THR 29 -2.682 -10.036 -2.801 226 HG23 THR 29 2HG2 THR 29 -3.638 -9.429 -1.448 227 H CYS 30 H CYS 30 -3.643 -10.314 0.616 228 HA CYS 30 HA CYS 30 -2.053 -11.995 2.414 229 HB2 CYS 30 2HB CYS 30 -4.103 -12.201 3.893 230 HB3 CYS 30 3HB CYS 30 -3.260 -10.659 3.964 231 HG CYS 30 HG CYS 30 -5.568 -10.459 1.652 232 H THR 31 H THR 31 -2.023 -13.932 1.500 233 HA THR 31 HA THR 31 -4.526 -14.980 0.351 234 HB THR 31 HB THR 31 -1.798 -15.708 -0.704 235 HG1 THR 31 HG1 THR 31 -2.302 -13.417 -0.979 236 HG21 THR 31 3HG2 THR 31 -4.428 -15.829 -2.146 237 HG22 THR 31 1HG2 THR 31 -3.912 -17.134 -1.080 238 HG23 THR 31 2HG2 THR 31 -2.937 -16.707 -2.486 239 H THR 32 H THR 32 -5.226 -16.546 1.644 240 HA THR 32 HA THR 32 -3.267 -18.267 2.998 241 HB THR 32 HB THR 32 -4.940 -18.820 4.595 242 HG1 THR 32 HG1 THR 32 -6.734 -17.606 2.755 243 HG21 THR 32 3HG2 THR 32 -4.762 -16.865 5.654 244 HG22 THR 32 1HG2 THR 32 -5.857 -16.084 4.514 245 HG23 THR 32 2HG2 THR 32 -4.133 -16.180 4.156 246 H PHE 33 H PHE 33 -3.029 -20.329 2.422 247 HA PHE 33 HA PHE 33 -4.993 -21.476 0.554 248 HB2 PHE 33 2HB PHE 33 -2.052 -22.070 0.923 249 HB3 PHE 33 3HB PHE 33 -3.118 -23.004 -0.121 250 HD1 PHE 33 HD2 PHE 33 -1.541 -19.718 0.385 251 HD2 PHE 33 HD1 PHE 33 -3.769 -22.202 -2.257 252 HE1 PHE 33 HE2 PHE 33 -1.119 -18.136 -1.452 253 HE2 PHE 33 HE1 PHE 33 -3.350 -20.625 -4.099 254 HZ PHE 33 HZ PHE 33 -2.024 -18.588 -3.697 255 H GLU 34 H GLU 34 -4.483 -24.097 0.656 256 HA GLU 34 HA GLU 34 -4.529 -24.963 3.440 257 HB2 GLU 34 2HB GLU 34 -6.628 -26.056 3.317 258 HB3 GLU 34 3HB GLU 34 -6.893 -24.430 2.702 259 HG2 GLU 34 2HG GLU 34 -6.506 -25.491 0.383 260 HG3 GLU 34 3HG GLU 34 -6.808 -27.017 1.211 261 H ASN 35 H ASN 35 -2.902 -25.272 0.887 262 HA ASN 35 HA ASN 35 -2.178 -27.988 1.287 263 HB2 ASN 35 2HB ASN 35 -4.232 -27.496 -0.650 264 HB3 ASN 35 3HB ASN 35 -2.779 -28.035 -1.486 265 HD21 ASN 35 1HD2 ASN 35 -5.280 -29.422 -1.198 266 HD22 ASN 35 2HD2 ASN 35 -4.939 -30.902 -0.376 267 H GLY 36 H GLY 36 -0.045 -27.924 1.083 268 HA2 GLY 36 2HA GLY 36 1.446 -25.847 0.042 269 HA3 GLY 36 3HA GLY 36 2.047 -27.487 0.239 270 H ASN 37 H ASN 37 0.525 -28.866 -1.593 271 HA ASN 37 HA ASN 37 1.910 -28.422 -3.978 272 HB2 ASN 37 2HB ASN 37 1.080 -30.595 -3.690 273 HB3 ASN 37 3HB ASN 37 -0.536 -30.025 -3.285 274 HD21 ASN 37 1HD2 ASN 37 1.799 -30.236 -5.918 275 HD22 ASN 37 2HD2 ASN 37 0.630 -30.339 -7.186 276 H GLU 38 H GLU 38 -0.901 -26.915 -2.726 277 HA GLU 38 HA GLU 38 -1.815 -25.974 -5.321 278 HB2 GLU 38 2HB GLU 38 -3.112 -26.493 -2.952 279 HB3 GLU 38 3HB GLU 38 -2.998 -24.739 -2.941 280 HG2 GLU 38 2HG GLU 38 -4.245 -24.529 -4.906 281 HG3 GLU 38 3HG GLU 38 -4.031 -26.227 -5.326 282 H VAL 39 H VAL 39 0.361 -25.017 -2.905 283 HA VAL 39 HA VAL 39 0.159 -22.173 -3.474 284 HB VAL 39 HB VAL 39 2.315 -23.465 -1.824 285 HG11 VAL 39 1HG1 VAL 39 1.064 -20.886 -1.109 286 HG12 VAL 39 2HG1 VAL 39 2.755 -21.386 -1.046 287 HG13 VAL 39 3HG1 VAL 39 2.032 -20.908 -2.583 288 HG21 VAL 39 3HG2 VAL 39 0.405 -24.389 -0.830 289 HG22 VAL 39 1HG2 VAL 39 0.744 -22.948 0.130 290 HG23 VAL 39 2HG2 VAL 39 -0.542 -22.922 -1.077 291 H LEU 40 H LEU 40 2.410 -24.847 -4.020 292 HA LEU 40 HA LEU 40 4.557 -23.497 -5.099 293 HB2 LEU 40 2HB LEU 40 5.002 -25.716 -4.867 294 HB3 LEU 40 3HB LEU 40 3.408 -26.206 -5.435 295 HG LEU 40 HG LEU 40 4.085 -25.833 -7.737 296 HD11 LEU 40 1HD1 LEU 40 6.111 -24.255 -6.548 297 HD12 LEU 40 2HD1 LEU 40 5.757 -24.479 -8.261 298 HD13 LEU 40 3HD1 LEU 40 6.898 -25.550 -7.449 299 HD21 LEU 40 3HD2 LEU 40 6.400 -27.390 -6.825 300 HD22 LEU 40 1HD2 LEU 40 5.079 -27.839 -7.903 301 HD23 LEU 40 2HD2 LEU 40 4.850 -27.902 -6.156 302 H ALA 41 H ALA 41 1.589 -24.551 -6.719 303 HA ALA 41 HA ALA 41 2.392 -23.603 -9.295 304 HB1 ALA 41 1HB ALA 41 0.269 -25.144 -8.239 305 HB2 ALA 41 2HB ALA 41 -0.442 -23.785 -9.110 306 HB3 ALA 41 3HB ALA 41 0.685 -24.866 -9.930 307 H ALA 42 H ALA 42 0.899 -22.184 -6.519 308 HA ALA 42 HA ALA 42 -0.430 -20.025 -7.749 309 HB1 ALA 42 1HB ALA 42 -0.716 -20.807 -5.377 310 HB2 ALA 42 2HB ALA 42 0.802 -19.988 -5.003 311 HB3 ALA 42 3HB ALA 42 -0.580 -19.060 -5.585 312 H LEU 43 H LEU 43 2.885 -20.432 -6.606 313 HA LEU 43 HA LEU 43 3.752 -17.790 -6.827 314 HB2 LEU 43 2HB LEU 43 5.529 -20.085 -7.547 315 HB3 LEU 43 3HB LEU 43 5.921 -18.606 -6.672 316 HG LEU 43 HG LEU 43 4.515 -21.060 -5.649 317 HD11 LEU 43 1HD1 LEU 43 7.113 -19.686 -5.154 318 HD12 LEU 43 2HD1 LEU 43 6.764 -21.403 -5.357 319 HD13 LEU 43 3HD1 LEU 43 6.351 -20.592 -3.847 320 HD21 LEU 43 3HD2 LEU 43 3.259 -19.723 -4.378 321 HD22 LEU 43 1HD2 LEU 43 4.184 -18.289 -4.825 322 HD23 LEU 43 2HD2 LEU 43 4.749 -19.330 -3.518 323 H ALA 44 H ALA 44 3.452 -20.319 -9.257 324 HA ALA 44 HA ALA 44 4.827 -18.991 -11.335 325 HB1 ALA 44 1HB ALA 44 3.031 -21.319 -11.111 326 HB2 ALA 44 2HB ALA 44 3.112 -20.552 -12.698 327 HB3 ALA 44 3HB ALA 44 4.583 -21.153 -11.933 328 H SER 45 H SER 45 1.899 -18.283 -9.839 329 HA SER 45 HA SER 45 0.514 -17.219 -12.118 330 HB2 SER 45 2HB SER 45 -0.640 -18.065 -10.062 331 HB3 SER 45 3HB SER 45 -0.007 -16.670 -9.188 332 HG SER 45 HG SER 45 -2.177 -16.821 -10.732 333 H LYS 46 H LYS 46 1.546 -15.528 -9.159 334 HA LYS 46 HA LYS 46 2.436 -13.289 -10.855 335 HB2 LYS 46 2HB LYS 46 1.711 -11.781 -8.986 336 HB3 LYS 46 3HB LYS 46 0.394 -12.593 -9.823 337 HG2 LYS 46 2HG LYS 46 0.558 -14.338 -7.939 338 HG3 LYS 46 3HG LYS 46 1.480 -13.102 -7.081 339 HD2 LYS 46 2HD LYS 46 -1.267 -12.656 -8.243 340 HD3 LYS 46 3HD LYS 46 -0.968 -13.118 -6.566 341 HE2 LYS 46 2HE LYS 46 -0.807 -10.943 -6.113 342 HE3 LYS 46 3HE LYS 46 0.721 -10.961 -6.991 343 HZ1 LYS 46 3HZ LYS 46 -0.472 -10.392 -9.011 344 HZ2 LYS 46 1HZ LYS 46 -0.756 -9.234 -7.811 345 HZ3 LYS 46 2HZ LYS 46 -1.941 -10.384 -8.174 346 H THR 47 H THR 47 3.262 -15.564 -8.533 347 HA THR 47 HA THR 47 5.119 -15.934 -7.269 348 HB THR 47 HB THR 47 6.853 -13.856 -8.290 349 HG1 THR 47 HG1 THR 47 6.179 -13.798 -10.288 350 HG21 THR 47 3HG2 THR 47 8.312 -15.558 -8.284 351 HG22 THR 47 1HG2 THR 47 7.258 -16.578 -9.261 352 HG23 THR 47 2HG2 THR 47 7.031 -16.492 -7.514 353 HA PRO 48 HA PRO 48 4.269 -12.680 -4.254 354 HB2 PRO 48 2HB PRO 48 4.849 -14.228 -2.100 355 HB3 PRO 48 3HB PRO 48 3.296 -14.295 -2.942 356 HG2 PRO 48 2HG PRO 48 5.664 -16.109 -3.189 357 HG3 PRO 48 3HG PRO 48 3.942 -16.523 -3.104 358 HD2 PRO 48 2HD PRO 48 5.312 -16.462 -5.439 359 HD3 PRO 48 3HD PRO 48 3.589 -16.048 -5.332 360 H ASP 49 H ASP 49 5.600 -11.970 -2.268 361 HA ASP 49 HA ASP 49 8.418 -11.878 -3.087 362 HB2 ASP 49 2HB ASP 49 6.729 -10.028 -1.405 363 HB3 ASP 49 3HB ASP 49 8.483 -9.893 -1.487 364 H VAL 50 H VAL 50 6.396 -13.327 -0.840 365 HA VAL 50 HA VAL 50 8.492 -14.605 0.532 366 HB VAL 50 HB VAL 50 8.688 -12.335 1.576 367 HG11 VAL 50 1HG1 VAL 50 6.369 -12.755 3.309 368 HG12 VAL 50 2HG1 VAL 50 6.971 -11.277 2.554 369 HG13 VAL 50 3HG1 VAL 50 5.957 -12.389 1.634 370 HG21 VAL 50 3HG2 VAL 50 9.577 -14.179 2.779 371 HG22 VAL 50 1HG2 VAL 50 8.660 -13.217 3.938 372 HG23 VAL 50 2HG2 VAL 50 7.974 -14.706 3.290 373 H LEU 51 H LEU 51 7.755 -16.380 1.598 374 HA LEU 51 HA LEU 51 4.833 -16.635 1.883 375 HB2 LEU 51 2HB LEU 51 6.570 -18.150 0.317 376 HB3 LEU 51 3HB LEU 51 6.234 -19.159 1.722 377 HG LEU 51 HG LEU 51 3.891 -17.933 0.400 378 HD11 LEU 51 1HD1 LEU 51 5.504 -20.133 -0.881 379 HD12 LEU 51 2HD1 LEU 51 5.168 -18.537 -1.553 380 HD13 LEU 51 3HD1 LEU 51 3.855 -19.693 -1.329 381 HD21 LEU 51 3HD2 LEU 51 4.415 -19.952 2.268 382 HD22 LEU 51 1HD2 LEU 51 3.835 -20.774 0.819 383 HD23 LEU 51 2HD2 LEU 51 2.857 -19.512 1.568 384 H LEU 52 H LEU 52 4.160 -18.262 3.529 385 HA LEU 52 HA LEU 52 6.074 -18.555 5.730 386 HB2 LEU 52 2HB LEU 52 3.396 -17.218 5.830 387 HB3 LEU 52 3HB LEU 52 4.065 -18.000 7.260 388 HG LEU 52 HG LEU 52 6.109 -16.481 6.873 389 HD11 LEU 52 1HD1 LEU 52 6.018 -15.292 4.988 390 HD12 LEU 52 2HD1 LEU 52 4.864 -14.267 5.840 391 HD13 LEU 52 3HD1 LEU 52 4.286 -15.564 4.794 392 HD21 LEU 52 3HD2 LEU 52 3.949 -16.293 8.481 393 HD22 LEU 52 1HD2 LEU 52 3.833 -14.766 7.607 394 HD23 LEU 52 2HD2 LEU 52 5.299 -15.158 8.506 395 H SER 53 H SER 53 5.943 -20.732 4.622 396 HA SER 53 HA SER 53 3.723 -22.367 4.593 397 HB2 SER 53 2HB SER 53 5.773 -23.105 3.573 398 HB3 SER 53 3HB SER 53 6.618 -23.067 5.121 399 HG SER 53 HG SER 53 5.892 -24.992 5.517 400 H ASP 54 H ASP 54 2.769 -23.794 6.026 401 HA ASP 54 HA ASP 54 3.533 -23.473 8.855 402 HB2 ASP 54 2HB ASP 54 1.413 -22.292 8.263 403 HB3 ASP 54 3HB ASP 54 0.723 -23.845 7.800 404 H ILE 55 H ILE 55 4.566 -25.335 9.293 405 HA ILE 55 HA ILE 55 3.680 -27.855 8.201 406 HB ILE 55 HB ILE 55 5.736 -27.532 10.371 407 HG12 ILE 55 2HG1 ILE 55 6.157 -27.222 7.390 408 HG13 ILE 55 3HG1 ILE 55 6.279 -25.934 8.584 409 HG21 ILE 55 1HG2 ILE 55 6.332 -29.653 9.913 410 HG22 ILE 55 2HG2 ILE 55 4.707 -29.759 9.238 411 HG23 ILE 55 3HG2 ILE 55 6.084 -29.459 8.178 412 HD11 ILE 55 3HD1 ILE 55 8.447 -26.396 8.638 413 HD12 ILE 55 1HD1 ILE 55 8.009 -27.848 9.538 414 HD13 ILE 55 2HD1 ILE 55 8.225 -27.925 7.789 415 H ARG 56 H ARG 56 1.808 -28.601 9.013 416 HA ARG 56 HA ARG 56 1.732 -29.545 11.700 417 HB2 ARG 56 2HB ARG 56 0.405 -26.990 11.034 418 HB3 ARG 56 3HB ARG 56 -0.579 -28.145 11.924 419 HG2 ARG 56 2HG ARG 56 0.408 -27.534 13.803 420 HG3 ARG 56 3HG ARG 56 1.966 -28.056 13.159 421 HD2 ARG 56 2HD ARG 56 2.101 -25.815 12.007 422 HD3 ARG 56 3HD ARG 56 0.697 -25.334 12.958 423 HE ARG 56 HE ARG 56 3.394 -25.501 13.857 424 HH11 ARG 56 1HH1 ARG 56 0.086 -25.897 14.867 425 HH12 ARG 56 2HH1 ARG 56 0.416 -25.555 16.533 426 HH21 ARG 56 1HH2 ARG 56 3.842 -25.048 16.047 427 HH22 ARG 56 2HH2 ARG 56 2.553 -25.071 17.203 428 H MET 57 H MET 57 1.370 -30.418 8.895 429 HA MET 57 HA MET 57 -1.162 -31.832 9.297 430 HB2 MET 57 2HB MET 57 -1.954 -31.421 7.100 431 HB3 MET 57 3HB MET 57 -1.481 -29.855 7.746 432 HG2 MET 57 2HG MET 57 0.719 -30.167 6.553 433 HG3 MET 57 3HG MET 57 -0.019 -31.546 5.744 434 HE1 MET 57 3HE MET 57 -0.248 -27.207 5.016 435 HE2 MET 57 1HE MET 57 0.914 -28.253 5.834 436 HE3 MET 57 2HE MET 57 0.850 -28.215 4.071 437 HA PRO 58 HA PRO 58 1.367 -35.292 8.241 438 HB2 PRO 58 2HB PRO 58 -0.617 -37.094 7.813 439 HB3 PRO 58 3HB PRO 58 -0.142 -36.553 9.428 440 HG2 PRO 58 2HG PRO 58 -2.433 -35.651 7.725 441 HG3 PRO 58 3HG PRO 58 -2.401 -36.002 9.463 442 HD2 PRO 58 2HD PRO 58 -2.301 -33.480 8.484 443 HD3 PRO 58 3HD PRO 58 -1.484 -33.953 9.987 444 H GLY 59 H GLY 59 -0.788 -33.730 6.121 445 HA2 GLY 59 2HA GLY 59 -0.828 -35.394 3.888 446 HA3 GLY 59 3HA GLY 59 -0.914 -33.640 3.832 447 H MET 60 H MET 60 0.891 -32.456 3.302 448 HA MET 60 HA MET 60 3.062 -33.995 2.107 449 HB2 MET 60 2HB MET 60 1.780 -32.050 0.969 450 HB3 MET 60 3HB MET 60 2.785 -31.007 1.966 451 HG2 MET 60 2HG MET 60 4.447 -31.180 0.525 452 HG3 MET 60 3HG MET 60 4.450 -32.934 0.700 453 HE1 MET 60 3HE MET 60 2.230 -30.230 -0.429 454 HE2 MET 60 1HE MET 60 2.392 -30.231 -2.185 455 HE3 MET 60 2HE MET 60 1.111 -31.169 -1.418 456 H ASP 61 H ASP 61 2.647 -33.385 5.075 457 HA ASP 61 HA ASP 61 4.045 -33.152 6.863 458 HB2 ASP 61 2HB ASP 61 5.797 -33.741 4.725 459 HB3 ASP 61 3HB ASP 61 6.517 -32.398 5.607 460 H GLY 62 H GLY 62 5.454 -30.892 4.487 461 HA2 GLY 62 2HA GLY 62 4.328 -28.538 5.040 462 HA3 GLY 62 3HA GLY 62 5.327 -28.764 6.468 463 H LEU 63 H LEU 63 7.639 -29.741 5.597 464 HA LEU 63 HA LEU 63 8.757 -27.503 4.151 465 HB2 LEU 63 2HB LEU 63 10.900 -28.949 4.527 466 HB3 LEU 63 3HB LEU 63 10.159 -28.071 5.863 467 HG LEU 63 HG LEU 63 9.194 -30.083 6.735 468 HD11 LEU 63 1HD1 LEU 63 9.877 -32.277 5.541 469 HD12 LEU 63 2HD1 LEU 63 10.065 -31.247 4.122 470 HD13 LEU 63 3HD1 LEU 63 8.502 -31.355 4.932 471 HD21 LEU 63 3HD2 LEU 63 12.095 -30.141 6.036 472 HD22 LEU 63 1HD2 LEU 63 11.372 -31.517 6.869 473 HD23 LEU 63 2HD2 LEU 63 11.318 -29.914 7.604 474 H ALA 64 H ALA 64 7.587 -30.591 3.387 475 HA ALA 64 HA ALA 64 9.177 -31.585 1.406 476 HB1 ALA 64 1HB ALA 64 6.170 -31.453 1.514 477 HB2 ALA 64 2HB ALA 64 7.066 -32.405 0.329 478 HB3 ALA 64 3HB ALA 64 7.215 -32.770 2.048 479 H LEU 65 H LEU 65 6.666 -29.093 0.987 480 HA LEU 65 HA LEU 65 7.395 -28.641 -1.759 481 HB2 LEU 65 2HB LEU 65 5.503 -27.430 -1.901 482 HB3 LEU 65 3HB LEU 65 5.116 -28.275 -0.404 483 HG LEU 65 HG LEU 65 6.303 -25.505 -0.544 484 HD11 LEU 65 1HD1 LEU 65 3.557 -25.849 0.419 485 HD12 LEU 65 2HD1 LEU 65 3.777 -26.155 -1.304 486 HD13 LEU 65 3HD1 LEU 65 4.254 -24.603 -0.617 487 HD21 LEU 65 3HD2 LEU 65 6.380 -27.260 1.527 488 HD22 LEU 65 1HD2 LEU 65 4.863 -26.417 1.844 489 HD23 LEU 65 2HD2 LEU 65 6.365 -25.504 1.700 490 H LEU 66 H LEU 66 8.308 -27.376 1.319 491 HA LEU 66 HA LEU 66 9.276 -24.851 0.454 492 HB2 LEU 66 2HB LEU 66 8.849 -26.000 2.866 493 HB3 LEU 66 3HB LEU 66 10.603 -26.127 2.752 494 HG LEU 66 HG LEU 66 10.270 -24.138 3.905 495 HD11 LEU 66 1HD1 LEU 66 11.771 -23.894 1.951 496 HD12 LEU 66 2HD1 LEU 66 11.002 -22.383 2.435 497 HD13 LEU 66 3HD1 LEU 66 10.409 -23.261 1.025 498 HD21 LEU 66 3HD2 LEU 66 8.190 -23.238 1.926 499 HD22 LEU 66 1HD2 LEU 66 8.582 -22.536 3.496 500 HD23 LEU 66 2HD2 LEU 66 7.791 -24.110 3.407 501 H LYS 67 H LYS 67 10.563 -28.068 0.396 502 HA LYS 67 HA LYS 67 13.308 -27.422 0.168 503 HB2 LYS 67 2HB LYS 67 11.732 -29.837 -0.728 504 HB3 LYS 67 3HB LYS 67 13.484 -29.727 -0.842 505 HG2 LYS 67 2HG LYS 67 11.912 -29.506 1.717 506 HG3 LYS 67 3HG LYS 67 12.711 -30.971 1.140 507 HD2 LYS 67 2HD LYS 67 14.083 -28.353 1.750 508 HD3 LYS 67 3HD LYS 67 14.066 -29.769 2.804 509 HE2 LYS 67 2HE LYS 67 15.956 -30.360 1.769 510 HE3 LYS 67 3HE LYS 67 14.925 -30.803 0.410 511 HZ1 LYS 67 3HZ LYS 67 16.937 -28.947 0.390 512 HZ2 LYS 67 1HZ LYS 67 15.524 -28.016 0.417 513 HZ3 LYS 67 2HZ LYS 67 15.759 -29.161 -0.805 514 H GLN 68 H GLN 68 10.677 -27.546 -2.122 515 HA GLN 68 HA GLN 68 12.446 -27.320 -4.410 516 HB2 GLN 68 2HB GLN 68 10.616 -27.753 -5.723 517 HB3 GLN 68 3HB GLN 68 10.099 -28.518 -4.226 518 HG2 GLN 68 2HG GLN 68 9.115 -26.088 -3.790 519 HG3 GLN 68 3HG GLN 68 9.105 -26.068 -5.552 520 HE21 GLN 68 1HE2 GLN 68 6.968 -26.221 -3.426 521 HE22 GLN 68 2HE2 GLN 68 5.982 -27.553 -3.912 522 H ILE 69 H ILE 69 10.667 -25.262 -2.292 523 HA ILE 69 HA ILE 69 10.341 -23.017 -3.962 524 HB ILE 69 HB ILE 69 10.559 -23.270 -0.968 525 HG12 ILE 69 2HG1 ILE 69 8.196 -22.491 -2.678 526 HG13 ILE 69 3HG1 ILE 69 8.547 -24.159 -2.240 527 HG21 ILE 69 1HG2 ILE 69 10.486 -20.847 -2.671 528 HG22 ILE 69 2HG2 ILE 69 9.474 -20.853 -1.227 529 HG23 ILE 69 3HG2 ILE 69 11.214 -21.098 -1.084 530 HD11 ILE 69 3HD1 ILE 69 7.561 -23.901 -0.280 531 HD12 ILE 69 1HD1 ILE 69 8.566 -22.502 0.098 532 HD13 ILE 69 2HD1 ILE 69 7.061 -22.291 -0.797 533 H LYS 70 H LYS 70 13.070 -24.246 -2.185 534 HA LYS 70 HA LYS 70 14.603 -21.810 -2.413 535 HB2 LYS 70 2HB LYS 70 15.378 -24.598 -1.539 536 HB3 LYS 70 3HB LYS 70 16.454 -23.208 -1.491 537 HG2 LYS 70 2HG LYS 70 13.829 -23.322 -0.028 538 HG3 LYS 70 3HG LYS 70 15.372 -23.802 0.685 539 HD2 LYS 70 2HD LYS 70 16.116 -21.662 0.845 540 HD3 LYS 70 3HD LYS 70 15.274 -21.145 -0.618 541 HE2 LYS 70 2HE LYS 70 13.127 -21.379 0.720 542 HE3 LYS 70 3HE LYS 70 14.151 -21.521 2.148 543 HZ1 LYS 70 3HZ LYS 70 15.179 -19.337 1.201 544 HZ2 LYS 70 1HZ LYS 70 13.751 -19.286 2.107 545 HZ3 LYS 70 2HZ LYS 70 13.685 -19.197 0.419 546 H GLN 71 H GLN 71 14.128 -24.716 -4.238 547 HA GLN 71 HA GLN 71 16.490 -24.272 -5.876 548 HB2 GLN 71 2HB GLN 71 15.481 -26.564 -5.140 549 HB3 GLN 71 3HB GLN 71 14.377 -26.309 -6.485 550 HG2 GLN 71 2HG GLN 71 16.059 -27.575 -7.427 551 HG3 GLN 71 3HG GLN 71 16.508 -25.931 -7.877 552 HE21 GLN 71 1HE2 GLN 71 17.026 -28.278 -5.269 553 HE22 GLN 71 2HE2 GLN 71 18.696 -27.906 -5.034 554 H ARG 72 H ARG 72 13.112 -23.585 -5.902 555 HA ARG 72 HA ARG 72 13.169 -22.913 -8.754 556 HB2 ARG 72 2HB ARG 72 11.266 -24.226 -7.444 557 HB3 ARG 72 3HB ARG 72 10.709 -22.594 -7.101 558 HG2 ARG 72 2HG ARG 72 11.278 -23.577 -9.883 559 HG3 ARG 72 3HG ARG 72 9.695 -23.708 -9.113 560 HD2 ARG 72 2HD ARG 72 9.244 -21.631 -9.754 561 HD3 ARG 72 3HD ARG 72 10.566 -21.055 -8.740 562 HE ARG 72 HE ARG 72 11.796 -20.696 -10.630 563 HH11 ARG 72 1HH1 ARG 72 9.179 -22.864 -11.387 564 HH12 ARG 72 2HH1 ARG 72 9.499 -22.864 -13.090 565 HH21 ARG 72 1HH2 ARG 72 12.227 -20.688 -12.870 566 HH22 ARG 72 2HH2 ARG 72 11.234 -21.627 -13.932 567 H HIS 73 H HIS 73 12.462 -21.480 -5.589 568 HA HIS 73 HA HIS 73 12.859 -18.824 -6.803 569 HB2 HIS 73 2HB HIS 73 11.074 -19.349 -4.428 570 HB3 HIS 73 3HB HIS 73 11.183 -17.883 -5.399 571 HD1 HIS 73 HD1 HIS 73 9.986 -17.899 -7.707 572 HD2 HIS 73 HD2 HIS 73 9.434 -21.350 -5.460 573 HE1 HIS 73 HE1 HIS 73 8.094 -19.128 -8.816 574 HA PRO 74 HA PRO 74 16.054 -19.489 -3.526 575 HB2 PRO 74 2HB PRO 74 18.065 -18.344 -4.945 576 HB3 PRO 74 3HB PRO 74 17.623 -20.048 -5.109 577 HG2 PRO 74 2HG PRO 74 16.888 -17.724 -6.847 578 HG3 PRO 74 3HG PRO 74 17.398 -19.356 -7.318 579 HD2 PRO 74 2HD PRO 74 14.803 -18.582 -7.322 580 HD3 PRO 74 3HD PRO 74 15.302 -20.248 -6.966 581 H MET 75 H MET 75 15.476 -16.663 -5.599 582 HA MET 75 HA MET 75 16.515 -14.814 -3.663 583 HB2 MET 75 2HB MET 75 15.615 -13.085 -5.217 584 HB3 MET 75 3HB MET 75 16.695 -14.236 -5.991 585 HG2 MET 75 2HG MET 75 15.133 -14.850 -7.432 586 HG3 MET 75 3HG MET 75 13.968 -15.137 -6.142 587 HE1 MET 75 3HE MET 75 12.674 -13.521 -5.016 588 HE2 MET 75 1HE MET 75 13.352 -11.893 -4.973 589 HE3 MET 75 2HE MET 75 11.847 -12.198 -5.840 590 H LEU 76 H LEU 76 13.733 -16.575 -3.772 591 HA LEU 76 HA LEU 76 12.022 -14.497 -2.636 592 HB2 LEU 76 2HB LEU 76 11.019 -15.921 -4.305 593 HB3 LEU 76 3HB LEU 76 11.476 -17.361 -3.399 594 HG LEU 76 HG LEU 76 9.947 -16.495 -1.556 595 HD11 LEU 76 1HD1 LEU 76 8.069 -15.061 -2.587 596 HD12 LEU 76 2HD1 LEU 76 9.286 -14.599 -3.777 597 HD13 LEU 76 3HD1 LEU 76 9.554 -14.265 -2.066 598 HD21 LEU 76 3HD2 LEU 76 9.343 -18.385 -2.928 599 HD22 LEU 76 1HD2 LEU 76 8.807 -17.316 -4.224 600 HD23 LEU 76 2HD2 LEU 76 7.929 -17.356 -2.695 601 HA PRO 77 HA PRO 77 13.339 -15.863 1.415 602 HB2 PRO 77 2HB PRO 77 11.908 -14.003 2.781 603 HB3 PRO 77 3HB PRO 77 13.439 -13.637 1.976 604 HG2 PRO 77 2HG PRO 77 10.639 -13.141 1.039 605 HG3 PRO 77 3HG PRO 77 12.055 -12.078 0.946 606 HD2 PRO 77 2HD PRO 77 11.178 -13.527 -1.168 607 HD3 PRO 77 3HD PRO 77 12.895 -13.152 -0.913 608 H VAL 78 H VAL 78 12.462 -17.217 2.904 609 HA VAL 78 HA VAL 78 9.543 -17.491 3.019 610 HB VAL 78 HB VAL 78 11.321 -19.918 2.938 611 HG11 VAL 78 1HG1 VAL 78 8.990 -20.809 2.103 612 HG12 VAL 78 2HG1 VAL 78 9.322 -20.603 3.824 613 HG13 VAL 78 3HG1 VAL 78 8.392 -19.383 2.952 614 HG21 VAL 78 3HG2 VAL 78 10.098 -20.006 0.545 615 HG22 VAL 78 1HG2 VAL 78 10.319 -18.264 0.709 616 HG23 VAL 78 2HG2 VAL 78 11.714 -19.341 0.786 617 H ILE 79 H ILE 79 8.800 -18.692 4.923 618 HA ILE 79 HA ILE 79 10.741 -18.778 7.122 619 HB ILE 79 HB ILE 79 7.997 -17.595 7.493 620 HG12 ILE 79 2HG1 ILE 79 10.597 -16.086 7.159 621 HG13 ILE 79 3HG1 ILE 79 9.354 -16.213 5.920 622 HG21 ILE 79 1HG2 ILE 79 10.473 -17.403 9.199 623 HG22 ILE 79 2HG2 ILE 79 8.852 -16.841 9.605 624 HG23 ILE 79 3HG2 ILE 79 9.174 -18.568 9.454 625 HD11 ILE 79 3HD1 ILE 79 8.032 -15.312 8.204 626 HD12 ILE 79 1HD1 ILE 79 9.545 -14.408 8.140 627 HD13 ILE 79 2HD1 ILE 79 8.444 -14.384 6.762 628 H ILE 80 H ILE 80 10.609 -20.597 8.261 629 HA ILE 80 HA ILE 80 8.431 -22.443 7.726 630 HB ILE 80 HB ILE 80 11.061 -22.711 9.155 631 HG12 ILE 80 2HG1 ILE 80 10.756 -22.870 6.601 632 HG13 ILE 80 3HG1 ILE 80 11.645 -24.161 7.402 633 HG21 ILE 80 1HG2 ILE 80 9.786 -24.024 10.565 634 HG22 ILE 80 2HG2 ILE 80 8.674 -24.502 9.284 635 HG23 ILE 80 3HG2 ILE 80 10.297 -25.189 9.344 636 HD11 ILE 80 3HD1 ILE 80 8.734 -24.305 6.661 637 HD12 ILE 80 1HD1 ILE 80 10.055 -24.956 5.690 638 HD13 ILE 80 2HD1 ILE 80 9.737 -25.608 7.299 639 H MET 81 H MET 81 6.923 -23.124 9.174 640 HA MET 81 HA MET 81 6.985 -21.891 11.850 641 HB2 MET 81 2HB MET 81 4.766 -22.086 9.855 642 HB3 MET 81 3HB MET 81 4.376 -22.108 11.570 643 HG2 MET 81 2HG MET 81 4.848 -19.931 11.843 644 HG3 MET 81 3HG MET 81 6.211 -19.977 10.728 645 HE1 MET 81 3HE MET 81 2.267 -20.384 10.725 646 HE2 MET 81 1HE MET 81 1.943 -20.095 9.015 647 HE3 MET 81 2HE MET 81 2.893 -21.497 9.508 648 H THR 82 H THR 82 7.011 -23.312 13.453 649 HA THR 82 HA THR 82 5.345 -25.534 13.703 650 HB THR 82 HB THR 82 6.446 -26.745 12.036 651 HG1 THR 82 HG1 THR 82 6.871 -28.395 13.287 652 HG21 THR 82 3HG2 THR 82 8.389 -25.010 12.034 653 HG22 THR 82 1HG2 THR 82 8.697 -26.656 11.484 654 HG23 THR 82 2HG2 THR 82 9.180 -26.164 13.107 655 H ALA 83 H ALA 83 8.779 -24.802 14.356 656 HA ALA 83 HA ALA 83 9.859 -24.378 16.331 657 HB1 ALA 83 1HB ALA 83 8.706 -23.705 18.220 658 HB2 ALA 83 2HB ALA 83 7.567 -23.321 16.928 659 HB3 ALA 83 3HB ALA 83 7.343 -24.778 17.897 660 H HIS 84 H HIS 84 7.266 -26.683 17.177 661 HA HIS 84 HA HIS 84 9.215 -28.425 18.437 662 HB2 HIS 84 2HB HIS 84 7.364 -29.626 19.323 663 HB3 HIS 84 3HB HIS 84 6.928 -27.922 19.411 664 HD1 HIS 84 HD1 HIS 84 5.122 -30.692 19.046 665 HD2 HIS 84 HD2 HIS 84 5.728 -27.562 16.382 666 HE1 HIS 84 HE1 HIS 84 3.158 -30.755 17.476 667 H SER 85 H SER 85 9.757 -30.476 17.774 668 HA SER 85 HA SER 85 10.382 -31.996 16.178 669 HB2 SER 85 2HB SER 85 7.937 -32.564 16.939 670 HB3 SER 85 3HB SER 85 7.516 -32.075 15.298 671 HG SER 85 HG SER 85 9.423 -34.061 15.993 672 H ASP 86 H ASP 86 11.481 -30.242 14.985 673 HA ASP 86 HA ASP 86 11.231 -30.429 12.275 674 HB2 ASP 86 2HB ASP 86 9.212 -28.657 13.383 675 HB3 ASP 86 3HB ASP 86 10.247 -27.821 12.228 676 H LEU 87 H LEU 87 11.533 -27.673 14.524 677 HA LEU 87 HA LEU 87 13.481 -26.228 13.294 678 HB2 LEU 87 2HB LEU 87 12.697 -26.671 16.097 679 HB3 LEU 87 3HB LEU 87 14.310 -26.003 15.858 680 HG LEU 87 HG LEU 87 13.450 -24.056 14.817 681 HD11 LEU 87 1HD1 LEU 87 10.964 -25.676 14.551 682 HD12 LEU 87 2HD1 LEU 87 11.785 -24.663 13.363 683 HD13 LEU 87 3HD1 LEU 87 10.839 -23.919 14.652 684 HD21 LEU 87 3HD2 LEU 87 13.277 -24.099 17.259 685 HD22 LEU 87 1HD2 LEU 87 11.647 -24.759 17.132 686 HD23 LEU 87 2HD2 LEU 87 11.989 -23.135 16.535 687 H ASP 88 H ASP 88 13.972 -29.063 15.364 688 HA ASP 88 HA ASP 88 16.681 -29.147 15.613 689 HB2 ASP 88 2HB ASP 88 14.578 -31.228 15.372 690 HB3 ASP 88 3HB ASP 88 16.244 -31.763 15.166 691 H ALA 89 H ALA 89 14.812 -30.243 12.802 692 HA ALA 89 HA ALA 89 17.247 -30.793 11.314 693 HB1 ALA 89 1HB ALA 89 14.532 -31.661 11.180 694 HB2 ALA 89 2HB ALA 89 14.997 -30.976 9.623 695 HB3 ALA 89 3HB ALA 89 15.942 -32.289 10.326 696 H ALA 90 H ALA 90 14.450 -28.611 11.082 697 HA ALA 90 HA ALA 90 15.047 -27.248 8.779 698 HB1 ALA 90 1HB ALA 90 13.003 -26.832 9.965 699 HB2 ALA 90 2HB ALA 90 13.884 -26.161 11.338 700 HB3 ALA 90 3HB ALA 90 13.874 -25.308 9.795 701 H VAL 91 H VAL 91 16.540 -26.920 11.936 702 HA VAL 91 HA VAL 91 17.861 -24.520 11.726 703 HB VAL 91 HB VAL 91 18.713 -27.108 12.999 704 HG11 VAL 91 1HG1 VAL 91 20.805 -26.184 12.601 705 HG12 VAL 91 2HG1 VAL 91 20.221 -24.529 12.792 706 HG13 VAL 91 3HG1 VAL 91 20.405 -25.570 14.205 707 HG21 VAL 91 3HG2 VAL 91 16.845 -25.310 13.759 708 HG22 VAL 91 1HG2 VAL 91 17.757 -26.318 14.882 709 HG23 VAL 91 2HG2 VAL 91 18.268 -24.659 14.572 710 H SER 92 H SER 92 19.156 -27.691 10.725 711 HA SER 92 HA SER 92 21.313 -26.394 9.281 712 HB2 SER 92 2HB SER 92 21.733 -28.464 10.577 713 HB3 SER 92 3HB SER 92 20.634 -29.337 9.510 714 HG SER 92 HG SER 92 23.063 -29.288 9.088 715 H ALA 93 H ALA 93 18.493 -28.417 8.552 716 HA ALA 93 HA ALA 93 18.855 -28.618 5.788 717 HB1 ALA 93 1HB ALA 93 16.259 -28.830 5.838 718 HB2 ALA 93 2HB ALA 93 17.258 -30.064 6.607 719 HB3 ALA 93 3HB ALA 93 16.481 -28.820 7.587 720 H TYR 94 H TYR 94 16.568 -26.451 7.470 721 HA TYR 94 HA TYR 94 15.898 -24.898 5.268 722 HB2 TYR 94 2HB TYR 94 14.950 -24.966 7.723 723 HB3 TYR 94 3HB TYR 94 16.073 -23.634 7.975 724 HD1 TYR 94 HD2 TYR 94 13.972 -24.463 5.008 725 HD2 TYR 94 HD1 TYR 94 14.754 -21.730 8.174 726 HE1 TYR 94 HE2 TYR 94 12.326 -22.902 4.059 727 HE2 TYR 94 HE1 TYR 94 13.108 -20.162 7.234 728 HH TYR 94 HH TYR 94 10.811 -20.909 5.198 729 H GLN 95 H GLN 95 18.789 -24.944 7.113 730 HA GLN 95 HA GLN 95 19.668 -22.292 6.578 731 HB2 GLN 95 2HB GLN 95 20.738 -24.692 7.843 732 HB3 GLN 95 3HB GLN 95 21.960 -23.805 6.942 733 HG2 GLN 95 2HG GLN 95 20.154 -22.422 8.888 734 HG3 GLN 95 3HG GLN 95 21.621 -23.245 9.415 735 HE21 GLN 95 1HE2 GLN 95 23.200 -21.866 9.731 736 HE22 GLN 95 2HE2 GLN 95 23.558 -20.479 8.765 737 H GLN 96 H GLN 96 19.029 -24.664 4.465 738 HA GLN 96 HA GLN 96 21.354 -24.583 2.797 739 HB2 GLN 96 2HB GLN 96 18.560 -25.635 2.447 740 HB3 GLN 96 3HB GLN 96 19.693 -25.604 1.103 741 HG2 GLN 96 2HG GLN 96 20.585 -26.837 3.649 742 HG3 GLN 96 3HG GLN 96 19.422 -27.716 2.657 743 HE21 GLN 96 1HE2 GLN 96 22.516 -27.666 3.336 744 HE22 GLN 96 2HE2 GLN 96 23.213 -28.077 1.809 745 H GLY 97 H GLY 97 20.114 -22.004 3.536 746 HA2 GLY 97 2HA GLY 97 20.425 -20.060 2.126 747 HA3 GLY 97 3HA GLY 97 19.750 -20.984 0.792 748 H ALA 98 H ALA 98 18.406 -20.927 4.034 749 HA ALA 98 HA ALA 98 16.060 -19.506 2.953 750 HB1 ALA 98 1HB ALA 98 15.955 -22.010 3.759 751 HB2 ALA 98 2HB ALA 98 15.820 -21.256 5.348 752 HB3 ALA 98 3HB ALA 98 14.637 -20.887 4.094 753 H PHE 99 H PHE 99 14.942 -18.064 4.353 754 HA PHE 99 HA PHE 99 16.703 -16.571 6.061 755 HB2 PHE 99 2HB PHE 99 15.237 -15.238 4.788 756 HB3 PHE 99 3HB PHE 99 13.843 -16.235 5.189 757 HD1 PHE 99 HD1 PHE 99 16.173 -13.686 6.455 758 HD2 PHE 99 HD2 PHE 99 12.584 -15.859 7.168 759 HE1 PHE 99 HE1 PHE 99 15.611 -12.147 8.291 760 HE2 PHE 99 HE2 PHE 99 12.015 -14.323 9.004 761 HZ PHE 99 HZ PHE 99 13.528 -12.464 9.567 762 H ASP 100 H ASP 100 16.387 -16.111 8.274 763 HA ASP 100 HA ASP 100 16.022 -18.181 9.986 764 HB2 ASP 100 2HB ASP 100 16.856 -15.860 10.546 765 HB3 ASP 100 3HB ASP 100 15.170 -15.366 10.674 766 H TYR 101 H TYR 101 14.371 -19.545 10.135 767 HA TYR 101 HA TYR 101 11.723 -18.951 9.369 768 HB2 TYR 101 2HB TYR 101 11.205 -21.131 10.588 769 HB3 TYR 101 3HB TYR 101 12.372 -21.223 9.274 770 HD1 TYR 101 HD1 TYR 101 12.560 -20.362 12.913 771 HD2 TYR 101 HD2 TYR 101 14.059 -22.724 9.708 772 HE1 TYR 101 HE1 TYR 101 14.189 -21.392 14.442 773 HE2 TYR 101 HE2 TYR 101 15.691 -23.762 11.227 774 HH TYR 101 HH TYR 101 15.560 -23.313 14.650 775 H LEU 102 H LEU 102 9.929 -19.687 11.115 776 HA LEU 102 HA LEU 102 10.398 -18.254 13.627 777 HB2 LEU 102 2HB LEU 102 9.377 -16.545 12.433 778 HB3 LEU 102 3HB LEU 102 8.312 -17.653 11.571 779 HG LEU 102 HG LEU 102 7.123 -18.018 13.776 780 HD11 LEU 102 1HD1 LEU 102 8.193 -17.226 15.568 781 HD12 LEU 102 2HD1 LEU 102 7.576 -15.649 15.076 782 HD13 LEU 102 3HD1 LEU 102 9.200 -16.146 14.603 783 HD21 LEU 102 3HD2 LEU 102 5.803 -16.751 12.454 784 HD22 LEU 102 1HD2 LEU 102 7.092 -15.609 12.074 785 HD23 LEU 102 2HD2 LEU 102 6.231 -15.487 13.608 786 HA PRO 103 HA PRO 103 8.439 -22.050 14.952 787 HB2 PRO 103 2HB PRO 103 8.770 -21.588 17.607 788 HB3 PRO 103 3HB PRO 103 10.075 -22.163 16.562 789 HG2 PRO 103 2HG PRO 103 9.503 -19.387 17.524 790 HG3 PRO 103 3HG PRO 103 11.057 -20.234 17.412 791 HD2 PRO 103 2HD PRO 103 10.247 -18.424 15.568 792 HD3 PRO 103 3HD PRO 103 11.261 -19.821 15.153 793 H LYS 104 H LYS 104 6.405 -22.558 15.610 794 HA LYS 104 HA LYS 104 4.667 -20.312 16.378 795 HB2 LYS 104 2HB LYS 104 4.397 -22.256 14.374 796 HB3 LYS 104 3HB LYS 104 3.249 -22.718 15.624 797 HG2 LYS 104 2HG LYS 104 1.935 -20.907 15.284 798 HG3 LYS 104 3HG LYS 104 3.291 -19.867 14.842 799 HD2 LYS 104 2HD LYS 104 3.082 -20.332 12.655 800 HD3 LYS 104 3HD LYS 104 2.798 -22.049 12.953 801 HE2 LYS 104 2HE LYS 104 0.840 -21.083 11.935 802 HE3 LYS 104 3HE LYS 104 0.475 -21.510 13.606 803 HZ1 LYS 104 3HZ LYS 104 0.762 -19.205 14.233 804 HZ2 LYS 104 1HZ LYS 104 -0.401 -19.330 13.011 805 HZ3 LYS 104 2HZ LYS 104 1.158 -18.784 12.643 806 HA PRO 105 HA PRO 105 2.564 -20.080 17.098 807 HB2 PRO 105 2HB PRO 105 1.999 -18.706 19.371 808 HB3 PRO 105 3HB PRO 105 1.057 -20.101 18.832 809 HG2 PRO 105 2HG PRO 105 3.224 -19.961 20.892 810 HG3 PRO 105 3HG PRO 105 1.677 -20.826 20.953 811 HD2 PRO 105 2HD PRO 105 4.016 -22.063 20.378 812 HD3 PRO 105 3HD PRO 105 2.466 -22.583 19.686 813 H PHE 106 H PHE 106 2.739 -17.591 17.478 814 HA PHE 106 HA PHE 106 5.334 -16.704 18.406 815 HB2 PHE 106 2HB PHE 106 5.941 -15.670 16.236 816 HB3 PHE 106 3HB PHE 106 5.898 -17.428 16.157 817 HD1 PHE 106 HD1 PHE 106 3.814 -14.426 15.468 818 HD2 PHE 106 HD2 PHE 106 4.683 -18.476 14.491 819 HE1 PHE 106 HE1 PHE 106 2.264 -14.295 13.562 820 HE2 PHE 106 HE2 PHE 106 3.135 -18.352 12.583 821 HZ PHE 106 HZ PHE 106 1.923 -16.259 12.116 822 H ASP 107 H ASP 107 5.566 -14.304 18.156 823 HA ASP 107 HA ASP 107 3.051 -13.053 18.872 824 HB2 ASP 107 2HB ASP 107 5.911 -12.087 18.888 825 HB3 ASP 107 3HB ASP 107 4.549 -11.046 19.294 826 H ILE 108 H ILE 108 1.772 -12.249 17.353 827 HA ILE 108 HA ILE 108 2.292 -11.909 14.691 828 HB ILE 108 HB ILE 108 0.341 -10.545 16.511 829 HG12 ILE 108 2HG1 ILE 108 -0.329 -12.129 14.064 830 HG13 ILE 108 3HG1 ILE 108 0.247 -12.979 15.494 831 HG21 ILE 108 1HG2 ILE 108 0.751 -8.803 14.980 832 HG22 ILE 108 2HG2 ILE 108 0.847 -9.916 13.617 833 HG23 ILE 108 3HG2 ILE 108 -0.705 -9.609 14.396 834 HD11 ILE 108 3HD1 ILE 108 -2.359 -12.171 14.926 835 HD12 ILE 108 1HD1 ILE 108 -1.748 -12.848 16.435 836 HD13 ILE 108 2HD1 ILE 108 -1.798 -11.099 16.209 837 H ASP 109 H ASP 109 2.706 -9.508 17.264 838 HA ASP 109 HA ASP 109 3.344 -7.281 15.766 839 HB2 ASP 109 2HB ASP 109 4.159 -8.232 18.483 840 HB3 ASP 109 3HB ASP 109 4.938 -6.803 17.810 841 H GLU 110 H GLU 110 5.414 -9.987 16.688 842 HA GLU 110 HA GLU 110 7.762 -8.813 15.499 843 HB2 GLU 110 2HB GLU 110 7.123 -11.211 17.069 844 HB3 GLU 110 3HB GLU 110 8.363 -11.465 15.849 845 HG2 GLU 110 2HG GLU 110 8.839 -9.021 17.290 846 HG3 GLU 110 3HG GLU 110 8.685 -10.385 18.395 847 H ALA 111 H ALA 111 5.241 -11.022 14.553 848 HA ALA 111 HA ALA 111 6.538 -12.161 12.307 849 HB1 ALA 111 1HB ALA 111 3.603 -11.838 12.917 850 HB2 ALA 111 2HB ALA 111 4.258 -12.817 11.604 851 HB3 ALA 111 3HB ALA 111 4.613 -13.237 13.280 852 H VAL 112 H VAL 112 4.052 -9.606 12.499 853 HA VAL 112 HA VAL 112 3.950 -8.908 9.833 854 HB VAL 112 HB VAL 112 3.592 -7.236 12.309 855 HG11 VAL 112 1HG1 VAL 112 4.190 -5.556 10.839 856 HG12 VAL 112 2HG1 VAL 112 3.520 -6.397 9.440 857 HG13 VAL 112 3HG1 VAL 112 2.443 -5.636 10.612 858 HG21 VAL 112 3HG2 VAL 112 1.272 -7.449 11.871 859 HG22 VAL 112 1HG2 VAL 112 1.566 -8.096 10.256 860 HG23 VAL 112 2HG2 VAL 112 1.963 -9.061 11.678 861 H ALA 113 H ALA 113 6.326 -8.015 12.256 862 HA ALA 113 HA ALA 113 7.649 -6.128 10.505 863 HB1 ALA 113 1HB ALA 113 7.746 -6.813 13.318 864 HB2 ALA 113 2HB ALA 113 9.358 -6.631 12.625 865 HB3 ALA 113 3HB ALA 113 8.193 -5.313 12.504 866 H LEU 114 H LEU 114 7.899 -9.478 11.353 867 HA LEU 114 HA LEU 114 10.588 -9.911 10.587 868 HB2 LEU 114 2HB LEU 114 9.357 -11.488 11.970 869 HB3 LEU 114 3HB LEU 114 8.245 -11.809 10.640 870 HG LEU 114 HG LEU 114 10.314 -12.645 9.370 871 HD11 LEU 114 1HD1 LEU 114 12.080 -13.544 10.870 872 HD12 LEU 114 2HD1 LEU 114 11.372 -12.615 12.191 873 HD13 LEU 114 3HD1 LEU 114 12.041 -11.782 10.787 874 HD21 LEU 114 3HD2 LEU 114 10.188 -14.859 10.581 875 HD22 LEU 114 1HD2 LEU 114 8.652 -14.192 10.028 876 HD23 LEU 114 2HD2 LEU 114 9.104 -14.070 11.728 877 H VAL 115 H VAL 115 7.519 -10.193 8.836 878 HA VAL 115 HA VAL 115 8.601 -11.180 6.426 879 HB VAL 115 HB VAL 115 6.229 -11.357 6.853 880 HG11 VAL 115 1HG1 VAL 115 6.108 -8.351 6.641 881 HG12 VAL 115 2HG1 VAL 115 4.752 -9.447 6.916 882 HG13 VAL 115 3HG1 VAL 115 6.003 -9.263 8.147 883 HG21 VAL 115 3HG2 VAL 115 5.862 -9.561 4.638 884 HG22 VAL 115 1HG2 VAL 115 7.368 -10.462 4.457 885 HG23 VAL 115 2HG2 VAL 115 5.843 -11.324 4.663 886 H GLU 116 H GLU 116 8.017 -7.903 7.607 887 HA GLU 116 HA GLU 116 8.518 -6.503 5.243 888 HB2 GLU 116 2HB GLU 116 8.100 -5.877 7.980 889 HB3 GLU 116 3HB GLU 116 9.550 -5.026 7.465 890 HG2 GLU 116 2HG GLU 116 6.844 -4.877 6.156 891 HG3 GLU 116 3HG GLU 116 7.581 -3.644 7.177 892 H ARG 117 H ARG 117 10.679 -8.058 7.469 893 HA ARG 117 HA ARG 117 13.049 -6.699 6.640 894 HB2 ARG 117 2HB ARG 117 13.142 -7.678 8.783 895 HB3 ARG 117 3HB ARG 117 12.524 -9.217 8.199 896 HG2 ARG 117 2HG ARG 117 14.553 -9.937 7.540 897 HG3 ARG 117 3HG ARG 117 15.074 -8.332 7.023 898 HD2 ARG 117 2HD ARG 117 14.779 -9.108 9.915 899 HD3 ARG 117 3HD ARG 117 16.282 -9.317 9.017 900 HE ARG 117 HE ARG 117 15.225 -6.873 10.058 901 HH11 ARG 117 1HH1 ARG 117 17.178 -8.252 7.527 902 HH12 ARG 117 2HH1 ARG 117 18.089 -6.803 7.262 903 HH21 ARG 117 1HH2 ARG 117 16.417 -4.959 9.718 904 HH22 ARG 117 2HH2 ARG 117 17.656 -4.930 8.509 905 H ALA 118 H ALA 118 11.241 -9.418 5.476 906 HA ALA 118 HA ALA 118 13.380 -10.469 3.851 907 HB1 ALA 118 1HB ALA 118 10.715 -11.290 4.619 908 HB2 ALA 118 2HB ALA 118 11.003 -11.532 2.895 909 HB3 ALA 118 3HB ALA 118 12.085 -12.263 4.081 910 H ILE 119 H ILE 119 10.600 -8.367 3.420 911 HA ILE 119 HA ILE 119 10.917 -8.252 0.548 912 HB ILE 119 HB ILE 119 9.140 -6.671 2.409 913 HG12 ILE 119 2HG1 ILE 119 8.276 -8.730 0.394 914 HG13 ILE 119 3HG1 ILE 119 8.791 -9.208 2.008 915 HG21 ILE 119 1HG2 ILE 119 9.588 -5.333 0.469 916 HG22 ILE 119 2HG2 ILE 119 9.283 -6.701 -0.600 917 HG23 ILE 119 3HG2 ILE 119 7.960 -5.995 0.327 918 HD11 ILE 119 3HD1 ILE 119 6.301 -8.893 1.600 919 HD12 ILE 119 1HD1 ILE 119 6.996 -8.118 3.024 920 HD13 ILE 119 2HD1 ILE 119 6.645 -7.163 1.582 921 H SER 120 H SER 120 11.292 -5.979 3.264 922 HA SER 120 HA SER 120 12.200 -3.785 1.817 923 HB2 SER 120 2HB SER 120 11.575 -3.936 4.306 924 HB3 SER 120 3HB SER 120 13.237 -4.466 4.565 925 HG SER 120 HG SER 120 12.583 -2.065 4.613 926 H HIS 121 H HIS 121 13.815 -6.722 2.661 927 HA HIS 121 HA HIS 121 16.485 -5.968 2.578 928 HB2 HIS 121 2HB HIS 121 15.569 -8.243 3.166 929 HB3 HIS 121 3HB HIS 121 15.384 -8.541 1.440 930 HD1 HIS 121 HD1 HIS 121 17.451 -9.208 0.143 931 HD2 HIS 121 HD2 HIS 121 18.283 -8.067 4.050 932 HE1 HIS 121 HE1 HIS 121 19.857 -9.829 0.526 933 H TYR 122 H TYR 122 14.171 -6.232 0.016 934 HA TYR 122 HA TYR 122 16.292 -5.886 -1.990 935 HB2 TYR 122 2HB TYR 122 13.394 -6.503 -2.555 936 HB3 TYR 122 3HB TYR 122 14.774 -6.695 -3.631 937 HD1 TYR 122 HD1 TYR 122 16.595 -8.397 -2.845 938 HD2 TYR 122 HD2 TYR 122 12.598 -8.342 -1.388 939 HE1 TYR 122 HE1 TYR 122 16.829 -10.740 -2.133 940 HE2 TYR 122 HE2 TYR 122 12.821 -10.684 -0.670 941 HH TYR 122 HH TYR 122 15.379 -12.195 -0.093 942 H GLN 123 H GLN 123 12.992 -4.713 -1.308 943 HA GLN 123 HA GLN 123 13.593 -2.252 -2.762 944 HB2 GLN 123 2HB GLN 123 10.986 -3.212 -1.570 945 HB3 GLN 123 3HB GLN 123 11.192 -1.791 -2.585 946 HG2 GLN 123 2HG GLN 123 11.761 -3.135 -4.473 947 HG3 GLN 123 3HG GLN 123 11.816 -4.592 -3.482 948 HE21 GLN 123 1HE2 GLN 123 9.991 -5.711 -3.131 949 HE22 GLN 123 2HE2 GLN 123 8.430 -5.253 -3.714 950 H GLU 124 H GLU 124 15.070 -2.373 -0.504 951 HA GLU 124 HA GLU 124 13.953 -1.399 1.854 952 HB2 GLU 124 2HB GLU 124 16.504 -2.016 0.959 953 HB3 GLU 124 3HB GLU 124 16.596 -0.295 1.308 954 HG2 GLU 124 2HG GLU 124 15.285 -1.263 3.502 955 HG3 GLU 124 3HG GLU 124 16.404 -2.570 3.119 Start of MODEL 3 1 H1 MET 1 H MET 1 -0.089 -0.627 -2.161 2 HA MET 1 HA MET 1 0.810 -0.847 -4.908 3 HB2 MET 1 2HB MET 1 1.841 0.877 -3.612 4 HB3 MET 1 3HB MET 1 2.237 -0.246 -2.318 5 HG2 MET 1 2HG MET 1 4.105 -0.950 -3.327 6 HG3 MET 1 3HG MET 1 3.360 -0.959 -4.924 7 HE1 MET 1 3HE MET 1 2.507 1.858 -5.734 8 HE2 MET 1 1HE MET 1 4.033 2.457 -6.386 9 HE3 MET 1 2HE MET 1 3.565 0.776 -6.640 10 H GLN 2 H GLN 2 0.776 -2.760 -1.998 11 HA GLN 2 HA GLN 2 1.468 -4.876 -1.520 12 HB2 GLN 2 2HB GLN 2 1.319 -5.327 -4.501 13 HB3 GLN 2 3HB GLN 2 1.151 -6.530 -3.229 14 HG2 GLN 2 2HG GLN 2 -1.035 -6.227 -3.730 15 HG3 GLN 2 3HG GLN 2 -0.854 -4.965 -2.513 16 HE21 GLN 2 1HE2 GLN 2 -2.601 -3.836 -3.414 17 HE22 GLN 2 2HE2 GLN 2 -2.435 -2.933 -4.877 18 H ARG 3 H ARG 3 3.554 -3.196 -1.502 19 HA ARG 3 HA ARG 3 5.681 -3.702 -3.233 20 HB2 ARG 3 2HB ARG 3 7.123 -2.924 -1.322 21 HB3 ARG 3 3HB ARG 3 5.814 -1.833 -1.758 22 HG2 ARG 3 2HG ARG 3 5.575 -1.800 0.494 23 HG3 ARG 3 3HG ARG 3 4.549 -3.189 0.131 24 HD2 ARG 3 2HD ARG 3 6.053 -3.658 1.998 25 HD3 ARG 3 3HD ARG 3 6.400 -4.698 0.617 26 HE ARG 3 HE ARG 3 8.459 -3.698 0.412 27 HH11 ARG 3 1HH1 ARG 3 6.473 -1.851 2.595 28 HH12 ARG 3 2HH1 ARG 3 7.772 -0.835 3.125 29 HH21 ARG 3 1HH2 ARG 3 10.178 -2.368 1.103 30 HH22 ARG 3 2HH2 ARG 3 9.879 -1.130 2.275 31 H GLY 4 H GLY 4 4.307 -5.671 -0.784 32 HA2 GLY 4 2HA GLY 4 6.152 -7.805 -1.409 33 HA3 GLY 4 3HA GLY 4 6.287 -7.208 0.239 34 H ILE 5 H ILE 5 4.469 -9.119 -1.964 35 HA ILE 5 HA ILE 5 2.181 -9.434 -0.238 36 HB ILE 5 HB ILE 5 3.018 -10.900 -2.739 37 HG12 ILE 5 2HG1 ILE 5 0.623 -9.117 -2.411 38 HG13 ILE 5 3HG1 ILE 5 2.209 -8.426 -2.736 39 HG21 ILE 5 1HG2 ILE 5 1.734 -12.511 -1.714 40 HG22 ILE 5 2HG2 ILE 5 0.731 -11.330 -0.874 41 HG23 ILE 5 3HG2 ILE 5 0.506 -11.608 -2.601 42 HD11 ILE 5 3HD1 ILE 5 0.341 -9.661 -4.535 43 HD12 ILE 5 1HD1 ILE 5 1.794 -8.726 -4.887 44 HD13 ILE 5 2HD1 ILE 5 1.910 -10.463 -4.607 45 H VAL 6 H VAL 6 1.709 -11.122 1.100 46 HA VAL 6 HA VAL 6 3.797 -13.175 1.443 47 HB VAL 6 HB VAL 6 2.117 -12.098 3.701 48 HG11 VAL 6 1HG1 VAL 6 4.058 -13.062 5.021 49 HG12 VAL 6 2HG1 VAL 6 2.990 -14.224 4.232 50 HG13 VAL 6 3HG1 VAL 6 4.559 -13.843 3.521 51 HG21 VAL 6 3HG2 VAL 6 4.484 -10.939 2.421 52 HG22 VAL 6 1HG2 VAL 6 3.293 -10.199 3.490 53 HG23 VAL 6 2HG2 VAL 6 4.626 -11.135 4.168 54 H TRP 7 H TRP 7 3.125 -15.226 1.386 55 HA TRP 7 HA TRP 7 0.223 -15.723 1.470 56 HB2 TRP 7 2HB TRP 7 2.424 -17.160 -0.021 57 HB3 TRP 7 3HB TRP 7 0.787 -17.793 0.133 58 HD1 TRP 7 HD1 TRP 7 0.176 -14.286 -0.192 59 HE1 TRP 7 HE1 TRP 7 -0.255 -13.586 -2.631 60 HE3 TRP 7 HE3 TRP 7 1.976 -18.445 -2.558 61 HZ2 TRP 7 HZ2 TRP 7 0.119 -14.657 -5.216 62 HZ3 TRP 7 HZ3 TRP 7 1.902 -18.528 -5.016 63 HH2 TRP 7 HH2 TRP 7 0.992 -16.672 -6.316 64 H VAL 8 H VAL 8 -0.389 -17.928 2.233 65 HA VAL 8 HA VAL 8 1.482 -19.105 4.146 66 HB VAL 8 HB VAL 8 -1.251 -18.062 4.886 67 HG11 VAL 8 1HG1 VAL 8 0.578 -19.866 6.467 68 HG12 VAL 8 2HG1 VAL 8 -0.884 -19.096 7.086 69 HG13 VAL 8 3HG1 VAL 8 -0.995 -20.297 5.799 70 HG21 VAL 8 3HG2 VAL 8 0.015 -16.286 5.423 71 HG22 VAL 8 1HG2 VAL 8 0.496 -17.259 6.813 72 HG23 VAL 8 2HG2 VAL 8 1.514 -17.214 5.373 73 H VAL 9 H VAL 9 1.177 -21.272 4.511 74 HA VAL 9 HA VAL 9 -1.121 -22.549 3.189 75 HB VAL 9 HB VAL 9 0.750 -22.832 1.686 76 HG11 VAL 9 1HG1 VAL 9 2.557 -24.478 3.012 77 HG12 VAL 9 2HG1 VAL 9 2.810 -22.799 2.530 78 HG13 VAL 9 3HG1 VAL 9 2.220 -23.174 4.150 79 HG21 VAL 9 3HG2 VAL 9 0.506 -25.461 3.110 80 HG22 VAL 9 1HG2 VAL 9 -0.860 -24.750 2.252 81 HG23 VAL 9 2HG2 VAL 9 0.621 -25.145 1.379 82 H ASP 10 H ASP 10 -1.931 -22.567 5.414 83 HA ASP 10 HA ASP 10 -0.734 -24.742 7.003 84 HB2 ASP 10 2HB ASP 10 -1.578 -23.676 9.006 85 HB3 ASP 10 3HB ASP 10 -0.624 -22.508 8.095 86 H ASP 11 H ASP 11 -2.419 -25.767 8.509 87 HA ASP 11 HA ASP 11 -4.916 -26.176 6.997 88 HB2 ASP 11 2HB ASP 11 -2.955 -28.060 7.516 89 HB3 ASP 11 3HB ASP 11 -4.158 -28.373 8.764 90 H ASP 12 H ASP 12 -4.308 -24.302 9.211 91 HA ASP 12 HA ASP 12 -6.347 -25.268 11.104 92 HB2 ASP 12 2HB ASP 12 -3.642 -24.604 11.667 93 HB3 ASP 12 3HB ASP 12 -4.653 -23.346 12.374 94 H SER 13 H SER 13 -7.622 -23.603 12.123 95 HA SER 13 HA SER 13 -8.349 -21.537 10.275 96 HB2 SER 13 2HB SER 13 -10.308 -21.902 11.303 97 HB3 SER 13 3HB SER 13 -9.516 -22.814 12.588 98 HG SER 13 HG SER 13 -9.230 -20.950 13.733 99 H SER 14 H SER 14 -7.218 -21.484 13.658 100 HA SER 14 HA SER 14 -6.867 -18.685 13.765 101 HB2 SER 14 2HB SER 14 -5.172 -20.442 15.475 102 HB3 SER 14 3HB SER 14 -6.115 -19.018 15.911 103 HG SER 14 HG SER 14 -7.420 -20.497 16.677 104 H ILE 15 H ILE 15 -4.592 -21.339 13.155 105 HA ILE 15 HA ILE 15 -2.211 -19.987 13.047 106 HB ILE 15 HB ILE 15 -3.145 -22.218 11.241 107 HG12 ILE 15 2HG1 ILE 15 -3.139 -22.785 13.622 108 HG13 ILE 15 3HG1 ILE 15 -1.852 -23.642 12.780 109 HG21 ILE 15 1HG2 ILE 15 -0.378 -21.108 11.676 110 HG22 ILE 15 2HG2 ILE 15 -0.725 -22.636 10.869 111 HG23 ILE 15 3HG2 ILE 15 -1.297 -21.121 10.171 112 HD11 ILE 15 3HD1 ILE 15 -1.009 -22.862 14.867 113 HD12 ILE 15 1HD1 ILE 15 -0.265 -21.909 13.583 114 HD13 ILE 15 2HD1 ILE 15 -1.576 -21.224 14.543 115 H ARG 16 H ARG 16 -4.551 -20.371 10.395 116 HA ARG 16 HA ARG 16 -3.039 -18.716 8.606 117 HB2 ARG 16 2HB ARG 16 -4.517 -19.367 7.010 118 HB3 ARG 16 3HB ARG 16 -4.893 -20.613 8.191 119 HG2 ARG 16 2HG ARG 16 -6.714 -19.103 9.044 120 HG3 ARG 16 3HG ARG 16 -6.414 -18.083 7.635 121 HD2 ARG 16 2HD ARG 16 -6.622 -20.620 6.567 122 HD3 ARG 16 3HD ARG 16 -7.837 -20.612 7.844 123 HE ARG 16 HE ARG 16 -8.180 -18.258 6.447 124 HH11 ARG 16 1HH1 ARG 16 -8.300 -21.669 5.758 125 HH12 ARG 16 2HH1 ARG 16 -9.476 -21.505 4.496 126 HH21 ARG 16 1HH2 ARG 16 -9.728 -18.030 4.788 127 HH22 ARG 16 2HH2 ARG 16 -10.287 -19.434 3.945 128 H TRP 17 H TRP 17 -5.729 -18.266 10.807 129 HA TRP 17 HA TRP 17 -6.676 -15.801 9.917 130 HB2 TRP 17 2HB TRP 17 -8.003 -16.849 11.533 131 HB3 TRP 17 3HB TRP 17 -6.635 -17.142 12.604 132 HD1 TRP 17 HD1 TRP 17 -8.902 -14.245 11.427 133 HE1 TRP 17 HE1 TRP 17 -8.916 -12.443 13.264 134 HE3 TRP 17 HE3 TRP 17 -5.430 -16.276 14.583 135 HZ2 TRP 17 HZ2 TRP 17 -7.626 -11.947 15.725 136 HZ3 TRP 17 HZ3 TRP 17 -4.876 -15.074 16.658 137 HH2 TRP 17 HH2 TRP 17 -5.952 -12.954 17.215 138 H VAL 18 H VAL 18 -4.511 -16.293 12.713 139 HA VAL 18 HA VAL 18 -3.791 -13.670 13.128 140 HB VAL 18 HB VAL 18 -3.065 -15.147 14.775 141 HG11 VAL 18 1HG1 VAL 18 -2.458 -16.867 12.519 142 HG12 VAL 18 2HG1 VAL 18 -1.190 -16.900 13.746 143 HG13 VAL 18 3HG1 VAL 18 -2.855 -17.287 14.184 144 HG21 VAL 18 3HG2 VAL 18 -0.936 -14.452 15.126 145 HG22 VAL 18 1HG2 VAL 18 -0.395 -14.942 13.521 146 HG23 VAL 18 2HG2 VAL 18 -1.291 -13.437 13.728 147 H LEU 19 H LEU 19 -2.467 -15.964 10.806 148 HA LEU 19 HA LEU 19 -0.323 -14.270 9.968 149 HB2 LEU 19 2HB LEU 19 -1.591 -16.700 8.723 150 HB3 LEU 19 3HB LEU 19 -0.189 -15.875 8.045 151 HG LEU 19 HG LEU 19 -0.183 -17.026 10.824 152 HD11 LEU 19 1HD1 LEU 19 0.685 -19.057 10.023 153 HD12 LEU 19 2HD1 LEU 19 0.882 -18.425 8.389 154 HD13 LEU 19 3HD1 LEU 19 -0.733 -18.732 9.026 155 HD21 LEU 19 3HD2 LEU 19 2.114 -16.556 8.944 156 HD22 LEU 19 1HD2 LEU 19 2.158 -16.832 10.685 157 HD23 LEU 19 2HD2 LEU 19 1.527 -15.313 10.049 158 H GLU 20 H GLU 20 -3.669 -14.511 9.209 159 HA GLU 20 HA GLU 20 -3.470 -13.201 6.647 160 HB2 GLU 20 2HB GLU 20 -5.368 -14.791 7.810 161 HB3 GLU 20 3HB GLU 20 -6.083 -13.196 7.996 162 HG2 GLU 20 2HG GLU 20 -4.996 -13.700 5.334 163 HG3 GLU 20 3HG GLU 20 -6.308 -14.783 5.795 164 H ARG 21 H ARG 21 -4.917 -12.304 9.784 165 HA ARG 21 HA ARG 21 -5.447 -9.637 9.145 166 HB2 ARG 21 2HB ARG 21 -5.372 -9.299 11.667 167 HB3 ARG 21 3HB ARG 21 -6.496 -10.513 11.070 168 HG2 ARG 21 2HG ARG 21 -5.321 -12.246 11.967 169 HG3 ARG 21 3HG ARG 21 -3.775 -11.402 11.853 170 HD2 ARG 21 2HD ARG 21 -5.955 -10.599 13.767 171 HD3 ARG 21 3HD ARG 21 -4.681 -11.744 14.185 172 HE ARG 21 HE ARG 21 -3.299 -9.604 13.295 173 HH11 ARG 21 1HH1 ARG 21 -5.846 -9.982 15.638 174 HH12 ARG 21 2HH1 ARG 21 -5.318 -8.655 16.619 175 HH21 ARG 21 1HH2 ARG 21 -2.594 -7.855 14.578 176 HH22 ARG 21 2HH2 ARG 21 -3.468 -7.446 16.015 177 H ALA 22 H ALA 22 -2.535 -11.183 10.356 178 HA ALA 22 HA ALA 22 -1.058 -9.013 11.201 179 HB1 ALA 22 1HB ALA 22 -0.363 -11.649 10.021 180 HB2 ALA 22 2HB ALA 22 0.912 -10.439 10.165 181 HB3 ALA 22 3HB ALA 22 0.038 -10.973 11.600 182 H LEU 23 H LEU 23 -1.533 -10.199 7.901 183 HA LEU 23 HA LEU 23 0.165 -8.139 6.785 184 HB2 LEU 23 2HB LEU 23 -1.681 -9.902 5.216 185 HB3 LEU 23 3HB LEU 23 -0.160 -9.168 4.711 186 HG LEU 23 HG LEU 23 -0.302 -11.344 6.785 187 HD11 LEU 23 1HD1 LEU 23 0.484 -12.805 4.856 188 HD12 LEU 23 2HD1 LEU 23 -0.142 -11.544 3.794 189 HD13 LEU 23 3HD1 LEU 23 -1.229 -12.385 4.899 190 HD21 LEU 23 3HD2 LEU 23 1.977 -10.575 4.984 191 HD22 LEU 23 1HD2 LEU 23 2.015 -11.559 6.447 192 HD23 LEU 23 2HD2 LEU 23 1.721 -9.823 6.560 193 H ALA 24 H ALA 24 -3.274 -8.829 7.085 194 HA ALA 24 HA ALA 24 -4.366 -6.970 5.372 195 HB1 ALA 24 1HB ALA 24 -6.272 -6.868 7.039 196 HB2 ALA 24 2HB ALA 24 -5.828 -8.471 6.452 197 HB3 ALA 24 3HB ALA 24 -5.312 -7.945 8.054 198 H GLY 25 H GLY 25 -3.375 -6.461 8.756 199 HA2 GLY 25 2HA GLY 25 -3.912 -3.615 8.551 200 HA3 GLY 25 3HA GLY 25 -3.327 -4.468 9.971 201 H ALA 26 H ALA 26 -1.429 -5.503 7.519 202 HA ALA 26 HA ALA 26 0.685 -3.618 8.248 203 HB1 ALA 26 1HB ALA 26 2.221 -5.267 7.296 204 HB2 ALA 26 2HB ALA 26 1.175 -5.989 8.519 205 HB3 ALA 26 3HB ALA 26 0.850 -6.263 6.807 206 H GLY 27 H GLY 27 -1.503 -4.195 5.742 207 HA2 GLY 27 2HA GLY 27 -1.793 -2.912 3.821 208 HA3 GLY 27 3HA GLY 27 -0.208 -2.201 4.087 209 H LEU 28 H LEU 28 -0.731 -5.656 4.024 210 HA LEU 28 HA LEU 28 0.431 -5.793 1.331 211 HB2 LEU 28 2HB LEU 28 1.336 -7.905 3.134 212 HB3 LEU 28 3HB LEU 28 2.237 -6.959 1.951 213 HG LEU 28 HG LEU 28 1.502 -5.933 4.687 214 HD11 LEU 28 1HD1 LEU 28 4.291 -6.667 4.126 215 HD12 LEU 28 2HD1 LEU 28 3.175 -8.021 4.299 216 HD13 LEU 28 3HD1 LEU 28 3.340 -6.844 5.601 217 HD21 LEU 28 3HD2 LEU 28 2.183 -4.006 3.810 218 HD22 LEU 28 1HD2 LEU 28 2.730 -4.795 2.330 219 HD23 LEU 28 2HD2 LEU 28 3.802 -4.704 3.728 220 H THR 29 H THR 29 -0.314 -7.431 0.057 221 HA THR 29 HA THR 29 -2.810 -8.508 0.452 222 HB THR 29 HB THR 29 -0.686 -9.945 -1.134 223 HG1 THR 29 HG1 THR 29 -2.241 -7.693 -1.941 224 HG21 THR 29 3HG2 THR 29 -2.579 -11.225 -1.333 225 HG22 THR 29 1HG2 THR 29 -2.846 -10.086 -2.652 226 HG23 THR 29 2HG2 THR 29 -3.663 -9.853 -1.107 227 H CYS 30 H CYS 30 -3.502 -10.733 0.792 228 HA CYS 30 HA CYS 30 -1.675 -12.408 2.337 229 HB2 CYS 30 2HB CYS 30 -3.518 -12.757 4.049 230 HB3 CYS 30 3HB CYS 30 -2.701 -11.199 4.103 231 HG CYS 30 HG CYS 30 -5.341 -10.659 4.620 232 H THR 31 H THR 31 -1.778 -14.404 1.575 233 HA THR 31 HA THR 31 -4.338 -15.368 0.478 234 HB THR 31 HB THR 31 -1.655 -16.235 -0.586 235 HG1 THR 31 HG1 THR 31 -3.240 -14.000 -1.254 236 HG21 THR 31 3HG2 THR 31 -4.410 -16.321 -1.818 237 HG22 THR 31 1HG2 THR 31 -3.645 -17.675 -0.987 238 HG23 THR 31 2HG2 THR 31 -2.934 -17.034 -2.468 239 H THR 32 H THR 32 -5.097 -16.905 1.768 240 HA THR 32 HA THR 32 -3.210 -18.649 3.188 241 HB THR 32 HB THR 32 -5.058 -19.239 4.660 242 HG1 THR 32 HG1 THR 32 -6.580 -17.559 2.933 243 HG21 THR 32 3HG2 THR 32 -5.671 -16.554 5.054 244 HG22 THR 32 1HG2 THR 32 -4.075 -16.536 4.304 245 HG23 THR 32 2HG2 THR 32 -4.341 -17.449 5.789 246 H PHE 33 H PHE 33 -2.982 -20.719 2.641 247 HA PHE 33 HA PHE 33 -4.959 -21.888 0.796 248 HB2 PHE 33 2HB PHE 33 -1.998 -22.447 1.052 249 HB3 PHE 33 3HB PHE 33 -3.094 -23.350 0.012 250 HD1 PHE 33 HD1 PHE 33 -4.004 -22.354 -2.001 251 HD2 PHE 33 HD2 PHE 33 -1.314 -20.204 0.500 252 HE1 PHE 33 HE1 PHE 33 -3.644 -20.717 -3.802 253 HE2 PHE 33 HE2 PHE 33 -0.951 -18.562 -1.297 254 HZ PHE 33 HZ PHE 33 -2.117 -18.817 -3.451 255 H GLU 34 H GLU 34 -4.336 -24.502 0.875 256 HA GLU 34 HA GLU 34 -4.372 -25.327 3.684 257 HB2 GLU 34 2HB GLU 34 -6.343 -26.640 3.455 258 HB3 GLU 34 3HB GLU 34 -6.730 -25.038 2.842 259 HG2 GLU 34 2HG GLU 34 -5.933 -26.254 0.569 260 HG3 GLU 34 3HG GLU 34 -6.613 -27.620 1.450 261 H ASN 35 H ASN 35 -2.665 -25.537 1.120 262 HA ASN 35 HA ASN 35 -1.532 -28.047 1.672 263 HB2 ASN 35 2HB ASN 35 -3.704 -28.027 -0.298 264 HB3 ASN 35 3HB ASN 35 -2.209 -28.730 -0.909 265 HD21 ASN 35 1HD2 ASN 35 -1.151 -30.028 1.145 266 HD22 ASN 35 2HD2 ASN 35 -2.214 -31.257 1.732 267 H GLY 36 H GLY 36 0.528 -27.969 1.025 268 HA2 GLY 36 2HA GLY 36 1.591 -25.734 -0.296 269 HA3 GLY 36 3HA GLY 36 2.443 -27.244 -0.011 270 H ASN 37 H ASN 37 0.507 -28.829 -1.532 271 HA ASN 37 HA ASN 37 1.749 -28.771 -4.037 272 HB2 ASN 37 2HB ASN 37 0.429 -30.575 -4.570 273 HB3 ASN 37 3HB ASN 37 0.261 -30.599 -2.818 274 HD21 ASN 37 1HD2 ASN 37 -1.278 -29.798 -5.837 275 HD22 ASN 37 2HD2 ASN 37 -2.888 -29.699 -5.218 276 H GLU 38 H GLU 38 -1.075 -27.118 -2.828 277 HA GLU 38 HA GLU 38 -1.837 -26.200 -5.483 278 HB2 GLU 38 2HB GLU 38 -3.126 -25.118 -3.028 279 HB3 GLU 38 3HB GLU 38 -3.842 -25.552 -4.573 280 HG2 GLU 38 2HG GLU 38 -3.138 -27.984 -3.775 281 HG3 GLU 38 3HG GLU 38 -3.301 -27.223 -2.193 282 H VAL 39 H VAL 39 0.166 -25.223 -2.932 283 HA VAL 39 HA VAL 39 -0.030 -22.381 -3.508 284 HB VAL 39 HB VAL 39 1.946 -23.754 -1.687 285 HG11 VAL 39 1HG1 VAL 39 1.459 -21.312 -0.628 286 HG12 VAL 39 2HG1 VAL 39 2.786 -21.665 -1.736 287 HG13 VAL 39 3HG1 VAL 39 1.287 -20.965 -2.348 288 HG21 VAL 39 3HG2 VAL 39 0.234 -24.276 -0.362 289 HG22 VAL 39 1HG2 VAL 39 -0.024 -22.546 -0.132 290 HG23 VAL 39 2HG2 VAL 39 -0.906 -23.410 -1.391 291 H LEU 40 H LEU 40 2.277 -25.030 -3.919 292 HA LEU 40 HA LEU 40 4.483 -23.674 -4.845 293 HB2 LEU 40 2HB LEU 40 4.890 -25.905 -4.619 294 HB3 LEU 40 3HB LEU 40 3.345 -26.369 -5.329 295 HG LEU 40 HG LEU 40 4.204 -25.962 -7.554 296 HD11 LEU 40 1HD1 LEU 40 5.787 -24.419 -7.792 297 HD12 LEU 40 2HD1 LEU 40 6.937 -25.651 -7.273 298 HD13 LEU 40 3HD1 LEU 40 6.256 -24.528 -6.095 299 HD21 LEU 40 3HD2 LEU 40 5.088 -27.972 -5.799 300 HD22 LEU 40 1HD2 LEU 40 6.488 -27.498 -6.762 301 HD23 LEU 40 2HD2 LEU 40 5.008 -28.030 -7.561 302 H ALA 41 H ALA 41 1.647 -24.725 -6.698 303 HA ALA 41 HA ALA 41 2.599 -23.742 -9.193 304 HB1 ALA 41 1HB ALA 41 -0.207 -23.830 -9.279 305 HB2 ALA 41 2HB ALA 41 0.932 -25.039 -9.873 306 HB3 ALA 41 3HB ALA 41 0.301 -25.154 -8.230 307 H ALA 42 H ALA 42 0.835 -22.344 -6.533 308 HA ALA 42 HA ALA 42 -0.310 -20.132 -7.803 309 HB1 ALA 42 1HB ALA 42 -0.780 -20.901 -5.474 310 HB2 ALA 42 2HB ALA 42 0.755 -20.183 -4.985 311 HB3 ALA 42 3HB ALA 42 -0.529 -19.162 -5.631 312 H LEU 43 H LEU 43 2.955 -20.709 -6.673 313 HA LEU 43 HA LEU 43 3.857 -18.024 -6.820 314 HB2 LEU 43 2HB LEU 43 5.721 -20.293 -7.291 315 HB3 LEU 43 3HB LEU 43 5.942 -18.837 -6.324 316 HG LEU 43 HG LEU 43 4.377 -21.302 -5.569 317 HD11 LEU 43 1HD1 LEU 43 7.036 -20.182 -4.850 318 HD12 LEU 43 2HD1 LEU 43 6.546 -21.855 -5.112 319 HD13 LEU 43 3HD1 LEU 43 6.113 -21.035 -3.612 320 HD21 LEU 43 3HD2 LEU 43 3.888 -18.658 -4.786 321 HD22 LEU 43 1HD2 LEU 43 4.757 -19.405 -3.445 322 HD23 LEU 43 2HD2 LEU 43 3.266 -20.133 -4.044 323 H ALA 44 H ALA 44 3.469 -20.566 -9.163 324 HA ALA 44 HA ALA 44 5.110 -19.338 -11.176 325 HB1 ALA 44 1HB ALA 44 4.974 -21.644 -11.412 326 HB2 ALA 44 2HB ALA 44 3.232 -21.669 -11.136 327 HB3 ALA 44 3HB ALA 44 3.875 -21.050 -12.657 328 H SER 45 H SER 45 2.201 -18.489 -9.897 329 HA SER 45 HA SER 45 1.413 -17.109 -12.372 330 HB2 SER 45 2HB SER 45 -0.084 -19.109 -11.021 331 HB3 SER 45 3HB SER 45 -0.901 -17.570 -10.748 332 HG SER 45 HG SER 45 -0.113 -18.590 -13.279 333 H LYS 46 H LYS 46 2.958 -16.327 -9.949 334 HA LYS 46 HA LYS 46 2.011 -13.725 -9.642 335 HB2 LYS 46 2HB LYS 46 0.513 -15.536 -8.110 336 HB3 LYS 46 3HB LYS 46 1.601 -14.754 -6.970 337 HG2 LYS 46 2HG LYS 46 0.275 -12.929 -8.843 338 HG3 LYS 46 3HG LYS 46 -0.807 -13.776 -7.736 339 HD2 LYS 46 2HD LYS 46 1.420 -12.916 -6.225 340 HD3 LYS 46 3HD LYS 46 0.911 -11.550 -7.222 341 HE2 LYS 46 2HE LYS 46 -1.233 -13.075 -5.875 342 HE3 LYS 46 3HE LYS 46 -0.173 -12.127 -4.834 343 HZ1 LYS 46 3HZ LYS 46 -1.863 -10.663 -5.383 344 HZ2 LYS 46 1HZ LYS 46 -1.959 -11.192 -6.987 345 HZ3 LYS 46 2HZ LYS 46 -0.648 -10.249 -6.485 346 H THR 47 H THR 47 3.640 -16.386 -7.969 347 HA THR 47 HA THR 47 5.607 -16.503 -6.823 348 HB THR 47 HB THR 47 7.105 -14.367 -7.934 349 HG1 THR 47 HG1 THR 47 5.531 -15.751 -9.871 350 HG21 THR 47 3HG2 THR 47 7.039 -17.298 -7.969 351 HG22 THR 47 1HG2 THR 47 8.405 -16.198 -7.787 352 HG23 THR 47 2HG2 THR 47 7.784 -16.575 -9.394 353 HA PRO 48 HA PRO 48 4.574 -13.141 -3.905 354 HB2 PRO 48 2HB PRO 48 4.967 -14.665 -1.693 355 HB3 PRO 48 3HB PRO 48 3.452 -14.667 -2.605 356 HG2 PRO 48 2HG PRO 48 5.724 -16.615 -2.701 357 HG3 PRO 48 3HG PRO 48 3.979 -16.931 -2.689 358 HD2 PRO 48 2HD PRO 48 5.457 -17.002 -4.957 359 HD3 PRO 48 3HD PRO 48 3.756 -16.492 -4.941 360 H ASP 49 H ASP 49 5.863 -12.073 -2.288 361 HA ASP 49 HA ASP 49 8.710 -12.322 -2.826 362 HB2 ASP 49 2HB ASP 49 6.916 -10.225 -1.779 363 HB3 ASP 49 3HB ASP 49 8.520 -10.268 -1.054 364 H VAL 50 H VAL 50 6.569 -13.619 -0.656 365 HA VAL 50 HA VAL 50 8.551 -14.804 0.942 366 HB VAL 50 HB VAL 50 8.772 -12.566 1.924 367 HG11 VAL 50 1HG1 VAL 50 7.056 -11.283 2.633 368 HG12 VAL 50 2HG1 VAL 50 6.125 -12.273 1.507 369 HG13 VAL 50 3HG1 VAL 50 6.130 -12.661 3.228 370 HG21 VAL 50 3HG2 VAL 50 8.793 -14.843 3.244 371 HG22 VAL 50 1HG2 VAL 50 8.926 -13.301 4.090 372 HG23 VAL 50 2HG2 VAL 50 7.378 -14.145 4.032 373 H LEU 51 H LEU 51 7.705 -16.325 2.415 374 HA LEU 51 HA LEU 51 4.802 -16.543 2.622 375 HB2 LEU 51 2HB LEU 51 6.015 -17.895 0.643 376 HB3 LEU 51 3HB LEU 51 6.203 -19.057 1.954 377 HG LEU 51 HG LEU 51 3.493 -17.934 1.456 378 HD11 LEU 51 1HD1 LEU 51 3.020 -19.293 -0.373 379 HD12 LEU 51 2HD1 LEU 51 4.485 -20.252 -0.164 380 HD13 LEU 51 3HD1 LEU 51 4.592 -18.598 -0.768 381 HD21 LEU 51 3HD2 LEU 51 3.783 -20.790 1.814 382 HD22 LEU 51 1HD2 LEU 51 2.878 -19.618 2.773 383 HD23 LEU 51 2HD2 LEU 51 4.592 -19.886 3.096 384 H LEU 52 H LEU 52 4.091 -17.945 4.308 385 HA LEU 52 HA LEU 52 6.196 -18.705 6.222 386 HB2 LEU 52 2HB LEU 52 3.508 -17.807 7.158 387 HB3 LEU 52 3HB LEU 52 5.048 -17.811 8.016 388 HG LEU 52 HG LEU 52 5.369 -16.006 5.896 389 HD11 LEU 52 1HD1 LEU 52 3.066 -15.786 5.473 390 HD12 LEU 52 2HD1 LEU 52 3.491 -14.404 6.482 391 HD13 LEU 52 3HD1 LEU 52 2.666 -15.792 7.191 392 HD21 LEU 52 3HD2 LEU 52 4.657 -14.983 8.577 393 HD22 LEU 52 1HD2 LEU 52 6.050 -14.626 7.556 394 HD23 LEU 52 2HD2 LEU 52 6.003 -16.120 8.491 395 H SER 53 H SER 53 6.155 -20.871 5.697 396 HA SER 53 HA SER 53 3.742 -22.368 5.452 397 HB2 SER 53 2HB SER 53 5.087 -24.084 4.808 398 HB3 SER 53 3HB SER 53 6.311 -22.818 4.699 399 HG SER 53 HG SER 53 6.768 -23.360 6.970 400 H ASP 54 H ASP 54 2.682 -23.621 6.913 401 HA ASP 54 HA ASP 54 3.411 -23.227 9.720 402 HB2 ASP 54 2HB ASP 54 1.163 -22.642 9.390 403 HB3 ASP 54 3HB ASP 54 0.868 -24.011 8.321 404 H ILE 55 H ILE 55 2.814 -25.768 7.356 405 HA ILE 55 HA ILE 55 3.383 -27.972 7.315 406 HB ILE 55 HB ILE 55 5.048 -27.452 9.774 407 HG12 ILE 55 2HG1 ILE 55 5.842 -27.128 6.872 408 HG13 ILE 55 3HG1 ILE 55 5.562 -25.804 7.998 409 HG21 ILE 55 1HG2 ILE 55 5.479 -29.624 9.577 410 HG22 ILE 55 2HG2 ILE 55 4.619 -29.719 8.041 411 HG23 ILE 55 3HG2 ILE 55 6.318 -29.248 8.073 412 HD11 ILE 55 3HD1 ILE 55 7.826 -25.954 8.108 413 HD12 ILE 55 1HD1 ILE 55 7.391 -27.068 9.404 414 HD13 ILE 55 2HD1 ILE 55 7.839 -27.693 7.816 415 H ARG 56 H ARG 56 1.213 -28.518 7.852 416 HA ARG 56 HA ARG 56 1.021 -29.970 10.357 417 HB2 ARG 56 2HB ARG 56 -0.118 -27.401 10.118 418 HB3 ARG 56 3HB ARG 56 -1.452 -28.542 10.014 419 HG2 ARG 56 2HG ARG 56 -1.430 -28.471 12.243 420 HG3 ARG 56 3HG ARG 56 -0.030 -29.538 12.115 421 HD2 ARG 56 2HD ARG 56 1.432 -27.908 12.690 422 HD3 ARG 56 3HD ARG 56 0.511 -26.648 11.870 423 HE ARG 56 HE ARG 56 -0.604 -26.226 13.831 424 HH11 ARG 56 1HH1 ARG 56 1.113 -29.242 14.099 425 HH12 ARG 56 2HH1 ARG 56 0.822 -29.407 15.799 426 HH21 ARG 56 1HH2 ARG 56 -0.994 -26.431 16.069 427 HH22 ARG 56 2HH2 ARG 56 -0.378 -27.808 16.918 428 H MET 57 H MET 57 -0.502 -29.003 7.320 429 HA MET 57 HA MET 57 -2.564 -30.804 7.136 430 HB2 MET 57 2HB MET 57 -2.155 -30.740 4.646 431 HB3 MET 57 3HB MET 57 -2.313 -29.171 5.425 432 HG2 MET 57 2HG MET 57 0.432 -29.927 5.430 433 HG3 MET 57 3HG MET 57 -0.215 -30.121 3.803 434 HE1 MET 57 3HE MET 57 1.584 -27.501 3.005 435 HE2 MET 57 1HE MET 57 1.916 -26.839 4.606 436 HE3 MET 57 2HE MET 57 2.019 -28.578 4.333 437 HA PRO 58 HA PRO 58 -0.872 -34.850 6.926 438 HB2 PRO 58 2HB PRO 58 -2.653 -36.071 5.281 439 HB3 PRO 58 3HB PRO 58 -3.035 -35.623 6.947 440 HG2 PRO 58 2HG PRO 58 -3.708 -34.200 4.401 441 HG3 PRO 58 3HG PRO 58 -4.726 -34.488 5.824 442 HD2 PRO 58 2HD PRO 58 -3.499 -32.118 5.366 443 HD3 PRO 58 3HD PRO 58 -3.791 -32.742 7.002 444 H GLY 59 H GLY 59 -1.958 -33.688 3.725 445 HA2 GLY 59 2HA GLY 59 -0.394 -35.342 2.141 446 HA3 GLY 59 3HA GLY 59 -0.926 -33.732 1.676 447 H MET 60 H MET 60 0.468 -31.979 1.915 448 HA MET 60 HA MET 60 3.189 -32.487 1.534 449 HB2 MET 60 2HB MET 60 1.621 -30.016 2.199 450 HB3 MET 60 3HB MET 60 3.378 -29.961 2.140 451 HG2 MET 60 2HG MET 60 1.662 -30.931 -0.129 452 HG3 MET 60 3HG MET 60 2.221 -29.269 0.042 453 HE1 MET 60 3HE MET 60 3.134 -30.703 -2.760 454 HE2 MET 60 1HE MET 60 3.248 -29.081 -2.076 455 HE3 MET 60 2HE MET 60 4.700 -29.898 -2.655 456 H ASP 61 H ASP 61 4.839 -32.828 2.880 457 HA ASP 61 HA ASP 61 4.371 -33.105 5.685 458 HB2 ASP 61 2HB ASP 61 6.307 -33.997 3.827 459 HB3 ASP 61 3HB ASP 61 7.174 -33.079 5.054 460 H GLY 62 H GLY 62 5.008 -30.447 3.781 461 HA2 GLY 62 2HA GLY 62 4.979 -28.283 4.906 462 HA3 GLY 62 3HA GLY 62 6.052 -28.971 6.115 463 H LEU 63 H LEU 63 8.185 -29.810 5.179 464 HA LEU 63 HA LEU 63 9.381 -27.626 3.721 465 HB2 LEU 63 2HB LEU 63 11.447 -29.192 3.994 466 HB3 LEU 63 3HB LEU 63 10.796 -28.319 5.379 467 HG LEU 63 HG LEU 63 9.726 -30.318 6.196 468 HD11 LEU 63 1HD1 LEU 63 10.551 -31.429 3.548 469 HD12 LEU 63 2HD1 LEU 63 8.992 -31.520 4.367 470 HD13 LEU 63 3HD1 LEU 63 10.345 -32.498 4.936 471 HD21 LEU 63 3HD2 LEU 63 11.883 -31.831 6.234 472 HD22 LEU 63 1HD2 LEU 63 11.829 -30.292 7.093 473 HD23 LEU 63 2HD2 LEU 63 12.623 -30.397 5.522 474 H ALA 64 H ALA 64 7.978 -30.598 2.925 475 HA ALA 64 HA ALA 64 9.456 -31.631 0.862 476 HB1 ALA 64 1HB ALA 64 7.685 -32.971 0.917 477 HB2 ALA 64 2HB ALA 64 6.699 -31.735 1.699 478 HB3 ALA 64 3HB ALA 64 6.831 -31.777 -0.060 479 H LEU 65 H LEU 65 7.025 -29.038 0.612 480 HA LEU 65 HA LEU 65 7.737 -28.531 -2.146 481 HB2 LEU 65 2HB LEU 65 5.815 -27.367 -2.285 482 HB3 LEU 65 3HB LEU 65 5.426 -28.273 -0.824 483 HG LEU 65 HG LEU 65 6.567 -25.483 -0.810 484 HD11 LEU 65 1HD1 LEU 65 4.555 -24.640 -1.203 485 HD12 LEU 65 2HD1 LEU 65 3.833 -25.662 0.039 486 HD13 LEU 65 3HD1 LEU 65 3.998 -26.264 -1.610 487 HD21 LEU 65 3HD2 LEU 65 4.991 -26.612 1.424 488 HD22 LEU 65 1HD2 LEU 65 6.381 -25.527 1.447 489 HD23 LEU 65 2HD2 LEU 65 6.617 -27.255 1.189 490 H LEU 66 H LEU 66 8.540 -27.313 0.987 491 HA LEU 66 HA LEU 66 9.454 -24.744 0.212 492 HB2 LEU 66 2HB LEU 66 9.046 -26.016 2.585 493 HB3 LEU 66 3HB LEU 66 10.806 -26.009 2.489 494 HG LEU 66 HG LEU 66 10.270 -24.094 3.716 495 HD11 LEU 66 1HD1 LEU 66 10.952 -22.246 2.324 496 HD12 LEU 66 2HD1 LEU 66 10.522 -23.142 0.867 497 HD13 LEU 66 3HD1 LEU 66 11.862 -23.689 1.876 498 HD21 LEU 66 3HD2 LEU 66 8.595 -22.409 2.647 499 HD22 LEU 66 1HD2 LEU 66 7.990 -23.793 3.558 500 HD23 LEU 66 2HD2 LEU 66 7.998 -23.834 1.794 501 H LYS 67 H LYS 67 10.832 -27.915 0.061 502 HA LYS 67 HA LYS 67 13.562 -27.180 -0.095 503 HB2 LYS 67 2HB LYS 67 11.963 -29.597 -0.470 504 HB3 LYS 67 3HB LYS 67 13.339 -29.514 -1.561 505 HG2 LYS 67 2HG LYS 67 14.216 -30.618 0.259 506 HG3 LYS 67 3HG LYS 67 14.687 -28.947 0.576 507 HD2 LYS 67 2HD LYS 67 12.733 -28.697 2.051 508 HD3 LYS 67 3HD LYS 67 12.311 -30.386 1.757 509 HE2 LYS 67 2HE LYS 67 15.070 -29.879 2.670 510 HE3 LYS 67 3HE LYS 67 13.797 -29.549 3.844 511 HZ1 LYS 67 3HZ LYS 67 14.457 -31.793 4.118 512 HZ2 LYS 67 1HZ LYS 67 14.347 -32.113 2.460 513 HZ3 LYS 67 2HZ LYS 67 12.944 -31.827 3.361 514 H GLN 68 H GLN 68 10.973 -27.332 -2.434 515 HA GLN 68 HA GLN 68 12.768 -26.980 -4.684 516 HB2 GLN 68 2HB GLN 68 10.963 -27.406 -6.044 517 HB3 GLN 68 3HB GLN 68 10.474 -28.265 -4.589 518 HG2 GLN 68 2HG GLN 68 9.410 -25.860 -4.069 519 HG3 GLN 68 3HG GLN 68 9.350 -25.842 -5.831 520 HE21 GLN 68 1HE2 GLN 68 7.189 -25.964 -3.862 521 HE22 GLN 68 2HE2 GLN 68 6.286 -27.388 -4.237 522 H ILE 69 H ILE 69 10.925 -25.036 -2.523 523 HA ILE 69 HA ILE 69 10.541 -22.755 -4.135 524 HB ILE 69 HB ILE 69 10.735 -23.085 -1.148 525 HG12 ILE 69 2HG1 ILE 69 8.368 -22.351 -2.874 526 HG13 ILE 69 3HG1 ILE 69 8.767 -24.011 -2.446 527 HG21 ILE 69 1HG2 ILE 69 11.306 -20.892 -1.181 528 HG22 ILE 69 2HG2 ILE 69 10.621 -20.624 -2.783 529 HG23 ILE 69 3HG2 ILE 69 9.564 -20.696 -1.373 530 HD11 ILE 69 3HD1 ILE 69 7.165 -22.260 -1.024 531 HD12 ILE 69 1HD1 ILE 69 7.801 -23.807 -0.465 532 HD13 ILE 69 2HD1 ILE 69 8.675 -22.316 -0.115 533 H LYS 70 H LYS 70 13.279 -23.943 -2.338 534 HA LYS 70 HA LYS 70 14.750 -21.491 -2.361 535 HB2 LYS 70 2HB LYS 70 15.175 -24.248 -1.463 536 HB3 LYS 70 3HB LYS 70 16.630 -23.482 -2.085 537 HG2 LYS 70 2HG LYS 70 16.545 -23.122 0.268 538 HG3 LYS 70 3HG LYS 70 16.220 -21.583 -0.532 539 HD2 LYS 70 2HD LYS 70 13.716 -22.741 -0.232 540 HD3 LYS 70 3HD LYS 70 14.554 -23.126 1.273 541 HE2 LYS 70 2HE LYS 70 13.359 -21.011 1.456 542 HE3 LYS 70 3HE LYS 70 15.100 -20.762 1.573 543 HZ1 LYS 70 3HZ LYS 70 13.630 -20.441 -0.976 544 HZ2 LYS 70 1HZ LYS 70 15.182 -19.892 -0.587 545 HZ3 LYS 70 2HZ LYS 70 13.827 -19.165 0.117 546 H GLN 71 H GLN 71 14.565 -24.320 -4.441 547 HA GLN 71 HA GLN 71 16.763 -23.481 -6.102 548 HB2 GLN 71 2HB GLN 71 16.191 -25.871 -5.762 549 HB3 GLN 71 3HB GLN 71 14.675 -25.605 -6.613 550 HG2 GLN 71 2HG GLN 71 16.230 -24.741 -8.520 551 HG3 GLN 71 3HG GLN 71 17.455 -25.686 -7.675 552 HE21 GLN 71 1HE2 GLN 71 17.662 -27.152 -9.350 553 HE22 GLN 71 2HE2 GLN 71 16.445 -28.324 -9.713 554 H ARG 72 H ARG 72 13.236 -23.733 -6.523 555 HA ARG 72 HA ARG 72 13.241 -22.476 -9.077 556 HB2 ARG 72 2HB ARG 72 11.408 -23.912 -7.604 557 HB3 ARG 72 3HB ARG 72 10.744 -22.285 -7.564 558 HG2 ARG 72 2HG ARG 72 11.641 -23.122 -10.213 559 HG3 ARG 72 3HG ARG 72 10.342 -24.113 -9.547 560 HD2 ARG 72 2HD ARG 72 9.041 -22.067 -9.109 561 HD3 ARG 72 3HD ARG 72 10.329 -21.112 -9.842 562 HE ARG 72 HE ARG 72 8.324 -22.644 -11.204 563 HH11 ARG 72 1HH1 ARG 72 11.544 -21.339 -11.420 564 HH12 ARG 72 2HH1 ARG 72 11.551 -21.298 -13.152 565 HH21 ARG 72 1HH2 ARG 72 8.321 -22.595 -13.484 566 HH22 ARG 72 2HH2 ARG 72 9.717 -22.011 -14.325 567 H HIS 73 H HIS 73 13.183 -21.327 -5.815 568 HA HIS 73 HA HIS 73 13.229 -18.580 -6.796 569 HB2 HIS 73 2HB HIS 73 11.443 -19.310 -4.479 570 HB3 HIS 73 3HB HIS 73 11.520 -17.784 -5.355 571 HD1 HIS 73 HD1 HIS 73 10.590 -17.884 -7.883 572 HD2 HIS 73 HD2 HIS 73 9.593 -21.079 -5.421 573 HE1 HIS 73 HE1 HIS 73 8.663 -19.033 -9.020 574 HA PRO 74 HA PRO 74 16.374 -19.516 -3.512 575 HB2 PRO 74 2HB PRO 74 18.449 -18.387 -4.850 576 HB3 PRO 74 3HB PRO 74 17.956 -20.068 -5.084 577 HG2 PRO 74 2HG PRO 74 17.330 -17.662 -6.750 578 HG3 PRO 74 3HG PRO 74 17.797 -19.291 -7.270 579 HD2 PRO 74 2HD PRO 74 15.228 -18.434 -7.295 580 HD3 PRO 74 3HD PRO 74 15.667 -20.127 -6.990 581 H MET 75 H MET 75 15.803 -16.613 -5.457 582 HA MET 75 HA MET 75 16.894 -14.864 -3.434 583 HB2 MET 75 2HB MET 75 16.260 -13.055 -4.934 584 HB3 MET 75 3HB MET 75 17.098 -14.317 -5.827 585 HG2 MET 75 2HG MET 75 15.377 -14.602 -7.188 586 HG3 MET 75 3HG MET 75 14.259 -14.775 -5.837 587 HE1 MET 75 3HE MET 75 12.841 -13.340 -4.968 588 HE2 MET 75 1HE MET 75 13.601 -11.819 -4.497 589 HE3 MET 75 2HE MET 75 12.279 -11.819 -5.665 590 H LEU 76 H LEU 76 14.137 -16.582 -3.562 591 HA LEU 76 HA LEU 76 12.385 -14.490 -2.518 592 HB2 LEU 76 2HB LEU 76 11.263 -15.836 -4.063 593 HB3 LEU 76 3HB LEU 76 11.965 -17.318 -3.417 594 HG LEU 76 HG LEU 76 10.536 -17.176 -1.461 595 HD11 LEU 76 1HD1 LEU 76 9.895 -14.507 -2.600 596 HD12 LEU 76 2HD1 LEU 76 10.147 -14.993 -0.924 597 HD13 LEU 76 3HD1 LEU 76 8.629 -15.379 -1.734 598 HD21 LEU 76 3HD2 LEU 76 9.735 -18.238 -3.589 599 HD22 LEU 76 1HD2 LEU 76 8.860 -16.744 -3.925 600 HD23 LEU 76 2HD2 LEU 76 8.458 -17.698 -2.497 601 HA PRO 77 HA PRO 77 13.737 -15.789 1.566 602 HB2 PRO 77 2HB PRO 77 12.489 -13.763 2.873 603 HB3 PRO 77 3HB PRO 77 14.034 -13.560 2.038 604 HG2 PRO 77 2HG PRO 77 11.273 -12.863 1.112 605 HG3 PRO 77 3HG PRO 77 12.773 -11.928 0.963 606 HD2 PRO 77 2HD PRO 77 11.748 -13.376 -1.083 607 HD3 PRO 77 3HD PRO 77 13.493 -13.140 -0.861 608 H VAL 78 H VAL 78 12.744 -17.449 2.512 609 HA VAL 78 HA VAL 78 9.818 -17.335 2.854 610 HB VAL 78 HB VAL 78 11.429 -19.876 2.852 611 HG11 VAL 78 1HG1 VAL 78 8.987 -20.515 1.928 612 HG12 VAL 78 2HG1 VAL 78 9.412 -20.524 3.640 613 HG13 VAL 78 3HG1 VAL 78 8.575 -19.136 2.946 614 HG21 VAL 78 3HG2 VAL 78 10.713 -18.173 0.591 615 HG22 VAL 78 1HG2 VAL 78 11.859 -19.511 0.687 616 HG23 VAL 78 2HG2 VAL 78 10.144 -19.835 0.431 617 H ILE 79 H ILE 79 8.980 -18.482 4.767 618 HA ILE 79 HA ILE 79 10.883 -18.597 7.001 619 HB ILE 79 HB ILE 79 8.166 -17.332 7.300 620 HG12 ILE 79 2HG1 ILE 79 10.830 -15.956 6.887 621 HG13 ILE 79 3HG1 ILE 79 9.487 -15.967 5.748 622 HG21 ILE 79 1HG2 ILE 79 9.414 -18.342 9.269 623 HG22 ILE 79 2HG2 ILE 79 10.584 -17.040 9.058 624 HG23 ILE 79 3HG2 ILE 79 8.903 -16.662 9.433 625 HD11 ILE 79 3HD1 ILE 79 9.894 -14.379 8.184 626 HD12 ILE 79 1HD1 ILE 79 9.038 -13.984 6.694 627 HD13 ILE 79 2HD1 ILE 79 8.256 -14.978 7.923 628 H ILE 80 H ILE 80 10.549 -20.232 8.411 629 HA ILE 80 HA ILE 80 8.314 -22.041 7.829 630 HB ILE 80 HB ILE 80 10.947 -22.496 9.222 631 HG12 ILE 80 2HG1 ILE 80 10.705 -22.467 6.658 632 HG13 ILE 80 3HG1 ILE 80 11.500 -23.858 7.388 633 HG21 ILE 80 1HG2 ILE 80 10.173 -24.886 9.390 634 HG22 ILE 80 2HG2 ILE 80 9.384 -23.752 10.486 635 HG23 ILE 80 3HG2 ILE 80 8.548 -24.301 9.034 636 HD11 ILE 80 3HD1 ILE 80 9.535 -24.006 5.546 637 HD12 ILE 80 1HD1 ILE 80 9.907 -25.276 6.711 638 HD13 ILE 80 2HD1 ILE 80 8.603 -24.134 7.038 639 H MET 81 H MET 81 6.873 -22.692 9.375 640 HA MET 81 HA MET 81 7.123 -21.444 12.031 641 HB2 MET 81 2HB MET 81 4.565 -21.820 10.466 642 HB3 MET 81 3HB MET 81 4.707 -21.100 12.064 643 HG2 MET 81 2HG MET 81 6.041 -19.281 11.120 644 HG3 MET 81 3HG MET 81 5.876 -19.999 9.519 645 HE1 MET 81 3HE MET 81 2.171 -20.653 10.021 646 HE2 MET 81 1HE MET 81 2.374 -19.728 8.533 647 HE3 MET 81 2HE MET 81 3.551 -20.967 8.968 648 H THR 82 H THR 82 7.007 -22.812 13.688 649 HA THR 82 HA THR 82 5.287 -25.017 13.881 650 HB THR 82 HB THR 82 6.467 -26.317 12.374 651 HG1 THR 82 HG1 THR 82 6.694 -27.785 13.878 652 HG21 THR 82 3HG2 THR 82 8.593 -24.490 12.931 653 HG22 THR 82 1HG2 THR 82 8.419 -25.603 11.575 654 HG23 THR 82 2HG2 THR 82 9.204 -26.139 13.060 655 H ALA 83 H ALA 83 8.684 -24.357 14.763 656 HA ALA 83 HA ALA 83 9.630 -23.892 16.798 657 HB1 ALA 83 1HB ALA 83 7.265 -22.796 17.165 658 HB2 ALA 83 2HB ALA 83 7.054 -24.161 18.262 659 HB3 ALA 83 3HB ALA 83 8.383 -23.028 18.509 660 H HIS 84 H HIS 84 6.905 -26.114 17.424 661 HA HIS 84 HA HIS 84 8.290 -27.744 19.237 662 HB2 HIS 84 2HB HIS 84 6.464 -29.275 19.046 663 HB3 HIS 84 3HB HIS 84 5.793 -27.653 18.902 664 HD1 HIS 84 HD1 HIS 84 5.736 -30.874 17.307 665 HD2 HIS 84 HD2 HIS 84 5.365 -26.935 16.042 666 HE1 HIS 84 HE1 HIS 84 4.645 -30.995 15.044 667 H SER 85 H SER 85 7.906 -30.355 18.325 668 HA SER 85 HA SER 85 10.310 -31.006 17.193 669 HB2 SER 85 2HB SER 85 8.902 -33.085 16.295 670 HB3 SER 85 3HB SER 85 9.249 -32.873 18.011 671 HG SER 85 HG SER 85 6.876 -32.948 16.785 672 H ASP 86 H ASP 86 10.938 -29.756 15.470 673 HA ASP 86 HA ASP 86 10.449 -30.618 12.903 674 HB2 ASP 86 2HB ASP 86 8.275 -29.056 13.847 675 HB3 ASP 86 3HB ASP 86 9.133 -28.089 12.651 676 H LEU 87 H LEU 87 11.214 -27.927 14.997 677 HA LEU 87 HA LEU 87 12.653 -26.393 13.092 678 HB2 LEU 87 2HB LEU 87 12.027 -26.266 15.894 679 HB3 LEU 87 3HB LEU 87 13.728 -25.885 15.634 680 HG LEU 87 HG LEU 87 13.188 -24.027 14.255 681 HD11 LEU 87 1HD1 LEU 87 10.744 -23.471 13.842 682 HD12 LEU 87 2HD1 LEU 87 10.398 -25.139 14.296 683 HD13 LEU 87 3HD1 LEU 87 11.428 -24.799 12.905 684 HD21 LEU 87 3HD2 LEU 87 13.061 -23.337 16.471 685 HD22 LEU 87 1HD2 LEU 87 11.575 -24.239 16.770 686 HD23 LEU 87 2HD2 LEU 87 11.535 -22.775 15.788 687 H ASP 88 H ASP 88 13.613 -28.820 15.484 688 HA ASP 88 HA ASP 88 16.347 -28.666 15.350 689 HB2 ASP 88 2HB ASP 88 14.595 -30.387 16.511 690 HB3 ASP 88 3HB ASP 88 15.285 -31.421 15.263 691 H ALA 89 H ALA 89 14.136 -29.974 12.976 692 HA ALA 89 HA ALA 89 16.279 -31.075 11.358 693 HB1 ALA 89 1HB ALA 89 13.509 -31.542 11.601 694 HB2 ALA 89 2HB ALA 89 13.795 -30.977 9.955 695 HB3 ALA 89 3HB ALA 89 14.669 -32.380 10.570 696 H ALA 90 H ALA 90 14.080 -28.321 11.329 697 HA ALA 90 HA ALA 90 14.799 -27.389 8.741 698 HB1 ALA 90 1HB ALA 90 12.773 -26.541 9.398 699 HB2 ALA 90 2HB ALA 90 13.304 -26.259 11.057 700 HB3 ALA 90 3HB ALA 90 13.831 -25.178 9.767 701 H VAL 91 H VAL 91 16.240 -27.126 11.865 702 HA VAL 91 HA VAL 91 17.667 -24.765 11.710 703 HB VAL 91 HB VAL 91 18.502 -27.398 12.928 704 HG11 VAL 91 1HG1 VAL 91 19.821 -24.719 12.920 705 HG12 VAL 91 2HG1 VAL 91 19.959 -25.759 14.339 706 HG13 VAL 91 3HG1 VAL 91 20.537 -26.323 12.770 707 HG21 VAL 91 3HG2 VAL 91 16.609 -25.401 13.679 708 HG22 VAL 91 1HG2 VAL 91 17.038 -26.893 14.518 709 HG23 VAL 91 2HG2 VAL 91 17.927 -25.407 14.851 710 H SER 92 H SER 92 18.813 -27.996 10.719 711 HA SER 92 HA SER 92 21.059 -26.809 9.318 712 HB2 SER 92 2HB SER 92 21.287 -28.926 10.634 713 HB3 SER 92 3HB SER 92 20.242 -29.720 9.456 714 HG SER 92 HG SER 92 22.660 -28.400 8.784 715 H ALA 93 H ALA 93 18.110 -28.605 8.546 716 HA ALA 93 HA ALA 93 18.521 -28.841 5.780 717 HB1 ALA 93 1HB ALA 93 16.072 -29.171 5.650 718 HB2 ALA 93 2HB ALA 93 16.839 -30.154 6.898 719 HB3 ALA 93 3HB ALA 93 15.948 -28.699 7.346 720 H TYR 94 H TYR 94 16.352 -26.548 7.452 721 HA TYR 94 HA TYR 94 15.803 -24.950 5.242 722 HB2 TYR 94 2HB TYR 94 14.815 -24.985 7.689 723 HB3 TYR 94 3HB TYR 94 15.992 -23.702 7.953 724 HD1 TYR 94 HD2 TYR 94 13.938 -24.428 4.931 725 HD2 TYR 94 HD1 TYR 94 14.713 -21.764 8.158 726 HE1 TYR 94 HE2 TYR 94 12.373 -22.800 3.955 727 HE2 TYR 94 HE1 TYR 94 13.150 -20.129 7.191 728 HH TYR 94 HH TYR 94 10.901 -20.812 4.995 729 H GLN 95 H GLN 95 18.659 -25.194 7.112 730 HA GLN 95 HA GLN 95 19.697 -22.586 6.652 731 HB2 GLN 95 2HB GLN 95 20.612 -25.077 7.860 732 HB3 GLN 95 3HB GLN 95 21.892 -24.247 6.985 733 HG2 GLN 95 2HG GLN 95 20.164 -22.812 8.967 734 HG3 GLN 95 3HG GLN 95 21.590 -23.722 9.465 735 HE21 GLN 95 1HE2 GLN 95 21.838 -21.296 10.166 736 HE22 GLN 95 2HE2 GLN 95 22.804 -20.345 9.095 737 H GLN 96 H GLN 96 18.930 -24.852 4.470 738 HA GLN 96 HA GLN 96 21.262 -24.895 2.819 739 HB2 GLN 96 2HB GLN 96 19.916 -26.044 1.216 740 HB3 GLN 96 3HB GLN 96 19.453 -26.638 2.806 741 HG2 GLN 96 2HG GLN 96 17.655 -24.688 2.556 742 HG3 GLN 96 3HG GLN 96 17.915 -25.046 0.850 743 HE21 GLN 96 1HE2 GLN 96 18.323 -27.735 0.883 744 HE22 GLN 96 2HE2 GLN 96 16.894 -28.544 1.418 745 H GLY 97 H GLY 97 20.124 -22.253 3.657 746 HA2 GLY 97 2HA GLY 97 20.621 -20.268 2.362 747 HA3 GLY 97 3HA GLY 97 19.983 -21.094 0.949 748 H ALA 98 H ALA 98 18.444 -21.111 4.103 749 HA ALA 98 HA ALA 98 16.208 -19.594 2.931 750 HB1 ALA 98 1HB ALA 98 16.003 -22.065 3.811 751 HB2 ALA 98 2HB ALA 98 15.846 -21.257 5.372 752 HB3 ALA 98 3HB ALA 98 14.711 -20.893 4.072 753 H PHE 99 H PHE 99 15.017 -18.166 4.352 754 HA PHE 99 HA PHE 99 16.786 -16.606 6.001 755 HB2 PHE 99 2HB PHE 99 15.294 -15.341 4.665 756 HB3 PHE 99 3HB PHE 99 13.906 -16.301 5.169 757 HD1 PHE 99 HD1 PHE 99 16.262 -13.669 6.162 758 HD2 PHE 99 HD2 PHE 99 12.763 -15.849 7.219 759 HE1 PHE 99 HE1 PHE 99 15.779 -12.028 7.930 760 HE2 PHE 99 HE2 PHE 99 12.273 -14.211 8.989 761 HZ PHE 99 HZ PHE 99 13.781 -12.297 9.346 762 H ASP 100 H ASP 100 16.509 -16.121 8.203 763 HA ASP 100 HA ASP 100 16.102 -18.167 9.947 764 HB2 ASP 100 2HB ASP 100 17.062 -15.912 10.492 765 HB3 ASP 100 3HB ASP 100 15.415 -15.292 10.580 766 H TYR 101 H TYR 101 14.397 -19.452 10.160 767 HA TYR 101 HA TYR 101 11.762 -18.746 9.430 768 HB2 TYR 101 2HB TYR 101 11.183 -20.895 10.703 769 HB3 TYR 101 3HB TYR 101 12.275 -21.043 9.330 770 HD1 TYR 101 HD1 TYR 101 12.727 -20.151 12.938 771 HD2 TYR 101 HD2 TYR 101 13.878 -22.653 9.695 772 HE1 TYR 101 HE1 TYR 101 14.385 -21.251 14.383 773 HE2 TYR 101 HE2 TYR 101 15.538 -23.761 11.132 774 HH TYR 101 HH TYR 101 16.753 -22.616 13.757 775 H LEU 102 H LEU 102 9.925 -19.241 11.122 776 HA LEU 102 HA LEU 102 10.523 -17.901 13.663 777 HB2 LEU 102 2HB LEU 102 9.629 -16.104 12.518 778 HB3 LEU 102 3HB LEU 102 8.514 -17.114 11.599 779 HG LEU 102 HG LEU 102 7.299 -17.464 13.833 780 HD11 LEU 102 1HD1 LEU 102 9.348 -15.483 14.567 781 HD12 LEU 102 2HD1 LEU 102 8.483 -16.650 15.565 782 HD13 LEU 102 3HD1 LEU 102 7.710 -15.131 15.115 783 HD21 LEU 102 3HD2 LEU 102 7.345 -14.989 12.168 784 HD22 LEU 102 1HD2 LEU 102 6.306 -15.057 13.593 785 HD23 LEU 102 2HD2 LEU 102 6.105 -16.238 12.298 786 HA PRO 103 HA PRO 103 8.279 -21.560 14.943 787 HB2 PRO 103 2HB PRO 103 8.718 -21.196 17.597 788 HB3 PRO 103 3HB PRO 103 9.937 -21.861 16.504 789 HG2 PRO 103 2HG PRO 103 9.646 -19.069 17.544 790 HG3 PRO 103 3HG PRO 103 11.112 -20.051 17.370 791 HD2 PRO 103 2HD PRO 103 10.426 -18.129 15.590 792 HD3 PRO 103 3HD PRO 103 11.297 -19.602 15.117 793 H LYS 104 H LYS 104 6.246 -21.924 15.738 794 HA LYS 104 HA LYS 104 4.761 -19.558 16.678 795 HB2 LYS 104 2HB LYS 104 2.742 -20.913 15.771 796 HB3 LYS 104 3HB LYS 104 3.775 -20.057 14.634 797 HG2 LYS 104 2HG LYS 104 4.747 -22.007 13.849 798 HG3 LYS 104 3HG LYS 104 4.298 -22.927 15.286 799 HD2 LYS 104 2HD LYS 104 2.035 -21.821 13.776 800 HD3 LYS 104 3HD LYS 104 2.984 -23.028 12.906 801 HE2 LYS 104 2HE LYS 104 2.151 -23.561 15.723 802 HE3 LYS 104 3HE LYS 104 0.976 -23.752 14.422 803 HZ1 LYS 104 3HZ LYS 104 3.214 -25.036 13.521 804 HZ2 LYS 104 1HZ LYS 104 1.827 -25.770 14.154 805 HZ3 LYS 104 2HZ LYS 104 3.148 -25.448 15.161 806 HA PRO 105 HA PRO 105 2.496 -19.370 17.263 807 HB2 PRO 105 2HB PRO 105 1.814 -18.207 19.620 808 HB3 PRO 105 3HB PRO 105 0.896 -19.537 18.904 809 HG2 PRO 105 2HG PRO 105 2.948 -19.609 21.081 810 HG3 PRO 105 3HG PRO 105 1.396 -20.461 20.978 811 HD2 PRO 105 2HD PRO 105 3.757 -21.663 20.418 812 HD3 PRO 105 3HD PRO 105 2.244 -22.101 19.598 813 H PHE 106 H PHE 106 2.680 -16.938 17.814 814 HA PHE 106 HA PHE 106 5.151 -16.112 19.045 815 HB2 PHE 106 2HB PHE 106 5.987 -14.985 16.960 816 HB3 PHE 106 3HB PHE 106 6.068 -16.743 16.921 817 HD1 PHE 106 HD1 PHE 106 3.751 -13.978 15.975 818 HD2 PHE 106 HD2 PHE 106 5.323 -17.821 15.036 819 HE1 PHE 106 HE1 PHE 106 2.471 -13.984 13.874 820 HE2 PHE 106 HE2 PHE 106 4.047 -17.832 12.933 821 HZ PHE 106 HZ PHE 106 2.619 -15.912 12.349 822 H ASP 107 H ASP 107 5.454 -13.608 18.204 823 HA ASP 107 HA ASP 107 2.901 -12.360 18.924 824 HB2 ASP 107 2HB ASP 107 5.632 -11.068 18.873 825 HB3 ASP 107 3HB ASP 107 4.171 -10.455 19.642 826 H ILE 108 H ILE 108 1.711 -11.620 17.305 827 HA ILE 108 HA ILE 108 2.373 -11.409 14.662 828 HB ILE 108 HB ILE 108 0.361 -9.865 16.278 829 HG12 ILE 108 2HG1 ILE 108 -0.257 -11.764 14.052 830 HG13 ILE 108 3HG1 ILE 108 0.276 -12.417 15.598 831 HG21 ILE 108 1HG2 ILE 108 0.812 -8.347 14.544 832 HG22 ILE 108 2HG2 ILE 108 0.978 -9.632 13.349 833 HG23 ILE 108 3HG2 ILE 108 -0.610 -9.240 14.007 834 HD11 ILE 108 3HD1 ILE 108 -2.307 -11.553 14.833 835 HD12 ILE 108 1HD1 ILE 108 -1.781 -12.234 16.372 836 HD13 ILE 108 2HD1 ILE 108 -1.731 -10.489 16.116 837 H ASP 109 H ASP 109 2.994 -9.098 17.214 838 HA ASP 109 HA ASP 109 3.620 -6.861 15.633 839 HB2 ASP 109 2HB ASP 109 3.309 -7.078 18.212 840 HB3 ASP 109 3HB ASP 109 5.035 -7.429 18.219 841 H GLU 110 H GLU 110 5.636 -9.512 16.843 842 HA GLU 110 HA GLU 110 8.025 -8.453 15.633 843 HB2 GLU 110 2HB GLU 110 7.933 -9.871 17.740 844 HB3 GLU 110 3HB GLU 110 7.619 -11.247 16.692 845 HG2 GLU 110 2HG GLU 110 9.743 -10.873 15.554 846 HG3 GLU 110 3HG GLU 110 10.060 -9.488 16.598 847 H ALA 111 H ALA 111 5.523 -10.722 14.784 848 HA ALA 111 HA ALA 111 6.902 -12.034 12.678 849 HB1 ALA 111 1HB ALA 111 5.115 -13.335 12.836 850 HB2 ALA 111 2HB ALA 111 4.321 -12.156 13.880 851 HB3 ALA 111 3HB ALA 111 4.131 -12.053 12.129 852 H VAL 112 H VAL 112 4.362 -9.526 12.589 853 HA VAL 112 HA VAL 112 4.336 -9.042 9.876 854 HB VAL 112 HB VAL 112 3.894 -7.145 12.176 855 HG11 VAL 112 1HG1 VAL 112 4.408 -5.616 10.529 856 HG12 VAL 112 2HG1 VAL 112 3.804 -6.649 9.232 857 HG13 VAL 112 3HG1 VAL 112 2.672 -5.814 10.296 858 HG21 VAL 112 3HG2 VAL 112 1.976 -8.482 10.268 859 HG22 VAL 112 1HG2 VAL 112 2.299 -8.995 11.924 860 HG23 VAL 112 2HG2 VAL 112 1.544 -7.431 11.617 861 H ALA 113 H ALA 113 6.631 -7.943 12.284 862 HA ALA 113 HA ALA 113 7.954 -6.120 10.477 863 HB1 ALA 113 1HB ALA 113 9.249 -7.022 12.995 864 HB2 ALA 113 2HB ALA 113 9.172 -5.414 12.274 865 HB3 ALA 113 3HB ALA 113 7.766 -6.073 13.111 866 H LEU 114 H LEU 114 8.443 -9.381 11.699 867 HA LEU 114 HA LEU 114 11.065 -9.815 10.873 868 HB2 LEU 114 2HB LEU 114 9.993 -11.407 12.275 869 HB3 LEU 114 3HB LEU 114 8.717 -11.682 11.092 870 HG LEU 114 HG LEU 114 10.576 -12.612 9.588 871 HD11 LEU 114 1HD1 LEU 114 12.495 -11.810 10.787 872 HD12 LEU 114 2HD1 LEU 114 12.481 -13.572 10.854 873 HD13 LEU 114 3HD1 LEU 114 11.974 -12.632 12.258 874 HD21 LEU 114 3HD2 LEU 114 10.591 -14.711 11.339 875 HD22 LEU 114 1HD2 LEU 114 9.307 -14.356 10.183 876 HD23 LEU 114 2HD2 LEU 114 9.166 -13.806 11.854 877 H VAL 115 H VAL 115 8.031 -10.270 9.089 878 HA VAL 115 HA VAL 115 9.228 -11.266 6.724 879 HB VAL 115 HB VAL 115 6.866 -11.622 7.156 880 HG11 VAL 115 1HG1 VAL 115 6.520 -8.650 6.777 881 HG12 VAL 115 2HG1 VAL 115 5.241 -9.830 7.075 882 HG13 VAL 115 3HG1 VAL 115 6.440 -9.492 8.324 883 HG21 VAL 115 3HG2 VAL 115 6.619 -11.789 4.956 884 HG22 VAL 115 1HG2 VAL 115 6.311 -10.055 4.851 885 HG23 VAL 115 2HG2 VAL 115 7.960 -10.668 4.719 886 H GLU 116 H GLU 116 8.409 -8.023 7.834 887 HA GLU 116 HA GLU 116 8.745 -6.619 5.453 888 HB2 GLU 116 2HB GLU 116 8.271 -5.974 8.119 889 HB3 GLU 116 3HB GLU 116 9.790 -5.171 7.747 890 HG2 GLU 116 2HG GLU 116 8.209 -4.603 5.561 891 HG3 GLU 116 3HG GLU 116 7.090 -4.522 6.920 892 H ARG 117 H ARG 117 11.090 -8.027 7.589 893 HA ARG 117 HA ARG 117 13.350 -6.541 6.758 894 HB2 ARG 117 2HB ARG 117 13.448 -9.394 7.712 895 HB3 ARG 117 3HB ARG 117 14.651 -8.128 7.926 896 HG2 ARG 117 2HG ARG 117 12.346 -7.148 9.147 897 HG3 ARG 117 3HG ARG 117 12.429 -8.851 9.603 898 HD2 ARG 117 2HD ARG 117 13.761 -8.025 11.238 899 HD3 ARG 117 3HD ARG 117 14.988 -8.184 9.983 900 HE ARG 117 HE ARG 117 13.947 -5.670 9.654 901 HH11 ARG 117 1HH1 ARG 117 15.487 -7.416 12.242 902 HH12 ARG 117 2HH1 ARG 117 16.188 -6.001 12.954 903 HH21 ARG 117 1HH2 ARG 117 14.865 -3.799 10.582 904 HH22 ARG 117 2HH2 ARG 117 15.833 -3.944 12.010 905 H ALA 118 H ALA 118 11.910 -9.568 5.632 906 HA ALA 118 HA ALA 118 13.954 -10.107 3.711 907 HB1 ALA 118 1HB ALA 118 12.978 -12.095 3.850 908 HB2 ALA 118 2HB ALA 118 11.585 -11.405 4.684 909 HB3 ALA 118 3HB ALA 118 11.625 -11.448 2.921 910 H ILE 119 H ILE 119 10.811 -8.518 3.628 911 HA ILE 119 HA ILE 119 10.715 -8.243 0.791 912 HB ILE 119 HB ILE 119 9.245 -6.646 2.891 913 HG12 ILE 119 2HG1 ILE 119 8.465 -9.162 1.403 914 HG13 ILE 119 3HG1 ILE 119 8.788 -9.026 3.128 915 HG21 ILE 119 1HG2 ILE 119 9.304 -5.596 0.664 916 HG22 ILE 119 2HG2 ILE 119 8.611 -7.062 -0.026 917 HG23 ILE 119 3HG2 ILE 119 7.680 -6.104 1.125 918 HD11 ILE 119 3HD1 ILE 119 6.626 -8.687 3.426 919 HD12 ILE 119 1HD1 ILE 119 6.802 -7.142 2.594 920 HD13 ILE 119 2HD1 ILE 119 6.351 -8.585 1.687 921 H SER 120 H SER 120 11.461 -5.969 3.429 922 HA SER 120 HA SER 120 12.070 -3.772 1.790 923 HB2 SER 120 2HB SER 120 12.870 -4.504 4.604 924 HB3 SER 120 3HB SER 120 13.407 -3.006 3.844 925 HG SER 120 HG SER 120 11.215 -3.290 5.117 926 H HIS 121 H HIS 121 13.785 -6.654 2.393 927 HA HIS 121 HA HIS 121 16.444 -5.829 2.156 928 HB2 HIS 121 2HB HIS 121 15.570 -8.141 2.766 929 HB3 HIS 121 3HB HIS 121 15.356 -8.413 1.039 930 HD1 HIS 121 HD1 HIS 121 17.461 -8.822 -0.365 931 HD2 HIS 121 HD2 HIS 121 18.249 -8.070 3.645 932 HE1 HIS 121 HE1 HIS 121 19.881 -9.419 -0.031 933 H TYR 122 H TYR 122 13.930 -5.975 -0.181 934 HA TYR 122 HA TYR 122 15.826 -5.126 -2.249 935 HB2 TYR 122 2HB TYR 122 14.299 -6.495 -3.867 936 HB3 TYR 122 3HB TYR 122 15.570 -7.317 -2.969 937 HD1 TYR 122 HD1 TYR 122 11.959 -6.417 -2.601 938 HD2 TYR 122 HD2 TYR 122 15.026 -9.277 -1.879 939 HE1 TYR 122 HE1 TYR 122 10.290 -7.961 -1.665 940 HE2 TYR 122 HE2 TYR 122 13.365 -10.830 -0.942 941 HH TYR 122 HH TYR 122 10.909 -10.410 0.230 942 H GLN 123 H GLN 123 14.272 -3.421 -0.759 943 HA GLN 123 HA GLN 123 12.937 -1.938 -2.720 944 HB2 GLN 123 2HB GLN 123 11.348 -4.022 -1.632 945 HB3 GLN 123 3HB GLN 123 10.732 -2.506 -0.988 946 HG2 GLN 123 2HG GLN 123 10.275 -1.657 -3.131 947 HG3 GLN 123 3HG GLN 123 11.234 -2.911 -3.917 948 HE21 GLN 123 1HE2 GLN 123 10.424 -5.206 -3.178 949 HE22 GLN 123 2HE2 GLN 123 8.722 -5.443 -3.357 950 H GLU 124 H GLU 124 13.271 -2.712 0.689 951 HA GLU 124 HA GLU 124 13.364 -1.419 2.564 952 HB2 GLU 124 2HB GLU 124 15.097 -0.345 0.652 953 HB3 GLU 124 3HB GLU 124 14.241 1.043 1.310 954 HG2 GLU 124 2HG GLU 124 15.601 -1.020 3.019 955 HG3 GLU 124 3HG GLU 124 16.391 0.450 2.451 Start of MODEL 4 1 H1 MET 1 H MET 1 0.516 0.050 2.570 2 HA MET 1 HA MET 1 0.797 0.289 -0.351 3 HB2 MET 1 2HB MET 1 2.155 2.005 0.782 4 HB3 MET 1 3HB MET 1 2.967 0.747 1.705 5 HG2 MET 1 2HG MET 1 4.084 -0.074 -0.173 6 HG3 MET 1 3HG MET 1 3.003 0.758 -1.289 7 HE1 MET 1 3HE MET 1 6.907 1.954 -1.171 8 HE2 MET 1 1HE MET 1 6.657 1.207 0.407 9 HE3 MET 1 2HE MET 1 6.069 0.406 -1.049 10 H GLN 2 H GLN 2 0.402 -1.819 -0.858 11 HA GLN 2 HA GLN 2 1.761 -3.940 0.596 12 HB2 GLN 2 2HB GLN 2 0.475 -5.441 -0.936 13 HB3 GLN 2 3HB GLN 2 -0.529 -4.377 0.040 14 HG2 GLN 2 2HG GLN 2 0.101 -3.109 -2.450 15 HG3 GLN 2 3HG GLN 2 -0.569 -4.713 -2.738 16 HE21 GLN 2 1HE2 GLN 2 -2.587 -5.217 -1.545 17 HE22 GLN 2 2HE2 GLN 2 -3.747 -3.951 -1.354 18 H ARG 3 H ARG 3 3.783 -2.688 -0.326 19 HA ARG 3 HA ARG 3 4.531 -3.074 -3.013 20 HB2 ARG 3 2HB ARG 3 6.649 -2.295 -2.399 21 HB3 ARG 3 3HB ARG 3 5.573 -1.527 -1.240 22 HG2 ARG 3 2HG ARG 3 7.074 -4.068 -0.667 23 HG3 ARG 3 3HG ARG 3 7.694 -2.459 -0.291 24 HD2 ARG 3 2HD ARG 3 5.115 -3.635 0.740 25 HD3 ARG 3 3HD ARG 3 6.620 -3.509 1.650 26 HE ARG 3 HE ARG 3 5.634 -1.004 0.615 27 HH11 ARG 3 1HH1 ARG 3 5.583 -3.255 3.271 28 HH12 ARG 3 2HH1 ARG 3 5.102 -2.068 4.438 29 HH21 ARG 3 1HH2 ARG 3 5.000 0.567 2.142 30 HH22 ARG 3 2HH2 ARG 3 4.769 0.105 3.795 31 H GLY 4 H GLY 4 4.556 -5.177 -0.260 32 HA2 GLY 4 2HA GLY 4 5.740 -7.282 -1.951 33 HA3 GLY 4 3HA GLY 4 6.297 -7.055 -0.300 34 H ILE 5 H ILE 5 4.283 -8.828 -2.217 35 HA ILE 5 HA ILE 5 2.114 -9.183 -0.349 36 HB ILE 5 HB ILE 5 2.836 -10.663 -2.877 37 HG12 ILE 5 2HG1 ILE 5 0.414 -8.945 -2.435 38 HG13 ILE 5 3HG1 ILE 5 1.958 -8.208 -2.852 39 HG21 ILE 5 1HG2 ILE 5 1.654 -12.296 -1.792 40 HG22 ILE 5 2HG2 ILE 5 0.714 -11.142 -0.848 41 HG23 ILE 5 3HG2 ILE 5 0.335 -11.405 -2.550 42 HD11 ILE 5 3HD1 ILE 5 1.607 -10.290 -4.677 43 HD12 ILE 5 1HD1 ILE 5 0.036 -9.500 -4.540 44 HD13 ILE 5 2HD1 ILE 5 1.463 -8.558 -4.976 45 H VAL 6 H VAL 6 1.755 -10.902 1.001 46 HA VAL 6 HA VAL 6 3.950 -12.852 1.267 47 HB VAL 6 HB VAL 6 2.306 -11.871 3.591 48 HG11 VAL 6 1HG1 VAL 6 4.634 -12.640 4.640 49 HG12 VAL 6 2HG1 VAL 6 3.302 -13.763 4.358 50 HG13 VAL 6 3HG1 VAL 6 4.632 -13.664 3.204 51 HG21 VAL 6 3HG2 VAL 6 4.759 -10.689 2.361 52 HG22 VAL 6 1HG2 VAL 6 3.336 -9.885 3.024 53 HG23 VAL 6 2HG2 VAL 6 4.527 -10.604 4.108 54 H TRP 7 H TRP 7 3.300 -14.853 0.877 55 HA TRP 7 HA TRP 7 0.458 -15.514 1.192 56 HB2 TRP 7 2HB TRP 7 2.671 -16.838 -0.382 57 HB3 TRP 7 3HB TRP 7 1.065 -17.535 -0.194 58 HD1 TRP 7 HD1 TRP 7 0.315 -14.049 -0.449 59 HE1 TRP 7 HE1 TRP 7 -0.211 -13.333 -2.865 60 HE3 TRP 7 HE3 TRP 7 2.198 -18.106 -2.926 61 HZ2 TRP 7 HZ2 TRP 7 0.127 -14.354 -5.475 62 HZ3 TRP 7 HZ3 TRP 7 2.056 -18.158 -5.382 63 HH2 TRP 7 HH2 TRP 7 1.041 -16.321 -6.628 64 H VAL 8 H VAL 8 -0.179 -17.466 2.216 65 HA VAL 8 HA VAL 8 1.829 -18.861 3.812 66 HB VAL 8 HB VAL 8 -0.667 -17.846 5.151 67 HG11 VAL 8 1HG1 VAL 8 1.576 -18.221 6.870 68 HG12 VAL 8 2HG1 VAL 8 0.037 -19.085 6.853 69 HG13 VAL 8 3HG1 VAL 8 1.382 -19.657 5.866 70 HG21 VAL 8 3HG2 VAL 8 0.971 -16.195 6.251 71 HG22 VAL 8 1HG2 VAL 8 1.993 -16.497 4.845 72 HG23 VAL 8 2HG2 VAL 8 0.376 -15.824 4.632 73 H VAL 9 H VAL 9 1.233 -20.941 4.440 74 HA VAL 9 HA VAL 9 -1.411 -21.907 3.641 75 HB VAL 9 HB VAL 9 0.061 -22.306 1.706 76 HG11 VAL 9 1HG1 VAL 9 1.639 -24.118 3.524 77 HG12 VAL 9 2HG1 VAL 9 1.954 -23.764 1.825 78 HG13 VAL 9 3HG1 VAL 9 2.161 -22.505 3.042 79 HG21 VAL 9 3HG2 VAL 9 -1.117 -24.151 1.307 80 HG22 VAL 9 1HG2 VAL 9 -0.190 -25.064 2.498 81 HG23 VAL 9 2HG2 VAL 9 -1.604 -24.138 3.002 82 H ASP 10 H ASP 10 -2.252 -23.188 5.148 83 HA ASP 10 HA ASP 10 -0.534 -24.900 6.757 84 HB2 ASP 10 2HB ASP 10 -1.448 -24.105 8.879 85 HB3 ASP 10 3HB ASP 10 -0.640 -22.792 8.027 86 H ASP 11 H ASP 11 -2.284 -25.834 8.586 87 HA ASP 11 HA ASP 11 -4.571 -26.798 6.998 88 HB2 ASP 11 2HB ASP 11 -2.391 -28.315 7.949 89 HB3 ASP 11 3HB ASP 11 -3.763 -28.730 8.973 90 H ASP 12 H ASP 12 -4.075 -24.734 9.230 91 HA ASP 12 HA ASP 12 -6.189 -25.715 11.036 92 HB2 ASP 12 2HB ASP 12 -3.581 -24.626 11.626 93 HB3 ASP 12 3HB ASP 12 -4.840 -23.613 12.327 94 H SER 13 H SER 13 -7.698 -24.151 11.816 95 HA SER 13 HA SER 13 -8.456 -22.254 9.807 96 HB2 SER 13 2HB SER 13 -9.844 -23.694 11.667 97 HB3 SER 13 3HB SER 13 -9.821 -22.097 12.415 98 HG SER 13 HG SER 13 -10.880 -21.263 10.687 99 H SER 14 H SER 14 -7.464 -21.991 13.215 100 HA SER 14 HA SER 14 -7.457 -19.155 13.247 101 HB2 SER 14 2HB SER 14 -6.119 -19.457 15.364 102 HB3 SER 14 3HB SER 14 -7.657 -20.319 15.336 103 HG SER 14 HG SER 14 -5.470 -21.402 15.949 104 H ILE 15 H ILE 15 -4.891 -21.573 12.860 105 HA ILE 15 HA ILE 15 -2.661 -19.976 12.827 106 HB ILE 15 HB ILE 15 -3.245 -22.363 11.073 107 HG12 ILE 15 2HG1 ILE 15 -3.328 -22.857 13.459 108 HG13 ILE 15 3HG1 ILE 15 -1.884 -23.569 12.747 109 HG21 ILE 15 1HG2 ILE 15 -0.637 -20.956 11.622 110 HG22 ILE 15 2HG2 ILE 15 -0.782 -22.533 10.847 111 HG23 ILE 15 3HG2 ILE 15 -1.459 -21.103 10.068 112 HD11 ILE 15 3HD1 ILE 15 -0.646 -21.520 13.562 113 HD12 ILE 15 1HD1 ILE 15 -2.089 -21.149 14.504 114 HD13 ILE 15 2HD1 ILE 15 -1.208 -22.649 14.794 115 H ARG 16 H ARG 16 -4.861 -20.646 10.122 116 HA ARG 16 HA ARG 16 -3.408 -18.936 8.320 117 HB2 ARG 16 2HB ARG 16 -4.788 -19.729 6.677 118 HB3 ARG 16 3HB ARG 16 -4.973 -21.026 7.850 119 HG2 ARG 16 2HG ARG 16 -6.966 -19.519 8.689 120 HG3 ARG 16 3HG ARG 16 -6.893 -18.916 7.032 121 HD2 ARG 16 2HD ARG 16 -7.091 -21.218 6.201 122 HD3 ARG 16 3HD ARG 16 -7.192 -21.801 7.862 123 HE ARG 16 HE ARG 16 -9.209 -19.997 7.699 124 HH11 ARG 16 1HH1 ARG 16 -8.295 -22.772 5.805 125 HH12 ARG 16 2HH1 ARG 16 -9.920 -23.152 5.340 126 HH21 ARG 16 1HH2 ARG 16 -11.353 -20.488 7.094 127 HH22 ARG 16 2HH2 ARG 16 -11.659 -21.852 6.073 128 H TRP 17 H TRP 17 -5.975 -18.578 10.594 129 HA TRP 17 HA TRP 17 -7.149 -16.235 9.475 130 HB2 TRP 17 2HB TRP 17 -8.541 -17.413 10.956 131 HB3 TRP 17 3HB TRP 17 -7.275 -17.560 12.172 132 HD1 TRP 17 HD1 TRP 17 -9.670 -14.915 10.696 133 HE1 TRP 17 HE1 TRP 17 -10.045 -13.092 12.474 134 HE3 TRP 17 HE3 TRP 17 -6.364 -16.544 14.239 135 HZ2 TRP 17 HZ2 TRP 17 -9.068 -12.432 15.038 136 HZ3 TRP 17 HZ3 TRP 17 -6.144 -15.260 16.326 137 HH2 TRP 17 HH2 TRP 17 -7.468 -13.246 16.715 138 H VAL 18 H VAL 18 -5.279 -16.578 12.496 139 HA VAL 18 HA VAL 18 -4.774 -13.908 12.945 140 HB VAL 18 HB VAL 18 -4.156 -15.278 14.707 141 HG11 VAL 18 1HG1 VAL 18 -3.881 -17.432 14.158 142 HG12 VAL 18 2HG1 VAL 18 -3.183 -17.039 12.585 143 HG13 VAL 18 3HG1 VAL 18 -2.169 -17.027 14.028 144 HG21 VAL 18 3HG2 VAL 18 -1.419 -14.895 13.554 145 HG22 VAL 18 1HG2 VAL 18 -2.412 -13.506 13.999 146 HG23 VAL 18 2HG2 VAL 18 -1.965 -14.699 15.220 147 H LEU 19 H LEU 19 -2.964 -16.173 10.923 148 HA LEU 19 HA LEU 19 -0.819 -14.444 10.314 149 HB2 LEU 19 2HB LEU 19 -1.897 -16.980 9.263 150 HB3 LEU 19 3HB LEU 19 -0.920 -16.034 8.142 151 HG LEU 19 HG LEU 19 0.061 -16.817 10.877 152 HD11 LEU 19 1HD1 LEU 19 0.353 -18.912 10.223 153 HD12 LEU 19 2HD1 LEU 19 1.277 -18.361 8.826 154 HD13 LEU 19 3HD1 LEU 19 -0.472 -18.554 8.706 155 HD21 LEU 19 3HD2 LEU 19 1.260 -14.996 9.840 156 HD22 LEU 19 1HD2 LEU 19 1.435 -15.919 8.347 157 HD23 LEU 19 2HD2 LEU 19 2.259 -16.450 9.813 158 H GLU 20 H GLU 20 -4.066 -14.601 9.188 159 HA GLU 20 HA GLU 20 -3.566 -13.162 6.734 160 HB2 GLU 20 2HB GLU 20 -5.621 -14.777 7.659 161 HB3 GLU 20 3HB GLU 20 -6.326 -13.167 7.675 162 HG2 GLU 20 2HG GLU 20 -4.832 -13.925 5.246 163 HG3 GLU 20 3HG GLU 20 -6.354 -14.767 5.537 164 H ARG 21 H ARG 21 -5.552 -12.420 9.607 165 HA ARG 21 HA ARG 21 -5.890 -9.708 9.061 166 HB2 ARG 21 2HB ARG 21 -6.407 -9.490 11.492 167 HB3 ARG 21 3HB ARG 21 -7.274 -10.796 10.697 168 HG2 ARG 21 2HG ARG 21 -6.111 -12.431 11.804 169 HG3 ARG 21 3HG ARG 21 -4.701 -11.402 12.065 170 HD2 ARG 21 2HD ARG 21 -7.355 -10.927 13.402 171 HD3 ARG 21 3HD ARG 21 -6.088 -11.928 14.110 172 HE ARG 21 HE ARG 21 -4.870 -9.546 13.514 173 HH11 ARG 21 1HH1 ARG 21 -7.593 -10.546 15.440 174 HH12 ARG 21 2HH1 ARG 21 -7.421 -9.258 16.587 175 HH21 ARG 21 1HH2 ARG 21 -4.634 -7.846 15.017 176 HH22 ARG 21 2HH2 ARG 21 -5.738 -7.722 16.344 177 H ALA 22 H ALA 22 -3.152 -11.408 10.255 178 HA ALA 22 HA ALA 22 -1.808 -9.546 11.775 179 HB1 ALA 22 1HB ALA 22 -0.919 -11.718 9.941 180 HB2 ALA 22 2HB ALA 22 0.284 -10.606 10.597 181 HB3 ALA 22 3HB ALA 22 -0.721 -11.562 11.687 182 H LEU 23 H LEU 23 -1.372 -9.995 8.258 183 HA LEU 23 HA LEU 23 -0.089 -7.408 8.050 184 HB2 LEU 23 2HB LEU 23 -0.864 -9.137 5.731 185 HB3 LEU 23 3HB LEU 23 0.474 -7.998 5.864 186 HG LEU 23 HG LEU 23 0.267 -10.767 7.020 187 HD11 LEU 23 1HD1 LEU 23 2.245 -11.183 5.726 188 HD12 LEU 23 2HD1 LEU 23 2.344 -9.489 5.251 189 HD13 LEU 23 3HD1 LEU 23 1.013 -10.490 4.672 190 HD21 LEU 23 3HD2 LEU 23 1.748 -8.456 8.014 191 HD22 LEU 23 1HD2 LEU 23 2.766 -9.856 7.674 192 HD23 LEU 23 2HD2 LEU 23 1.406 -10.004 8.787 193 H ALA 24 H ALA 24 -3.222 -8.775 7.579 194 HA ALA 24 HA ALA 24 -4.354 -7.066 5.711 195 HB1 ALA 24 1HB ALA 24 -5.933 -7.918 8.098 196 HB2 ALA 24 2HB ALA 24 -6.408 -7.853 6.400 197 HB3 ALA 24 3HB ALA 24 -5.331 -9.130 6.966 198 H GLY 25 H GLY 25 -3.689 -6.547 9.123 199 HA2 GLY 25 2HA GLY 25 -5.106 -4.011 9.154 200 HA3 GLY 25 3HA GLY 25 -4.228 -4.735 10.494 201 H ALA 26 H ALA 26 -2.141 -4.979 8.031 202 HA ALA 26 HA ALA 26 -0.766 -2.516 8.814 203 HB1 ALA 26 1HB ALA 26 0.764 -4.186 9.093 204 HB2 ALA 26 2HB ALA 26 0.113 -5.156 7.771 205 HB3 ALA 26 3HB ALA 26 1.111 -3.745 7.421 206 H GLY 27 H GLY 27 -0.651 -4.350 5.770 207 HA2 GLY 27 2HA GLY 27 -2.027 -2.766 4.051 208 HA3 GLY 27 3HA GLY 27 -0.516 -1.894 4.261 209 H LEU 28 H LEU 28 -0.929 -5.398 4.222 210 HA LEU 28 HA LEU 28 0.316 -5.524 1.576 211 HB2 LEU 28 2HB LEU 28 1.338 -7.487 3.510 212 HB3 LEU 28 3HB LEU 28 2.170 -6.631 2.214 213 HG LEU 28 HG LEU 28 1.458 -5.335 4.837 214 HD11 LEU 28 1HD1 LEU 28 3.262 -6.180 5.847 215 HD12 LEU 28 2HD1 LEU 28 4.256 -6.040 4.398 216 HD13 LEU 28 3HD1 LEU 28 3.197 -7.434 4.608 217 HD21 LEU 28 3HD2 LEU 28 3.747 -4.221 3.695 218 HD22 LEU 28 1HD2 LEU 28 2.135 -3.511 3.767 219 HD23 LEU 28 2HD2 LEU 28 2.622 -4.449 2.355 220 H THR 29 H THR 29 -0.367 -7.196 0.333 221 HA THR 29 HA THR 29 -2.767 -8.465 0.843 222 HB THR 29 HB THR 29 -0.637 -9.677 -0.914 223 HG1 THR 29 HG1 THR 29 -2.456 -7.628 -1.680 224 HG21 THR 29 3HG2 THR 29 -2.446 -11.101 -0.999 225 HG22 THR 29 1HG2 THR 29 -2.841 -9.989 -2.309 226 HG23 THR 29 2HG2 THR 29 -3.614 -9.807 -0.734 227 H CYS 30 H CYS 30 -3.243 -10.752 1.152 228 HA CYS 30 HA CYS 30 -1.199 -12.373 2.425 229 HB2 CYS 30 2HB CYS 30 -2.857 -10.788 4.012 230 HB3 CYS 30 3HB CYS 30 -3.583 -12.389 4.085 231 HG CYS 30 HG CYS 30 -1.298 -13.654 5.039 232 H THR 31 H THR 31 -1.414 -14.022 1.011 233 HA THR 31 HA THR 31 -4.089 -15.057 0.421 234 HB THR 31 HB THR 31 -1.502 -16.023 -0.790 235 HG1 THR 31 HG1 THR 31 -3.155 -13.832 -1.539 236 HG21 THR 31 3HG2 THR 31 -4.289 -16.009 -1.937 237 HG22 THR 31 1HG2 THR 31 -3.626 -17.366 -1.028 238 HG23 THR 31 2HG2 THR 31 -2.873 -16.867 -2.543 239 H THR 32 H THR 32 -4.845 -16.577 1.730 240 HA THR 32 HA THR 32 -2.964 -18.382 3.076 241 HB THR 32 HB THR 32 -4.639 -18.829 4.692 242 HG1 THR 32 HG1 THR 32 -6.695 -18.768 4.197 243 HG21 THR 32 3HG2 THR 32 -5.352 -15.986 4.311 244 HG22 THR 32 1HG2 THR 32 -3.629 -16.351 4.388 245 HG23 THR 32 2HG2 THR 32 -4.687 -16.809 5.722 246 H PHE 33 H PHE 33 -2.804 -20.452 2.507 247 HA PHE 33 HA PHE 33 -4.858 -21.556 0.708 248 HB2 PHE 33 2HB PHE 33 -1.917 -22.222 0.937 249 HB3 PHE 33 3HB PHE 33 -3.056 -23.098 -0.081 250 HD1 PHE 33 HD1 PHE 33 -1.322 -19.896 0.418 251 HD2 PHE 33 HD2 PHE 33 -3.798 -22.207 -2.160 252 HE1 PHE 33 HE1 PHE 33 -0.925 -18.287 -1.400 253 HE2 PHE 33 HE2 PHE 33 -3.404 -20.602 -3.982 254 HZ PHE 33 HZ PHE 33 -1.966 -18.639 -3.604 255 H GLU 34 H GLU 34 -4.336 -24.193 0.790 256 HA GLU 34 HA GLU 34 -4.061 -25.181 3.468 257 HB2 GLU 34 2HB GLU 34 -6.402 -26.208 3.440 258 HB3 GLU 34 3HB GLU 34 -6.282 -24.495 3.816 259 HG2 GLU 34 2HG GLU 34 -6.728 -25.293 0.990 260 HG3 GLU 34 3HG GLU 34 -8.071 -25.412 2.126 261 H ASN 35 H ASN 35 -2.422 -26.138 1.921 262 HA ASN 35 HA ASN 35 -2.980 -28.836 1.487 263 HB2 ASN 35 2HB ASN 35 -3.878 -27.142 -0.644 264 HB3 ASN 35 3HB ASN 35 -2.542 -28.131 -1.225 265 HD21 ASN 35 1HD2 ASN 35 -3.958 -29.259 -2.583 266 HD22 ASN 35 2HD2 ASN 35 -5.036 -30.460 -1.967 267 H GLY 36 H GLY 36 -1.083 -26.020 0.610 268 HA2 GLY 36 2HA GLY 36 1.244 -25.850 0.963 269 HA3 GLY 36 3HA GLY 36 1.347 -27.604 0.981 270 H ASN 37 H ASN 37 0.601 -28.580 -1.242 271 HA ASN 37 HA ASN 37 2.476 -27.643 -3.169 272 HB2 ASN 37 2HB ASN 37 1.930 -30.030 -2.928 273 HB3 ASN 37 3HB ASN 37 0.280 -29.707 -3.453 274 HD21 ASN 37 1HD2 ASN 37 3.592 -29.028 -4.539 275 HD22 ASN 37 2HD2 ASN 37 3.309 -29.427 -6.197 276 H GLU 38 H GLU 38 -0.809 -26.936 -2.514 277 HA GLU 38 HA GLU 38 -1.599 -26.165 -5.141 278 HB2 GLU 38 2HB GLU 38 -2.881 -26.514 -2.711 279 HB3 GLU 38 3HB GLU 38 -2.973 -24.778 -2.972 280 HG2 GLU 38 2HG GLU 38 -4.917 -25.582 -3.939 281 HG3 GLU 38 3HG GLU 38 -3.831 -25.370 -5.311 282 H VAL 39 H VAL 39 0.394 -24.738 -2.789 283 HA VAL 39 HA VAL 39 -0.041 -22.014 -3.718 284 HB VAL 39 HB VAL 39 2.107 -22.891 -1.802 285 HG11 VAL 39 1HG1 VAL 39 0.722 -20.376 -1.336 286 HG12 VAL 39 2HG1 VAL 39 2.450 -20.711 -1.463 287 HG13 VAL 39 3HG1 VAL 39 1.492 -20.447 -2.920 288 HG21 VAL 39 3HG2 VAL 39 0.502 -23.649 -0.442 289 HG22 VAL 39 1HG2 VAL 39 0.048 -21.957 -0.237 290 HG23 VAL 39 2HG2 VAL 39 -0.783 -22.955 -1.431 291 H LEU 40 H LEU 40 2.332 -24.588 -3.975 292 HA LEU 40 HA LEU 40 4.516 -23.254 -4.986 293 HB2 LEU 40 2HB LEU 40 4.972 -25.459 -4.681 294 HB3 LEU 40 3HB LEU 40 3.405 -25.980 -5.297 295 HG LEU 40 HG LEU 40 4.177 -25.652 -7.583 296 HD11 LEU 40 1HD1 LEU 40 6.981 -25.378 -7.144 297 HD12 LEU 40 2HD1 LEU 40 6.140 -24.043 -6.357 298 HD13 LEU 40 3HD1 LEU 40 5.896 -24.347 -8.077 299 HD21 LEU 40 3HD2 LEU 40 4.876 -27.682 -5.904 300 HD22 LEU 40 1HD2 LEU 40 6.440 -27.204 -6.563 301 HD23 LEU 40 2HD2 LEU 40 5.134 -27.678 -7.649 302 H ALA 41 H ALA 41 1.630 -24.349 -6.717 303 HA ALA 41 HA ALA 41 2.554 -23.494 -9.281 304 HB1 ALA 41 1HB ALA 41 0.839 -25.279 -8.879 305 HB2 ALA 41 2HB ALA 41 -0.301 -23.996 -8.468 306 HB3 ALA 41 3HB ALA 41 0.394 -24.074 -10.088 307 H ALA 42 H ALA 42 0.859 -21.990 -6.645 308 HA ALA 42 HA ALA 42 -0.338 -19.847 -8.005 309 HB1 ALA 42 1HB ALA 42 -0.541 -18.785 -5.867 310 HB2 ALA 42 2HB ALA 42 -0.813 -20.515 -5.655 311 HB3 ALA 42 3HB ALA 42 0.731 -19.802 -5.188 312 H LEU 43 H LEU 43 2.929 -20.334 -6.821 313 HA LEU 43 HA LEU 43 3.874 -17.712 -6.953 314 HB2 LEU 43 2HB LEU 43 5.563 -20.060 -7.730 315 HB3 LEU 43 3HB LEU 43 6.029 -18.602 -6.858 316 HG LEU 43 HG LEU 43 4.580 -21.022 -5.829 317 HD11 LEU 43 1HD1 LEU 43 7.162 -19.628 -5.280 318 HD12 LEU 43 2HD1 LEU 43 6.843 -21.342 -5.541 319 HD13 LEU 43 3HD1 LEU 43 6.391 -20.584 -4.014 320 HD21 LEU 43 3HD2 LEU 43 3.289 -19.639 -4.628 321 HD22 LEU 43 1HD2 LEU 43 4.300 -18.235 -4.975 322 HD23 LEU 43 2HD2 LEU 43 4.750 -19.348 -3.683 323 H ALA 44 H ALA 44 3.534 -20.161 -9.463 324 HA ALA 44 HA ALA 44 4.933 -18.776 -11.492 325 HB1 ALA 44 1HB ALA 44 2.705 -20.535 -12.301 326 HB2 ALA 44 2HB ALA 44 4.389 -20.517 -12.827 327 HB3 ALA 44 3HB ALA 44 3.952 -21.265 -11.291 328 H SER 45 H SER 45 2.018 -18.084 -9.982 329 HA SER 45 HA SER 45 0.640 -16.957 -12.239 330 HB2 SER 45 2HB SER 45 -0.507 -17.867 -10.192 331 HB3 SER 45 3HB SER 45 0.095 -16.468 -9.304 332 HG SER 45 HG SER 45 -1.270 -15.194 -10.344 333 H LYS 46 H LYS 46 1.684 -15.371 -9.224 334 HA LYS 46 HA LYS 46 2.568 -13.074 -10.845 335 HB2 LYS 46 2HB LYS 46 1.895 -11.679 -8.817 336 HB3 LYS 46 3HB LYS 46 0.591 -12.321 -9.808 337 HG2 LYS 46 2HG LYS 46 0.403 -14.208 -8.168 338 HG3 LYS 46 3HG LYS 46 1.536 -13.330 -7.137 339 HD2 LYS 46 2HD LYS 46 -1.134 -12.305 -8.106 340 HD3 LYS 46 3HD LYS 46 -0.786 -12.908 -6.484 341 HE2 LYS 46 2HE LYS 46 -0.448 -10.721 -6.044 342 HE3 LYS 46 3HE LYS 46 1.147 -11.052 -6.716 343 HZ1 LYS 46 3HZ LYS 46 -0.554 -9.140 -7.592 344 HZ2 LYS 46 1HZ LYS 46 -0.818 -10.387 -8.705 345 HZ3 LYS 46 2HZ LYS 46 0.741 -9.771 -8.478 346 H THR 47 H THR 47 3.391 -15.425 -8.587 347 HA THR 47 HA THR 47 5.254 -15.844 -7.348 348 HB THR 47 HB THR 47 6.998 -13.759 -8.345 349 HG1 THR 47 HG1 THR 47 6.541 -13.799 -10.415 350 HG21 THR 47 3HG2 THR 47 7.153 -16.419 -7.621 351 HG22 THR 47 1HG2 THR 47 8.445 -15.469 -8.354 352 HG23 THR 47 2HG2 THR 47 7.393 -16.458 -9.367 353 HA PRO 48 HA PRO 48 4.472 -12.650 -4.252 354 HB2 PRO 48 2HB PRO 48 5.064 -14.249 -2.140 355 HB3 PRO 48 3HB PRO 48 3.501 -14.285 -2.964 356 HG2 PRO 48 2HG PRO 48 5.851 -16.113 -3.279 357 HG3 PRO 48 3HG PRO 48 4.126 -16.514 -3.183 358 HD2 PRO 48 2HD PRO 48 5.470 -16.413 -5.532 359 HD3 PRO 48 3HD PRO 48 3.751 -15.988 -5.396 360 H ASP 49 H ASP 49 5.851 -12.123 -2.178 361 HA ASP 49 HA ASP 49 8.671 -12.065 -3.025 362 HB2 ASP 49 2HB ASP 49 6.907 -10.050 -1.715 363 HB3 ASP 49 3HB ASP 49 8.615 -10.053 -1.285 364 H VAL 50 H VAL 50 6.611 -13.468 -0.846 365 HA VAL 50 HA VAL 50 8.645 -14.677 0.660 366 HB VAL 50 HB VAL 50 8.935 -12.528 1.738 367 HG11 VAL 50 1HG1 VAL 50 6.358 -12.395 3.078 368 HG12 VAL 50 2HG1 VAL 50 7.274 -11.130 2.257 369 HG13 VAL 50 3HG1 VAL 50 6.227 -12.205 1.330 370 HG21 VAL 50 3HG2 VAL 50 8.513 -14.914 3.027 371 HG22 VAL 50 1HG2 VAL 50 9.201 -13.461 3.754 372 HG23 VAL 50 2HG2 VAL 50 7.479 -13.801 3.924 373 H LEU 51 H LEU 51 7.873 -16.428 1.741 374 HA LEU 51 HA LEU 51 4.946 -16.669 1.981 375 HB2 LEU 51 2HB LEU 51 6.603 -18.146 0.332 376 HB3 LEU 51 3HB LEU 51 6.364 -19.193 1.729 377 HG LEU 51 HG LEU 51 3.922 -17.991 0.588 378 HD11 LEU 51 1HD1 LEU 51 4.335 -20.281 -0.956 379 HD12 LEU 51 2HD1 LEU 51 5.822 -19.344 -1.094 380 HD13 LEU 51 3HD1 LEU 51 4.275 -18.609 -1.513 381 HD21 LEU 51 3HD2 LEU 51 2.965 -19.713 1.635 382 HD22 LEU 51 1HD2 LEU 51 4.537 -19.981 2.389 383 HD23 LEU 51 2HD2 LEU 51 4.093 -20.875 0.935 384 H LEU 52 H LEU 52 4.163 -17.991 3.702 385 HA LEU 52 HA LEU 52 6.117 -18.525 5.834 386 HB2 LEU 52 2HB LEU 52 3.538 -17.014 5.981 387 HB3 LEU 52 3HB LEU 52 4.162 -17.858 7.396 388 HG LEU 52 HG LEU 52 6.245 -16.493 7.199 389 HD11 LEU 52 1HD1 LEU 52 4.785 -15.503 4.842 390 HD12 LEU 52 2HD1 LEU 52 6.518 -15.594 5.153 391 HD13 LEU 52 3HD1 LEU 52 5.569 -14.274 5.834 392 HD21 LEU 52 3HD2 LEU 52 5.360 -14.687 8.369 393 HD22 LEU 52 1HD2 LEU 52 4.168 -15.961 8.623 394 HD23 LEU 52 2HD2 LEU 52 3.862 -14.691 7.438 395 H SER 53 H SER 53 5.421 -20.535 4.217 396 HA SER 53 HA SER 53 3.112 -21.971 4.674 397 HB2 SER 53 2HB SER 53 4.959 -22.515 3.028 398 HB3 SER 53 3HB SER 53 5.840 -23.239 4.373 399 HG SER 53 HG SER 53 3.934 -24.582 4.677 400 H ASP 54 H ASP 54 2.608 -23.745 6.045 401 HA ASP 54 HA ASP 54 4.071 -23.718 8.604 402 HB2 ASP 54 2HB ASP 54 1.617 -22.780 8.423 403 HB3 ASP 54 3HB ASP 54 1.183 -24.487 8.461 404 H ILE 55 H ILE 55 4.401 -25.671 9.659 405 HA ILE 55 HA ILE 55 3.908 -28.065 8.014 406 HB ILE 55 HB ILE 55 6.067 -27.779 10.097 407 HG12 ILE 55 2HG1 ILE 55 6.364 -27.477 7.103 408 HG13 ILE 55 3HG1 ILE 55 6.338 -26.129 8.234 409 HG21 ILE 55 1HG2 ILE 55 5.318 -29.835 8.070 410 HG22 ILE 55 2HG2 ILE 55 7.006 -29.657 8.544 411 HG23 ILE 55 3HG2 ILE 55 5.785 -30.038 9.758 412 HD11 ILE 55 3HD1 ILE 55 8.602 -26.602 7.688 413 HD12 ILE 55 1HD1 ILE 55 8.327 -27.126 9.349 414 HD13 ILE 55 2HD1 ILE 55 8.390 -28.315 8.048 415 H ARG 56 H ARG 56 2.133 -29.019 8.816 416 HA ARG 56 HA ARG 56 2.185 -30.377 11.259 417 HB2 ARG 56 2HB ARG 56 0.347 -29.118 12.433 418 HB3 ARG 56 3HB ARG 56 1.903 -28.299 12.389 419 HG2 ARG 56 2HG ARG 56 1.018 -27.054 10.360 420 HG3 ARG 56 3HG ARG 56 -0.568 -27.689 10.802 421 HD2 ARG 56 2HD ARG 56 1.182 -26.154 12.710 422 HD3 ARG 56 3HD ARG 56 -0.014 -25.382 11.670 423 HE ARG 56 HE ARG 56 -1.439 -27.296 12.951 424 HH11 ARG 56 1HH1 ARG 56 0.670 -24.744 14.028 425 HH12 ARG 56 2HH1 ARG 56 -0.158 -24.517 15.533 426 HH21 ARG 56 1HH2 ARG 56 -2.538 -27.006 14.929 427 HH22 ARG 56 2HH2 ARG 56 -1.982 -25.805 16.045 428 H MET 57 H MET 57 1.489 -30.756 8.485 429 HA MET 57 HA MET 57 -1.298 -31.649 8.815 430 HB2 MET 57 2HB MET 57 -1.426 -31.397 6.270 431 HB3 MET 57 3HB MET 57 -1.462 -29.924 7.229 432 HG2 MET 57 2HG MET 57 1.202 -30.818 6.355 433 HG3 MET 57 3HG MET 57 0.108 -30.287 5.080 434 HE1 MET 57 3HE MET 57 1.462 -28.741 4.291 435 HE2 MET 57 1HE MET 57 1.184 -27.050 4.707 436 HE3 MET 57 2HE MET 57 2.632 -27.874 5.286 437 HA PRO 58 HA PRO 58 0.020 -35.713 7.814 438 HB2 PRO 58 2HB PRO 58 -2.116 -36.659 6.432 439 HB3 PRO 58 3HB PRO 58 -2.146 -36.387 8.178 440 HG2 PRO 58 2HG PRO 58 -3.194 -34.655 5.972 441 HG3 PRO 58 3HG PRO 58 -3.941 -35.058 7.530 442 HD2 PRO 58 2HD PRO 58 -2.670 -32.708 7.088 443 HD3 PRO 58 3HD PRO 58 -2.687 -33.500 8.676 444 H GLY 59 H GLY 59 0.273 -37.278 5.951 445 HA2 GLY 59 2HA GLY 59 0.990 -37.782 3.824 446 HA3 GLY 59 3HA GLY 59 0.178 -36.324 3.272 447 H MET 60 H MET 60 1.317 -34.300 3.416 448 HA MET 60 HA MET 60 4.085 -34.589 2.725 449 HB2 MET 60 2HB MET 60 2.082 -32.411 2.722 450 HB3 MET 60 3HB MET 60 3.759 -31.914 2.900 451 HG2 MET 60 2HG MET 60 4.025 -32.085 0.717 452 HG3 MET 60 3HG MET 60 3.685 -33.811 0.821 453 HE1 MET 60 3HE MET 60 2.126 -30.237 0.370 454 HE2 MET 60 1HE MET 60 2.881 -30.852 -1.100 455 HE3 MET 60 2HE MET 60 1.137 -30.598 -1.045 456 H ASP 61 H ASP 61 5.878 -33.728 3.801 457 HA ASP 61 HA ASP 61 5.550 -33.573 6.696 458 HB2 ASP 61 2HB ASP 61 7.865 -34.064 4.860 459 HB3 ASP 61 3HB ASP 61 8.168 -33.507 6.503 460 H GLY 62 H GLY 62 4.934 -31.380 4.653 461 HA2 GLY 62 2HA GLY 62 4.894 -29.075 4.853 462 HA3 GLY 62 3HA GLY 62 5.926 -29.218 6.268 463 H LEU 63 H LEU 63 8.219 -30.181 5.533 464 HA LEU 63 HA LEU 63 9.307 -28.145 3.803 465 HB2 LEU 63 2HB LEU 63 11.469 -29.487 4.345 466 HB3 LEU 63 3HB LEU 63 10.704 -28.496 5.585 467 HG LEU 63 HG LEU 63 9.758 -30.453 6.630 468 HD11 LEU 63 1HD1 LEU 63 10.735 -31.804 4.160 469 HD12 LEU 63 2HD1 LEU 63 9.195 -31.970 5.002 470 HD13 LEU 63 3HD1 LEU 63 10.648 -32.715 5.668 471 HD21 LEU 63 3HD2 LEU 63 12.665 -30.294 6.096 472 HD22 LEU 63 1HD2 LEU 63 12.070 -31.769 6.858 473 HD23 LEU 63 2HD2 LEU 63 11.782 -30.205 7.621 474 H ALA 64 H ALA 64 8.138 -31.292 3.411 475 HA ALA 64 HA ALA 64 9.732 -32.526 1.572 476 HB1 ALA 64 1HB ALA 64 7.278 -33.047 0.520 477 HB2 ALA 64 2HB ALA 64 7.974 -33.876 1.914 478 HB3 ALA 64 3HB ALA 64 6.861 -32.529 2.154 479 H LEU 65 H LEU 65 7.073 -30.301 0.714 480 HA LEU 65 HA LEU 65 8.096 -30.047 -1.981 481 HB2 LEU 65 2HB LEU 65 6.119 -28.934 -2.498 482 HB3 LEU 65 3HB LEU 65 5.639 -30.133 -1.299 483 HG LEU 65 HG LEU 65 6.204 -27.271 -0.566 484 HD11 LEU 65 1HD1 LEU 65 4.282 -27.860 -2.338 485 HD12 LEU 65 2HD1 LEU 65 4.126 -26.589 -1.126 486 HD13 LEU 65 3HD1 LEU 65 3.407 -28.174 -0.839 487 HD21 LEU 65 3HD2 LEU 65 4.804 -29.583 0.752 488 HD22 LEU 65 1HD2 LEU 65 4.613 -27.916 1.295 489 HD23 LEU 65 2HD2 LEU 65 6.204 -28.677 1.329 490 H LEU 66 H LEU 66 8.034 -28.192 0.981 491 HA LEU 66 HA LEU 66 8.675 -25.663 0.019 492 HB2 LEU 66 2HB LEU 66 8.449 -26.896 2.508 493 HB3 LEU 66 3HB LEU 66 10.096 -26.270 2.461 494 HG LEU 66 HG LEU 66 7.876 -24.441 1.698 495 HD11 LEU 66 1HD1 LEU 66 7.902 -23.861 4.253 496 HD12 LEU 66 2HD1 LEU 66 8.335 -25.563 4.418 497 HD13 LEU 66 3HD1 LEU 66 6.828 -25.110 3.622 498 HD21 LEU 66 3HD2 LEU 66 10.508 -24.154 3.139 499 HD22 LEU 66 1HD2 LEU 66 9.365 -22.835 2.884 500 HD23 LEU 66 2HD2 LEU 66 10.120 -23.626 1.500 501 H LYS 67 H LYS 67 10.597 -28.520 0.212 502 HA LYS 67 HA LYS 67 13.167 -27.358 0.227 503 HB2 LYS 67 2HB LYS 67 12.117 -29.943 0.211 504 HB3 LYS 67 3HB LYS 67 13.033 -29.833 -1.287 505 HG2 LYS 67 2HG LYS 67 14.538 -30.662 0.301 506 HG3 LYS 67 3HG LYS 67 14.951 -28.954 0.123 507 HD2 LYS 67 2HD LYS 67 14.674 -28.675 2.310 508 HD3 LYS 67 3HD LYS 67 12.981 -29.147 2.148 509 HE2 LYS 67 2HE LYS 67 13.662 -30.741 3.625 510 HE3 LYS 67 3HE LYS 67 14.050 -31.572 2.119 511 HZ1 LYS 67 3HZ LYS 67 15.834 -30.413 4.114 512 HZ2 LYS 67 1HZ LYS 67 16.314 -30.285 2.497 513 HZ3 LYS 67 2HZ LYS 67 16.021 -31.807 3.175 514 H GLN 68 H GLN 68 10.773 -27.620 -2.216 515 HA GLN 68 HA GLN 68 12.637 -27.288 -4.411 516 HB2 GLN 68 2HB GLN 68 10.832 -27.602 -5.840 517 HB3 GLN 68 3HB GLN 68 10.387 -28.578 -4.446 518 HG2 GLN 68 2HG GLN 68 9.241 -26.265 -3.744 519 HG3 GLN 68 3HG GLN 68 9.176 -26.105 -5.498 520 HE21 GLN 68 1HE2 GLN 68 6.975 -26.386 -3.678 521 HE22 GLN 68 2HE2 GLN 68 6.139 -27.833 -4.116 522 H ILE 69 H ILE 69 10.668 -25.326 -2.350 523 HA ILE 69 HA ILE 69 10.322 -23.049 -3.915 524 HB ILE 69 HB ILE 69 10.717 -23.285 -0.933 525 HG12 ILE 69 2HG1 ILE 69 8.209 -22.867 -2.573 526 HG13 ILE 69 3HG1 ILE 69 8.730 -24.419 -1.926 527 HG21 ILE 69 1HG2 ILE 69 10.094 -20.918 -2.656 528 HG22 ILE 69 2HG2 ILE 69 9.502 -21.007 -0.998 529 HG23 ILE 69 3HG2 ILE 69 11.236 -21.055 -1.319 530 HD11 ILE 69 3HD1 ILE 69 7.362 -22.211 -0.622 531 HD12 ILE 69 1HD1 ILE 69 7.447 -23.916 -0.182 532 HD13 ILE 69 2HD1 ILE 69 8.743 -22.817 0.291 533 H LYS 70 H LYS 70 13.128 -24.219 -2.199 534 HA LYS 70 HA LYS 70 14.599 -21.752 -2.496 535 HB2 LYS 70 2HB LYS 70 15.502 -24.503 -1.623 536 HB3 LYS 70 3HB LYS 70 16.488 -23.048 -1.556 537 HG2 LYS 70 2HG LYS 70 13.873 -23.347 -0.101 538 HG3 LYS 70 3HG LYS 70 15.441 -23.735 0.609 539 HD2 LYS 70 2HD LYS 70 15.953 -21.574 0.932 540 HD3 LYS 70 3HD LYS 70 15.341 -21.099 -0.654 541 HE2 LYS 70 2HE LYS 70 13.009 -21.461 0.396 542 HE3 LYS 70 3HE LYS 70 13.861 -21.383 1.937 543 HZ1 LYS 70 3HZ LYS 70 13.176 -19.271 0.124 544 HZ2 LYS 70 1HZ LYS 70 14.806 -19.232 0.576 545 HZ3 LYS 70 2HZ LYS 70 13.599 -19.193 1.760 546 H GLN 71 H GLN 71 14.023 -24.569 -4.358 547 HA GLN 71 HA GLN 71 16.408 -24.229 -5.989 548 HB2 GLN 71 2HB GLN 71 15.792 -26.500 -5.560 549 HB3 GLN 71 3HB GLN 71 14.133 -26.210 -6.069 550 HG2 GLN 71 2HG GLN 71 15.456 -27.459 -7.725 551 HG3 GLN 71 3HG GLN 71 14.819 -25.939 -8.350 552 HE21 GLN 71 1HE2 GLN 71 17.708 -27.224 -6.741 553 HE22 GLN 71 2HE2 GLN 71 18.842 -26.306 -7.666 554 H ARG 72 H ARG 72 13.015 -23.480 -6.047 555 HA ARG 72 HA ARG 72 13.145 -22.673 -8.855 556 HB2 ARG 72 2HB ARG 72 11.041 -23.530 -7.042 557 HB3 ARG 72 3HB ARG 72 10.610 -22.047 -7.885 558 HG2 ARG 72 2HG ARG 72 11.561 -23.498 -9.942 559 HG3 ARG 72 3HG ARG 72 10.934 -24.785 -8.909 560 HD2 ARG 72 2HD ARG 72 8.830 -24.279 -9.433 561 HD3 ARG 72 3HD ARG 72 9.085 -22.576 -9.055 562 HE ARG 72 HE ARG 72 9.238 -22.166 -11.291 563 HH11 ARG 72 1HH1 ARG 72 9.878 -25.543 -10.737 564 HH12 ARG 72 2HH1 ARG 72 9.974 -25.935 -12.422 565 HH21 ARG 72 1HH2 ARG 72 9.362 -22.670 -13.512 566 HH22 ARG 72 2HH2 ARG 72 9.681 -24.300 -13.999 567 H HIS 73 H HIS 73 12.521 -21.330 -5.640 568 HA HIS 73 HA HIS 73 13.006 -18.649 -6.760 569 HB2 HIS 73 2HB HIS 73 11.173 -19.196 -4.427 570 HB3 HIS 73 3HB HIS 73 11.360 -17.692 -5.324 571 HD1 HIS 73 HD1 HIS 73 10.121 -17.490 -7.571 572 HD2 HIS 73 HD2 HIS 73 9.539 -21.126 -5.647 573 HE1 HIS 73 HE1 HIS 73 8.211 -18.592 -8.780 574 HA PRO 74 HA PRO 74 16.140 -19.556 -3.481 575 HB2 PRO 74 2HB PRO 74 18.211 -18.450 -4.843 576 HB3 PRO 74 3HB PRO 74 17.700 -20.127 -5.068 577 HG2 PRO 74 2HG PRO 74 17.079 -17.718 -6.734 578 HG3 PRO 74 3HG PRO 74 17.526 -19.354 -7.254 579 HD2 PRO 74 2HD PRO 74 14.965 -18.473 -7.255 580 HD3 PRO 74 3HD PRO 74 15.391 -20.169 -6.950 581 H MET 75 H MET 75 15.691 -16.642 -5.461 582 HA MET 75 HA MET 75 16.784 -14.905 -3.448 583 HB2 MET 75 2HB MET 75 16.234 -13.104 -4.944 584 HB3 MET 75 3HB MET 75 16.912 -14.422 -5.891 585 HG2 MET 75 2HG MET 75 15.129 -14.408 -7.189 586 HG3 MET 75 3HG MET 75 14.113 -14.793 -5.802 587 HE1 MET 75 3HE MET 75 12.721 -12.614 -4.354 588 HE2 MET 75 1HE MET 75 11.800 -12.042 -5.745 589 HE3 MET 75 2HE MET 75 12.202 -13.753 -5.597 590 H LEU 76 H LEU 76 13.953 -16.554 -3.620 591 HA LEU 76 HA LEU 76 12.291 -14.439 -2.482 592 HB2 LEU 76 2HB LEU 76 11.313 -15.858 -4.204 593 HB3 LEU 76 3HB LEU 76 11.638 -17.287 -3.225 594 HG LEU 76 HG LEU 76 10.087 -16.218 -1.487 595 HD11 LEU 76 1HD1 LEU 76 9.361 -14.585 -3.913 596 HD12 LEU 76 2HD1 LEU 76 10.003 -13.983 -2.386 597 HD13 LEU 76 3HD1 LEU 76 8.394 -14.700 -2.443 598 HD21 LEU 76 3HD2 LEU 76 9.406 -18.168 -2.672 599 HD22 LEU 76 1HD2 LEU 76 9.100 -17.242 -4.141 600 HD23 LEU 76 2HD2 LEU 76 8.065 -17.024 -2.730 601 HA PRO 77 HA PRO 77 13.578 -15.941 1.547 602 HB2 PRO 77 2HB PRO 77 12.353 -13.956 2.937 603 HB3 PRO 77 3HB PRO 77 13.904 -13.739 2.118 604 HG2 PRO 77 2HG PRO 77 11.159 -12.961 1.212 605 HG3 PRO 77 3HG PRO 77 12.673 -12.044 1.110 606 HD2 PRO 77 2HD PRO 77 11.636 -13.385 -1.002 607 HD3 PRO 77 3HD PRO 77 13.384 -13.184 -0.763 608 H VAL 78 H VAL 78 12.551 -17.638 2.390 609 HA VAL 78 HA VAL 78 9.628 -17.486 2.743 610 HB VAL 78 HB VAL 78 11.317 -19.971 2.422 611 HG11 VAL 78 1HG1 VAL 78 8.884 -20.877 2.013 612 HG12 VAL 78 2HG1 VAL 78 9.530 -20.722 3.648 613 HG13 VAL 78 3HG1 VAL 78 8.436 -19.493 3.010 614 HG21 VAL 78 3HG2 VAL 78 10.414 -18.178 0.464 615 HG22 VAL 78 1HG2 VAL 78 11.081 -19.792 0.220 616 HG23 VAL 78 2HG2 VAL 78 9.338 -19.572 0.379 617 H ILE 79 H ILE 79 8.731 -18.467 4.634 618 HA ILE 79 HA ILE 79 10.645 -18.752 6.857 619 HB ILE 79 HB ILE 79 7.873 -17.621 7.179 620 HG12 ILE 79 2HG1 ILE 79 10.459 -16.068 6.947 621 HG13 ILE 79 3HG1 ILE 79 9.243 -16.177 5.680 622 HG21 ILE 79 1HG2 ILE 79 10.292 -17.405 8.961 623 HG22 ILE 79 2HG2 ILE 79 8.638 -16.925 9.334 624 HG23 ILE 79 3HG2 ILE 79 9.037 -18.631 9.142 625 HD11 ILE 79 3HD1 ILE 79 8.172 -14.462 6.560 626 HD12 ILE 79 1HD1 ILE 79 7.958 -15.350 8.068 627 HD13 ILE 79 2HD1 ILE 79 9.392 -14.352 7.828 628 H ILE 80 H ILE 80 10.294 -20.388 8.297 629 HA ILE 80 HA ILE 80 8.174 -22.293 7.580 630 HB ILE 80 HB ILE 80 10.684 -22.790 9.184 631 HG12 ILE 80 2HG1 ILE 80 10.912 -22.251 6.679 632 HG13 ILE 80 3HG1 ILE 80 11.659 -23.734 7.262 633 HG21 ILE 80 1HG2 ILE 80 9.111 -24.373 9.886 634 HG22 ILE 80 2HG2 ILE 80 8.446 -24.563 8.264 635 HG23 ILE 80 3HG2 ILE 80 10.043 -25.207 8.642 636 HD11 ILE 80 3HD1 ILE 80 10.308 -25.042 6.043 637 HD12 ILE 80 1HD1 ILE 80 8.899 -24.014 6.304 638 HD13 ILE 80 2HD1 ILE 80 10.094 -23.580 5.081 639 H MET 81 H MET 81 6.736 -23.048 9.078 640 HA MET 81 HA MET 81 6.928 -21.944 11.799 641 HB2 MET 81 2HB MET 81 4.315 -22.266 10.334 642 HB3 MET 81 3HB MET 81 4.620 -21.396 11.831 643 HG2 MET 81 2HG MET 81 5.992 -19.777 10.555 644 HG3 MET 81 3HG MET 81 5.531 -20.614 9.074 645 HE1 MET 81 3HE MET 81 1.816 -20.803 10.001 646 HE2 MET 81 1HE MET 81 2.108 -20.120 8.401 647 HE3 MET 81 2HE MET 81 3.111 -21.445 8.990 648 H THR 82 H THR 82 6.907 -23.471 13.302 649 HA THR 82 HA THR 82 5.116 -25.666 13.301 650 HB THR 82 HB THR 82 6.524 -26.685 11.665 651 HG1 THR 82 HG1 THR 82 5.926 -27.925 13.642 652 HG21 THR 82 3HG2 THR 82 8.972 -26.571 13.345 653 HG22 THR 82 1HG2 THR 82 8.511 -25.111 12.472 654 HG23 THR 82 2HG2 THR 82 8.806 -26.609 11.589 655 H ALA 83 H ALA 83 8.349 -24.684 14.427 656 HA ALA 83 HA ALA 83 9.234 -24.485 16.515 657 HB1 ALA 83 1HB ALA 83 7.736 -23.130 17.492 658 HB2 ALA 83 2HB ALA 83 6.359 -24.079 16.930 659 HB3 ALA 83 3HB ALA 83 7.249 -24.582 18.367 660 H HIS 84 H HIS 84 8.868 -25.617 18.894 661 HA HIS 84 HA HIS 84 9.516 -27.566 19.932 662 HB2 HIS 84 2HB HIS 84 7.708 -29.152 20.110 663 HB3 HIS 84 3HB HIS 84 7.021 -27.532 20.049 664 HD1 HIS 84 HD1 HIS 84 7.146 -30.750 18.203 665 HD2 HIS 84 HD2 HIS 84 5.606 -26.928 17.670 666 HE1 HIS 84 HE1 HIS 84 5.542 -30.935 16.276 667 H SER 85 H SER 85 8.840 -30.257 19.169 668 HA SER 85 HA SER 85 11.107 -31.020 17.791 669 HB2 SER 85 2HB SER 85 8.508 -32.343 18.411 670 HB3 SER 85 3HB SER 85 9.562 -33.119 17.229 671 HG SER 85 HG SER 85 9.746 -33.343 19.790 672 H ASP 86 H ASP 86 11.481 -29.857 15.929 673 HA ASP 86 HA ASP 86 10.692 -30.857 13.507 674 HB2 ASP 86 2HB ASP 86 8.662 -29.115 14.649 675 HB3 ASP 86 3HB ASP 86 9.226 -28.527 13.087 676 H LEU 87 H LEU 87 11.278 -27.781 15.164 677 HA LEU 87 HA LEU 87 12.510 -26.443 13.028 678 HB2 LEU 87 2HB LEU 87 12.147 -26.051 15.867 679 HB3 LEU 87 3HB LEU 87 13.746 -25.521 15.349 680 HG LEU 87 HG LEU 87 12.818 -23.926 13.845 681 HD11 LEU 87 1HD1 LEU 87 10.206 -23.734 13.900 682 HD12 LEU 87 2HD1 LEU 87 10.299 -25.450 14.296 683 HD13 LEU 87 3HD1 LEU 87 11.004 -24.853 12.794 684 HD21 LEU 87 3HD2 LEU 87 11.058 -23.702 16.263 685 HD22 LEU 87 1HD2 LEU 87 11.852 -22.422 15.345 686 HD23 LEU 87 2HD2 LEU 87 12.806 -23.492 16.372 687 H ASP 88 H ASP 88 13.808 -28.595 15.501 688 HA ASP 88 HA ASP 88 16.522 -28.228 15.126 689 HB2 ASP 88 2HB ASP 88 15.650 -29.634 16.907 690 HB3 ASP 88 3HB ASP 88 15.032 -30.790 15.730 691 H ALA 89 H ALA 89 14.211 -29.775 13.058 692 HA ALA 89 HA ALA 89 16.232 -31.076 11.436 693 HB1 ALA 89 1HB ALA 89 13.533 -31.531 11.905 694 HB2 ALA 89 2HB ALA 89 13.605 -30.961 10.237 695 HB3 ALA 89 3HB ALA 89 14.558 -32.359 10.732 696 H ALA 90 H ALA 90 14.296 -28.170 11.399 697 HA ALA 90 HA ALA 90 14.983 -27.528 8.658 698 HB1 ALA 90 1HB ALA 90 13.884 -25.256 9.573 699 HB2 ALA 90 2HB ALA 90 12.939 -26.629 8.996 700 HB3 ALA 90 3HB ALA 90 13.203 -26.405 10.725 701 H VAL 91 H VAL 91 16.263 -26.994 11.798 702 HA VAL 91 HA VAL 91 17.558 -24.564 11.583 703 HB VAL 91 HB VAL 91 18.434 -27.098 12.963 704 HG11 VAL 91 1HG1 VAL 91 19.802 -24.475 12.704 705 HG12 VAL 91 2HG1 VAL 91 19.839 -25.275 14.277 706 HG13 VAL 91 3HG1 VAL 91 20.480 -26.096 12.853 707 HG21 VAL 91 3HG2 VAL 91 17.725 -24.739 14.537 708 HG22 VAL 91 1HG2 VAL 91 16.403 -25.361 13.549 709 HG23 VAL 91 2HG2 VAL 91 17.208 -26.416 14.710 710 H SER 92 H SER 92 18.911 -27.762 10.758 711 HA SER 92 HA SER 92 21.143 -26.511 9.395 712 HB2 SER 92 2HB SER 92 21.528 -28.528 10.747 713 HB3 SER 92 3HB SER 92 20.427 -29.437 9.712 714 HG SER 92 HG SER 92 22.014 -29.718 8.380 715 H ALA 93 H ALA 93 18.341 -28.516 8.571 716 HA ALA 93 HA ALA 93 18.855 -28.801 5.835 717 HB1 ALA 93 1HB ALA 93 16.477 -29.323 5.614 718 HB2 ALA 93 2HB ALA 93 17.186 -30.133 7.012 719 HB3 ALA 93 3HB ALA 93 16.187 -28.698 7.238 720 H TYR 94 H TYR 94 16.510 -26.570 7.344 721 HA TYR 94 HA TYR 94 15.992 -25.070 5.052 722 HB2 TYR 94 2HB TYR 94 14.851 -25.101 7.425 723 HB3 TYR 94 3HB TYR 94 15.947 -23.760 7.743 724 HD1 TYR 94 HD1 TYR 94 14.145 -24.619 4.599 725 HD2 TYR 94 HD2 TYR 94 14.562 -21.886 7.833 726 HE1 TYR 94 HE1 TYR 94 12.575 -23.081 3.494 727 HE2 TYR 94 HE2 TYR 94 12.993 -20.341 6.738 728 HH TYR 94 HH TYR 94 11.019 -20.669 4.969 729 H GLN 95 H GLN 95 18.752 -25.121 7.063 730 HA GLN 95 HA GLN 95 19.667 -22.464 6.621 731 HB2 GLN 95 2HB GLN 95 20.623 -24.859 7.945 732 HB3 GLN 95 3HB GLN 95 21.918 -24.058 7.065 733 HG2 GLN 95 2HG GLN 95 20.113 -22.578 8.948 734 HG3 GLN 95 3HG GLN 95 21.576 -23.399 9.489 735 HE21 GLN 95 1HE2 GLN 95 21.145 -20.653 9.753 736 HE22 GLN 95 2HE2 GLN 95 22.291 -19.820 8.763 737 H GLN 96 H GLN 96 19.121 -24.774 4.426 738 HA GLN 96 HA GLN 96 21.525 -24.740 2.891 739 HB2 GLN 96 2HB GLN 96 18.718 -25.665 2.414 740 HB3 GLN 96 3HB GLN 96 19.830 -25.541 1.058 741 HG2 GLN 96 2HG GLN 96 20.376 -27.133 3.551 742 HG3 GLN 96 3HG GLN 96 19.689 -27.802 2.071 743 HE21 GLN 96 1HE2 GLN 96 21.006 -28.322 0.420 744 HE22 GLN 96 2HE2 GLN 96 22.720 -28.109 0.431 745 H GLY 97 H GLY 97 20.210 -22.137 3.670 746 HA2 GLY 97 2HA GLY 97 20.723 -20.127 2.418 747 HA3 GLY 97 3HA GLY 97 20.224 -20.972 0.960 748 H ALA 98 H ALA 98 18.461 -21.068 3.993 749 HA ALA 98 HA ALA 98 16.240 -19.675 2.654 750 HB1 ALA 98 1HB ALA 98 16.118 -22.128 3.625 751 HB2 ALA 98 2HB ALA 98 15.798 -21.261 5.128 752 HB3 ALA 98 3HB ALA 98 14.747 -21.023 3.732 753 H PHE 99 H PHE 99 14.766 -18.471 4.177 754 HA PHE 99 HA PHE 99 16.378 -16.647 5.744 755 HB2 PHE 99 2HB PHE 99 14.745 -15.618 4.340 756 HB3 PHE 99 3HB PHE 99 13.467 -16.665 4.949 757 HD1 PHE 99 HD2 PHE 99 15.526 -13.725 5.623 758 HD2 PHE 99 HD1 PHE 99 12.428 -16.248 7.090 759 HE1 PHE 99 HE2 PHE 99 14.951 -12.031 7.311 760 HE2 PHE 99 HE1 PHE 99 11.847 -14.557 8.780 761 HZ PHE 99 HZ PHE 99 13.110 -12.446 8.893 762 H ASP 100 H ASP 100 16.055 -16.156 7.933 763 HA ASP 100 HA ASP 100 15.796 -18.237 9.696 764 HB2 ASP 100 2HB ASP 100 16.697 -15.971 10.234 765 HB3 ASP 100 3HB ASP 100 15.042 -15.371 10.298 766 H TYR 101 H TYR 101 14.129 -19.593 9.839 767 HA TYR 101 HA TYR 101 11.473 -19.006 9.168 768 HB2 TYR 101 2HB TYR 101 10.987 -21.129 10.530 769 HB3 TYR 101 3HB TYR 101 12.063 -21.282 9.145 770 HD1 TYR 101 HD2 TYR 101 12.412 -20.385 12.765 771 HD2 TYR 101 HD1 TYR 101 13.851 -22.684 9.486 772 HE1 TYR 101 HE2 TYR 101 14.133 -21.371 14.219 773 HE2 TYR 101 HE1 TYR 101 15.576 -23.677 10.932 774 HH TYR 101 HH TYR 101 16.792 -22.895 13.149 775 H LEU 102 H LEU 102 9.748 -19.727 11.035 776 HA LEU 102 HA LEU 102 10.275 -18.185 13.462 777 HB2 LEU 102 2HB LEU 102 9.230 -16.475 12.359 778 HB3 LEU 102 3HB LEU 102 8.253 -17.563 11.375 779 HG LEU 102 HG LEU 102 6.986 -18.050 13.571 780 HD11 LEU 102 1HD1 LEU 102 7.395 -15.399 14.567 781 HD12 LEU 102 2HD1 LEU 102 8.928 -16.270 14.545 782 HD13 LEU 102 3HD1 LEU 102 7.545 -16.943 15.407 783 HD21 LEU 102 3HD2 LEU 102 5.513 -16.942 12.325 784 HD22 LEU 102 1HD2 LEU 102 6.771 -15.934 11.610 785 HD23 LEU 102 2HD2 LEU 102 6.041 -15.474 13.149 786 HA PRO 103 HA PRO 103 8.257 -21.736 15.176 787 HB2 PRO 103 2HB PRO 103 8.108 -20.826 17.730 788 HB3 PRO 103 3HB PRO 103 9.608 -21.418 17.007 789 HG2 PRO 103 2HG PRO 103 8.666 -18.601 17.377 790 HG3 PRO 103 3HG PRO 103 10.279 -19.285 17.646 791 HD2 PRO 103 2HD PRO 103 9.643 -17.887 15.416 792 HD3 PRO 103 3HD PRO 103 10.819 -19.216 15.406 793 H LYS 104 H LYS 104 6.252 -22.302 16.202 794 HA LYS 104 HA LYS 104 4.205 -20.188 16.030 795 HB2 LYS 104 2HB LYS 104 4.291 -22.245 14.339 796 HB3 LYS 104 3HB LYS 104 3.448 -23.045 15.659 797 HG2 LYS 104 2HG LYS 104 1.844 -22.171 14.104 798 HG3 LYS 104 3HG LYS 104 1.745 -21.259 15.611 799 HD2 LYS 104 2HD LYS 104 2.628 -19.358 14.676 800 HD3 LYS 104 3HD LYS 104 3.529 -20.251 13.449 801 HE2 LYS 104 2HE LYS 104 1.898 -19.448 12.102 802 HE3 LYS 104 3HE LYS 104 1.034 -20.865 12.695 803 HZ1 LYS 104 3HZ LYS 104 -0.051 -18.508 12.775 804 HZ2 LYS 104 1HZ LYS 104 0.835 -18.363 14.210 805 HZ3 LYS 104 2HZ LYS 104 -0.296 -19.609 14.036 806 HA PRO 105 HA PRO 105 2.230 -19.718 16.602 807 HB2 PRO 105 2HB PRO 105 1.593 -17.901 18.516 808 HB3 PRO 105 3HB PRO 105 0.622 -19.344 18.200 809 HG2 PRO 105 2HG PRO 105 2.666 -18.867 20.334 810 HG3 PRO 105 3HG PRO 105 1.081 -19.651 20.459 811 HD2 PRO 105 2HD PRO 105 3.391 -21.054 20.298 812 HD3 PRO 105 3HD PRO 105 1.863 -21.650 19.619 813 H PHE 106 H PHE 106 2.436 -17.098 16.796 814 HA PHE 106 HA PHE 106 5.197 -16.369 17.400 815 HB2 PHE 106 2HB PHE 106 5.525 -15.350 15.188 816 HB3 PHE 106 3HB PHE 106 5.251 -17.085 15.056 817 HD1 PHE 106 HD1 PHE 106 3.443 -13.837 14.887 818 HD2 PHE 106 HD2 PHE 106 3.665 -17.881 13.579 819 HE1 PHE 106 HE1 PHE 106 1.610 -13.421 13.300 820 HE2 PHE 106 HE2 PHE 106 1.833 -17.471 11.989 821 HZ PHE 106 HZ PHE 106 0.803 -15.239 11.848 822 H ASP 107 H ASP 107 5.553 -14.014 17.280 823 HA ASP 107 HA ASP 107 3.190 -12.611 18.257 824 HB2 ASP 107 2HB ASP 107 6.141 -12.171 18.447 825 HB3 ASP 107 3HB ASP 107 5.064 -10.790 18.639 826 H ILE 108 H ILE 108 1.974 -11.648 16.770 827 HA ILE 108 HA ILE 108 2.566 -11.060 14.168 828 HB ILE 108 HB ILE 108 0.663 -9.744 16.081 829 HG12 ILE 108 2HG1 ILE 108 -0.065 -11.157 13.545 830 HG13 ILE 108 3HG1 ILE 108 0.448 -12.108 14.934 831 HG21 ILE 108 1HG2 ILE 108 -0.321 -8.630 14.030 832 HG22 ILE 108 2HG2 ILE 108 1.181 -7.945 14.647 833 HG23 ILE 108 3HG2 ILE 108 1.207 -8.985 13.224 834 HD11 ILE 108 3HD1 ILE 108 -1.558 -11.937 15.839 835 HD12 ILE 108 1HD1 ILE 108 -1.493 -10.177 15.757 836 HD13 ILE 108 2HD1 ILE 108 -2.104 -11.102 14.385 837 H ASP 109 H ASP 109 3.390 -9.210 17.015 838 HA ASP 109 HA ASP 109 4.078 -6.788 15.744 839 HB2 ASP 109 2HB ASP 109 5.252 -7.933 18.286 840 HB3 ASP 109 3HB ASP 109 5.255 -6.240 17.797 841 H GLU 110 H GLU 110 5.989 -9.654 16.580 842 HA GLU 110 HA GLU 110 8.396 -8.539 15.440 843 HB2 GLU 110 2HB GLU 110 7.930 -10.438 17.347 844 HB3 GLU 110 3HB GLU 110 8.314 -11.436 15.952 845 HG2 GLU 110 2HG GLU 110 10.325 -11.058 17.154 846 HG3 GLU 110 3HG GLU 110 10.404 -10.116 15.666 847 H ALA 111 H ALA 111 5.829 -10.689 14.463 848 HA ALA 111 HA ALA 111 7.119 -11.839 12.219 849 HB1 ALA 111 1HB ALA 111 4.705 -12.197 13.509 850 HB2 ALA 111 2HB ALA 111 4.242 -11.571 11.927 851 HB3 ALA 111 3HB ALA 111 5.238 -13.021 12.044 852 H VAL 112 H VAL 112 4.742 -9.188 12.450 853 HA VAL 112 HA VAL 112 4.548 -8.466 9.818 854 HB VAL 112 HB VAL 112 4.546 -6.745 12.287 855 HG11 VAL 112 1HG1 VAL 112 3.410 -5.066 10.669 856 HG12 VAL 112 2HG1 VAL 112 5.171 -5.153 10.726 857 HG13 VAL 112 3HG1 VAL 112 4.290 -5.942 9.418 858 HG21 VAL 112 3HG2 VAL 112 2.189 -6.755 12.051 859 HG22 VAL 112 1HG2 VAL 112 2.284 -7.445 10.431 860 HG23 VAL 112 2HG2 VAL 112 2.714 -8.424 11.833 861 H ALA 113 H ALA 113 7.129 -7.665 12.083 862 HA ALA 113 HA ALA 113 8.507 -6.008 10.150 863 HB1 ALA 113 1HB ALA 113 9.023 -6.816 12.981 864 HB2 ALA 113 2HB ALA 113 10.314 -6.107 12.012 865 HB3 ALA 113 3HB ALA 113 8.826 -5.204 12.294 866 H LEU 114 H LEU 114 8.654 -9.283 11.357 867 HA LEU 114 HA LEU 114 11.214 -10.010 10.526 868 HB2 LEU 114 2HB LEU 114 9.861 -11.429 11.941 869 HB3 LEU 114 3HB LEU 114 8.690 -11.653 10.643 870 HG LEU 114 HG LEU 114 10.627 -12.738 9.351 871 HD11 LEU 114 1HD1 LEU 114 12.442 -12.005 10.776 872 HD12 LEU 114 2HD1 LEU 114 12.344 -13.766 10.776 873 HD13 LEU 114 3HD1 LEU 114 11.734 -12.849 12.153 874 HD21 LEU 114 3HD2 LEU 114 8.985 -14.225 9.926 875 HD22 LEU 114 1HD2 LEU 114 9.101 -13.861 11.647 876 HD23 LEU 114 2HD2 LEU 114 10.328 -14.865 10.874 877 H VAL 115 H VAL 115 8.221 -9.713 8.724 878 HA VAL 115 HA VAL 115 9.349 -10.888 6.330 879 HB VAL 115 HB VAL 115 6.973 -11.213 6.808 880 HG11 VAL 115 1HG1 VAL 115 6.544 -9.108 7.969 881 HG12 VAL 115 2HG1 VAL 115 6.731 -8.227 6.451 882 HG13 VAL 115 3HG1 VAL 115 5.392 -9.357 6.657 883 HG21 VAL 115 3HG2 VAL 115 6.828 -9.466 4.431 884 HG22 VAL 115 1HG2 VAL 115 8.062 -10.726 4.403 885 HG23 VAL 115 2HG2 VAL 115 6.367 -11.157 4.628 886 H GLU 116 H GLU 116 8.678 -7.695 7.620 887 HA GLU 116 HA GLU 116 8.906 -6.151 5.328 888 HB2 GLU 116 2HB GLU 116 9.335 -5.692 8.225 889 HB3 GLU 116 3HB GLU 116 10.046 -4.512 7.132 890 HG2 GLU 116 2HG GLU 116 7.857 -4.128 6.120 891 HG3 GLU 116 3HG GLU 116 7.144 -5.308 7.219 892 H ARG 117 H ARG 117 11.439 -7.440 7.428 893 HA ARG 117 HA ARG 117 13.595 -6.128 6.136 894 HB2 ARG 117 2HB ARG 117 15.016 -7.767 7.325 895 HB3 ARG 117 3HB ARG 117 13.846 -6.993 8.386 896 HG2 ARG 117 2HG ARG 117 12.515 -8.925 8.505 897 HG3 ARG 117 3HG ARG 117 13.338 -9.672 7.134 898 HD2 ARG 117 2HD ARG 117 14.429 -10.779 8.778 899 HD3 ARG 117 3HD ARG 117 15.431 -9.328 8.769 900 HE ARG 117 HE ARG 117 13.346 -8.865 10.540 901 HH11 ARG 117 1HH1 ARG 117 16.042 -11.046 10.228 902 HH12 ARG 117 2HH1 ARG 117 16.242 -11.251 11.937 903 HH21 ARG 117 1HH2 ARG 117 13.600 -9.127 12.792 904 HH22 ARG 117 2HH2 ARG 117 14.851 -10.160 13.394 905 H ALA 118 H ALA 118 11.671 -8.818 5.288 906 HA ALA 118 HA ALA 118 13.650 -10.056 3.578 907 HB1 ALA 118 1HB ALA 118 12.331 -11.775 4.126 908 HB2 ALA 118 2HB ALA 118 10.984 -10.721 4.560 909 HB3 ALA 118 3HB ALA 118 11.247 -11.167 2.875 910 H ILE 119 H ILE 119 10.769 -8.042 3.219 911 HA ILE 119 HA ILE 119 10.960 -8.040 0.334 912 HB ILE 119 HB ILE 119 9.182 -6.463 2.197 913 HG12 ILE 119 2HG1 ILE 119 8.314 -8.649 0.330 914 HG13 ILE 119 3HG1 ILE 119 8.970 -9.044 1.914 915 HG21 ILE 119 1HG2 ILE 119 7.882 -5.933 0.162 916 HG22 ILE 119 2HG2 ILE 119 9.496 -5.224 0.153 917 HG23 ILE 119 3HG2 ILE 119 9.160 -6.662 -0.811 918 HD11 ILE 119 3HD1 ILE 119 6.725 -7.093 1.649 919 HD12 ILE 119 1HD1 ILE 119 6.422 -8.830 1.621 920 HD13 ILE 119 2HD1 ILE 119 7.185 -8.090 3.029 921 H SER 120 H SER 120 11.369 -5.657 2.944 922 HA SER 120 HA SER 120 12.056 -3.458 1.399 923 HB2 SER 120 2HB SER 120 11.664 -3.643 3.955 924 HB3 SER 120 3HB SER 120 13.390 -3.996 4.042 925 HG SER 120 HG SER 120 12.180 -1.672 2.950 926 H HIS 121 H HIS 121 13.899 -6.283 2.184 927 HA HIS 121 HA HIS 121 16.503 -5.365 1.820 928 HB2 HIS 121 2HB HIS 121 15.814 -7.644 2.637 929 HB3 HIS 121 3HB HIS 121 15.469 -8.073 0.964 930 HD1 HIS 121 HD1 HIS 121 17.360 -9.052 -0.305 931 HD2 HIS 121 HD2 HIS 121 18.656 -6.898 3.002 932 HE1 HIS 121 HE1 HIS 121 19.846 -9.414 -0.200 933 H TYR 122 H TYR 122 13.976 -5.872 -0.473 934 HA TYR 122 HA TYR 122 15.877 -5.522 -2.693 935 HB2 TYR 122 2HB TYR 122 13.019 -6.434 -2.972 936 HB3 TYR 122 3HB TYR 122 14.333 -6.598 -4.131 937 HD1 TYR 122 HD2 TYR 122 16.390 -8.024 -3.248 938 HD2 TYR 122 HD1 TYR 122 12.425 -8.285 -1.725 939 HE1 TYR 122 HE2 TYR 122 16.876 -10.275 -2.384 940 HE2 TYR 122 HE1 TYR 122 12.900 -10.536 -0.856 941 HH TYR 122 HH TYR 122 15.983 -11.773 -0.547 942 H GLN 123 H GLN 123 13.054 -4.230 -1.111 943 HA GLN 123 HA GLN 123 13.005 -2.012 -3.049 944 HB2 GLN 123 2HB GLN 123 10.824 -3.194 -1.338 945 HB3 GLN 123 3HB GLN 123 10.669 -1.616 -2.099 946 HG2 GLN 123 2HG GLN 123 11.032 -2.685 -4.297 947 HG3 GLN 123 3HG GLN 123 11.058 -4.253 -3.493 948 HE21 GLN 123 1HE2 GLN 123 9.151 -5.081 -2.624 949 HE22 GLN 123 2HE2 GLN 123 7.599 -4.471 -3.077 950 H GLU 124 H GLU 124 14.950 -1.891 -1.160 951 HA GLU 124 HA GLU 124 14.193 -0.610 1.247 952 HB2 GLU 124 2HB GLU 124 16.588 0.034 1.392 953 HB3 GLU 124 3HB GLU 124 16.348 -1.679 1.076 954 HG2 GLU 124 2HG GLU 124 16.568 -0.227 -1.392 955 HG3 GLU 124 3HG GLU 124 17.946 0.112 -0.347 Start of MODEL 5 1 H1 MET 1 H MET 1 -1.031 -1.032 -1.438 2 HA MET 1 HA MET 1 0.728 -0.553 -3.494 3 HB2 MET 1 2HB MET 1 1.221 1.480 -1.949 4 HB3 MET 1 3HB MET 1 2.089 0.312 -0.962 5 HG2 MET 1 2HG MET 1 3.797 0.163 -2.405 6 HG3 MET 1 3HG MET 1 2.747 0.245 -3.818 7 HE1 MET 1 3HE MET 1 4.676 1.730 -1.190 8 HE2 MET 1 1HE MET 1 5.483 3.035 -2.060 9 HE3 MET 1 2HE MET 1 4.090 3.387 -1.038 10 H GLN 2 H GLN 2 0.679 -2.763 -3.665 11 HA GLN 2 HA GLN 2 1.393 -4.450 -1.436 12 HB2 GLN 2 2HB GLN 2 1.113 -5.304 -4.312 13 HB3 GLN 2 3HB GLN 2 0.927 -6.289 -2.867 14 HG2 GLN 2 2HG GLN 2 -1.254 -5.959 -3.078 15 HG3 GLN 2 3HG GLN 2 -0.959 -4.308 -2.537 16 HE21 GLN 2 1HE2 GLN 2 -1.327 -2.670 -3.901 17 HE22 GLN 2 2HE2 GLN 2 -1.792 -2.847 -5.556 18 H ARG 3 H ARG 3 3.489 -2.925 -1.555 19 HA ARG 3 HA ARG 3 5.518 -3.459 -3.387 20 HB2 ARG 3 2HB ARG 3 7.067 -2.734 -1.537 21 HB3 ARG 3 3HB ARG 3 5.766 -1.610 -1.906 22 HG2 ARG 3 2HG ARG 3 5.641 -1.592 0.359 23 HG3 ARG 3 3HG ARG 3 4.551 -2.940 0.027 24 HD2 ARG 3 2HD ARG 3 5.831 -4.220 1.314 25 HD3 ARG 3 3HD ARG 3 7.126 -4.040 0.131 26 HE ARG 3 HE ARG 3 7.410 -1.819 1.598 27 HH11 ARG 3 1HH1 ARG 3 7.015 -5.157 2.504 28 HH12 ARG 3 2HH1 ARG 3 7.929 -5.004 3.968 29 HH21 ARG 3 1HH2 ARG 3 8.616 -1.604 3.523 30 HH22 ARG 3 2HH2 ARG 3 8.839 -2.982 4.547 31 H GLY 4 H GLY 4 4.253 -5.408 -0.851 32 HA2 GLY 4 2HA GLY 4 6.058 -7.559 -1.586 33 HA3 GLY 4 3HA GLY 4 6.205 -7.001 0.074 34 H ILE 5 H ILE 5 4.366 -8.853 -2.162 35 HA ILE 5 HA ILE 5 2.078 -9.193 -0.449 36 HB ILE 5 HB ILE 5 2.942 -10.566 -2.988 37 HG12 ILE 5 2HG1 ILE 5 0.450 -8.946 -2.529 38 HG13 ILE 5 3HG1 ILE 5 1.983 -8.158 -2.888 39 HG21 ILE 5 1HG2 ILE 5 1.796 -12.243 -1.746 40 HG22 ILE 5 2HG2 ILE 5 0.537 -11.109 -1.261 41 HG23 ILE 5 3HG2 ILE 5 0.665 -11.616 -2.945 42 HD11 ILE 5 3HD1 ILE 5 0.115 -9.379 -4.666 43 HD12 ILE 5 1HD1 ILE 5 1.564 -8.444 -5.036 44 HD13 ILE 5 2HD1 ILE 5 1.676 -10.189 -4.797 45 H VAL 6 H VAL 6 1.585 -10.907 0.855 46 HA VAL 6 HA VAL 6 3.615 -13.019 1.141 47 HB VAL 6 HB VAL 6 2.168 -11.857 3.510 48 HG11 VAL 6 1HG1 VAL 6 3.847 -12.975 4.797 49 HG12 VAL 6 2HG1 VAL 6 3.179 -14.134 3.647 50 HG13 VAL 6 3HG1 VAL 6 4.753 -13.397 3.344 51 HG21 VAL 6 3HG2 VAL 6 4.163 -10.545 4.008 52 HG22 VAL 6 1HG2 VAL 6 4.901 -11.079 2.498 53 HG23 VAL 6 2HG2 VAL 6 3.463 -10.060 2.464 54 H TRP 7 H TRP 7 2.818 -15.022 1.140 55 HA TRP 7 HA TRP 7 -0.096 -15.342 1.400 56 HB2 TRP 7 2HB TRP 7 1.935 -17.047 -0.057 57 HB3 TRP 7 3HB TRP 7 0.228 -17.450 0.105 58 HD1 TRP 7 HD1 TRP 7 -0.099 -13.974 -0.351 59 HE1 TRP 7 HE1 TRP 7 -0.350 -13.292 -2.820 60 HE3 TRP 7 HE3 TRP 7 1.592 -18.266 -2.555 61 HZ2 TRP 7 HZ2 TRP 7 0.108 -14.423 -5.365 62 HZ3 TRP 7 HZ3 TRP 7 1.653 -18.385 -5.012 63 HH2 TRP 7 HH2 TRP 7 0.926 -16.502 -6.386 64 H VAL 8 H VAL 8 -0.950 -16.911 2.731 65 HA VAL 8 HA VAL 8 0.957 -18.162 4.597 66 HB VAL 8 HB VAL 8 -1.946 -17.539 5.144 67 HG11 VAL 8 1HG1 VAL 8 -1.336 -19.218 6.621 68 HG12 VAL 8 2HG1 VAL 8 0.320 -18.626 6.769 69 HG13 VAL 8 3HG1 VAL 8 -1.003 -17.754 7.545 70 HG21 VAL 8 3HG2 VAL 8 -1.184 -15.636 6.439 71 HG22 VAL 8 1HG2 VAL 8 0.491 -15.990 6.017 72 HG23 VAL 8 2HG2 VAL 8 -0.643 -15.479 4.768 73 H VAL 9 H VAL 9 0.624 -20.300 5.248 74 HA VAL 9 HA VAL 9 -1.553 -21.851 4.170 75 HB VAL 9 HB VAL 9 0.163 -21.674 2.294 76 HG11 VAL 9 1HG1 VAL 9 1.697 -23.572 4.066 77 HG12 VAL 9 2HG1 VAL 9 2.132 -23.064 2.433 78 HG13 VAL 9 3HG1 VAL 9 2.146 -21.896 3.755 79 HG21 VAL 9 3HG2 VAL 9 -1.584 -23.380 2.349 80 HG22 VAL 9 1HG2 VAL 9 -0.086 -24.030 1.681 81 HG23 VAL 9 2HG2 VAL 9 -0.553 -24.414 3.338 82 H ASP 10 H ASP 10 -1.873 -23.745 5.271 83 HA ASP 10 HA ASP 10 0.107 -25.043 6.828 84 HB2 ASP 10 2HB ASP 10 -0.053 -23.230 8.363 85 HB3 ASP 10 3HB ASP 10 -1.812 -23.210 8.263 86 H ASP 11 H ASP 11 -3.171 -24.582 7.989 87 HA ASP 11 HA ASP 11 -4.530 -26.538 6.594 88 HB2 ASP 11 2HB ASP 11 -2.547 -27.713 8.210 89 HB3 ASP 11 3HB ASP 11 -4.076 -28.006 9.034 90 H ASP 12 H ASP 12 -3.952 -24.970 9.660 91 HA ASP 12 HA ASP 12 -6.712 -25.337 10.510 92 HB2 ASP 12 2HB ASP 12 -4.231 -24.859 11.831 93 HB3 ASP 12 3HB ASP 12 -5.319 -23.527 12.213 94 H SER 13 H SER 13 -8.029 -23.493 11.147 95 HA SER 13 HA SER 13 -8.016 -21.468 9.116 96 HB2 SER 13 2HB SER 13 -10.207 -21.608 9.576 97 HB3 SER 13 3HB SER 13 -9.888 -22.508 11.059 98 HG SER 13 HG SER 13 -10.920 -20.559 11.541 99 H SER 14 H SER 14 -7.853 -21.346 12.677 100 HA SER 14 HA SER 14 -7.345 -18.618 12.913 101 HB2 SER 14 2HB SER 14 -6.368 -20.837 14.728 102 HB3 SER 14 3HB SER 14 -6.494 -19.131 15.156 103 HG SER 14 HG SER 14 -8.560 -19.376 15.468 104 H ILE 15 H ILE 15 -5.075 -21.327 12.621 105 HA ILE 15 HA ILE 15 -2.677 -20.031 12.978 106 HB ILE 15 HB ILE 15 -3.341 -22.239 11.031 107 HG12 ILE 15 2HG1 ILE 15 -3.711 -22.844 13.354 108 HG13 ILE 15 3HG1 ILE 15 -2.270 -23.662 12.761 109 HG21 ILE 15 1HG2 ILE 15 -1.360 -21.553 10.126 110 HG22 ILE 15 2HG2 ILE 15 -0.778 -20.868 11.643 111 HG23 ILE 15 3HG2 ILE 15 -0.751 -22.614 11.396 112 HD11 ILE 15 3HD1 ILE 15 -2.571 -21.876 14.980 113 HD12 ILE 15 1HD1 ILE 15 -1.193 -22.876 14.522 114 HD13 ILE 15 2HD1 ILE 15 -1.368 -21.256 13.849 115 H ARG 16 H ARG 16 -4.678 -20.149 10.067 116 HA ARG 16 HA ARG 16 -2.785 -18.609 8.524 117 HB2 ARG 16 2HB ARG 16 -5.635 -19.390 7.885 118 HB3 ARG 16 3HB ARG 16 -4.477 -18.706 6.753 119 HG2 ARG 16 2HG ARG 16 -3.090 -20.667 6.910 120 HG3 ARG 16 3HG ARG 16 -4.132 -21.341 8.166 121 HD2 ARG 16 2HD ARG 16 -5.083 -20.675 5.387 122 HD3 ARG 16 3HD ARG 16 -4.490 -22.268 5.858 123 HE ARG 16 HE ARG 16 -6.410 -21.789 7.685 124 HH11 ARG 16 1HH1 ARG 16 -6.355 -21.590 4.210 125 HH12 ARG 16 2HH1 ARG 16 -8.034 -21.979 4.030 126 HH21 ARG 16 1HH2 ARG 16 -8.622 -22.303 7.462 127 HH22 ARG 16 2HH2 ARG 16 -9.322 -22.384 5.881 128 H TRP 17 H TRP 17 -5.510 -18.000 10.553 129 HA TRP 17 HA TRP 17 -6.214 -15.449 9.510 130 HB2 TRP 17 2HB TRP 17 -7.898 -16.455 10.787 131 HB3 TRP 17 3HB TRP 17 -6.785 -16.903 12.076 132 HD1 TRP 17 HD1 TRP 17 -8.802 -13.922 10.764 133 HE1 TRP 17 HE1 TRP 17 -8.946 -12.148 12.624 134 HE3 TRP 17 HE3 TRP 17 -5.600 -16.030 14.147 135 HZ2 TRP 17 HZ2 TRP 17 -7.848 -11.702 15.185 136 HZ3 TRP 17 HZ3 TRP 17 -5.201 -14.865 16.278 137 HH2 TRP 17 HH2 TRP 17 -6.303 -12.746 16.784 138 H VAL 18 H VAL 18 -4.309 -16.445 12.350 139 HA VAL 18 HA VAL 18 -3.631 -14.018 13.405 140 HB VAL 18 HB VAL 18 -1.595 -15.017 14.263 141 HG11 VAL 18 1HG1 VAL 18 -3.663 -15.678 15.330 142 HG12 VAL 18 2HG1 VAL 18 -3.886 -16.977 14.156 143 HG13 VAL 18 3HG1 VAL 18 -2.547 -17.042 15.302 144 HG21 VAL 18 3HG2 VAL 18 -1.918 -16.764 11.916 145 HG22 VAL 18 1HG2 VAL 18 -0.455 -16.221 12.738 146 HG23 VAL 18 2HG2 VAL 18 -1.386 -17.568 13.392 147 H LEU 19 H LEU 19 -2.314 -15.542 10.526 148 HA LEU 19 HA LEU 19 -0.314 -13.475 10.171 149 HB2 LEU 19 2HB LEU 19 -1.067 -15.982 8.744 150 HB3 LEU 19 3HB LEU 19 -0.126 -14.762 7.889 151 HG LEU 19 HG LEU 19 0.746 -15.955 10.512 152 HD11 LEU 19 1HD1 LEU 19 2.330 -17.272 9.014 153 HD12 LEU 19 2HD1 LEU 19 1.205 -16.911 7.705 154 HD13 LEU 19 3HD1 LEU 19 0.659 -17.828 9.109 155 HD21 LEU 19 3HD2 LEU 19 2.799 -14.951 10.110 156 HD22 LEU 19 1HD2 LEU 19 1.651 -13.729 9.564 157 HD23 LEU 19 2HD2 LEU 19 2.478 -14.750 8.387 158 H GLU 20 H GLU 20 -3.459 -14.350 8.893 159 HA GLU 20 HA GLU 20 -3.454 -12.602 6.670 160 HB2 GLU 20 2HB GLU 20 -5.174 -14.521 7.693 161 HB3 GLU 20 3HB GLU 20 -6.080 -13.024 7.864 162 HG2 GLU 20 2HG GLU 20 -4.759 -13.411 5.267 163 HG3 GLU 20 3HG GLU 20 -6.059 -14.542 5.640 164 H ARG 21 H ARG 21 -4.818 -12.257 9.940 165 HA ARG 21 HA ARG 21 -5.832 -9.667 9.619 166 HB2 ARG 21 2HB ARG 21 -5.878 -9.557 12.053 167 HB3 ARG 21 3HB ARG 21 -6.425 -11.134 11.500 168 HG2 ARG 21 2HG ARG 21 -4.596 -12.218 12.334 169 HG3 ARG 21 3HG ARG 21 -3.557 -10.798 12.200 170 HD2 ARG 21 2HD ARG 21 -5.784 -10.436 14.049 171 HD3 ARG 21 3HD ARG 21 -4.701 -11.747 14.512 172 HE ARG 21 HE ARG 21 -3.001 -9.725 13.957 173 HH11 ARG 21 1HH1 ARG 21 -5.831 -9.971 15.969 174 HH12 ARG 21 2HH1 ARG 21 -5.284 -8.786 17.109 175 HH21 ARG 21 1HH2 ARG 21 -2.269 -8.164 15.450 176 HH22 ARG 21 2HH2 ARG 21 -3.258 -7.758 16.812 177 H ALA 22 H ALA 22 -2.606 -10.794 9.993 178 HA ALA 22 HA ALA 22 -1.460 -8.422 11.069 179 HB1 ALA 22 1HB ALA 22 0.200 -9.871 11.336 180 HB2 ALA 22 2HB ALA 22 -0.543 -11.009 10.212 181 HB3 ALA 22 3HB ALA 22 0.523 -9.742 9.607 182 H LEU 23 H LEU 23 -1.785 -9.701 7.774 183 HA LEU 23 HA LEU 23 -0.565 -7.340 6.627 184 HB2 LEU 23 2HB LEU 23 -1.993 -9.561 5.184 185 HB3 LEU 23 3HB LEU 23 -0.830 -8.417 4.517 186 HG LEU 23 HG LEU 23 -0.085 -10.441 6.615 187 HD11 LEU 23 1HD1 LEU 23 -1.009 -11.573 4.616 188 HD12 LEU 23 2HD1 LEU 23 0.707 -11.889 4.866 189 HD13 LEU 23 3HD1 LEU 23 0.193 -10.742 3.629 190 HD21 LEU 23 3HD2 LEU 23 1.257 -8.257 5.764 191 HD22 LEU 23 1HD2 LEU 23 1.835 -9.461 4.612 192 HD23 LEU 23 2HD2 LEU 23 2.034 -9.731 6.343 193 H ALA 24 H ALA 24 -3.776 -8.681 7.071 194 HA ALA 24 HA ALA 24 -5.278 -7.156 5.336 195 HB1 ALA 24 1HB ALA 24 -6.458 -8.801 6.466 196 HB2 ALA 24 2HB ALA 24 -5.863 -8.285 8.045 197 HB3 ALA 24 3HB ALA 24 -7.065 -7.314 7.196 198 H GLY 25 H GLY 25 -3.767 -6.207 8.345 199 HA2 GLY 25 2HA GLY 25 -5.160 -3.660 8.424 200 HA3 GLY 25 3HA GLY 25 -3.942 -4.220 9.559 201 H ALA 26 H ALA 26 -2.181 -4.920 7.198 202 HA ALA 26 HA ALA 26 -1.029 -2.249 6.918 203 HB1 ALA 26 1HB ALA 26 0.244 -4.802 5.986 204 HB2 ALA 26 2HB ALA 26 1.015 -3.281 6.438 205 HB3 ALA 26 3HB ALA 26 0.290 -4.305 7.677 206 H GLY 27 H GLY 27 0.407 -2.453 4.613 207 HA2 GLY 27 2HA GLY 27 -1.735 -2.415 2.599 208 HA3 GLY 27 3HA GLY 27 -0.208 -1.553 2.485 209 H LEU 28 H LEU 28 -0.832 -4.960 3.258 210 HA LEU 28 HA LEU 28 0.534 -5.709 0.764 211 HB2 LEU 28 2HB LEU 28 1.051 -7.563 2.926 212 HB3 LEU 28 3HB LEU 28 2.173 -6.795 1.805 213 HG LEU 28 HG LEU 28 1.115 -5.449 4.285 214 HD11 LEU 28 1HD1 LEU 28 2.824 -7.627 4.227 215 HD12 LEU 28 2HD1 LEU 28 2.630 -6.475 5.547 216 HD13 LEU 28 3HD1 LEU 28 3.900 -6.235 4.347 217 HD21 LEU 28 3HD2 LEU 28 3.588 -4.420 3.576 218 HD22 LEU 28 1HD2 LEU 28 2.018 -3.660 3.317 219 HD23 LEU 28 2HD2 LEU 28 2.749 -4.630 2.038 220 H THR 29 H THR 29 -0.295 -7.441 -0.297 221 HA THR 29 HA THR 29 -2.924 -8.265 0.247 222 HB THR 29 HB THR 29 -0.980 -9.826 -1.450 223 HG1 THR 29 HG1 THR 29 -1.935 -8.325 -3.130 224 HG21 THR 29 3HG2 THR 29 -3.952 -9.553 -1.276 225 HG22 THR 29 1HG2 THR 29 -2.967 -11.007 -1.429 226 HG23 THR 29 2HG2 THR 29 -3.204 -9.952 -2.823 227 H CYS 30 H CYS 30 -3.691 -10.441 0.693 228 HA CYS 30 HA CYS 30 -1.831 -12.148 2.171 229 HB2 CYS 30 2HB CYS 30 -3.618 -12.420 3.957 230 HB3 CYS 30 3HB CYS 30 -2.758 -10.886 3.952 231 HG CYS 30 HG CYS 30 -4.772 -9.330 3.221 232 H THR 31 H THR 31 -1.962 -14.082 1.266 233 HA THR 31 HA THR 31 -4.605 -15.046 0.382 234 HB THR 31 HB THR 31 -1.994 -15.916 -0.851 235 HG1 THR 31 HG1 THR 31 -3.783 -13.934 -1.850 236 HG21 THR 31 3HG2 THR 31 -3.348 -16.797 -2.599 237 HG22 THR 31 1HG2 THR 31 -4.788 -15.990 -1.981 238 HG23 THR 31 2HG2 THR 31 -4.073 -17.328 -1.082 239 H THR 32 H THR 32 -5.291 -16.575 1.722 240 HA THR 32 HA THR 32 -3.333 -18.337 3.016 241 HB THR 32 HB THR 32 -4.947 -18.817 4.681 242 HG1 THR 32 HG1 THR 32 -7.142 -17.767 4.335 243 HG21 THR 32 3HG2 THR 32 -5.734 -15.991 4.303 244 HG22 THR 32 1HG2 THR 32 -4.004 -16.323 4.357 245 HG23 THR 32 2HG2 THR 32 -5.035 -16.794 5.708 246 H PHE 33 H PHE 33 -3.164 -20.417 2.474 247 HA PHE 33 HA PHE 33 -5.231 -21.555 0.711 248 HB2 PHE 33 2HB PHE 33 -2.283 -22.210 0.894 249 HB3 PHE 33 3HB PHE 33 -3.437 -23.058 -0.131 250 HD1 PHE 33 HD1 PHE 33 -1.638 -19.905 0.403 251 HD2 PHE 33 HD2 PHE 33 -4.235 -22.090 -2.166 252 HE1 PHE 33 HE1 PHE 33 -1.249 -18.259 -1.385 253 HE2 PHE 33 HE2 PHE 33 -3.849 -20.449 -3.958 254 HZ PHE 33 HZ PHE 33 -2.354 -18.531 -3.569 255 H GLU 34 H GLU 34 -4.624 -24.190 0.796 256 HA GLU 34 HA GLU 34 -4.987 -24.897 3.635 257 HB2 GLU 34 2HB GLU 34 -6.166 -26.435 1.328 258 HB3 GLU 34 3HB GLU 34 -6.564 -26.566 3.035 259 HG2 GLU 34 2HG GLU 34 -7.525 -24.310 2.970 260 HG3 GLU 34 3HG GLU 34 -7.162 -24.220 1.247 261 H ASN 35 H ASN 35 -3.839 -26.044 0.482 262 HA ASN 35 HA ASN 35 -1.985 -27.837 1.909 263 HB2 ASN 35 2HB ASN 35 -3.878 -28.406 -0.201 264 HB3 ASN 35 3HB ASN 35 -2.239 -28.786 -0.722 265 HD21 ASN 35 1HD2 ASN 35 -4.720 -30.349 0.181 266 HD22 ASN 35 2HD2 ASN 35 -4.075 -31.511 1.286 267 H GLY 36 H GLY 36 0.128 -27.567 1.521 268 HA2 GLY 36 2HA GLY 36 1.161 -25.345 0.235 269 HA3 GLY 36 3HA GLY 36 2.081 -26.800 0.589 270 H ASN 37 H ASN 37 0.549 -28.559 -1.079 271 HA ASN 37 HA ASN 37 1.942 -28.321 -3.482 272 HB2 ASN 37 2HB ASN 37 0.722 -30.364 -2.450 273 HB3 ASN 37 3HB ASN 37 -0.692 -29.759 -3.307 274 HD21 ASN 37 1HD2 ASN 37 2.055 -31.649 -3.508 275 HD22 ASN 37 2HD2 ASN 37 2.093 -31.875 -5.221 276 H GLU 38 H GLU 38 -0.993 -26.841 -2.442 277 HA GLU 38 HA GLU 38 -1.815 -26.133 -5.139 278 HB2 GLU 38 2HB GLU 38 -3.096 -24.974 -2.702 279 HB3 GLU 38 3HB GLU 38 -3.824 -25.439 -4.233 280 HG2 GLU 38 2HG GLU 38 -2.842 -27.321 -2.099 281 HG3 GLU 38 3HG GLU 38 -4.524 -26.912 -2.432 282 H VAL 39 H VAL 39 0.187 -24.899 -2.703 283 HA VAL 39 HA VAL 39 -0.139 -22.113 -3.463 284 HB VAL 39 HB VAL 39 2.010 -23.187 -1.654 285 HG11 VAL 39 1HG1 VAL 39 2.177 -21.029 -0.835 286 HG12 VAL 39 2HG1 VAL 39 1.851 -20.753 -2.547 287 HG13 VAL 39 3HG1 VAL 39 0.553 -20.592 -1.364 288 HG21 VAL 39 3HG2 VAL 39 0.433 -22.774 0.229 289 HG22 VAL 39 1HG2 VAL 39 -0.860 -22.586 -0.955 290 HG23 VAL 39 2HG2 VAL 39 -0.025 -24.131 -0.799 291 H LEU 40 H LEU 40 2.195 -24.726 -3.846 292 HA LEU 40 HA LEU 40 4.365 -23.370 -4.867 293 HB2 LEU 40 2HB LEU 40 4.832 -25.577 -4.606 294 HB3 LEU 40 3HB LEU 40 3.254 -26.092 -5.199 295 HG LEU 40 HG LEU 40 3.977 -25.737 -7.494 296 HD11 LEU 40 1HD1 LEU 40 5.967 -24.138 -6.283 297 HD12 LEU 40 2HD1 LEU 40 5.667 -24.399 -8.001 298 HD13 LEU 40 3HD1 LEU 40 6.785 -25.449 -7.132 299 HD21 LEU 40 3HD2 LEU 40 4.722 -27.783 -5.860 300 HD22 LEU 40 1HD2 LEU 40 6.274 -27.282 -6.532 301 HD23 LEU 40 2HD2 LEU 40 4.957 -27.751 -7.608 302 H ALA 41 H ALA 41 1.475 -24.484 -6.591 303 HA ALA 41 HA ALA 41 2.355 -23.563 -9.145 304 HB1 ALA 41 1HB ALA 41 -0.349 -23.733 -9.389 305 HB2 ALA 41 2HB ALA 41 0.766 -25.087 -9.575 306 HB3 ALA 41 3HB ALA 41 -0.048 -24.821 -8.033 307 H ALA 42 H ALA 42 0.615 -22.142 -6.479 308 HA ALA 42 HA ALA 42 -0.609 -19.989 -7.776 309 HB1 ALA 42 1HB ALA 42 0.506 -20.023 -4.975 310 HB2 ALA 42 2HB ALA 42 -0.736 -18.940 -5.604 311 HB3 ALA 42 3HB ALA 42 -1.067 -20.665 -5.448 312 H LEU 43 H LEU 43 2.678 -20.407 -6.589 313 HA LEU 43 HA LEU 43 3.577 -17.780 -6.730 314 HB2 LEU 43 2HB LEU 43 5.276 -20.115 -7.538 315 HB3 LEU 43 3HB LEU 43 5.760 -18.637 -6.709 316 HG LEU 43 HG LEU 43 4.155 -20.903 -5.528 317 HD11 LEU 43 1HD1 LEU 43 7.011 -20.020 -5.231 318 HD12 LEU 43 2HD1 LEU 43 6.395 -21.605 -5.699 319 HD13 LEU 43 3HD1 LEU 43 6.200 -21.038 -4.041 320 HD21 LEU 43 3HD2 LEU 43 4.066 -19.713 -3.514 321 HD22 LEU 43 1HD2 LEU 43 3.629 -18.529 -4.745 322 HD23 LEU 43 2HD2 LEU 43 5.254 -18.527 -4.058 323 H ALA 44 H ALA 44 3.213 -20.195 -9.263 324 HA ALA 44 HA ALA 44 4.601 -18.867 -11.308 325 HB1 ALA 44 1HB ALA 44 3.459 -21.273 -11.130 326 HB2 ALA 44 2HB ALA 44 2.207 -20.439 -12.051 327 HB3 ALA 44 3HB ALA 44 3.856 -20.516 -12.673 328 H SER 45 H SER 45 1.675 -18.092 -9.767 329 HA SER 45 HA SER 45 0.377 -16.779 -11.946 330 HB2 SER 45 2HB SER 45 -0.034 -16.396 -8.970 331 HB3 SER 45 3HB SER 45 -1.138 -15.887 -10.247 332 HG SER 45 HG SER 45 -1.974 -17.793 -9.909 333 H LYS 46 H LYS 46 1.518 -15.272 -8.933 334 HA LYS 46 HA LYS 46 2.641 -13.079 -10.548 335 HB2 LYS 46 2HB LYS 46 1.912 -11.500 -8.807 336 HB3 LYS 46 3HB LYS 46 0.550 -12.331 -9.547 337 HG2 LYS 46 2HG LYS 46 0.891 -13.969 -7.507 338 HG3 LYS 46 3HG LYS 46 1.633 -12.536 -6.791 339 HD2 LYS 46 2HD LYS 46 -1.064 -12.416 -8.105 340 HD3 LYS 46 3HD LYS 46 -0.882 -12.910 -6.420 341 HE2 LYS 46 2HE LYS 46 -0.815 -10.772 -5.825 342 HE3 LYS 46 3HE LYS 46 0.661 -10.572 -6.768 343 HZ1 LYS 46 3HZ LYS 46 -2.126 -10.170 -7.703 344 HZ2 LYS 46 1HZ LYS 46 -0.782 -10.170 -8.730 345 HZ3 LYS 46 2HZ LYS 46 -0.926 -8.991 -7.525 346 H THR 47 H THR 47 3.202 -15.465 -8.283 347 HA THR 47 HA THR 47 4.981 -16.014 -6.973 348 HB THR 47 HB THR 47 6.826 -13.922 -7.806 349 HG1 THR 47 HG1 THR 47 6.107 -13.792 -9.799 350 HG21 THR 47 3HG2 THR 47 7.161 -16.706 -8.720 351 HG22 THR 47 1HG2 THR 47 7.015 -16.488 -6.977 352 HG23 THR 47 2HG2 THR 47 8.286 -15.650 -7.866 353 HA PRO 48 HA PRO 48 4.143 -12.964 -3.762 354 HB2 PRO 48 2HB PRO 48 4.657 -14.662 -1.707 355 HB3 PRO 48 3HB PRO 48 3.123 -14.653 -2.585 356 HG2 PRO 48 2HG PRO 48 5.478 -16.474 -2.903 357 HG3 PRO 48 3HG PRO 48 3.750 -16.872 -2.885 358 HD2 PRO 48 2HD PRO 48 5.175 -16.669 -5.179 359 HD3 PRO 48 3HD PRO 48 3.454 -16.243 -5.083 360 H ASP 49 H ASP 49 5.421 -11.982 -2.086 361 HA ASP 49 HA ASP 49 8.238 -11.953 -2.733 362 HB2 ASP 49 2HB ASP 49 6.360 -10.229 -1.251 363 HB3 ASP 49 3HB ASP 49 7.996 -10.273 -0.601 364 H VAL 50 H VAL 50 6.211 -13.479 -0.449 365 HA VAL 50 HA VAL 50 8.260 -15.044 0.646 366 HB VAL 50 HB VAL 50 8.992 -13.053 1.809 367 HG11 VAL 50 1HG1 VAL 50 6.702 -12.689 3.548 368 HG12 VAL 50 2HG1 VAL 50 7.623 -11.496 2.629 369 HG13 VAL 50 3HG1 VAL 50 6.305 -12.379 1.858 370 HG21 VAL 50 3HG2 VAL 50 8.560 -15.449 2.965 371 HG22 VAL 50 1HG2 VAL 50 9.348 -14.097 3.778 372 HG23 VAL 50 2HG2 VAL 50 7.633 -14.410 4.047 373 H LEU 51 H LEU 51 7.465 -16.703 1.922 374 HA LEU 51 HA LEU 51 4.564 -16.653 2.434 375 HB2 LEU 51 2HB LEU 51 5.935 -18.305 0.666 376 HB3 LEU 51 3HB LEU 51 5.651 -19.313 2.084 377 HG LEU 51 HG LEU 51 3.297 -17.828 1.142 378 HD11 LEU 51 1HD1 LEU 51 4.590 -18.507 -0.960 379 HD12 LEU 51 2HD1 LEU 51 2.906 -19.012 -0.831 380 HD13 LEU 51 3HD1 LEU 51 4.199 -20.166 -0.506 381 HD21 LEU 51 3HD2 LEU 51 2.701 -19.354 2.714 382 HD22 LEU 51 1HD2 LEU 51 4.002 -20.467 2.289 383 HD23 LEU 51 2HD2 LEU 51 2.552 -20.382 1.288 384 H LEU 52 H LEU 52 3.848 -18.121 4.155 385 HA LEU 52 HA LEU 52 5.929 -18.756 6.123 386 HB2 LEU 52 2HB LEU 52 3.352 -17.651 7.106 387 HB3 LEU 52 3HB LEU 52 4.953 -17.602 7.841 388 HG LEU 52 HG LEU 52 5.295 -16.009 5.648 389 HD11 LEU 52 1HD1 LEU 52 3.235 -14.421 6.038 390 HD12 LEU 52 2HD1 LEU 52 2.435 -15.933 6.464 391 HD13 LEU 52 3HD1 LEU 52 3.163 -15.740 4.870 392 HD21 LEU 52 3HD2 LEU 52 5.139 -14.141 7.259 393 HD22 LEU 52 1HD2 LEU 52 6.076 -15.502 7.873 394 HD23 LEU 52 2HD2 LEU 52 4.423 -15.246 8.433 395 H SER 53 H SER 53 5.737 -20.945 5.813 396 HA SER 53 HA SER 53 3.107 -22.186 6.007 397 HB2 SER 53 2HB SER 53 4.439 -23.138 4.292 398 HB3 SER 53 3HB SER 53 5.854 -23.239 5.339 399 HG SER 53 HG SER 53 3.549 -24.848 5.299 400 H ASP 54 H ASP 54 2.402 -23.386 7.697 401 HA ASP 54 HA ASP 54 3.971 -23.235 10.153 402 HB2 ASP 54 2HB ASP 54 1.327 -22.788 9.697 403 HB3 ASP 54 3HB ASP 54 1.289 -24.463 10.241 404 H ILE 55 H ILE 55 3.440 -25.402 7.670 405 HA ILE 55 HA ILE 55 3.805 -27.632 7.380 406 HB ILE 55 HB ILE 55 5.533 -27.288 9.835 407 HG12 ILE 55 2HG1 ILE 55 6.349 -27.210 6.926 408 HG13 ILE 55 3HG1 ILE 55 6.018 -25.767 7.878 409 HG21 ILE 55 1HG2 ILE 55 5.009 -29.551 8.037 410 HG22 ILE 55 2HG2 ILE 55 6.713 -29.220 8.347 411 HG23 ILE 55 3HG2 ILE 55 5.617 -29.531 9.693 412 HD11 ILE 55 3HD1 ILE 55 8.074 -27.799 8.679 413 HD12 ILE 55 1HD1 ILE 55 8.435 -26.424 7.636 414 HD13 ILE 55 2HD1 ILE 55 7.866 -26.156 9.283 415 H ARG 56 H ARG 56 1.743 -28.414 7.778 416 HA ARG 56 HA ARG 56 1.500 -30.120 10.074 417 HB2 ARG 56 2HB ARG 56 0.594 -27.576 10.485 418 HB3 ARG 56 3HB ARG 56 -0.861 -28.373 9.903 419 HG2 ARG 56 2HG ARG 56 -1.189 -29.299 11.884 420 HG3 ARG 56 3HG ARG 56 0.410 -30.044 11.837 421 HD2 ARG 56 2HD ARG 56 1.306 -28.495 13.196 422 HD3 ARG 56 3HD ARG 56 0.424 -27.174 12.430 423 HE ARG 56 HE ARG 56 -0.320 -28.596 14.795 424 HH11 ARG 56 1HH1 ARG 56 -1.554 -26.854 12.044 425 HH12 ARG 56 2HH1 ARG 56 -3.027 -26.394 12.832 426 HH21 ARG 56 1HH2 ARG 56 -2.256 -27.995 15.843 427 HH22 ARG 56 2HH2 ARG 56 -3.424 -27.042 14.993 428 H MET 57 H MET 57 1.612 -30.643 7.344 429 HA MET 57 HA MET 57 -1.154 -31.331 6.630 430 HB2 MET 57 2HB MET 57 1.172 -31.633 4.764 431 HB3 MET 57 3HB MET 57 -0.523 -31.359 4.386 432 HG2 MET 57 2HG MET 57 0.228 -29.284 3.950 433 HG3 MET 57 3HG MET 57 -0.015 -29.088 5.684 434 HE1 MET 57 3HE MET 57 1.379 -27.117 4.429 435 HE2 MET 57 1HE MET 57 3.082 -26.969 4.867 436 HE3 MET 57 2HE MET 57 2.629 -27.685 3.320 437 HA PRO 58 HA PRO 58 -0.480 -35.601 7.422 438 HB2 PRO 58 2HB PRO 58 -2.189 -36.702 5.623 439 HB3 PRO 58 3HB PRO 58 -2.736 -35.880 7.089 440 HG2 PRO 58 2HG PRO 58 -2.583 -34.847 4.283 441 HG3 PRO 58 3HG PRO 58 -3.873 -34.642 5.482 442 HD2 PRO 58 2HD PRO 58 -2.043 -32.714 4.968 443 HD3 PRO 58 3HD PRO 58 -2.761 -32.945 6.575 444 H GLY 59 H GLY 59 -0.693 -34.879 3.927 445 HA2 GLY 59 2HA GLY 59 0.961 -37.101 3.205 446 HA3 GLY 59 3HA GLY 59 0.426 -35.811 2.139 447 H MET 60 H MET 60 1.505 -33.582 2.943 448 HA MET 60 HA MET 60 4.348 -34.034 2.595 449 HB2 MET 60 2HB MET 60 2.534 -31.663 2.410 450 HB3 MET 60 3HB MET 60 4.260 -31.404 2.623 451 HG2 MET 60 2HG MET 60 4.553 -31.657 0.452 452 HG3 MET 60 3HG MET 60 3.964 -33.313 0.574 453 HE1 MET 60 3HE MET 60 2.560 -30.009 -1.709 454 HE2 MET 60 1HE MET 60 1.989 -29.468 -0.130 455 HE3 MET 60 2HE MET 60 3.680 -29.917 -0.350 456 H ASP 61 H ASP 61 5.934 -33.569 4.048 457 HA ASP 61 HA ASP 61 5.091 -33.217 6.809 458 HB2 ASP 61 2HB ASP 61 7.686 -33.985 5.494 459 HB3 ASP 61 3HB ASP 61 7.620 -33.558 7.201 460 H GLY 62 H GLY 62 5.398 -31.085 4.515 461 HA2 GLY 62 2HA GLY 62 5.432 -28.742 5.015 462 HA3 GLY 62 3HA GLY 62 6.577 -29.072 6.308 463 H LEU 63 H LEU 63 8.740 -29.898 5.595 464 HA LEU 63 HA LEU 63 9.894 -28.096 3.766 465 HB2 LEU 63 2HB LEU 63 11.854 -29.812 3.948 466 HB3 LEU 63 3HB LEU 63 11.404 -28.809 5.325 467 HG LEU 63 HG LEU 63 10.291 -30.650 6.382 468 HD11 LEU 63 1HD1 LEU 63 9.225 -31.900 4.781 469 HD12 LEU 63 2HD1 LEU 63 10.590 -32.948 5.166 470 HD13 LEU 63 3HD1 LEU 63 10.632 -31.941 3.718 471 HD21 LEU 63 3HD2 LEU 63 12.321 -32.383 6.162 472 HD22 LEU 63 1HD2 LEU 63 12.431 -30.879 7.076 473 HD23 LEU 63 2HD2 LEU 63 13.073 -30.962 5.435 474 H ALA 64 H ALA 64 8.216 -30.987 3.258 475 HA ALA 64 HA ALA 64 9.414 -32.247 1.150 476 HB1 ALA 64 1HB ALA 64 6.981 -32.605 0.325 477 HB2 ALA 64 2HB ALA 64 7.470 -33.256 1.889 478 HB3 ALA 64 3HB ALA 64 6.539 -31.761 1.809 479 H LEU 65 H LEU 65 7.003 -29.637 0.783 480 HA LEU 65 HA LEU 65 7.800 -29.244 -1.975 481 HB2 LEU 65 2HB LEU 65 5.884 -28.026 -2.237 482 HB3 LEU 65 3HB LEU 65 5.418 -29.093 -0.914 483 HG LEU 65 HG LEU 65 6.377 -26.260 -0.533 484 HD11 LEU 65 1HD1 LEU 65 4.308 -26.245 -1.801 485 HD12 LEU 65 2HD1 LEU 65 4.020 -25.705 -0.148 486 HD13 LEU 65 3HD1 LEU 65 3.562 -27.337 -0.634 487 HD21 LEU 65 3HD2 LEU 65 6.640 -27.100 1.543 488 HD22 LEU 65 1HD2 LEU 65 5.563 -28.465 1.246 489 HD23 LEU 65 2HD2 LEU 65 4.892 -26.878 1.628 490 H LEU 66 H LEU 66 8.415 -27.840 1.122 491 HA LEU 66 HA LEU 66 9.209 -25.259 0.307 492 HB2 LEU 66 2HB LEU 66 8.891 -26.530 2.696 493 HB3 LEU 66 3HB LEU 66 10.646 -26.407 2.591 494 HG LEU 66 HG LEU 66 9.897 -24.533 3.826 495 HD11 LEU 66 1HD1 LEU 66 10.431 -23.692 0.981 496 HD12 LEU 66 2HD1 LEU 66 11.638 -24.020 2.224 497 HD13 LEU 66 3HD1 LEU 66 10.548 -22.645 2.396 498 HD21 LEU 66 3HD2 LEU 66 7.730 -24.023 3.588 499 HD22 LEU 66 1HD2 LEU 66 7.680 -24.594 1.920 500 HD23 LEU 66 2HD2 LEU 66 8.274 -22.973 2.278 501 H LYS 67 H LYS 67 10.737 -28.336 0.088 502 HA LYS 67 HA LYS 67 13.434 -27.457 -0.047 503 HB2 LYS 67 2HB LYS 67 11.981 -29.947 -0.339 504 HB3 LYS 67 3HB LYS 67 13.242 -29.804 -1.557 505 HG2 LYS 67 2HG LYS 67 14.321 -30.863 0.190 506 HG3 LYS 67 3HG LYS 67 14.771 -29.172 0.420 507 HD2 LYS 67 2HD LYS 67 12.832 -28.996 2.024 508 HD3 LYS 67 3HD LYS 67 12.690 -30.753 1.919 509 HE2 LYS 67 2HE LYS 67 14.389 -31.052 3.327 510 HE3 LYS 67 3HE LYS 67 15.419 -29.944 2.421 511 HZ1 LYS 67 3HZ LYS 67 15.077 -28.342 3.903 512 HZ2 LYS 67 1HZ LYS 67 14.387 -29.514 4.910 513 HZ3 LYS 67 2HZ LYS 67 13.401 -28.573 3.909 514 H GLN 68 H GLN 68 10.825 -27.566 -2.323 515 HA GLN 68 HA GLN 68 12.555 -27.238 -4.625 516 HB2 GLN 68 2HB GLN 68 10.685 -27.562 -5.933 517 HB3 GLN 68 3HB GLN 68 10.234 -28.452 -4.485 518 HG2 GLN 68 2HG GLN 68 9.261 -26.026 -3.860 519 HG3 GLN 68 3HG GLN 68 9.115 -25.977 -5.616 520 HE21 GLN 68 1HE2 GLN 68 6.938 -25.940 -3.861 521 HE22 GLN 68 2HE2 GLN 68 6.027 -27.390 -4.090 522 H ILE 69 H ILE 69 10.868 -25.263 -2.371 523 HA ILE 69 HA ILE 69 10.457 -22.950 -3.905 524 HB ILE 69 HB ILE 69 10.993 -23.227 -0.947 525 HG12 ILE 69 2HG1 ILE 69 8.417 -22.862 -2.494 526 HG13 ILE 69 3HG1 ILE 69 8.964 -24.368 -1.765 527 HG21 ILE 69 1HG2 ILE 69 11.529 -20.982 -1.577 528 HG22 ILE 69 2HG2 ILE 69 10.064 -20.850 -2.547 529 HG23 ILE 69 3HG2 ILE 69 9.950 -20.967 -0.791 530 HD11 ILE 69 3HD1 ILE 69 7.510 -22.199 -0.593 531 HD12 ILE 69 1HD1 ILE 69 7.871 -23.795 0.066 532 HD13 ILE 69 2HD1 ILE 69 9.015 -22.470 0.286 533 H LYS 70 H LYS 70 13.289 -24.185 -2.249 534 HA LYS 70 HA LYS 70 14.810 -21.761 -2.641 535 HB2 LYS 70 2HB LYS 70 15.131 -24.266 -1.195 536 HB3 LYS 70 3HB LYS 70 16.606 -23.793 -2.028 537 HG2 LYS 70 2HG LYS 70 16.963 -22.668 -0.109 538 HG3 LYS 70 3HG LYS 70 15.977 -21.447 -0.915 539 HD2 LYS 70 2HD LYS 70 14.478 -23.495 0.576 540 HD3 LYS 70 3HD LYS 70 15.475 -22.423 1.561 541 HE2 LYS 70 2HE LYS 70 13.419 -21.542 -0.464 542 HE3 LYS 70 3HE LYS 70 13.185 -21.572 1.283 543 HZ1 LYS 70 3HZ LYS 70 13.994 -19.523 1.309 544 HZ2 LYS 70 1HZ LYS 70 14.440 -19.594 -0.321 545 HZ3 LYS 70 2HZ LYS 70 15.504 -20.148 0.871 546 H GLN 71 H GLN 71 14.265 -24.744 -4.318 547 HA GLN 71 HA GLN 71 16.574 -24.459 -6.035 548 HB2 GLN 71 2HB GLN 71 14.641 -26.519 -5.436 549 HB3 GLN 71 3HB GLN 71 14.802 -26.313 -7.175 550 HG2 GLN 71 2HG GLN 71 17.406 -26.304 -6.085 551 HG3 GLN 71 3HG GLN 71 16.532 -27.654 -5.362 552 HE21 GLN 71 1HE2 GLN 71 18.536 -26.922 -7.766 553 HE22 GLN 71 2HE2 GLN 71 18.055 -28.082 -8.953 554 H ARG 72 H ARG 72 13.258 -23.504 -6.020 555 HA ARG 72 HA ARG 72 13.378 -22.789 -8.865 556 HB2 ARG 72 2HB ARG 72 11.381 -24.019 -7.484 557 HB3 ARG 72 3HB ARG 72 10.867 -22.340 -7.387 558 HG2 ARG 72 2HG ARG 72 11.700 -23.343 -10.044 559 HG3 ARG 72 3HG ARG 72 10.175 -23.943 -9.389 560 HD2 ARG 72 2HD ARG 72 9.216 -21.830 -9.347 561 HD3 ARG 72 3HD ARG 72 10.778 -21.014 -9.373 562 HE ARG 72 HE ARG 72 10.695 -21.051 -11.650 563 HH11 ARG 72 1HH1 ARG 72 8.523 -23.478 -10.420 564 HH12 ARG 72 2HH1 ARG 72 7.888 -23.886 -11.979 565 HH21 ARG 72 1HH2 ARG 72 9.866 -21.580 -13.709 566 HH22 ARG 72 2HH2 ARG 72 8.653 -22.807 -13.849 567 H HIS 73 H HIS 73 12.282 -21.398 -5.768 568 HA HIS 73 HA HIS 73 12.908 -18.732 -6.854 569 HB2 HIS 73 2HB HIS 73 11.096 -19.200 -4.501 570 HB3 HIS 73 3HB HIS 73 11.176 -17.803 -5.571 571 HD1 HIS 73 HD1 HIS 73 9.999 -18.021 -7.889 572 HD2 HIS 73 HD2 HIS 73 9.460 -21.274 -5.362 573 HE1 HIS 73 HE1 HIS 73 8.117 -19.350 -8.896 574 HA PRO 74 HA PRO 74 15.998 -19.551 -3.507 575 HB2 PRO 74 2HB PRO 74 18.078 -18.433 -4.846 576 HB3 PRO 74 3HB PRO 74 17.597 -20.121 -5.055 577 HG2 PRO 74 2HG PRO 74 16.971 -17.747 -6.768 578 HG3 PRO 74 3HG PRO 74 17.452 -19.382 -7.255 579 HD2 PRO 74 2HD PRO 74 14.879 -18.541 -7.318 580 HD3 PRO 74 3HD PRO 74 15.325 -20.226 -6.980 581 H MET 75 H MET 75 15.686 -16.663 -5.568 582 HA MET 75 HA MET 75 16.694 -14.876 -3.590 583 HB2 MET 75 2HB MET 75 15.977 -13.104 -5.098 584 HB3 MET 75 3HB MET 75 16.796 -14.375 -5.997 585 HG2 MET 75 2HG MET 75 15.028 -14.707 -7.284 586 HG3 MET 75 3HG MET 75 13.965 -14.868 -5.888 587 HE1 MET 75 3HE MET 75 12.012 -13.817 -6.062 588 HE2 MET 75 1HE MET 75 12.485 -12.594 -4.883 589 HE3 MET 75 2HE MET 75 11.678 -12.114 -6.376 590 H LEU 76 H LEU 76 13.789 -16.507 -3.862 591 HA LEU 76 HA LEU 76 12.155 -14.435 -2.644 592 HB2 LEU 76 2HB LEU 76 10.965 -15.701 -4.203 593 HB3 LEU 76 3HB LEU 76 11.644 -17.220 -3.623 594 HG LEU 76 HG LEU 76 10.288 -16.960 -1.549 595 HD11 LEU 76 1HD1 LEU 76 9.628 -14.841 -1.176 596 HD12 LEU 76 2HD1 LEU 76 8.251 -15.307 -2.174 597 HD13 LEU 76 3HD1 LEU 76 9.603 -14.432 -2.892 598 HD21 LEU 76 3HD2 LEU 76 8.086 -17.413 -2.708 599 HD22 LEU 76 1HD2 LEU 76 9.442 -18.430 -3.193 600 HD23 LEU 76 2HD2 LEU 76 8.925 -17.099 -4.228 601 HA PRO 77 HA PRO 77 13.509 -15.865 1.386 602 HB2 PRO 77 2HB PRO 77 12.247 -13.900 2.769 603 HB3 PRO 77 3HB PRO 77 13.783 -13.650 1.932 604 HG2 PRO 77 2HG PRO 77 11.009 -12.954 1.048 605 HG3 PRO 77 3HG PRO 77 12.497 -11.998 0.920 606 HD2 PRO 77 2HD PRO 77 11.475 -13.388 -1.167 607 HD3 PRO 77 3HD PRO 77 13.219 -13.138 -0.948 608 H VAL 78 H VAL 78 12.577 -17.304 2.711 609 HA VAL 78 HA VAL 78 9.645 -17.304 2.964 610 HB VAL 78 HB VAL 78 11.386 -19.733 2.520 611 HG11 VAL 78 1HG1 VAL 78 8.466 -19.490 3.215 612 HG12 VAL 78 2HG1 VAL 78 9.195 -20.957 2.557 613 HG13 VAL 78 3HG1 VAL 78 9.726 -20.330 4.118 614 HG21 VAL 78 3HG2 VAL 78 9.993 -18.012 0.727 615 HG22 VAL 78 1HG2 VAL 78 10.924 -19.466 0.366 616 HG23 VAL 78 2HG2 VAL 78 9.202 -19.588 0.727 617 H ILE 79 H ILE 79 8.824 -18.201 4.909 618 HA ILE 79 HA ILE 79 10.821 -18.501 7.054 619 HB ILE 79 HB ILE 79 8.119 -17.185 7.345 620 HG12 ILE 79 2HG1 ILE 79 10.735 -15.755 7.651 621 HG13 ILE 79 3HG1 ILE 79 10.057 -15.985 6.043 622 HG21 ILE 79 1HG2 ILE 79 10.396 -17.259 9.312 623 HG22 ILE 79 2HG2 ILE 79 8.746 -16.699 9.582 624 HG23 ILE 79 3HG2 ILE 79 9.063 -18.414 9.327 625 HD11 ILE 79 3HD1 ILE 79 8.685 -14.281 6.334 626 HD12 ILE 79 1HD1 ILE 79 8.040 -14.993 7.812 627 HD13 ILE 79 2HD1 ILE 79 9.470 -13.963 7.881 628 H ILE 80 H ILE 80 10.547 -20.169 8.441 629 HA ILE 80 HA ILE 80 8.329 -22.001 7.872 630 HB ILE 80 HB ILE 80 10.843 -22.551 9.450 631 HG12 ILE 80 2HG1 ILE 80 11.138 -21.975 6.976 632 HG13 ILE 80 3HG1 ILE 80 11.799 -23.515 7.515 633 HG21 ILE 80 1HG2 ILE 80 9.236 -24.115 10.112 634 HG22 ILE 80 2HG2 ILE 80 8.578 -24.262 8.483 635 HG23 ILE 80 3HG2 ILE 80 10.160 -24.945 8.860 636 HD11 ILE 80 3HD1 ILE 80 9.044 -23.655 6.540 637 HD12 ILE 80 1HD1 ILE 80 10.233 -23.170 5.331 638 HD13 ILE 80 2HD1 ILE 80 10.429 -24.693 6.201 639 H MET 81 H MET 81 6.923 -22.700 9.428 640 HA MET 81 HA MET 81 7.200 -21.507 12.107 641 HB2 MET 81 2HB MET 81 4.890 -21.475 10.227 642 HB3 MET 81 3HB MET 81 4.545 -21.635 11.944 643 HG2 MET 81 2HG MET 81 5.142 -19.515 12.403 644 HG3 MET 81 3HG MET 81 6.440 -19.508 11.211 645 HE1 MET 81 3HE MET 81 2.500 -19.810 11.383 646 HE2 MET 81 1HE MET 81 2.085 -19.313 9.742 647 HE3 MET 81 2HE MET 81 3.011 -20.790 10.009 648 H THR 82 H THR 82 6.995 -22.877 13.768 649 HA THR 82 HA THR 82 5.320 -25.101 13.909 650 HB THR 82 HB THR 82 6.504 -26.347 12.349 651 HG1 THR 82 HG1 THR 82 8.024 -27.005 14.650 652 HG21 THR 82 3HG2 THR 82 8.505 -25.708 11.613 653 HG22 THR 82 1HG2 THR 82 9.239 -26.183 13.144 654 HG23 THR 82 2HG2 THR 82 8.612 -24.548 12.936 655 H ALA 83 H ALA 83 8.714 -24.415 14.784 656 HA ALA 83 HA ALA 83 9.668 -23.992 16.824 657 HB1 ALA 83 1HB ALA 83 7.348 -22.897 17.253 658 HB2 ALA 83 2HB ALA 83 7.058 -24.331 18.238 659 HB3 ALA 83 3HB ALA 83 8.409 -23.262 18.614 660 H HIS 84 H HIS 84 6.983 -26.266 17.440 661 HA HIS 84 HA HIS 84 8.421 -27.923 19.183 662 HB2 HIS 84 2HB HIS 84 6.609 -29.463 19.001 663 HB3 HIS 84 3HB HIS 84 5.913 -27.850 18.879 664 HD1 HIS 84 HD1 HIS 84 5.834 -31.055 17.281 665 HD2 HIS 84 HD2 HIS 84 5.494 -27.116 16.004 666 HE1 HIS 84 HE1 HIS 84 4.733 -31.173 15.023 667 H SER 85 H SER 85 8.065 -30.516 18.222 668 HA SER 85 HA SER 85 10.450 -31.114 17.036 669 HB2 SER 85 2HB SER 85 8.163 -32.824 16.215 670 HB3 SER 85 3HB SER 85 9.709 -33.277 16.932 671 HG SER 85 HG SER 85 8.675 -33.384 18.746 672 H ASP 86 H ASP 86 11.063 -29.832 15.337 673 HA ASP 86 HA ASP 86 10.545 -30.616 12.754 674 HB2 ASP 86 2HB ASP 86 8.378 -29.081 13.770 675 HB3 ASP 86 3HB ASP 86 9.215 -28.092 12.578 676 H LEU 87 H LEU 87 11.342 -28.004 14.926 677 HA LEU 87 HA LEU 87 12.759 -26.417 13.034 678 HB2 LEU 87 2HB LEU 87 12.125 -26.329 15.837 679 HB3 LEU 87 3HB LEU 87 13.823 -25.931 15.584 680 HG LEU 87 HG LEU 87 13.263 -24.066 14.214 681 HD11 LEU 87 1HD1 LEU 87 10.847 -23.507 13.787 682 HD12 LEU 87 2HD1 LEU 87 10.456 -25.144 14.313 683 HD13 LEU 87 3HD1 LEU 87 11.477 -24.893 12.897 684 HD21 LEU 87 3HD2 LEU 87 13.160 -23.464 16.481 685 HD22 LEU 87 1HD2 LEU 87 11.613 -24.279 16.716 686 HD23 LEU 87 2HD2 LEU 87 11.693 -22.795 15.766 687 H ASP 88 H ASP 88 13.718 -28.877 15.390 688 HA ASP 88 HA ASP 88 16.449 -28.712 15.290 689 HB2 ASP 88 2HB ASP 88 15.039 -30.327 16.646 690 HB3 ASP 88 3HB ASP 88 14.969 -31.342 15.208 691 H ALA 89 H ALA 89 14.278 -29.990 12.858 692 HA ALA 89 HA ALA 89 16.456 -31.008 11.233 693 HB1 ALA 89 1HB ALA 89 13.687 -31.526 11.434 694 HB2 ALA 89 2HB ALA 89 13.992 -30.930 9.802 695 HB3 ALA 89 3HB ALA 89 14.877 -32.329 10.409 696 H ALA 90 H ALA 90 14.084 -28.377 11.125 697 HA ALA 90 HA ALA 90 14.830 -27.347 8.612 698 HB1 ALA 90 1HB ALA 90 12.790 -26.554 9.310 699 HB2 ALA 90 2HB ALA 90 13.343 -26.271 10.962 700 HB3 ALA 90 3HB ALA 90 13.828 -25.174 9.670 701 H VAL 91 H VAL 91 16.272 -27.097 11.742 702 HA VAL 91 HA VAL 91 17.673 -24.713 11.582 703 HB VAL 91 HB VAL 91 18.449 -27.330 12.863 704 HG11 VAL 91 1HG1 VAL 91 19.941 -24.774 12.647 705 HG12 VAL 91 2HG1 VAL 91 19.962 -25.608 14.202 706 HG13 VAL 91 3HG1 VAL 91 20.538 -26.430 12.752 707 HG21 VAL 91 3HG2 VAL 91 16.529 -25.484 13.546 708 HG22 VAL 91 1HG2 VAL 91 17.267 -26.656 14.637 709 HG23 VAL 91 2HG2 VAL 91 17.902 -25.014 14.547 710 H SER 92 H SER 92 18.901 -27.945 10.694 711 HA SER 92 HA SER 92 21.129 -26.750 9.277 712 HB2 SER 92 2HB SER 92 21.791 -28.691 10.397 713 HB3 SER 92 3HB SER 92 20.320 -29.562 9.961 714 HG SER 92 HG SER 92 21.215 -30.154 8.147 715 H ALA 93 H ALA 93 18.199 -28.575 8.525 716 HA ALA 93 HA ALA 93 18.643 -28.904 5.772 717 HB1 ALA 93 1HB ALA 93 16.059 -28.715 7.314 718 HB2 ALA 93 2HB ALA 93 16.187 -29.224 5.629 719 HB3 ALA 93 3HB ALA 93 16.947 -30.182 6.900 720 H TYR 94 H TYR 94 16.465 -26.552 7.349 721 HA TYR 94 HA TYR 94 15.972 -25.023 5.064 722 HB2 TYR 94 2HB TYR 94 14.877 -25.010 7.462 723 HB3 TYR 94 3HB TYR 94 16.036 -23.719 7.755 724 HD1 TYR 94 HD1 TYR 94 14.095 -24.521 4.675 725 HD2 TYR 94 HD2 TYR 94 14.775 -21.766 7.845 726 HE1 TYR 94 HE1 TYR 94 12.572 -22.917 3.600 727 HE2 TYR 94 HE2 TYR 94 13.253 -20.155 6.779 728 HH TYR 94 HH TYR 94 12.478 -19.806 4.170 729 H GLN 95 H GLN 95 18.767 -25.233 7.005 730 HA GLN 95 HA GLN 95 19.805 -22.621 6.587 731 HB2 GLN 95 2HB GLN 95 20.685 -25.100 7.816 732 HB3 GLN 95 3HB GLN 95 21.989 -24.316 6.934 733 HG2 GLN 95 2HG GLN 95 20.282 -22.843 8.913 734 HG3 GLN 95 3HG GLN 95 21.730 -23.730 9.386 735 HE21 GLN 95 1HE2 GLN 95 21.122 -20.864 9.504 736 HE22 GLN 95 2HE2 GLN 95 22.377 -20.080 8.613 737 H GLN 96 H GLN 96 19.070 -24.835 4.356 738 HA GLN 96 HA GLN 96 21.418 -24.938 2.754 739 HB2 GLN 96 2HB GLN 96 18.520 -25.550 2.280 740 HB3 GLN 96 3HB GLN 96 19.654 -25.536 0.936 741 HG2 GLN 96 2HG GLN 96 20.657 -27.074 3.170 742 HG3 GLN 96 3HG GLN 96 19.090 -27.660 2.616 743 HE21 GLN 96 1HE2 GLN 96 18.997 -28.856 0.823 744 HE22 GLN 96 2HE2 GLN 96 20.327 -29.165 -0.234 745 H GLY 97 H GLY 97 20.237 -22.262 3.663 746 HA2 GLY 97 2HA GLY 97 20.919 -20.240 2.504 747 HA3 GLY 97 3HA GLY 97 20.391 -20.991 1.005 748 H ALA 98 H ALA 98 18.573 -21.088 4.006 749 HA ALA 98 HA ALA 98 16.426 -19.599 2.669 750 HB1 ALA 98 1HB ALA 98 16.014 -21.047 5.242 751 HB2 ALA 98 2HB ALA 98 14.894 -20.779 3.906 752 HB3 ALA 98 3HB ALA 98 16.182 -21.973 3.750 753 H PHE 99 H PHE 99 14.936 -18.620 4.628 754 HA PHE 99 HA PHE 99 16.709 -16.669 5.923 755 HB2 PHE 99 2HB PHE 99 15.168 -15.545 4.522 756 HB3 PHE 99 3HB PHE 99 13.824 -16.544 5.064 757 HD1 PHE 99 HD1 PHE 99 16.112 -13.821 6.029 758 HD2 PHE 99 HD2 PHE 99 12.573 -15.981 6.992 759 HE1 PHE 99 HE1 PHE 99 15.535 -12.120 7.711 760 HE2 PHE 99 HE2 PHE 99 11.990 -14.284 8.675 761 HZ PHE 99 HZ PHE 99 13.472 -12.350 9.036 762 H ASP 100 H ASP 100 16.341 -16.040 8.092 763 HA ASP 100 HA ASP 100 16.043 -18.020 9.947 764 HB2 ASP 100 2HB ASP 100 16.885 -15.695 10.372 765 HB3 ASP 100 3HB ASP 100 15.210 -15.151 10.411 766 H TYR 101 H TYR 101 14.409 -19.349 10.333 767 HA TYR 101 HA TYR 101 11.719 -18.726 9.573 768 HB2 TYR 101 2HB TYR 101 11.245 -20.959 10.722 769 HB3 TYR 101 3HB TYR 101 12.329 -20.996 9.336 770 HD1 TYR 101 HD2 TYR 101 12.658 -20.418 13.022 771 HD2 TYR 101 HD1 TYR 101 14.112 -22.427 9.564 772 HE1 TYR 101 HE2 TYR 101 14.367 -21.533 14.395 773 HE2 TYR 101 HE1 TYR 101 15.824 -23.548 10.928 774 HH TYR 101 HH TYR 101 17.003 -23.190 13.062 775 H LEU 102 H LEU 102 9.885 -19.041 11.124 776 HA LEU 102 HA LEU 102 10.534 -17.941 13.778 777 HB2 LEU 102 2HB LEU 102 9.598 -16.108 12.714 778 HB3 LEU 102 3HB LEU 102 8.464 -17.096 11.795 779 HG LEU 102 HG LEU 102 7.329 -17.540 14.058 780 HD11 LEU 102 1HD1 LEU 102 8.531 -16.757 15.785 781 HD12 LEU 102 2HD1 LEU 102 7.769 -15.219 15.380 782 HD13 LEU 102 3HD1 LEU 102 9.391 -15.581 14.791 783 HD21 LEU 102 3HD2 LEU 102 6.390 -15.049 13.909 784 HD22 LEU 102 1HD2 LEU 102 5.999 -16.286 12.715 785 HD23 LEU 102 2HD2 LEU 102 7.263 -15.103 12.377 786 HA PRO 103 HA PRO 103 8.362 -21.678 14.940 787 HB2 PRO 103 2HB PRO 103 8.810 -21.403 17.604 788 HB3 PRO 103 3HB PRO 103 10.036 -22.002 16.480 789 HG2 PRO 103 2HG PRO 103 9.695 -19.257 17.625 790 HG3 PRO 103 3HG PRO 103 11.179 -20.202 17.406 791 HD2 PRO 103 2HD PRO 103 10.443 -18.230 15.702 792 HD3 PRO 103 3HD PRO 103 11.341 -19.667 15.170 793 H LYS 104 H LYS 104 6.324 -22.090 15.664 794 HA LYS 104 HA LYS 104 4.788 -19.786 16.664 795 HB2 LYS 104 2HB LYS 104 2.813 -20.823 15.691 796 HB3 LYS 104 3HB LYS 104 4.062 -20.633 14.468 797 HG2 LYS 104 2HG LYS 104 3.891 -22.782 13.987 798 HG3 LYS 104 3HG LYS 104 4.420 -23.182 15.623 799 HD2 LYS 104 2HD LYS 104 1.563 -22.487 15.013 800 HD3 LYS 104 3HD LYS 104 2.176 -24.131 14.827 801 HE2 LYS 104 2HE LYS 104 3.044 -23.816 17.247 802 HE3 LYS 104 3HE LYS 104 1.889 -22.485 17.313 803 HZ1 LYS 104 3HZ LYS 104 1.361 -25.143 17.757 804 HZ2 LYS 104 1HZ LYS 104 0.700 -24.831 16.232 805 HZ3 LYS 104 2HZ LYS 104 0.223 -23.906 17.566 806 HA PRO 105 HA PRO 105 2.531 -19.667 17.289 807 HB2 PRO 105 2HB PRO 105 1.852 -18.487 19.638 808 HB3 PRO 105 3HB PRO 105 0.968 -19.860 18.962 809 HG2 PRO 105 2HG PRO 105 3.062 -19.823 21.102 810 HG3 PRO 105 3HG PRO 105 1.539 -20.730 21.042 811 HD2 PRO 105 2HD PRO 105 3.930 -21.858 20.458 812 HD3 PRO 105 3HD PRO 105 2.419 -22.363 19.675 813 H PHE 106 H PHE 106 2.707 -17.263 17.578 814 HA PHE 106 HA PHE 106 5.144 -16.305 18.825 815 HB2 PHE 106 2HB PHE 106 5.941 -15.240 16.709 816 HB3 PHE 106 3HB PHE 106 6.024 -16.999 16.690 817 HD1 PHE 106 HD1 PHE 106 3.913 -14.144 15.605 818 HD2 PHE 106 HD2 PHE 106 5.023 -18.204 14.976 819 HE1 PHE 106 HE1 PHE 106 2.599 -14.177 13.525 820 HE2 PHE 106 HE2 PHE 106 3.712 -18.244 12.895 821 HZ PHE 106 HZ PHE 106 2.498 -16.228 12.166 822 H ASP 107 H ASP 107 5.377 -13.834 18.122 823 HA ASP 107 HA ASP 107 2.768 -12.648 18.712 824 HB2 ASP 107 2HB ASP 107 5.492 -11.337 18.782 825 HB3 ASP 107 3HB ASP 107 3.989 -10.688 19.433 826 H ILE 108 H ILE 108 1.617 -11.935 17.053 827 HA ILE 108 HA ILE 108 2.371 -11.696 14.436 828 HB ILE 108 HB ILE 108 0.242 -10.270 15.997 829 HG12 ILE 108 2HG1 ILE 108 -0.205 -12.056 13.642 830 HG13 ILE 108 3HG1 ILE 108 0.286 -12.782 15.168 831 HG21 ILE 108 1HG2 ILE 108 1.043 -9.817 13.146 832 HG22 ILE 108 2HG2 ILE 108 -0.626 -9.599 13.669 833 HG23 ILE 108 3HG2 ILE 108 0.658 -8.633 14.395 834 HD11 ILE 108 3HD1 ILE 108 -1.805 -12.715 15.865 835 HD12 ILE 108 1HD1 ILE 108 -1.812 -10.958 15.706 836 HD13 ILE 108 2HD1 ILE 108 -2.293 -11.969 14.343 837 H ASP 109 H ASP 109 2.811 -9.370 17.014 838 HA ASP 109 HA ASP 109 3.397 -7.088 15.522 839 HB2 ASP 109 2HB ASP 109 3.080 -6.946 17.911 840 HB3 ASP 109 3HB ASP 109 4.470 -7.988 18.200 841 H GLU 110 H GLU 110 5.492 -9.749 16.545 842 HA GLU 110 HA GLU 110 7.841 -8.568 15.374 843 HB2 GLU 110 2HB GLU 110 7.695 -10.207 17.380 844 HB3 GLU 110 3HB GLU 110 7.595 -11.459 16.151 845 HG2 GLU 110 2HG GLU 110 9.832 -11.459 16.446 846 HG3 GLU 110 3HG GLU 110 9.735 -10.185 15.232 847 H ALA 111 H ALA 111 5.381 -10.846 14.416 848 HA ALA 111 HA ALA 111 6.735 -11.997 12.216 849 HB1 ALA 111 1HB ALA 111 4.664 -12.884 13.345 850 HB2 ALA 111 2HB ALA 111 3.755 -11.661 12.457 851 HB3 ALA 111 3HB ALA 111 4.643 -12.908 11.581 852 H VAL 112 H VAL 112 4.237 -9.449 12.317 853 HA VAL 112 HA VAL 112 4.182 -8.799 9.636 854 HB VAL 112 HB VAL 112 3.766 -7.087 12.076 855 HG11 VAL 112 1HG1 VAL 112 2.678 -5.482 10.398 856 HG12 VAL 112 2HG1 VAL 112 4.437 -5.470 10.528 857 HG13 VAL 112 3HG1 VAL 112 3.657 -6.302 9.183 858 HG21 VAL 112 3HG2 VAL 112 1.444 -7.289 11.543 859 HG22 VAL 112 1HG2 VAL 112 1.811 -8.053 9.996 860 HG23 VAL 112 2HG2 VAL 112 2.147 -8.906 11.503 861 H ALA 113 H ALA 113 6.533 -7.913 12.073 862 HA ALA 113 HA ALA 113 7.868 -6.008 10.348 863 HB1 ALA 113 1HB ALA 113 9.545 -5.959 12.237 864 HB2 ALA 113 2HB ALA 113 7.904 -5.456 12.646 865 HB3 ALA 113 3HB ALA 113 8.473 -7.063 13.099 866 H LEU 114 H LEU 114 8.182 -9.356 11.271 867 HA LEU 114 HA LEU 114 10.849 -9.764 10.443 868 HB2 LEU 114 2HB LEU 114 9.669 -11.334 11.878 869 HB3 LEU 114 3HB LEU 114 8.538 -11.696 10.576 870 HG LEU 114 HG LEU 114 10.593 -12.526 9.282 871 HD11 LEU 114 1HD1 LEU 114 12.379 -11.672 10.563 872 HD12 LEU 114 2HD1 LEU 114 12.365 -13.411 10.855 873 HD13 LEU 114 3HD1 LEU 114 11.709 -12.309 12.065 874 HD21 LEU 114 3HD2 LEU 114 9.198 -13.827 11.558 875 HD22 LEU 114 1HD2 LEU 114 10.576 -14.665 10.844 876 HD23 LEU 114 2HD2 LEU 114 9.190 -14.233 9.841 877 H VAL 115 H VAL 115 7.760 -9.979 8.748 878 HA VAL 115 HA VAL 115 8.802 -11.044 6.334 879 HB VAL 115 HB VAL 115 6.443 -11.241 6.798 880 HG11 VAL 115 1HG1 VAL 115 6.342 -8.230 6.640 881 HG12 VAL 115 2HG1 VAL 115 4.953 -9.304 6.817 882 HG13 VAL 115 3HG1 VAL 115 6.156 -9.198 8.103 883 HG21 VAL 115 3HG2 VAL 115 6.063 -9.427 4.579 884 HG22 VAL 115 1HG2 VAL 115 7.524 -10.395 4.380 885 HG23 VAL 115 2HG2 VAL 115 5.967 -11.187 4.622 886 H GLU 116 H GLU 116 8.278 -7.768 7.519 887 HA GLU 116 HA GLU 116 8.749 -6.417 5.090 888 HB2 GLU 116 2HB GLU 116 9.116 -5.523 7.953 889 HB3 GLU 116 3HB GLU 116 9.247 -4.451 6.566 890 HG2 GLU 116 2HG GLU 116 6.980 -4.604 6.074 891 HG3 GLU 116 3HG GLU 116 6.777 -6.074 7.024 892 H ARG 117 H ARG 117 10.881 -7.781 7.483 893 HA ARG 117 HA ARG 117 13.239 -6.400 6.835 894 HB2 ARG 117 2HB ARG 117 13.481 -7.575 8.791 895 HB3 ARG 117 3HB ARG 117 12.585 -8.965 8.193 896 HG2 ARG 117 2HG ARG 117 14.432 -9.860 7.121 897 HG3 ARG 117 3HG ARG 117 15.279 -8.312 7.077 898 HD2 ARG 117 2HD ARG 117 16.039 -10.128 8.762 899 HD3 ARG 117 3HD ARG 117 15.921 -8.452 9.295 900 HE ARG 117 HE ARG 117 13.540 -10.017 9.738 901 HH11 ARG 117 1HH1 ARG 117 16.605 -8.991 11.031 902 HH12 ARG 117 2HH1 ARG 117 16.147 -9.258 12.680 903 HH21 ARG 117 1HH2 ARG 117 12.925 -10.374 11.905 904 HH22 ARG 117 2HH2 ARG 117 14.053 -10.046 13.176 905 H ALA 118 H ALA 118 11.652 -9.149 5.362 906 HA ALA 118 HA ALA 118 13.895 -9.743 3.630 907 HB1 ALA 118 1HB ALA 118 11.491 -11.077 4.442 908 HB2 ALA 118 2HB ALA 118 11.606 -11.061 2.682 909 HB3 ALA 118 3HB ALA 118 12.920 -11.736 3.645 910 H ILE 119 H ILE 119 10.616 -8.418 3.278 911 HA ILE 119 HA ILE 119 10.724 -7.995 0.501 912 HB ILE 119 HB ILE 119 9.142 -6.405 2.524 913 HG12 ILE 119 2HG1 ILE 119 8.289 -8.860 0.979 914 HG13 ILE 119 3HG1 ILE 119 8.824 -8.893 2.655 915 HG21 ILE 119 1HG2 ILE 119 9.327 -5.442 0.232 916 HG22 ILE 119 2HG2 ILE 119 8.563 -6.904 -0.389 917 HG23 ILE 119 3HG2 ILE 119 7.680 -5.848 0.714 918 HD11 ILE 119 3HD1 ILE 119 6.652 -7.007 2.012 919 HD12 ILE 119 1HD1 ILE 119 6.262 -8.725 1.930 920 HD13 ILE 119 2HD1 ILE 119 6.890 -8.033 3.426 921 H SER 120 H SER 120 11.261 -5.712 3.185 922 HA SER 120 HA SER 120 11.944 -3.499 1.622 923 HB2 SER 120 2HB SER 120 12.981 -4.160 4.388 924 HB3 SER 120 3HB SER 120 12.918 -2.562 3.646 925 HG SER 120 HG SER 120 10.539 -4.005 3.800 926 H HIS 121 H HIS 121 13.730 -6.338 2.409 927 HA HIS 121 HA HIS 121 16.356 -5.384 2.115 928 HB2 HIS 121 2HB HIS 121 15.610 -7.650 3.007 929 HB3 HIS 121 3HB HIS 121 15.428 -8.145 1.326 930 HD1 HIS 121 HD1 HIS 121 17.617 -8.373 -0.082 931 HD2 HIS 121 HD2 HIS 121 18.220 -7.542 3.944 932 HE1 HIS 121 HE1 HIS 121 20.051 -8.840 0.344 933 H TYR 122 H TYR 122 13.866 -5.814 -0.169 934 HA TYR 122 HA TYR 122 15.806 -5.619 -2.379 935 HB2 TYR 122 2HB TYR 122 12.965 -6.557 -2.703 936 HB3 TYR 122 3HB TYR 122 14.328 -6.792 -3.792 937 HD1 TYR 122 HD2 TYR 122 16.368 -8.110 -2.618 938 HD2 TYR 122 HD1 TYR 122 12.272 -8.395 -1.504 939 HE1 TYR 122 HE2 TYR 122 16.802 -10.310 -1.608 940 HE2 TYR 122 HE1 TYR 122 12.694 -10.595 -0.489 941 HH TYR 122 HH TYR 122 15.641 -11.719 0.300 942 H GLN 123 H GLN 123 14.533 -3.504 -0.667 943 HA GLN 123 HA GLN 123 13.800 -1.747 -2.847 944 HB2 GLN 123 2HB GLN 123 11.882 -2.428 -0.621 945 HB3 GLN 123 3HB GLN 123 11.732 -0.973 -1.598 946 HG2 GLN 123 2HG GLN 123 11.522 -2.351 -3.608 947 HG3 GLN 123 3HG GLN 123 11.652 -3.804 -2.618 948 HE21 GLN 123 1HE2 GLN 123 9.602 -4.432 -3.440 949 HE22 GLN 123 2HE2 GLN 123 8.150 -3.753 -2.798 950 H GLU 124 H GLU 124 13.400 -1.726 0.698 951 HA GLU 124 HA GLU 124 14.226 -0.355 2.314 952 HB2 GLU 124 2HB GLU 124 16.389 -0.670 0.407 953 HB3 GLU 124 3HB GLU 124 16.459 0.897 1.201 954 HG2 GLU 124 2HG GLU 124 17.042 0.018 3.176 955 HG3 GLU 124 3HG GLU 124 15.966 -1.367 2.996 Start of MODEL 6 1 H1 MET 1 H MET 1 -0.937 -0.461 -3.340 2 HA MET 1 HA MET 1 0.792 -0.843 -4.789 3 HB2 MET 1 2HB MET 1 3.007 -0.298 -3.850 4 HB3 MET 1 3HB MET 1 1.773 0.851 -3.352 5 HG2 MET 1 2HG MET 1 1.607 -0.748 -1.269 6 HG3 MET 1 3HG MET 1 3.250 -1.165 -1.751 7 HE1 MET 1 3HE MET 1 2.423 -0.256 0.865 8 HE2 MET 1 1HE MET 1 3.276 1.196 1.388 9 HE3 MET 1 2HE MET 1 1.600 1.304 0.851 10 H GLN 2 H GLN 2 0.692 -2.846 -1.956 11 HA GLN 2 HA GLN 2 1.398 -4.967 -1.518 12 HB2 GLN 2 2HB GLN 2 1.313 -5.381 -4.503 13 HB3 GLN 2 3HB GLN 2 1.045 -6.573 -3.238 14 HG2 GLN 2 2HG GLN 2 -1.019 -5.441 -2.600 15 HG3 GLN 2 3HG GLN 2 -0.750 -4.239 -3.861 16 HE21 GLN 2 1HE2 GLN 2 -3.063 -5.722 -3.749 17 HE22 GLN 2 2HE2 GLN 2 -3.117 -6.804 -5.095 18 H ARG 3 H ARG 3 3.478 -3.183 -1.575 19 HA ARG 3 HA ARG 3 5.612 -3.726 -3.267 20 HB2 ARG 3 2HB ARG 3 7.046 -2.917 -1.354 21 HB3 ARG 3 3HB ARG 3 5.747 -1.833 -1.834 22 HG2 ARG 3 2HG ARG 3 5.463 -1.742 0.408 23 HG3 ARG 3 3HG ARG 3 4.458 -3.153 0.072 24 HD2 ARG 3 2HD ARG 3 5.950 -3.538 1.975 25 HD3 ARG 3 3HD ARG 3 6.308 -4.627 0.635 26 HE ARG 3 HE ARG 3 8.374 -3.659 0.444 27 HH11 ARG 3 1HH1 ARG 3 6.333 -1.626 2.398 28 HH12 ARG 3 2HH1 ARG 3 7.618 -0.560 2.863 29 HH21 ARG 3 1HH2 ARG 3 10.074 -2.263 1.049 30 HH22 ARG 3 2HH2 ARG 3 9.745 -0.923 2.094 31 H GLY 4 H GLY 4 4.269 -5.642 -0.746 32 HA2 GLY 4 2HA GLY 4 6.130 -7.778 -1.343 33 HA3 GLY 4 3HA GLY 4 6.245 -7.153 0.295 34 H ILE 5 H ILE 5 4.461 -9.115 -1.893 35 HA ILE 5 HA ILE 5 2.167 -9.428 -0.174 36 HB ILE 5 HB ILE 5 3.024 -10.923 -2.652 37 HG12 ILE 5 2HG1 ILE 5 0.629 -9.132 -2.368 38 HG13 ILE 5 3HG1 ILE 5 2.218 -8.449 -2.693 39 HG21 ILE 5 1HG2 ILE 5 1.730 -12.518 -1.615 40 HG22 ILE 5 2HG2 ILE 5 0.726 -11.324 -0.795 41 HG23 ILE 5 3HG2 ILE 5 0.508 -11.623 -2.519 42 HD11 ILE 5 3HD1 ILE 5 2.093 -8.984 -4.837 43 HD12 ILE 5 1HD1 ILE 5 1.623 -10.643 -4.471 44 HD13 ILE 5 2HD1 ILE 5 0.398 -9.377 -4.552 45 H VAL 6 H VAL 6 1.674 -11.151 1.133 46 HA VAL 6 HA VAL 6 3.781 -13.176 1.512 47 HB VAL 6 HB VAL 6 2.114 -12.091 3.774 48 HG11 VAL 6 1HG1 VAL 6 4.500 -13.883 3.532 49 HG12 VAL 6 2HG1 VAL 6 4.193 -12.992 5.023 50 HG13 VAL 6 3HG1 VAL 6 2.997 -14.139 4.418 51 HG21 VAL 6 3HG2 VAL 6 3.253 -10.166 3.421 52 HG22 VAL 6 1HG2 VAL 6 4.531 -11.036 4.270 53 HG23 VAL 6 2HG2 VAL 6 4.534 -10.963 2.508 54 H TRP 7 H TRP 7 3.099 -15.213 1.399 55 HA TRP 7 HA TRP 7 0.201 -15.714 1.560 56 HB2 TRP 7 2HB TRP 7 2.361 -17.145 0.005 57 HB3 TRP 7 3HB TRP 7 0.720 -17.761 0.181 58 HD1 TRP 7 HD1 TRP 7 0.176 -14.230 -0.090 59 HE1 TRP 7 HE1 TRP 7 -0.304 -13.499 -2.511 60 HE3 TRP 7 HE3 TRP 7 1.808 -18.411 -2.537 61 HZ2 TRP 7 HZ2 TRP 7 -0.028 -14.556 -5.113 62 HZ3 TRP 7 HZ3 TRP 7 1.665 -18.471 -4.993 63 HH2 TRP 7 HH2 TRP 7 0.765 -16.583 -6.252 64 H VAL 8 H VAL 8 -0.394 -17.924 2.318 65 HA VAL 8 HA VAL 8 1.526 -19.122 4.169 66 HB VAL 8 HB VAL 8 -1.216 -18.166 5.003 67 HG11 VAL 8 1HG1 VAL 8 -0.708 -20.380 5.927 68 HG12 VAL 8 2HG1 VAL 8 0.809 -19.756 6.577 69 HG13 VAL 8 3HG1 VAL 8 -0.730 -19.139 7.179 70 HG21 VAL 8 3HG2 VAL 8 1.541 -17.183 5.419 71 HG22 VAL 8 1HG2 VAL 8 0.018 -16.297 5.341 72 HG23 VAL 8 2HG2 VAL 8 0.471 -17.144 6.820 73 H VAL 9 H VAL 9 1.201 -21.292 4.560 74 HA VAL 9 HA VAL 9 -1.123 -22.558 3.280 75 HB VAL 9 HB VAL 9 0.721 -22.792 1.714 76 HG11 VAL 9 1HG1 VAL 9 2.509 -24.533 2.956 77 HG12 VAL 9 2HG1 VAL 9 2.800 -22.852 2.505 78 HG13 VAL 9 3HG1 VAL 9 2.234 -23.246 4.129 79 HG21 VAL 9 3HG2 VAL 9 -0.735 -24.926 2.873 80 HG22 VAL 9 1HG2 VAL 9 -0.099 -24.798 1.233 81 HG23 VAL 9 2HG2 VAL 9 0.883 -25.524 2.506 82 H ASP 10 H ASP 10 -1.733 -22.491 5.625 83 HA ASP 10 HA ASP 10 -0.479 -24.689 7.131 84 HB2 ASP 10 2HB ASP 10 -1.400 -23.663 9.148 85 HB3 ASP 10 3HB ASP 10 -0.423 -22.498 8.258 86 H ASP 11 H ASP 11 -2.133 -25.723 8.716 87 HA ASP 11 HA ASP 11 -4.592 -26.312 7.201 88 HB2 ASP 11 2HB ASP 11 -2.678 -28.112 7.551 89 HB3 ASP 11 3HB ASP 11 -3.459 -28.300 9.119 90 H ASP 12 H ASP 12 -4.031 -24.333 9.378 91 HA ASP 12 HA ASP 12 -6.112 -25.261 11.244 92 HB2 ASP 12 2HB ASP 12 -3.408 -24.360 11.816 93 HB3 ASP 12 3HB ASP 12 -4.611 -23.378 12.648 94 H SER 13 H SER 13 -7.439 -23.594 12.166 95 HA SER 13 HA SER 13 -8.105 -21.564 10.260 96 HB2 SER 13 2HB SER 13 -9.539 -22.934 12.129 97 HB3 SER 13 3HB SER 13 -9.320 -21.385 12.944 98 HG SER 13 HG SER 13 -11.212 -21.565 11.546 99 H SER 14 H SER 14 -7.091 -21.441 13.677 100 HA SER 14 HA SER 14 -6.785 -18.653 13.794 101 HB2 SER 14 2HB SER 14 -6.547 -20.773 15.583 102 HB3 SER 14 3HB SER 14 -4.929 -20.075 15.529 103 HG SER 14 HG SER 14 -5.779 -18.710 16.896 104 H ILE 15 H ILE 15 -4.460 -21.229 13.080 105 HA ILE 15 HA ILE 15 -2.115 -19.794 12.981 106 HB ILE 15 HB ILE 15 -2.990 -22.050 11.177 107 HG12 ILE 15 2HG1 ILE 15 -2.941 -22.628 13.553 108 HG13 ILE 15 3HG1 ILE 15 -1.629 -23.432 12.698 109 HG21 ILE 15 1HG2 ILE 15 -1.186 -20.855 10.109 110 HG22 ILE 15 2HG2 ILE 15 -0.247 -20.875 11.601 111 HG23 ILE 15 3HG2 ILE 15 -0.579 -22.383 10.748 112 HD11 ILE 15 3HD1 ILE 15 -1.437 -21.015 14.474 113 HD12 ILE 15 1HD1 ILE 15 -0.796 -22.630 14.778 114 HD13 ILE 15 2HD1 ILE 15 -0.107 -21.634 13.496 115 H ARG 16 H ARG 16 -4.423 -20.298 10.315 116 HA ARG 16 HA ARG 16 -3.001 -18.542 8.549 117 HB2 ARG 16 2HB ARG 16 -4.448 -19.244 6.933 118 HB3 ARG 16 3HB ARG 16 -4.695 -20.551 8.083 119 HG2 ARG 16 2HG ARG 16 -6.627 -19.195 8.999 120 HG3 ARG 16 3HG ARG 16 -6.451 -18.173 7.571 121 HD2 ARG 16 2HD ARG 16 -6.527 -20.487 6.319 122 HD3 ARG 16 3HD ARG 16 -7.350 -21.005 7.790 123 HE ARG 16 HE ARG 16 -8.409 -19.341 5.721 124 HH11 ARG 16 1HH1 ARG 16 -8.554 -20.042 9.128 125 HH12 ARG 16 2HH1 ARG 16 -10.176 -19.460 9.311 126 HH21 ARG 16 1HH2 ARG 16 -10.544 -18.572 5.949 127 HH22 ARG 16 2HH2 ARG 16 -11.307 -18.626 7.502 128 H TRP 17 H TRP 17 -5.708 -18.263 10.750 129 HA TRP 17 HA TRP 17 -6.841 -15.883 9.865 130 HB2 TRP 17 2HB TRP 17 -8.039 -17.013 11.532 131 HB3 TRP 17 3HB TRP 17 -6.627 -17.164 12.575 132 HD1 TRP 17 HD1 TRP 17 -9.152 -14.494 11.386 133 HE1 TRP 17 HE1 TRP 17 -9.279 -12.655 13.183 134 HE3 TRP 17 HE3 TRP 17 -5.462 -16.156 14.509 135 HZ2 TRP 17 HZ2 TRP 17 -7.985 -11.997 15.604 136 HZ3 TRP 17 HZ3 TRP 17 -4.968 -14.864 16.544 137 HH2 TRP 17 HH2 TRP 17 -6.205 -12.827 17.078 138 H VAL 18 H VAL 18 -4.617 -16.147 12.644 139 HA VAL 18 HA VAL 18 -4.067 -13.457 12.933 140 HB VAL 18 HB VAL 18 -3.298 -14.817 14.668 141 HG11 VAL 18 1HG1 VAL 18 -2.545 -16.596 12.515 142 HG12 VAL 18 2HG1 VAL 18 -1.270 -16.466 13.728 143 HG13 VAL 18 3HG1 VAL 18 -2.896 -16.957 14.205 144 HG21 VAL 18 3HG2 VAL 18 -0.617 -14.475 13.466 145 HG22 VAL 18 1HG2 VAL 18 -1.624 -13.032 13.583 146 HG23 VAL 18 2HG2 VAL 18 -1.233 -13.954 15.034 147 H LEU 19 H LEU 19 -2.592 -15.797 10.756 148 HA LEU 19 HA LEU 19 -0.506 -14.070 9.862 149 HB2 LEU 19 2HB LEU 19 -1.689 -16.621 8.810 150 HB3 LEU 19 3HB LEU 19 -0.431 -15.751 7.934 151 HG LEU 19 HG LEU 19 -0.050 -16.667 10.771 152 HD11 LEU 19 1HD1 LEU 19 -0.656 -18.513 9.050 153 HD12 LEU 19 2HD1 LEU 19 0.743 -18.728 10.102 154 HD13 LEU 19 3HD1 LEU 19 0.968 -18.217 8.429 155 HD21 LEU 19 3HD2 LEU 19 1.473 -14.953 9.861 156 HD22 LEU 19 1HD2 LEU 19 1.903 -16.058 8.555 157 HD23 LEU 19 2HD2 LEU 19 2.296 -16.471 10.224 158 H GLU 20 H GLU 20 -3.841 -14.380 9.120 159 HA GLU 20 HA GLU 20 -3.663 -13.175 6.503 160 HB2 GLU 20 2HB GLU 20 -5.554 -14.719 7.788 161 HB3 GLU 20 3HB GLU 20 -6.284 -13.120 7.799 162 HG2 GLU 20 2HG GLU 20 -5.116 -13.981 5.238 163 HG3 GLU 20 3HG GLU 20 -6.538 -14.871 5.782 164 H ARG 21 H ARG 21 -5.176 -12.175 9.578 165 HA ARG 21 HA ARG 21 -5.677 -9.528 8.813 166 HB2 ARG 21 2HB ARG 21 -5.759 -9.101 11.311 167 HB3 ARG 21 3HB ARG 21 -6.829 -10.359 10.707 168 HG2 ARG 21 2HG ARG 21 -5.567 -12.063 11.643 169 HG3 ARG 21 3HG ARG 21 -4.127 -11.053 11.780 170 HD2 ARG 21 2HD ARG 21 -6.604 -10.357 13.304 171 HD3 ARG 21 3HD ARG 21 -5.521 -11.613 13.903 172 HE ARG 21 HE ARG 21 -3.902 -9.467 13.367 173 HH11 ARG 21 1HH1 ARG 21 -6.694 -10.049 15.364 174 HH12 ARG 21 2HH1 ARG 21 -6.244 -8.880 16.560 175 HH21 ARG 21 1HH2 ARG 21 -3.298 -7.925 14.936 176 HH22 ARG 21 2HH2 ARG 21 -4.313 -7.672 16.316 177 H ALA 22 H ALA 22 -2.837 -11.051 10.197 178 HA ALA 22 HA ALA 22 -1.389 -8.882 11.081 179 HB1 ALA 22 1HB ALA 22 -0.626 -11.510 9.904 180 HB2 ALA 22 2HB ALA 22 0.627 -10.298 10.173 181 HB3 ALA 22 3HB ALA 22 -0.347 -10.875 11.525 182 H LEU 23 H LEU 23 -1.736 -10.078 7.769 183 HA LEU 23 HA LEU 23 0.010 -8.024 6.716 184 HB2 LEU 23 2HB LEU 23 -1.772 -9.805 5.090 185 HB3 LEU 23 3HB LEU 23 -0.246 -9.055 4.627 186 HG LEU 23 HG LEU 23 -0.422 -11.221 6.710 187 HD11 LEU 23 1HD1 LEU 23 -0.145 -11.446 3.726 188 HD12 LEU 23 2HD1 LEU 23 -1.294 -12.262 4.786 189 HD13 LEU 23 3HD1 LEU 23 0.413 -12.701 4.833 190 HD21 LEU 23 3HD2 LEU 23 1.895 -11.380 6.494 191 HD22 LEU 23 1HD2 LEU 23 1.590 -9.643 6.471 192 HD23 LEU 23 2HD2 LEU 23 1.909 -10.502 4.964 193 H ALA 24 H ALA 24 -3.432 -8.679 6.947 194 HA ALA 24 HA ALA 24 -4.472 -6.855 5.160 195 HB1 ALA 24 1HB ALA 24 -5.982 -8.308 6.221 196 HB2 ALA 24 2HB ALA 24 -5.479 -7.791 7.831 197 HB3 ALA 24 3HB ALA 24 -6.408 -6.699 6.804 198 H GLY 25 H GLY 25 -3.516 -6.283 8.541 199 HA2 GLY 25 2HA GLY 25 -4.059 -3.443 8.291 200 HA3 GLY 25 3HA GLY 25 -3.468 -4.272 9.723 201 H ALA 26 H ALA 26 -1.572 -5.338 7.283 202 HA ALA 26 HA ALA 26 0.527 -3.412 7.962 203 HB1 ALA 26 1HB ALA 26 1.764 -5.244 8.153 204 HB2 ALA 26 2HB ALA 26 0.467 -6.243 7.497 205 HB3 ALA 26 3HB ALA 26 1.621 -5.472 6.409 206 H GLY 27 H GLY 27 -1.680 -4.009 5.518 207 HA2 GLY 27 2HA GLY 27 -1.963 -2.860 3.524 208 HA3 GLY 27 3HA GLY 27 -0.397 -2.103 3.777 209 H LEU 28 H LEU 28 -0.957 -5.572 3.770 210 HA LEU 28 HA LEU 28 0.277 -5.778 1.120 211 HB2 LEU 28 2HB LEU 28 1.185 -7.808 3.023 212 HB3 LEU 28 3HB LEU 28 2.083 -6.925 1.789 213 HG LEU 28 HG LEU 28 1.337 -5.724 4.448 214 HD11 LEU 28 1HD1 LEU 28 3.027 -7.860 4.157 215 HD12 LEU 28 2HD1 LEU 28 3.080 -6.678 5.465 216 HD13 LEU 28 3HD1 LEU 28 4.125 -6.483 4.058 217 HD21 LEU 28 3HD2 LEU 28 3.680 -4.616 3.439 218 HD22 LEU 28 1HD2 LEU 28 2.078 -3.877 3.458 219 HD23 LEU 28 2HD2 LEU 28 2.618 -4.774 2.039 220 H THR 29 H THR 29 -0.441 -7.456 -0.112 221 HA THR 29 HA THR 29 -2.924 -8.555 0.291 222 HB THR 29 HB THR 29 -0.765 -10.018 -1.223 223 HG1 THR 29 HG1 THR 29 -1.489 -8.619 -2.998 224 HG21 THR 29 3HG2 THR 29 -3.727 -10.014 -1.169 225 HG22 THR 29 1HG2 THR 29 -2.602 -11.336 -1.479 226 HG23 THR 29 2HG2 THR 29 -2.959 -10.165 -2.750 227 H CYS 30 H CYS 30 -3.592 -10.777 0.694 228 HA CYS 30 HA CYS 30 -1.763 -12.378 2.313 229 HB2 CYS 30 2HB CYS 30 -3.616 -12.694 4.017 230 HB3 CYS 30 3HB CYS 30 -2.828 -11.121 4.024 231 HG CYS 30 HG CYS 30 -5.983 -11.918 3.059 232 H THR 31 H THR 31 -1.825 -14.390 1.590 233 HA THR 31 HA THR 31 -4.368 -15.434 0.528 234 HB THR 31 HB THR 31 -1.676 -16.264 -0.543 235 HG1 THR 31 HG1 THR 31 -2.465 -14.831 -2.371 236 HG21 THR 31 3HG2 THR 31 -2.955 -17.123 -2.398 237 HG22 THR 31 1HG2 THR 31 -4.439 -16.428 -1.749 238 HG23 THR 31 2HG2 THR 31 -3.640 -17.751 -0.899 239 H THR 32 H THR 32 -5.078 -16.951 1.870 240 HA THR 32 HA THR 32 -3.133 -18.634 3.288 241 HB THR 32 HB THR 32 -4.924 -19.204 4.828 242 HG1 THR 32 HG1 THR 32 -6.991 -18.608 4.483 243 HG21 THR 32 3HG2 THR 32 -4.299 -17.363 5.916 244 HG22 THR 32 1HG2 THR 32 -5.577 -16.482 5.081 245 HG23 THR 32 2HG2 THR 32 -3.952 -16.535 4.399 246 H PHE 33 H PHE 33 -2.932 -20.738 2.844 247 HA PHE 33 HA PHE 33 -4.923 -21.961 1.048 248 HB2 PHE 33 2HB PHE 33 -1.961 -22.536 1.276 249 HB3 PHE 33 3HB PHE 33 -3.082 -23.416 0.243 250 HD1 PHE 33 HD1 PHE 33 -4.230 -22.193 -1.622 251 HD2 PHE 33 HD2 PHE 33 -1.000 -20.512 0.583 252 HE1 PHE 33 HE1 PHE 33 -3.855 -20.559 -3.423 253 HE2 PHE 33 HE2 PHE 33 -0.621 -18.875 -1.214 254 HZ PHE 33 HZ PHE 33 -2.050 -18.896 -3.220 255 H GLU 34 H GLU 34 -4.176 -24.579 1.201 256 HA GLU 34 HA GLU 34 -3.906 -25.456 3.917 257 HB2 GLU 34 2HB GLU 34 -6.142 -26.639 3.924 258 HB3 GLU 34 3HB GLU 34 -6.200 -24.894 4.129 259 HG2 GLU 34 2HG GLU 34 -7.537 -24.693 2.385 260 HG3 GLU 34 3HG GLU 34 -6.367 -25.509 1.350 261 H ASN 35 H ASN 35 -2.178 -26.238 2.263 262 HA ASN 35 HA ASN 35 -2.376 -29.001 2.027 263 HB2 ASN 35 2HB ASN 35 -3.788 -27.705 -0.037 264 HB3 ASN 35 3HB ASN 35 -2.298 -28.294 -0.768 265 HD21 ASN 35 1HD2 ASN 35 -4.889 -29.225 -1.368 266 HD22 ASN 35 2HD2 ASN 35 -4.977 -30.888 -0.906 267 H GLY 36 H GLY 36 -1.123 -26.554 -0.252 268 HA2 GLY 36 2HA GLY 36 1.255 -25.848 0.215 269 HA3 GLY 36 3HA GLY 36 1.587 -27.570 0.342 270 H ASN 37 H ASN 37 0.588 -28.782 -1.706 271 HA ASN 37 HA ASN 37 2.197 -28.098 -3.877 272 HB2 ASN 37 2HB ASN 37 1.501 -30.336 -3.799 273 HB3 ASN 37 3HB ASN 37 -0.191 -29.900 -3.583 274 HD21 ASN 37 1HD2 ASN 37 -1.455 -29.553 -5.335 275 HD22 ASN 37 2HD2 ASN 37 -0.921 -29.759 -6.965 276 H GLU 38 H GLU 38 -1.013 -27.072 -3.019 277 HA GLU 38 HA GLU 38 -1.691 -26.032 -5.602 278 HB2 GLU 38 2HB GLU 38 -3.548 -24.898 -4.340 279 HB3 GLU 38 3HB GLU 38 -3.499 -26.648 -4.175 280 HG2 GLU 38 2HG GLU 38 -2.608 -26.508 -1.986 281 HG3 GLU 38 3HG GLU 38 -2.296 -24.781 -2.153 282 H VAL 39 H VAL 39 0.288 -24.975 -3.062 283 HA VAL 39 HA VAL 39 -0.012 -22.144 -3.640 284 HB VAL 39 HB VAL 39 2.100 -23.363 -1.877 285 HG11 VAL 39 1HG1 VAL 39 1.583 -20.763 -2.662 286 HG12 VAL 39 2HG1 VAL 39 0.862 -20.871 -1.055 287 HG13 VAL 39 3HG1 VAL 39 2.566 -21.265 -1.287 288 HG21 VAL 39 3HG2 VAL 39 -0.792 -23.308 -1.483 289 HG22 VAL 39 1HG2 VAL 39 0.452 -24.218 -0.627 290 HG23 VAL 39 2HG2 VAL 39 0.111 -22.549 -0.172 291 H LEU 40 H LEU 40 2.352 -24.724 -4.121 292 HA LEU 40 HA LEU 40 4.509 -23.286 -5.059 293 HB2 LEU 40 2HB LEU 40 5.026 -25.488 -4.870 294 HB3 LEU 40 3HB LEU 40 3.464 -26.019 -5.490 295 HG LEU 40 HG LEU 40 4.198 -25.567 -7.769 296 HD11 LEU 40 1HD1 LEU 40 7.002 -25.250 -7.341 297 HD12 LEU 40 2HD1 LEU 40 6.136 -23.968 -6.495 298 HD13 LEU 40 3HD1 LEU 40 5.886 -24.207 -8.224 299 HD21 LEU 40 3HD2 LEU 40 4.953 -27.660 -6.202 300 HD22 LEU 40 1HD2 LEU 40 6.506 -27.114 -6.835 301 HD23 LEU 40 2HD2 LEU 40 5.210 -27.561 -7.945 302 H ALA 41 H ALA 41 1.678 -24.420 -6.868 303 HA ALA 41 HA ALA 41 2.564 -23.402 -9.377 304 HB1 ALA 41 1HB ALA 41 -0.335 -23.759 -8.895 305 HB2 ALA 41 2HB ALA 41 0.669 -24.301 -10.240 306 HB3 ALA 41 3HB ALA 41 0.693 -25.181 -8.712 307 H ALA 42 H ALA 42 0.672 -22.109 -6.726 308 HA ALA 42 HA ALA 42 -0.511 -19.920 -7.979 309 HB1 ALA 42 1HB ALA 42 -0.677 -18.930 -5.762 310 HB2 ALA 42 2HB ALA 42 -1.074 -20.648 -5.711 311 HB3 ALA 42 3HB ALA 42 0.500 -20.089 -5.143 312 H LEU 43 H LEU 43 2.762 -20.392 -6.829 313 HA LEU 43 HA LEU 43 3.618 -17.721 -6.822 314 HB2 LEU 43 2HB LEU 43 5.412 -19.976 -7.629 315 HB3 LEU 43 3HB LEU 43 5.791 -18.542 -6.677 316 HG LEU 43 HG LEU 43 4.203 -20.937 -5.755 317 HD11 LEU 43 1HD1 LEU 43 6.162 -21.041 -4.121 318 HD12 LEU 43 2HD1 LEU 43 7.000 -19.977 -5.250 319 HD13 LEU 43 3HD1 LEU 43 6.454 -21.568 -5.779 320 HD21 LEU 43 3HD2 LEU 43 5.119 -18.757 -3.944 321 HD22 LEU 43 1HD2 LEU 43 3.767 -19.877 -3.771 322 HD23 LEU 43 2HD2 LEU 43 3.650 -18.519 -4.891 323 H ALA 44 H ALA 44 3.344 -20.082 -9.410 324 HA ALA 44 HA ALA 44 4.801 -18.695 -11.377 325 HB1 ALA 44 1HB ALA 44 4.372 -20.547 -12.518 326 HB2 ALA 44 2HB ALA 44 3.295 -21.076 -11.225 327 HB3 ALA 44 3HB ALA 44 2.656 -20.143 -12.579 328 H SER 45 H SER 45 1.819 -17.992 -9.923 329 HA SER 45 HA SER 45 0.615 -16.637 -12.149 330 HB2 SER 45 2HB SER 45 -0.041 -16.462 -9.198 331 HB3 SER 45 3HB SER 45 -1.054 -15.884 -10.521 332 HG SER 45 HG SER 45 -1.588 -18.015 -9.669 333 H LYS 46 H LYS 46 1.468 -15.281 -8.973 334 HA LYS 46 HA LYS 46 2.529 -12.913 -10.372 335 HB2 LYS 46 2HB LYS 46 1.812 -11.629 -8.323 336 HB3 LYS 46 3HB LYS 46 0.501 -12.248 -9.318 337 HG2 LYS 46 2HG LYS 46 -0.304 -13.502 -7.664 338 HG3 LYS 46 3HG LYS 46 1.297 -14.101 -7.222 339 HD2 LYS 46 2HD LYS 46 1.004 -12.884 -5.358 340 HD3 LYS 46 3HD LYS 46 1.428 -11.511 -6.383 341 HE2 LYS 46 2HE LYS 46 -0.585 -10.996 -5.167 342 HE3 LYS 46 3HE LYS 46 -0.978 -11.193 -6.875 343 HZ1 LYS 46 3HZ LYS 46 -1.433 -13.640 -6.096 344 HZ2 LYS 46 1HZ LYS 46 -2.613 -12.438 -5.931 345 HZ3 LYS 46 2HZ LYS 46 -1.677 -12.894 -4.598 346 H THR 47 H THR 47 3.152 -15.437 -8.201 347 HA THR 47 HA THR 47 4.972 -16.023 -6.965 348 HB THR 47 HB THR 47 6.769 -13.880 -7.808 349 HG1 THR 47 HG1 THR 47 5.238 -15.297 -9.716 350 HG21 THR 47 3HG2 THR 47 8.267 -15.570 -7.882 351 HG22 THR 47 1HG2 THR 47 7.162 -16.652 -8.729 352 HG23 THR 47 2HG2 THR 47 7.029 -16.445 -6.982 353 HA PRO 48 HA PRO 48 4.208 -13.076 -3.644 354 HB2 PRO 48 2HB PRO 48 4.785 -14.831 -1.655 355 HB3 PRO 48 3HB PRO 48 3.228 -14.805 -2.491 356 HG2 PRO 48 2HG PRO 48 5.582 -16.603 -2.926 357 HG3 PRO 48 3HG PRO 48 3.857 -17.011 -2.875 358 HD2 PRO 48 2HD PRO 48 5.219 -16.731 -5.198 359 HD3 PRO 48 3HD PRO 48 3.500 -16.317 -5.044 360 H ASP 49 H ASP 49 5.541 -11.915 -2.267 361 HA ASP 49 HA ASP 49 8.365 -12.072 -2.843 362 HB2 ASP 49 2HB ASP 49 6.794 -9.964 -2.425 363 HB3 ASP 49 3HB ASP 49 7.303 -10.225 -0.759 364 H VAL 50 H VAL 50 6.387 -13.618 -0.695 365 HA VAL 50 HA VAL 50 8.468 -14.821 0.740 366 HB VAL 50 HB VAL 50 8.739 -12.702 1.881 367 HG11 VAL 50 1HG1 VAL 50 6.054 -12.365 1.507 368 HG12 VAL 50 2HG1 VAL 50 6.147 -12.702 3.237 369 HG13 VAL 50 3HG1 VAL 50 7.069 -11.366 2.547 370 HG21 VAL 50 3HG2 VAL 50 8.516 -15.100 3.091 371 HG22 VAL 50 1HG2 VAL 50 8.979 -13.619 3.930 372 HG23 VAL 50 2HG2 VAL 50 7.309 -14.183 3.993 373 H LEU 51 H LEU 51 7.751 -16.527 2.009 374 HA LEU 51 HA LEU 51 4.830 -16.893 2.136 375 HB2 LEU 51 2HB LEU 51 6.657 -18.385 0.647 376 HB3 LEU 51 3HB LEU 51 6.295 -19.381 2.055 377 HG LEU 51 HG LEU 51 3.974 -18.227 0.631 378 HD11 LEU 51 1HD1 LEU 51 6.000 -19.530 -0.840 379 HD12 LEU 51 2HD1 LEU 51 4.382 -19.074 -1.373 380 HD13 LEU 51 3HD1 LEU 51 4.662 -20.666 -0.669 381 HD21 LEU 51 3HD2 LEU 51 4.665 -20.536 2.302 382 HD22 LEU 51 1HD2 LEU 51 3.554 -20.890 0.978 383 HD23 LEU 51 2HD2 LEU 51 3.148 -19.646 2.161 384 H LEU 52 H LEU 52 4.059 -18.242 3.865 385 HA LEU 52 HA LEU 52 5.952 -18.610 6.081 386 HB2 LEU 52 2HB LEU 52 3.426 -17.043 6.041 387 HB3 LEU 52 3HB LEU 52 3.817 -17.952 7.499 388 HG LEU 52 HG LEU 52 6.034 -16.716 7.504 389 HD11 LEU 52 1HD1 LEU 52 4.809 -15.595 5.116 390 HD12 LEU 52 2HD1 LEU 52 6.488 -15.562 5.652 391 HD13 LEU 52 3HD1 LEU 52 5.346 -14.363 6.259 392 HD21 LEU 52 3HD2 LEU 52 5.090 -14.779 8.598 393 HD22 LEU 52 1HD2 LEU 52 4.151 -16.212 9.015 394 HD23 LEU 52 2HD2 LEU 52 3.529 -15.066 7.827 395 H SER 53 H SER 53 5.895 -20.837 5.395 396 HA SER 53 HA SER 53 3.463 -22.330 5.423 397 HB2 SER 53 2HB SER 53 5.554 -22.964 4.158 398 HB3 SER 53 3HB SER 53 6.270 -23.420 5.704 399 HG SER 53 HG SER 53 4.597 -24.942 5.954 400 H ASP 54 H ASP 54 2.658 -23.715 6.977 401 HA ASP 54 HA ASP 54 3.691 -23.264 9.693 402 HB2 ASP 54 2HB ASP 54 1.370 -22.553 9.331 403 HB3 ASP 54 3HB ASP 54 0.949 -24.177 8.795 404 H ILE 55 H ILE 55 3.131 -25.661 7.282 405 HA ILE 55 HA ILE 55 3.683 -27.867 7.161 406 HB ILE 55 HB ILE 55 4.994 -27.575 9.859 407 HG12 ILE 55 2HG1 ILE 55 6.178 -27.008 7.133 408 HG13 ILE 55 3HG1 ILE 55 5.778 -25.793 8.342 409 HG21 ILE 55 1HG2 ILE 55 6.444 -29.245 8.128 410 HG22 ILE 55 2HG2 ILE 55 5.509 -29.711 9.547 411 HG23 ILE 55 3HG2 ILE 55 4.750 -29.700 7.956 412 HD11 ILE 55 3HD1 ILE 55 7.417 -26.829 9.866 413 HD12 ILE 55 1HD1 ILE 55 7.861 -27.949 8.578 414 HD13 ILE 55 2HD1 ILE 55 8.137 -26.218 8.377 415 H ARG 56 H ARG 56 1.414 -28.317 7.378 416 HA ARG 56 HA ARG 56 0.855 -29.908 9.758 417 HB2 ARG 56 2HB ARG 56 -1.092 -27.831 8.743 418 HB3 ARG 56 3HB ARG 56 -1.328 -28.912 10.110 419 HG2 ARG 56 2HG ARG 56 0.848 -26.840 9.977 420 HG3 ARG 56 3HG ARG 56 -0.733 -26.566 10.711 421 HD2 ARG 56 2HD ARG 56 0.934 -28.905 11.546 422 HD3 ARG 56 3HD ARG 56 1.269 -27.302 12.197 423 HE ARG 56 HE ARG 56 -1.489 -28.061 12.413 424 HH11 ARG 56 1HH1 ARG 56 1.652 -28.286 13.896 425 HH12 ARG 56 2HH1 ARG 56 1.026 -28.557 15.488 426 HH21 ARG 56 1HH2 ARG 56 -2.327 -28.417 14.504 427 HH22 ARG 56 2HH2 ARG 56 -1.238 -28.632 15.833 428 H MET 57 H MET 57 1.512 -30.990 7.392 429 HA MET 57 HA MET 57 -1.064 -31.974 6.356 430 HB2 MET 57 2HB MET 57 1.391 -31.956 4.642 431 HB3 MET 57 3HB MET 57 -0.301 -31.968 4.161 432 HG2 MET 57 2HG MET 57 0.145 -29.821 3.662 433 HG3 MET 57 3HG MET 57 -0.230 -29.594 5.369 434 HE1 MET 57 3HE MET 57 2.622 -27.879 3.154 435 HE2 MET 57 1HE MET 57 0.959 -27.679 3.705 436 HE3 MET 57 2HE MET 57 2.288 -27.010 4.652 437 HA PRO 58 HA PRO 58 0.339 -35.978 7.524 438 HB2 PRO 58 2HB PRO 58 -1.186 -37.481 5.855 439 HB3 PRO 58 3HB PRO 58 -1.843 -36.653 7.272 440 HG2 PRO 58 2HG PRO 58 -1.904 -35.825 4.396 441 HG3 PRO 58 3HG PRO 58 -3.194 -35.748 5.610 442 HD2 PRO 58 2HD PRO 58 -1.721 -33.586 4.910 443 HD3 PRO 58 3HD PRO 58 -2.367 -33.811 6.548 444 H GLY 59 H GLY 59 -0.042 -35.570 3.993 445 HA2 GLY 59 2HA GLY 59 1.927 -37.543 3.372 446 HA3 GLY 59 3HA GLY 59 1.204 -36.405 2.244 447 H MET 60 H MET 60 1.951 -33.999 2.939 448 HA MET 60 HA MET 60 4.810 -34.032 2.509 449 HB2 MET 60 2HB MET 60 2.961 -31.656 2.762 450 HB3 MET 60 3HB MET 60 4.593 -31.653 2.107 451 HG2 MET 60 2HG MET 60 3.869 -32.207 0.091 452 HG3 MET 60 3HG MET 60 2.941 -33.563 0.728 453 HE1 MET 60 3HE MET 60 1.104 -30.659 -1.624 454 HE2 MET 60 1HE MET 60 2.453 -29.834 -0.841 455 HE3 MET 60 2HE MET 60 2.702 -31.406 -1.600 456 H ASP 61 H ASP 61 6.374 -33.310 3.885 457 HA ASP 61 HA ASP 61 5.583 -33.023 6.680 458 HB2 ASP 61 2HB ASP 61 8.239 -33.511 5.332 459 HB3 ASP 61 3HB ASP 61 8.098 -33.176 7.055 460 H GLY 62 H GLY 62 5.316 -30.885 4.564 461 HA2 GLY 62 2HA GLY 62 5.284 -28.567 4.825 462 HA3 GLY 62 3HA GLY 62 6.354 -28.733 6.210 463 H LEU 63 H LEU 63 8.530 -29.979 5.243 464 HA LEU 63 HA LEU 63 9.731 -27.910 3.633 465 HB2 LEU 63 2HB LEU 63 11.745 -29.556 3.877 466 HB3 LEU 63 3HB LEU 63 11.207 -28.580 5.242 467 HG LEU 63 HG LEU 63 10.097 -30.478 6.225 468 HD11 LEU 63 1HD1 LEU 63 10.671 -31.730 3.584 469 HD12 LEU 63 2HD1 LEU 63 9.206 -31.781 4.564 470 HD13 LEU 63 3HD1 LEU 63 10.606 -32.750 5.021 471 HD21 LEU 63 3HD2 LEU 63 12.225 -32.097 6.140 472 HD22 LEU 63 1HD2 LEU 63 12.200 -30.589 7.053 473 HD23 LEU 63 2HD2 LEU 63 12.947 -30.640 5.456 474 H ALA 64 H ALA 64 8.189 -30.861 3.037 475 HA ALA 64 HA ALA 64 9.523 -32.039 0.957 476 HB1 ALA 64 1HB ALA 64 7.636 -33.191 1.568 477 HB2 ALA 64 2HB ALA 64 6.628 -31.744 1.599 478 HB3 ALA 64 3HB ALA 64 7.097 -32.460 0.056 479 H LEU 65 H LEU 65 7.006 -29.536 0.562 480 HA LEU 65 HA LEU 65 7.821 -29.086 -2.178 481 HB2 LEU 65 2HB LEU 65 5.888 -27.868 -2.433 482 HB3 LEU 65 3HB LEU 65 5.428 -29.027 -1.187 483 HG LEU 65 HG LEU 65 6.278 -26.189 -0.623 484 HD11 LEU 65 1HD1 LEU 65 3.479 -27.297 -0.648 485 HD12 LEU 65 2HD1 LEU 65 4.179 -26.365 -1.971 486 HD13 LEU 65 3HD1 LEU 65 3.977 -25.626 -0.383 487 HD21 LEU 65 3HD2 LEU 65 4.845 -26.916 1.494 488 HD22 LEU 65 1HD2 LEU 65 6.579 -27.217 1.381 489 HD23 LEU 65 2HD2 LEU 65 5.435 -28.510 1.019 490 H LEU 66 H LEU 66 8.394 -27.710 0.933 491 HA LEU 66 HA LEU 66 9.134 -25.099 0.122 492 HB2 LEU 66 2HB LEU 66 8.748 -26.332 2.509 493 HB3 LEU 66 3HB LEU 66 10.507 -26.226 2.465 494 HG LEU 66 HG LEU 66 9.736 -24.331 3.654 495 HD11 LEU 66 1HD1 LEU 66 10.349 -23.502 0.821 496 HD12 LEU 66 2HD1 LEU 66 11.529 -23.866 2.080 497 HD13 LEU 66 3HD1 LEU 66 10.465 -22.469 2.246 498 HD21 LEU 66 3HD2 LEU 66 8.175 -22.762 2.082 499 HD22 LEU 66 1HD2 LEU 66 7.567 -23.848 3.332 500 HD23 LEU 66 2HD2 LEU 66 7.594 -24.370 1.647 501 H LYS 67 H LYS 67 10.725 -28.148 -0.022 502 HA LYS 67 HA LYS 67 13.409 -27.226 -0.074 503 HB2 LYS 67 2HB LYS 67 12.010 -29.738 -0.390 504 HB3 LYS 67 3HB LYS 67 13.286 -29.581 -1.590 505 HG2 LYS 67 2HG LYS 67 14.376 -30.603 0.161 506 HG3 LYS 67 3HG LYS 67 14.763 -28.901 0.424 507 HD2 LYS 67 2HD LYS 67 12.745 -28.839 1.969 508 HD3 LYS 67 3HD LYS 67 12.745 -30.601 1.871 509 HE2 LYS 67 2HE LYS 67 13.992 -30.179 3.784 510 HE3 LYS 67 3HE LYS 67 15.226 -30.414 2.548 511 HZ1 LYS 67 3HZ LYS 67 14.382 -27.931 3.875 512 HZ2 LYS 67 1HZ LYS 67 15.034 -27.854 2.316 513 HZ3 LYS 67 2HZ LYS 67 15.943 -28.512 3.581 514 H GLN 68 H GLN 68 10.882 -27.406 -2.444 515 HA GLN 68 HA GLN 68 12.687 -27.033 -4.681 516 HB2 GLN 68 2HB GLN 68 10.878 -27.414 -6.057 517 HB3 GLN 68 3HB GLN 68 10.401 -28.316 -4.625 518 HG2 GLN 68 2HG GLN 68 9.328 -25.928 -4.037 519 HG3 GLN 68 3HG GLN 68 9.255 -25.871 -5.797 520 HE21 GLN 68 1HE2 GLN 68 7.035 -25.952 -4.028 521 HE22 GLN 68 2HE2 GLN 68 6.167 -27.411 -4.347 522 H ILE 69 H ILE 69 10.848 -25.105 -2.503 523 HA ILE 69 HA ILE 69 10.436 -22.809 -4.064 524 HB ILE 69 HB ILE 69 10.826 -23.092 -1.085 525 HG12 ILE 69 2HG1 ILE 69 8.327 -22.666 -2.737 526 HG13 ILE 69 3HG1 ILE 69 8.844 -24.215 -2.080 527 HG21 ILE 69 1HG2 ILE 69 10.596 -20.713 -2.765 528 HG22 ILE 69 2HG2 ILE 69 9.418 -20.778 -1.455 529 HG23 ILE 69 3HG2 ILE 69 11.142 -20.876 -1.096 530 HD11 ILE 69 3HD1 ILE 69 8.814 -22.435 0.079 531 HD12 ILE 69 1HD1 ILE 69 7.339 -22.126 -0.837 532 HD13 ILE 69 2HD1 ILE 69 7.691 -23.754 -0.255 533 H LYS 70 H LYS 70 13.238 -23.982 -2.333 534 HA LYS 70 HA LYS 70 14.713 -21.535 -2.478 535 HB2 LYS 70 2HB LYS 70 15.016 -24.034 -1.211 536 HB3 LYS 70 3HB LYS 70 16.408 -23.856 -2.271 537 HG2 LYS 70 2HG LYS 70 17.333 -22.685 -0.625 538 HG3 LYS 70 3HG LYS 70 16.218 -21.388 -1.063 539 HD2 LYS 70 2HD LYS 70 15.817 -21.620 1.201 540 HD3 LYS 70 3HD LYS 70 14.564 -22.649 0.504 541 HE2 LYS 70 2HE LYS 70 16.941 -24.189 0.847 542 HE3 LYS 70 3HE LYS 70 16.587 -23.348 2.355 543 HZ1 LYS 70 3HZ LYS 70 14.328 -24.621 1.043 544 HZ2 LYS 70 1HZ LYS 70 14.722 -24.540 2.686 545 HZ3 LYS 70 2HZ LYS 70 15.490 -25.668 1.688 546 H GLN 71 H GLN 71 14.164 -24.202 -4.605 547 HA GLN 71 HA GLN 71 16.433 -23.553 -6.302 548 HB2 GLN 71 2HB GLN 71 15.513 -25.919 -5.827 549 HB3 GLN 71 3HB GLN 71 14.251 -25.507 -6.981 550 HG2 GLN 71 2HG GLN 71 15.579 -26.019 -8.668 551 HG3 GLN 71 3HG GLN 71 16.780 -24.853 -8.114 552 HE21 GLN 71 1HE2 GLN 71 16.020 -28.122 -8.520 553 HE22 GLN 71 2HE2 GLN 71 17.402 -28.795 -7.732 554 H ARG 72 H ARG 72 12.887 -23.694 -6.651 555 HA ARG 72 HA ARG 72 12.884 -22.400 -9.185 556 HB2 ARG 72 2HB ARG 72 10.984 -23.664 -7.488 557 HB3 ARG 72 3HB ARG 72 10.377 -22.057 -7.862 558 HG2 ARG 72 2HG ARG 72 11.308 -23.064 -10.289 559 HG3 ARG 72 3HG ARG 72 10.475 -24.411 -9.510 560 HD2 ARG 72 2HD ARG 72 8.447 -23.302 -9.465 561 HD3 ARG 72 3HD ARG 72 9.200 -21.711 -9.561 562 HE ARG 72 HE ARG 72 9.762 -23.047 -11.936 563 HH11 ARG 72 1HH1 ARG 72 6.992 -21.818 -10.222 564 HH12 ARG 72 2HH1 ARG 72 6.074 -21.515 -11.660 565 HH21 ARG 72 1HH2 ARG 72 8.562 -22.653 -13.836 566 HH22 ARG 72 2HH2 ARG 72 6.967 -21.991 -13.715 567 H HIS 73 H HIS 73 12.842 -21.295 -5.895 568 HA HIS 73 HA HIS 73 12.962 -18.536 -6.847 569 HB2 HIS 73 2HB HIS 73 11.231 -19.209 -4.480 570 HB3 HIS 73 3HB HIS 73 11.278 -17.719 -5.417 571 HD1 HIS 73 HD1 HIS 73 10.168 -17.831 -7.829 572 HD2 HIS 73 HD2 HIS 73 9.441 -21.095 -5.364 573 HE1 HIS 73 HE1 HIS 73 8.227 -19.042 -8.872 574 HA PRO 74 HA PRO 74 16.157 -19.575 -3.647 575 HB2 PRO 74 2HB PRO 74 18.218 -18.445 -5.005 576 HB3 PRO 74 3HB PRO 74 17.697 -20.115 -5.264 577 HG2 PRO 74 2HG PRO 74 17.069 -17.665 -6.865 578 HG3 PRO 74 3HG PRO 74 17.502 -19.289 -7.429 579 HD2 PRO 74 2HD PRO 74 14.946 -18.397 -7.381 580 HD3 PRO 74 3HD PRO 74 15.368 -20.102 -7.121 581 H MET 75 H MET 75 15.615 -16.620 -5.527 582 HA MET 75 HA MET 75 16.748 -14.939 -3.469 583 HB2 MET 75 2HB MET 75 15.986 -13.078 -4.950 584 HB3 MET 75 3HB MET 75 17.050 -14.231 -5.744 585 HG2 MET 75 2HG MET 75 15.488 -14.851 -7.215 586 HG3 MET 75 3HG MET 75 14.207 -14.853 -6.005 587 HE1 MET 75 3HE MET 75 12.875 -11.360 -5.879 588 HE2 MET 75 1HE MET 75 13.329 -12.789 -4.951 589 HE3 MET 75 2HE MET 75 14.446 -11.430 -5.078 590 H LEU 76 H LEU 76 13.964 -16.596 -3.618 591 HA LEU 76 HA LEU 76 12.246 -14.486 -2.553 592 HB2 LEU 76 2HB LEU 76 11.165 -15.846 -4.155 593 HB3 LEU 76 3HB LEU 76 11.750 -17.327 -3.399 594 HG LEU 76 HG LEU 76 10.241 -17.013 -1.533 595 HD11 LEU 76 1HD1 LEU 76 9.692 -14.390 -2.867 596 HD12 LEU 76 2HD1 LEU 76 10.087 -14.723 -1.181 597 HD13 LEU 76 3HD1 LEU 76 8.495 -15.143 -1.813 598 HD21 LEU 76 3HD2 LEU 76 9.255 -17.086 -4.316 599 HD22 LEU 76 1HD2 LEU 76 8.048 -16.794 -3.063 600 HD23 LEU 76 2HD2 LEU 76 9.047 -18.247 -3.003 601 HA PRO 77 HA PRO 77 13.575 -15.849 1.518 602 HB2 PRO 77 2HB PRO 77 12.358 -13.818 2.846 603 HB3 PRO 77 3HB PRO 77 13.906 -13.630 2.014 604 HG2 PRO 77 2HG PRO 77 11.157 -12.880 1.094 605 HG3 PRO 77 3HG PRO 77 12.672 -11.968 0.955 606 HD2 PRO 77 2HD PRO 77 11.625 -13.377 -1.106 607 HD3 PRO 77 3HD PRO 77 13.374 -13.171 -0.881 608 H VAL 78 H VAL 78 12.554 -17.505 2.443 609 HA VAL 78 HA VAL 78 9.630 -17.349 2.785 610 HB VAL 78 HB VAL 78 11.315 -19.849 2.602 611 HG11 VAL 78 1HG1 VAL 78 9.480 -20.504 3.824 612 HG12 VAL 78 2HG1 VAL 78 8.414 -19.325 3.058 613 HG13 VAL 78 3HG1 VAL 78 8.904 -20.774 2.179 614 HG21 VAL 78 3HG2 VAL 78 9.521 -19.748 0.465 615 HG22 VAL 78 1HG2 VAL 78 10.235 -18.137 0.552 616 HG23 VAL 78 2HG2 VAL 78 11.273 -19.555 0.397 617 H ILE 79 H ILE 79 8.739 -18.309 4.709 618 HA ILE 79 HA ILE 79 10.648 -18.486 6.945 619 HB ILE 79 HB ILE 79 7.891 -17.307 7.221 620 HG12 ILE 79 2HG1 ILE 79 10.511 -15.836 6.855 621 HG13 ILE 79 3HG1 ILE 79 9.205 -15.910 5.677 622 HG21 ILE 79 1HG2 ILE 79 8.776 -16.441 9.326 623 HG22 ILE 79 2HG2 ILE 79 8.907 -18.198 9.252 624 HG23 ILE 79 3HG2 ILE 79 10.333 -17.195 8.985 625 HD11 ILE 79 3HD1 ILE 79 7.856 -14.955 7.785 626 HD12 ILE 79 1HD1 ILE 79 9.459 -14.305 8.130 627 HD13 ILE 79 2HD1 ILE 79 8.667 -13.933 6.598 628 H ILE 80 H ILE 80 10.135 -19.927 8.604 629 HA ILE 80 HA ILE 80 8.014 -21.860 7.933 630 HB ILE 80 HB ILE 80 10.521 -22.395 9.528 631 HG12 ILE 80 2HG1 ILE 80 10.815 -21.873 7.038 632 HG13 ILE 80 3HG1 ILE 80 11.477 -23.398 7.616 633 HG21 ILE 80 1HG2 ILE 80 8.909 -23.937 10.222 634 HG22 ILE 80 2HG2 ILE 80 8.241 -24.107 8.599 635 HG23 ILE 80 3HG2 ILE 80 9.819 -24.798 8.980 636 HD11 ILE 80 3HD1 ILE 80 9.932 -23.125 5.419 637 HD12 ILE 80 1HD1 ILE 80 10.096 -24.616 6.346 638 HD13 ILE 80 2HD1 ILE 80 8.722 -23.548 6.631 639 H MET 81 H MET 81 6.590 -22.507 9.491 640 HA MET 81 HA MET 81 6.865 -21.263 12.146 641 HB2 MET 81 2HB MET 81 4.238 -21.699 10.728 642 HB3 MET 81 3HB MET 81 4.519 -20.798 12.212 643 HG2 MET 81 2HG MET 81 5.723 -19.096 10.999 644 HG3 MET 81 3HG MET 81 5.578 -20.021 9.506 645 HE1 MET 81 3HE MET 81 3.341 -21.025 8.909 646 HE2 MET 81 1HE MET 81 1.962 -20.760 9.978 647 HE3 MET 81 2HE MET 81 2.073 -19.888 8.449 648 H THR 82 H THR 82 6.893 -22.681 13.753 649 HA THR 82 HA THR 82 5.133 -24.828 14.071 650 HB THR 82 HB THR 82 6.088 -26.159 12.447 651 HG1 THR 82 HG1 THR 82 6.734 -27.748 13.692 652 HG21 THR 82 3HG2 THR 82 8.433 -24.486 12.910 653 HG22 THR 82 1HG2 THR 82 7.887 -25.283 11.435 654 HG23 THR 82 2HG2 THR 82 8.836 -26.179 12.621 655 H ALA 83 H ALA 83 8.570 -25.249 14.655 656 HA ALA 83 HA ALA 83 9.811 -25.312 16.562 657 HB1 ALA 83 1HB ALA 83 8.068 -23.000 16.868 658 HB2 ALA 83 2HB ALA 83 8.597 -23.678 18.408 659 HB3 ALA 83 3HB ALA 83 9.789 -23.176 17.209 660 H HIS 84 H HIS 84 8.892 -27.540 16.679 661 HA HIS 84 HA HIS 84 8.191 -28.200 19.301 662 HB2 HIS 84 2HB HIS 84 5.877 -29.000 18.990 663 HB3 HIS 84 3HB HIS 84 6.003 -27.256 18.777 664 HD1 HIS 84 HD1 HIS 84 5.600 -30.424 16.762 665 HD2 HIS 84 HD2 HIS 84 5.166 -26.314 16.338 666 HE1 HIS 84 HE1 HIS 84 4.479 -30.092 14.535 667 H SER 85 H SER 85 8.115 -29.076 15.905 668 HA SER 85 HA SER 85 9.478 -31.540 16.438 669 HB2 SER 85 2HB SER 85 7.111 -32.167 16.913 670 HB3 SER 85 3HB SER 85 6.694 -31.719 15.260 671 HG SER 85 HG SER 85 7.352 -34.045 15.922 672 H ASP 86 H ASP 86 9.778 -29.079 14.869 673 HA ASP 86 HA ASP 86 10.379 -30.350 12.307 674 HB2 ASP 86 2HB ASP 86 8.468 -28.125 12.731 675 HB3 ASP 86 3HB ASP 86 9.589 -27.939 11.385 676 H LEU 87 H LEU 87 10.748 -27.568 14.445 677 HA LEU 87 HA LEU 87 12.723 -26.143 13.185 678 HB2 LEU 87 2HB LEU 87 11.800 -26.487 15.919 679 HB3 LEU 87 3HB LEU 87 13.517 -26.102 15.833 680 HG LEU 87 HG LEU 87 13.007 -24.062 14.592 681 HD11 LEU 87 1HD1 LEU 87 11.108 -23.910 13.460 682 HD12 LEU 87 2HD1 LEU 87 10.252 -23.752 14.993 683 HD13 LEU 87 3HD1 LEU 87 10.462 -25.343 14.260 684 HD21 LEU 87 3HD2 LEU 87 11.786 -22.868 16.414 685 HD22 LEU 87 1HD2 LEU 87 13.144 -23.846 16.967 686 HD23 LEU 87 2HD2 LEU 87 11.494 -24.434 17.172 687 H ASP 88 H ASP 88 13.160 -28.934 15.343 688 HA ASP 88 HA ASP 88 15.873 -29.101 15.498 689 HB2 ASP 88 2HB ASP 88 13.721 -30.839 15.973 690 HB3 ASP 88 3HB ASP 88 14.818 -31.730 14.922 691 H ALA 89 H ALA 89 13.848 -30.051 12.770 692 HA ALA 89 HA ALA 89 16.151 -30.952 11.244 693 HB1 ALA 89 1HB ALA 89 13.817 -30.795 9.630 694 HB2 ALA 89 2HB ALA 89 14.646 -32.230 10.235 695 HB3 ALA 89 3HB ALA 89 13.369 -31.481 11.192 696 H ALA 90 H ALA 90 13.616 -28.469 10.905 697 HA ALA 90 HA ALA 90 14.476 -27.215 8.619 698 HB1 ALA 90 1HB ALA 90 13.514 -25.102 9.697 699 HB2 ALA 90 2HB ALA 90 12.439 -26.488 9.507 700 HB3 ALA 90 3HB ALA 90 13.147 -26.132 11.082 701 H VAL 91 H VAL 91 15.822 -27.009 11.844 702 HA VAL 91 HA VAL 91 17.358 -24.732 11.710 703 HB VAL 91 HB VAL 91 17.911 -27.382 13.024 704 HG11 VAL 91 1HG1 VAL 91 19.663 -26.019 14.323 705 HG12 VAL 91 2HG1 VAL 91 20.091 -26.615 12.718 706 HG13 VAL 91 3HG1 VAL 91 19.630 -24.927 12.940 707 HG21 VAL 91 3HG2 VAL 91 16.175 -25.396 13.676 708 HG22 VAL 91 1HG2 VAL 91 16.889 -26.522 14.832 709 HG23 VAL 91 2HG2 VAL 91 17.601 -24.925 14.602 710 H SER 92 H SER 92 18.438 -28.012 10.806 711 HA SER 92 HA SER 92 20.762 -26.912 9.461 712 HB2 SER 92 2HB SER 92 21.214 -28.908 10.660 713 HB3 SER 92 3HB SER 92 19.801 -29.723 9.990 714 HG SER 92 HG SER 92 22.303 -29.257 8.850 715 H ALA 93 H ALA 93 17.812 -28.681 8.615 716 HA ALA 93 HA ALA 93 18.309 -28.956 5.869 717 HB1 ALA 93 1HB ALA 93 15.719 -28.797 7.398 718 HB2 ALA 93 2HB ALA 93 15.823 -29.191 5.681 719 HB3 ALA 93 3HB ALA 93 16.577 -30.247 6.876 720 H TYR 94 H TYR 94 16.107 -26.614 7.426 721 HA TYR 94 HA TYR 94 15.672 -25.038 5.174 722 HB2 TYR 94 2HB TYR 94 14.581 -25.035 7.580 723 HB3 TYR 94 3HB TYR 94 15.753 -23.755 7.872 724 HD1 TYR 94 HD2 TYR 94 13.774 -24.541 4.810 725 HD2 TYR 94 HD1 TYR 94 14.527 -21.782 7.961 726 HE1 TYR 94 HE2 TYR 94 12.262 -22.920 3.745 727 HE2 TYR 94 HE1 TYR 94 13.016 -20.154 6.904 728 HH TYR 94 HH TYR 94 10.917 -20.423 5.210 729 H GLN 95 H GLN 95 18.447 -25.304 7.150 730 HA GLN 95 HA GLN 95 19.534 -22.711 6.735 731 HB2 GLN 95 2HB GLN 95 20.346 -25.189 8.001 732 HB3 GLN 95 3HB GLN 95 21.679 -24.457 7.118 733 HG2 GLN 95 2HG GLN 95 19.998 -22.916 9.068 734 HG3 GLN 95 3HG GLN 95 21.430 -23.822 9.552 735 HE21 GLN 95 1HE2 GLN 95 23.457 -23.252 8.488 736 HE22 GLN 95 2HE2 GLN 95 23.723 -21.609 8.028 737 H GLN 96 H GLN 96 18.803 -24.940 4.510 738 HA GLN 96 HA GLN 96 21.176 -25.059 2.941 739 HB2 GLN 96 2HB GLN 96 18.299 -25.745 2.500 740 HB3 GLN 96 3HB GLN 96 19.375 -25.649 1.112 741 HG2 GLN 96 2HG GLN 96 20.279 -27.255 3.429 742 HG3 GLN 96 3HG GLN 96 18.963 -27.899 2.449 743 HE21 GLN 96 1HE2 GLN 96 22.312 -27.382 2.694 744 HE22 GLN 96 2HE2 GLN 96 22.763 -28.009 1.149 745 H GLY 97 H GLY 97 20.013 -22.377 3.800 746 HA2 GLY 97 2HA GLY 97 20.691 -20.374 2.610 747 HA3 GLY 97 3HA GLY 97 20.158 -21.144 1.123 748 H ALA 98 H ALA 98 18.343 -21.203 4.126 749 HA ALA 98 HA ALA 98 16.213 -19.691 2.780 750 HB1 ALA 98 1HB ALA 98 14.655 -20.880 3.974 751 HB2 ALA 98 2HB ALA 98 15.935 -22.083 3.810 752 HB3 ALA 98 3HB ALA 98 15.756 -21.186 5.318 753 H PHE 99 H PHE 99 14.762 -18.482 4.434 754 HA PHE 99 HA PHE 99 16.511 -16.640 5.857 755 HB2 PHE 99 2HB PHE 99 14.923 -15.559 4.452 756 HB3 PHE 99 3HB PHE 99 13.599 -16.536 5.077 757 HD1 PHE 99 HD1 PHE 99 15.900 -13.767 5.825 758 HD2 PHE 99 HD2 PHE 99 12.469 -15.948 7.086 759 HE1 PHE 99 HE1 PHE 99 15.401 -12.018 7.483 760 HE2 PHE 99 HE2 PHE 99 11.965 -14.203 8.745 761 HZ PHE 99 HZ PHE 99 13.431 -12.234 8.945 762 H ASP 100 H ASP 100 16.213 -16.047 8.033 763 HA ASP 100 HA ASP 100 15.909 -18.044 9.875 764 HB2 ASP 100 2HB ASP 100 16.844 -15.764 10.313 765 HB3 ASP 100 3HB ASP 100 15.194 -15.149 10.377 766 H TYR 101 H TYR 101 14.239 -19.333 10.246 767 HA TYR 101 HA TYR 101 11.563 -18.658 9.546 768 HB2 TYR 101 2HB TYR 101 11.052 -20.829 10.810 769 HB3 TYR 101 3HB TYR 101 12.093 -20.948 9.396 770 HD1 TYR 101 HD2 TYR 101 12.587 -20.190 13.030 771 HD2 TYR 101 HD1 TYR 101 13.806 -22.460 9.644 772 HE1 TYR 101 HE2 TYR 101 14.308 -21.293 14.397 773 HE2 TYR 101 HE1 TYR 101 15.530 -23.570 11.002 774 HH TYR 101 HH TYR 101 16.725 -22.519 13.675 775 H LEU 102 H LEU 102 9.742 -18.922 11.153 776 HA LEU 102 HA LEU 102 10.440 -17.696 13.738 777 HB2 LEU 102 2HB LEU 102 9.496 -15.893 12.669 778 HB3 LEU 102 3HB LEU 102 8.400 -16.895 11.720 779 HG LEU 102 HG LEU 102 7.179 -17.319 13.937 780 HD11 LEU 102 1HD1 LEU 102 9.222 -15.381 14.748 781 HD12 LEU 102 2HD1 LEU 102 8.291 -16.526 15.713 782 HD13 LEU 102 3HD1 LEU 102 7.580 -14.979 15.253 783 HD21 LEU 102 3HD2 LEU 102 6.265 -14.813 13.737 784 HD22 LEU 102 1HD2 LEU 102 5.892 -16.069 12.556 785 HD23 LEU 102 2HD2 LEU 102 7.176 -14.905 12.229 786 HA PRO 103 HA PRO 103 8.247 -21.253 15.257 787 HB2 PRO 103 2HB PRO 103 8.409 -20.593 17.885 788 HB3 PRO 103 3HB PRO 103 9.771 -21.260 16.976 789 HG2 PRO 103 2HG PRO 103 9.180 -18.412 17.685 790 HG3 PRO 103 3HG PRO 103 10.724 -19.281 17.742 791 HD2 PRO 103 2HD PRO 103 10.067 -17.609 15.716 792 HD3 PRO 103 3HD PRO 103 11.084 -19.045 15.477 793 H LYS 104 H LYS 104 6.250 -21.720 16.269 794 HA LYS 104 HA LYS 104 4.485 -19.394 16.664 795 HB2 LYS 104 2HB LYS 104 2.684 -20.535 15.597 796 HB3 LYS 104 3HB LYS 104 4.073 -20.654 14.523 797 HG2 LYS 104 2HG LYS 104 3.509 -22.816 14.417 798 HG3 LYS 104 3HG LYS 104 4.348 -22.928 15.966 799 HD2 LYS 104 2HD LYS 104 2.456 -23.399 17.052 800 HD3 LYS 104 3HD LYS 104 1.601 -22.059 16.286 801 HE2 LYS 104 2HE LYS 104 1.079 -23.393 14.375 802 HE3 LYS 104 3HE LYS 104 2.134 -24.694 14.926 803 HZ1 LYS 104 3HZ LYS 104 0.041 -23.928 16.777 804 HZ2 LYS 104 1HZ LYS 104 0.587 -25.467 16.334 805 HZ3 LYS 104 2HZ LYS 104 -0.500 -24.636 15.339 806 HA PRO 105 HA PRO 105 2.329 -19.125 17.239 807 HB2 PRO 105 2HB PRO 105 1.638 -17.707 19.449 808 HB3 PRO 105 3HB PRO 105 0.714 -19.099 18.873 809 HG2 PRO 105 2HG PRO 105 2.746 -18.951 21.065 810 HG3 PRO 105 3HG PRO 105 1.188 -19.796 21.040 811 HD2 PRO 105 2HD PRO 105 3.542 -21.071 20.637 812 HD3 PRO 105 3HD PRO 105 2.033 -21.583 19.855 813 H PHE 106 H PHE 106 2.519 -16.637 17.568 814 HA PHE 106 HA PHE 106 5.046 -15.754 18.665 815 HB2 PHE 106 2HB PHE 106 5.772 -14.749 16.480 816 HB3 PHE 106 3HB PHE 106 5.838 -16.507 16.528 817 HD1 PHE 106 HD2 PHE 106 3.571 -13.733 15.513 818 HD2 PHE 106 HD1 PHE 106 4.904 -17.712 14.803 819 HE1 PHE 106 HE2 PHE 106 2.177 -13.835 13.488 820 HE2 PHE 106 HE1 PHE 106 3.513 -17.820 12.776 821 HZ PHE 106 HZ PHE 106 2.146 -15.881 12.117 822 H ASP 107 H ASP 107 5.349 -13.326 18.096 823 HA ASP 107 HA ASP 107 2.798 -12.032 18.670 824 HB2 ASP 107 2HB ASP 107 5.611 -10.918 18.740 825 HB3 ASP 107 3HB ASP 107 4.160 -10.081 19.284 826 H ILE 108 H ILE 108 1.648 -11.303 17.015 827 HA ILE 108 HA ILE 108 2.368 -11.085 14.391 828 HB ILE 108 HB ILE 108 0.354 -9.469 15.942 829 HG12 ILE 108 2HG1 ILE 108 -0.280 -11.488 13.829 830 HG13 ILE 108 3HG1 ILE 108 0.236 -12.055 15.413 831 HG21 ILE 108 1HG2 ILE 108 -0.602 -8.899 13.689 832 HG22 ILE 108 2HG2 ILE 108 0.910 -8.088 14.092 833 HG23 ILE 108 3HG2 ILE 108 0.914 -9.461 12.985 834 HD11 ILE 108 3HD1 ILE 108 -1.727 -10.095 15.862 835 HD12 ILE 108 1HD1 ILE 108 -2.328 -11.138 14.574 836 HD13 ILE 108 2HD1 ILE 108 -1.843 -11.835 16.120 837 H ASP 109 H ASP 109 2.947 -8.778 16.958 838 HA ASP 109 HA ASP 109 3.621 -6.541 15.407 839 HB2 ASP 109 2HB ASP 109 4.804 -7.304 18.083 840 HB3 ASP 109 3HB ASP 109 4.719 -5.688 17.388 841 H GLU 110 H GLU 110 5.613 -9.208 16.625 842 HA GLU 110 HA GLU 110 8.009 -8.160 15.414 843 HB2 GLU 110 2HB GLU 110 7.825 -9.606 17.547 844 HB3 GLU 110 3HB GLU 110 7.676 -10.965 16.443 845 HG2 GLU 110 2HG GLU 110 9.884 -11.072 16.420 846 HG3 GLU 110 3HG GLU 110 9.880 -9.560 15.514 847 H ALA 111 H ALA 111 5.527 -10.476 14.611 848 HA ALA 111 HA ALA 111 6.906 -11.803 12.521 849 HB1 ALA 111 1HB ALA 111 4.650 -12.349 13.808 850 HB2 ALA 111 2HB ALA 111 3.953 -11.553 12.397 851 HB3 ALA 111 3HB ALA 111 4.982 -12.971 12.191 852 H VAL 112 H VAL 112 4.413 -9.252 12.431 853 HA VAL 112 HA VAL 112 4.321 -8.820 9.711 854 HB VAL 112 HB VAL 112 3.982 -6.897 12.002 855 HG11 VAL 112 1HG1 VAL 112 4.611 -5.422 10.313 856 HG12 VAL 112 2HG1 VAL 112 3.825 -6.377 9.054 857 HG13 VAL 112 3HG1 VAL 112 2.851 -5.451 10.197 858 HG21 VAL 112 3HG2 VAL 112 2.017 -8.159 10.090 859 HG22 VAL 112 1HG2 VAL 112 2.303 -8.658 11.757 860 HG23 VAL 112 2HG2 VAL 112 1.617 -7.069 11.418 861 H ALA 113 H ALA 113 6.723 -7.755 12.026 862 HA ALA 113 HA ALA 113 8.051 -6.023 10.126 863 HB1 ALA 113 1HB ALA 113 7.916 -5.907 12.780 864 HB2 ALA 113 2HB ALA 113 9.406 -6.838 12.631 865 HB3 ALA 113 3HB ALA 113 9.280 -5.251 11.873 866 H LEU 114 H LEU 114 8.508 -9.231 11.510 867 HA LEU 114 HA LEU 114 11.088 -9.776 10.650 868 HB2 LEU 114 2HB LEU 114 10.026 -11.295 12.118 869 HB3 LEU 114 3HB LEU 114 8.687 -11.549 11.001 870 HG LEU 114 HG LEU 114 10.444 -12.599 9.448 871 HD11 LEU 114 1HD1 LEU 114 11.934 -12.696 12.066 872 HD12 LEU 114 2HD1 LEU 114 12.423 -11.819 10.617 873 HD13 LEU 114 3HD1 LEU 114 12.368 -13.581 10.603 874 HD21 LEU 114 3HD2 LEU 114 10.420 -14.629 11.315 875 HD22 LEU 114 1HD2 LEU 114 9.169 -14.302 10.116 876 HD23 LEU 114 2HD2 LEU 114 9.015 -13.654 11.749 877 H VAL 115 H VAL 115 8.058 -9.862 8.878 878 HA VAL 115 HA VAL 115 9.221 -11.064 6.532 879 HB VAL 115 HB VAL 115 6.873 -11.455 7.004 880 HG11 VAL 115 1HG1 VAL 115 5.222 -9.645 6.834 881 HG12 VAL 115 2HG1 VAL 115 6.354 -9.382 8.162 882 HG13 VAL 115 3HG1 VAL 115 6.532 -8.478 6.657 883 HG21 VAL 115 3HG2 VAL 115 6.450 -9.801 4.647 884 HG22 VAL 115 1HG2 VAL 115 7.931 -10.754 4.559 885 HG23 VAL 115 2HG2 VAL 115 6.382 -11.554 4.825 886 H GLU 116 H GLU 116 8.443 -7.825 7.644 887 HA GLU 116 HA GLU 116 8.742 -6.475 5.195 888 HB2 GLU 116 2HB GLU 116 8.963 -5.633 8.068 889 HB3 GLU 116 3HB GLU 116 9.341 -4.503 6.776 890 HG2 GLU 116 2HG GLU 116 6.885 -5.653 6.087 891 HG3 GLU 116 3HG GLU 116 6.791 -5.303 7.812 892 H ARG 117 H ARG 117 11.035 -7.919 7.285 893 HA ARG 117 HA ARG 117 13.292 -6.318 6.657 894 HB2 ARG 117 2HB ARG 117 13.456 -9.227 7.394 895 HB3 ARG 117 3HB ARG 117 14.576 -7.929 7.785 896 HG2 ARG 117 2HG ARG 117 12.248 -7.103 8.983 897 HG3 ARG 117 3HG ARG 117 12.216 -8.853 9.208 898 HD2 ARG 117 2HD ARG 117 14.575 -7.104 9.883 899 HD3 ARG 117 3HD ARG 117 13.341 -7.586 11.046 900 HE ARG 117 HE ARG 117 14.284 -9.914 9.886 901 HH11 ARG 117 1HH1 ARG 117 15.559 -7.298 11.797 902 HH12 ARG 117 2HH1 ARG 117 16.775 -8.272 12.556 903 HH21 ARG 117 1HH2 ARG 117 15.880 -11.207 10.879 904 HH22 ARG 117 2HH2 ARG 117 16.956 -10.495 12.033 905 H ALA 118 H ALA 118 12.109 -9.415 5.375 906 HA ALA 118 HA ALA 118 14.178 -9.701 3.452 907 HB1 ALA 118 1HB ALA 118 12.008 -11.240 4.372 908 HB2 ALA 118 2HB ALA 118 11.802 -11.061 2.630 909 HB3 ALA 118 3HB ALA 118 13.300 -11.730 3.276 910 H ILE 119 H ILE 119 10.848 -8.488 3.266 911 HA ILE 119 HA ILE 119 10.810 -8.014 0.495 912 HB ILE 119 HB ILE 119 9.286 -6.493 2.612 913 HG12 ILE 119 2HG1 ILE 119 8.469 -8.990 1.113 914 HG13 ILE 119 3HG1 ILE 119 9.028 -8.968 2.782 915 HG21 ILE 119 1HG2 ILE 119 8.556 -7.006 -0.265 916 HG22 ILE 119 2HG2 ILE 119 7.721 -5.965 0.887 917 HG23 ILE 119 3HG2 ILE 119 9.328 -5.527 0.307 918 HD11 ILE 119 3HD1 ILE 119 6.806 -7.147 2.206 919 HD12 ILE 119 1HD1 ILE 119 6.438 -8.862 2.023 920 HD13 ILE 119 2HD1 ILE 119 7.056 -8.251 3.558 921 H SER 120 H SER 120 11.317 -5.710 3.173 922 HA SER 120 HA SER 120 11.899 -3.477 1.617 923 HB2 SER 120 2HB SER 120 11.486 -3.557 4.124 924 HB3 SER 120 3HB SER 120 13.169 -4.054 4.297 925 HG SER 120 HG SER 120 12.971 -1.804 4.504 926 H HIS 121 H HIS 121 13.835 -6.242 2.377 927 HA HIS 121 HA HIS 121 16.405 -5.219 1.993 928 HB2 HIS 121 2HB HIS 121 15.746 -7.532 2.830 929 HB3 HIS 121 3HB HIS 121 15.531 -7.978 1.139 930 HD1 HIS 121 HD1 HIS 121 17.668 -8.190 -0.312 931 HD2 HIS 121 HD2 HIS 121 18.394 -7.289 3.678 932 HE1 HIS 121 HE1 HIS 121 20.129 -8.578 0.027 933 H TYR 122 H TYR 122 13.874 -5.809 -0.258 934 HA TYR 122 HA TYR 122 15.741 -5.460 -2.508 935 HB2 TYR 122 2HB TYR 122 12.895 -6.419 -2.746 936 HB3 TYR 122 3HB TYR 122 14.204 -6.587 -3.910 937 HD1 TYR 122 HD1 TYR 122 16.310 -7.933 -2.939 938 HD2 TYR 122 HD2 TYR 122 12.307 -8.293 -1.542 939 HE1 TYR 122 HE1 TYR 122 16.830 -10.162 -2.038 940 HE2 TYR 122 HE2 TYR 122 12.817 -10.522 -0.636 941 HH TYR 122 HH TYR 122 15.502 -12.276 -1.475 942 H GLN 123 H GLN 123 15.028 -3.230 -0.996 943 HA GLN 123 HA GLN 123 14.129 -1.464 -2.992 944 HB2 GLN 123 2HB GLN 123 12.063 -2.651 -1.312 945 HB3 GLN 123 3HB GLN 123 12.075 -0.894 -1.219 946 HG2 GLN 123 2HG GLN 123 11.187 -0.682 -3.242 947 HG3 GLN 123 3HG GLN 123 12.308 -1.847 -3.945 948 HE21 GLN 123 1HE2 GLN 123 9.603 -1.894 -1.642 949 HE22 GLN 123 2HE2 GLN 123 8.798 -3.247 -2.355 950 H GLU 124 H GLU 124 13.559 -1.574 0.528 951 HA GLU 124 HA GLU 124 14.299 -0.257 2.229 952 HB2 GLU 124 2HB GLU 124 16.554 -0.824 0.649 953 HB3 GLU 124 3HB GLU 124 16.647 0.894 1.011 954 HG2 GLU 124 2HG GLU 124 16.016 -0.126 3.445 955 HG3 GLU 124 3HG GLU 124 16.992 -1.426 2.762 Start of MODEL 7 1 H1 MET 1 H MET 1 3.225 -0.449 0.351 2 HA MET 1 HA MET 1 1.191 0.811 -1.271 3 HB2 MET 1 2HB MET 1 2.776 1.214 -3.170 4 HB3 MET 1 3HB MET 1 2.998 2.290 -1.797 5 HG2 MET 1 2HG MET 1 4.663 0.037 -1.401 6 HG3 MET 1 3HG MET 1 4.890 0.596 -3.057 7 HE1 MET 1 3HE MET 1 7.889 1.975 -0.837 8 HE2 MET 1 1HE MET 1 6.843 0.860 0.043 9 HE3 MET 1 2HE MET 1 7.273 0.527 -1.635 10 H GLN 2 H GLN 2 1.902 -1.838 -0.100 11 HA GLN 2 HA GLN 2 1.859 -4.045 -0.656 12 HB2 GLN 2 2HB GLN 2 0.561 -2.982 -3.171 13 HB3 GLN 2 3HB GLN 2 0.505 -4.650 -2.614 14 HG2 GLN 2 2HG GLN 2 -0.931 -4.163 -0.875 15 HG3 GLN 2 3HG GLN 2 -0.491 -2.456 -0.854 16 HE21 GLN 2 1HE2 GLN 2 -0.916 -1.464 -3.186 17 HE22 GLN 2 2HE2 GLN 2 -2.522 -1.729 -3.763 18 H ARG 3 H ARG 3 4.315 -3.010 -1.047 19 HA ARG 3 HA ARG 3 5.239 -3.683 -3.718 20 HB2 ARG 3 2HB ARG 3 7.195 -2.590 -3.196 21 HB3 ARG 3 3HB ARG 3 6.071 -1.755 -2.132 22 HG2 ARG 3 2HG ARG 3 7.919 -3.999 -1.349 23 HG3 ARG 3 3HG ARG 3 8.130 -2.288 -0.971 24 HD2 ARG 3 2HD ARG 3 5.767 -3.944 -0.098 25 HD3 ARG 3 3HD ARG 3 7.192 -3.649 0.898 26 HE ARG 3 HE ARG 3 6.006 -1.230 -0.054 27 HH11 ARG 3 1HH1 ARG 3 5.782 -3.712 2.376 28 HH12 ARG 3 2HH1 ARG 3 4.990 -2.692 3.531 29 HH21 ARG 3 1HH2 ARG 3 4.963 0.123 1.458 30 HH22 ARG 3 2HH2 ARG 3 4.524 -0.511 3.008 31 H GLY 4 H GLY 4 4.456 -5.445 -1.087 32 HA2 GLY 4 2HA GLY 4 6.105 -7.671 -1.957 33 HA3 GLY 4 3HA GLY 4 6.398 -7.124 -0.313 34 H ILE 5 H ILE 5 4.517 -9.101 -2.295 35 HA ILE 5 HA ILE 5 2.216 -9.249 -0.565 36 HB ILE 5 HB ILE 5 3.063 -10.968 -2.897 37 HG12 ILE 5 2HG1 ILE 5 0.768 -9.018 -2.735 38 HG13 ILE 5 3HG1 ILE 5 2.374 -8.536 -3.270 39 HG21 ILE 5 1HG2 ILE 5 0.462 -11.502 -2.673 40 HG22 ILE 5 2HG2 ILE 5 1.701 -12.459 -1.862 41 HG23 ILE 5 3HG2 ILE 5 0.827 -11.212 -0.972 42 HD11 ILE 5 3HD1 ILE 5 1.844 -10.753 -4.803 43 HD12 ILE 5 1HD1 ILE 5 0.279 -9.947 -4.694 44 HD13 ILE 5 2HD1 ILE 5 1.682 -9.072 -5.309 45 H VAL 6 H VAL 6 1.729 -10.804 0.921 46 HA VAL 6 HA VAL 6 3.827 -12.796 1.492 47 HB VAL 6 HB VAL 6 2.054 -11.554 3.588 48 HG11 VAL 6 1HG1 VAL 6 4.365 -13.434 3.574 49 HG12 VAL 6 2HG1 VAL 6 4.152 -12.351 4.951 50 HG13 VAL 6 3HG1 VAL 6 2.874 -13.485 4.514 51 HG21 VAL 6 3HG2 VAL 6 3.348 -9.753 2.662 52 HG22 VAL 6 1HG2 VAL 6 4.041 -10.200 4.220 53 HG23 VAL 6 2HG2 VAL 6 4.821 -10.720 2.726 54 H TRP 7 H TRP 7 3.115 -14.774 1.087 55 HA TRP 7 HA TRP 7 0.249 -15.346 1.350 56 HB2 TRP 7 2HB TRP 7 2.472 -16.756 -0.130 57 HB3 TRP 7 3HB TRP 7 0.867 -17.453 0.072 58 HD1 TRP 7 HD1 TRP 7 0.108 -13.982 -0.335 59 HE1 TRP 7 HE1 TRP 7 -0.402 -13.371 -2.783 60 HE3 TRP 7 HE3 TRP 7 2.020 -18.134 -2.622 61 HZ2 TRP 7 HZ2 TRP 7 -0.041 -14.500 -5.344 62 HZ3 TRP 7 HZ3 TRP 7 1.898 -18.292 -5.075 63 HH2 TRP 7 HH2 TRP 7 0.888 -16.512 -6.406 64 H VAL 8 H VAL 8 -0.496 -17.152 2.501 65 HA VAL 8 HA VAL 8 1.456 -18.426 4.298 66 HB VAL 8 HB VAL 8 -1.266 -17.398 5.114 67 HG11 VAL 8 1HG1 VAL 8 -0.641 -18.139 7.365 68 HG12 VAL 8 2HG1 VAL 8 -0.712 -19.490 6.232 69 HG13 VAL 8 3HG1 VAL 8 0.848 -18.828 6.721 70 HG21 VAL 8 3HG2 VAL 8 1.063 -15.969 4.869 71 HG22 VAL 8 1HG2 VAL 8 -0.290 -15.553 5.921 72 HG23 VAL 8 2HG2 VAL 8 1.084 -16.452 6.565 73 H VAL 9 H VAL 9 1.038 -20.551 4.866 74 HA VAL 9 HA VAL 9 -1.369 -21.825 3.800 75 HB VAL 9 HB VAL 9 0.381 -22.031 2.049 76 HG11 VAL 9 1HG1 VAL 9 2.327 -23.423 2.427 77 HG12 VAL 9 2HG1 VAL 9 2.324 -22.074 3.565 78 HG13 VAL 9 3HG1 VAL 9 1.846 -23.684 4.103 79 HG21 VAL 9 3HG2 VAL 9 0.342 -24.755 2.383 80 HG22 VAL 9 1HG2 VAL 9 -1.035 -24.225 3.349 81 HG23 VAL 9 2HG2 VAL 9 -0.937 -23.793 1.642 82 H ASP 10 H ASP 10 -2.156 -23.367 5.106 83 HA ASP 10 HA ASP 10 -0.482 -24.879 6.888 84 HB2 ASP 10 2HB ASP 10 -1.518 -24.131 8.969 85 HB3 ASP 10 3HB ASP 10 -0.727 -22.782 8.159 86 H ASP 11 H ASP 11 -2.329 -25.829 8.657 87 HA ASP 11 HA ASP 11 -4.371 -27.019 6.896 88 HB2 ASP 11 2HB ASP 11 -2.329 -28.285 8.382 89 HB3 ASP 11 3HB ASP 11 -3.843 -28.645 9.208 90 H ASP 12 H ASP 12 -3.853 -25.069 9.561 91 HA ASP 12 HA ASP 12 -6.509 -25.677 10.678 92 HB2 ASP 12 2HB ASP 12 -3.948 -24.894 11.893 93 HB3 ASP 12 3HB ASP 12 -5.341 -24.005 12.504 94 H SER 13 H SER 13 -7.980 -24.016 11.036 95 HA SER 13 HA SER 13 -7.793 -21.817 9.206 96 HB2 SER 13 2HB SER 13 -9.880 -23.216 10.315 97 HB3 SER 13 3HB SER 13 -9.941 -21.696 11.207 98 HG SER 13 HG SER 13 -10.966 -22.071 8.904 99 H SER 14 H SER 14 -8.065 -22.055 12.751 100 HA SER 14 HA SER 14 -7.814 -19.318 13.286 101 HB2 SER 14 2HB SER 14 -6.980 -20.168 15.574 102 HB3 SER 14 3HB SER 14 -8.600 -20.644 15.066 103 HG SER 14 HG SER 14 -7.345 -22.402 15.885 104 H ILE 15 H ILE 15 -5.483 -21.641 12.319 105 HA ILE 15 HA ILE 15 -3.184 -20.284 13.370 106 HB ILE 15 HB ILE 15 -3.485 -22.477 11.324 107 HG12 ILE 15 2HG1 ILE 15 -3.938 -23.136 13.627 108 HG13 ILE 15 3HG1 ILE 15 -2.417 -23.840 13.090 109 HG21 ILE 15 1HG2 ILE 15 -0.984 -21.131 12.322 110 HG22 ILE 15 2HG2 ILE 15 -0.994 -22.708 11.533 111 HG23 ILE 15 3HG2 ILE 15 -1.542 -21.279 10.656 112 HD11 ILE 15 3HD1 ILE 15 -1.438 -22.984 14.872 113 HD12 ILE 15 1HD1 ILE 15 -1.791 -21.366 14.269 114 HD13 ILE 15 2HD1 ILE 15 -2.934 -22.176 15.341 115 H ARG 16 H ARG 16 -4.837 -20.422 10.250 116 HA ARG 16 HA ARG 16 -2.910 -18.712 8.962 117 HB2 ARG 16 2HB ARG 16 -4.405 -18.818 7.035 118 HB3 ARG 16 3HB ARG 16 -4.121 -20.426 7.690 119 HG2 ARG 16 2HG ARG 16 -6.274 -20.524 8.649 120 HG3 ARG 16 3HG ARG 16 -6.546 -18.800 8.389 121 HD2 ARG 16 2HD ARG 16 -5.929 -19.995 5.885 122 HD3 ARG 16 3HD ARG 16 -7.168 -20.972 6.671 123 HE ARG 16 HE ARG 16 -7.690 -18.138 6.702 124 HH11 ARG 16 1HH1 ARG 16 -8.076 -21.127 4.958 125 HH12 ARG 16 2HH1 ARG 16 -9.460 -20.581 4.069 126 HH21 ARG 16 1HH2 ARG 16 -9.511 -17.408 5.537 127 HH22 ARG 16 2HH2 ARG 16 -10.274 -18.465 4.399 128 H TRP 17 H TRP 17 -5.826 -18.315 10.762 129 HA TRP 17 HA TRP 17 -6.678 -15.823 9.775 130 HB2 TRP 17 2HB TRP 17 -8.235 -16.954 11.115 131 HB3 TRP 17 3HB TRP 17 -7.058 -17.257 12.389 132 HD1 TRP 17 HD1 TRP 17 -9.111 -14.335 10.908 133 HE1 TRP 17 HE1 TRP 17 -9.476 -12.593 12.768 134 HE3 TRP 17 HE3 TRP 17 -6.268 -16.465 14.585 135 HZ2 TRP 17 HZ2 TRP 17 -8.665 -12.177 15.439 136 HZ3 TRP 17 HZ3 TRP 17 -6.114 -15.330 16.763 137 HH2 TRP 17 HH2 TRP 17 -7.288 -13.231 17.179 138 H VAL 18 H VAL 18 -4.710 -16.580 12.652 139 HA VAL 18 HA VAL 18 -4.176 -14.018 13.512 140 HB VAL 18 HB VAL 18 -2.202 -14.871 14.605 141 HG11 VAL 18 1HG1 VAL 18 -3.151 -16.829 15.757 142 HG12 VAL 18 2HG1 VAL 18 -4.328 -15.528 15.566 143 HG13 VAL 18 3HG1 VAL 18 -4.394 -16.940 14.512 144 HG21 VAL 18 3HG2 VAL 18 -2.294 -16.846 12.417 145 HG22 VAL 18 1HG2 VAL 18 -0.912 -16.143 13.257 146 HG23 VAL 18 2HG2 VAL 18 -1.813 -17.466 13.996 147 H LEU 19 H LEU 19 -2.715 -15.797 10.865 148 HA LEU 19 HA LEU 19 -0.689 -13.781 10.409 149 HB2 LEU 19 2HB LEU 19 -1.427 -16.389 9.171 150 HB3 LEU 19 3HB LEU 19 -0.456 -15.251 8.238 151 HG LEU 19 HG LEU 19 0.354 -16.185 10.980 152 HD11 LEU 19 1HD1 LEU 19 0.009 -18.053 9.249 153 HD12 LEU 19 2HD1 LEU 19 1.557 -17.966 10.089 154 HD13 LEU 19 3HD1 LEU 19 1.415 -17.363 8.438 155 HD21 LEU 19 3HD2 LEU 19 2.253 -15.396 8.845 156 HD22 LEU 19 1HD2 LEU 19 2.337 -15.147 10.589 157 HD23 LEU 19 2HD2 LEU 19 1.300 -14.118 9.601 158 H GLU 20 H GLU 20 -3.860 -14.591 9.237 159 HA GLU 20 HA GLU 20 -3.776 -13.137 6.810 160 HB2 GLU 20 2HB GLU 20 -5.597 -14.801 8.059 161 HB3 GLU 20 3HB GLU 20 -6.397 -13.236 8.096 162 HG2 GLU 20 2HG GLU 20 -5.198 -13.872 5.515 163 HG3 GLU 20 3HG GLU 20 -6.450 -15.006 6.018 164 H ARG 21 H ARG 21 -4.753 -12.282 10.099 165 HA ARG 21 HA ARG 21 -5.735 -9.706 9.500 166 HB2 ARG 21 2HB ARG 21 -4.599 -10.837 12.062 167 HB3 ARG 21 3HB ARG 21 -5.399 -9.275 11.941 168 HG2 ARG 21 2HG ARG 21 -7.438 -10.437 11.145 169 HG3 ARG 21 3HG ARG 21 -6.623 -11.976 11.429 170 HD2 ARG 21 2HD ARG 21 -8.164 -11.147 13.267 171 HD3 ARG 21 3HD ARG 21 -6.537 -11.621 13.753 172 HE ARG 21 HE ARG 21 -7.623 -8.914 13.683 173 HH11 ARG 21 1HH1 ARG 21 -4.907 -11.024 14.224 174 HH12 ARG 21 2HH1 ARG 21 -3.995 -9.841 15.101 175 HH21 ARG 21 1HH2 ARG 21 -6.432 -7.347 14.836 176 HH22 ARG 21 2HH2 ARG 21 -4.864 -7.750 15.450 177 H ALA 22 H ALA 22 -2.529 -10.898 10.361 178 HA ALA 22 HA ALA 22 -1.175 -8.568 10.879 179 HB1 ALA 22 1HB ALA 22 0.702 -9.911 9.471 180 HB2 ALA 22 2HB ALA 22 0.266 -10.276 11.141 181 HB3 ALA 22 3HB ALA 22 -0.437 -11.211 9.822 182 H LEU 23 H LEU 23 -1.752 -10.023 7.682 183 HA LEU 23 HA LEU 23 -0.621 -7.722 6.340 184 HB2 LEU 23 2HB LEU 23 -2.150 -9.888 4.961 185 HB3 LEU 23 3HB LEU 23 -0.793 -8.932 4.369 186 HG LEU 23 HG LEU 23 -0.537 -11.033 6.514 187 HD11 LEU 23 1HD1 LEU 23 -1.335 -11.998 4.378 188 HD12 LEU 23 2HD1 LEU 23 0.283 -12.534 4.826 189 HD13 LEU 23 3HD1 LEU 23 0.076 -11.307 3.576 190 HD21 LEU 23 3HD2 LEU 23 1.166 -9.116 6.201 191 HD22 LEU 23 1HD2 LEU 23 1.628 -9.979 4.734 192 HD23 LEU 23 2HD2 LEU 23 1.760 -10.775 6.302 193 H ALA 24 H ALA 24 -3.800 -9.120 6.929 194 HA ALA 24 HA ALA 24 -5.392 -7.665 5.231 195 HB1 ALA 24 1HB ALA 24 -6.193 -9.447 6.735 196 HB2 ALA 24 2HB ALA 24 -6.055 -8.333 8.096 197 HB3 ALA 24 3HB ALA 24 -7.201 -8.001 6.797 198 H GLY 25 H GLY 25 -4.110 -6.663 8.384 199 HA2 GLY 25 2HA GLY 25 -5.365 -4.053 8.164 200 HA3 GLY 25 3HA GLY 25 -4.364 -4.622 9.491 201 H ALA 26 H ALA 26 -2.426 -5.482 7.205 202 HA ALA 26 HA ALA 26 -0.981 -2.944 7.207 203 HB1 ALA 26 1HB ALA 26 0.232 -4.908 7.963 204 HB2 ALA 26 2HB ALA 26 -0.076 -5.713 6.423 205 HB3 ALA 26 3HB ALA 26 0.946 -4.277 6.479 206 H GLY 27 H GLY 27 0.463 -2.731 5.098 207 HA2 GLY 27 2HA GLY 27 -1.457 -2.500 2.912 208 HA3 GLY 27 3HA GLY 27 0.125 -1.738 2.994 209 H LEU 28 H LEU 28 -0.660 -5.156 3.461 210 HA LEU 28 HA LEU 28 0.706 -5.778 0.938 211 HB2 LEU 28 2HB LEU 28 1.268 -7.763 2.945 212 HB3 LEU 28 3HB LEU 28 2.377 -6.866 1.910 213 HG LEU 28 HG LEU 28 1.263 -5.727 4.463 214 HD11 LEU 28 1HD1 LEU 28 2.718 -7.957 4.523 215 HD12 LEU 28 2HD1 LEU 28 2.894 -6.674 5.720 216 HD13 LEU 28 3HD1 LEU 28 4.026 -6.784 4.373 217 HD21 LEU 28 3HD2 LEU 28 3.025 -4.805 2.352 218 HD22 LEU 28 1HD2 LEU 28 3.784 -4.714 3.942 219 HD23 LEU 28 2HD2 LEU 28 2.246 -3.901 3.652 220 H THR 29 H THR 29 -0.156 -7.436 -0.205 221 HA THR 29 HA THR 29 -2.767 -8.238 0.168 222 HB THR 29 HB THR 29 -0.724 -9.978 -1.210 223 HG1 THR 29 HG1 THR 29 -1.814 -7.482 -1.960 224 HG21 THR 29 3HG2 THR 29 -2.768 -11.077 -1.286 225 HG22 THR 29 1HG2 THR 29 -2.778 -10.165 -2.794 226 HG23 THR 29 2HG2 THR 29 -3.687 -9.577 -1.401 227 H CYS 30 H CYS 30 -3.656 -10.371 0.646 228 HA CYS 30 HA CYS 30 -2.038 -11.984 2.483 229 HB2 CYS 30 2HB CYS 30 -4.709 -11.907 3.484 230 HB3 CYS 30 3HB CYS 30 -3.226 -11.397 4.281 231 HG CYS 30 HG CYS 30 -3.374 -8.797 3.025 232 H THR 31 H THR 31 -1.993 -13.938 1.603 233 HA THR 31 HA THR 31 -4.506 -15.054 0.543 234 HB THR 31 HB THR 31 -1.794 -15.765 -0.564 235 HG1 THR 31 HG1 THR 31 -2.680 -13.434 -0.811 236 HG21 THR 31 3HG2 THR 31 -3.799 -17.283 -0.877 237 HG22 THR 31 1HG2 THR 31 -3.002 -16.746 -2.355 238 HG23 THR 31 2HG2 THR 31 -4.512 -15.992 -1.844 239 H THR 32 H THR 32 -5.146 -16.588 1.904 240 HA THR 32 HA THR 32 -3.121 -18.261 3.223 241 HB THR 32 HB THR 32 -4.693 -18.751 4.924 242 HG1 THR 32 HG1 THR 32 -6.694 -17.435 3.377 243 HG21 THR 32 3HG2 THR 32 -3.815 -16.244 4.551 244 HG22 THR 32 1HG2 THR 32 -4.821 -16.713 5.921 245 HG23 THR 32 2HG2 THR 32 -5.553 -15.949 4.510 246 H PHE 33 H PHE 33 -2.913 -20.342 2.704 247 HA PHE 33 HA PHE 33 -4.983 -21.552 0.993 248 HB2 PHE 33 2HB PHE 33 -2.018 -22.129 1.136 249 HB3 PHE 33 3HB PHE 33 -3.165 -23.033 0.154 250 HD1 PHE 33 HD2 PHE 33 -1.467 -19.807 0.586 251 HD2 PHE 33 HD1 PHE 33 -4.011 -22.149 -1.895 252 HE1 PHE 33 HE2 PHE 33 -1.159 -18.194 -1.246 253 HE2 PHE 33 HE1 PHE 33 -3.707 -20.540 -3.731 254 HZ PHE 33 HZ PHE 33 -2.281 -18.559 -3.408 255 H GLU 34 H GLU 34 -4.406 -24.160 1.101 256 HA GLU 34 HA GLU 34 -4.529 -24.863 3.959 257 HB2 GLU 34 2HB GLU 34 -6.200 -26.579 3.415 258 HB3 GLU 34 3HB GLU 34 -6.773 -24.967 3.011 259 HG2 GLU 34 2HG GLU 34 -5.911 -25.497 0.642 260 HG3 GLU 34 3HG GLU 34 -5.921 -27.174 1.186 261 H ASN 35 H ASN 35 -3.764 -25.929 0.681 262 HA ASN 35 HA ASN 35 -1.984 -27.971 1.842 263 HB2 ASN 35 2HB ASN 35 -4.020 -28.185 -0.215 264 HB3 ASN 35 3HB ASN 35 -2.447 -28.704 -0.813 265 HD21 ASN 35 1HD2 ASN 35 -4.850 -30.259 -0.274 266 HD22 ASN 35 2HD2 ASN 35 -4.389 -31.471 0.868 267 H GLY 36 H GLY 36 0.113 -27.672 1.478 268 HA2 GLY 36 2HA GLY 36 1.206 -25.488 0.184 269 HA3 GLY 36 3HA GLY 36 2.076 -26.980 0.506 270 H ASN 37 H ASN 37 0.406 -28.646 -1.151 271 HA ASN 37 HA ASN 37 1.775 -28.474 -3.571 272 HB2 ASN 37 2HB ASN 37 0.505 -30.468 -2.596 273 HB3 ASN 37 3HB ASN 37 -0.946 -29.742 -3.282 274 HD21 ASN 37 1HD2 ASN 37 -1.452 -31.034 -4.919 275 HD22 ASN 37 2HD2 ASN 37 -0.394 -31.466 -6.215 276 H GLU 38 H GLU 38 -1.077 -26.847 -2.488 277 HA GLU 38 HA GLU 38 -1.837 -26.024 -5.173 278 HB2 GLU 38 2HB GLU 38 -3.089 -24.899 -2.701 279 HB3 GLU 38 3HB GLU 38 -3.819 -25.245 -4.263 280 HG2 GLU 38 2HG GLU 38 -3.134 -27.734 -3.481 281 HG3 GLU 38 3HG GLU 38 -3.449 -26.976 -1.921 282 H VAL 39 H VAL 39 0.204 -24.970 -2.693 283 HA VAL 39 HA VAL 39 0.007 -22.146 -3.337 284 HB VAL 39 HB VAL 39 2.114 -23.401 -1.594 285 HG11 VAL 39 1HG1 VAL 39 0.884 -20.805 -0.947 286 HG12 VAL 39 2HG1 VAL 39 2.575 -21.307 -0.897 287 HG13 VAL 39 3HG1 VAL 39 1.835 -20.850 -2.432 288 HG21 VAL 39 3HG2 VAL 39 -0.013 -24.251 -0.803 289 HG22 VAL 39 1HG2 VAL 39 0.604 -23.038 0.319 290 HG23 VAL 39 2HG2 VAL 39 -0.692 -22.624 -0.803 291 H LEU 40 H LEU 40 2.295 -24.811 -3.761 292 HA LEU 40 HA LEU 40 4.465 -23.474 -4.802 293 HB2 LEU 40 2HB LEU 40 4.910 -25.687 -4.532 294 HB3 LEU 40 3HB LEU 40 3.330 -26.188 -5.133 295 HG LEU 40 HG LEU 40 4.064 -25.841 -7.423 296 HD11 LEU 40 1HD1 LEU 40 6.193 -24.384 -6.121 297 HD12 LEU 40 2HD1 LEU 40 5.670 -24.354 -7.804 298 HD13 LEU 40 3HD1 LEU 40 6.822 -25.573 -7.262 299 HD21 LEU 40 3HD2 LEU 40 4.936 -27.839 -5.691 300 HD22 LEU 40 1HD2 LEU 40 6.364 -27.392 -6.625 301 HD23 LEU 40 2HD2 LEU 40 4.894 -27.904 -7.454 302 H ALA 41 H ALA 41 1.545 -24.550 -6.493 303 HA ALA 41 HA ALA 41 2.421 -23.636 -9.057 304 HB1 ALA 41 1HB ALA 41 0.813 -25.093 -9.565 305 HB2 ALA 41 2HB ALA 41 0.096 -24.985 -7.957 306 HB3 ALA 41 3HB ALA 41 -0.330 -23.802 -9.194 307 H ALA 42 H ALA 42 0.779 -22.200 -6.358 308 HA ALA 42 HA ALA 42 -0.503 -20.059 -7.632 309 HB1 ALA 42 1HB ALA 42 0.708 -19.985 -4.876 310 HB2 ALA 42 2HB ALA 42 -0.652 -19.040 -5.484 311 HB3 ALA 42 3HB ALA 42 -0.820 -20.780 -5.255 312 H LEU 43 H LEU 43 2.814 -20.452 -6.509 313 HA LEU 43 HA LEU 43 3.683 -17.812 -6.736 314 HB2 LEU 43 2HB LEU 43 5.448 -20.106 -7.487 315 HB3 LEU 43 3HB LEU 43 5.851 -18.632 -6.609 316 HG LEU 43 HG LEU 43 4.446 -21.085 -5.580 317 HD11 LEU 43 1HD1 LEU 43 6.318 -20.639 -3.805 318 HD12 LEU 43 2HD1 LEU 43 7.066 -19.740 -5.125 319 HD13 LEU 43 3HD1 LEU 43 6.696 -21.453 -5.324 320 HD21 LEU 43 3HD2 LEU 43 4.737 -19.360 -3.447 321 HD22 LEU 43 1HD2 LEU 43 3.228 -19.753 -4.272 322 HD23 LEU 43 2HD2 LEU 43 4.142 -18.319 -4.741 323 H ALA 44 H ALA 44 3.340 -20.332 -9.168 324 HA ALA 44 HA ALA 44 4.694 -19.008 -11.262 325 HB1 ALA 44 1HB ALA 44 2.440 -20.986 -11.548 326 HB2 ALA 44 2HB ALA 44 3.702 -20.618 -12.725 327 HB3 ALA 44 3HB ALA 44 4.113 -21.433 -11.216 328 H SER 45 H SER 45 1.785 -18.291 -9.727 329 HA SER 45 HA SER 45 0.380 -17.206 -11.982 330 HB2 SER 45 2HB SER 45 -0.095 -16.677 -9.040 331 HB3 SER 45 3HB SER 45 -1.231 -16.401 -10.360 332 HG SER 45 HG SER 45 -0.161 -18.966 -9.911 333 H LYS 46 H LYS 46 1.457 -15.530 -9.030 334 HA LYS 46 HA LYS 46 2.341 -13.291 -10.731 335 HB2 LYS 46 2HB LYS 46 1.655 -11.787 -8.843 336 HB3 LYS 46 3HB LYS 46 0.320 -12.586 -9.664 337 HG2 LYS 46 2HG LYS 46 0.519 -14.345 -7.787 338 HG3 LYS 46 3HG LYS 46 1.433 -13.097 -6.937 339 HD2 LYS 46 2HD LYS 46 -1.325 -12.680 -8.082 340 HD3 LYS 46 3HD LYS 46 -1.013 -13.143 -6.408 341 HE2 LYS 46 2HE LYS 46 -0.887 -10.963 -5.959 342 HE3 LYS 46 3HE LYS 46 0.652 -10.972 -6.819 343 HZ1 LYS 46 3HZ LYS 46 -0.856 -9.255 -7.641 344 HZ2 LYS 46 1HZ LYS 46 -1.993 -10.437 -8.059 345 HZ3 LYS 46 2HZ LYS 46 -0.497 -10.388 -8.845 346 H THR 47 H THR 47 3.187 -15.582 -8.432 347 HA THR 47 HA THR 47 5.059 -15.969 -7.196 348 HB THR 47 HB THR 47 6.791 -13.901 -8.243 349 HG1 THR 47 HG1 THR 47 5.967 -13.806 -10.192 350 HG21 THR 47 3HG2 THR 47 8.016 -15.708 -7.661 351 HG22 THR 47 1HG2 THR 47 7.668 -16.231 -9.308 352 HG23 THR 47 2HG2 THR 47 6.692 -16.833 -7.968 353 HA PRO 48 HA PRO 48 4.284 -12.715 -4.161 354 HB2 PRO 48 2HB PRO 48 4.888 -14.272 -2.020 355 HB3 PRO 48 3HB PRO 48 3.321 -14.326 -2.836 356 HG2 PRO 48 2HG PRO 48 5.671 -16.157 -3.126 357 HG3 PRO 48 3HG PRO 48 3.948 -16.558 -3.014 358 HD2 PRO 48 2HD PRO 48 5.280 -16.502 -5.370 359 HD3 PRO 48 3HD PRO 48 3.562 -16.076 -5.234 360 H ASP 49 H ASP 49 5.670 -12.133 -2.112 361 HA ASP 49 HA ASP 49 8.475 -12.041 -2.995 362 HB2 ASP 49 2HB ASP 49 6.857 -9.938 -2.487 363 HB3 ASP 49 3HB ASP 49 7.549 -10.181 -0.885 364 H VAL 50 H VAL 50 6.434 -13.405 -0.705 365 HA VAL 50 HA VAL 50 8.509 -14.721 0.664 366 HB VAL 50 HB VAL 50 8.827 -12.479 1.684 367 HG11 VAL 50 1HG1 VAL 50 7.176 -11.271 2.599 368 HG12 VAL 50 2HG1 VAL 50 6.103 -12.323 1.674 369 HG13 VAL 50 3HG1 VAL 50 6.442 -12.678 3.369 370 HG21 VAL 50 3HG2 VAL 50 9.426 -13.411 3.646 371 HG22 VAL 50 1HG2 VAL 50 7.809 -14.044 3.956 372 HG23 VAL 50 2HG2 VAL 50 8.904 -14.910 2.877 373 H LEU 51 H LEU 51 7.745 -16.359 1.990 374 HA LEU 51 HA LEU 51 4.837 -16.506 2.384 375 HB2 LEU 51 2HB LEU 51 6.209 -17.981 0.495 376 HB3 LEU 51 3HB LEU 51 6.069 -19.088 1.859 377 HG LEU 51 HG LEU 51 3.563 -17.742 1.173 378 HD11 LEU 51 1HD1 LEU 51 4.820 -19.636 -0.808 379 HD12 LEU 51 2HD1 LEU 51 4.481 -17.927 -1.075 380 HD13 LEU 51 3HD1 LEU 51 3.152 -19.063 -0.841 381 HD21 LEU 51 3HD2 LEU 51 2.663 -19.677 1.913 382 HD22 LEU 51 1HD2 LEU 51 4.258 -19.882 2.637 383 HD23 LEU 51 2HD2 LEU 51 3.875 -20.677 1.110 384 H LEU 52 H LEU 52 4.223 -18.208 3.977 385 HA LEU 52 HA LEU 52 6.338 -18.796 5.921 386 HB2 LEU 52 2HB LEU 52 3.666 -17.903 6.903 387 HB3 LEU 52 3HB LEU 52 5.225 -17.883 7.725 388 HG LEU 52 HG LEU 52 5.777 -16.064 5.889 389 HD11 LEU 52 1HD1 LEU 52 3.179 -14.941 6.145 390 HD12 LEU 52 2HD1 LEU 52 3.025 -16.548 5.436 391 HD13 LEU 52 3HD1 LEU 52 4.069 -15.346 4.677 392 HD21 LEU 52 3HD2 LEU 52 4.536 -15.936 8.557 393 HD22 LEU 52 1HD2 LEU 52 4.473 -14.449 7.610 394 HD23 LEU 52 2HD2 LEU 52 6.027 -15.208 7.958 395 H SER 53 H SER 53 6.074 -20.911 4.877 396 HA SER 53 HA SER 53 3.692 -22.391 4.958 397 HB2 SER 53 2HB SER 53 4.959 -24.205 4.263 398 HB3 SER 53 3HB SER 53 5.992 -22.863 3.772 399 HG SER 53 HG SER 53 7.081 -23.161 5.829 400 H ASP 54 H ASP 54 2.718 -23.592 6.490 401 HA ASP 54 HA ASP 54 3.970 -23.632 9.155 402 HB2 ASP 54 2HB ASP 54 1.684 -22.433 8.657 403 HB3 ASP 54 3HB ASP 54 1.036 -24.069 8.745 404 H ILE 55 H ILE 55 5.010 -25.552 9.248 405 HA ILE 55 HA ILE 55 3.957 -27.958 8.120 406 HB ILE 55 HB ILE 55 6.184 -27.654 10.137 407 HG12 ILE 55 2HG1 ILE 55 6.614 -28.048 7.199 408 HG13 ILE 55 3HG1 ILE 55 6.284 -26.431 7.812 409 HG21 ILE 55 1HG2 ILE 55 5.209 -29.919 8.447 410 HG22 ILE 55 2HG2 ILE 55 6.906 -29.823 8.914 411 HG23 ILE 55 3HG2 ILE 55 5.654 -29.906 10.153 412 HD11 ILE 55 3HD1 ILE 55 8.726 -27.231 7.536 413 HD12 ILE 55 1HD1 ILE 55 8.265 -26.329 8.980 414 HD13 ILE 55 2HD1 ILE 55 8.434 -28.084 9.052 415 H ARG 56 H ARG 56 2.207 -28.899 8.947 416 HA ARG 56 HA ARG 56 2.164 -30.094 11.463 417 HB2 ARG 56 2HB ARG 56 0.281 -28.681 12.464 418 HB3 ARG 56 3HB ARG 56 1.909 -28.021 12.541 419 HG2 ARG 56 2HG ARG 56 1.430 -26.310 11.151 420 HG3 ARG 56 3HG ARG 56 0.310 -27.268 10.180 421 HD2 ARG 56 2HD ARG 56 -0.713 -25.396 11.536 422 HD3 ARG 56 3HD ARG 56 -1.435 -26.991 11.746 423 HE ARG 56 HE ARG 56 0.614 -26.323 13.668 424 HH11 ARG 56 1HH1 ARG 56 -2.782 -26.253 12.903 425 HH12 ARG 56 2HH1 ARG 56 -3.285 -26.132 14.557 426 HH21 ARG 56 1HH2 ARG 56 -0.036 -26.163 15.849 427 HH22 ARG 56 2HH2 ARG 56 -1.723 -26.079 16.231 428 H MET 57 H MET 57 1.507 -30.644 8.725 429 HA MET 57 HA MET 57 -1.303 -31.450 9.068 430 HB2 MET 57 2HB MET 57 -1.626 -31.170 6.636 431 HB3 MET 57 3HB MET 57 -1.245 -29.653 7.439 432 HG2 MET 57 2HG MET 57 1.202 -30.239 6.746 433 HG3 MET 57 3HG MET 57 0.404 -31.271 5.562 434 HE1 MET 57 3HE MET 57 2.206 -29.680 4.456 435 HE2 MET 57 1HE MET 57 1.607 -28.383 3.422 436 HE3 MET 57 2HE MET 57 2.215 -28.014 5.036 437 HA PRO 58 HA PRO 58 -0.002 -35.553 8.205 438 HB2 PRO 58 2HB PRO 58 -2.195 -36.549 6.953 439 HB3 PRO 58 3HB PRO 58 -2.151 -36.208 8.687 440 HG2 PRO 58 2HG PRO 58 -3.291 -34.562 6.461 441 HG3 PRO 58 3HG PRO 58 -3.971 -34.903 8.063 442 HD2 PRO 58 2HD PRO 58 -2.721 -32.574 7.476 443 HD3 PRO 58 3HD PRO 58 -2.671 -33.303 9.093 444 H GLY 59 H GLY 59 -0.321 -37.244 6.233 445 HA2 GLY 59 2HA GLY 59 0.383 -37.815 4.124 446 HA3 GLY 59 3HA GLY 59 -0.325 -36.296 3.596 447 H MET 60 H MET 60 0.975 -34.511 3.276 448 HA MET 60 HA MET 60 3.636 -34.980 2.529 449 HB2 MET 60 2HB MET 60 2.404 -32.307 3.212 450 HB3 MET 60 3HB MET 60 3.801 -32.593 2.183 451 HG2 MET 60 2HG MET 60 2.520 -32.872 0.404 452 HG3 MET 60 3HG MET 60 1.541 -34.082 1.230 453 HE1 MET 60 3HE MET 60 1.629 -30.133 0.201 454 HE2 MET 60 1HE MET 60 1.309 -31.507 -0.858 455 HE3 MET 60 2HE MET 60 -0.004 -30.423 -0.400 456 H ASP 61 H ASP 61 5.186 -32.956 3.495 457 HA ASP 61 HA ASP 61 5.381 -33.536 6.377 458 HB2 ASP 61 2HB ASP 61 7.544 -33.460 4.283 459 HB3 ASP 61 3HB ASP 61 7.908 -33.249 5.993 460 H GLY 62 H GLY 62 4.606 -31.206 4.311 461 HA2 GLY 62 2HA GLY 62 4.312 -28.940 4.737 462 HA3 GLY 62 3HA GLY 62 5.305 -29.111 6.177 463 H LEU 63 H LEU 63 7.688 -29.907 5.368 464 HA LEU 63 HA LEU 63 8.679 -27.611 3.926 465 HB2 LEU 63 2HB LEU 63 10.908 -28.888 4.344 466 HB3 LEU 63 3HB LEU 63 10.072 -28.096 5.679 467 HG LEU 63 HG LEU 63 9.229 -30.210 6.470 468 HD11 LEU 63 1HD1 LEU 63 10.290 -31.202 3.867 469 HD12 LEU 63 2HD1 LEU 63 8.759 -31.552 4.670 470 HD13 LEU 63 3HD1 LEU 63 10.250 -32.290 5.254 471 HD21 LEU 63 3HD2 LEU 63 11.509 -31.420 6.737 472 HD22 LEU 63 1HD2 LEU 63 11.294 -29.814 7.434 473 HD23 LEU 63 2HD2 LEU 63 12.160 -30.004 5.909 474 H ALA 64 H ALA 64 7.700 -30.748 3.134 475 HA ALA 64 HA ALA 64 9.391 -31.651 1.188 476 HB1 ALA 64 1HB ALA 64 6.638 -31.856 0.300 477 HB2 ALA 64 2HB ALA 64 7.765 -33.121 0.791 478 HB3 ALA 64 3HB ALA 64 6.821 -32.262 2.007 479 H LEU 65 H LEU 65 6.865 -29.186 0.818 480 HA LEU 65 HA LEU 65 7.570 -28.728 -1.950 481 HB2 LEU 65 2HB LEU 65 5.617 -27.630 -2.116 482 HB3 LEU 65 3HB LEU 65 5.258 -28.466 -0.606 483 HG LEU 65 HG LEU 65 6.318 -25.647 -0.790 484 HD11 LEU 65 1HD1 LEU 65 3.670 -25.807 0.239 485 HD12 LEU 65 2HD1 LEU 65 3.718 -26.618 -1.326 486 HD13 LEU 65 3HD1 LEU 65 4.256 -24.945 -1.184 487 HD21 LEU 65 3HD2 LEU 65 6.456 -27.365 1.315 488 HD22 LEU 65 1HD2 LEU 65 4.909 -26.570 1.609 489 HD23 LEU 65 2HD2 LEU 65 6.379 -25.608 1.452 490 H LEU 66 H LEU 66 8.388 -27.454 1.147 491 HA LEU 66 HA LEU 66 9.254 -24.880 0.305 492 HB2 LEU 66 2HB LEU 66 8.821 -26.050 2.708 493 HB3 LEU 66 3HB LEU 66 10.581 -26.093 2.636 494 HG LEU 66 HG LEU 66 10.000 -24.130 3.816 495 HD11 LEU 66 1HD1 LEU 66 10.618 -23.389 0.960 496 HD12 LEU 66 2HD1 LEU 66 11.789 -23.817 2.207 497 HD13 LEU 66 3HD1 LEU 66 10.835 -22.342 2.363 498 HD21 LEU 66 3HD2 LEU 66 7.931 -23.347 3.564 499 HD22 LEU 66 1HD2 LEU 66 7.764 -24.084 1.970 500 HD23 LEU 66 2HD2 LEU 66 8.526 -22.502 2.134 501 H LYS 67 H LYS 67 10.649 -28.034 0.205 502 HA LYS 67 HA LYS 67 13.381 -27.281 0.073 503 HB2 LYS 67 2HB LYS 67 11.927 -29.747 -0.891 504 HB3 LYS 67 3HB LYS 67 13.675 -29.566 -0.947 505 HG2 LYS 67 2HG LYS 67 12.011 -29.442 1.560 506 HG3 LYS 67 3HG LYS 67 12.896 -30.861 0.996 507 HD2 LYS 67 2HD LYS 67 14.121 -28.190 1.686 508 HD3 LYS 67 3HD LYS 67 14.139 -29.623 2.717 509 HE2 LYS 67 2HE LYS 67 15.104 -30.439 0.206 510 HE3 LYS 67 3HE LYS 67 15.897 -28.906 0.564 511 HZ1 LYS 67 3HZ LYS 67 16.211 -30.064 2.887 512 HZ2 LYS 67 1HZ LYS 67 17.297 -30.328 1.618 513 HZ3 LYS 67 2HZ LYS 67 16.096 -31.470 1.954 514 H GLN 68 H GLN 68 10.803 -27.407 -2.258 515 HA GLN 68 HA GLN 68 12.599 -27.148 -4.521 516 HB2 GLN 68 2HB GLN 68 10.772 -27.525 -5.871 517 HB3 GLN 68 3HB GLN 68 10.279 -28.370 -4.409 518 HG2 GLN 68 2HG GLN 68 9.271 -25.943 -3.884 519 HG3 GLN 68 3HG GLN 68 9.198 -25.923 -5.645 520 HE21 GLN 68 1HE2 GLN 68 7.080 -26.040 -3.582 521 HE22 GLN 68 2HE2 GLN 68 6.132 -27.427 -3.981 522 H ILE 69 H ILE 69 10.808 -25.120 -2.388 523 HA ILE 69 HA ILE 69 10.439 -22.856 -3.998 524 HB ILE 69 HB ILE 69 10.843 -23.104 -1.020 525 HG12 ILE 69 2HG1 ILE 69 8.366 -22.528 -2.660 526 HG13 ILE 69 3HG1 ILE 69 8.794 -24.111 -2.020 527 HG21 ILE 69 1HG2 ILE 69 9.618 -20.725 -1.291 528 HG22 ILE 69 2HG2 ILE 69 11.365 -20.912 -1.142 529 HG23 ILE 69 3HG2 ILE 69 10.632 -20.714 -2.734 530 HD11 ILE 69 3HD1 ILE 69 7.442 -21.929 -0.745 531 HD12 ILE 69 1HD1 ILE 69 7.658 -23.591 -0.198 532 HD13 ILE 69 2HD1 ILE 69 8.886 -22.377 0.163 533 H LYS 70 H LYS 70 13.258 -24.108 -2.393 534 HA LYS 70 HA LYS 70 14.779 -21.671 -2.645 535 HB2 LYS 70 2HB LYS 70 15.650 -24.481 -1.947 536 HB3 LYS 70 3HB LYS 70 16.670 -23.052 -1.847 537 HG2 LYS 70 2HG LYS 70 14.103 -23.340 -0.312 538 HG3 LYS 70 3HG LYS 70 15.671 -23.849 0.317 539 HD2 LYS 70 2HD LYS 70 16.399 -21.715 0.606 540 HD3 LYS 70 3HD LYS 70 15.494 -21.104 -0.780 541 HE2 LYS 70 2HE LYS 70 13.407 -21.544 0.658 542 HE3 LYS 70 3HE LYS 70 14.533 -21.644 2.011 543 HZ1 LYS 70 3HZ LYS 70 15.360 -19.387 1.078 544 HZ2 LYS 70 1HZ LYS 70 13.961 -19.437 2.028 545 HZ3 LYS 70 2HZ LYS 70 13.837 -19.325 0.345 546 H GLN 71 H GLN 71 14.141 -24.467 -4.564 547 HA GLN 71 HA GLN 71 16.425 -24.017 -6.306 548 HB2 GLN 71 2HB GLN 71 15.837 -26.317 -5.852 549 HB3 GLN 71 3HB GLN 71 14.186 -26.043 -6.394 550 HG2 GLN 71 2HG GLN 71 14.732 -26.503 -8.485 551 HG3 GLN 71 3HG GLN 71 16.029 -25.310 -8.462 552 HE21 GLN 71 1HE2 GLN 71 17.289 -26.687 -9.762 553 HE22 GLN 71 2HE2 GLN 71 18.090 -28.065 -9.096 554 H ARG 72 H ARG 72 12.961 -23.511 -6.251 555 HA ARG 72 HA ARG 72 12.949 -22.585 -9.014 556 HB2 ARG 72 2HB ARG 72 10.987 -23.617 -7.170 557 HB3 ARG 72 3HB ARG 72 10.448 -22.079 -7.829 558 HG2 ARG 72 2HG ARG 72 11.327 -23.332 -10.070 559 HG3 ARG 72 3HG ARG 72 10.726 -24.692 -9.119 560 HD2 ARG 72 2HD ARG 72 8.608 -23.379 -8.781 561 HD3 ARG 72 3HD ARG 72 9.221 -22.225 -9.964 562 HE ARG 72 HE ARG 72 8.143 -24.841 -10.487 563 HH11 ARG 72 1HH1 ARG 72 10.187 -22.285 -11.673 564 HH12 ARG 72 2HH1 ARG 72 10.020 -22.746 -13.335 565 HH21 ARG 72 1HH2 ARG 72 7.916 -25.458 -12.671 566 HH22 ARG 72 2HH2 ARG 72 8.727 -24.550 -13.901 567 H HIS 73 H HIS 73 12.552 -21.333 -5.740 568 HA HIS 73 HA HIS 73 12.877 -18.617 -6.821 569 HB2 HIS 73 2HB HIS 73 11.141 -19.194 -4.429 570 HB3 HIS 73 3HB HIS 73 11.219 -17.723 -5.394 571 HD1 HIS 73 HD1 HIS 73 9.957 -17.730 -7.667 572 HD2 HIS 73 HD2 HIS 73 9.469 -21.189 -5.418 573 HE1 HIS 73 HE1 HIS 73 8.031 -18.953 -8.725 574 HA PRO 74 HA PRO 74 16.095 -19.535 -3.619 575 HB2 PRO 74 2HB PRO 74 18.130 -18.407 -5.018 576 HB3 PRO 74 3HB PRO 74 17.626 -20.087 -5.240 577 HG2 PRO 74 2HG PRO 74 16.955 -17.675 -6.881 578 HG3 PRO 74 3HG PRO 74 17.402 -19.305 -7.419 579 HD2 PRO 74 2HD PRO 74 14.836 -18.442 -7.363 580 HD3 PRO 74 3HD PRO 74 15.280 -20.136 -7.075 581 H MET 75 H MET 75 15.714 -16.606 -5.608 582 HA MET 75 HA MET 75 16.793 -14.877 -3.599 583 HB2 MET 75 2HB MET 75 16.727 -14.501 -6.144 584 HB3 MET 75 3HB MET 75 15.063 -13.991 -5.896 585 HG2 MET 75 2HG MET 75 16.215 -12.459 -4.061 586 HG3 MET 75 3HG MET 75 17.593 -12.657 -5.141 587 HE1 MET 75 3HE MET 75 14.181 -11.177 -4.477 588 HE2 MET 75 1HE MET 75 13.674 -10.442 -5.998 589 HE3 MET 75 2HE MET 75 13.623 -12.194 -5.806 590 H LEU 76 H LEU 76 13.899 -16.480 -3.835 591 HA LEU 76 HA LEU 76 12.281 -14.385 -2.620 592 HB2 LEU 76 2HB LEU 76 11.255 -15.780 -4.319 593 HB3 LEU 76 3HB LEU 76 11.630 -17.228 -3.386 594 HG LEU 76 HG LEU 76 10.118 -16.232 -1.576 595 HD11 LEU 76 1HD1 LEU 76 9.925 -13.983 -2.321 596 HD12 LEU 76 2HD1 LEU 76 8.344 -14.737 -2.524 597 HD13 LEU 76 3HD1 LEU 76 9.390 -14.493 -3.922 598 HD21 LEU 76 3HD2 LEU 76 8.747 -16.960 -4.153 599 HD22 LEU 76 1HD2 LEU 76 8.208 -17.270 -2.503 600 HD23 LEU 76 2HD2 LEU 76 9.600 -18.137 -3.153 601 HA PRO 77 HA PRO 77 13.548 -15.834 1.415 602 HB2 PRO 77 2HB PRO 77 12.148 -13.967 2.803 603 HB3 PRO 77 3HB PRO 77 13.686 -13.618 2.006 604 HG2 PRO 77 2HG PRO 77 10.899 -13.058 1.070 605 HG3 PRO 77 3HG PRO 77 12.334 -12.020 0.994 606 HD2 PRO 77 2HD PRO 77 11.437 -13.423 -1.141 607 HD3 PRO 77 3HD PRO 77 13.160 -13.083 -0.877 608 H VAL 78 H VAL 78 12.638 -17.166 2.911 609 HA VAL 78 HA VAL 78 9.715 -17.398 3.002 610 HB VAL 78 HB VAL 78 11.450 -19.855 2.902 611 HG11 VAL 78 1HG1 VAL 78 9.019 -20.570 1.981 612 HG12 VAL 78 2HG1 VAL 78 9.485 -20.644 3.682 613 HG13 VAL 78 3HG1 VAL 78 8.569 -19.264 3.076 614 HG21 VAL 78 3HG2 VAL 78 11.862 -19.241 0.761 615 HG22 VAL 78 1HG2 VAL 78 10.251 -19.911 0.507 616 HG23 VAL 78 2HG2 VAL 78 10.464 -18.169 0.683 617 H ILE 79 H ILE 79 8.947 -18.615 4.890 618 HA ILE 79 HA ILE 79 10.877 -18.747 7.096 619 HB ILE 79 HB ILE 79 8.142 -17.543 7.469 620 HG12 ILE 79 2HG1 ILE 79 10.753 -16.043 7.181 621 HG13 ILE 79 3HG1 ILE 79 9.539 -16.166 5.912 622 HG21 ILE 79 1HG2 ILE 79 10.606 -17.354 9.190 623 HG22 ILE 79 2HG2 ILE 79 8.968 -16.845 9.596 624 HG23 ILE 79 3HG2 ILE 79 9.338 -18.559 9.414 625 HD11 ILE 79 3HD1 ILE 79 9.651 -14.418 8.215 626 HD12 ILE 79 1HD1 ILE 79 8.692 -14.292 6.740 627 HD13 ILE 79 2HD1 ILE 79 8.111 -15.267 8.091 628 H ILE 80 H ILE 80 10.725 -20.581 8.207 629 HA ILE 80 HA ILE 80 8.530 -22.398 7.644 630 HB ILE 80 HB ILE 80 11.154 -22.706 9.075 631 HG12 ILE 80 2HG1 ILE 80 10.841 -22.847 6.518 632 HG13 ILE 80 3HG1 ILE 80 11.725 -24.146 7.311 633 HG21 ILE 80 1HG2 ILE 80 8.723 -24.400 9.275 634 HG22 ILE 80 2HG2 ILE 80 10.288 -25.203 9.167 635 HG23 ILE 80 3HG2 ILE 80 9.970 -24.064 10.475 636 HD11 ILE 80 3HD1 ILE 80 8.814 -24.266 6.565 637 HD12 ILE 80 1HD1 ILE 80 10.132 -24.934 5.604 638 HD13 ILE 80 2HD1 ILE 80 9.799 -25.577 7.212 639 H MET 81 H MET 81 6.953 -22.980 9.032 640 HA MET 81 HA MET 81 7.038 -21.822 11.741 641 HB2 MET 81 2HB MET 81 4.950 -21.753 9.659 642 HB3 MET 81 3HB MET 81 4.375 -22.136 11.277 643 HG2 MET 81 2HG MET 81 4.804 -20.067 12.073 644 HG3 MET 81 3HG MET 81 6.215 -19.842 11.042 645 HE1 MET 81 3HE MET 81 2.075 -19.746 9.055 646 HE2 MET 81 1HE MET 81 3.076 -21.175 9.308 647 HE3 MET 81 2HE MET 81 2.296 -20.392 10.681 648 H THR 82 H THR 82 7.029 -23.271 13.319 649 HA THR 82 HA THR 82 5.309 -25.463 13.513 650 HB THR 82 HB THR 82 6.422 -26.669 11.851 651 HG1 THR 82 HG1 THR 82 7.873 -27.442 14.172 652 HG21 THR 82 3HG2 THR 82 8.708 -26.647 11.379 653 HG22 THR 82 1HG2 THR 82 9.135 -26.098 12.999 654 HG23 THR 82 2HG2 THR 82 8.380 -24.983 11.860 655 H ALA 83 H ALA 83 8.727 -24.739 14.245 656 HA ALA 83 HA ALA 83 9.763 -24.346 16.251 657 HB1 ALA 83 1HB ALA 83 8.575 -23.603 18.039 658 HB2 ALA 83 2HB ALA 83 7.322 -23.453 16.807 659 HB3 ALA 83 3HB ALA 83 7.340 -24.852 17.880 660 H HIS 84 H HIS 84 7.193 -26.689 17.053 661 HA HIS 84 HA HIS 84 9.174 -28.451 18.239 662 HB2 HIS 84 2HB HIS 84 7.348 -29.661 19.160 663 HB3 HIS 84 3HB HIS 84 6.912 -27.959 19.282 664 HD1 HIS 84 HD1 HIS 84 5.087 -30.711 18.945 665 HD2 HIS 84 HD2 HIS 84 5.645 -27.577 16.275 666 HE1 HIS 84 HE1 HIS 84 3.086 -30.760 17.423 667 H SER 85 H SER 85 9.623 -30.540 17.563 668 HA SER 85 HA SER 85 10.194 -32.051 15.940 669 HB2 SER 85 2HB SER 85 7.233 -31.892 16.032 670 HB3 SER 85 3HB SER 85 7.926 -32.752 14.657 671 HG SER 85 HG SER 85 7.634 -33.605 17.159 672 H ASP 86 H ASP 86 11.358 -30.287 14.805 673 HA ASP 86 HA ASP 86 11.156 -30.417 12.092 674 HB2 ASP 86 2HB ASP 86 9.135 -28.639 13.188 675 HB3 ASP 86 3HB ASP 86 10.201 -27.798 12.066 676 H LEU 87 H LEU 87 11.427 -27.675 14.362 677 HA LEU 87 HA LEU 87 13.423 -26.247 13.200 678 HB2 LEU 87 2HB LEU 87 12.572 -26.708 15.982 679 HB3 LEU 87 3HB LEU 87 14.193 -26.046 15.782 680 HG LEU 87 HG LEU 87 13.350 -24.096 14.708 681 HD11 LEU 87 1HD1 LEU 87 10.745 -23.933 14.561 682 HD12 LEU 87 2HD1 LEU 87 10.843 -25.692 14.487 683 HD13 LEU 87 3HD1 LEU 87 11.667 -24.712 13.274 684 HD21 LEU 87 3HD2 LEU 87 13.199 -24.145 17.159 685 HD22 LEU 87 1HD2 LEU 87 11.551 -24.759 17.036 686 HD23 LEU 87 2HD2 LEU 87 11.937 -23.146 16.438 687 H ASP 88 H ASP 88 13.832 -29.107 15.252 688 HA ASP 88 HA ASP 88 16.533 -29.222 15.569 689 HB2 ASP 88 2HB ASP 88 14.415 -31.276 15.257 690 HB3 ASP 88 3HB ASP 88 16.079 -31.829 15.082 691 H ALA 89 H ALA 89 14.727 -30.299 12.706 692 HA ALA 89 HA ALA 89 17.194 -30.845 11.273 693 HB1 ALA 89 1HB ALA 89 14.988 -31.009 9.525 694 HB2 ALA 89 2HB ALA 89 15.906 -32.330 10.248 695 HB3 ALA 89 3HB ALA 89 14.478 -31.698 11.067 696 H ALA 90 H ALA 90 14.411 -28.650 10.985 697 HA ALA 90 HA ALA 90 15.060 -27.276 8.707 698 HB1 ALA 90 1HB ALA 90 13.000 -26.849 9.860 699 HB2 ALA 90 2HB ALA 90 13.863 -26.195 11.253 700 HB3 ALA 90 3HB ALA 90 13.887 -25.331 9.715 701 H VAL 91 H VAL 91 16.500 -26.972 11.892 702 HA VAL 91 HA VAL 91 17.845 -24.583 11.708 703 HB VAL 91 HB VAL 91 18.642 -27.178 13.002 704 HG11 VAL 91 1HG1 VAL 91 20.337 -25.672 14.234 705 HG12 VAL 91 2HG1 VAL 91 20.753 -26.275 12.629 706 HG13 VAL 91 3HG1 VAL 91 20.186 -24.617 12.829 707 HG21 VAL 91 3HG2 VAL 91 17.671 -26.365 14.870 708 HG22 VAL 91 1HG2 VAL 91 18.198 -24.712 14.552 709 HG23 VAL 91 2HG2 VAL 91 16.782 -25.362 13.724 710 H SER 92 H SER 92 19.101 -27.767 10.705 711 HA SER 92 HA SER 92 21.316 -26.498 9.322 712 HB2 SER 92 2HB SER 92 21.923 -28.489 10.463 713 HB3 SER 92 3HB SER 92 20.545 -29.375 9.811 714 HG SER 92 HG SER 92 23.013 -28.947 8.728 715 H ALA 93 H ALA 93 18.481 -28.472 8.516 716 HA ALA 93 HA ALA 93 18.899 -28.642 5.755 717 HB1 ALA 93 1HB ALA 93 17.277 -30.087 6.523 718 HB2 ALA 93 2HB ALA 93 16.489 -28.852 7.505 719 HB3 ALA 93 3HB ALA 93 16.301 -28.836 5.752 720 H TYR 94 H TYR 94 16.588 -26.485 7.417 721 HA TYR 94 HA TYR 94 15.969 -24.897 5.229 722 HB2 TYR 94 2HB TYR 94 14.989 -24.984 7.671 723 HB3 TYR 94 3HB TYR 94 16.119 -23.665 7.952 724 HD1 TYR 94 HD1 TYR 94 14.048 -24.447 4.951 725 HD2 TYR 94 HD2 TYR 94 14.818 -21.749 8.149 726 HE1 TYR 94 HE1 TYR 94 12.426 -22.863 3.997 727 HE2 TYR 94 HE2 TYR 94 13.197 -20.158 7.205 728 HH TYR 94 HH TYR 94 10.924 -20.897 5.070 729 H GLN 95 H GLN 95 18.833 -24.988 7.117 730 HA GLN 95 HA GLN 95 19.743 -22.339 6.621 731 HB2 GLN 95 2HB GLN 95 20.768 -24.757 7.884 732 HB3 GLN 95 3HB GLN 95 22.014 -23.884 7.002 733 HG2 GLN 95 2HG GLN 95 20.204 -22.488 8.936 734 HG3 GLN 95 3HG GLN 95 21.659 -23.327 9.470 735 HE21 GLN 95 1HE2 GLN 95 23.593 -22.368 9.227 736 HE22 GLN 95 2HE2 GLN 95 23.836 -20.823 8.495 737 H GLN 96 H GLN 96 19.115 -24.684 4.475 738 HA GLN 96 HA GLN 96 21.465 -24.608 2.843 739 HB2 GLN 96 2HB GLN 96 18.685 -25.674 2.505 740 HB3 GLN 96 3HB GLN 96 19.752 -25.558 1.112 741 HG2 GLN 96 2HG GLN 96 20.457 -27.016 3.645 742 HG3 GLN 96 3HG GLN 96 19.724 -27.781 2.236 743 HE21 GLN 96 1HE2 GLN 96 22.471 -27.735 3.708 744 HE22 GLN 96 2HE2 GLN 96 23.595 -27.696 2.396 745 H GLY 97 H GLY 97 20.230 -22.026 3.589 746 HA2 GLY 97 2HA GLY 97 20.579 -20.070 2.205 747 HA3 GLY 97 3HA GLY 97 19.921 -20.976 0.850 748 H ALA 98 H ALA 98 18.521 -20.945 4.069 749 HA ALA 98 HA ALA 98 16.202 -19.500 2.962 750 HB1 ALA 98 1HB ALA 98 15.918 -21.263 5.342 751 HB2 ALA 98 2HB ALA 98 14.753 -20.878 4.074 752 HB3 ALA 98 3HB ALA 98 16.069 -22.007 3.750 753 H PHE 99 H PHE 99 15.084 -18.044 4.336 754 HA PHE 99 HA PHE 99 16.820 -16.569 6.078 755 HB2 PHE 99 2HB PHE 99 15.354 -15.244 4.787 756 HB3 PHE 99 3HB PHE 99 13.958 -16.232 5.205 757 HD1 PHE 99 HD2 PHE 99 16.292 -13.666 6.418 758 HD2 PHE 99 HD1 PHE 99 12.730 -15.856 7.209 759 HE1 PHE 99 HE2 PHE 99 15.747 -12.113 8.246 760 HE2 PHE 99 HE1 PHE 99 12.179 -14.306 9.039 761 HZ PHE 99 HZ PHE 99 13.689 -12.432 9.560 762 H ASP 100 H ASP 100 16.488 -16.121 8.291 763 HA ASP 100 HA ASP 100 16.105 -18.206 9.985 764 HB2 ASP 100 2HB ASP 100 16.963 -15.908 10.574 765 HB3 ASP 100 3HB ASP 100 15.284 -15.383 10.682 766 H TYR 101 H TYR 101 14.438 -19.560 10.079 767 HA TYR 101 HA TYR 101 11.805 -18.948 9.312 768 HB2 TYR 101 2HB TYR 101 11.261 -21.116 10.553 769 HB3 TYR 101 3HB TYR 101 12.425 -21.225 9.237 770 HD1 TYR 101 HD2 TYR 101 12.631 -20.342 12.869 771 HD2 TYR 101 HD1 TYR 101 14.097 -22.742 9.676 772 HE1 TYR 101 HE2 TYR 101 14.256 -21.376 14.399 773 HE2 TYR 101 HE1 TYR 101 15.726 -23.782 11.197 774 HH TYR 101 HH TYR 101 15.784 -22.984 14.650 775 H LEU 102 H LEU 102 9.989 -19.663 11.048 776 HA LEU 102 HA LEU 102 10.444 -18.225 13.558 777 HB2 LEU 102 2HB LEU 102 9.461 -16.495 12.381 778 HB3 LEU 102 3HB LEU 102 8.422 -17.579 11.458 779 HG LEU 102 HG LEU 102 7.169 -17.978 13.639 780 HD11 LEU 102 1HD1 LEU 102 9.149 -15.976 14.483 781 HD12 LEU 102 2HD1 LEU 102 8.268 -17.177 15.428 782 HD13 LEU 102 3HD1 LEU 102 7.488 -15.658 14.985 783 HD21 LEU 102 3HD2 LEU 102 7.160 -15.565 11.932 784 HD22 LEU 102 1HD2 LEU 102 6.223 -15.483 13.424 785 HD23 LEU 102 2HD2 LEU 102 5.886 -16.746 12.240 786 HA PRO 103 HA PRO 103 8.408 -22.043 14.766 787 HB2 PRO 103 2HB PRO 103 8.910 -21.741 17.417 788 HB3 PRO 103 3HB PRO 103 10.120 -22.329 16.271 789 HG2 PRO 103 2HG PRO 103 9.761 -19.581 17.402 790 HG3 PRO 103 3HG PRO 103 11.255 -20.504 17.158 791 HD2 PRO 103 2HD PRO 103 10.451 -18.557 15.457 792 HD3 PRO 103 3HD PRO 103 11.359 -19.984 14.915 793 H LYS 104 H LYS 104 6.368 -22.447 15.441 794 HA LYS 104 HA LYS 104 4.811 -20.163 16.439 795 HB2 LYS 104 2HB LYS 104 4.270 -22.337 14.561 796 HB3 LYS 104 3HB LYS 104 2.995 -22.129 15.754 797 HG2 LYS 104 2HG LYS 104 2.830 -19.756 15.139 798 HG3 LYS 104 3HG LYS 104 4.068 -20.007 13.906 799 HD2 LYS 104 2HD LYS 104 1.847 -20.068 12.913 800 HD3 LYS 104 3HD LYS 104 2.618 -21.651 12.800 801 HE2 LYS 104 2HE LYS 104 1.182 -21.505 15.257 802 HE3 LYS 104 3HE LYS 104 0.117 -20.984 13.953 803 HZ1 LYS 104 3HZ LYS 104 1.553 -23.268 13.141 804 HZ2 LYS 104 1HZ LYS 104 -0.118 -23.076 13.319 805 HZ3 LYS 104 2HZ LYS 104 0.820 -23.582 14.632 806 HA PRO 105 HA PRO 105 2.618 -20.015 17.166 807 HB2 PRO 105 2HB PRO 105 2.043 -18.723 19.483 808 HB3 PRO 105 3HB PRO 105 1.133 -20.128 18.915 809 HG2 PRO 105 2HG PRO 105 3.320 -19.986 20.954 810 HG3 PRO 105 3HG PRO 105 1.799 -20.895 21.007 811 HD2 PRO 105 2HD PRO 105 4.164 -22.050 20.371 812 HD3 PRO 105 3HD PRO 105 2.620 -22.593 19.682 813 H PHE 106 H PHE 106 2.734 -17.538 17.592 814 HA PHE 106 HA PHE 106 5.294 -16.590 18.543 815 HB2 PHE 106 2HB PHE 106 5.859 -15.494 16.371 816 HB3 PHE 106 3HB PHE 106 5.942 -17.252 16.315 817 HD1 PHE 106 HD2 PHE 106 3.537 -14.480 15.654 818 HD2 PHE 106 HD1 PHE 106 4.952 -18.340 14.552 819 HE1 PHE 106 HE2 PHE 106 2.009 -14.486 13.726 820 HE2 PHE 106 HE1 PHE 106 3.427 -18.351 12.621 821 HZ PHE 106 HZ PHE 106 1.952 -16.423 12.207 822 H ASP 107 H ASP 107 5.454 -14.123 17.982 823 HA ASP 107 HA ASP 107 2.885 -12.963 18.767 824 HB2 ASP 107 2HB ASP 107 5.720 -11.933 18.898 825 HB3 ASP 107 3HB ASP 107 4.321 -10.922 19.248 826 H ILE 108 H ILE 108 1.647 -12.210 17.188 827 HA ILE 108 HA ILE 108 2.265 -11.836 14.555 828 HB ILE 108 HB ILE 108 0.214 -10.485 16.281 829 HG12 ILE 108 2HG1 ILE 108 -0.352 -12.204 13.902 830 HG13 ILE 108 3HG1 ILE 108 0.224 -12.971 15.377 831 HG21 ILE 108 1HG2 ILE 108 0.781 -9.992 13.372 832 HG22 ILE 108 2HG2 ILE 108 -0.797 -9.687 14.097 833 HG23 ILE 108 3HG2 ILE 108 0.622 -8.812 14.672 834 HD11 ILE 108 3HD1 ILE 108 -1.824 -12.932 16.194 835 HD12 ILE 108 1HD1 ILE 108 -1.852 -11.173 16.075 836 HD13 ILE 108 2HD1 ILE 108 -2.399 -12.159 14.718 837 H ASP 109 H ASP 109 2.762 -9.590 17.206 838 HA ASP 109 HA ASP 109 3.300 -7.268 15.752 839 HB2 ASP 109 2HB ASP 109 3.069 -7.644 18.318 840 HB3 ASP 109 3HB ASP 109 4.805 -7.937 18.263 841 H GLU 110 H GLU 110 5.447 -9.907 16.736 842 HA GLU 110 HA GLU 110 7.760 -8.680 15.538 843 HB2 GLU 110 2HB GLU 110 7.418 -10.566 17.486 844 HB3 GLU 110 3HB GLU 110 7.873 -11.563 16.112 845 HG2 GLU 110 2HG GLU 110 9.536 -9.182 16.504 846 HG3 GLU 110 3HG GLU 110 9.617 -10.370 17.803 847 H ALA 111 H ALA 111 5.313 -10.969 14.599 848 HA ALA 111 HA ALA 111 6.669 -12.115 12.390 849 HB1 ALA 111 1HB ALA 111 4.628 -13.115 11.823 850 HB2 ALA 111 2HB ALA 111 4.583 -12.977 13.581 851 HB3 ALA 111 3HB ALA 111 3.687 -11.832 12.583 852 H VAL 112 H VAL 112 4.122 -9.616 12.512 853 HA VAL 112 HA VAL 112 4.017 -8.966 9.838 854 HB VAL 112 HB VAL 112 3.636 -7.247 12.278 855 HG11 VAL 112 1HG1 VAL 112 2.536 -5.623 10.680 856 HG12 VAL 112 2HG1 VAL 112 4.299 -5.674 10.644 857 HG13 VAL 112 3HG1 VAL 112 3.366 -6.480 9.382 858 HG21 VAL 112 3HG2 VAL 112 1.283 -7.430 11.703 859 HG22 VAL 112 1HG2 VAL 112 1.690 -8.346 10.252 860 HG23 VAL 112 2HG2 VAL 112 2.001 -9.034 11.845 861 H ALA 113 H ALA 113 6.390 -8.012 12.236 862 HA ALA 113 HA ALA 113 7.681 -6.128 10.457 863 HB1 ALA 113 1HB ALA 113 9.290 -6.825 12.727 864 HB2 ALA 113 2HB ALA 113 8.510 -5.292 12.338 865 HB3 ALA 113 3HB ALA 113 7.627 -6.528 13.232 866 H LEU 114 H LEU 114 8.033 -9.453 11.428 867 HA LEU 114 HA LEU 114 10.703 -9.858 10.622 868 HB2 LEU 114 2HB LEU 114 9.555 -11.440 12.041 869 HB3 LEU 114 3HB LEU 114 8.382 -11.775 10.770 870 HG LEU 114 HG LEU 114 10.390 -12.625 9.413 871 HD11 LEU 114 1HD1 LEU 114 12.206 -13.532 10.877 872 HD12 LEU 114 2HD1 LEU 114 11.574 -12.525 12.179 873 HD13 LEU 114 3HD1 LEU 114 12.197 -11.777 10.709 874 HD21 LEU 114 3HD2 LEU 114 8.876 -14.250 10.048 875 HD22 LEU 114 1HD2 LEU 114 9.128 -13.961 11.769 876 HD23 LEU 114 2HD2 LEU 114 10.358 -14.805 10.828 877 H VAL 115 H VAL 115 7.630 -10.174 8.895 878 HA VAL 115 HA VAL 115 8.704 -11.213 6.499 879 HB VAL 115 HB VAL 115 6.341 -11.411 6.929 880 HG11 VAL 115 1HG1 VAL 115 4.843 -9.501 6.970 881 HG12 VAL 115 2HG1 VAL 115 6.071 -9.340 8.227 882 HG13 VAL 115 3HG1 VAL 115 6.203 -8.404 6.737 883 HG21 VAL 115 3HG2 VAL 115 5.878 -11.348 4.749 884 HG22 VAL 115 1HG2 VAL 115 5.996 -9.589 4.707 885 HG23 VAL 115 2HG2 VAL 115 7.447 -10.575 4.523 886 H GLU 116 H GLU 116 8.103 -7.920 7.623 887 HA GLU 116 HA GLU 116 8.595 -6.573 5.218 888 HB2 GLU 116 2HB GLU 116 8.461 -5.874 8.069 889 HB3 GLU 116 3HB GLU 116 9.498 -4.820 7.118 890 HG2 GLU 116 2HG GLU 116 7.520 -4.637 5.508 891 HG3 GLU 116 3HG GLU 116 6.563 -5.328 6.817 892 H ARG 117 H ARG 117 10.747 -8.047 7.501 893 HA ARG 117 HA ARG 117 13.109 -6.661 6.709 894 HB2 ARG 117 2HB ARG 117 13.161 -7.662 8.850 895 HB3 ARG 117 3HB ARG 117 12.608 -9.211 8.228 896 HG2 ARG 117 2HG ARG 117 14.675 -9.863 7.639 897 HG3 ARG 117 3HG ARG 117 15.150 -8.246 7.113 898 HD2 ARG 117 2HD ARG 117 14.822 -8.979 10.011 899 HD3 ARG 117 3HD ARG 117 16.346 -9.184 9.147 900 HE ARG 117 HE ARG 117 15.281 -6.541 8.896 901 HH11 ARG 117 1HH1 ARG 117 17.117 -8.667 10.953 902 HH12 ARG 117 2HH1 ARG 117 17.965 -7.380 11.745 903 HH21 ARG 117 1HH2 ARG 117 16.391 -4.839 9.932 904 HH22 ARG 117 2HH2 ARG 117 17.551 -5.203 11.164 905 H ALA 118 H ALA 118 11.351 -9.376 5.477 906 HA ALA 118 HA ALA 118 13.544 -10.361 3.867 907 HB1 ALA 118 1HB ALA 118 10.929 -11.303 4.651 908 HB2 ALA 118 2HB ALA 118 11.197 -11.512 2.920 909 HB3 ALA 118 3HB ALA 118 12.328 -12.211 4.078 910 H ILE 119 H ILE 119 10.700 -8.349 3.461 911 HA ILE 119 HA ILE 119 10.990 -8.224 0.585 912 HB ILE 119 HB ILE 119 9.169 -6.717 2.464 913 HG12 ILE 119 2HG1 ILE 119 8.403 -8.808 0.436 914 HG13 ILE 119 3HG1 ILE 119 8.883 -9.246 2.072 915 HG21 ILE 119 1HG2 ILE 119 9.286 -6.716 -0.548 916 HG22 ILE 119 2HG2 ILE 119 7.960 -6.049 0.404 917 HG23 ILE 119 3HG2 ILE 119 9.574 -5.349 0.529 918 HD11 ILE 119 3HD1 ILE 119 6.377 -8.947 1.485 919 HD12 ILE 119 1HD1 ILE 119 7.001 -8.322 3.011 920 HD13 ILE 119 2HD1 ILE 119 6.731 -7.227 1.654 921 H SER 120 H SER 120 11.322 -5.958 3.310 922 HA SER 120 HA SER 120 12.156 -3.736 1.840 923 HB2 SER 120 2HB SER 120 11.509 -3.928 4.344 924 HB3 SER 120 3HB SER 120 13.212 -4.311 4.598 925 HG SER 120 HG SER 120 13.667 -2.282 4.345 926 H HIS 121 H HIS 121 13.824 -6.630 2.658 927 HA HIS 121 HA HIS 121 16.481 -5.802 2.651 928 HB2 HIS 121 2HB HIS 121 15.629 -8.102 3.210 929 HB3 HIS 121 3HB HIS 121 15.454 -8.393 1.482 930 HD1 HIS 121 HD1 HIS 121 17.502 -9.128 0.233 931 HD2 HIS 121 HD2 HIS 121 18.373 -7.742 4.051 932 HE1 HIS 121 HE1 HIS 121 19.931 -9.664 0.604 933 H TYR 122 H TYR 122 14.216 -6.045 0.058 934 HA TYR 122 HA TYR 122 16.365 -5.642 -1.910 935 HB2 TYR 122 2HB TYR 122 13.499 -6.330 -2.545 936 HB3 TYR 122 3HB TYR 122 14.910 -6.484 -3.586 937 HD1 TYR 122 HD1 TYR 122 16.742 -8.155 -2.787 938 HD2 TYR 122 HD2 TYR 122 12.726 -8.187 -1.384 939 HE1 TYR 122 HE1 TYR 122 17.014 -10.496 -2.081 940 HE2 TYR 122 HE2 TYR 122 12.986 -10.527 -0.673 941 HH TYR 122 HH TYR 122 15.451 -12.492 -1.687 942 H GLN 123 H GLN 123 13.248 -4.399 -0.804 943 HA GLN 123 HA GLN 123 13.530 -2.061 -2.534 944 HB2 GLN 123 2HB GLN 123 11.281 -3.207 -0.914 945 HB3 GLN 123 3HB GLN 123 11.228 -1.527 -1.434 946 HG2 GLN 123 2HG GLN 123 10.558 -2.115 -3.456 947 HG3 GLN 123 3HG GLN 123 11.929 -3.207 -3.644 948 HE21 GLN 123 1HE2 GLN 123 9.132 -3.480 -4.490 949 HE22 GLN 123 2HE2 GLN 123 8.570 -4.952 -3.781 950 H GLU 124 H GLU 124 15.365 -2.404 -0.353 951 HA GLU 124 HA GLU 124 16.270 -1.287 1.416 952 HB2 GLU 124 2HB GLU 124 14.684 1.022 0.277 953 HB3 GLU 124 3HB GLU 124 16.064 1.146 1.359 954 HG2 GLU 124 2HG GLU 124 16.632 -0.392 -1.045 955 HG3 GLU 124 3HG GLU 124 16.144 1.269 -1.375 Start of MODEL 8 1 H1 MET 1 H MET 1 -0.374 -0.637 1.873 2 HA MET 1 HA MET 1 0.194 -0.313 -0.570 3 HB2 MET 1 2HB MET 1 1.695 1.541 -0.257 4 HB3 MET 1 3HB MET 1 2.742 0.583 0.781 5 HG2 MET 1 2HG MET 1 3.427 -0.781 -1.061 6 HG3 MET 1 3HG MET 1 2.246 -0.017 -2.123 7 HE1 MET 1 3HE MET 1 5.923 0.067 -2.607 8 HE2 MET 1 1HE MET 1 4.409 -0.261 -3.449 9 HE3 MET 1 2HE MET 1 5.317 1.208 -3.808 10 H GLN 2 H GLN 2 0.200 -2.356 -1.213 11 HA GLN 2 HA GLN 2 1.442 -4.418 0.374 12 HB2 GLN 2 2HB GLN 2 0.517 -5.942 -1.377 13 HB3 GLN 2 3HB GLN 2 -0.689 -4.924 -0.602 14 HG2 GLN 2 2HG GLN 2 0.356 -3.613 -2.928 15 HG3 GLN 2 3HG GLN 2 -0.204 -5.234 -3.339 16 HE21 GLN 2 1HE2 GLN 2 -2.075 -4.862 -4.341 17 HE22 GLN 2 2HE2 GLN 2 -3.408 -3.993 -3.668 18 H ARG 3 H ARG 3 3.594 -3.255 -0.038 19 HA ARG 3 HA ARG 3 4.829 -3.554 -2.588 20 HB2 ARG 3 2HB ARG 3 6.725 -2.619 -1.626 21 HB3 ARG 3 3HB ARG 3 5.433 -1.949 -0.639 22 HG2 ARG 3 2HG ARG 3 7.094 -4.350 0.098 23 HG3 ARG 3 3HG ARG 3 7.369 -2.707 0.680 24 HD2 ARG 3 2HD ARG 3 4.873 -4.344 1.114 25 HD3 ARG 3 3HD ARG 3 6.132 -4.047 2.312 26 HE ARG 3 HE ARG 3 4.023 -2.269 1.552 27 HH11 ARG 3 1HH1 ARG 3 7.280 -2.437 2.772 28 HH12 ARG 3 2HH1 ARG 3 7.200 -0.899 3.567 29 HH21 ARG 3 1HH2 ARG 3 3.907 -0.243 2.595 30 HH22 ARG 3 2HH2 ARG 3 5.281 0.347 3.466 31 H GLY 4 H GLY 4 4.163 -5.720 -0.065 32 HA2 GLY 4 2HA GLY 4 5.792 -7.762 -1.383 33 HA3 GLY 4 3HA GLY 4 6.080 -7.482 0.328 34 H ILE 5 H ILE 5 4.263 -9.183 -1.937 35 HA ILE 5 HA ILE 5 1.968 -9.666 -0.256 36 HB ILE 5 HB ILE 5 2.844 -10.993 -2.823 37 HG12 ILE 5 2HG1 ILE 5 0.531 -9.104 -2.420 38 HG13 ILE 5 3HG1 ILE 5 2.146 -8.521 -2.808 39 HG21 ILE 5 1HG2 ILE 5 0.272 -11.262 -1.274 40 HG22 ILE 5 2HG2 ILE 5 0.548 -11.893 -2.896 41 HG23 ILE 5 3HG2 ILE 5 1.481 -12.518 -1.537 42 HD11 ILE 5 3HD1 ILE 5 1.658 -10.504 -4.682 43 HD12 ILE 5 1HD1 ILE 5 0.126 -9.645 -4.529 44 HD13 ILE 5 2HD1 ILE 5 1.596 -8.761 -4.939 45 H VAL 6 H VAL 6 1.781 -11.186 1.251 46 HA VAL 6 HA VAL 6 3.794 -13.340 1.318 47 HB VAL 6 HB VAL 6 2.284 -12.297 3.709 48 HG11 VAL 6 1HG1 VAL 6 3.739 -14.598 3.360 49 HG12 VAL 6 2HG1 VAL 6 4.917 -13.496 4.076 50 HG13 VAL 6 3HG1 VAL 6 3.395 -13.823 4.907 51 HG21 VAL 6 3HG2 VAL 6 3.627 -10.485 2.735 52 HG22 VAL 6 1HG2 VAL 6 4.262 -11.011 4.294 53 HG23 VAL 6 2HG2 VAL 6 5.055 -11.518 2.803 54 H TRP 7 H TRP 7 3.109 -15.395 1.323 55 HA TRP 7 HA TRP 7 0.207 -15.861 1.539 56 HB2 TRP 7 2HB TRP 7 2.305 -17.329 -0.067 57 HB3 TRP 7 3HB TRP 7 0.652 -17.902 0.138 58 HD1 TRP 7 HD1 TRP 7 -0.001 -14.445 -0.106 59 HE1 TRP 7 HE1 TRP 7 -0.429 -13.662 -2.520 60 HE3 TRP 7 HE3 TRP 7 1.945 -18.451 -2.615 61 HZ2 TRP 7 HZ2 TRP 7 0.001 -14.617 -5.141 62 HZ3 TRP 7 HZ3 TRP 7 1.898 -18.438 -5.075 63 HH2 TRP 7 HH2 TRP 7 0.945 -16.560 -6.310 64 H VAL 8 H VAL 8 -0.387 -18.072 2.304 65 HA VAL 8 HA VAL 8 1.569 -19.276 4.115 66 HB VAL 8 HB VAL 8 -1.150 -18.294 4.985 67 HG11 VAL 8 1HG1 VAL 8 -0.671 -19.315 7.149 68 HG12 VAL 8 2HG1 VAL 8 -0.717 -20.533 5.873 69 HG13 VAL 8 3HG1 VAL 8 0.832 -19.981 6.511 70 HG21 VAL 8 3HG2 VAL 8 0.781 -16.672 4.924 71 HG22 VAL 8 1HG2 VAL 8 0.009 -16.881 6.496 72 HG23 VAL 8 2HG2 VAL 8 1.551 -17.668 6.159 73 H VAL 9 H VAL 9 1.249 -21.448 4.517 74 HA VAL 9 HA VAL 9 -1.082 -22.716 3.249 75 HB VAL 9 HB VAL 9 0.767 -22.958 1.688 76 HG11 VAL 9 1HG1 VAL 9 2.839 -23.007 2.501 77 HG12 VAL 9 2HG1 VAL 9 2.267 -23.437 4.115 78 HG13 VAL 9 3HG1 VAL 9 2.552 -24.697 2.913 79 HG21 VAL 9 3HG2 VAL 9 -0.710 -25.077 2.837 80 HG22 VAL 9 1HG2 VAL 9 -0.047 -24.967 1.207 81 HG23 VAL 9 2HG2 VAL 9 0.909 -25.689 2.500 82 H ASP 10 H ASP 10 -1.652 -22.598 5.622 83 HA ASP 10 HA ASP 10 -0.424 -24.812 7.124 84 HB2 ASP 10 2HB ASP 10 -1.349 -23.762 9.140 85 HB3 ASP 10 3HB ASP 10 -0.319 -22.639 8.256 86 H ASP 11 H ASP 11 -2.092 -25.796 8.742 87 HA ASP 11 HA ASP 11 -4.572 -26.359 7.252 88 HB2 ASP 11 2HB ASP 11 -2.557 -28.158 7.826 89 HB3 ASP 11 3HB ASP 11 -3.721 -28.446 9.117 90 H ASP 12 H ASP 12 -3.938 -24.406 9.438 91 HA ASP 12 HA ASP 12 -5.964 -25.340 11.363 92 HB2 ASP 12 2HB ASP 12 -3.287 -24.620 11.890 93 HB3 ASP 12 3HB ASP 12 -4.282 -23.297 12.493 94 H SER 13 H SER 13 -7.300 -23.686 12.307 95 HA SER 13 HA SER 13 -8.100 -21.722 10.382 96 HB2 SER 13 2HB SER 13 -9.416 -23.088 12.343 97 HB3 SER 13 3HB SER 13 -9.218 -21.509 13.103 98 HG SER 13 HG SER 13 -11.098 -21.429 11.942 99 H SER 14 H SER 14 -6.944 -21.497 13.748 100 HA SER 14 HA SER 14 -6.709 -18.691 13.770 101 HB2 SER 14 2HB SER 14 -5.715 -20.920 15.485 102 HB3 SER 14 3HB SER 14 -4.963 -19.336 15.677 103 HG SER 14 HG SER 14 -7.128 -18.503 15.953 104 H ILE 15 H ILE 15 -4.308 -21.243 13.193 105 HA ILE 15 HA ILE 15 -2.006 -19.788 12.973 106 HB ILE 15 HB ILE 15 -2.885 -22.098 11.240 107 HG12 ILE 15 2HG1 ILE 15 -2.783 -22.619 13.626 108 HG13 ILE 15 3HG1 ILE 15 -1.472 -23.422 12.768 109 HG21 ILE 15 1HG2 ILE 15 -0.476 -22.412 10.778 110 HG22 ILE 15 2HG2 ILE 15 -1.119 -20.915 10.105 111 HG23 ILE 15 3HG2 ILE 15 -0.151 -20.874 11.578 112 HD11 ILE 15 3HD1 ILE 15 0.013 -21.536 13.487 113 HD12 ILE 15 1HD1 ILE 15 -1.308 -20.989 14.519 114 HD13 ILE 15 2HD1 ILE 15 -0.579 -22.573 14.784 115 H ARG 16 H ARG 16 -4.361 -20.371 10.366 116 HA ARG 16 HA ARG 16 -2.985 -18.649 8.530 117 HB2 ARG 16 2HB ARG 16 -4.461 -19.395 6.960 118 HB3 ARG 16 3HB ARG 16 -4.669 -20.680 8.141 119 HG2 ARG 16 2HG ARG 16 -6.553 -19.129 9.068 120 HG3 ARG 16 3HG ARG 16 -6.492 -18.430 7.449 121 HD2 ARG 16 2HD ARG 16 -6.484 -21.312 7.334 122 HD3 ARG 16 3HD ARG 16 -7.867 -20.723 8.254 123 HE ARG 16 HE ARG 16 -7.519 -19.309 5.798 124 HH11 ARG 16 1HH1 ARG 16 -8.780 -22.232 7.207 125 HH12 ARG 16 2HH1 ARG 16 -9.948 -22.488 5.954 126 HH21 ARG 16 1HH2 ARG 16 -9.053 -19.635 4.141 127 HH22 ARG 16 2HH2 ARG 16 -10.102 -21.010 4.210 128 H TRP 17 H TRP 17 -5.417 -18.259 10.948 129 HA TRP 17 HA TRP 17 -6.623 -15.892 9.960 130 HB2 TRP 17 2HB TRP 17 -7.782 -17.169 11.628 131 HB3 TRP 17 3HB TRP 17 -6.426 -17.045 12.746 132 HD1 TRP 17 HD1 TRP 17 -9.236 -14.891 11.228 133 HE1 TRP 17 HE1 TRP 17 -9.657 -12.893 12.795 134 HE3 TRP 17 HE3 TRP 17 -5.412 -15.636 14.538 135 HZ2 TRP 17 HZ2 TRP 17 -8.517 -11.779 15.125 136 HZ3 TRP 17 HZ3 TRP 17 -5.146 -14.059 16.407 137 HH2 TRP 17 HH2 TRP 17 -6.667 -12.171 16.693 138 H VAL 18 H VAL 18 -4.494 -16.196 12.807 139 HA VAL 18 HA VAL 18 -3.889 -13.536 13.134 140 HB VAL 18 HB VAL 18 -3.083 -14.797 14.870 141 HG11 VAL 18 1HG1 VAL 18 -2.434 -16.751 12.755 142 HG12 VAL 18 2HG1 VAL 18 -1.410 -16.783 14.192 143 HG13 VAL 18 3HG1 VAL 18 -3.154 -16.995 14.346 144 HG21 VAL 18 3HG2 VAL 18 -0.488 -14.782 13.389 145 HG22 VAL 18 1HG2 VAL 18 -1.294 -13.258 13.761 146 HG23 VAL 18 2HG2 VAL 18 -0.826 -14.349 15.065 147 H LEU 19 H LEU 19 -2.266 -15.886 11.040 148 HA LEU 19 HA LEU 19 -0.161 -14.251 10.183 149 HB2 LEU 19 2HB LEU 19 -1.568 -16.602 8.969 150 HB3 LEU 19 3HB LEU 19 -0.285 -15.764 8.098 151 HG LEU 19 HG LEU 19 0.129 -16.926 10.842 152 HD11 LEU 19 1HD1 LEU 19 0.786 -18.963 9.965 153 HD12 LEU 19 2HD1 LEU 19 0.960 -18.322 8.331 154 HD13 LEU 19 3HD1 LEU 19 -0.647 -18.582 9.009 155 HD21 LEU 19 3HD2 LEU 19 2.413 -16.672 10.405 156 HD22 LEU 19 1HD2 LEU 19 1.686 -15.183 9.802 157 HD23 LEU 19 2HD2 LEU 19 2.151 -16.456 8.673 158 H GLU 20 H GLU 20 -3.510 -14.363 9.263 159 HA GLU 20 HA GLU 20 -3.144 -12.814 6.856 160 HB2 GLU 20 2HB GLU 20 -5.088 -14.520 7.668 161 HB3 GLU 20 3HB GLU 20 -5.834 -12.979 8.069 162 HG2 GLU 20 2HG GLU 20 -4.722 -13.665 5.359 163 HG3 GLU 20 3HG GLU 20 -6.415 -13.845 5.818 164 H ARG 21 H ARG 21 -4.573 -12.240 10.065 165 HA ARG 21 HA ARG 21 -5.313 -9.593 9.737 166 HB2 ARG 21 2HB ARG 21 -4.152 -10.694 12.294 167 HB3 ARG 21 3HB ARG 21 -5.354 -9.423 12.113 168 HG2 ARG 21 2HG ARG 21 -5.696 -12.372 11.671 169 HG3 ARG 21 3HG ARG 21 -6.511 -11.339 12.846 170 HD2 ARG 21 2HD ARG 21 -6.886 -11.435 9.865 171 HD3 ARG 21 3HD ARG 21 -8.081 -11.735 11.127 172 HE ARG 21 HE ARG 21 -7.384 -9.174 11.576 173 HH11 ARG 21 1HH1 ARG 21 -8.363 -10.883 8.705 174 HH12 ARG 21 2HH1 ARG 21 -9.097 -9.495 7.972 175 HH21 ARG 21 1HH2 ARG 21 -8.348 -7.340 10.622 176 HH22 ARG 21 2HH2 ARG 21 -9.088 -7.481 9.063 177 H ALA 22 H ALA 22 -2.154 -10.971 10.181 178 HA ALA 22 HA ALA 22 -0.683 -8.843 11.137 179 HB1 ALA 22 1HB ALA 22 0.752 -10.547 10.935 180 HB2 ALA 22 2HB ALA 22 -0.122 -11.247 9.572 181 HB3 ALA 22 3HB ALA 22 1.025 -9.933 9.304 182 H LEU 23 H LEU 23 -1.119 -9.644 7.683 183 HA LEU 23 HA LEU 23 -0.208 -7.009 6.911 184 HB2 LEU 23 2HB LEU 23 -1.418 -8.986 5.024 185 HB3 LEU 23 3HB LEU 23 -0.151 -7.796 4.731 186 HG LEU 23 HG LEU 23 0.095 -10.446 6.140 187 HD11 LEU 23 1HD1 LEU 23 0.725 -11.157 4.139 188 HD12 LEU 23 2HD1 LEU 23 2.070 -10.017 4.180 189 HD13 LEU 23 3HD1 LEU 23 0.530 -9.537 3.467 190 HD21 LEU 23 3HD2 LEU 23 2.623 -9.490 6.019 191 HD22 LEU 23 1HD2 LEU 23 1.592 -9.393 7.447 192 HD23 LEU 23 2HD2 LEU 23 1.727 -8.010 6.361 193 H ALA 24 H ALA 24 -3.226 -8.759 7.174 194 HA ALA 24 HA ALA 24 -4.931 -7.235 5.640 195 HB1 ALA 24 1HB ALA 24 -5.726 -8.214 8.363 196 HB2 ALA 24 2HB ALA 24 -6.702 -8.108 6.897 197 HB3 ALA 24 3HB ALA 24 -5.431 -9.325 7.025 198 H GLY 25 H GLY 25 -3.880 -6.621 8.980 199 HA2 GLY 25 2HA GLY 25 -5.335 -4.107 9.051 200 HA3 GLY 25 3HA GLY 25 -4.381 -4.799 10.354 201 H ALA 26 H ALA 26 -2.475 -5.012 7.709 202 HA ALA 26 HA ALA 26 -1.090 -2.519 8.401 203 HB1 ALA 26 1HB ALA 26 0.241 -4.515 8.679 204 HB2 ALA 26 2HB ALA 26 -0.081 -4.999 7.014 205 HB3 ALA 26 3HB ALA 26 0.882 -3.558 7.343 206 H GLY 27 H GLY 27 -1.040 -4.442 5.413 207 HA2 GLY 27 2HA GLY 27 -2.532 -2.983 3.693 208 HA3 GLY 27 3HA GLY 27 -1.069 -2.021 3.834 209 H LEU 28 H LEU 28 -1.326 -5.546 3.875 210 HA LEU 28 HA LEU 28 -0.079 -5.655 1.225 211 HB2 LEU 28 2HB LEU 28 0.977 -7.632 3.097 212 HB3 LEU 28 3HB LEU 28 1.810 -6.649 1.895 213 HG LEU 28 HG LEU 28 0.945 -5.564 4.566 214 HD11 LEU 28 1HD1 LEU 28 2.713 -6.442 5.602 215 HD12 LEU 28 2HD1 LEU 28 3.783 -6.119 4.239 216 HD13 LEU 28 3HD1 LEU 28 2.792 -7.577 4.254 217 HD21 LEU 28 3HD2 LEU 28 2.224 -4.496 2.201 218 HD22 LEU 28 1HD2 LEU 28 3.224 -4.281 3.637 219 HD23 LEU 28 2HD2 LEU 28 1.575 -3.656 3.611 220 H THR 29 H THR 29 -0.743 -7.324 -0.026 221 HA THR 29 HA THR 29 -3.113 -8.662 0.532 222 HB THR 29 HB THR 29 -1.026 -9.731 -1.365 223 HG1 THR 29 HG1 THR 29 -2.963 -7.783 -2.061 224 HG21 THR 29 3HG2 THR 29 -2.750 -11.217 -1.516 225 HG22 THR 29 1HG2 THR 29 -3.347 -10.002 -2.646 226 HG23 THR 29 2HG2 THR 29 -3.955 -10.041 -0.991 227 H CYS 30 H CYS 30 -3.533 -10.934 0.846 228 HA CYS 30 HA CYS 30 -1.377 -12.561 1.917 229 HB2 CYS 30 2HB CYS 30 -2.866 -11.048 3.678 230 HB3 CYS 30 3HB CYS 30 -3.694 -12.600 3.706 231 HG CYS 30 HG CYS 30 -1.096 -13.917 4.157 232 H THR 31 H THR 31 -1.631 -14.624 1.345 233 HA THR 31 HA THR 31 -4.325 -15.529 0.559 234 HB THR 31 HB THR 31 -1.778 -16.528 -0.711 235 HG1 THR 31 HG1 THR 31 -3.542 -14.623 -1.864 236 HG21 THR 31 3HG2 THR 31 -3.272 -17.341 -2.444 237 HG22 THR 31 1HG2 THR 31 -4.656 -16.620 -1.625 238 HG23 THR 31 2HG2 THR 31 -3.786 -17.958 -0.874 239 H THR 32 H THR 32 -5.036 -17.049 1.890 240 HA THR 32 HA THR 32 -3.101 -18.758 3.284 241 HB THR 32 HB THR 32 -4.878 -19.289 4.849 242 HG1 THR 32 HG1 THR 32 -6.450 -18.034 2.902 243 HG21 THR 32 3HG2 THR 32 -5.315 -16.383 4.684 244 HG22 THR 32 1HG2 THR 32 -3.626 -16.888 4.673 245 HG23 THR 32 2HG2 THR 32 -4.679 -17.361 6.006 246 H PHE 33 H PHE 33 -2.906 -20.853 2.815 247 HA PHE 33 HA PHE 33 -4.949 -22.077 1.080 248 HB2 PHE 33 2HB PHE 33 -1.983 -22.650 1.229 249 HB3 PHE 33 3HB PHE 33 -3.130 -23.545 0.238 250 HD1 PHE 33 HD2 PHE 33 -4.260 -22.417 -1.657 251 HD2 PHE 33 HD1 PHE 33 -1.125 -20.557 0.540 252 HE1 PHE 33 HE2 PHE 33 -3.943 -20.801 -3.485 253 HE2 PHE 33 HE1 PHE 33 -0.804 -18.937 -1.283 254 HZ PHE 33 HZ PHE 33 -2.213 -19.058 -3.300 255 H GLU 34 H GLU 34 -4.225 -24.695 1.220 256 HA GLU 34 HA GLU 34 -3.899 -25.553 3.944 257 HB2 GLU 34 2HB GLU 34 -6.135 -26.787 3.915 258 HB3 GLU 34 3HB GLU 34 -6.182 -25.055 4.212 259 HG2 GLU 34 2HG GLU 34 -6.422 -25.837 1.394 260 HG3 GLU 34 3HG GLU 34 -7.748 -26.352 2.435 261 H ASN 35 H ASN 35 -2.175 -26.319 2.271 262 HA ASN 35 HA ASN 35 -2.362 -29.093 2.048 263 HB2 ASN 35 2HB ASN 35 -3.572 -27.656 -0.154 264 HB3 ASN 35 3HB ASN 35 -2.213 -28.628 -0.713 265 HD21 ASN 35 1HD2 ASN 35 -3.814 -29.853 -1.862 266 HD22 ASN 35 2HD2 ASN 35 -4.705 -31.086 -1.040 267 H GLY 36 H GLY 36 -1.088 -26.801 -0.359 268 HA2 GLY 36 2HA GLY 36 1.300 -26.048 0.210 269 HA3 GLY 36 3HA GLY 36 1.613 -27.775 0.301 270 H ASN 37 H ASN 37 0.668 -28.953 -1.766 271 HA ASN 37 HA ASN 37 2.271 -28.216 -3.919 272 HB2 ASN 37 2HB ASN 37 1.250 -29.969 -5.128 273 HB3 ASN 37 3HB ASN 37 1.173 -30.479 -3.444 274 HD21 ASN 37 1HD2 ASN 37 -0.494 -30.746 -6.076 275 HD22 ASN 37 2HD2 ASN 37 -2.115 -30.582 -5.501 276 H GLU 38 H GLU 38 -0.992 -27.286 -3.099 277 HA GLU 38 HA GLU 38 -1.653 -26.187 -5.648 278 HB2 GLU 38 2HB GLU 38 -3.517 -25.081 -4.380 279 HB3 GLU 38 3HB GLU 38 -3.455 -26.831 -4.222 280 HG2 GLU 38 2HG GLU 38 -2.666 -26.724 -2.028 281 HG3 GLU 38 3HG GLU 38 -2.187 -25.036 -2.188 282 H VAL 39 H VAL 39 0.310 -25.147 -3.084 283 HA VAL 39 HA VAL 39 0.008 -22.312 -3.655 284 HB VAL 39 HB VAL 39 2.090 -23.527 -1.855 285 HG11 VAL 39 1HG1 VAL 39 0.821 -21.044 -1.051 286 HG12 VAL 39 2HG1 VAL 39 2.532 -21.427 -1.247 287 HG13 VAL 39 3HG1 VAL 39 1.574 -20.927 -2.641 288 HG21 VAL 39 3HG2 VAL 39 0.413 -24.405 -0.654 289 HG22 VAL 39 1HG2 VAL 39 0.080 -22.740 -0.177 290 HG23 VAL 39 2HG2 VAL 39 -0.813 -23.471 -1.511 291 H LEU 40 H LEU 40 2.385 -24.886 -4.097 292 HA LEU 40 HA LEU 40 4.561 -23.451 -4.985 293 HB2 LEU 40 2HB LEU 40 5.065 -25.657 -4.810 294 HB3 LEU 40 3HB LEU 40 3.513 -26.174 -5.464 295 HG LEU 40 HG LEU 40 4.292 -25.698 -7.724 296 HD11 LEU 40 1HD1 LEU 40 6.212 -24.125 -6.399 297 HD12 LEU 40 2HD1 LEU 40 6.005 -24.355 -8.135 298 HD13 LEU 40 3HD1 LEU 40 7.091 -25.408 -7.230 299 HD21 LEU 40 3HD2 LEU 40 6.566 -27.276 -6.752 300 HD22 LEU 40 1HD2 LEU 40 5.302 -27.693 -7.909 301 HD23 LEU 40 2HD2 LEU 40 4.988 -27.819 -6.178 302 H ALA 41 H ALA 41 1.730 -24.503 -6.831 303 HA ALA 41 HA ALA 41 2.682 -23.459 -9.317 304 HB1 ALA 41 1HB ALA 41 0.847 -24.400 -10.239 305 HB2 ALA 41 2HB ALA 41 0.794 -25.261 -8.700 306 HB3 ALA 41 3HB ALA 41 -0.221 -23.841 -8.951 307 H ALA 42 H ALA 42 0.864 -22.196 -6.635 308 HA ALA 42 HA ALA 42 -0.397 -20.020 -7.862 309 HB1 ALA 42 1HB ALA 42 -0.833 -20.841 -5.553 310 HB2 ALA 42 2HB ALA 42 0.681 -20.089 -5.049 311 HB3 ALA 42 3HB ALA 42 -0.636 -19.092 -5.667 312 H LEU 43 H LEU 43 2.882 -20.414 -6.647 313 HA LEU 43 HA LEU 43 3.709 -17.752 -6.674 314 HB2 LEU 43 2HB LEU 43 5.553 -19.936 -7.538 315 HB3 LEU 43 3HB LEU 43 5.877 -18.542 -6.511 316 HG LEU 43 HG LEU 43 4.477 -21.101 -5.768 317 HD11 LEU 43 1HD1 LEU 43 6.304 -20.826 -3.913 318 HD12 LEU 43 2HD1 LEU 43 7.083 -19.808 -5.125 319 HD13 LEU 43 3HD1 LEU 43 6.718 -21.494 -5.492 320 HD21 LEU 43 3HD2 LEU 43 4.762 -19.504 -3.494 321 HD22 LEU 43 1HD2 LEU 43 3.261 -19.963 -4.299 322 HD23 LEU 43 2HD2 LEU 43 4.062 -18.450 -4.723 323 H ALA 44 H ALA 44 3.465 -20.101 -9.280 324 HA ALA 44 HA ALA 44 4.864 -18.640 -11.244 325 HB1 ALA 44 1HB ALA 44 3.477 -21.091 -11.099 326 HB2 ALA 44 2HB ALA 44 2.785 -20.184 -12.445 327 HB3 ALA 44 3HB ALA 44 4.519 -20.504 -12.395 328 H SER 45 H SER 45 1.899 -18.039 -9.747 329 HA SER 45 HA SER 45 0.572 -16.777 -11.955 330 HB2 SER 45 2HB SER 45 0.006 -16.488 -8.995 331 HB3 SER 45 3HB SER 45 -1.085 -16.083 -10.320 332 HG SER 45 HG SER 45 -1.167 -18.277 -9.139 333 H LYS 46 H LYS 46 1.534 -15.327 -8.849 334 HA LYS 46 HA LYS 46 2.481 -12.970 -10.343 335 HB2 LYS 46 2HB LYS 46 1.713 -11.593 -8.416 336 HB3 LYS 46 3HB LYS 46 0.402 -12.384 -9.280 337 HG2 LYS 46 2HG LYS 46 0.717 -14.231 -7.452 338 HG3 LYS 46 3HG LYS 46 1.466 -12.911 -6.550 339 HD2 LYS 46 2HD LYS 46 -1.259 -12.709 -7.819 340 HD3 LYS 46 3HD LYS 46 -1.004 -13.243 -6.156 341 HE2 LYS 46 2HE LYS 46 -0.828 -11.139 -5.463 342 HE3 LYS 46 3HE LYS 46 0.459 -10.826 -6.626 343 HZ1 LYS 46 3HZ LYS 46 -1.387 -9.334 -6.983 344 HZ2 LYS 46 1HZ LYS 46 -2.456 -10.633 -7.157 345 HZ3 LYS 46 2HZ LYS 46 -1.240 -10.380 -8.304 346 H THR 47 H THR 47 3.233 -15.422 -8.171 347 HA THR 47 HA THR 47 5.071 -15.910 -6.919 348 HB THR 47 HB THR 47 6.805 -13.733 -7.752 349 HG1 THR 47 HG1 THR 47 5.543 -15.286 -9.787 350 HG21 THR 47 3HG2 THR 47 8.314 -15.402 -7.869 351 HG22 THR 47 1HG2 THR 47 7.241 -16.443 -8.803 352 HG23 THR 47 2HG2 THR 47 7.074 -16.350 -7.050 353 HA PRO 48 HA PRO 48 4.183 -12.947 -3.637 354 HB2 PRO 48 2HB PRO 48 4.798 -14.661 -1.624 355 HB3 PRO 48 3HB PRO 48 3.247 -14.690 -2.470 356 HG2 PRO 48 2HG PRO 48 5.655 -16.423 -2.869 357 HG3 PRO 48 3HG PRO 48 3.942 -16.881 -2.823 358 HD2 PRO 48 2HD PRO 48 5.310 -16.589 -5.142 359 HD3 PRO 48 3HD PRO 48 3.578 -16.224 -5.002 360 H ASP 49 H ASP 49 5.463 -12.023 -1.892 361 HA ASP 49 HA ASP 49 8.257 -11.833 -2.628 362 HB2 ASP 49 2HB ASP 49 6.421 -10.044 -1.597 363 HB3 ASP 49 3HB ASP 49 7.444 -10.406 -0.209 364 H VAL 50 H VAL 50 6.370 -13.574 -0.392 365 HA VAL 50 HA VAL 50 8.479 -15.115 0.572 366 HB VAL 50 HB VAL 50 9.319 -13.272 1.808 367 HG11 VAL 50 1HG1 VAL 50 6.562 -12.848 2.952 368 HG12 VAL 50 2HG1 VAL 50 8.000 -11.871 3.255 369 HG13 VAL 50 3HG1 VAL 50 7.266 -11.889 1.651 370 HG21 VAL 50 3HG2 VAL 50 7.801 -14.459 4.039 371 HG22 VAL 50 1HG2 VAL 50 8.647 -15.598 2.992 372 HG23 VAL 50 2HG2 VAL 50 9.542 -14.312 3.801 373 H LEU 51 H LEU 51 7.648 -16.942 1.382 374 HA LEU 51 HA LEU 51 4.783 -16.993 1.970 375 HB2 LEU 51 2HB LEU 51 6.488 -18.693 0.560 376 HB3 LEU 51 3HB LEU 51 6.096 -19.564 2.041 377 HG LEU 51 HG LEU 51 3.766 -18.398 0.709 378 HD11 LEU 51 1HD1 LEU 51 5.286 -19.032 -1.212 379 HD12 LEU 51 2HD1 LEU 51 3.701 -19.804 -1.182 380 HD13 LEU 51 3HD1 LEU 51 5.128 -20.701 -0.662 381 HD21 LEU 51 3HD2 LEU 51 4.340 -20.422 2.524 382 HD22 LEU 51 1HD2 LEU 51 3.837 -21.267 1.060 383 HD23 LEU 51 2HD2 LEU 51 2.773 -20.067 1.794 384 H LEU 52 H LEU 52 4.076 -18.504 3.735 385 HA LEU 52 HA LEU 52 5.965 -18.677 5.960 386 HB2 LEU 52 2HB LEU 52 3.546 -16.991 5.833 387 HB3 LEU 52 3HB LEU 52 3.764 -17.922 7.314 388 HG LEU 52 HG LEU 52 6.088 -16.867 7.431 389 HD11 LEU 52 1HD1 LEU 52 5.476 -14.449 6.163 390 HD12 LEU 52 2HD1 LEU 52 5.125 -15.713 4.985 391 HD13 LEU 52 3HD1 LEU 52 6.726 -15.612 5.719 392 HD21 LEU 52 3HD2 LEU 52 3.537 -15.316 7.794 393 HD22 LEU 52 1HD2 LEU 52 5.106 -14.705 8.320 394 HD23 LEU 52 2HD2 LEU 52 4.466 -16.198 9.007 395 H SER 53 H SER 53 5.779 -20.937 5.206 396 HA SER 53 HA SER 53 3.344 -22.369 5.431 397 HB2 SER 53 2HB SER 53 5.070 -23.318 4.079 398 HB3 SER 53 3HB SER 53 6.231 -23.259 5.404 399 HG SER 53 HG SER 53 4.050 -24.996 5.025 400 H ASP 54 H ASP 54 2.771 -23.958 7.016 401 HA ASP 54 HA ASP 54 3.797 -23.308 9.701 402 HB2 ASP 54 2HB ASP 54 1.412 -22.693 9.267 403 HB3 ASP 54 3HB ASP 54 1.066 -24.400 9.000 404 H ILE 55 H ILE 55 3.248 -25.787 7.379 405 HA ILE 55 HA ILE 55 3.714 -28.014 7.334 406 HB ILE 55 HB ILE 55 5.449 -27.387 9.725 407 HG12 ILE 55 2HG1 ILE 55 6.138 -27.453 6.779 408 HG13 ILE 55 3HG1 ILE 55 5.978 -25.997 7.754 409 HG21 ILE 55 1HG2 ILE 55 6.497 -29.461 8.108 410 HG22 ILE 55 2HG2 ILE 55 5.931 -29.550 9.775 411 HG23 ILE 55 3HG2 ILE 55 4.809 -29.843 8.446 412 HD11 ILE 55 3HD1 ILE 55 8.201 -27.864 7.516 413 HD12 ILE 55 1HD1 ILE 55 8.182 -26.173 8.016 414 HD13 ILE 55 2HD1 ILE 55 7.799 -27.441 9.180 415 H ARG 56 H ARG 56 1.573 -28.605 7.885 416 HA ARG 56 HA ARG 56 1.376 -30.283 10.159 417 HB2 ARG 56 2HB ARG 56 -0.280 -29.135 11.454 418 HB3 ARG 56 3HB ARG 56 1.075 -28.038 11.227 419 HG2 ARG 56 2HG ARG 56 -0.161 -26.924 9.413 420 HG3 ARG 56 3HG ARG 56 -1.531 -27.993 9.721 421 HD2 ARG 56 2HD ARG 56 -0.477 -26.576 12.075 422 HD3 ARG 56 3HD ARG 56 -1.214 -25.551 10.844 423 HE ARG 56 HE ARG 56 -3.274 -26.507 11.303 424 HH11 ARG 56 1HH1 ARG 56 -0.743 -28.139 13.049 425 HH12 ARG 56 2HH1 ARG 56 -1.834 -28.997 14.087 426 HH21 ARG 56 1HH2 ARG 56 -4.720 -27.631 12.662 427 HH22 ARG 56 2HH2 ARG 56 -4.096 -28.709 13.865 428 H MET 57 H MET 57 0.946 -30.272 7.263 429 HA MET 57 HA MET 57 -1.878 -31.114 7.226 430 HB2 MET 57 2HB MET 57 -1.761 -30.602 4.738 431 HB3 MET 57 3HB MET 57 -1.773 -29.217 5.822 432 HG2 MET 57 2HG MET 57 0.926 -30.017 5.338 433 HG3 MET 57 3HG MET 57 0.081 -29.831 3.803 434 HE1 MET 57 3HE MET 57 2.354 -26.660 4.811 435 HE2 MET 57 1HE MET 57 2.516 -28.404 4.608 436 HE3 MET 57 2HE MET 57 1.895 -27.417 3.285 437 HA PRO 58 HA PRO 58 -0.590 -35.119 5.976 438 HB2 PRO 58 2HB PRO 58 -2.606 -35.844 4.308 439 HB3 PRO 58 3HB PRO 58 -2.802 -35.734 6.061 440 HG2 PRO 58 2HG PRO 58 -3.568 -33.763 3.943 441 HG3 PRO 58 3HG PRO 58 -4.480 -34.278 5.373 442 HD2 PRO 58 2HD PRO 58 -3.098 -31.951 5.287 443 HD3 PRO 58 3HD PRO 58 -3.299 -32.887 6.782 444 H GLY 59 H GLY 59 -0.392 -36.533 3.907 445 HA2 GLY 59 2HA GLY 59 0.458 -36.845 1.789 446 HA3 GLY 59 3HA GLY 59 -0.052 -35.208 1.404 447 H MET 60 H MET 60 1.355 -33.441 2.040 448 HA MET 60 HA MET 60 4.122 -34.121 1.589 449 HB2 MET 60 2HB MET 60 2.490 -31.652 1.599 450 HB3 MET 60 3HB MET 60 4.183 -31.458 2.034 451 HG2 MET 60 2HG MET 60 4.727 -31.474 -0.102 452 HG3 MET 60 3HG MET 60 4.091 -33.110 -0.250 453 HE1 MET 60 3HE MET 60 3.106 -29.219 -1.479 454 HE2 MET 60 1HE MET 60 4.452 -30.310 -1.808 455 HE3 MET 60 2HE MET 60 3.109 -30.199 -2.946 456 H ASP 61 H ASP 61 5.869 -33.298 2.941 457 HA ASP 61 HA ASP 61 5.222 -33.629 5.772 458 HB2 ASP 61 2HB ASP 61 7.755 -33.843 4.170 459 HB3 ASP 61 3HB ASP 61 7.815 -33.669 5.922 460 H GLY 62 H GLY 62 4.714 -31.135 4.218 461 HA2 GLY 62 2HA GLY 62 4.682 -28.905 4.843 462 HA3 GLY 62 3HA GLY 62 5.734 -29.306 6.193 463 H LEU 63 H LEU 63 8.022 -30.066 5.330 464 HA LEU 63 HA LEU 63 9.068 -27.780 3.913 465 HB2 LEU 63 2HB LEU 63 11.257 -29.149 4.269 466 HB3 LEU 63 3HB LEU 63 10.476 -28.342 5.627 467 HG LEU 63 HG LEU 63 9.562 -30.433 6.405 468 HD11 LEU 63 1HD1 LEU 63 10.507 -32.529 5.139 469 HD12 LEU 63 2HD1 LEU 63 10.530 -31.420 3.769 470 HD13 LEU 63 3HD1 LEU 63 9.017 -31.747 4.613 471 HD21 LEU 63 3HD2 LEU 63 11.828 -31.735 6.572 472 HD22 LEU 63 1HD2 LEU 63 11.629 -30.175 7.372 473 HD23 LEU 63 2HD2 LEU 63 12.484 -30.274 5.832 474 H ALA 64 H ALA 64 7.980 -30.874 3.081 475 HA ALA 64 HA ALA 64 9.614 -31.779 1.084 476 HB1 ALA 64 1HB ALA 64 7.748 -32.921 0.171 477 HB2 ALA 64 2HB ALA 64 7.479 -32.827 1.912 478 HB3 ALA 64 3HB ALA 64 6.616 -31.738 0.827 479 H LEU 65 H LEU 65 6.901 -29.506 0.618 480 HA LEU 65 HA LEU 65 7.697 -28.921 -2.077 481 HB2 LEU 65 2HB LEU 65 5.719 -27.854 -2.270 482 HB3 LEU 65 3HB LEU 65 5.344 -28.802 -0.833 483 HG LEU 65 HG LEU 65 6.281 -25.936 -0.782 484 HD11 LEU 65 1HD1 LEU 65 3.542 -26.482 0.031 485 HD12 LEU 65 2HD1 LEU 65 3.836 -26.823 -1.674 486 HD13 LEU 65 3HD1 LEU 65 4.183 -25.221 -1.023 487 HD21 LEU 65 3HD2 LEU 65 6.468 -27.722 1.208 488 HD22 LEU 65 1HD2 LEU 65 4.808 -27.181 1.456 489 HD23 LEU 65 2HD2 LEU 65 6.128 -26.011 1.473 490 H LEU 66 H LEU 66 8.393 -27.647 1.049 491 HA LEU 66 HA LEU 66 9.166 -25.028 0.243 492 HB2 LEU 66 2HB LEU 66 8.714 -26.229 2.629 493 HB3 LEU 66 3HB LEU 66 10.475 -26.189 2.608 494 HG LEU 66 HG LEU 66 9.716 -24.265 3.786 495 HD11 LEU 66 1HD1 LEU 66 10.527 -23.482 0.990 496 HD12 LEU 66 2HD1 LEU 66 11.615 -23.900 2.312 497 HD13 LEU 66 3HD1 LEU 66 10.618 -22.450 2.417 498 HD21 LEU 66 3HD2 LEU 66 7.623 -24.289 1.787 499 HD22 LEU 66 1HD2 LEU 66 8.331 -22.685 1.975 500 HD23 LEU 66 2HD2 LEU 66 7.660 -23.521 3.375 501 H LYS 67 H LYS 67 10.680 -28.118 0.133 502 HA LYS 67 HA LYS 67 13.387 -27.238 0.088 503 HB2 LYS 67 2HB LYS 67 11.937 -29.751 -0.256 504 HB3 LYS 67 3HB LYS 67 13.338 -29.624 -1.312 505 HG2 LYS 67 2HG LYS 67 14.069 -30.688 0.662 506 HG3 LYS 67 3HG LYS 67 14.688 -29.036 0.725 507 HD2 LYS 67 2HD LYS 67 12.613 -28.484 2.096 508 HD3 LYS 67 3HD LYS 67 12.382 -30.228 2.244 509 HE2 LYS 67 2HE LYS 67 14.860 -28.721 3.075 510 HE3 LYS 67 3HE LYS 67 13.584 -29.256 4.167 511 HZ1 LYS 67 3HZ LYS 67 15.798 -30.701 3.254 512 HZ2 LYS 67 1HZ LYS 67 14.411 -31.449 2.639 513 HZ3 LYS 67 2HZ LYS 67 14.576 -31.213 4.306 514 H GLN 68 H GLN 68 10.869 -27.473 -2.290 515 HA GLN 68 HA GLN 68 12.693 -27.193 -4.526 516 HB2 GLN 68 2HB GLN 68 10.889 -27.607 -5.901 517 HB3 GLN 68 3HB GLN 68 10.397 -28.457 -4.442 518 HG2 GLN 68 2HG GLN 68 9.335 -26.046 -3.940 519 HG3 GLN 68 3HG GLN 68 9.277 -26.042 -5.702 520 HE21 GLN 68 1HE2 GLN 68 7.086 -26.108 -3.813 521 HE22 GLN 68 2HE2 GLN 68 6.193 -27.549 -4.148 522 H ILE 69 H ILE 69 10.848 -25.177 -2.432 523 HA ILE 69 HA ILE 69 10.454 -22.935 -4.065 524 HB ILE 69 HB ILE 69 10.853 -23.129 -1.081 525 HG12 ILE 69 2HG1 ILE 69 8.359 -22.684 -2.736 526 HG13 ILE 69 3HG1 ILE 69 8.843 -24.232 -2.052 527 HG21 ILE 69 1HG2 ILE 69 11.424 -20.916 -1.499 528 HG22 ILE 69 2HG2 ILE 69 10.275 -20.767 -2.827 529 HG23 ILE 69 3HG2 ILE 69 9.696 -20.826 -1.163 530 HD11 ILE 69 3HD1 ILE 69 7.382 -22.095 -0.847 531 HD12 ILE 69 1HD1 ILE 69 7.717 -23.711 -0.226 532 HD13 ILE 69 2HD1 ILE 69 8.858 -22.398 0.068 533 H LYS 70 H LYS 70 13.287 -24.144 -2.468 534 HA LYS 70 HA LYS 70 14.773 -21.685 -2.675 535 HB2 LYS 70 2HB LYS 70 15.778 -24.484 -2.131 536 HB3 LYS 70 3HB LYS 70 16.661 -22.987 -1.860 537 HG2 LYS 70 2HG LYS 70 14.056 -23.530 -0.485 538 HG3 LYS 70 3HG LYS 70 15.585 -24.138 0.153 539 HD2 LYS 70 2HD LYS 70 16.368 -22.033 0.652 540 HD3 LYS 70 3HD LYS 70 15.373 -21.255 -0.581 541 HE2 LYS 70 2HE LYS 70 14.334 -22.467 1.978 542 HE3 LYS 70 3HE LYS 70 14.629 -20.748 1.719 543 HZ1 LYS 70 3HZ LYS 70 12.349 -21.090 1.342 544 HZ2 LYS 70 1HZ LYS 70 12.614 -22.466 0.394 545 HZ3 LYS 70 2HZ LYS 70 13.032 -20.939 -0.198 546 H GLN 71 H GLN 71 14.180 -24.453 -4.659 547 HA GLN 71 HA GLN 71 16.427 -23.884 -6.417 548 HB2 GLN 71 2HB GLN 71 15.259 -26.220 -5.745 549 HB3 GLN 71 3HB GLN 71 14.373 -25.860 -7.221 550 HG2 GLN 71 2HG GLN 71 16.122 -27.097 -8.027 551 HG3 GLN 71 3HG GLN 71 16.737 -25.457 -8.221 552 HE21 GLN 71 1HE2 GLN 71 17.582 -28.445 -7.296 553 HE22 GLN 71 2HE2 GLN 71 18.848 -28.080 -6.180 554 H ARG 72 H ARG 72 12.928 -23.589 -6.347 555 HA ARG 72 HA ARG 72 12.852 -22.584 -9.076 556 HB2 ARG 72 2HB ARG 72 10.950 -23.721 -7.218 557 HB3 ARG 72 3HB ARG 72 10.341 -22.213 -7.885 558 HG2 ARG 72 2HG ARG 72 11.108 -23.277 -10.157 559 HG3 ARG 72 3HG ARG 72 10.953 -24.782 -9.249 560 HD2 ARG 72 2HD ARG 72 8.652 -24.285 -8.732 561 HD3 ARG 72 3HD ARG 72 8.790 -22.696 -9.483 562 HE ARG 72 HE ARG 72 8.324 -25.185 -10.804 563 HH11 ARG 72 1HH1 ARG 72 9.753 -22.031 -11.163 564 HH12 ARG 72 2HH1 ARG 72 9.599 -22.014 -12.889 565 HH21 ARG 72 1HH2 ARG 72 8.115 -25.175 -13.075 566 HH22 ARG 72 2HH2 ARG 72 8.666 -23.802 -13.975 567 H HIS 73 H HIS 73 12.851 -21.402 -5.815 568 HA HIS 73 HA HIS 73 12.940 -18.667 -6.826 569 HB2 HIS 73 2HB HIS 73 11.182 -19.306 -4.468 570 HB3 HIS 73 3HB HIS 73 11.243 -17.825 -5.418 571 HD1 HIS 73 HD1 HIS 73 10.167 -17.959 -7.845 572 HD2 HIS 73 HD2 HIS 73 9.404 -21.200 -5.359 573 HE1 HIS 73 HE1 HIS 73 8.240 -19.179 -8.903 574 HA PRO 74 HA PRO 74 16.117 -19.597 -3.583 575 HB2 PRO 74 2HB PRO 74 18.168 -18.444 -4.939 576 HB3 PRO 74 3HB PRO 74 17.680 -20.125 -5.183 577 HG2 PRO 74 2HG PRO 74 17.019 -17.705 -6.816 578 HG3 PRO 74 3HG PRO 74 17.487 -19.327 -7.358 579 HD2 PRO 74 2HD PRO 74 14.914 -18.483 -7.340 580 HD3 PRO 74 3HD PRO 74 15.365 -20.177 -7.058 581 H MET 75 H MET 75 15.763 -16.654 -5.558 582 HA MET 75 HA MET 75 16.801 -14.930 -3.531 583 HB2 MET 75 2HB MET 75 16.786 -14.495 -6.037 584 HB3 MET 75 3HB MET 75 15.080 -14.106 -5.866 585 HG2 MET 75 2HG MET 75 16.267 -12.582 -3.910 586 HG3 MET 75 3HG MET 75 17.429 -12.524 -5.233 587 HE1 MET 75 3HE MET 75 13.694 -12.897 -4.915 588 HE2 MET 75 1HE MET 75 13.634 -11.284 -4.204 589 HE3 MET 75 2HE MET 75 12.996 -11.556 -5.825 590 H LEU 76 H LEU 76 13.912 -16.553 -3.806 591 HA LEU 76 HA LEU 76 12.285 -14.490 -2.550 592 HB2 LEU 76 2HB LEU 76 11.150 -15.736 -4.208 593 HB3 LEU 76 3HB LEU 76 11.712 -17.268 -3.543 594 HG LEU 76 HG LEU 76 10.273 -16.855 -1.550 595 HD11 LEU 76 1HD1 LEU 76 9.946 -14.559 -1.448 596 HD12 LEU 76 2HD1 LEU 76 8.394 -15.161 -2.029 597 HD13 LEU 76 3HD1 LEU 76 9.539 -14.440 -3.160 598 HD21 LEU 76 3HD2 LEU 76 8.076 -17.052 -2.982 599 HD22 LEU 76 1HD2 LEU 76 9.275 -18.345 -2.973 600 HD23 LEU 76 2HD2 LEU 76 9.223 -17.201 -4.314 601 HA PRO 77 HA PRO 77 13.621 -16.089 1.426 602 HB2 PRO 77 2HB PRO 77 12.415 -14.137 2.878 603 HB3 PRO 77 3HB PRO 77 13.956 -13.902 2.045 604 HG2 PRO 77 2HG PRO 77 11.201 -13.100 1.192 605 HG3 PRO 77 3HG PRO 77 12.715 -12.182 1.093 606 HD2 PRO 77 2HD PRO 77 11.651 -13.471 -1.037 607 HD3 PRO 77 3HD PRO 77 13.402 -13.278 -0.815 608 H VAL 78 H VAL 78 12.651 -17.488 2.781 609 HA VAL 78 HA VAL 78 9.711 -17.473 2.942 610 HB VAL 78 HB VAL 78 11.378 -19.986 2.826 611 HG11 VAL 78 1HG1 VAL 78 8.934 -20.792 2.190 612 HG12 VAL 78 2HG1 VAL 78 9.465 -20.658 3.868 613 HG13 VAL 78 3HG1 VAL 78 8.490 -19.378 3.145 614 HG21 VAL 78 3HG2 VAL 78 9.703 -18.760 0.635 615 HG22 VAL 78 1HG2 VAL 78 11.466 -18.770 0.686 616 HG23 VAL 78 2HG2 VAL 78 10.579 -20.289 0.555 617 H ILE 79 H ILE 79 8.839 -18.511 4.858 618 HA ILE 79 HA ILE 79 10.746 -18.656 7.095 619 HB ILE 79 HB ILE 79 7.988 -17.472 7.358 620 HG12 ILE 79 2HG1 ILE 79 10.603 -15.965 7.161 621 HG13 ILE 79 3HG1 ILE 79 9.449 -16.114 5.840 622 HG21 ILE 79 1HG2 ILE 79 8.829 -16.654 9.492 623 HG22 ILE 79 2HG2 ILE 79 8.978 -18.408 9.390 624 HG23 ILE 79 3HG2 ILE 79 10.399 -17.387 9.167 625 HD11 ILE 79 3HD1 ILE 79 9.500 -14.236 7.971 626 HD12 ILE 79 1HD1 ILE 79 8.402 -14.325 6.595 627 HD13 ILE 79 2HD1 ILE 79 8.021 -15.189 8.085 628 H ILE 80 H ILE 80 10.275 -20.136 8.714 629 HA ILE 80 HA ILE 80 8.151 -22.065 8.047 630 HB ILE 80 HB ILE 80 10.660 -22.584 9.644 631 HG12 ILE 80 2HG1 ILE 80 10.939 -22.070 7.148 632 HG13 ILE 80 3HG1 ILE 80 11.619 -23.584 7.733 633 HG21 ILE 80 1HG2 ILE 80 9.968 -24.993 9.099 634 HG22 ILE 80 2HG2 ILE 80 9.069 -24.136 10.351 635 HG23 ILE 80 3HG2 ILE 80 8.384 -24.309 8.735 636 HD11 ILE 80 3HD1 ILE 80 10.249 -24.824 6.474 637 HD12 ILE 80 1HD1 ILE 80 8.862 -23.774 6.764 638 HD13 ILE 80 2HD1 ILE 80 10.057 -23.339 5.542 639 H MET 81 H MET 81 6.729 -22.733 9.600 640 HA MET 81 HA MET 81 6.954 -21.436 12.237 641 HB2 MET 81 2HB MET 81 4.649 -21.658 10.361 642 HB3 MET 81 3HB MET 81 4.317 -21.731 12.086 643 HG2 MET 81 2HG MET 81 4.316 -19.523 12.112 644 HG3 MET 81 3HG MET 81 6.043 -19.567 11.764 645 HE1 MET 81 3HE MET 81 2.711 -19.193 8.617 646 HE2 MET 81 1HE MET 81 3.326 -20.797 9.015 647 HE3 MET 81 2HE MET 81 2.545 -19.820 10.257 648 H THR 82 H THR 82 7.088 -22.807 13.879 649 HA THR 82 HA THR 82 5.462 -25.032 14.297 650 HB THR 82 HB THR 82 6.431 -26.351 12.668 651 HG1 THR 82 HG1 THR 82 8.444 -27.087 14.391 652 HG21 THR 82 3HG2 THR 82 8.169 -25.433 11.593 653 HG22 THR 82 1HG2 THR 82 9.184 -26.249 12.782 654 HG23 THR 82 2HG2 THR 82 8.709 -24.569 13.032 655 H ALA 83 H ALA 83 8.930 -25.282 14.779 656 HA ALA 83 HA ALA 83 10.228 -25.258 16.649 657 HB1 ALA 83 1HB ALA 83 9.179 -23.599 18.490 658 HB2 ALA 83 2HB ALA 83 10.103 -23.050 17.091 659 HB3 ALA 83 3HB ALA 83 8.340 -23.031 17.047 660 H HIS 84 H HIS 84 9.315 -27.508 16.835 661 HA HIS 84 HA HIS 84 8.744 -28.102 19.510 662 HB2 HIS 84 2HB HIS 84 6.438 -28.941 19.325 663 HB3 HIS 84 3HB HIS 84 6.519 -27.207 19.027 664 HD1 HIS 84 HD1 HIS 84 6.106 -30.474 17.178 665 HD2 HIS 84 HD2 HIS 84 5.567 -26.398 16.583 666 HE1 HIS 84 HE1 HIS 84 4.894 -30.270 14.984 667 H SER 85 H SER 85 8.545 -29.083 16.148 668 HA SER 85 HA SER 85 9.965 -31.514 16.714 669 HB2 SER 85 2HB SER 85 7.641 -32.184 17.256 670 HB3 SER 85 3HB SER 85 7.146 -31.726 15.627 671 HG SER 85 HG SER 85 7.641 -33.726 15.192 672 H ASP 86 H ASP 86 10.169 -29.074 15.070 673 HA ASP 86 HA ASP 86 10.744 -30.406 12.529 674 HB2 ASP 86 2HB ASP 86 8.668 -28.433 12.932 675 HB3 ASP 86 3HB ASP 86 9.880 -27.838 11.801 676 H LEU 87 H LEU 87 11.139 -27.572 14.593 677 HA LEU 87 HA LEU 87 13.085 -26.175 13.251 678 HB2 LEU 87 2HB LEU 87 12.217 -26.441 16.018 679 HB3 LEU 87 3HB LEU 87 13.921 -26.017 15.873 680 HG LEU 87 HG LEU 87 13.339 -24.032 14.594 681 HD11 LEU 87 1HD1 LEU 87 10.818 -25.390 14.330 682 HD12 LEU 87 2HD1 LEU 87 11.440 -23.994 13.450 683 HD13 LEU 87 3HD1 LEU 87 10.586 -23.765 14.976 684 HD21 LEU 87 3HD2 LEU 87 11.971 -22.869 16.400 685 HD22 LEU 87 1HD2 LEU 87 13.483 -23.626 16.902 686 HD23 LEU 87 2HD2 LEU 87 11.946 -24.428 17.226 687 H ASP 88 H ASP 88 13.544 -28.919 15.459 688 HA ASP 88 HA ASP 88 16.258 -29.070 15.621 689 HB2 ASP 88 2HB ASP 88 15.069 -30.692 16.826 690 HB3 ASP 88 3HB ASP 88 14.175 -31.225 15.405 691 H ALA 89 H ALA 89 14.244 -30.128 12.916 692 HA ALA 89 HA ALA 89 16.570 -30.988 11.401 693 HB1 ALA 89 1HB ALA 89 14.229 -30.945 9.791 694 HB2 ALA 89 2HB ALA 89 15.102 -32.338 10.432 695 HB3 ALA 89 3HB ALA 89 13.803 -31.603 11.372 696 H ALA 90 H ALA 90 13.996 -28.546 11.098 697 HA ALA 90 HA ALA 90 14.764 -27.330 8.752 698 HB1 ALA 90 1HB ALA 90 12.739 -26.628 9.694 699 HB2 ALA 90 2HB ALA 90 13.496 -26.212 11.232 700 HB3 ALA 90 3HB ALA 90 13.792 -25.217 9.806 701 H VAL 91 H VAL 91 16.203 -27.057 11.928 702 HA VAL 91 HA VAL 91 17.697 -24.755 11.713 703 HB VAL 91 HB VAL 91 18.337 -27.374 13.051 704 HG11 VAL 91 1HG1 VAL 91 19.983 -24.865 12.934 705 HG12 VAL 91 2HG1 VAL 91 20.105 -26.001 14.279 706 HG13 VAL 91 3HG1 VAL 91 20.487 -26.529 12.640 707 HG21 VAL 91 3HG2 VAL 91 16.566 -25.435 13.724 708 HG22 VAL 91 1HG2 VAL 91 17.354 -26.507 14.881 709 HG23 VAL 91 2HG2 VAL 91 18.002 -24.893 14.593 710 H SER 92 H SER 92 18.761 -28.034 10.792 711 HA SER 92 HA SER 92 21.052 -26.933 9.388 712 HB2 SER 92 2HB SER 92 21.536 -28.925 10.584 713 HB3 SER 92 3HB SER 92 20.112 -29.746 9.946 714 HG SER 92 HG SER 92 22.420 -30.045 8.998 715 H ALA 93 H ALA 93 18.088 -28.717 8.625 716 HA ALA 93 HA ALA 93 18.516 -28.989 5.866 717 HB1 ALA 93 1HB ALA 93 16.829 -30.321 6.807 718 HB2 ALA 93 2HB ALA 93 16.019 -28.933 7.533 719 HB3 ALA 93 3HB ALA 93 15.977 -29.163 5.785 720 H TYR 94 H TYR 94 16.334 -26.672 7.488 721 HA TYR 94 HA TYR 94 15.813 -25.100 5.253 722 HB2 TYR 94 2HB TYR 94 14.797 -25.106 7.690 723 HB3 TYR 94 3HB TYR 94 15.970 -23.820 7.951 724 HD1 TYR 94 HD2 TYR 94 13.975 -24.569 4.899 725 HD2 TYR 94 HD1 TYR 94 14.664 -21.893 8.134 726 HE1 TYR 94 HE2 TYR 94 12.423 -22.953 3.885 727 HE2 TYR 94 HE1 TYR 94 13.113 -20.270 7.130 728 HH TYR 94 HH TYR 94 10.992 -20.584 5.392 729 H GLN 95 H GLN 95 18.654 -25.339 7.136 730 HA GLN 95 HA GLN 95 19.701 -22.735 6.687 731 HB2 GLN 95 2HB GLN 95 20.577 -25.204 7.928 732 HB3 GLN 95 3HB GLN 95 21.874 -24.464 6.999 733 HG2 GLN 95 2HG GLN 95 20.249 -22.925 8.996 734 HG3 GLN 95 3HG GLN 95 21.696 -23.827 9.442 735 HE21 GLN 95 1HE2 GLN 95 22.926 -22.090 10.006 736 HE22 GLN 95 2HE2 GLN 95 23.473 -20.900 8.879 737 H GLN 96 H GLN 96 18.924 -24.979 4.489 738 HA GLN 96 HA GLN 96 21.246 -25.065 2.842 739 HB2 GLN 96 2HB GLN 96 18.367 -25.798 2.496 740 HB3 GLN 96 3HB GLN 96 19.401 -25.696 1.076 741 HG2 GLN 96 2HG GLN 96 20.822 -27.408 1.872 742 HG3 GLN 96 3HG GLN 96 20.090 -27.365 3.474 743 HE21 GLN 96 1HE2 GLN 96 20.276 -29.140 0.783 744 HE22 GLN 96 2HE2 GLN 96 18.740 -29.931 0.819 745 H GLY 97 H GLY 97 20.067 -22.400 3.733 746 HA2 GLY 97 2HA GLY 97 20.673 -20.391 2.512 747 HA3 GLY 97 3HA GLY 97 20.096 -21.175 1.049 748 H ALA 98 H ALA 98 18.394 -21.256 4.115 749 HA ALA 98 HA ALA 98 16.209 -19.746 2.854 750 HB1 ALA 98 1HB ALA 98 15.781 -21.281 5.362 751 HB2 ALA 98 2HB ALA 98 14.695 -21.014 3.998 752 HB3 ALA 98 3HB ALA 98 16.011 -22.181 3.862 753 H PHE 99 H PHE 99 14.833 -18.488 4.449 754 HA PHE 99 HA PHE 99 16.590 -16.722 5.934 755 HB2 PHE 99 2HB PHE 99 14.981 -15.610 4.575 756 HB3 PHE 99 3HB PHE 99 13.665 -16.594 5.207 757 HD1 PHE 99 HD1 PHE 99 15.977 -13.836 5.946 758 HD2 PHE 99 HD2 PHE 99 12.591 -16.053 7.264 759 HE1 PHE 99 HE1 PHE 99 15.517 -12.117 7.645 760 HE2 PHE 99 HE2 PHE 99 12.126 -14.337 8.965 761 HZ PHE 99 HZ PHE 99 13.589 -12.366 9.157 762 H ASP 100 H ASP 100 16.316 -16.171 8.127 763 HA ASP 100 HA ASP 100 16.036 -18.214 9.927 764 HB2 ASP 100 2HB ASP 100 16.995 -15.958 10.411 765 HB3 ASP 100 3HB ASP 100 15.354 -15.323 10.499 766 H TYR 101 H TYR 101 14.359 -19.510 10.252 767 HA TYR 101 HA TYR 101 11.689 -18.849 9.594 768 HB2 TYR 101 2HB TYR 101 11.189 -20.984 10.935 769 HB3 TYR 101 3HB TYR 101 12.209 -21.140 9.509 770 HD1 TYR 101 HD1 TYR 101 12.771 -20.262 13.106 771 HD2 TYR 101 HD2 TYR 101 13.916 -22.655 9.780 772 HE1 TYR 101 HE1 TYR 101 14.515 -21.323 14.478 773 HE2 TYR 101 HE2 TYR 101 15.662 -23.724 11.143 774 HH TYR 101 HH TYR 101 15.768 -23.603 14.421 775 H LEU 102 H LEU 102 9.876 -19.137 11.243 776 HA LEU 102 HA LEU 102 10.565 -17.787 13.766 777 HB2 LEU 102 2HB LEU 102 9.555 -16.046 12.672 778 HB3 LEU 102 3HB LEU 102 8.510 -17.105 11.729 779 HG LEU 102 HG LEU 102 7.263 -17.526 13.927 780 HD11 LEU 102 1HD1 LEU 102 8.267 -16.666 15.726 781 HD12 LEU 102 2HD1 LEU 102 7.609 -15.122 15.187 782 HD13 LEU 102 3HD1 LEU 102 9.261 -15.571 14.765 783 HD21 LEU 102 3HD2 LEU 102 6.296 -15.037 13.677 784 HD22 LEU 102 1HD2 LEU 102 5.956 -16.329 12.525 785 HD23 LEU 102 2HD2 LEU 102 7.219 -15.147 12.177 786 HA PRO 103 HA PRO 103 8.479 -21.304 15.490 787 HB2 PRO 103 2HB PRO 103 8.539 -20.463 18.070 788 HB3 PRO 103 3HB PRO 103 9.955 -21.119 17.240 789 HG2 PRO 103 2HG PRO 103 9.206 -18.264 17.741 790 HG3 PRO 103 3HG PRO 103 10.790 -19.048 17.891 791 HD2 PRO 103 2HD PRO 103 10.104 -17.550 15.742 792 HD3 PRO 103 3HD PRO 103 11.196 -18.945 15.625 793 H LYS 104 H LYS 104 6.479 -21.806 16.475 794 HA LYS 104 HA LYS 104 4.599 -19.550 16.712 795 HB2 LYS 104 2HB LYS 104 2.851 -20.952 15.728 796 HB3 LYS 104 3HB LYS 104 4.197 -20.749 14.614 797 HG2 LYS 104 2HG LYS 104 4.465 -22.939 14.461 798 HG3 LYS 104 3HG LYS 104 4.613 -23.087 16.214 799 HD2 LYS 104 2HD LYS 104 1.976 -22.886 14.768 800 HD3 LYS 104 3HD LYS 104 2.746 -24.417 15.191 801 HE2 LYS 104 2HE LYS 104 2.179 -22.294 17.240 802 HE3 LYS 104 3HE LYS 104 0.976 -23.503 16.791 803 HZ1 LYS 104 3HZ LYS 104 2.986 -25.105 17.274 804 HZ2 LYS 104 1HZ LYS 104 1.974 -24.562 18.517 805 HZ3 LYS 104 2HZ LYS 104 3.478 -23.829 18.269 806 HA PRO 105 HA PRO 105 2.486 -19.264 17.274 807 HB2 PRO 105 2HB PRO 105 1.771 -17.807 19.451 808 HB3 PRO 105 3HB PRO 105 0.851 -19.207 18.887 809 HG2 PRO 105 2HG PRO 105 2.858 -19.025 21.101 810 HG3 PRO 105 3HG PRO 105 1.298 -19.868 21.072 811 HD2 PRO 105 2HD PRO 105 3.655 -21.153 20.719 812 HD3 PRO 105 3HD PRO 105 2.154 -21.676 19.928 813 H PHE 106 H PHE 106 2.639 -16.737 17.709 814 HA PHE 106 HA PHE 106 5.181 -15.869 18.758 815 HB2 PHE 106 2HB PHE 106 5.909 -14.859 16.584 816 HB3 PHE 106 3HB PHE 106 5.950 -16.619 16.605 817 HD1 PHE 106 HD2 PHE 106 3.786 -13.766 15.596 818 HD2 PHE 106 HD1 PHE 106 4.921 -17.812 14.914 819 HE1 PHE 106 HE2 PHE 106 2.381 -13.817 13.577 820 HE2 PHE 106 HE1 PHE 106 3.519 -17.868 12.893 821 HZ PHE 106 HZ PHE 106 2.245 -15.870 12.223 822 H ASP 107 H ASP 107 5.480 -13.436 18.189 823 HA ASP 107 HA ASP 107 2.943 -12.143 18.813 824 HB2 ASP 107 2HB ASP 107 5.668 -10.850 18.710 825 HB3 ASP 107 3HB ASP 107 4.229 -10.271 19.544 826 H ILE 108 H ILE 108 1.743 -11.394 17.206 827 HA ILE 108 HA ILE 108 2.374 -11.203 14.555 828 HB ILE 108 HB ILE 108 0.414 -9.594 16.176 829 HG12 ILE 108 2HG1 ILE 108 -0.285 -11.556 14.032 830 HG13 ILE 108 3HG1 ILE 108 0.275 -12.166 15.585 831 HG21 ILE 108 1HG2 ILE 108 0.915 -9.507 13.211 832 HG22 ILE 108 2HG2 ILE 108 -0.597 -8.982 13.949 833 HG23 ILE 108 3HG2 ILE 108 0.912 -8.164 14.353 834 HD11 ILE 108 3HD1 ILE 108 -1.672 -10.207 16.126 835 HD12 ILE 108 1HD1 ILE 108 -2.310 -11.240 14.847 836 HD13 ILE 108 2HD1 ILE 108 -1.775 -11.950 16.371 837 H ASP 109 H ASP 109 3.060 -8.888 17.086 838 HA ASP 109 HA ASP 109 3.687 -6.660 15.506 839 HB2 ASP 109 2HB ASP 109 3.407 -6.717 18.021 840 HB3 ASP 109 3HB ASP 109 5.033 -7.389 18.110 841 H GLU 110 H GLU 110 5.683 -9.369 16.603 842 HA GLU 110 HA GLU 110 8.063 -8.335 15.359 843 HB2 GLU 110 2HB GLU 110 7.346 -10.627 17.047 844 HB3 GLU 110 3HB GLU 110 8.584 -10.981 15.851 845 HG2 GLU 110 2HG GLU 110 9.544 -8.672 16.811 846 HG3 GLU 110 3HG GLU 110 8.689 -9.256 18.238 847 H ALA 111 H ALA 111 5.524 -10.596 14.541 848 HA ALA 111 HA ALA 111 6.805 -11.840 12.348 849 HB1 ALA 111 1HB ALA 111 4.219 -11.901 13.592 850 HB2 ALA 111 2HB ALA 111 4.049 -11.841 11.837 851 HB3 ALA 111 3HB ALA 111 5.006 -13.118 12.587 852 H VAL 112 H VAL 112 4.300 -9.295 12.396 853 HA VAL 112 HA VAL 112 4.203 -8.729 9.704 854 HB VAL 112 HB VAL 112 3.856 -6.920 12.085 855 HG11 VAL 112 1HG1 VAL 112 3.701 -6.260 9.167 856 HG12 VAL 112 2HG1 VAL 112 2.707 -5.402 10.346 857 HG13 VAL 112 3HG1 VAL 112 4.466 -5.356 10.474 858 HG21 VAL 112 3HG2 VAL 112 2.032 -8.410 10.230 859 HG22 VAL 112 1HG2 VAL 112 2.088 -8.432 11.993 860 HG23 VAL 112 2HG2 VAL 112 1.455 -7.019 11.149 861 H ALA 113 H ALA 113 6.611 -7.768 12.056 862 HA ALA 113 HA ALA 113 7.919 -5.941 10.229 863 HB1 ALA 113 1HB ALA 113 9.145 -6.893 12.784 864 HB2 ALA 113 2HB ALA 113 9.273 -5.320 11.996 865 HB3 ALA 113 3HB ALA 113 7.780 -5.777 12.816 866 H LEU 114 H LEU 114 8.262 -9.241 11.323 867 HA LEU 114 HA LEU 114 10.899 -9.721 10.497 868 HB2 LEU 114 2HB LEU 114 9.736 -11.265 11.930 869 HB3 LEU 114 3HB LEU 114 8.529 -11.572 10.683 870 HG LEU 114 HG LEU 114 10.494 -12.491 9.299 871 HD11 LEU 114 1HD1 LEU 114 11.708 -12.428 12.052 872 HD12 LEU 114 2HD1 LEU 114 12.342 -11.705 10.574 873 HD13 LEU 114 3HD1 LEU 114 12.291 -13.460 10.745 874 HD21 LEU 114 3HD2 LEU 114 10.410 -14.646 10.820 875 HD22 LEU 114 1HD2 LEU 114 9.002 -14.112 9.901 876 HD23 LEU 114 2HD2 LEU 114 9.123 -13.744 11.622 877 H VAL 115 H VAL 115 7.828 -9.950 8.761 878 HA VAL 115 HA VAL 115 8.917 -11.037 6.375 879 HB VAL 115 HB VAL 115 6.548 -11.250 6.831 880 HG11 VAL 115 1HG1 VAL 115 6.385 -8.254 6.522 881 HG12 VAL 115 2HG1 VAL 115 5.036 -9.356 6.806 882 HG13 VAL 115 3HG1 VAL 115 6.267 -9.129 8.049 883 HG21 VAL 115 3HG2 VAL 115 6.013 -9.636 4.572 884 HG22 VAL 115 1HG2 VAL 115 7.648 -10.272 4.392 885 HG23 VAL 115 2HG2 VAL 115 6.293 -11.376 4.629 886 H GLU 116 H GLU 116 8.287 -7.749 7.490 887 HA GLU 116 HA GLU 116 8.778 -6.421 5.062 888 HB2 GLU 116 2HB GLU 116 8.755 -5.640 7.938 889 HB3 GLU 116 3HB GLU 116 9.499 -4.533 6.792 890 HG2 GLU 116 2HG GLU 116 7.142 -5.151 5.554 891 HG3 GLU 116 3HG GLU 116 6.688 -5.145 7.257 892 H ARG 117 H ARG 117 10.906 -7.821 7.410 893 HA ARG 117 HA ARG 117 13.255 -6.384 6.746 894 HB2 ARG 117 2HB ARG 117 13.341 -7.502 8.800 895 HB3 ARG 117 3HB ARG 117 12.715 -8.998 8.119 896 HG2 ARG 117 2HG ARG 117 14.748 -9.720 7.500 897 HG3 ARG 117 3HG ARG 117 15.286 -8.111 7.013 898 HD2 ARG 117 2HD ARG 117 14.923 -8.145 9.841 899 HD3 ARG 117 3HD ARG 117 15.907 -9.533 9.380 900 HE ARG 117 HE ARG 117 16.913 -7.307 8.044 901 HH11 ARG 117 1HH1 ARG 117 16.554 -8.458 11.310 902 HH12 ARG 117 2HH1 ARG 117 17.950 -7.617 11.898 903 HH21 ARG 117 1HH2 ARG 117 18.753 -6.196 8.806 904 HH22 ARG 117 2HH2 ARG 117 19.200 -6.330 10.473 905 H ALA 118 H ALA 118 11.692 -9.208 5.400 906 HA ALA 118 HA ALA 118 13.943 -9.866 3.702 907 HB1 ALA 118 1HB ALA 118 11.541 -11.177 4.567 908 HB2 ALA 118 2HB ALA 118 11.675 -11.250 2.809 909 HB3 ALA 118 3HB ALA 118 12.983 -11.864 3.819 910 H ILE 119 H ILE 119 10.776 -8.345 3.395 911 HA ILE 119 HA ILE 119 10.879 -8.107 0.551 912 HB ILE 119 HB ILE 119 9.188 -6.589 2.540 913 HG12 ILE 119 2HG1 ILE 119 8.217 -8.831 0.803 914 HG13 ILE 119 3HG1 ILE 119 9.053 -9.197 2.308 915 HG21 ILE 119 1HG2 ILE 119 7.716 -6.188 0.576 916 HG22 ILE 119 2HG2 ILE 119 9.283 -5.386 0.468 917 HG23 ILE 119 3HG2 ILE 119 8.981 -6.859 -0.454 918 HD11 ILE 119 3HD1 ILE 119 6.501 -9.081 2.329 919 HD12 ILE 119 1HD1 ILE 119 7.381 -8.243 3.607 920 HD13 ILE 119 2HD1 ILE 119 6.715 -7.332 2.250 921 H SER 120 H SER 120 11.208 -5.716 3.178 922 HA SER 120 HA SER 120 11.874 -3.525 1.603 923 HB2 SER 120 2HB SER 120 12.859 -4.131 4.402 924 HB3 SER 120 3HB SER 120 12.825 -2.543 3.636 925 HG SER 120 HG SER 120 10.885 -3.770 4.979 926 H HIS 121 H HIS 121 13.769 -6.269 2.519 927 HA HIS 121 HA HIS 121 16.358 -5.302 2.302 928 HB2 HIS 121 2HB HIS 121 15.673 -7.616 3.012 929 HB3 HIS 121 3HB HIS 121 15.429 -8.002 1.311 930 HD1 HIS 121 HD1 HIS 121 17.491 -8.491 -0.091 931 HD2 HIS 121 HD2 HIS 121 18.389 -7.251 3.772 932 HE1 HIS 121 HE1 HIS 121 19.953 -8.917 0.197 933 H TYR 122 H TYR 122 13.996 -5.888 -0.167 934 HA TYR 122 HA TYR 122 16.009 -5.456 -2.262 935 HB2 TYR 122 2HB TYR 122 13.141 -6.278 -2.697 936 HB3 TYR 122 3HB TYR 122 14.496 -6.433 -3.810 937 HD1 TYR 122 HD1 TYR 122 16.484 -7.936 -2.898 938 HD2 TYR 122 HD2 TYR 122 12.456 -8.158 -1.546 939 HE1 TYR 122 HE1 TYR 122 16.886 -10.226 -2.096 940 HE2 TYR 122 HE2 TYR 122 12.847 -10.448 -0.740 941 HH TYR 122 HH TYR 122 15.317 -12.326 -1.666 942 H GLN 123 H GLN 123 13.112 -4.137 -0.825 943 HA GLN 123 HA GLN 123 13.214 -1.880 -2.711 944 HB2 GLN 123 2HB GLN 123 10.956 -2.936 -1.009 945 HB3 GLN 123 3HB GLN 123 10.882 -1.404 -1.869 946 HG2 GLN 123 2HG GLN 123 10.443 -2.389 -3.814 947 HG3 GLN 123 3HG GLN 123 11.683 -3.619 -3.573 948 HE21 GLN 123 1HE2 GLN 123 8.348 -2.830 -3.306 949 HE22 GLN 123 2HE2 GLN 123 7.792 -4.392 -2.821 950 H GLU 124 H GLU 124 15.128 -1.851 -0.780 951 HA GLU 124 HA GLU 124 14.464 -0.650 1.655 952 HB2 GLU 124 2HB GLU 124 16.830 0.137 1.675 953 HB3 GLU 124 3HB GLU 124 16.657 -1.577 1.325 954 HG2 GLU 124 2HG GLU 124 17.655 -1.371 -0.644 955 HG3 GLU 124 3HG GLU 124 16.660 0.014 -1.090 Start of MODEL 9 1 H1 MET 1 H MET 1 0.212 0.235 1.078 2 HA MET 1 HA MET 1 1.355 0.762 -1.079 3 HB2 MET 1 2HB MET 1 2.933 2.345 -0.196 4 HB3 MET 1 3HB MET 1 3.633 1.133 0.868 5 HG2 MET 1 2HG MET 1 4.996 0.377 -0.716 6 HG3 MET 1 3HG MET 1 3.715 0.348 -1.925 7 HE1 MET 1 3HE MET 1 5.381 0.961 -3.786 8 HE2 MET 1 1HE MET 1 6.384 2.411 -3.825 9 HE3 MET 1 2HE MET 1 6.762 1.108 -2.698 10 H GLN 2 H GLN 2 0.804 -1.289 -1.640 11 HA GLN 2 HA GLN 2 1.877 -3.590 -0.306 12 HB2 GLN 2 2HB GLN 2 -0.365 -3.609 -1.321 13 HB3 GLN 2 3HB GLN 2 0.354 -3.386 -2.910 14 HG2 GLN 2 2HG GLN 2 1.626 -5.618 -1.794 15 HG3 GLN 2 3HG GLN 2 -0.090 -5.799 -1.435 16 HE21 GLN 2 1HE2 GLN 2 2.337 -5.812 -3.864 17 HE22 GLN 2 2HE2 GLN 2 1.326 -6.277 -5.185 18 H ARG 3 H ARG 3 4.154 -2.904 -0.612 19 HA ARG 3 HA ARG 3 5.209 -3.311 -3.303 20 HB2 ARG 3 2HB ARG 3 7.097 -2.189 -2.635 21 HB3 ARG 3 3HB ARG 3 5.916 -1.471 -1.548 22 HG2 ARG 3 2HG ARG 3 7.810 -3.713 -0.876 23 HG3 ARG 3 3HG ARG 3 7.958 -2.030 -0.367 24 HD2 ARG 3 2HD ARG 3 5.613 -3.800 0.305 25 HD3 ARG 3 3HD ARG 3 7.004 -3.563 1.362 26 HE ARG 3 HE ARG 3 4.842 -1.724 0.900 27 HH11 ARG 3 1HH1 ARG 3 8.157 -2.060 1.910 28 HH12 ARG 3 2HH1 ARG 3 8.160 -0.596 2.836 29 HH21 ARG 3 1HH2 ARG 3 4.834 0.206 2.115 30 HH22 ARG 3 2HH2 ARG 3 6.269 0.692 2.952 31 H GLY 4 H GLY 4 4.332 -5.269 -0.867 32 HA2 GLY 4 2HA GLY 4 6.047 -7.404 -1.793 33 HA3 GLY 4 3HA GLY 4 6.326 -6.937 -0.122 34 H ILE 5 H ILE 5 4.434 -8.789 -2.238 35 HA ILE 5 HA ILE 5 2.167 -9.084 -0.479 36 HB ILE 5 HB ILE 5 2.962 -10.593 -2.970 37 HG12 ILE 5 2HG1 ILE 5 0.661 -8.680 -2.594 38 HG13 ILE 5 3HG1 ILE 5 2.256 -8.135 -3.102 39 HG21 ILE 5 1HG2 ILE 5 1.637 -12.168 -1.989 40 HG22 ILE 5 2HG2 ILE 5 0.738 -10.983 -1.042 41 HG23 ILE 5 3HG2 ILE 5 0.392 -11.184 -2.759 42 HD11 ILE 5 3HD1 ILE 5 0.148 -9.336 -4.643 43 HD12 ILE 5 1HD1 ILE 5 1.622 -8.531 -5.183 44 HD13 ILE 5 2HD1 ILE 5 1.647 -10.252 -4.798 45 H VAL 6 H VAL 6 1.757 -10.706 0.934 46 HA VAL 6 HA VAL 6 3.861 -12.745 1.275 47 HB VAL 6 HB VAL 6 2.106 -11.665 3.478 48 HG11 VAL 6 1HG1 VAL 6 4.365 -13.602 3.316 49 HG12 VAL 6 2HG1 VAL 6 4.167 -12.635 4.779 50 HG13 VAL 6 3HG1 VAL 6 2.865 -13.695 4.237 51 HG21 VAL 6 3HG2 VAL 6 4.672 -10.788 3.979 52 HG22 VAL 6 1HG2 VAL 6 4.479 -10.520 2.246 53 HG23 VAL 6 2HG2 VAL 6 3.337 -9.803 3.383 54 H TRP 7 H TRP 7 3.219 -14.762 0.946 55 HA TRP 7 HA TRP 7 0.344 -15.366 1.100 56 HB2 TRP 7 2HB TRP 7 2.576 -16.646 -0.480 57 HB3 TRP 7 3HB TRP 7 0.981 -17.374 -0.317 58 HD1 TRP 7 HD1 TRP 7 0.244 -13.859 -0.496 59 HE1 TRP 7 HE1 TRP 7 -0.309 -13.108 -2.894 60 HE3 TRP 7 HE3 TRP 7 2.040 -17.908 -3.050 61 HZ2 TRP 7 HZ2 TRP 7 -0.022 -14.100 -5.521 62 HZ3 TRP 7 HZ3 TRP 7 1.861 -17.928 -5.504 63 HH2 TRP 7 HH2 TRP 7 0.851 -16.063 -6.712 64 H VAL 8 H VAL 8 -0.392 -17.138 2.242 65 HA VAL 8 HA VAL 8 1.597 -18.529 3.914 66 HB VAL 8 HB VAL 8 -1.177 -17.789 4.841 67 HG11 VAL 8 1HG1 VAL 8 0.014 -19.758 5.868 68 HG12 VAL 8 2HG1 VAL 8 1.220 -18.616 6.464 69 HG13 VAL 8 3HG1 VAL 8 -0.458 -18.484 6.992 70 HG21 VAL 8 3HG2 VAL 8 -0.074 -16.057 6.218 71 HG22 VAL 8 1HG2 VAL 8 1.437 -16.380 5.368 72 HG23 VAL 8 2HG2 VAL 8 0.051 -15.737 4.489 73 H VAL 9 H VAL 9 1.294 -20.697 4.256 74 HA VAL 9 HA VAL 9 -1.108 -21.959 3.151 75 HB VAL 9 HB VAL 9 0.411 -22.137 1.320 76 HG11 VAL 9 1HG1 VAL 9 2.599 -23.606 2.121 77 HG12 VAL 9 2HG1 VAL 9 2.582 -21.875 1.775 78 HG13 VAL 9 3HG1 VAL 9 2.388 -22.447 3.433 79 HG21 VAL 9 3HG2 VAL 9 -0.882 -24.190 2.098 80 HG22 VAL 9 1HG2 VAL 9 0.469 -24.466 0.998 81 HG23 VAL 9 2HG2 VAL 9 0.656 -24.784 2.723 82 H ASP 10 H ASP 10 -1.711 -22.379 5.306 83 HA ASP 10 HA ASP 10 -0.130 -24.507 6.592 84 HB2 ASP 10 2HB ASP 10 -1.760 -23.081 8.496 85 HB3 ASP 10 3HB ASP 10 -0.019 -23.351 8.504 86 H ASP 11 H ASP 11 -1.271 -26.178 7.578 87 HA ASP 11 HA ASP 11 -3.946 -26.579 6.522 88 HB2 ASP 11 2HB ASP 11 -1.758 -28.263 7.209 89 HB3 ASP 11 3HB ASP 11 -3.128 -28.731 8.213 90 H ASP 12 H ASP 12 -2.925 -24.916 9.038 91 HA ASP 12 HA ASP 12 -5.008 -25.903 10.872 92 HB2 ASP 12 2HB ASP 12 -2.321 -24.735 11.307 93 HB3 ASP 12 3HB ASP 12 -3.582 -24.206 12.418 94 H SER 13 H SER 13 -6.507 -24.481 11.724 95 HA SER 13 HA SER 13 -7.124 -22.210 10.093 96 HB2 SER 13 2HB SER 13 -8.604 -23.915 11.666 97 HB3 SER 13 3HB SER 13 -8.590 -22.435 12.625 98 HG SER 13 HG SER 13 -9.927 -22.990 10.332 99 H SER 14 H SER 14 -6.204 -22.637 13.502 100 HA SER 14 HA SER 14 -6.140 -19.878 14.116 101 HB2 SER 14 2HB SER 14 -4.378 -21.034 15.894 102 HB3 SER 14 3HB SER 14 -6.123 -20.918 16.118 103 HG SER 14 HG SER 14 -6.347 -22.988 15.612 104 H ILE 15 H ILE 15 -3.986 -21.908 12.408 105 HA ILE 15 HA ILE 15 -1.642 -20.274 12.871 106 HB ILE 15 HB ILE 15 -2.111 -22.582 10.982 107 HG12 ILE 15 2HG1 ILE 15 -2.121 -23.221 13.341 108 HG13 ILE 15 3HG1 ILE 15 -0.662 -23.813 12.554 109 HG21 ILE 15 1HG2 ILE 15 -0.424 -21.116 10.059 110 HG22 ILE 15 2HG2 ILE 15 0.427 -21.078 11.602 111 HG23 ILE 15 3HG2 ILE 15 0.337 -22.580 10.682 112 HD11 ILE 15 3HD1 ILE 15 -0.880 -21.399 14.335 113 HD12 ILE 15 1HD1 ILE 15 -0.141 -22.948 14.740 114 HD13 ILE 15 2HD1 ILE 15 0.584 -21.921 13.502 115 H ARG 16 H ARG 16 -3.875 -20.932 10.193 116 HA ARG 16 HA ARG 16 -2.593 -19.028 8.457 117 HB2 ARG 16 2HB ARG 16 -4.199 -19.643 6.833 118 HB3 ARG 16 3HB ARG 16 -3.825 -21.120 7.710 119 HG2 ARG 16 2HG ARG 16 -5.872 -20.755 9.074 120 HG3 ARG 16 3HG ARG 16 -6.265 -19.389 8.027 121 HD2 ARG 16 2HD ARG 16 -5.642 -21.710 6.451 122 HD3 ARG 16 3HD ARG 16 -6.895 -22.093 7.630 123 HE ARG 16 HE ARG 16 -7.362 -19.646 6.194 124 HH11 ARG 16 1HH1 ARG 16 -7.775 -23.103 6.178 125 HH12 ARG 16 2HH1 ARG 16 -9.136 -23.067 5.108 126 HH21 ARG 16 1HH2 ARG 16 -9.154 -19.585 4.784 127 HH22 ARG 16 2HH2 ARG 16 -9.919 -21.065 4.314 128 H TRP 17 H TRP 17 -5.170 -19.005 10.769 129 HA TRP 17 HA TRP 17 -6.557 -16.720 9.852 130 HB2 TRP 17 2HB TRP 17 -7.737 -18.023 11.399 131 HB3 TRP 17 3HB TRP 17 -6.366 -18.125 12.501 132 HD1 TRP 17 HD1 TRP 17 -9.020 -15.577 11.319 133 HE1 TRP 17 HE1 TRP 17 -9.377 -13.862 13.205 134 HE3 TRP 17 HE3 TRP 17 -5.393 -17.161 14.554 135 HZ2 TRP 17 HZ2 TRP 17 -8.267 -13.260 15.730 136 HZ3 TRP 17 HZ3 TRP 17 -5.105 -15.962 16.683 137 HH2 TRP 17 HH2 TRP 17 -6.513 -14.051 17.257 138 H VAL 18 H VAL 18 -4.444 -16.954 12.720 139 HA VAL 18 HA VAL 18 -4.135 -14.277 13.228 140 HB VAL 18 HB VAL 18 -3.252 -15.807 14.805 141 HG11 VAL 18 1HG1 VAL 18 -1.770 -17.523 14.399 142 HG12 VAL 18 2HG1 VAL 18 -2.659 -17.467 12.875 143 HG13 VAL 18 3HG1 VAL 18 -1.063 -16.724 12.995 144 HG21 VAL 18 3HG2 VAL 18 -0.612 -14.893 13.937 145 HG22 VAL 18 1HG2 VAL 18 -1.839 -13.627 13.959 146 HG23 VAL 18 2HG2 VAL 18 -1.500 -14.551 15.422 147 H LEU 19 H LEU 19 -2.098 -16.284 11.111 148 HA LEU 19 HA LEU 19 -0.283 -14.321 10.335 149 HB2 LEU 19 2HB LEU 19 -1.318 -16.780 8.963 150 HB3 LEU 19 3HB LEU 19 -0.120 -15.736 8.202 151 HG LEU 19 HG LEU 19 0.328 -16.979 10.903 152 HD11 LEU 19 1HD1 LEU 19 1.439 -18.142 8.386 153 HD12 LEU 19 2HD1 LEU 19 -0.161 -18.620 8.952 154 HD13 LEU 19 3HD1 LEU 19 1.250 -18.880 9.977 155 HD21 LEU 19 3HD2 LEU 19 2.595 -16.454 10.545 156 HD22 LEU 19 1HD2 LEU 19 1.699 -15.016 10.055 157 HD23 LEU 19 2HD2 LEU 19 2.332 -16.119 8.833 158 H GLU 20 H GLU 20 -3.584 -14.776 9.448 159 HA GLU 20 HA GLU 20 -3.438 -13.181 7.049 160 HB2 GLU 20 2HB GLU 20 -5.183 -15.074 7.890 161 HB3 GLU 20 3HB GLU 20 -6.063 -13.619 8.336 162 HG2 GLU 20 2HG GLU 20 -5.054 -13.267 5.709 163 HG3 GLU 20 3HG GLU 20 -5.837 -14.844 5.795 164 H ARG 21 H ARG 21 -4.416 -12.737 10.403 165 HA ARG 21 HA ARG 21 -5.622 -10.225 10.174 166 HB2 ARG 21 2HB ARG 21 -3.992 -11.144 12.541 167 HB3 ARG 21 3HB ARG 21 -5.346 -10.022 12.538 168 HG2 ARG 21 2HG ARG 21 -5.444 -12.986 12.027 169 HG3 ARG 21 3HG ARG 21 -6.077 -12.118 13.427 170 HD2 ARG 21 2HD ARG 21 -7.079 -12.079 10.593 171 HD3 ARG 21 3HD ARG 21 -7.939 -12.576 12.050 172 HE ARG 21 HE ARG 21 -7.374 -9.974 12.523 173 HH11 ARG 21 1HH1 ARG 21 -8.881 -11.652 9.871 174 HH12 ARG 21 2HH1 ARG 21 -9.902 -10.321 9.438 175 HH21 ARG 21 1HH2 ARG 21 -8.713 -8.214 11.963 176 HH22 ARG 21 2HH2 ARG 21 -9.805 -8.366 10.628 177 H ALA 22 H ALA 22 -2.237 -11.090 10.810 178 HA ALA 22 HA ALA 22 -1.161 -8.590 11.234 179 HB1 ALA 22 1HB ALA 22 -0.111 -11.147 10.169 180 HB2 ALA 22 2HB ALA 22 0.871 -9.703 9.919 181 HB3 ALA 22 3HB ALA 22 0.418 -10.189 11.553 182 H LEU 23 H LEU 23 -1.211 -10.270 8.082 183 HA LEU 23 HA LEU 23 -0.408 -8.020 6.592 184 HB2 LEU 23 2HB LEU 23 -2.057 -10.305 5.544 185 HB3 LEU 23 3HB LEU 23 -0.929 -9.286 4.653 186 HG LEU 23 HG LEU 23 -0.148 -11.273 6.785 187 HD11 LEU 23 1HD1 LEU 23 -1.072 -12.341 4.765 188 HD12 LEU 23 2HD1 LEU 23 0.647 -12.666 4.982 189 HD13 LEU 23 3HD1 LEU 23 0.118 -11.479 3.790 190 HD21 LEU 23 3HD2 LEU 23 1.250 -9.102 6.073 191 HD22 LEU 23 1HD2 LEU 23 1.778 -10.214 4.810 192 HD23 LEU 23 2HD2 LEU 23 2.006 -10.636 6.507 193 H ALA 24 H ALA 24 -3.615 -9.400 7.227 194 HA ALA 24 HA ALA 24 -5.182 -7.790 5.639 195 HB1 ALA 24 1HB ALA 24 -5.659 -9.097 8.284 196 HB2 ALA 24 2HB ALA 24 -6.895 -8.059 7.572 197 HB3 ALA 24 3HB ALA 24 -6.335 -9.487 6.702 198 H GLY 25 H GLY 25 -3.691 -7.031 8.734 199 HA2 GLY 25 2HA GLY 25 -5.044 -4.469 8.911 200 HA3 GLY 25 3HA GLY 25 -3.867 -5.110 10.047 201 H ALA 26 H ALA 26 -2.102 -5.700 7.619 202 HA ALA 26 HA ALA 26 -0.850 -3.061 7.580 203 HB1 ALA 26 1HB ALA 26 0.608 -4.856 8.199 204 HB2 ALA 26 2HB ALA 26 0.170 -5.774 6.758 205 HB3 ALA 26 3HB ALA 26 1.091 -4.278 6.604 206 H GLY 27 H GLY 27 0.419 -2.707 5.378 207 HA2 GLY 27 2HA GLY 27 -1.666 -2.577 3.341 208 HA3 GLY 27 3HA GLY 27 -0.138 -1.709 3.323 209 H LEU 28 H LEU 28 -0.735 -5.181 3.726 210 HA LEU 28 HA LEU 28 0.581 -5.651 1.141 211 HB2 LEU 28 2HB LEU 28 1.180 -7.664 3.160 212 HB3 LEU 28 3HB LEU 28 2.244 -6.868 2.002 213 HG LEU 28 HG LEU 28 1.364 -5.616 4.599 214 HD11 LEU 28 1HD1 LEU 28 4.141 -6.442 4.415 215 HD12 LEU 28 2HD1 LEU 28 3.024 -7.806 4.354 216 HD13 LEU 28 3HD1 LEU 28 2.971 -6.682 5.712 217 HD21 LEU 28 3HD2 LEU 28 2.237 -3.790 3.680 218 HD22 LEU 28 1HD2 LEU 28 2.820 -4.695 2.283 219 HD23 LEU 28 2HD2 LEU 28 3.807 -4.592 3.741 220 H THR 29 H THR 29 -0.282 -7.248 -0.076 221 HA THR 29 HA THR 29 -2.862 -8.136 0.311 222 HB THR 29 HB THR 29 -0.814 -9.744 -1.211 223 HG1 THR 29 HG1 THR 29 -1.558 -8.262 -2.979 224 HG21 THR 29 3HG2 THR 29 -3.788 -9.398 -1.321 225 HG22 THR 29 1HG2 THR 29 -2.840 -10.884 -1.292 226 HG23 THR 29 2HG2 THR 29 -2.893 -9.900 -2.755 227 H CYS 30 H CYS 30 -3.691 -10.312 0.688 228 HA CYS 30 HA CYS 30 -1.992 -11.982 2.398 229 HB2 CYS 30 2HB CYS 30 -3.989 -12.292 3.926 230 HB3 CYS 30 3HB CYS 30 -3.210 -10.716 4.003 231 HG CYS 30 HG CYS 30 -5.248 -9.809 1.997 232 H THR 31 H THR 31 -1.919 -13.900 1.447 233 HA THR 31 HA THR 31 -4.411 -15.010 0.333 234 HB THR 31 HB THR 31 -1.687 -15.622 -0.802 235 HG1 THR 31 HG1 THR 31 -3.530 -13.818 -1.977 236 HG21 THR 31 3HG2 THR 31 -2.901 -16.494 -2.666 237 HG22 THR 31 1HG2 THR 31 -4.423 -15.852 -2.051 238 HG23 THR 31 2HG2 THR 31 -3.620 -17.176 -1.208 239 H THR 32 H THR 32 -5.024 -16.618 1.619 240 HA THR 32 HA THR 32 -2.973 -18.306 2.875 241 HB THR 32 HB THR 32 -4.553 -18.917 4.529 242 HG1 THR 32 HG1 THR 32 -6.457 -19.269 3.569 243 HG21 THR 32 3HG2 THR 32 -3.804 -16.309 4.181 244 HG22 THR 32 1HG2 THR 32 -4.606 -16.949 5.615 245 HG23 THR 32 2HG2 THR 32 -5.554 -16.170 4.349 246 H PHE 33 H PHE 33 -2.780 -20.414 2.391 247 HA PHE 33 HA PHE 33 -4.791 -21.587 0.584 248 HB2 PHE 33 2HB PHE 33 -1.802 -22.048 0.641 249 HB3 PHE 33 3HB PHE 33 -2.933 -22.950 -0.363 250 HD1 PHE 33 HD1 PHE 33 -4.054 -21.874 -2.246 251 HD2 PHE 33 HD2 PHE 33 -1.158 -19.811 0.093 252 HE1 PHE 33 HE1 PHE 33 -3.854 -20.166 -4.007 253 HE2 PHE 33 HE2 PHE 33 -0.953 -18.100 -1.663 254 HZ PHE 33 HZ PHE 33 -2.303 -18.276 -3.716 255 H GLU 34 H GLU 34 -4.051 -24.177 0.554 256 HA GLU 34 HA GLU 34 -4.039 -25.030 3.369 257 HB2 GLU 34 2HB GLU 34 -5.744 -26.714 2.870 258 HB3 GLU 34 3HB GLU 34 -6.348 -25.092 2.563 259 HG2 GLU 34 2HG GLU 34 -5.456 -25.680 0.117 260 HG3 GLU 34 3HG GLU 34 -5.818 -27.308 0.688 261 H ASN 35 H ASN 35 -3.472 -25.869 -0.007 262 HA ASN 35 HA ASN 35 -1.786 -28.115 0.871 263 HB2 ASN 35 2HB ASN 35 -3.469 -27.640 -1.533 264 HB3 ASN 35 3HB ASN 35 -1.971 -28.536 -1.771 265 HD21 ASN 35 1HD2 ASN 35 -4.107 -29.901 -2.350 266 HD22 ASN 35 2HD2 ASN 35 -4.521 -31.040 -1.119 267 H GLY 36 H GLY 36 0.353 -27.974 0.644 268 HA2 GLY 36 2HA GLY 36 1.661 -25.628 -0.096 269 HA3 GLY 36 3HA GLY 36 2.424 -27.206 0.022 270 H ASN 37 H ASN 37 0.438 -28.165 -2.085 271 HA ASN 37 HA ASN 37 2.144 -27.600 -4.335 272 HB2 ASN 37 2HB ASN 37 1.350 -29.839 -4.174 273 HB3 ASN 37 3HB ASN 37 -0.319 -29.308 -3.985 274 HD21 ASN 37 1HD2 ASN 37 2.375 -28.986 -6.271 275 HD22 ASN 37 2HD2 ASN 37 1.412 -29.173 -7.694 276 H GLU 38 H GLU 38 -1.190 -26.875 -3.394 277 HA GLU 38 HA GLU 38 -1.997 -25.632 -5.773 278 HB2 GLU 38 2HB GLU 38 -3.187 -26.219 -3.368 279 HB3 GLU 38 3HB GLU 38 -3.115 -24.463 -3.327 280 HG2 GLU 38 2HG GLU 38 -4.813 -24.294 -4.732 281 HG3 GLU 38 3HG GLU 38 -4.030 -25.361 -5.895 282 H VAL 39 H VAL 39 0.152 -24.598 -3.321 283 HA VAL 39 HA VAL 39 -0.106 -21.774 -3.971 284 HB VAL 39 HB VAL 39 1.949 -23.046 -2.166 285 HG11 VAL 39 1HG1 VAL 39 2.710 -20.931 -2.283 286 HG12 VAL 39 2HG1 VAL 39 1.171 -20.299 -2.871 287 HG13 VAL 39 3HG1 VAL 39 1.402 -20.599 -1.148 288 HG21 VAL 39 3HG2 VAL 39 -0.902 -22.816 -1.802 289 HG22 VAL 39 1HG2 VAL 39 0.303 -23.589 -0.771 290 HG23 VAL 39 2HG2 VAL 39 -0.036 -21.867 -0.594 291 H LEU 40 H LEU 40 2.175 -24.428 -4.423 292 HA LEU 40 HA LEU 40 4.372 -23.094 -5.405 293 HB2 LEU 40 2HB LEU 40 4.791 -25.317 -5.211 294 HB3 LEU 40 3HB LEU 40 3.202 -25.780 -5.815 295 HG LEU 40 HG LEU 40 3.934 -25.366 -8.102 296 HD11 LEU 40 1HD1 LEU 40 5.947 -23.846 -6.855 297 HD12 LEU 40 2HD1 LEU 40 5.682 -24.093 -8.581 298 HD13 LEU 40 3HD1 LEU 40 6.755 -25.173 -7.692 299 HD21 LEU 40 3HD2 LEU 40 5.206 -27.309 -6.315 300 HD22 LEU 40 1HD2 LEU 40 6.062 -27.044 -7.835 301 HD23 LEU 40 2HD2 LEU 40 4.373 -27.551 -7.852 302 H ALA 41 H ALA 41 1.451 -24.070 -7.153 303 HA ALA 41 HA ALA 41 2.360 -23.098 -9.681 304 HB1 ALA 41 1HB ALA 41 0.751 -24.813 -9.762 305 HB2 ALA 41 2HB ALA 41 -0.329 -23.962 -8.657 306 HB3 ALA 41 3HB ALA 41 -0.089 -23.356 -10.295 307 H ALA 42 H ALA 42 0.695 -21.715 -6.960 308 HA ALA 42 HA ALA 42 -0.494 -19.497 -8.204 309 HB1 ALA 42 1HB ALA 42 -0.638 -18.527 -6.002 310 HB2 ALA 42 2HB ALA 42 -0.993 -20.252 -5.904 311 HB3 ALA 42 3HB ALA 42 0.582 -19.645 -5.392 312 H LEU 43 H LEU 43 2.769 -20.045 -7.014 313 HA LEU 43 HA LEU 43 3.708 -17.410 -7.082 314 HB2 LEU 43 2HB LEU 43 5.436 -19.735 -7.830 315 HB3 LEU 43 3HB LEU 43 5.854 -18.292 -6.908 316 HG LEU 43 HG LEU 43 4.374 -20.739 -5.987 317 HD11 LEU 43 1HD1 LEU 43 6.954 -19.388 -5.355 318 HD12 LEU 43 2HD1 LEU 43 6.611 -21.097 -5.617 319 HD13 LEU 43 3HD1 LEU 43 6.138 -20.326 -4.104 320 HD21 LEU 43 3HD2 LEU 43 3.064 -19.400 -4.766 321 HD22 LEU 43 1HD2 LEU 43 4.054 -17.978 -5.095 322 HD23 LEU 43 2HD2 LEU 43 4.509 -19.089 -3.803 323 H ALA 44 H ALA 44 3.417 -19.837 -9.614 324 HA ALA 44 HA ALA 44 4.881 -18.444 -11.596 325 HB1 ALA 44 1HB ALA 44 4.618 -20.399 -12.608 326 HB2 ALA 44 2HB ALA 44 3.426 -20.887 -11.403 327 HB3 ALA 44 3HB ALA 44 2.912 -20.028 -12.855 328 H SER 45 H SER 45 1.928 -17.759 -10.161 329 HA SER 45 HA SER 45 0.626 -16.610 -12.458 330 HB2 SER 45 2HB SER 45 -0.616 -17.562 -10.499 331 HB3 SER 45 3HB SER 45 -0.034 -16.207 -9.531 332 HG SER 45 HG SER 45 -1.343 -15.693 -11.957 333 H LYS 46 H LYS 46 1.527 -15.074 -9.373 334 HA LYS 46 HA LYS 46 2.432 -12.729 -10.912 335 HB2 LYS 46 2HB LYS 46 1.726 -11.407 -8.846 336 HB3 LYS 46 3HB LYS 46 0.438 -12.030 -9.869 337 HG2 LYS 46 2HG LYS 46 0.260 -13.973 -8.291 338 HG3 LYS 46 3HG LYS 46 1.370 -13.112 -7.223 339 HD2 LYS 46 2HD LYS 46 -1.314 -12.115 -8.178 340 HD3 LYS 46 3HD LYS 46 -0.947 -12.728 -6.565 341 HE2 LYS 46 2HE LYS 46 -0.543 -10.598 -6.025 342 HE3 LYS 46 3HE LYS 46 0.962 -10.788 -6.924 343 HZ1 LYS 46 3HZ LYS 46 0.227 -9.497 -8.581 344 HZ2 LYS 46 1HZ LYS 46 -0.894 -8.927 -7.449 345 HZ3 LYS 46 2HZ LYS 46 -1.339 -10.135 -8.546 346 H THR 47 H THR 47 3.254 -15.139 -8.712 347 HA THR 47 HA THR 47 5.103 -15.573 -7.456 348 HB THR 47 HB THR 47 6.869 -13.490 -8.395 349 HG1 THR 47 HG1 THR 47 5.640 -15.039 -10.444 350 HG21 THR 47 3HG2 THR 47 8.063 -15.342 -7.902 351 HG22 THR 47 1HG2 THR 47 7.710 -15.786 -9.572 352 HG23 THR 47 2HG2 THR 47 6.721 -16.428 -8.260 353 HA PRO 48 HA PRO 48 4.302 -12.422 -4.321 354 HB2 PRO 48 2HB PRO 48 4.882 -14.051 -2.228 355 HB3 PRO 48 3HB PRO 48 3.324 -14.076 -3.062 356 HG2 PRO 48 2HG PRO 48 5.676 -15.898 -3.389 357 HG3 PRO 48 3HG PRO 48 3.951 -16.302 -3.308 358 HD2 PRO 48 2HD PRO 48 5.309 -16.168 -5.647 359 HD3 PRO 48 3HD PRO 48 3.589 -15.745 -5.515 360 H ASP 49 H ASP 49 5.639 -11.699 -2.393 361 HA ASP 49 HA ASP 49 8.470 -11.695 -3.175 362 HB2 ASP 49 2HB ASP 49 6.646 -9.692 -2.025 363 HB3 ASP 49 3HB ASP 49 8.242 -9.735 -1.279 364 H VAL 50 H VAL 50 6.454 -13.193 -1.038 365 HA VAL 50 HA VAL 50 8.520 -14.358 0.462 366 HB VAL 50 HB VAL 50 8.684 -12.201 1.579 367 HG11 VAL 50 1HG1 VAL 50 6.001 -11.980 1.164 368 HG12 VAL 50 2HG1 VAL 50 6.069 -12.336 2.891 369 HG13 VAL 50 3HG1 VAL 50 6.944 -10.950 2.240 370 HG21 VAL 50 3HG2 VAL 50 7.314 -13.710 3.696 371 HG22 VAL 50 1HG2 VAL 50 8.525 -14.619 2.792 372 HG23 VAL 50 2HG2 VAL 50 8.975 -13.124 3.612 373 H LEU 51 H LEU 51 7.800 -16.091 1.673 374 HA LEU 51 HA LEU 51 4.885 -16.490 1.778 375 HB2 LEU 51 2HB LEU 51 6.686 -17.907 0.207 376 HB3 LEU 51 3HB LEU 51 6.391 -18.957 1.592 377 HG LEU 51 HG LEU 51 4.001 -17.811 0.280 378 HD11 LEU 51 1HD1 LEU 51 4.315 -19.982 -1.269 379 HD12 LEU 51 2HD1 LEU 51 5.993 -19.455 -1.142 380 HD13 LEU 51 3HD1 LEU 51 4.768 -18.353 -1.770 381 HD21 LEU 51 3HD2 LEU 51 4.612 -19.845 2.112 382 HD22 LEU 51 1HD2 LEU 51 4.055 -20.656 0.648 383 HD23 LEU 51 2HD2 LEU 51 3.035 -19.447 1.428 384 H LEU 52 H LEU 52 4.098 -17.763 3.508 385 HA LEU 52 HA LEU 52 6.019 -18.243 5.684 386 HB2 LEU 52 2HB LEU 52 3.431 -16.756 5.735 387 HB3 LEU 52 3HB LEU 52 3.965 -17.624 7.173 388 HG LEU 52 HG LEU 52 6.042 -16.271 7.162 389 HD11 LEU 52 1HD1 LEU 52 5.456 -14.057 5.683 390 HD12 LEU 52 2HD1 LEU 52 4.892 -15.356 4.634 391 HD13 LEU 52 3HD1 LEU 52 6.563 -15.340 5.196 392 HD21 LEU 52 3HD2 LEU 52 4.511 -15.449 8.672 393 HD22 LEU 52 1HD2 LEU 52 3.334 -15.044 7.423 394 HD23 LEU 52 2HD2 LEU 52 4.769 -14.042 7.639 395 H SER 53 H SER 53 5.807 -20.416 4.572 396 HA SER 53 HA SER 53 3.348 -21.855 5.070 397 HB2 SER 53 2HB SER 53 4.515 -23.764 4.047 398 HB3 SER 53 3HB SER 53 4.655 -22.323 3.040 399 HG SER 53 HG SER 53 6.698 -22.931 3.123 400 H ASP 54 H ASP 54 2.994 -23.396 6.608 401 HA ASP 54 HA ASP 54 4.937 -23.481 8.801 402 HB2 ASP 54 2HB ASP 54 3.179 -23.904 10.258 403 HB3 ASP 54 3HB ASP 54 2.413 -22.863 9.060 404 H ILE 55 H ILE 55 4.246 -25.788 10.073 405 HA ILE 55 HA ILE 55 4.456 -27.978 8.163 406 HB ILE 55 HB ILE 55 6.532 -27.596 10.322 407 HG12 ILE 55 2HG1 ILE 55 6.801 -27.343 7.319 408 HG13 ILE 55 3HG1 ILE 55 6.823 -26.003 8.460 409 HG21 ILE 55 1HG2 ILE 55 7.100 -29.514 8.224 410 HG22 ILE 55 2HG2 ILE 55 7.162 -29.704 9.976 411 HG23 ILE 55 3HG2 ILE 55 5.636 -29.919 9.119 412 HD11 ILE 55 3HD1 ILE 55 8.859 -28.178 8.112 413 HD12 ILE 55 1HD1 ILE 55 9.064 -26.438 7.905 414 HD13 ILE 55 2HD1 ILE 55 8.828 -27.113 9.517 415 H ARG 56 H ARG 56 2.666 -29.025 8.833 416 HA ARG 56 HA ARG 56 2.733 -30.538 11.212 417 HB2 ARG 56 2HB ARG 56 0.949 -29.537 12.482 418 HB3 ARG 56 3HB ARG 56 2.178 -28.314 12.189 419 HG2 ARG 56 2HG ARG 56 0.741 -27.594 10.207 420 HG3 ARG 56 3HG ARG 56 -0.528 -28.585 10.931 421 HD2 ARG 56 2HD ARG 56 0.910 -26.291 12.262 422 HD3 ARG 56 3HD ARG 56 -0.727 -26.245 11.608 423 HE ARG 56 HE ARG 56 -0.887 -28.259 13.370 424 HH11 ARG 56 1HH1 ARG 56 0.399 -25.035 13.635 425 HH12 ARG 56 2HH1 ARG 56 0.039 -24.890 15.324 426 HH21 ARG 56 1HH2 ARG 56 -1.367 -28.080 15.593 427 HH22 ARG 56 2HH2 ARG 56 -0.965 -26.623 16.436 428 H MET 57 H MET 57 2.267 -30.871 8.388 429 HA MET 57 HA MET 57 -0.560 -31.577 8.204 430 HB2 MET 57 2HB MET 57 1.437 -32.055 6.021 431 HB3 MET 57 3HB MET 57 -0.281 -31.706 5.894 432 HG2 MET 57 2HG MET 57 0.627 -29.437 7.065 433 HG3 MET 57 3HG MET 57 2.008 -29.889 6.069 434 HE1 MET 57 3HE MET 57 -0.096 -26.958 4.727 435 HE2 MET 57 1HE MET 57 1.325 -27.483 5.631 436 HE3 MET 57 2HE MET 57 1.348 -27.495 3.868 437 HA PRO 58 HA PRO 58 -0.020 -35.868 8.954 438 HB2 PRO 58 2HB PRO 58 -1.866 -36.942 7.276 439 HB3 PRO 58 3HB PRO 58 -2.300 -36.072 8.752 440 HG2 PRO 58 2HG PRO 58 -2.268 -35.100 5.921 441 HG3 PRO 58 3HG PRO 58 -3.482 -34.826 7.184 442 HD2 PRO 58 2HD PRO 58 -1.617 -32.975 6.529 443 HD3 PRO 58 3HD PRO 58 -2.251 -33.149 8.178 444 H GLY 59 H GLY 59 -0.390 -35.191 5.463 445 HA2 GLY 59 2HA GLY 59 1.633 -37.273 4.941 446 HA3 GLY 59 3HA GLY 59 0.413 -36.748 3.791 447 H MET 60 H MET 60 0.595 -34.105 3.671 448 HA MET 60 HA MET 60 2.760 -33.587 2.043 449 HB2 MET 60 2HB MET 60 0.532 -32.207 2.752 450 HB3 MET 60 3HB MET 60 1.769 -31.266 3.574 451 HG2 MET 60 2HG MET 60 1.776 -30.184 1.592 452 HG3 MET 60 3HG MET 60 2.945 -31.445 1.209 453 HE1 MET 60 3HE MET 60 -0.296 -29.838 0.779 454 HE2 MET 60 1HE MET 60 0.354 -29.669 -0.852 455 HE3 MET 60 2HE MET 60 -1.095 -30.635 -0.577 456 H ASP 61 H ASP 61 2.569 -33.524 5.503 457 HA ASP 61 HA ASP 61 4.199 -33.371 7.091 458 HB2 ASP 61 2HB ASP 61 5.572 -34.505 5.196 459 HB3 ASP 61 3HB ASP 61 6.279 -32.907 4.974 460 H GLY 62 H GLY 62 5.417 -31.225 4.511 461 HA2 GLY 62 2HA GLY 62 4.539 -28.798 5.149 462 HA3 GLY 62 3HA GLY 62 5.672 -29.075 6.464 463 H LEU 63 H LEU 63 7.908 -29.799 5.717 464 HA LEU 63 HA LEU 63 8.978 -27.793 4.045 465 HB2 LEU 63 2HB LEU 63 11.048 -29.361 4.162 466 HB3 LEU 63 3HB LEU 63 10.486 -28.526 5.609 467 HG LEU 63 HG LEU 63 9.487 -30.540 6.453 468 HD11 LEU 63 1HD1 LEU 63 8.593 -31.681 4.654 469 HD12 LEU 63 2HD1 LEU 63 9.972 -32.689 5.089 470 HD13 LEU 63 3HD1 LEU 63 10.085 -31.587 3.718 471 HD21 LEU 63 3HD2 LEU 63 11.673 -30.525 7.156 472 HD22 LEU 63 1HD2 LEU 63 12.316 -30.662 5.520 473 HD23 LEU 63 2HD2 LEU 63 11.607 -32.071 6.309 474 H ALA 64 H ALA 64 7.507 -30.757 3.325 475 HA ALA 64 HA ALA 64 8.785 -31.837 1.190 476 HB1 ALA 64 1HB ALA 64 6.761 -32.818 1.944 477 HB2 ALA 64 2HB ALA 64 5.836 -31.367 1.559 478 HB3 ALA 64 3HB ALA 64 6.506 -32.355 0.261 479 H LEU 65 H LEU 65 6.802 -28.906 1.166 480 HA LEU 65 HA LEU 65 7.279 -28.496 -1.668 481 HB2 LEU 65 2HB LEU 65 6.056 -26.257 -1.005 482 HB3 LEU 65 3HB LEU 65 5.174 -27.766 -1.230 483 HG LEU 65 HG LEU 65 6.102 -27.027 1.508 484 HD11 LEU 65 1HD1 LEU 65 3.613 -26.026 1.536 485 HD12 LEU 65 2HD1 LEU 65 4.097 -25.577 -0.099 486 HD13 LEU 65 3HD1 LEU 65 5.054 -25.042 1.282 487 HD21 LEU 65 3HD2 LEU 65 4.311 -28.929 0.254 488 HD22 LEU 65 1HD2 LEU 65 3.518 -28.022 1.543 489 HD23 LEU 65 2HD2 LEU 65 4.996 -28.923 1.880 490 H LEU 66 H LEU 66 8.273 -27.128 1.422 491 HA LEU 66 HA LEU 66 9.544 -24.824 0.643 492 HB2 LEU 66 2HB LEU 66 10.121 -26.829 2.783 493 HB3 LEU 66 3HB LEU 66 11.219 -25.474 2.531 494 HG LEU 66 HG LEU 66 9.617 -25.061 4.345 495 HD11 LEU 66 1HD1 LEU 66 10.506 -23.289 2.648 496 HD12 LEU 66 2HD1 LEU 66 9.252 -22.857 3.809 497 HD13 LEU 66 3HD1 LEU 66 8.819 -23.219 2.139 498 HD21 LEU 66 3HD2 LEU 66 7.791 -26.429 3.170 499 HD22 LEU 66 1HD2 LEU 66 7.441 -24.945 2.283 500 HD23 LEU 66 2HD2 LEU 66 7.305 -24.974 4.042 501 H LYS 67 H LYS 67 10.869 -28.117 0.633 502 HA LYS 67 HA LYS 67 13.462 -27.602 -0.141 503 HB2 LYS 67 2HB LYS 67 11.722 -29.891 -1.080 504 HB3 LYS 67 3HB LYS 67 13.480 -29.855 -1.117 505 HG2 LYS 67 2HG LYS 67 11.852 -29.649 1.405 506 HG3 LYS 67 3HG LYS 67 12.504 -31.160 0.765 507 HD2 LYS 67 2HD LYS 67 14.159 -28.739 1.475 508 HD3 LYS 67 3HD LYS 67 13.921 -30.136 2.528 509 HE2 LYS 67 2HE LYS 67 14.874 -31.565 0.716 510 HE3 LYS 67 3HE LYS 67 15.252 -30.092 -0.177 511 HZ1 LYS 67 3HZ LYS 67 16.879 -31.306 1.618 512 HZ2 LYS 67 1HZ LYS 67 16.205 -30.051 2.531 513 HZ3 LYS 67 2HZ LYS 67 17.025 -29.705 1.092 514 H GLN 68 H GLN 68 10.547 -27.620 -2.097 515 HA GLN 68 HA GLN 68 12.032 -27.272 -4.563 516 HB2 GLN 68 2HB GLN 68 10.131 -27.875 -5.608 517 HB3 GLN 68 3HB GLN 68 9.600 -28.379 -4.009 518 HG2 GLN 68 2HG GLN 68 8.666 -26.040 -3.739 519 HG3 GLN 68 3HG GLN 68 8.947 -25.841 -5.468 520 HE21 GLN 68 1HE2 GLN 68 6.540 -26.200 -3.532 521 HE22 GLN 68 2HE2 GLN 68 5.528 -27.305 -4.392 522 H ILE 69 H ILE 69 10.265 -25.336 -2.257 523 HA ILE 69 HA ILE 69 9.829 -23.031 -3.762 524 HB ILE 69 HB ILE 69 10.380 -23.342 -0.813 525 HG12 ILE 69 2HG1 ILE 69 7.800 -22.795 -2.292 526 HG13 ILE 69 3HG1 ILE 69 8.315 -24.393 -1.764 527 HG21 ILE 69 1HG2 ILE 69 10.811 -21.132 -0.894 528 HG22 ILE 69 2HG2 ILE 69 10.027 -20.929 -2.460 529 HG23 ILE 69 3HG2 ILE 69 9.055 -20.999 -0.990 530 HD11 ILE 69 3HD1 ILE 69 7.677 -24.026 0.340 531 HD12 ILE 69 1HD1 ILE 69 8.324 -22.385 0.354 532 HD13 ILE 69 2HD1 ILE 69 6.735 -22.701 -0.343 533 H LYS 70 H LYS 70 12.738 -24.288 -2.337 534 HA LYS 70 HA LYS 70 14.205 -21.813 -2.588 535 HB2 LYS 70 2HB LYS 70 14.543 -24.211 -1.165 536 HB3 LYS 70 3HB LYS 70 15.879 -24.150 -2.308 537 HG2 LYS 70 2HG LYS 70 16.905 -22.914 -0.766 538 HG3 LYS 70 3HG LYS 70 15.856 -21.604 -1.314 539 HD2 LYS 70 2HD LYS 70 15.583 -21.633 1.012 540 HD3 LYS 70 3HD LYS 70 14.168 -22.490 0.397 541 HE2 LYS 70 2HE LYS 70 15.961 -24.521 0.696 542 HE3 LYS 70 3HE LYS 70 16.405 -23.458 2.030 543 HZ1 LYS 70 3HZ LYS 70 14.776 -24.601 3.058 544 HZ2 LYS 70 1HZ LYS 70 13.980 -25.010 1.622 545 HZ3 LYS 70 2HZ LYS 70 13.770 -23.474 2.297 546 H GLN 71 H GLN 71 14.058 -24.924 -4.276 547 HA GLN 71 HA GLN 71 16.096 -24.321 -6.152 548 HB2 GLN 71 2HB GLN 71 14.226 -26.483 -5.648 549 HB3 GLN 71 3HB GLN 71 14.394 -26.165 -7.370 550 HG2 GLN 71 2HG GLN 71 16.324 -27.233 -7.413 551 HG3 GLN 71 3HG GLN 71 16.981 -26.157 -6.180 552 HE21 GLN 71 1HE2 GLN 71 14.630 -28.817 -6.345 553 HE22 GLN 71 2HE2 GLN 71 15.242 -29.668 -4.972 554 H ARG 72 H ARG 72 12.616 -23.843 -6.107 555 HA ARG 72 HA ARG 72 12.518 -22.967 -8.854 556 HB2 ARG 72 2HB ARG 72 10.565 -23.373 -6.657 557 HB3 ARG 72 3HB ARG 72 10.142 -22.180 -7.878 558 HG2 ARG 72 2HG ARG 72 11.055 -24.431 -9.278 559 HG3 ARG 72 3HG ARG 72 9.995 -25.034 -8.002 560 HD2 ARG 72 2HD ARG 72 8.343 -24.565 -9.444 561 HD3 ARG 72 3HD ARG 72 8.581 -22.900 -8.918 562 HE ARG 72 HE ARG 72 10.346 -23.407 -11.021 563 HH11 ARG 72 1HH1 ARG 72 6.921 -23.151 -10.453 564 HH12 ARG 72 2HH1 ARG 72 6.563 -22.607 -12.058 565 HH21 ARG 72 1HH2 ARG 72 9.888 -22.691 -13.138 566 HH22 ARG 72 2HH2 ARG 72 8.252 -22.346 -13.585 567 H HIS 73 H HIS 73 11.950 -21.399 -5.700 568 HA HIS 73 HA HIS 73 12.719 -18.843 -6.949 569 HB2 HIS 73 2HB HIS 73 10.828 -19.118 -4.613 570 HB3 HIS 73 3HB HIS 73 11.141 -17.684 -5.586 571 HD1 HIS 73 HD1 HIS 73 9.798 -17.398 -7.713 572 HD2 HIS 73 HD2 HIS 73 9.206 -21.087 -5.897 573 HE1 HIS 73 HE1 HIS 73 7.856 -18.440 -8.925 574 HA PRO 74 HA PRO 74 15.783 -19.753 -3.627 575 HB2 PRO 74 2HB PRO 74 17.892 -18.733 -4.998 576 HB3 PRO 74 3HB PRO 74 17.328 -20.396 -5.202 577 HG2 PRO 74 2HG PRO 74 16.789 -17.992 -6.902 578 HG3 PRO 74 3HG PRO 74 17.184 -19.648 -7.399 579 HD2 PRO 74 2HD PRO 74 14.654 -18.685 -7.420 580 HD3 PRO 74 3HD PRO 74 15.024 -20.389 -7.090 581 H MET 75 H MET 75 15.296 -16.862 -5.607 582 HA MET 75 HA MET 75 16.482 -15.126 -3.625 583 HB2 MET 75 2HB MET 75 15.953 -13.324 -5.146 584 HB3 MET 75 3HB MET 75 16.659 -14.654 -6.054 585 HG2 MET 75 2HG MET 75 14.907 -14.692 -7.392 586 HG3 MET 75 3HG MET 75 13.846 -15.006 -6.020 587 HE1 MET 75 3HE MET 75 12.400 -13.766 -5.068 588 HE2 MET 75 1HE MET 75 12.947 -12.197 -4.476 589 HE3 MET 75 2HE MET 75 11.697 -12.285 -5.717 590 H LEU 76 H LEU 76 13.621 -16.710 -3.775 591 HA LEU 76 HA LEU 76 11.999 -14.536 -2.687 592 HB2 LEU 76 2HB LEU 76 10.958 -15.925 -4.366 593 HB3 LEU 76 3HB LEU 76 11.315 -17.376 -3.430 594 HG LEU 76 HG LEU 76 9.795 -16.418 -1.636 595 HD11 LEU 76 1HD1 LEU 76 9.313 -14.249 -1.980 596 HD12 LEU 76 2HD1 LEU 76 8.036 -14.900 -3.006 597 HD13 LEU 76 3HD1 LEU 76 9.553 -14.359 -3.724 598 HD21 LEU 76 3HD2 LEU 76 8.979 -17.464 -4.294 599 HD22 LEU 76 1HD2 LEU 76 7.716 -16.909 -3.195 600 HD23 LEU 76 2HD2 LEU 76 8.822 -18.189 -2.694 601 HA PRO 77 HA PRO 77 13.163 -15.927 1.400 602 HB2 PRO 77 2HB PRO 77 11.780 -14.003 2.724 603 HB3 PRO 77 3HB PRO 77 13.340 -13.703 1.948 604 HG2 PRO 77 2HG PRO 77 10.582 -13.104 0.950 605 HG3 PRO 77 3HG PRO 77 12.040 -12.098 0.880 606 HD2 PRO 77 2HD PRO 77 11.152 -13.525 -1.242 607 HD3 PRO 77 3HD PRO 77 12.876 -13.217 -0.954 608 H VAL 78 H VAL 78 12.193 -17.184 2.930 609 HA VAL 78 HA VAL 78 9.274 -17.328 3.022 610 HB VAL 78 HB VAL 78 11.040 -19.736 2.562 611 HG11 VAL 78 1HG1 VAL 78 9.345 -20.351 4.127 612 HG12 VAL 78 2HG1 VAL 78 8.099 -19.529 3.185 613 HG13 VAL 78 3HG1 VAL 78 8.871 -20.982 2.550 614 HG21 VAL 78 3HG2 VAL 78 10.721 -19.028 0.432 615 HG22 VAL 78 1HG2 VAL 78 9.178 -19.858 0.639 616 HG23 VAL 78 2HG2 VAL 78 9.271 -18.108 0.838 617 H ILE 79 H ILE 79 8.437 -18.184 4.956 618 HA ILE 79 HA ILE 79 10.417 -18.495 7.118 619 HB ILE 79 HB ILE 79 7.641 -17.397 7.512 620 HG12 ILE 79 2HG1 ILE 79 10.210 -15.836 7.156 621 HG13 ILE 79 3HG1 ILE 79 8.902 -15.921 5.981 622 HG21 ILE 79 1HG2 ILE 79 10.130 -17.288 9.212 623 HG22 ILE 79 2HG2 ILE 79 8.565 -16.589 9.623 624 HG23 ILE 79 3HG2 ILE 79 8.738 -18.338 9.480 625 HD11 ILE 79 3HD1 ILE 79 7.923 -14.202 6.956 626 HD12 ILE 79 1HD1 ILE 79 7.794 -15.116 8.459 627 HD13 ILE 79 2HD1 ILE 79 9.223 -14.131 8.146 628 H ILE 80 H ILE 80 9.995 -20.020 8.721 629 HA ILE 80 HA ILE 80 7.898 -21.974 8.035 630 HB ILE 80 HB ILE 80 10.426 -22.542 9.580 631 HG12 ILE 80 2HG1 ILE 80 10.758 -21.810 7.154 632 HG13 ILE 80 3HG1 ILE 80 11.432 -23.372 7.605 633 HG21 ILE 80 1HG2 ILE 80 8.291 -24.291 8.379 634 HG22 ILE 80 2HG2 ILE 80 9.842 -24.900 8.954 635 HG23 ILE 80 3HG2 ILE 80 8.727 -24.129 10.080 636 HD11 ILE 80 3HD1 ILE 80 9.600 -24.517 6.557 637 HD12 ILE 80 1HD1 ILE 80 8.792 -22.986 6.216 638 HD13 ILE 80 2HD1 ILE 80 10.312 -23.380 5.412 639 H MET 81 H MET 81 6.541 -22.727 9.608 640 HA MET 81 HA MET 81 6.903 -21.677 12.330 641 HB2 MET 81 2HB MET 81 4.262 -21.753 10.863 642 HB3 MET 81 3HB MET 81 4.545 -21.137 12.486 643 HG2 MET 81 2HG MET 81 4.534 -19.177 11.360 644 HG3 MET 81 3HG MET 81 6.244 -19.573 11.201 645 HE1 MET 81 3HE MET 81 2.828 -19.605 8.416 646 HE2 MET 81 1HE MET 81 3.382 -21.278 8.342 647 HE3 MET 81 2HE MET 81 2.956 -20.559 9.895 648 H THR 82 H THR 82 6.895 -23.254 13.779 649 HA THR 82 HA THR 82 4.990 -25.373 13.762 650 HB THR 82 HB THR 82 6.363 -26.405 12.107 651 HG1 THR 82 HG1 THR 82 6.094 -28.144 13.275 652 HG21 THR 82 3HG2 THR 82 8.693 -26.552 12.138 653 HG22 THR 82 1HG2 THR 82 8.788 -26.209 13.864 654 HG23 THR 82 2HG2 THR 82 8.381 -24.921 12.730 655 H ALA 83 H ALA 83 8.254 -24.516 14.902 656 HA ALA 83 HA ALA 83 9.137 -24.364 16.995 657 HB1 ALA 83 1HB ALA 83 6.933 -24.604 18.729 658 HB2 ALA 83 2HB ALA 83 7.770 -23.132 18.234 659 HB3 ALA 83 3HB ALA 83 6.373 -23.702 17.320 660 H HIS 84 H HIS 84 8.735 -25.553 19.351 661 HA HIS 84 HA HIS 84 9.358 -27.534 20.342 662 HB2 HIS 84 2HB HIS 84 7.536 -29.100 20.476 663 HB3 HIS 84 3HB HIS 84 6.856 -27.476 20.423 664 HD1 HIS 84 HD1 HIS 84 6.981 -30.677 18.555 665 HD2 HIS 84 HD2 HIS 84 5.497 -26.834 18.017 666 HE1 HIS 84 HE1 HIS 84 5.409 -30.831 16.598 667 H SER 85 H SER 85 8.677 -30.199 19.508 668 HA SER 85 HA SER 85 10.950 -30.915 18.096 669 HB2 SER 85 2HB SER 85 9.993 -32.696 19.226 670 HB3 SER 85 3HB SER 85 8.361 -32.295 18.690 671 HG SER 85 HG SER 85 10.347 -33.168 16.881 672 H ASP 86 H ASP 86 11.271 -29.736 16.236 673 HA ASP 86 HA ASP 86 10.410 -30.732 13.825 674 HB2 ASP 86 2HB ASP 86 8.449 -28.951 15.029 675 HB3 ASP 86 3HB ASP 86 8.979 -28.376 13.451 676 H LEU 87 H LEU 87 11.133 -27.699 15.499 677 HA LEU 87 HA LEU 87 12.297 -26.332 13.353 678 HB2 LEU 87 2HB LEU 87 12.120 -26.039 16.224 679 HB3 LEU 87 3HB LEU 87 13.698 -25.535 15.624 680 HG LEU 87 HG LEU 87 12.740 -23.846 14.263 681 HD11 LEU 87 1HD1 LEU 87 10.243 -23.541 14.195 682 HD12 LEU 87 2HD1 LEU 87 10.106 -25.155 14.892 683 HD13 LEU 87 3HD1 LEU 87 10.864 -24.937 13.315 684 HD21 LEU 87 3HD2 LEU 87 12.806 -23.574 16.833 685 HD22 LEU 87 1HD2 LEU 87 11.048 -23.673 16.727 686 HD23 LEU 87 2HD2 LEU 87 11.912 -22.394 15.872 687 H ASP 88 H ASP 88 13.675 -28.598 15.682 688 HA ASP 88 HA ASP 88 16.372 -28.298 15.108 689 HB2 ASP 88 2HB ASP 88 14.713 -30.221 16.459 690 HB3 ASP 88 3HB ASP 88 15.937 -31.060 15.509 691 H ALA 89 H ALA 89 13.860 -29.670 13.192 692 HA ALA 89 HA ALA 89 15.669 -31.122 11.452 693 HB1 ALA 89 1HB ALA 89 12.984 -31.371 12.075 694 HB2 ALA 89 2HB ALA 89 12.986 -30.760 10.420 695 HB3 ALA 89 3HB ALA 89 13.855 -32.243 10.814 696 H ALA 90 H ALA 90 13.904 -28.092 11.489 697 HA ALA 90 HA ALA 90 14.573 -27.482 8.737 698 HB1 ALA 90 1HB ALA 90 12.593 -26.469 9.090 699 HB2 ALA 90 2HB ALA 90 12.867 -26.298 10.824 700 HB3 ALA 90 3HB ALA 90 13.604 -25.158 9.698 701 H VAL 91 H VAL 91 15.935 -27.022 11.851 702 HA VAL 91 HA VAL 91 17.338 -24.656 11.631 703 HB VAL 91 HB VAL 91 18.097 -27.244 12.971 704 HG11 VAL 91 1HG1 VAL 91 19.600 -24.655 12.828 705 HG12 VAL 91 2HG1 VAL 91 19.743 -25.715 14.232 706 HG13 VAL 91 3HG1 VAL 91 20.199 -26.302 12.632 707 HG21 VAL 91 3HG2 VAL 91 17.613 -24.824 14.550 708 HG22 VAL 91 1HG2 VAL 91 16.217 -25.383 13.628 709 HG23 VAL 91 2HG2 VAL 91 17.008 -26.466 14.773 710 H SER 92 H SER 92 18.549 -27.899 10.761 711 HA SER 92 HA SER 92 20.788 -26.725 9.341 712 HB2 SER 92 2HB SER 92 21.419 -28.670 10.487 713 HB3 SER 92 3HB SER 92 19.957 -29.536 10.015 714 HG SER 92 HG SER 92 21.803 -28.686 8.068 715 H ALA 93 H ALA 93 17.888 -28.614 8.587 716 HA ALA 93 HA ALA 93 18.321 -28.919 5.839 717 HB1 ALA 93 1HB ALA 93 16.627 -30.176 7.071 718 HB2 ALA 93 2HB ALA 93 15.690 -28.698 7.296 719 HB3 ALA 93 3HB ALA 93 15.927 -29.354 5.676 720 H TYR 94 H TYR 94 16.112 -26.591 7.406 721 HA TYR 94 HA TYR 94 15.614 -25.067 5.121 722 HB2 TYR 94 2HB TYR 94 14.504 -25.066 7.509 723 HB3 TYR 94 3HB TYR 94 15.651 -23.767 7.815 724 HD1 TYR 94 HD2 TYR 94 13.735 -24.574 4.721 725 HD2 TYR 94 HD1 TYR 94 14.374 -21.824 7.904 726 HE1 TYR 94 HE2 TYR 94 12.207 -22.977 3.642 727 HE2 TYR 94 HE1 TYR 94 12.847 -20.220 6.834 728 HH TYR 94 HH TYR 94 12.082 -19.861 4.235 729 H GLN 95 H GLN 95 18.404 -25.249 7.069 730 HA GLN 95 HA GLN 95 19.413 -22.623 6.652 731 HB2 GLN 95 2HB GLN 95 20.291 -25.065 7.929 732 HB3 GLN 95 3HB GLN 95 21.602 -24.336 7.011 733 HG2 GLN 95 2HG GLN 95 19.939 -22.781 8.967 734 HG3 GLN 95 3HG GLN 95 21.394 -23.659 9.435 735 HE21 GLN 95 1HE2 GLN 95 21.887 -21.355 10.077 736 HE22 GLN 95 2HE2 GLN 95 22.703 -20.383 8.904 737 H GLN 96 H GLN 96 18.720 -24.859 4.427 738 HA GLN 96 HA GLN 96 21.080 -24.933 2.840 739 HB2 GLN 96 2HB GLN 96 18.206 -25.638 2.402 740 HB3 GLN 96 3HB GLN 96 19.285 -25.536 1.017 741 HG2 GLN 96 2HG GLN 96 20.003 -27.191 3.402 742 HG3 GLN 96 3HG GLN 96 18.926 -27.812 2.152 743 HE21 GLN 96 1HE2 GLN 96 20.037 -29.183 0.958 744 HE22 GLN 96 2HE2 GLN 96 21.614 -28.916 0.306 745 H GLY 97 H GLY 97 19.854 -22.272 3.725 746 HA2 GLY 97 2HA GLY 97 20.508 -20.248 2.554 747 HA3 GLY 97 3HA GLY 97 19.995 -21.016 1.059 748 H ALA 98 H ALA 98 18.170 -21.128 4.054 749 HA ALA 98 HA ALA 98 16.020 -19.641 2.712 750 HB1 ALA 98 1HB ALA 98 14.483 -20.895 3.841 751 HB2 ALA 98 2HB ALA 98 15.808 -22.057 3.754 752 HB3 ALA 98 3HB ALA 98 15.537 -21.138 5.234 753 H PHE 99 H PHE 99 14.520 -18.540 4.448 754 HA PHE 99 HA PHE 99 16.224 -16.636 5.846 755 HB2 PHE 99 2HB PHE 99 14.551 -15.610 4.497 756 HB3 PHE 99 3HB PHE 99 13.289 -16.652 5.148 757 HD1 PHE 99 HD1 PHE 99 15.511 -13.810 5.888 758 HD2 PHE 99 HD2 PHE 99 12.173 -16.119 7.172 759 HE1 PHE 99 HE1 PHE 99 14.986 -12.104 7.581 760 HE2 PHE 99 HE2 PHE 99 11.642 -14.416 8.866 761 HZ PHE 99 HZ PHE 99 13.049 -12.405 9.072 762 H ASP 100 H ASP 100 15.953 -16.082 8.037 763 HA ASP 100 HA ASP 100 15.750 -18.146 9.843 764 HB2 ASP 100 2HB ASP 100 16.729 -15.924 10.340 765 HB3 ASP 100 3HB ASP 100 15.106 -15.242 10.392 766 H TYR 101 H TYR 101 14.067 -19.469 10.073 767 HA TYR 101 HA TYR 101 11.390 -18.805 9.519 768 HB2 TYR 101 2HB TYR 101 10.915 -20.948 10.845 769 HB3 TYR 101 3HB TYR 101 11.931 -21.095 9.416 770 HD1 TYR 101 HD2 TYR 101 12.411 -20.329 13.050 771 HD2 TYR 101 HD1 TYR 101 13.732 -22.505 9.641 772 HE1 TYR 101 HE2 TYR 101 14.164 -21.388 14.412 773 HE2 TYR 101 HE1 TYR 101 15.488 -23.571 10.994 774 HH TYR 101 HH TYR 101 16.676 -22.558 13.593 775 H LEU 102 H LEU 102 9.765 -19.566 11.482 776 HA LEU 102 HA LEU 102 10.448 -18.129 13.923 777 HB2 LEU 102 2HB LEU 102 9.473 -16.302 12.966 778 HB3 LEU 102 3HB LEU 102 8.425 -17.269 11.930 779 HG LEU 102 HG LEU 102 7.135 -17.818 14.082 780 HD11 LEU 102 1HD1 LEU 102 7.563 -15.423 15.427 781 HD12 LEU 102 2HD1 LEU 102 9.177 -16.053 15.101 782 HD13 LEU 102 3HD1 LEU 102 8.005 -17.042 15.971 783 HD21 LEU 102 3HD2 LEU 102 5.820 -16.518 12.808 784 HD22 LEU 102 1HD2 LEU 102 7.129 -15.403 12.415 785 HD23 LEU 102 2HD2 LEU 102 6.267 -15.247 13.947 786 HA PRO 103 HA PRO 103 8.284 -21.757 15.362 787 HB2 PRO 103 2HB PRO 103 8.702 -21.282 18.001 788 HB3 PRO 103 3HB PRO 103 9.948 -21.942 16.935 789 HG2 PRO 103 2HG PRO 103 9.554 -19.126 17.873 790 HG3 PRO 103 3HG PRO 103 11.055 -20.060 17.736 791 HD2 PRO 103 2HD PRO 103 10.304 -18.230 15.887 792 HD3 PRO 103 3HD PRO 103 11.229 -19.687 15.468 793 H LYS 104 H LYS 104 6.258 -22.161 16.147 794 HA LYS 104 HA LYS 104 4.647 -19.805 16.860 795 HB2 LYS 104 2HB LYS 104 2.703 -21.318 16.234 796 HB3 LYS 104 3HB LYS 104 3.745 -20.801 14.915 797 HG2 LYS 104 2HG LYS 104 4.253 -22.895 14.392 798 HG3 LYS 104 3HG LYS 104 4.669 -23.283 16.063 799 HD2 LYS 104 2HD LYS 104 1.852 -23.182 14.988 800 HD3 LYS 104 3HD LYS 104 2.809 -24.658 15.134 801 HE2 LYS 104 2HE LYS 104 2.239 -22.832 17.459 802 HE3 LYS 104 3HE LYS 104 1.192 -24.181 17.021 803 HZ1 LYS 104 3HZ LYS 104 3.216 -25.620 17.221 804 HZ2 LYS 104 1HZ LYS 104 2.661 -24.959 18.676 805 HZ3 LYS 104 2HZ LYS 104 4.017 -24.299 17.910 806 HA PRO 105 HA PRO 105 2.509 -19.532 17.587 807 HB2 PRO 105 2HB PRO 105 1.979 -18.024 19.781 808 HB3 PRO 105 3HB PRO 105 1.029 -19.448 19.343 809 HG2 PRO 105 2HG PRO 105 3.230 -19.185 21.356 810 HG3 PRO 105 3HG PRO 105 1.685 -20.044 21.493 811 HD2 PRO 105 2HD PRO 105 4.015 -21.314 20.957 812 HD3 PRO 105 3HD PRO 105 2.454 -21.874 20.323 813 H PHE 106 H PHE 106 2.684 -17.019 17.835 814 HA PHE 106 HA PHE 106 5.287 -16.074 18.666 815 HB2 PHE 106 2HB PHE 106 5.843 -15.165 16.409 816 HB3 PHE 106 3HB PHE 106 5.873 -16.923 16.484 817 HD1 PHE 106 HD2 PHE 106 3.651 -14.086 15.561 818 HD2 PHE 106 HD1 PHE 106 4.709 -18.158 14.917 819 HE1 PHE 106 HE2 PHE 106 2.089 -14.188 13.664 820 HE2 PHE 106 HE1 PHE 106 3.148 -18.266 13.017 821 HZ PHE 106 HZ PHE 106 1.835 -16.280 12.389 822 H ASP 107 H ASP 107 5.515 -13.692 18.223 823 HA ASP 107 HA ASP 107 2.970 -12.405 18.815 824 HB2 ASP 107 2HB ASP 107 5.844 -11.693 19.166 825 HB3 ASP 107 3HB ASP 107 4.680 -10.378 19.024 826 H ILE 108 H ILE 108 1.789 -11.689 17.176 827 HA ILE 108 HA ILE 108 2.487 -11.440 14.544 828 HB ILE 108 HB ILE 108 0.434 -9.917 16.133 829 HG12 ILE 108 2HG1 ILE 108 -0.136 -11.879 13.948 830 HG13 ILE 108 3HG1 ILE 108 0.385 -12.482 15.517 831 HG21 ILE 108 1HG2 ILE 108 1.256 -9.584 13.301 832 HG22 ILE 108 2HG2 ILE 108 -0.468 -9.548 13.668 833 HG23 ILE 108 3HG2 ILE 108 0.622 -8.400 14.444 834 HD11 ILE 108 3HD1 ILE 108 -1.702 -12.343 16.217 835 HD12 ILE 108 1HD1 ILE 108 -1.634 -10.593 16.012 836 HD13 ILE 108 2HD1 ILE 108 -2.197 -11.615 14.689 837 H ASP 109 H ASP 109 2.986 -9.120 17.124 838 HA ASP 109 HA ASP 109 3.595 -6.855 15.604 839 HB2 ASP 109 2HB ASP 109 3.255 -6.932 18.094 840 HB3 ASP 109 3HB ASP 109 4.873 -7.614 18.236 841 H GLU 110 H GLU 110 5.673 -9.498 16.722 842 HA GLU 110 HA GLU 110 8.021 -8.360 15.495 843 HB2 GLU 110 2HB GLU 110 7.656 -10.097 17.557 844 HB3 GLU 110 3HB GLU 110 8.067 -11.208 16.258 845 HG2 GLU 110 2HG GLU 110 10.205 -10.522 16.161 846 HG3 GLU 110 3HG GLU 110 9.797 -8.842 16.503 847 H ALA 111 H ALA 111 5.558 -10.674 14.665 848 HA ALA 111 HA ALA 111 6.937 -11.945 12.533 849 HB1 ALA 111 1HB ALA 111 5.159 -13.272 12.572 850 HB2 ALA 111 2HB ALA 111 4.459 -12.236 13.816 851 HB3 ALA 111 3HB ALA 111 4.100 -11.938 12.116 852 H VAL 112 H VAL 112 4.414 -9.423 12.548 853 HA VAL 112 HA VAL 112 4.247 -8.934 9.844 854 HB VAL 112 HB VAL 112 3.970 -7.061 12.183 855 HG11 VAL 112 1HG1 VAL 112 2.799 -5.570 10.443 856 HG12 VAL 112 2HG1 VAL 112 4.562 -5.549 10.510 857 HG13 VAL 112 3HG1 VAL 112 3.738 -6.471 9.253 858 HG21 VAL 112 3HG2 VAL 112 1.818 -7.944 10.296 859 HG22 VAL 112 1HG2 VAL 112 2.335 -8.982 11.624 860 HG23 VAL 112 2HG2 VAL 112 1.678 -7.380 11.961 861 H ALA 113 H ALA 113 6.645 -7.756 12.141 862 HA ALA 113 HA ALA 113 7.945 -6.085 10.174 863 HB1 ALA 113 1HB ALA 113 9.648 -6.436 12.380 864 HB2 ALA 113 2HB ALA 113 8.615 -5.052 12.020 865 HB3 ALA 113 3HB ALA 113 8.007 -6.369 13.024 866 H LEU 114 H LEU 114 8.278 -9.305 11.452 867 HA LEU 114 HA LEU 114 10.931 -9.846 10.757 868 HB2 LEU 114 2HB LEU 114 9.708 -11.349 12.161 869 HB3 LEU 114 3HB LEU 114 8.518 -11.642 10.894 870 HG LEU 114 HG LEU 114 10.477 -12.645 9.566 871 HD11 LEU 114 1HD1 LEU 114 12.289 -11.822 10.941 872 HD12 LEU 114 2HD1 LEU 114 12.266 -13.585 10.970 873 HD13 LEU 114 3HD1 LEU 114 11.645 -12.672 12.346 874 HD21 LEU 114 3HD2 LEU 114 9.043 -13.815 11.895 875 HD22 LEU 114 1HD2 LEU 114 10.310 -14.767 11.121 876 HD23 LEU 114 2HD2 LEU 114 8.927 -14.209 10.179 877 H VAL 115 H VAL 115 7.962 -10.014 8.858 878 HA VAL 115 HA VAL 115 9.266 -11.118 6.545 879 HB VAL 115 HB VAL 115 6.902 -11.576 6.945 880 HG11 VAL 115 1HG1 VAL 115 6.313 -9.457 8.020 881 HG12 VAL 115 2HG1 VAL 115 6.473 -8.627 6.471 882 HG13 VAL 115 3HG1 VAL 115 5.211 -9.839 6.698 883 HG21 VAL 115 3HG2 VAL 115 6.766 -9.903 4.506 884 HG22 VAL 115 1HG2 VAL 115 8.034 -11.128 4.569 885 HG23 VAL 115 2HG2 VAL 115 6.343 -11.599 4.744 886 H GLU 116 H GLU 116 8.329 -7.924 7.666 887 HA GLU 116 HA GLU 116 8.544 -6.452 5.336 888 HB2 GLU 116 2HB GLU 116 8.523 -5.914 8.160 889 HB3 GLU 116 3HB GLU 116 9.713 -4.887 7.374 890 HG2 GLU 116 2HG GLU 116 8.066 -3.981 5.904 891 HG3 GLU 116 3HG GLU 116 6.860 -5.139 6.462 892 H ARG 117 H ARG 117 11.039 -7.917 7.249 893 HA ARG 117 HA ARG 117 13.219 -6.392 6.237 894 HB2 ARG 117 2HB ARG 117 13.467 -9.210 7.252 895 HB3 ARG 117 3HB ARG 117 14.617 -7.887 7.386 896 HG2 ARG 117 2HG ARG 117 12.412 -6.935 8.729 897 HG3 ARG 117 3HG ARG 117 12.438 -8.650 9.146 898 HD2 ARG 117 2HD ARG 117 13.912 -8.037 10.720 899 HD3 ARG 117 3HD ARG 117 15.068 -7.982 9.390 900 HE ARG 117 HE ARG 117 13.629 -5.524 9.778 901 HH11 ARG 117 1HH1 ARG 117 16.395 -7.408 10.737 902 HH12 ARG 117 2HH1 ARG 117 17.310 -6.035 11.267 903 HH21 ARG 117 1HH2 ARG 117 14.824 -3.709 10.472 904 HH22 ARG 117 2HH2 ARG 117 16.415 -3.932 11.116 905 H ALA 118 H ALA 118 11.934 -9.613 5.441 906 HA ALA 118 HA ALA 118 13.754 -10.279 3.440 907 HB1 ALA 118 1HB ALA 118 11.266 -11.293 4.431 908 HB2 ALA 118 2HB ALA 118 11.275 -11.352 2.668 909 HB3 ALA 118 3HB ALA 118 12.559 -12.142 3.583 910 H ILE 119 H ILE 119 10.806 -8.355 3.294 911 HA ILE 119 HA ILE 119 10.891 -8.089 0.429 912 HB ILE 119 HB ILE 119 9.257 -6.608 2.493 913 HG12 ILE 119 2HG1 ILE 119 8.339 -8.719 0.542 914 HG13 ILE 119 3HG1 ILE 119 8.897 -9.114 2.164 915 HG21 ILE 119 1HG2 ILE 119 9.051 -6.609 -0.515 916 HG22 ILE 119 2HG2 ILE 119 7.873 -5.892 0.583 917 HG23 ILE 119 3HG2 ILE 119 9.513 -5.249 0.508 918 HD11 ILE 119 3HD1 ILE 119 6.358 -8.785 1.656 919 HD12 ILE 119 1HD1 ILE 119 7.058 -8.201 3.165 920 HD13 ILE 119 2HD1 ILE 119 6.756 -7.077 1.839 921 H SER 120 H SER 120 11.480 -5.916 3.186 922 HA SER 120 HA SER 120 12.206 -3.655 1.712 923 HB2 SER 120 2HB SER 120 11.715 -3.716 4.174 924 HB3 SER 120 3HB SER 120 13.305 -4.436 4.421 925 HG SER 120 HG SER 120 14.259 -2.577 3.811 926 H HIS 121 H HIS 121 13.971 -6.542 2.480 927 HA HIS 121 HA HIS 121 16.599 -5.702 2.206 928 HB2 HIS 121 2HB HIS 121 15.766 -8.007 2.863 929 HB3 HIS 121 3HB HIS 121 15.546 -8.325 1.145 930 HD1 HIS 121 HD1 HIS 121 17.628 -8.817 -0.239 931 HD2 HIS 121 HD2 HIS 121 18.467 -7.817 3.705 932 HE1 HIS 121 HE1 HIS 121 20.061 -9.364 0.090 933 H TYR 122 H TYR 122 14.137 -6.109 -0.202 934 HA TYR 122 HA TYR 122 16.100 -5.753 -2.354 935 HB2 TYR 122 2HB TYR 122 13.162 -6.350 -2.686 936 HB3 TYR 122 3HB TYR 122 14.448 -6.552 -3.870 937 HD1 TYR 122 HD1 TYR 122 16.443 -8.141 -2.883 938 HD2 TYR 122 HD2 TYR 122 12.333 -8.300 -1.797 939 HE1 TYR 122 HE1 TYR 122 16.725 -10.482 -2.183 940 HE2 TYR 122 HE2 TYR 122 12.603 -10.641 -1.093 941 HH TYR 122 HH TYR 122 15.342 -12.487 -1.865 942 H GLN 123 H GLN 123 13.509 -4.188 -0.672 943 HA GLN 123 HA GLN 123 13.680 -1.914 -2.538 944 HB2 GLN 123 2HB GLN 123 11.399 -2.937 -0.865 945 HB3 GLN 123 3HB GLN 123 11.422 -1.287 -1.470 946 HG2 GLN 123 2HG GLN 123 10.771 -1.925 -3.490 947 HG3 GLN 123 3HG GLN 123 11.999 -3.187 -3.565 948 HE21 GLN 123 1HE2 GLN 123 9.061 -3.021 -4.272 949 HE22 GLN 123 2HE2 GLN 123 8.369 -4.414 -3.521 950 H GLU 124 H GLU 124 15.667 -2.050 -0.731 951 HA GLU 124 HA GLU 124 15.037 -0.703 1.718 952 HB2 GLU 124 2HB GLU 124 17.249 -2.101 0.664 953 HB3 GLU 124 3HB GLU 124 17.813 -0.470 1.001 954 HG2 GLU 124 2HG GLU 124 16.559 -2.406 2.927 955 HG3 GLU 124 3HG GLU 124 18.217 -1.808 2.925 Start of MODEL 10 1 H1 MET 1 H MET 1 0.055 -0.108 -2.544 2 HA MET 1 HA MET 1 0.192 -1.191 -4.572 3 HB2 MET 1 2HB MET 1 2.237 -0.650 -5.749 4 HB3 MET 1 3HB MET 1 1.778 0.704 -4.725 5 HG2 MET 1 2HG MET 1 3.483 -0.976 -3.216 6 HG3 MET 1 3HG MET 1 4.224 -0.730 -4.796 7 HE1 MET 1 3HE MET 1 6.342 0.673 -3.290 8 HE2 MET 1 1HE MET 1 5.894 0.766 -4.993 9 HE3 MET 1 2HE MET 1 6.191 2.244 -4.078 10 H GLN 2 H GLN 2 0.660 -2.931 -2.220 11 HA GLN 2 HA GLN 2 1.364 -5.039 -1.714 12 HB2 GLN 2 2HB GLN 2 1.456 -5.460 -4.699 13 HB3 GLN 2 3HB GLN 2 1.158 -6.664 -3.452 14 HG2 GLN 2 2HG GLN 2 -0.956 -6.303 -4.250 15 HG3 GLN 2 3HG GLN 2 -0.902 -5.178 -2.893 16 HE21 GLN 2 1HE2 GLN 2 -2.112 -3.513 -3.482 17 HE22 GLN 2 2HE2 GLN 2 -1.957 -2.627 -4.957 18 H ARG 3 H ARG 3 3.427 -3.195 -1.713 19 HA ARG 3 HA ARG 3 5.665 -3.785 -3.248 20 HB2 ARG 3 2HB ARG 3 6.970 -2.864 -1.294 21 HB3 ARG 3 3HB ARG 3 5.690 -1.823 -1.903 22 HG2 ARG 3 2HG ARG 3 5.274 -1.631 0.314 23 HG3 ARG 3 3HG ARG 3 4.302 -3.067 -0.016 24 HD2 ARG 3 2HD ARG 3 5.666 -3.368 1.984 25 HD3 ARG 3 3HD ARG 3 6.146 -4.490 0.712 26 HE ARG 3 HE ARG 3 7.817 -2.368 0.385 27 HH11 ARG 3 1HH1 ARG 3 7.008 -4.446 3.059 28 HH12 ARG 3 2HH1 ARG 3 8.567 -4.312 3.804 29 HH21 ARG 3 1HH2 ARG 3 9.873 -2.184 1.356 30 HH22 ARG 3 2HH2 ARG 3 10.195 -3.025 2.834 31 H GLY 4 H GLY 4 4.196 -5.595 -0.718 32 HA2 GLY 4 2HA GLY 4 6.146 -7.713 -1.083 33 HA3 GLY 4 3HA GLY 4 6.088 -7.027 0.534 34 H ILE 5 H ILE 5 4.541 -9.085 -1.757 35 HA ILE 5 HA ILE 5 2.125 -9.420 -0.216 36 HB ILE 5 HB ILE 5 3.201 -10.899 -2.615 37 HG12 ILE 5 2HG1 ILE 5 0.757 -9.143 -2.421 38 HG13 ILE 5 3HG1 ILE 5 2.347 -8.493 -2.804 39 HG21 ILE 5 1HG2 ILE 5 0.772 -11.381 -0.941 40 HG22 ILE 5 2HG2 ILE 5 0.747 -11.743 -2.666 41 HG23 ILE 5 3HG2 ILE 5 1.916 -12.542 -1.615 42 HD11 ILE 5 3HD1 ILE 5 1.845 -10.721 -4.497 43 HD12 ILE 5 1HD1 ILE 5 0.455 -9.637 -4.548 44 HD13 ILE 5 2HD1 ILE 5 2.066 -9.025 -4.927 45 H VAL 6 H VAL 6 1.579 -11.117 1.094 46 HA VAL 6 HA VAL 6 3.680 -13.109 1.643 47 HB VAL 6 HB VAL 6 1.860 -11.940 3.747 48 HG11 VAL 6 1HG1 VAL 6 3.670 -14.168 3.660 49 HG12 VAL 6 2HG1 VAL 6 4.217 -12.984 4.849 50 HG13 VAL 6 3HG1 VAL 6 2.590 -13.656 4.956 51 HG21 VAL 6 3HG2 VAL 6 4.425 -10.968 2.663 52 HG22 VAL 6 1HG2 VAL 6 3.132 -10.094 3.485 53 HG23 VAL 6 2HG2 VAL 6 4.303 -11.023 4.422 54 H TRP 7 H TRP 7 3.025 -15.141 1.431 55 HA TRP 7 HA TRP 7 0.132 -15.688 1.476 56 HB2 TRP 7 2HB TRP 7 2.374 -17.052 -0.019 57 HB3 TRP 7 3HB TRP 7 0.747 -17.715 0.097 58 HD1 TRP 7 HD1 TRP 7 0.128 -14.190 -0.151 59 HE1 TRP 7 HE1 TRP 7 -0.302 -13.447 -2.577 60 HE3 TRP 7 HE3 TRP 7 1.915 -18.311 -2.591 61 HZ2 TRP 7 HZ2 TRP 7 0.067 -14.472 -5.181 62 HZ3 TRP 7 HZ3 TRP 7 1.840 -18.351 -5.051 63 HH2 TRP 7 HH2 TRP 7 0.934 -16.470 -6.317 64 H VAL 8 H VAL 8 -0.543 -17.777 2.315 65 HA VAL 8 HA VAL 8 1.350 -19.019 4.183 66 HB VAL 8 HB VAL 8 -1.422 -18.058 4.897 67 HG11 VAL 8 1HG1 VAL 8 -1.062 -20.288 5.806 68 HG12 VAL 8 2HG1 VAL 8 0.472 -19.768 6.507 69 HG13 VAL 8 3HG1 VAL 8 -1.044 -19.081 7.090 70 HG21 VAL 8 3HG2 VAL 8 0.994 -17.437 6.504 71 HG22 VAL 8 1HG2 VAL 8 0.797 -16.602 4.963 72 HG23 VAL 8 2HG2 VAL 8 -0.448 -16.467 6.205 73 H VAL 9 H VAL 9 0.986 -21.192 4.614 74 HA VAL 9 HA VAL 9 -1.254 -22.482 3.223 75 HB VAL 9 HB VAL 9 0.688 -22.654 1.736 76 HG11 VAL 9 1HG1 VAL 9 2.058 -23.192 4.200 77 HG12 VAL 9 2HG1 VAL 9 2.335 -24.503 3.052 78 HG13 VAL 9 3HG1 VAL 9 2.723 -22.841 2.605 79 HG21 VAL 9 3HG2 VAL 9 -0.419 -24.527 1.217 80 HG22 VAL 9 1HG2 VAL 9 0.817 -25.368 2.152 81 HG23 VAL 9 2HG2 VAL 9 -0.712 -24.925 2.910 82 H ASP 10 H ASP 10 -1.808 -22.322 5.641 83 HA ASP 10 HA ASP 10 -0.624 -24.562 7.131 84 HB2 ASP 10 2HB ASP 10 -1.636 -23.532 9.131 85 HB3 ASP 10 3HB ASP 10 -0.552 -22.421 8.300 86 H ASP 11 H ASP 11 -2.370 -25.491 8.758 87 HA ASP 11 HA ASP 11 -4.789 -26.103 7.189 88 HB2 ASP 11 2HB ASP 11 -2.789 -27.890 7.786 89 HB3 ASP 11 3HB ASP 11 -3.939 -28.169 9.092 90 H ASP 12 H ASP 12 -4.325 -24.095 9.302 91 HA ASP 12 HA ASP 12 -6.429 -25.001 11.143 92 HB2 ASP 12 2HB ASP 12 -3.711 -24.091 11.801 93 HB3 ASP 12 3HB ASP 12 -4.985 -23.285 12.711 94 H SER 13 H SER 13 -7.801 -23.367 11.944 95 HA SER 13 HA SER 13 -8.194 -21.193 10.114 96 HB2 SER 13 2HB SER 13 -10.306 -21.295 10.863 97 HB3 SER 13 3HB SER 13 -9.810 -22.638 11.891 98 HG SER 13 HG SER 13 -9.679 -21.322 13.585 99 H SER 14 H SER 14 -7.370 -21.449 13.561 100 HA SER 14 HA SER 14 -7.083 -18.644 13.940 101 HB2 SER 14 2HB SER 14 -6.756 -19.167 16.124 102 HB3 SER 14 3HB SER 14 -7.293 -20.772 15.627 103 HG SER 14 HG SER 14 -5.033 -20.212 16.733 104 H ILE 15 H ILE 15 -5.056 -21.085 12.637 105 HA ILE 15 HA ILE 15 -2.573 -19.698 13.109 106 HB ILE 15 HB ILE 15 -3.238 -22.071 11.366 107 HG12 ILE 15 2HG1 ILE 15 -3.390 -22.503 13.769 108 HG13 ILE 15 3HG1 ILE 15 -1.994 -23.328 13.084 109 HG21 ILE 15 1HG2 ILE 15 -1.374 -20.974 10.357 110 HG22 ILE 15 2HG2 ILE 15 -0.589 -20.750 11.919 111 HG23 ILE 15 3HG2 ILE 15 -0.758 -22.369 11.242 112 HD11 ILE 15 3HD1 ILE 15 -0.981 -20.894 13.889 113 HD12 ILE 15 1HD1 ILE 15 -2.132 -21.315 15.157 114 HD13 ILE 15 2HD1 ILE 15 -0.830 -22.430 14.743 115 H ARG 16 H ARG 16 -4.847 -20.088 10.444 116 HA ARG 16 HA ARG 16 -3.198 -18.619 8.591 117 HB2 ARG 16 2HB ARG 16 -5.053 -18.876 7.038 118 HB3 ARG 16 3HB ARG 16 -4.700 -20.411 7.819 119 HG2 ARG 16 2HG ARG 16 -6.580 -20.006 9.374 120 HG3 ARG 16 3HG ARG 16 -6.963 -18.538 8.473 121 HD2 ARG 16 2HD ARG 16 -6.694 -20.706 6.639 122 HD3 ARG 16 3HD ARG 16 -7.782 -21.192 7.939 123 HE ARG 16 HE ARG 16 -8.453 -18.608 7.002 124 HH11 ARG 16 1HH1 ARG 16 -8.633 -21.973 6.127 125 HH12 ARG 16 2HH1 ARG 16 -10.046 -21.776 5.142 126 HH21 ARG 16 1HH2 ARG 16 -10.312 -18.336 5.709 127 HH22 ARG 16 2HH2 ARG 16 -10.999 -19.706 4.905 128 H TRP 17 H TRP 17 -6.082 -18.002 10.534 129 HA TRP 17 HA TRP 17 -6.781 -15.504 9.533 130 HB2 TRP 17 2HB TRP 17 -8.319 -16.484 11.013 131 HB3 TRP 17 3HB TRP 17 -7.090 -16.775 12.241 132 HD1 TRP 17 HD1 TRP 17 -9.071 -13.837 10.694 133 HE1 TRP 17 HE1 TRP 17 -9.253 -11.977 12.464 134 HE3 TRP 17 HE3 TRP 17 -6.152 -15.905 14.346 135 HZ2 TRP 17 HZ2 TRP 17 -8.286 -11.456 15.064 136 HZ3 TRP 17 HZ3 TRP 17 -5.830 -14.661 16.444 137 HH2 TRP 17 HH2 TRP 17 -6.876 -12.482 16.794 138 H VAL 18 H VAL 18 -4.735 -16.206 12.372 139 HA VAL 18 HA VAL 18 -4.007 -13.643 13.049 140 HB VAL 18 HB VAL 18 -1.818 -14.671 13.840 141 HG11 VAL 18 1HG1 VAL 18 -2.843 -15.711 15.701 142 HG12 VAL 18 2HG1 VAL 18 -3.965 -14.461 15.159 143 HG13 VAL 18 3HG1 VAL 18 -4.269 -16.153 14.762 144 HG21 VAL 18 3HG2 VAL 18 -1.240 -16.555 12.775 145 HG22 VAL 18 1HG2 VAL 18 -2.394 -17.348 13.847 146 HG23 VAL 18 2HG2 VAL 18 -2.888 -16.860 12.226 147 H LEU 19 H LEU 19 -2.423 -15.778 10.690 148 HA LEU 19 HA LEU 19 -0.423 -13.894 9.961 149 HB2 LEU 19 2HB LEU 19 -1.443 -16.449 8.790 150 HB3 LEU 19 3HB LEU 19 -0.323 -15.444 7.874 151 HG LEU 19 HG LEU 19 0.317 -16.414 10.646 152 HD11 LEU 19 1HD1 LEU 19 0.129 -17.965 8.207 153 HD12 LEU 19 2HD1 LEU 19 0.400 -18.495 9.867 154 HD13 LEU 19 3HD1 LEU 19 1.761 -17.973 8.875 155 HD21 LEU 19 3HD2 LEU 19 1.568 -14.515 9.451 156 HD22 LEU 19 1HD2 LEU 19 2.207 -15.783 8.405 157 HD23 LEU 19 2HD2 LEU 19 2.518 -15.832 10.141 158 H GLU 20 H GLU 20 -3.720 -14.311 9.092 159 HA GLU 20 HA GLU 20 -3.535 -12.902 6.582 160 HB2 GLU 20 2HB GLU 20 -5.394 -14.608 7.726 161 HB3 GLU 20 3HB GLU 20 -6.192 -13.042 7.777 162 HG2 GLU 20 2HG GLU 20 -5.733 -12.788 5.354 163 HG3 GLU 20 3HG GLU 20 -5.088 -14.428 5.347 164 H ARG 21 H ARG 21 -5.190 -12.201 9.667 165 HA ARG 21 HA ARG 21 -5.851 -9.560 9.123 166 HB2 ARG 21 2HB ARG 21 -6.085 -9.271 11.534 167 HB3 ARG 21 3HB ARG 21 -6.746 -10.821 11.031 168 HG2 ARG 21 2HG ARG 21 -5.016 -12.021 12.003 169 HG3 ARG 21 3HG ARG 21 -3.941 -10.622 12.046 170 HD2 ARG 21 2HD ARG 21 -6.433 -10.314 13.567 171 HD3 ARG 21 3HD ARG 21 -5.348 -11.565 14.172 172 HE ARG 21 HE ARG 21 -3.907 -9.189 13.669 173 HH11 ARG 21 1HH1 ARG 21 -6.200 -10.568 15.896 174 HH12 ARG 21 2HH1 ARG 21 -5.689 -9.589 17.232 175 HH21 ARG 21 1HH2 ARG 21 -3.226 -7.894 15.419 176 HH22 ARG 21 2HH2 ARG 21 -3.998 -8.068 16.959 177 H ALA 22 H ALA 22 -2.805 -10.955 9.985 178 HA ALA 22 HA ALA 22 -1.518 -8.651 10.987 179 HB1 ALA 22 1HB ALA 22 -0.184 -10.385 11.484 180 HB2 ALA 22 2HB ALA 22 -0.715 -11.325 10.089 181 HB3 ALA 22 3HB ALA 22 0.518 -10.079 9.896 182 H LEU 23 H LEU 23 -1.942 -9.926 7.728 183 HA LEU 23 HA LEU 23 -0.274 -7.874 6.554 184 HB2 LEU 23 2HB LEU 23 -2.111 -9.747 5.091 185 HB3 LEU 23 3HB LEU 23 -0.674 -8.929 4.479 186 HG LEU 23 HG LEU 23 -0.549 -11.047 6.614 187 HD11 LEU 23 1HD1 LEU 23 -0.211 -11.434 3.645 188 HD12 LEU 23 2HD1 LEU 23 -1.614 -11.954 4.578 189 HD13 LEU 23 3HD1 LEU 23 -0.030 -12.659 4.901 190 HD21 LEU 23 3HD2 LEU 23 1.371 -9.497 6.344 191 HD22 LEU 23 1HD2 LEU 23 1.527 -10.040 4.673 192 HD23 LEU 23 2HD2 LEU 23 1.770 -11.180 5.996 193 H ALA 24 H ALA 24 -3.714 -8.630 6.807 194 HA ALA 24 HA ALA 24 -4.800 -6.772 5.090 195 HB1 ALA 24 1HB ALA 24 -6.294 -8.272 6.074 196 HB2 ALA 24 2HB ALA 24 -5.774 -7.862 7.709 197 HB3 ALA 24 3HB ALA 24 -6.729 -6.713 6.774 198 H GLY 25 H GLY 25 -3.861 -6.288 8.489 199 HA2 GLY 25 2HA GLY 25 -4.476 -3.454 8.325 200 HA3 GLY 25 3HA GLY 25 -3.880 -4.314 9.737 201 H ALA 26 H ALA 26 -1.937 -5.257 7.282 202 HA ALA 26 HA ALA 26 0.112 -3.310 8.046 203 HB1 ALA 26 1HB ALA 26 1.703 -4.925 7.070 204 HB2 ALA 26 2HB ALA 26 0.721 -5.625 8.358 205 HB3 ALA 26 3HB ALA 26 0.348 -5.983 6.672 206 H GLY 27 H GLY 27 -1.920 -4.169 5.425 207 HA2 GLY 27 2HA GLY 27 -2.257 -2.851 3.511 208 HA3 GLY 27 3HA GLY 27 -0.707 -2.074 3.800 209 H LEU 28 H LEU 28 -1.148 -5.551 3.749 210 HA LEU 28 HA LEU 28 0.121 -5.675 1.104 211 HB2 LEU 28 2HB LEU 28 1.000 -7.759 2.950 212 HB3 LEU 28 3HB LEU 28 1.926 -6.801 1.797 213 HG LEU 28 HG LEU 28 1.067 -5.773 4.496 214 HD11 LEU 28 1HD1 LEU 28 2.877 -6.654 5.489 215 HD12 LEU 28 2HD1 LEU 28 3.888 -6.458 4.058 216 HD13 LEU 28 3HD1 LEU 28 2.794 -7.835 4.181 217 HD21 LEU 28 3HD2 LEU 28 3.451 -4.674 3.258 218 HD22 LEU 28 1HD2 LEU 28 2.036 -3.853 3.916 219 HD23 LEU 28 2HD2 LEU 28 2.014 -4.456 2.259 220 H THR 29 H THR 29 -0.420 -7.448 -0.146 221 HA THR 29 HA THR 29 -2.941 -8.517 0.053 222 HB THR 29 HB THR 29 -0.632 -9.996 -1.212 223 HG1 THR 29 HG1 THR 29 -2.197 -7.860 -2.275 224 HG21 THR 29 3HG2 THR 29 -3.592 -10.100 -1.408 225 HG22 THR 29 1HG2 THR 29 -2.405 -11.398 -1.520 226 HG23 THR 29 2HG2 THR 29 -2.671 -10.326 -2.895 227 H CYS 30 H CYS 30 -3.727 -10.637 0.558 228 HA CYS 30 HA CYS 30 -2.056 -12.227 2.361 229 HB2 CYS 30 2HB CYS 30 -4.060 -12.456 3.897 230 HB3 CYS 30 3HB CYS 30 -3.257 -10.890 3.915 231 HG CYS 30 HG CYS 30 -5.465 -9.622 3.651 232 H THR 31 H THR 31 -2.017 -14.204 1.542 233 HA THR 31 HA THR 31 -4.509 -15.317 0.431 234 HB THR 31 HB THR 31 -1.779 -16.066 -0.599 235 HG1 THR 31 HG1 THR 31 -2.514 -13.731 -0.883 236 HG21 THR 31 3HG2 THR 31 -2.988 -16.967 -2.466 237 HG22 THR 31 1HG2 THR 31 -4.502 -16.276 -1.883 238 HG23 THR 31 2HG2 THR 31 -3.728 -17.585 -0.989 239 H THR 32 H THR 32 -5.194 -16.856 1.761 240 HA THR 32 HA THR 32 -3.219 -18.502 3.182 241 HB THR 32 HB THR 32 -4.962 -19.084 4.745 242 HG1 THR 32 HG1 THR 32 -6.773 -17.413 3.340 243 HG21 THR 32 3HG2 THR 32 -4.096 -16.404 4.275 244 HG22 THR 32 1HG2 THR 32 -4.489 -17.184 5.807 245 HG23 THR 32 2HG2 THR 32 -5.751 -16.368 4.884 246 H PHE 33 H PHE 33 -3.059 -20.646 2.845 247 HA PHE 33 HA PHE 33 -5.011 -21.883 1.016 248 HB2 PHE 33 2HB PHE 33 -2.038 -22.409 1.214 249 HB3 PHE 33 3HB PHE 33 -3.155 -23.307 0.191 250 HD1 PHE 33 HD1 PHE 33 -4.412 -22.027 -1.608 251 HD2 PHE 33 HD2 PHE 33 -1.045 -20.444 0.460 252 HE1 PHE 33 HE1 PHE 33 -4.081 -20.386 -3.411 253 HE2 PHE 33 HE2 PHE 33 -0.709 -18.800 -1.339 254 HZ PHE 33 HZ PHE 33 -2.228 -18.768 -3.277 255 H GLU 34 H GLU 34 -4.228 -24.488 1.161 256 HA GLU 34 HA GLU 34 -3.865 -25.389 3.846 257 HB2 GLU 34 2HB GLU 34 -6.103 -26.499 4.030 258 HB3 GLU 34 3HB GLU 34 -6.149 -24.746 4.148 259 HG2 GLU 34 2HG GLU 34 -7.186 -24.495 2.117 260 HG3 GLU 34 3HG GLU 34 -6.584 -26.031 1.499 261 H ASN 35 H ASN 35 -2.244 -26.211 2.129 262 HA ASN 35 HA ASN 35 -2.518 -28.960 1.871 263 HB2 ASN 35 2HB ASN 35 -3.811 -27.468 -0.262 264 HB3 ASN 35 3HB ASN 35 -2.545 -28.523 -0.885 265 HD21 ASN 35 1HD2 ASN 35 -2.635 -30.693 0.642 266 HD22 ASN 35 2HD2 ASN 35 -4.177 -31.466 0.546 267 H GLY 36 H GLY 36 -1.268 -26.228 -0.056 268 HA2 GLY 36 2HA GLY 36 1.079 -25.644 0.076 269 HA3 GLY 36 3HA GLY 36 1.435 -27.347 0.323 270 H ASN 37 H ASN 37 0.293 -28.680 -1.627 271 HA ASN 37 HA ASN 37 1.886 -28.199 -3.868 272 HB2 ASN 37 2HB ASN 37 0.608 -29.940 -4.970 273 HB3 ASN 37 3HB ASN 37 0.873 -30.395 -3.289 274 HD21 ASN 37 1HD2 ASN 37 -0.856 -30.393 -1.855 275 HD22 ASN 37 2HD2 ASN 37 -2.496 -30.365 -2.398 276 H GLU 38 H GLU 38 -1.093 -26.799 -2.924 277 HA GLU 38 HA GLU 38 -1.805 -25.943 -5.606 278 HB2 GLU 38 2HB GLU 38 -3.156 -24.821 -3.203 279 HB3 GLU 38 3HB GLU 38 -3.838 -25.313 -4.746 280 HG2 GLU 38 2HG GLU 38 -3.085 -27.705 -3.860 281 HG3 GLU 38 3HG GLU 38 -3.313 -26.900 -2.309 282 H VAL 39 H VAL 39 0.134 -24.853 -3.050 283 HA VAL 39 HA VAL 39 -0.110 -22.033 -3.711 284 HB VAL 39 HB VAL 39 1.930 -23.228 -1.850 285 HG11 VAL 39 1HG1 VAL 39 2.459 -21.111 -1.447 286 HG12 VAL 39 2HG1 VAL 39 1.314 -20.609 -2.693 287 HG13 VAL 39 3HG1 VAL 39 0.789 -20.746 -1.014 288 HG21 VAL 39 3HG2 VAL 39 0.134 -24.099 -0.769 289 HG22 VAL 39 1HG2 VAL 39 0.023 -22.454 -0.145 290 HG23 VAL 39 2HG2 VAL 39 -0.996 -22.956 -1.493 291 H LEU 40 H LEU 40 2.222 -24.662 -4.050 292 HA LEU 40 HA LEU 40 4.442 -23.307 -4.944 293 HB2 LEU 40 2HB LEU 40 4.857 -25.532 -4.710 294 HB3 LEU 40 3HB LEU 40 3.317 -26.006 -5.423 295 HG LEU 40 HG LEU 40 4.188 -25.603 -7.649 296 HD11 LEU 40 1HD1 LEU 40 5.791 -24.079 -7.883 297 HD12 LEU 40 2HD1 LEU 40 6.924 -25.316 -7.341 298 HD13 LEU 40 3HD1 LEU 40 6.238 -24.179 -6.180 299 HD21 LEU 40 3HD2 LEU 40 6.453 -27.158 -6.811 300 HD22 LEU 40 1HD2 LEU 40 4.993 -27.671 -7.658 301 HD23 LEU 40 2HD2 LEU 40 5.019 -27.624 -5.895 302 H ALA 41 H ALA 41 1.628 -24.351 -6.831 303 HA ALA 41 HA ALA 41 2.637 -23.344 -9.308 304 HB1 ALA 41 1HB ALA 41 -0.265 -23.850 -8.756 305 HB2 ALA 41 2HB ALA 41 0.632 -24.049 -10.261 306 HB3 ALA 41 3HB ALA 41 0.879 -25.181 -8.931 307 H ALA 42 H ALA 42 0.829 -22.012 -6.663 308 HA ALA 42 HA ALA 42 -0.390 -19.837 -7.954 309 HB1 ALA 42 1HB ALA 42 0.602 -19.921 -5.108 310 HB2 ALA 42 2HB ALA 42 -0.658 -18.876 -5.767 311 HB3 ALA 42 3HB ALA 42 -0.923 -20.616 -5.659 312 H LEU 43 H LEU 43 2.847 -20.274 -6.648 313 HA LEU 43 HA LEU 43 3.717 -17.625 -6.668 314 HB2 LEU 43 2HB LEU 43 5.548 -19.844 -7.467 315 HB3 LEU 43 3HB LEU 43 5.866 -18.447 -6.439 316 HG LEU 43 HG LEU 43 4.398 -20.976 -5.718 317 HD11 LEU 43 1HD1 LEU 43 7.009 -19.727 -4.995 318 HD12 LEU 43 2HD1 LEU 43 6.637 -21.400 -5.408 319 HD13 LEU 43 3HD1 LEU 43 6.182 -20.760 -3.829 320 HD21 LEU 43 3HD2 LEU 43 3.201 -19.841 -4.235 321 HD22 LEU 43 1HD2 LEU 43 3.964 -18.329 -4.727 322 HD23 LEU 43 2HD2 LEU 43 4.698 -19.316 -3.463 323 H ALA 44 H ALA 44 3.509 -19.988 -9.264 324 HA ALA 44 HA ALA 44 4.982 -18.558 -11.197 325 HB1 ALA 44 1HB ALA 44 4.671 -20.776 -11.751 326 HB2 ALA 44 2HB ALA 44 2.961 -20.755 -11.315 327 HB3 ALA 44 3HB ALA 44 3.502 -19.974 -12.801 328 H SER 45 H SER 45 1.991 -17.905 -9.785 329 HA SER 45 HA SER 45 0.743 -16.642 -12.041 330 HB2 SER 45 2HB SER 45 0.082 -16.336 -9.104 331 HB3 SER 45 3HB SER 45 -0.961 -15.930 -10.466 332 HG SER 45 HG SER 45 0.017 -18.533 -10.343 333 H LYS 46 H LYS 46 1.624 -15.197 -8.909 334 HA LYS 46 HA LYS 46 2.636 -12.850 -10.377 335 HB2 LYS 46 2HB LYS 46 1.814 -11.449 -8.513 336 HB3 LYS 46 3HB LYS 46 0.513 -12.284 -9.351 337 HG2 LYS 46 2HG LYS 46 0.836 -14.067 -7.472 338 HG3 LYS 46 3HG LYS 46 1.593 -12.726 -6.610 339 HD2 LYS 46 2HD LYS 46 -1.136 -12.537 -7.868 340 HD3 LYS 46 3HD LYS 46 -0.880 -13.052 -6.199 341 HE2 LYS 46 2HE LYS 46 -0.692 -10.941 -5.534 342 HE3 LYS 46 3HE LYS 46 0.595 -10.650 -6.702 343 HZ1 LYS 46 3HZ LYS 46 -0.852 -9.265 -7.647 344 HZ2 LYS 46 1HZ LYS 46 -2.177 -9.904 -6.811 345 HZ3 LYS 46 2HZ LYS 46 -1.637 -10.644 -8.232 346 H THR 47 H THR 47 3.306 -15.309 -8.186 347 HA THR 47 HA THR 47 5.106 -15.816 -6.888 348 HB THR 47 HB THR 47 6.879 -13.651 -7.668 349 HG1 THR 47 HG1 THR 47 6.376 -13.524 -9.711 350 HG21 THR 47 3HG2 THR 47 7.122 -16.258 -6.954 351 HG22 THR 47 1HG2 THR 47 8.382 -15.333 -7.770 352 HG23 THR 47 2HG2 THR 47 7.306 -16.372 -8.704 353 HA PRO 48 HA PRO 48 4.163 -12.866 -3.614 354 HB2 PRO 48 2HB PRO 48 4.751 -14.583 -1.595 355 HB3 PRO 48 3HB PRO 48 3.215 -14.618 -2.469 356 HG2 PRO 48 2HG PRO 48 5.638 -16.338 -2.831 357 HG3 PRO 48 3HG PRO 48 3.927 -16.804 -2.816 358 HD2 PRO 48 2HD PRO 48 5.334 -16.499 -5.109 359 HD3 PRO 48 3HD PRO 48 3.598 -16.143 -4.999 360 H ASP 49 H ASP 49 5.418 -12.117 -1.683 361 HA ASP 49 HA ASP 49 8.263 -11.988 -2.375 362 HB2 ASP 49 2HB ASP 49 6.611 -9.949 -1.902 363 HB3 ASP 49 3HB ASP 49 7.099 -10.268 -0.240 364 H VAL 50 H VAL 50 6.244 -13.642 -0.323 365 HA VAL 50 HA VAL 50 8.323 -14.868 1.109 366 HB VAL 50 HB VAL 50 8.421 -12.707 2.298 367 HG11 VAL 50 1HG1 VAL 50 6.124 -12.855 3.924 368 HG12 VAL 50 2HG1 VAL 50 6.551 -11.602 2.758 369 HG13 VAL 50 3HG1 VAL 50 5.577 -12.983 2.253 370 HG21 VAL 50 3HG2 VAL 50 7.299 -14.452 4.382 371 HG22 VAL 50 1HG2 VAL 50 8.525 -15.196 3.356 372 HG23 VAL 50 2HG2 VAL 50 8.899 -13.723 4.251 373 H LEU 51 H LEU 51 7.603 -16.596 2.391 374 HA LEU 51 HA LEU 51 4.695 -17.045 2.413 375 HB2 LEU 51 2HB LEU 51 6.594 -18.441 0.882 376 HB3 LEU 51 3HB LEU 51 6.138 -19.517 2.201 377 HG LEU 51 HG LEU 51 3.929 -18.217 0.718 378 HD11 LEU 51 1HD1 LEU 51 4.613 -20.610 -0.659 379 HD12 LEU 51 2HD1 LEU 51 6.002 -19.525 -0.689 380 HD13 LEU 51 3HD1 LEU 51 4.442 -18.975 -1.298 381 HD21 LEU 51 3HD2 LEU 51 4.451 -20.623 2.313 382 HD22 LEU 51 1HD2 LEU 51 3.409 -20.877 0.912 383 HD23 LEU 51 2HD2 LEU 51 2.973 -19.677 2.129 384 H LEU 52 H LEU 52 3.890 -18.299 4.124 385 HA LEU 52 HA LEU 52 5.788 -18.988 6.253 386 HB2 LEU 52 2HB LEU 52 3.296 -17.325 6.547 387 HB3 LEU 52 3HB LEU 52 4.129 -18.078 7.906 388 HG LEU 52 HG LEU 52 6.180 -16.740 7.143 389 HD11 LEU 52 1HD1 LEU 52 4.958 -14.511 6.109 390 HD12 LEU 52 2HD1 LEU 52 4.164 -15.829 5.249 391 HD13 LEU 52 3HD1 LEU 52 5.920 -15.677 5.200 392 HD21 LEU 52 3HD2 LEU 52 5.689 -15.224 8.741 393 HD22 LEU 52 1HD2 LEU 52 4.302 -16.280 9.010 394 HD23 LEU 52 2HD2 LEU 52 4.123 -14.822 8.034 395 H SER 53 H SER 53 5.486 -21.170 5.713 396 HA SER 53 HA SER 53 2.821 -22.303 5.790 397 HB2 SER 53 2HB SER 53 3.780 -24.292 5.009 398 HB3 SER 53 3HB SER 53 4.793 -23.049 4.276 399 HG SER 53 HG SER 53 6.084 -23.397 6.345 400 H ASP 54 H ASP 54 1.888 -23.281 7.477 401 HA ASP 54 HA ASP 54 3.148 -23.139 10.053 402 HB2 ASP 54 2HB ASP 54 0.762 -22.690 9.838 403 HB3 ASP 54 3HB ASP 54 0.491 -24.311 9.205 404 H ILE 55 H ILE 55 2.945 -25.477 7.578 405 HA ILE 55 HA ILE 55 3.560 -27.664 7.414 406 HB ILE 55 HB ILE 55 5.275 -27.010 9.813 407 HG12 ILE 55 2HG1 ILE 55 5.870 -26.773 6.855 408 HG13 ILE 55 3HG1 ILE 55 5.642 -25.431 7.971 409 HG21 ILE 55 1HG2 ILE 55 4.869 -29.423 8.357 410 HG22 ILE 55 2HG2 ILE 55 6.504 -28.843 8.047 411 HG23 ILE 55 3HG2 ILE 55 5.966 -29.115 9.704 412 HD11 ILE 55 3HD1 ILE 55 7.963 -25.665 7.645 413 HD12 ILE 55 1HD1 ILE 55 7.619 -26.310 9.249 414 HD13 ILE 55 2HD1 ILE 55 7.897 -27.409 7.898 415 H ARG 56 H ARG 56 1.593 -28.629 7.921 416 HA ARG 56 HA ARG 56 1.604 -30.211 10.321 417 HB2 ARG 56 2HB ARG 56 0.279 -27.738 10.423 418 HB3 ARG 56 3HB ARG 56 -0.988 -28.941 10.223 419 HG2 ARG 56 2HG ARG 56 -0.804 -29.602 12.332 420 HG3 ARG 56 3HG ARG 56 0.947 -29.775 12.196 421 HD2 ARG 56 2HD ARG 56 0.960 -28.090 13.694 422 HD3 ARG 56 3HD ARG 56 0.740 -27.092 12.257 423 HE ARG 56 HE ARG 56 -1.348 -26.559 13.008 424 HH11 ARG 56 1HH1 ARG 56 -0.271 -29.438 14.642 425 HH12 ARG 56 2HH1 ARG 56 -1.631 -29.494 15.715 426 HH21 ARG 56 1HH2 ARG 56 -3.142 -26.622 14.415 427 HH22 ARG 56 2HH2 ARG 56 -3.263 -27.892 15.584 428 H MET 57 H MET 57 1.580 -30.558 7.407 429 HA MET 57 HA MET 57 -1.042 -31.723 6.884 430 HB2 MET 57 2HB MET 57 1.255 -31.867 4.969 431 HB3 MET 57 3HB MET 57 -0.468 -31.767 4.632 432 HG2 MET 57 2HG MET 57 -0.016 -29.638 4.135 433 HG3 MET 57 3HG MET 57 -0.059 -29.405 5.881 434 HE1 MET 57 3HE MET 57 0.976 -27.633 3.899 435 HE2 MET 57 1HE MET 57 2.211 -26.972 4.971 436 HE3 MET 57 2HE MET 57 2.674 -27.677 3.422 437 HA PRO 58 HA PRO 58 0.156 -35.828 7.917 438 HB2 PRO 58 2HB PRO 58 -1.581 -37.207 6.352 439 HB3 PRO 58 3HB PRO 58 -2.079 -36.349 7.815 440 HG2 PRO 58 2HG PRO 58 -2.283 -35.492 4.954 441 HG3 PRO 58 3HG PRO 58 -3.477 -35.338 6.256 442 HD2 PRO 58 2HD PRO 58 -1.911 -33.276 5.464 443 HD3 PRO 58 3HD PRO 58 -2.456 -33.472 7.143 444 H GLY 59 H GLY 59 -0.448 -35.374 4.423 445 HA2 GLY 59 2HA GLY 59 1.377 -37.455 3.683 446 HA3 GLY 59 3HA GLY 59 0.596 -36.318 2.594 447 H MET 60 H MET 60 1.492 -33.904 3.424 448 HA MET 60 HA MET 60 4.309 -34.054 2.686 449 HB2 MET 60 2HB MET 60 2.475 -31.662 2.927 450 HB3 MET 60 3HB MET 60 4.119 -31.632 2.303 451 HG2 MET 60 2HG MET 60 3.022 -33.521 0.718 452 HG3 MET 60 3HG MET 60 1.622 -32.496 1.025 453 HE1 MET 60 3HE MET 60 1.162 -31.541 -1.272 454 HE2 MET 60 1HE MET 60 1.190 -30.251 -0.070 455 HE3 MET 60 2HE MET 60 1.941 -30.003 -1.646 456 H ASP 61 H ASP 61 5.978 -33.231 3.905 457 HA ASP 61 HA ASP 61 5.417 -32.948 6.750 458 HB2 ASP 61 2HB ASP 61 7.321 -34.369 5.613 459 HB3 ASP 61 3HB ASP 61 8.181 -32.831 5.609 460 H GLY 62 H GLY 62 4.972 -30.845 4.552 461 HA2 GLY 62 2HA GLY 62 4.834 -28.528 4.769 462 HA3 GLY 62 3HA GLY 62 5.902 -28.620 6.161 463 H LEU 63 H LEU 63 8.149 -29.748 5.251 464 HA LEU 63 HA LEU 63 9.249 -27.660 3.597 465 HB2 LEU 63 2HB LEU 63 11.391 -28.810 3.983 466 HB3 LEU 63 3HB LEU 63 10.531 -28.434 5.475 467 HG LEU 63 HG LEU 63 9.710 -30.885 5.341 468 HD11 LEU 63 1HD1 LEU 63 11.555 -30.742 3.102 469 HD12 LEU 63 2HD1 LEU 63 10.365 -31.976 3.513 470 HD13 LEU 63 3HD1 LEU 63 11.969 -32.020 4.246 471 HD21 LEU 63 3HD2 LEU 63 11.150 -30.158 7.095 472 HD22 LEU 63 1HD2 LEU 63 12.538 -30.094 6.009 473 HD23 LEU 63 2HD2 LEU 63 11.827 -31.649 6.439 474 H ALA 64 H ALA 64 7.924 -30.746 3.083 475 HA ALA 64 HA ALA 64 9.307 -31.906 1.053 476 HB1 ALA 64 1HB ALA 64 6.402 -31.690 1.645 477 HB2 ALA 64 2HB ALA 64 6.892 -32.382 0.098 478 HB3 ALA 64 3HB ALA 64 7.447 -33.110 1.605 479 H LEU 65 H LEU 65 6.792 -29.419 0.567 480 HA LEU 65 HA LEU 65 7.621 -29.053 -2.185 481 HB2 LEU 65 2HB LEU 65 5.685 -27.863 -2.491 482 HB3 LEU 65 3HB LEU 65 5.220 -28.957 -1.190 483 HG LEU 65 HG LEU 65 6.078 -26.098 -0.768 484 HD11 LEU 65 1HD1 LEU 65 3.276 -27.193 -0.727 485 HD12 LEU 65 2HD1 LEU 65 3.976 -26.345 -2.105 486 HD13 LEU 65 3HD1 LEU 65 3.783 -25.512 -0.563 487 HD21 LEU 65 3HD2 LEU 65 4.607 -26.760 1.373 488 HD22 LEU 65 1HD2 LEU 65 6.356 -26.970 1.299 489 HD23 LEU 65 2HD2 LEU 65 5.290 -28.340 0.986 490 H LEU 66 H LEU 66 8.136 -27.568 0.895 491 HA LEU 66 HA LEU 66 8.910 -24.995 -0.001 492 HB2 LEU 66 2HB LEU 66 8.554 -26.249 2.444 493 HB3 LEU 66 3HB LEU 66 10.278 -25.886 2.398 494 HG LEU 66 HG LEU 66 8.529 -23.648 1.643 495 HD11 LEU 66 1HD1 LEU 66 8.142 -25.112 4.165 496 HD12 LEU 66 2HD1 LEU 66 7.063 -24.010 3.310 497 HD13 LEU 66 3HD1 LEU 66 8.358 -23.368 4.321 498 HD21 LEU 66 3HD2 LEU 66 10.664 -22.928 1.902 499 HD22 LEU 66 1HD2 LEU 66 11.053 -24.159 3.104 500 HD23 LEU 66 2HD2 LEU 66 10.128 -22.731 3.572 501 H LYS 67 H LYS 67 10.486 -28.053 0.016 502 HA LYS 67 HA LYS 67 13.177 -27.213 0.050 503 HB2 LYS 67 2HB LYS 67 11.771 -29.668 -0.953 504 HB3 LYS 67 3HB LYS 67 13.491 -29.445 -1.248 505 HG2 LYS 67 2HG LYS 67 12.234 -29.376 1.485 506 HG3 LYS 67 3HG LYS 67 12.946 -30.817 0.757 507 HD2 LYS 67 2HD LYS 67 14.405 -28.221 1.247 508 HD3 LYS 67 3HD LYS 67 14.497 -29.646 2.284 509 HE2 LYS 67 2HE LYS 67 15.144 -30.829 0.020 510 HE3 LYS 67 3HE LYS 67 15.615 -29.194 -0.440 511 HZ1 LYS 67 3HZ LYS 67 17.373 -30.661 0.623 512 HZ2 LYS 67 1HZ LYS 67 16.550 -30.420 2.081 513 HZ3 LYS 67 2HZ LYS 67 17.199 -29.099 1.250 514 H GLN 68 H GLN 68 10.753 -27.206 -2.425 515 HA GLN 68 HA GLN 68 12.666 -26.829 -4.571 516 HB2 GLN 68 2HB GLN 68 10.883 -27.031 -6.043 517 HB3 GLN 68 3HB GLN 68 10.375 -28.046 -4.700 518 HG2 GLN 68 2HG GLN 68 9.316 -25.684 -3.949 519 HG3 GLN 68 3HG GLN 68 9.248 -25.525 -5.704 520 HE21 GLN 68 1HE2 GLN 68 7.064 -25.762 -3.824 521 HE22 GLN 68 2HE2 GLN 68 6.176 -27.173 -4.277 522 H ILE 69 H ILE 69 10.719 -24.910 -2.451 523 HA ILE 69 HA ILE 69 10.469 -22.551 -3.913 524 HB ILE 69 HB ILE 69 10.797 -22.935 -0.937 525 HG12 ILE 69 2HG1 ILE 69 8.367 -22.495 -2.686 526 HG13 ILE 69 3HG1 ILE 69 8.806 -23.995 -1.876 527 HG21 ILE 69 1HG2 ILE 69 9.998 -20.473 -2.482 528 HG22 ILE 69 2HG2 ILE 69 9.837 -20.662 -0.737 529 HG23 ILE 69 3HG2 ILE 69 11.435 -20.677 -1.481 530 HD11 ILE 69 3HD1 ILE 69 7.424 -23.308 -0.274 531 HD12 ILE 69 1HD1 ILE 69 8.729 -22.219 0.196 532 HD13 ILE 69 2HD1 ILE 69 7.433 -21.642 -0.852 533 H LYS 70 H LYS 70 13.229 -23.951 -2.354 534 HA LYS 70 HA LYS 70 14.779 -21.517 -2.355 535 HB2 LYS 70 2HB LYS 70 15.631 -24.384 -1.901 536 HB3 LYS 70 3HB LYS 70 16.630 -22.964 -1.615 537 HG2 LYS 70 2HG LYS 70 14.002 -23.364 -0.225 538 HG3 LYS 70 3HG LYS 70 15.512 -24.032 0.400 539 HD2 LYS 70 2HD LYS 70 16.365 -21.971 0.922 540 HD3 LYS 70 3HD LYS 70 15.444 -21.150 -0.341 541 HE2 LYS 70 2HE LYS 70 14.310 -22.262 2.225 542 HE3 LYS 70 3HE LYS 70 14.655 -20.562 1.909 543 HZ1 LYS 70 3HZ LYS 70 13.102 -21.043 -0.143 544 HZ2 LYS 70 1HZ LYS 70 12.466 -20.621 1.368 545 HZ3 LYS 70 2HZ LYS 70 12.494 -22.242 0.884 546 H GLN 71 H GLN 71 14.119 -24.087 -4.544 547 HA GLN 71 HA GLN 71 16.465 -23.549 -6.179 548 HB2 GLN 71 2HB GLN 71 15.849 -25.857 -6.004 549 HB3 GLN 71 3HB GLN 71 14.185 -25.507 -6.451 550 HG2 GLN 71 2HG GLN 71 14.665 -25.332 -8.669 551 HG3 GLN 71 3HG GLN 71 16.320 -24.797 -8.382 552 HE21 GLN 71 1HE2 GLN 71 17.509 -26.642 -6.990 553 HE22 GLN 71 2HE2 GLN 71 17.454 -28.191 -7.751 554 H ARG 72 H ARG 72 12.954 -23.160 -6.312 555 HA ARG 72 HA ARG 72 13.059 -21.915 -8.920 556 HB2 ARG 72 2HB ARG 72 10.929 -22.738 -7.019 557 HB3 ARG 72 3HB ARG 72 10.549 -21.422 -8.122 558 HG2 ARG 72 2HG ARG 72 11.263 -22.911 -10.004 559 HG3 ARG 72 3HG ARG 72 11.374 -24.225 -8.830 560 HD2 ARG 72 2HD ARG 72 9.072 -24.204 -8.417 561 HD3 ARG 72 3HD ARG 72 8.871 -22.599 -9.117 562 HE ARG 72 HE ARG 72 8.884 -25.109 -10.514 563 HH11 ARG 72 1HH1 ARG 72 9.431 -21.682 -10.785 564 HH12 ARG 72 2HH1 ARG 72 9.133 -21.637 -12.491 565 HH21 ARG 72 1HH2 ARG 72 8.489 -25.063 -12.760 566 HH22 ARG 72 2HH2 ARG 72 8.597 -23.561 -13.613 567 H HIS 73 H HIS 73 12.626 -20.924 -5.564 568 HA HIS 73 HA HIS 73 13.053 -18.141 -6.409 569 HB2 HIS 73 2HB HIS 73 11.243 -18.820 -4.106 570 HB3 HIS 73 3HB HIS 73 11.362 -17.310 -5.005 571 HD1 HIS 73 HD1 HIS 73 10.162 -17.210 -7.316 572 HD2 HIS 73 HD2 HIS 73 9.543 -20.730 -5.197 573 HE1 HIS 73 HE1 HIS 73 8.235 -18.353 -8.459 574 HA PRO 74 HA PRO 74 16.105 -19.460 -3.165 575 HB2 PRO 74 2HB PRO 74 18.265 -18.426 -4.442 576 HB3 PRO 74 3HB PRO 74 17.654 -20.054 -4.754 577 HG2 PRO 74 2HG PRO 74 17.216 -17.536 -6.312 578 HG3 PRO 74 3HG PRO 74 17.567 -19.170 -6.903 579 HD2 PRO 74 2HD PRO 74 15.068 -18.128 -6.900 580 HD3 PRO 74 3HD PRO 74 15.380 -19.861 -6.670 581 H MET 75 H MET 75 16.018 -16.433 -5.040 582 HA MET 75 HA MET 75 17.119 -14.876 -2.899 583 HB2 MET 75 2HB MET 75 17.154 -13.132 -4.379 584 HB3 MET 75 3HB MET 75 17.076 -14.468 -5.521 585 HG2 MET 75 2HG MET 75 14.750 -12.812 -4.569 586 HG3 MET 75 3HG MET 75 15.545 -12.691 -6.137 587 HE1 MET 75 3HE MET 75 12.480 -13.753 -4.563 588 HE2 MET 75 1HE MET 75 12.482 -12.956 -6.137 589 HE3 MET 75 2HE MET 75 11.790 -14.569 -5.967 590 H LEU 76 H LEU 76 14.153 -16.258 -3.318 591 HA LEU 76 HA LEU 76 12.580 -14.082 -2.209 592 HB2 LEU 76 2HB LEU 76 11.468 -15.381 -3.847 593 HB3 LEU 76 3HB LEU 76 11.930 -16.891 -3.062 594 HG LEU 76 HG LEU 76 10.439 -16.196 -1.138 595 HD11 LEU 76 1HD1 LEU 76 9.938 -13.980 -3.047 596 HD12 LEU 76 2HD1 LEU 76 9.973 -13.973 -1.284 597 HD13 LEU 76 3HD1 LEU 76 8.568 -14.613 -2.135 598 HD21 LEU 76 3HD2 LEU 76 9.170 -16.640 -3.839 599 HD22 LEU 76 1HD2 LEU 76 8.402 -16.921 -2.277 600 HD23 LEU 76 2HD2 LEU 76 9.790 -17.894 -2.764 601 HA PRO 77 HA PRO 77 13.598 -15.432 1.927 602 HB2 PRO 77 2HB PRO 77 12.181 -13.487 3.185 603 HB3 PRO 77 3HB PRO 77 13.765 -13.202 2.455 604 HG2 PRO 77 2HG PRO 77 11.042 -12.604 1.364 605 HG3 PRO 77 3HG PRO 77 12.506 -11.605 1.328 606 HD2 PRO 77 2HD PRO 77 11.678 -13.054 -0.804 607 HD3 PRO 77 3HD PRO 77 13.394 -12.748 -0.466 608 H VAL 78 H VAL 78 12.618 -17.160 2.761 609 HA VAL 78 HA VAL 78 9.682 -17.116 3.034 610 HB VAL 78 HB VAL 78 11.388 -19.572 2.606 611 HG11 VAL 78 1HG1 VAL 78 9.542 -20.361 3.723 612 HG12 VAL 78 2HG1 VAL 78 8.482 -19.103 3.083 613 HG13 VAL 78 3HG1 VAL 78 8.979 -20.447 2.054 614 HG21 VAL 78 3HG2 VAL 78 10.493 -17.658 0.719 615 HG22 VAL 78 1HG2 VAL 78 11.295 -19.200 0.420 616 HG23 VAL 78 2HG2 VAL 78 9.535 -19.121 0.493 617 H ILE 79 H ILE 79 8.820 -18.334 4.840 618 HA ILE 79 HA ILE 79 10.735 -18.612 7.063 619 HB ILE 79 HB ILE 79 7.874 -17.744 7.423 620 HG12 ILE 79 2HG1 ILE 79 10.330 -15.982 7.271 621 HG13 ILE 79 3HG1 ILE 79 9.072 -16.078 6.045 622 HG21 ILE 79 1HG2 ILE 79 9.216 -18.790 9.307 623 HG22 ILE 79 2HG2 ILE 79 10.215 -17.338 9.262 624 HG23 ILE 79 3HG2 ILE 79 8.495 -17.214 9.632 625 HD11 ILE 79 3HD1 ILE 79 7.881 -15.526 8.578 626 HD12 ILE 79 1HD1 ILE 79 9.192 -14.386 8.278 627 HD13 ILE 79 2HD1 ILE 79 7.882 -14.552 7.108 628 H ILE 80 H ILE 80 10.633 -20.445 8.231 629 HA ILE 80 HA ILE 80 8.633 -22.432 7.425 630 HB ILE 80 HB ILE 80 11.348 -22.669 8.688 631 HG12 ILE 80 2HG1 ILE 80 10.864 -22.599 6.142 632 HG13 ILE 80 3HG1 ILE 80 11.931 -23.855 6.759 633 HG21 ILE 80 1HG2 ILE 80 9.057 -24.535 8.884 634 HG22 ILE 80 2HG2 ILE 80 10.641 -25.232 8.548 635 HG23 ILE 80 3HG2 ILE 80 10.395 -24.260 9.998 636 HD11 ILE 80 3HD1 ILE 80 10.198 -25.487 6.617 637 HD12 ILE 80 1HD1 ILE 80 9.000 -24.254 6.226 638 HD13 ILE 80 2HD1 ILE 80 10.283 -24.635 5.076 639 H MET 81 H MET 81 6.860 -22.067 8.672 640 HA MET 81 HA MET 81 7.180 -21.721 11.552 641 HB2 MET 81 2HB MET 81 5.092 -21.118 9.575 642 HB3 MET 81 3HB MET 81 4.480 -21.741 11.101 643 HG2 MET 81 2HG MET 81 5.339 -19.953 12.316 644 HG3 MET 81 3HG MET 81 6.456 -19.497 11.032 645 HE1 MET 81 3HE MET 81 2.911 -20.535 11.269 646 HE2 MET 81 1HE MET 81 1.940 -19.092 10.977 647 HE3 MET 81 2HE MET 81 2.567 -20.023 9.616 648 H THR 82 H THR 82 7.050 -23.371 12.913 649 HA THR 82 HA THR 82 5.167 -25.493 12.611 650 HB THR 82 HB THR 82 6.691 -26.431 11.037 651 HG1 THR 82 HG1 THR 82 7.248 -27.658 13.550 652 HG21 THR 82 3HG2 THR 82 8.630 -24.973 11.856 653 HG22 THR 82 1HG2 THR 82 9.022 -26.599 11.297 654 HG23 THR 82 2HG2 THR 82 8.940 -26.257 13.025 655 H ALA 83 H ALA 83 8.309 -24.692 14.087 656 HA ALA 83 HA ALA 83 8.987 -24.631 16.262 657 HB1 ALA 83 1HB ALA 83 6.717 -24.988 17.826 658 HB2 ALA 83 2HB ALA 83 7.452 -23.454 17.358 659 HB3 ALA 83 3HB ALA 83 6.144 -24.136 16.391 660 H HIS 84 H HIS 84 8.384 -25.970 18.500 661 HA HIS 84 HA HIS 84 8.973 -27.993 19.426 662 HB2 HIS 84 2HB HIS 84 7.193 -29.626 19.257 663 HB3 HIS 84 3HB HIS 84 6.488 -28.013 19.310 664 HD1 HIS 84 HD1 HIS 84 6.783 -31.023 17.177 665 HD2 HIS 84 HD2 HIS 84 5.342 -27.139 16.855 666 HE1 HIS 84 HE1 HIS 84 5.379 -30.998 15.091 667 H SER 85 H SER 85 8.406 -30.614 18.339 668 HA SER 85 HA SER 85 10.833 -31.206 17.131 669 HB2 SER 85 2HB SER 85 9.248 -32.835 18.237 670 HB3 SER 85 3HB SER 85 8.295 -32.807 16.753 671 HG SER 85 HG SER 85 10.194 -33.526 15.651 672 H ASP 86 H ASP 86 11.328 -29.911 15.395 673 HA ASP 86 HA ASP 86 10.730 -30.747 12.848 674 HB2 ASP 86 2HB ASP 86 8.630 -29.065 13.959 675 HB3 ASP 86 3HB ASP 86 9.309 -28.385 12.483 676 H LEU 87 H LEU 87 11.210 -27.810 14.769 677 HA LEU 87 HA LEU 87 12.599 -26.329 12.832 678 HB2 LEU 87 2HB LEU 87 12.046 -26.151 15.668 679 HB3 LEU 87 3HB LEU 87 13.668 -25.579 15.286 680 HG LEU 87 HG LEU 87 12.812 -23.887 13.839 681 HD11 LEU 87 1HD1 LEU 87 10.161 -25.259 14.211 682 HD12 LEU 87 2HD1 LEU 87 11.049 -24.995 12.711 683 HD13 LEU 87 3HD1 LEU 87 10.325 -23.628 13.559 684 HD21 LEU 87 3HD2 LEU 87 11.808 -22.486 15.395 685 HD22 LEU 87 1HD2 LEU 87 12.654 -23.659 16.405 686 HD23 LEU 87 2HD2 LEU 87 10.914 -23.803 16.155 687 H ASP 88 H ASP 88 13.716 -28.638 15.259 688 HA ASP 88 HA ASP 88 16.447 -28.279 15.096 689 HB2 ASP 88 2HB ASP 88 14.655 -30.336 16.027 690 HB3 ASP 88 3HB ASP 88 16.055 -31.064 15.244 691 H ALA 89 H ALA 89 14.285 -29.692 12.778 692 HA ALA 89 HA ALA 89 16.421 -30.878 11.215 693 HB1 ALA 89 1HB ALA 89 13.777 -31.484 11.501 694 HB2 ALA 89 2HB ALA 89 13.794 -30.646 9.948 695 HB3 ALA 89 3HB ALA 89 14.816 -32.062 10.197 696 H ALA 90 H ALA 90 14.234 -28.108 11.029 697 HA ALA 90 HA ALA 90 15.139 -27.259 8.454 698 HB1 ALA 90 1HB ALA 90 13.279 -26.258 10.509 699 HB2 ALA 90 2HB ALA 90 14.017 -25.033 9.477 700 HB3 ALA 90 3HB ALA 90 13.096 -26.353 8.757 701 H VAL 91 H VAL 91 16.304 -26.896 11.664 702 HA VAL 91 HA VAL 91 17.609 -24.473 11.651 703 HB VAL 91 HB VAL 91 18.425 -27.103 12.870 704 HG11 VAL 91 1HG1 VAL 91 20.503 -26.153 12.819 705 HG12 VAL 91 2HG1 VAL 91 19.872 -24.505 12.810 706 HG13 VAL 91 3HG1 VAL 91 19.884 -25.438 14.307 707 HG21 VAL 91 3HG2 VAL 91 17.158 -26.503 14.610 708 HG22 VAL 91 1HG2 VAL 91 17.802 -24.861 14.615 709 HG23 VAL 91 2HG2 VAL 91 16.466 -25.281 13.543 710 H SER 92 H SER 92 19.022 -27.596 10.656 711 HA SER 92 HA SER 92 21.248 -26.220 9.399 712 HB2 SER 92 2HB SER 92 22.037 -28.141 10.422 713 HB3 SER 92 3HB SER 92 20.591 -29.070 10.030 714 HG SER 92 HG SER 92 22.801 -28.445 8.405 715 H ALA 93 H ALA 93 18.485 -28.214 8.453 716 HA ALA 93 HA ALA 93 19.061 -28.390 5.711 717 HB1 ALA 93 1HB ALA 93 17.429 -29.846 6.674 718 HB2 ALA 93 2HB ALA 93 16.429 -28.482 7.174 719 HB3 ALA 93 3HB ALA 93 16.622 -28.853 5.461 720 H TYR 94 H TYR 94 16.639 -26.282 7.276 721 HA TYR 94 HA TYR 94 16.099 -24.701 5.052 722 HB2 TYR 94 2HB TYR 94 14.966 -24.835 7.421 723 HB3 TYR 94 3HB TYR 94 16.046 -23.497 7.793 724 HD1 TYR 94 HD2 TYR 94 14.237 -24.252 4.626 725 HD2 TYR 94 HD1 TYR 94 14.648 -21.639 7.959 726 HE1 TYR 94 HE2 TYR 94 12.648 -22.688 3.588 727 HE2 TYR 94 HE1 TYR 94 13.059 -20.068 6.931 728 HH TYR 94 HH TYR 94 11.028 -20.452 5.082 729 H GLN 95 H GLN 95 18.858 -24.760 7.075 730 HA GLN 95 HA GLN 95 19.727 -22.079 6.702 731 HB2 GLN 95 2HB GLN 95 20.756 -24.516 7.925 732 HB3 GLN 95 3HB GLN 95 22.016 -23.583 7.128 733 HG2 GLN 95 2HG GLN 95 20.091 -22.310 9.037 734 HG3 GLN 95 3HG GLN 95 21.555 -23.119 9.593 735 HE21 GLN 95 1HE2 GLN 95 23.571 -22.405 8.365 736 HE22 GLN 95 2HE2 GLN 95 23.744 -20.704 8.118 737 H GLN 96 H GLN 96 19.229 -24.337 4.446 738 HA GLN 96 HA GLN 96 21.639 -24.214 2.922 739 HB2 GLN 96 2HB GLN 96 18.843 -25.152 2.356 740 HB3 GLN 96 3HB GLN 96 20.034 -25.052 1.066 741 HG2 GLN 96 2HG GLN 96 20.699 -26.518 3.575 742 HG3 GLN 96 3HG GLN 96 19.675 -27.279 2.359 743 HE21 GLN 96 1HE2 GLN 96 22.149 -28.294 3.097 744 HE22 GLN 96 2HE2 GLN 96 23.230 -28.164 1.756 745 H GLY 97 H GLY 97 20.300 -21.657 3.756 746 HA2 GLY 97 2HA GLY 97 20.765 -19.614 2.539 747 HA3 GLY 97 3HA GLY 97 20.258 -20.436 1.071 748 H ALA 98 H ALA 98 18.541 -20.618 4.127 749 HA ALA 98 HA ALA 98 16.285 -19.223 2.851 750 HB1 ALA 98 1HB ALA 98 15.921 -20.907 5.280 751 HB2 ALA 98 2HB ALA 98 14.815 -20.602 3.940 752 HB3 ALA 98 3HB ALA 98 16.180 -21.697 3.724 753 H PHE 99 H PHE 99 14.815 -18.079 4.423 754 HA PHE 99 HA PHE 99 16.424 -16.287 6.030 755 HB2 PHE 99 2HB PHE 99 14.780 -15.221 4.674 756 HB3 PHE 99 3HB PHE 99 13.513 -16.304 5.239 757 HD1 PHE 99 HD1 PHE 99 15.576 -13.396 6.066 758 HD2 PHE 99 HD2 PHE 99 12.428 -15.953 7.355 759 HE1 PHE 99 HE1 PHE 99 14.979 -11.773 7.816 760 HE2 PHE 99 HE2 PHE 99 11.825 -14.334 9.106 761 HZ PHE 99 HZ PHE 99 13.100 -12.240 9.338 762 H ASP 100 H ASP 100 16.112 -15.864 8.234 763 HA ASP 100 HA ASP 100 15.883 -17.993 9.939 764 HB2 ASP 100 2HB ASP 100 16.760 -15.741 10.546 765 HB3 ASP 100 3HB ASP 100 15.102 -15.150 10.614 766 H TYR 101 H TYR 101 14.230 -19.380 9.991 767 HA TYR 101 HA TYR 101 11.566 -18.803 9.369 768 HB2 TYR 101 2HB TYR 101 11.112 -20.979 10.655 769 HB3 TYR 101 3HB TYR 101 12.185 -21.069 9.264 770 HD1 TYR 101 HD2 TYR 101 12.583 -20.236 12.893 771 HD2 TYR 101 HD1 TYR 101 13.944 -22.517 9.569 772 HE1 TYR 101 HE2 TYR 101 14.321 -21.250 14.307 773 HE2 TYR 101 HE1 TYR 101 15.685 -23.538 10.974 774 HH TYR 101 HH TYR 101 16.688 -22.344 13.817 775 H LEU 102 H LEU 102 9.856 -19.611 11.213 776 HA LEU 102 HA LEU 102 10.372 -18.207 13.716 777 HB2 LEU 102 2HB LEU 102 9.398 -16.386 12.763 778 HB3 LEU 102 3HB LEU 102 8.463 -17.349 11.621 779 HG LEU 102 HG LEU 102 7.027 -18.005 13.643 780 HD11 LEU 102 1HD1 LEU 102 7.662 -17.253 15.629 781 HD12 LEU 102 2HD1 LEU 102 7.332 -15.612 15.073 782 HD13 LEU 102 3HD1 LEU 102 8.950 -16.292 14.902 783 HD21 LEU 102 3HD2 LEU 102 5.790 -16.693 12.301 784 HD22 LEU 102 1HD2 LEU 102 7.085 -15.515 12.083 785 HD23 LEU 102 2HD2 LEU 102 6.085 -15.468 13.536 786 HA PRO 103 HA PRO 103 8.227 -21.931 14.943 787 HB2 PRO 103 2HB PRO 103 8.555 -21.545 17.610 788 HB3 PRO 103 3HB PRO 103 9.842 -22.152 16.562 789 HG2 PRO 103 2HG PRO 103 9.384 -19.376 17.585 790 HG3 PRO 103 3HG PRO 103 10.900 -20.288 17.464 791 HD2 PRO 103 2HD PRO 103 10.187 -18.403 15.657 792 HD3 PRO 103 3HD PRO 103 11.142 -19.833 15.218 793 H LYS 104 H LYS 104 6.179 -22.379 15.630 794 HA LYS 104 HA LYS 104 4.519 -20.070 16.379 795 HB2 LYS 104 2HB LYS 104 2.632 -21.264 15.470 796 HB3 LYS 104 3HB LYS 104 3.925 -21.260 14.277 797 HG2 LYS 104 2HG LYS 104 3.314 -23.435 14.129 798 HG3 LYS 104 3HG LYS 104 4.491 -23.576 15.437 799 HD2 LYS 104 2HD LYS 104 2.904 -24.418 16.745 800 HD3 LYS 104 3HD LYS 104 2.010 -22.901 16.613 801 HE2 LYS 104 2HE LYS 104 0.458 -24.415 15.839 802 HE3 LYS 104 3HE LYS 104 1.218 -23.896 14.335 803 HZ1 LYS 104 3HZ LYS 104 0.915 -26.457 15.099 804 HZ2 LYS 104 1HZ LYS 104 2.503 -26.149 15.596 805 HZ3 LYS 104 2HZ LYS 104 2.063 -25.919 13.979 806 HA PRO 105 HA PRO 105 2.342 -19.862 17.033 807 HB2 PRO 105 2HB PRO 105 1.704 -18.439 19.256 808 HB3 PRO 105 3HB PRO 105 0.798 -19.865 18.735 809 HG2 PRO 105 2HG PRO 105 2.919 -19.631 20.835 810 HG3 PRO 105 3HG PRO 105 1.387 -20.522 20.887 811 HD2 PRO 105 2HD PRO 105 3.759 -21.731 20.394 812 HD3 PRO 105 3HD PRO 105 2.233 -22.297 19.684 813 H PHE 106 H PHE 106 2.457 -17.352 17.388 814 HA PHE 106 HA PHE 106 5.032 -16.410 18.317 815 HB2 PHE 106 2HB PHE 106 5.668 -15.417 16.159 816 HB3 PHE 106 3HB PHE 106 5.572 -17.172 16.054 817 HD1 PHE 106 HD1 PHE 106 3.868 -14.022 15.182 818 HD2 PHE 106 HD2 PHE 106 4.041 -18.235 14.597 819 HE1 PHE 106 HE1 PHE 106 2.326 -13.817 13.277 820 HE2 PHE 106 HE2 PHE 106 2.499 -18.036 12.690 821 HZ PHE 106 HZ PHE 106 1.640 -15.826 12.027 822 H ASP 107 H ASP 107 5.225 -13.978 17.871 823 HA ASP 107 HA ASP 107 2.659 -12.773 18.571 824 HB2 ASP 107 2HB ASP 107 5.462 -11.636 18.664 825 HB3 ASP 107 3HB ASP 107 4.011 -10.811 19.228 826 H ILE 108 H ILE 108 1.464 -12.028 16.953 827 HA ILE 108 HA ILE 108 2.143 -11.645 14.340 828 HB ILE 108 HB ILE 108 0.065 -10.294 16.031 829 HG12 ILE 108 2HG1 ILE 108 -0.453 -11.955 13.600 830 HG13 ILE 108 3HG1 ILE 108 0.072 -12.759 15.075 831 HG21 ILE 108 1HG2 ILE 108 -0.880 -9.437 13.839 832 HG22 ILE 108 2HG2 ILE 108 0.529 -8.590 14.474 833 HG23 ILE 108 3HG2 ILE 108 0.715 -9.740 13.151 834 HD11 ILE 108 3HD1 ILE 108 -1.993 -12.705 15.846 835 HD12 ILE 108 1HD1 ILE 108 -2.008 -10.945 15.737 836 HD13 ILE 108 2HD1 ILE 108 -2.522 -11.919 14.359 837 H ASP 109 H ASP 109 2.569 -9.387 17.001 838 HA ASP 109 HA ASP 109 3.198 -7.090 15.534 839 HB2 ASP 109 2HB ASP 109 4.451 -7.820 18.180 840 HB3 ASP 109 3HB ASP 109 4.113 -6.210 17.549 841 H GLU 110 H GLU 110 5.281 -9.700 16.729 842 HA GLU 110 HA GLU 110 7.651 -8.522 15.589 843 HB2 GLU 110 2HB GLU 110 7.033 -11.042 17.081 844 HB3 GLU 110 3HB GLU 110 8.547 -10.916 16.195 845 HG2 GLU 110 2HG GLU 110 9.114 -8.902 17.470 846 HG3 GLU 110 3HG GLU 110 7.610 -9.063 18.375 847 H ALA 111 H ALA 111 5.219 -10.785 14.612 848 HA ALA 111 HA ALA 111 6.699 -12.072 12.550 849 HB1 ALA 111 1HB ALA 111 4.922 -13.396 12.588 850 HB2 ALA 111 2HB ALA 111 4.101 -12.274 13.674 851 HB3 ALA 111 3HB ALA 111 3.930 -12.096 11.928 852 H VAL 112 H VAL 112 4.168 -9.557 12.435 853 HA VAL 112 HA VAL 112 4.176 -9.044 9.729 854 HB VAL 112 HB VAL 112 3.724 -7.193 12.060 855 HG11 VAL 112 1HG1 VAL 112 2.566 -5.860 10.045 856 HG12 VAL 112 2HG1 VAL 112 4.213 -5.539 10.592 857 HG13 VAL 112 3HG1 VAL 112 3.934 -6.561 9.181 858 HG21 VAL 112 3HG2 VAL 112 2.000 -8.765 10.187 859 HG22 VAL 112 1HG2 VAL 112 1.952 -8.677 11.948 860 HG23 VAL 112 2HG2 VAL 112 1.365 -7.324 10.981 861 H ALA 113 H ALA 113 6.415 -7.893 12.189 862 HA ALA 113 HA ALA 113 7.814 -6.158 10.352 863 HB1 ALA 113 1HB ALA 113 9.079 -5.454 12.163 864 HB2 ALA 113 2HB ALA 113 7.529 -5.858 12.903 865 HB3 ALA 113 3HB ALA 113 8.883 -6.982 13.023 866 H LEU 114 H LEU 114 8.171 -9.390 11.647 867 HA LEU 114 HA LEU 114 10.833 -9.904 11.055 868 HB2 LEU 114 2HB LEU 114 9.610 -11.488 12.318 869 HB3 LEU 114 3HB LEU 114 8.409 -11.682 11.043 870 HG LEU 114 HG LEU 114 10.341 -12.657 9.653 871 HD11 LEU 114 1HD1 LEU 114 12.112 -13.711 10.984 872 HD12 LEU 114 2HD1 LEU 114 11.509 -12.889 12.423 873 HD13 LEU 114 3HD1 LEU 114 12.168 -11.950 11.083 874 HD21 LEU 114 3HD2 LEU 114 10.108 -14.872 10.997 875 HD22 LEU 114 1HD2 LEU 114 8.688 -14.163 10.227 876 HD23 LEU 114 2HD2 LEU 114 8.949 -13.953 11.959 877 H VAL 115 H VAL 115 8.016 -9.895 8.956 878 HA VAL 115 HA VAL 115 9.489 -10.932 6.693 879 HB VAL 115 HB VAL 115 7.157 -11.522 6.851 880 HG11 VAL 115 1HG1 VAL 115 5.400 -9.764 6.602 881 HG12 VAL 115 2HG1 VAL 115 6.281 -9.700 8.129 882 HG13 VAL 115 3HG1 VAL 115 6.656 -8.550 6.845 883 HG21 VAL 115 3HG2 VAL 115 6.360 -10.750 4.643 884 HG22 VAL 115 1HG2 VAL 115 7.669 -9.569 4.610 885 HG23 VAL 115 2HG2 VAL 115 8.037 -11.294 4.609 886 H GLU 116 H GLU 116 8.471 -7.828 7.939 887 HA GLU 116 HA GLU 116 8.683 -6.209 5.718 888 HB2 GLU 116 2HB GLU 116 8.008 -5.558 8.082 889 HB3 GLU 116 3HB GLU 116 9.725 -5.428 8.438 890 HG2 GLU 116 2HG GLU 116 9.875 -3.787 6.532 891 HG3 GLU 116 3HG GLU 116 8.112 -3.793 6.504 892 H ARG 117 H ARG 117 11.264 -7.402 7.821 893 HA ARG 117 HA ARG 117 13.363 -5.940 6.628 894 HB2 ARG 117 2HB ARG 117 14.825 -7.245 7.913 895 HB3 ARG 117 3HB ARG 117 13.348 -7.199 8.866 896 HG2 ARG 117 2HG ARG 117 12.803 -9.425 7.635 897 HG3 ARG 117 3HG ARG 117 14.541 -9.461 7.333 898 HD2 ARG 117 2HD ARG 117 13.073 -9.545 9.943 899 HD3 ARG 117 3HD ARG 117 14.298 -10.651 9.323 900 HE ARG 117 HE ARG 117 14.749 -8.293 10.839 901 HH11 ARG 117 1HH1 ARG 117 16.072 -10.227 8.264 902 HH12 ARG 117 2HH1 ARG 117 17.706 -9.729 8.554 903 HH21 ARG 117 1HH2 ARG 117 16.896 -7.630 11.231 904 HH22 ARG 117 2HH2 ARG 117 18.174 -8.253 10.242 905 H ALA 118 H ALA 118 11.747 -8.897 5.767 906 HA ALA 118 HA ALA 118 13.765 -9.755 3.900 907 HB1 ALA 118 1HB ALA 118 11.306 -10.824 4.998 908 HB2 ALA 118 2HB ALA 118 11.433 -11.105 3.262 909 HB3 ALA 118 3HB ALA 118 12.710 -11.666 4.342 910 H ILE 119 H ILE 119 10.696 -8.034 3.760 911 HA ILE 119 HA ILE 119 10.596 -7.993 0.891 912 HB ILE 119 HB ILE 119 9.070 -6.295 2.870 913 HG12 ILE 119 2HG1 ILE 119 8.216 -8.838 1.472 914 HG13 ILE 119 3HG1 ILE 119 8.748 -8.755 3.148 915 HG21 ILE 119 1HG2 ILE 119 9.185 -5.438 0.530 916 HG22 ILE 119 2HG2 ILE 119 8.402 -6.927 0.002 917 HG23 ILE 119 3HG2 ILE 119 7.554 -5.821 1.082 918 HD11 ILE 119 3HD1 ILE 119 6.588 -6.903 2.456 919 HD12 ILE 119 1HD1 ILE 119 6.174 -8.613 2.334 920 HD13 ILE 119 2HD1 ILE 119 6.783 -7.958 3.856 921 H SER 120 H SER 120 11.558 -5.728 3.430 922 HA SER 120 HA SER 120 12.039 -3.533 1.696 923 HB2 SER 120 2HB SER 120 13.244 -4.065 4.422 924 HB3 SER 120 3HB SER 120 13.153 -2.506 3.602 925 HG SER 120 HG SER 120 11.346 -2.354 4.679 926 H HIS 121 H HIS 121 13.882 -6.321 2.605 927 HA HIS 121 HA HIS 121 16.485 -5.506 2.156 928 HB2 HIS 121 2HB HIS 121 15.666 -7.779 2.954 929 HB3 HIS 121 3HB HIS 121 15.406 -8.178 1.259 930 HD1 HIS 121 HD1 HIS 121 17.519 -8.492 -0.222 931 HD2 HIS 121 HD2 HIS 121 18.323 -7.777 3.791 932 HE1 HIS 121 HE1 HIS 121 19.945 -9.074 0.092 933 H TYR 122 H TYR 122 14.035 -6.499 -0.189 934 HA TYR 122 HA TYR 122 15.598 -6.628 -2.477 935 HB2 TYR 122 2HB TYR 122 12.718 -5.889 -2.028 936 HB3 TYR 122 3HB TYR 122 13.415 -5.870 -3.644 937 HD1 TYR 122 HD1 TYR 122 12.512 -8.009 -0.786 938 HD2 TYR 122 HD2 TYR 122 13.914 -7.911 -4.802 939 HE1 TYR 122 HE1 TYR 122 12.105 -10.427 -0.981 940 HE2 TYR 122 HE2 TYR 122 13.510 -10.328 -5.009 941 HH TYR 122 HH TYR 122 11.616 -12.035 -3.231 942 H GLN 123 H GLN 123 13.832 -3.816 -1.187 943 HA GLN 123 HA GLN 123 15.274 -2.077 -3.042 944 HB2 GLN 123 2HB GLN 123 12.953 -1.552 -1.181 945 HB3 GLN 123 3HB GLN 123 13.714 -0.316 -2.175 946 HG2 GLN 123 2HG GLN 123 12.094 -0.847 -3.625 947 HG3 GLN 123 3HG GLN 123 13.178 -2.170 -4.050 948 HE21 GLN 123 1HE2 GLN 123 10.429 -1.297 -2.032 949 HE22 GLN 123 2HE2 GLN 123 9.751 -2.884 -1.951 950 H GLU 124 H GLU 124 16.530 -3.378 -0.687 951 HA GLU 124 HA GLU 124 17.941 -2.887 1.033 952 HB2 GLU 124 2HB GLU 124 18.156 -0.272 -0.469 953 HB3 GLU 124 3HB GLU 124 19.277 -0.829 0.765 954 HG2 GLU 124 2HG GLU 124 20.219 -2.403 -0.599 955 HG3 GLU 124 3HG GLU 124 18.771 -2.571 -1.590 Start of MODEL 11 1 H1 MET 1 H MET 1 -1.075 -5.483 -4.430 2 HA MET 1 HA MET 1 0.617 -3.862 -5.964 3 HB2 MET 1 2HB MET 1 -0.323 -2.072 -4.512 4 HB3 MET 1 3HB MET 1 0.322 -2.913 -3.109 5 HG2 MET 1 2HG MET 1 2.010 -1.451 -3.422 6 HG3 MET 1 3HG MET 1 2.566 -2.718 -4.514 7 HE1 MET 1 3HE MET 1 3.581 -0.055 -4.367 8 HE2 MET 1 1HE MET 1 4.045 -0.237 -6.059 9 HE3 MET 1 2HE MET 1 3.087 1.155 -5.552 10 H GLN 2 H GLN 2 2.559 -4.810 -5.997 11 HA GLN 2 HA GLN 2 3.075 -7.095 -4.396 12 HB2 GLN 2 2HB GLN 2 3.898 -6.770 -6.732 13 HB3 GLN 2 3HB GLN 2 5.025 -5.564 -6.125 14 HG2 GLN 2 2HG GLN 2 5.609 -7.650 -4.512 15 HG3 GLN 2 3HG GLN 2 5.127 -8.493 -5.983 16 HE21 GLN 2 1HE2 GLN 2 6.012 -6.797 -7.922 17 HE22 GLN 2 2HE2 GLN 2 7.735 -6.692 -7.873 18 H ARG 3 H ARG 3 2.996 -6.334 -2.242 19 HA ARG 3 HA ARG 3 5.516 -5.628 -1.159 20 HB2 ARG 3 2HB ARG 3 5.280 -3.393 -1.589 21 HB3 ARG 3 3HB ARG 3 3.523 -3.469 -1.592 22 HG2 ARG 3 2HG ARG 3 4.412 -2.149 0.275 23 HG3 ARG 3 3HG ARG 3 3.481 -3.546 0.819 24 HD2 ARG 3 2HD ARG 3 5.224 -4.289 1.976 25 HD3 ARG 3 3HD ARG 3 6.209 -4.317 0.515 26 HE ARG 3 HE ARG 3 6.222 -2.311 2.584 27 HH11 ARG 3 1HH1 ARG 3 6.998 -3.045 -0.729 28 HH12 ARG 3 2HH1 ARG 3 8.193 -1.797 -0.863 29 HH21 ARG 3 1HH2 ARG 3 7.793 -0.665 2.421 30 HH22 ARG 3 2HH2 ARG 3 8.644 -0.444 0.930 31 H GLY 4 H GLY 4 5.609 -6.586 0.763 32 HA2 GLY 4 2HA GLY 4 4.976 -7.491 2.777 33 HA3 GLY 4 3HA GLY 4 3.628 -6.362 2.763 34 H ILE 5 H ILE 5 3.902 -8.483 0.075 35 HA ILE 5 HA ILE 5 1.402 -9.739 0.755 36 HB ILE 5 HB ILE 5 3.249 -10.162 -1.596 37 HG12 ILE 5 2HG1 ILE 5 0.618 -8.686 -1.356 38 HG13 ILE 5 3HG1 ILE 5 2.204 -7.934 -1.490 39 HG21 ILE 5 1HG2 ILE 5 2.096 -12.006 -2.041 40 HG22 ILE 5 2HG2 ILE 5 1.038 -11.729 -0.658 41 HG23 ILE 5 3HG2 ILE 5 0.651 -11.010 -2.221 42 HD11 ILE 5 3HD1 ILE 5 1.369 -7.807 -3.639 43 HD12 ILE 5 1HD1 ILE 5 2.387 -9.246 -3.698 44 HD13 ILE 5 2HD1 ILE 5 0.636 -9.409 -3.558 45 H VAL 6 H VAL 6 1.473 -11.249 2.308 46 HA VAL 6 HA VAL 6 3.591 -13.291 2.179 47 HB VAL 6 HB VAL 6 1.841 -12.473 4.501 48 HG11 VAL 6 1HG1 VAL 6 3.687 -14.777 4.098 49 HG12 VAL 6 2HG1 VAL 6 3.585 -14.028 5.693 50 HG13 VAL 6 3HG1 VAL 6 2.140 -14.706 4.942 51 HG21 VAL 6 3HG2 VAL 6 4.686 -12.334 4.928 52 HG22 VAL 6 1HG2 VAL 6 4.217 -11.372 3.526 53 HG23 VAL 6 2HG2 VAL 6 3.465 -11.072 5.093 54 H TRP 7 H TRP 7 3.045 -15.241 1.480 55 HA TRP 7 HA TRP 7 0.205 -15.957 1.358 56 HB2 TRP 7 2HB TRP 7 2.641 -16.954 -0.109 57 HB3 TRP 7 3HB TRP 7 1.113 -17.829 -0.146 58 HD1 TRP 7 HD1 TRP 7 0.223 -14.301 -0.080 59 HE1 TRP 7 HE1 TRP 7 -0.273 -13.413 -2.445 60 HE3 TRP 7 HE3 TRP 7 2.208 -18.135 -2.819 61 HZ2 TRP 7 HZ2 TRP 7 0.125 -14.230 -5.117 62 HZ3 TRP 7 HZ3 TRP 7 2.110 -18.005 -5.274 63 HH2 TRP 7 HH2 TRP 7 1.089 -16.092 -6.397 64 H VAL 8 H VAL 8 -0.603 -17.300 2.817 65 HA VAL 8 HA VAL 8 1.239 -19.022 4.330 66 HB VAL 8 HB VAL 8 -1.566 -18.143 5.033 67 HG11 VAL 8 1HG1 VAL 8 -1.092 -19.134 7.230 68 HG12 VAL 8 2HG1 VAL 8 -1.061 -20.340 5.942 69 HG13 VAL 8 3HG1 VAL 8 0.450 -19.731 6.619 70 HG21 VAL 8 3HG2 VAL 8 0.609 -16.572 5.106 71 HG22 VAL 8 1HG2 VAL 8 -0.705 -16.460 6.277 72 HG23 VAL 8 2HG2 VAL 8 0.760 -17.357 6.678 73 H VAL 9 H VAL 9 0.774 -21.205 4.662 74 HA VAL 9 HA VAL 9 -1.482 -22.369 3.215 75 HB VAL 9 HB VAL 9 0.340 -22.414 1.591 76 HG11 VAL 9 1HG1 VAL 9 1.885 -23.182 3.916 77 HG12 VAL 9 2HG1 VAL 9 2.145 -24.283 2.561 78 HG13 VAL 9 3HG1 VAL 9 2.426 -22.553 2.360 79 HG21 VAL 9 3HG2 VAL 9 -0.873 -24.249 1.091 80 HG22 VAL 9 1HG2 VAL 9 0.557 -25.104 1.669 81 HG23 VAL 9 2HG2 VAL 9 -0.821 -24.863 2.743 82 H ASP 10 H ASP 10 -1.931 -22.464 5.637 83 HA ASP 10 HA ASP 10 -0.617 -24.773 6.888 84 HB2 ASP 10 2HB ASP 10 -1.695 -23.969 8.985 85 HB3 ASP 10 3HB ASP 10 -0.600 -22.789 8.270 86 H ASP 11 H ASP 11 -2.261 -25.944 8.452 87 HA ASP 11 HA ASP 11 -4.612 -26.641 6.818 88 HB2 ASP 11 2HB ASP 11 -2.530 -28.271 7.875 89 HB3 ASP 11 3HB ASP 11 -4.023 -28.696 8.708 90 H ASP 12 H ASP 12 -4.215 -24.629 9.057 91 HA ASP 12 HA ASP 12 -6.518 -25.512 10.653 92 HB2 ASP 12 2HB ASP 12 -3.828 -24.861 11.608 93 HB3 ASP 12 3HB ASP 12 -5.094 -23.944 12.419 94 H SER 13 H SER 13 -7.902 -23.869 11.359 95 HA SER 13 HA SER 13 -7.976 -21.568 9.656 96 HB2 SER 13 2HB SER 13 -9.881 -23.019 10.987 97 HB3 SER 13 3HB SER 13 -9.776 -21.567 11.983 98 HG SER 13 HG SER 13 -10.818 -21.897 9.479 99 H SER 14 H SER 14 -7.711 -21.994 13.184 100 HA SER 14 HA SER 14 -7.321 -19.287 13.802 101 HB2 SER 14 2HB SER 14 -6.488 -21.802 15.257 102 HB3 SER 14 3HB SER 14 -6.293 -20.186 15.934 103 HG SER 14 HG SER 14 -8.657 -21.598 15.349 104 H ILE 15 H ILE 15 -5.218 -21.602 12.401 105 HA ILE 15 HA ILE 15 -2.768 -20.287 13.161 106 HB ILE 15 HB ILE 15 -3.308 -22.459 11.135 107 HG12 ILE 15 2HG1 ILE 15 -3.670 -23.084 13.502 108 HG13 ILE 15 3HG1 ILE 15 -2.308 -23.941 12.789 109 HG21 ILE 15 1HG2 ILE 15 -1.323 -21.885 10.281 110 HG22 ILE 15 2HG2 ILE 15 -0.932 -20.849 11.653 111 HG23 ILE 15 3HG2 ILE 15 -0.640 -22.585 11.749 112 HD11 ILE 15 3HD1 ILE 15 -0.921 -23.149 14.318 113 HD12 ILE 15 1HD1 ILE 15 -1.452 -21.491 14.038 114 HD13 ILE 15 2HD1 ILE 15 -2.333 -22.521 15.167 115 H ARG 16 H ARG 16 -4.825 -20.455 10.292 116 HA ARG 16 HA ARG 16 -3.074 -18.793 8.724 117 HB2 ARG 16 2HB ARG 16 -4.877 -18.870 7.046 118 HB3 ARG 16 3HB ARG 16 -4.440 -20.474 7.620 119 HG2 ARG 16 2HG ARG 16 -6.394 -20.515 9.061 120 HG3 ARG 16 3HG ARG 16 -6.820 -18.881 8.550 121 HD2 ARG 16 2HD ARG 16 -6.692 -19.984 6.152 122 HD3 ARG 16 3HD ARG 16 -7.014 -21.454 7.070 123 HE ARG 16 HE ARG 16 -8.869 -19.584 7.910 124 HH11 ARG 16 1HH1 ARG 16 -8.009 -21.184 4.940 125 HH12 ARG 16 2HH1 ARG 16 -9.615 -21.128 4.292 126 HH21 ARG 16 1HH2 ARG 16 -10.987 -19.505 7.069 127 HH22 ARG 16 2HH2 ARG 16 -11.308 -20.172 5.504 128 H TRP 17 H TRP 17 -6.026 -18.373 10.592 129 HA TRP 17 HA TRP 17 -6.812 -15.853 9.773 130 HB2 TRP 17 2HB TRP 17 -8.261 -16.971 11.249 131 HB3 TRP 17 3HB TRP 17 -6.985 -17.252 12.431 132 HD1 TRP 17 HD1 TRP 17 -9.094 -14.321 11.032 133 HE1 TRP 17 HE1 TRP 17 -9.326 -12.552 12.888 134 HE3 TRP 17 HE3 TRP 17 -6.092 -16.462 14.574 135 HZ2 TRP 17 HZ2 TRP 17 -8.363 -12.121 15.506 136 HZ3 TRP 17 HZ3 TRP 17 -5.800 -15.307 16.727 137 HH2 TRP 17 HH2 TRP 17 -6.912 -13.181 17.181 138 H VAL 18 H VAL 18 -4.695 -16.594 12.551 139 HA VAL 18 HA VAL 18 -4.025 -14.030 13.289 140 HB VAL 18 HB VAL 18 -1.802 -15.026 14.031 141 HG11 VAL 18 1HG1 VAL 18 -3.964 -14.905 15.361 142 HG12 VAL 18 2HG1 VAL 18 -4.187 -16.607 14.952 143 HG13 VAL 18 3HG1 VAL 18 -2.778 -16.100 15.885 144 HG21 VAL 18 3HG2 VAL 18 -1.528 -16.770 12.421 145 HG22 VAL 18 1HG2 VAL 18 -1.743 -17.527 13.999 146 HG23 VAL 18 2HG2 VAL 18 -3.081 -17.487 12.850 147 H LEU 19 H LEU 19 -2.426 -16.061 10.851 148 HA LEU 19 HA LEU 19 -0.475 -14.111 10.156 149 HB2 LEU 19 2HB LEU 19 -1.446 -16.656 8.922 150 HB3 LEU 19 3HB LEU 19 -0.351 -15.601 8.032 151 HG LEU 19 HG LEU 19 0.325 -16.628 10.773 152 HD11 LEU 19 1HD1 LEU 19 -0.195 -18.360 8.792 153 HD12 LEU 19 2HD1 LEU 19 1.061 -18.617 10.003 154 HD13 LEU 19 3HD1 LEU 19 1.485 -17.972 8.417 155 HD21 LEU 19 3HD2 LEU 19 2.068 -15.757 8.474 156 HD22 LEU 19 1HD2 LEU 19 2.579 -16.136 10.118 157 HD23 LEU 19 2HD2 LEU 19 1.585 -14.712 9.811 158 H GLU 20 H GLU 20 -3.772 -14.570 9.325 159 HA GLU 20 HA GLU 20 -3.650 -13.103 6.844 160 HB2 GLU 20 2HB GLU 20 -5.452 -14.879 7.955 161 HB3 GLU 20 3HB GLU 20 -6.283 -13.335 8.089 162 HG2 GLU 20 2HG GLU 20 -5.022 -13.922 5.488 163 HG3 GLU 20 3HG GLU 20 -6.416 -14.906 5.929 164 H ARG 21 H ARG 21 -5.173 -12.508 10.015 165 HA ARG 21 HA ARG 21 -5.953 -9.878 9.546 166 HB2 ARG 21 2HB ARG 21 -6.024 -9.639 11.996 167 HB3 ARG 21 3HB ARG 21 -6.754 -11.147 11.461 168 HG2 ARG 21 2HG ARG 21 -5.103 -12.435 12.375 169 HG3 ARG 21 3HG ARG 21 -3.888 -11.162 12.245 170 HD2 ARG 21 2HD ARG 21 -6.123 -10.511 14.020 171 HD3 ARG 21 3HD ARG 21 -5.168 -11.898 14.544 172 HE ARG 21 HE ARG 21 -3.422 -9.823 13.843 173 HH11 ARG 21 1HH1 ARG 21 -5.797 -10.601 16.267 174 HH12 ARG 21 2HH1 ARG 21 -5.049 -9.635 17.496 175 HH21 ARG 21 1HH2 ARG 21 -2.429 -8.548 15.453 176 HH22 ARG 21 2HH2 ARG 21 -3.134 -8.467 17.032 177 H ALA 22 H ALA 22 -2.829 -11.196 10.199 178 HA ALA 22 HA ALA 22 -1.465 -9.070 11.317 179 HB1 ALA 22 1HB ALA 22 -0.042 -10.529 9.181 180 HB2 ALA 22 2HB ALA 22 0.419 -10.231 10.858 181 HB3 ALA 22 3HB ALA 22 -0.736 -11.508 10.474 182 H LEU 23 H LEU 23 -1.682 -9.792 7.826 183 HA LEU 23 HA LEU 23 -0.733 -7.139 7.170 184 HB2 LEU 23 2HB LEU 23 -1.816 -9.121 5.202 185 HB3 LEU 23 3HB LEU 23 -0.602 -7.868 4.954 186 HG LEU 23 HG LEU 23 -0.252 -10.488 6.404 187 HD11 LEU 23 1HD1 LEU 23 1.672 -10.419 4.557 188 HD12 LEU 23 2HD1 LEU 23 0.463 -9.433 3.735 189 HD13 LEU 23 3HD1 LEU 23 0.066 -11.075 4.241 190 HD21 LEU 23 3HD2 LEU 23 1.334 -9.498 7.606 191 HD22 LEU 23 1HD2 LEU 23 1.156 -7.988 6.713 192 HD23 LEU 23 2HD2 LEU 23 2.224 -9.251 6.102 193 H ALA 24 H ALA 24 -3.753 -8.792 7.465 194 HA ALA 24 HA ALA 24 -5.427 -7.382 5.790 195 HB1 ALA 24 1HB ALA 24 -7.214 -8.124 7.098 196 HB2 ALA 24 2HB ALA 24 -5.959 -9.336 7.359 197 HB3 ALA 24 3HB ALA 24 -6.259 -8.100 8.581 198 H GLY 25 H GLY 25 -4.070 -6.406 8.885 199 HA2 GLY 25 2HA GLY 25 -5.656 -3.975 8.966 200 HA3 GLY 25 3HA GLY 25 -4.449 -4.475 10.141 201 H ALA 26 H ALA 26 -2.609 -4.965 7.730 202 HA ALA 26 HA ALA 26 -1.594 -2.225 7.649 203 HB1 ALA 26 1HB ALA 26 0.505 -3.093 7.236 204 HB2 ALA 26 2HB ALA 26 -0.213 -4.341 8.255 205 HB3 ALA 26 3HB ALA 26 -0.132 -4.567 6.507 206 H GLY 27 H GLY 27 -0.128 -2.195 5.357 207 HA2 GLY 27 2HA GLY 27 -2.247 -2.110 3.326 208 HA3 GLY 27 3HA GLY 27 -0.739 -1.211 3.276 209 H LEU 28 H LEU 28 -1.569 -4.661 3.633 210 HA LEU 28 HA LEU 28 -0.031 -5.220 1.202 211 HB2 LEU 28 2HB LEU 28 0.331 -7.213 3.308 212 HB3 LEU 28 3HB LEU 28 1.501 -6.525 2.185 213 HG LEU 28 HG LEU 28 0.553 -5.080 4.651 214 HD11 LEU 28 1HD1 LEU 28 1.971 -7.425 4.702 215 HD12 LEU 28 2HD1 LEU 28 1.988 -6.184 5.955 216 HD13 LEU 28 3HD1 LEU 28 3.242 -6.202 4.714 217 HD21 LEU 28 3HD2 LEU 28 3.148 -4.350 3.939 218 HD22 LEU 28 1HD2 LEU 28 1.675 -3.403 3.721 219 HD23 LEU 28 2HD2 LEU 28 2.259 -4.438 2.417 220 H THR 29 H THR 29 -0.293 -7.637 0.621 221 HA THR 29 HA THR 29 -3.153 -8.215 0.731 222 HB THR 29 HB THR 29 -1.095 -9.673 -0.924 223 HG1 THR 29 HG1 THR 29 -2.612 -7.363 -1.632 224 HG21 THR 29 3HG2 THR 29 -3.274 -9.776 -2.397 225 HG22 THR 29 1HG2 THR 29 -4.074 -9.509 -0.848 226 HG23 THR 29 2HG2 THR 29 -3.029 -10.912 -1.071 227 H CYS 30 H CYS 30 -3.934 -10.360 1.149 228 HA CYS 30 HA CYS 30 -2.102 -12.078 2.669 229 HB2 CYS 30 2HB CYS 30 -4.036 -12.485 4.277 230 HB3 CYS 30 3HB CYS 30 -3.229 -10.927 4.404 231 HG CYS 30 HG CYS 30 -5.788 -10.771 2.308 232 H THR 31 H THR 31 -2.079 -14.007 1.747 233 HA THR 31 HA THR 31 -4.596 -15.075 0.647 234 HB THR 31 HB THR 31 -1.886 -15.696 -0.519 235 HG1 THR 31 HG1 THR 31 -2.554 -13.398 -0.681 236 HG21 THR 31 3HG2 THR 31 -4.615 -15.900 -1.779 237 HG22 THR 31 1HG2 THR 31 -3.864 -17.229 -0.897 238 HG23 THR 31 2HG2 THR 31 -3.098 -16.593 -2.353 239 H THR 32 H THR 32 -5.222 -16.719 1.875 240 HA THR 32 HA THR 32 -3.185 -18.420 3.136 241 HB THR 32 HB THR 32 -4.796 -19.070 4.749 242 HG1 THR 32 HG1 THR 32 -6.668 -19.403 3.688 243 HG21 THR 32 3HG2 THR 32 -4.108 -16.403 4.384 244 HG22 THR 32 1HG2 THR 32 -4.749 -17.130 5.857 245 HG23 THR 32 2HG2 THR 32 -5.842 -16.366 4.703 246 H PHE 33 H PHE 33 -3.162 -20.624 2.862 247 HA PHE 33 HA PHE 33 -5.086 -21.750 0.941 248 HB2 PHE 33 2HB PHE 33 -2.091 -22.172 0.971 249 HB3 PHE 33 3HB PHE 33 -3.216 -23.094 -0.021 250 HD1 PHE 33 HD2 PHE 33 -4.512 -21.932 -1.803 251 HD2 PHE 33 HD1 PHE 33 -1.355 -20.030 0.325 252 HE1 PHE 33 HE2 PHE 33 -4.358 -20.223 -3.566 253 HE2 PHE 33 HE1 PHE 33 -1.196 -18.317 -1.434 254 HZ PHE 33 HZ PHE 33 -2.698 -18.412 -3.383 255 H GLU 34 H GLU 34 -4.323 -24.333 0.886 256 HA GLU 34 HA GLU 34 -4.276 -25.210 3.692 257 HB2 GLU 34 2HB GLU 34 -5.954 -26.947 3.131 258 HB3 GLU 34 3HB GLU 34 -6.586 -25.312 2.994 259 HG2 GLU 34 2HG GLU 34 -7.362 -25.982 1.018 260 HG3 GLU 34 3HG GLU 34 -5.703 -25.776 0.461 261 H ASN 35 H ASN 35 -3.767 -26.034 0.300 262 HA ASN 35 HA ASN 35 -1.997 -28.228 1.152 263 HB2 ASN 35 2HB ASN 35 -3.867 -27.912 -1.123 264 HB3 ASN 35 3HB ASN 35 -2.338 -28.707 -1.486 265 HD21 ASN 35 1HD2 ASN 35 -4.863 -29.931 -1.623 266 HD22 ASN 35 2HD2 ASN 35 -4.914 -31.191 -0.442 267 H GLY 36 H GLY 36 0.118 -27.991 0.835 268 HA2 GLY 36 2HA GLY 36 1.285 -25.642 -0.110 269 HA3 GLY 36 3HA GLY 36 2.124 -27.174 0.077 270 H ASN 37 H ASN 37 0.257 -28.476 -1.851 271 HA ASN 37 HA ASN 37 1.793 -27.972 -4.203 272 HB2 ASN 37 2HB ASN 37 1.092 -30.209 -3.917 273 HB3 ASN 37 3HB ASN 37 -0.573 -29.734 -3.598 274 HD21 ASN 37 1HD2 ASN 37 1.720 -30.606 -5.953 275 HD22 ASN 37 2HD2 ASN 37 0.702 -30.449 -7.340 276 H GLU 38 H GLU 38 -1.097 -26.675 -2.910 277 HA GLU 38 HA GLU 38 -2.106 -25.755 -5.473 278 HB2 GLU 38 2HB GLU 38 -3.336 -26.376 -3.107 279 HB3 GLU 38 3HB GLU 38 -3.285 -24.620 -3.031 280 HG2 GLU 38 2HG GLU 38 -4.924 -24.420 -4.509 281 HG3 GLU 38 3HG GLU 38 -4.150 -25.541 -5.628 282 H VAL 39 H VAL 39 0.022 -24.678 -3.042 283 HA VAL 39 HA VAL 39 -0.319 -21.855 -3.660 284 HB VAL 39 HB VAL 39 1.797 -23.079 -1.894 285 HG11 VAL 39 1HG1 VAL 39 1.437 -20.494 -2.795 286 HG12 VAL 39 2HG1 VAL 39 0.719 -20.478 -1.183 287 HG13 VAL 39 3HG1 VAL 39 2.394 -20.988 -1.399 288 HG21 VAL 39 3HG2 VAL 39 -0.194 -22.011 -0.267 289 HG22 VAL 39 1HG2 VAL 39 -1.059 -22.944 -1.488 290 HG23 VAL 39 2HG2 VAL 39 0.181 -23.718 -0.501 291 H LEU 40 H LEU 40 2.069 -24.425 -4.106 292 HA LEU 40 HA LEU 40 4.194 -23.016 -5.127 293 HB2 LEU 40 2HB LEU 40 4.669 -25.234 -4.891 294 HB3 LEU 40 3HB LEU 40 3.119 -25.747 -5.555 295 HG LEU 40 HG LEU 40 3.910 -25.309 -7.809 296 HD11 LEU 40 1HD1 LEU 40 6.695 -24.969 -7.365 297 HD12 LEU 40 2HD1 LEU 40 5.832 -23.713 -6.479 298 HD13 LEU 40 3HD1 LEU 40 5.573 -23.905 -8.213 299 HD21 LEU 40 3HD2 LEU 40 6.109 -26.873 -7.490 300 HD22 LEU 40 1HD2 LEU 40 4.449 -27.469 -7.526 301 HD23 LEU 40 2HD2 LEU 40 5.246 -27.175 -5.980 302 H ALA 41 H ALA 41 1.271 -24.068 -6.813 303 HA ALA 41 HA ALA 41 2.120 -23.118 -9.372 304 HB1 ALA 41 1HB ALA 41 0.045 -24.718 -8.413 305 HB2 ALA 41 2HB ALA 41 -0.743 -23.310 -9.125 306 HB3 ALA 41 3HB ALA 41 0.368 -24.280 -10.091 307 H ALA 42 H ALA 42 0.397 -21.754 -6.660 308 HA ALA 42 HA ALA 42 -0.849 -19.580 -7.879 309 HB1 ALA 42 1HB ALA 42 -1.088 -20.380 -5.487 310 HB2 ALA 42 2HB ALA 42 0.384 -19.472 -5.140 311 HB3 ALA 42 3HB ALA 42 -1.051 -18.634 -5.730 312 H LEU 43 H LEU 43 2.492 -20.064 -6.953 313 HA LEU 43 HA LEU 43 3.424 -17.447 -6.991 314 HB2 LEU 43 2HB LEU 43 4.987 -19.757 -8.102 315 HB3 LEU 43 3HB LEU 43 5.588 -18.333 -7.255 316 HG LEU 43 HG LEU 43 4.064 -20.634 -6.035 317 HD11 LEU 43 1HD1 LEU 43 6.143 -21.097 -4.871 318 HD12 LEU 43 2HD1 LEU 43 6.926 -19.747 -5.693 319 HD13 LEU 43 3HD1 LEU 43 6.389 -21.150 -6.617 320 HD21 LEU 43 3HD2 LEU 43 4.121 -17.992 -5.186 321 HD22 LEU 43 1HD2 LEU 43 5.347 -18.795 -4.206 322 HD23 LEU 43 2HD2 LEU 43 3.692 -19.404 -4.218 323 H ALA 44 H ALA 44 3.020 -19.732 -9.669 324 HA ALA 44 HA ALA 44 4.176 -18.267 -11.715 325 HB1 ALA 44 1HB ALA 44 3.605 -20.203 -12.662 326 HB2 ALA 44 2HB ALA 44 2.300 -20.478 -11.508 327 HB3 ALA 44 3HB ALA 44 2.020 -19.477 -12.933 328 H SER 45 H SER 45 1.250 -17.677 -9.994 329 HA SER 45 HA SER 45 0.095 -15.962 -12.010 330 HB2 SER 45 2HB SER 45 -0.770 -16.038 -9.129 331 HB3 SER 45 3HB SER 45 -1.742 -15.727 -10.567 332 HG SER 45 HG SER 45 -2.227 -17.776 -10.178 333 H LYS 46 H LYS 46 1.917 -15.603 -9.023 334 HA LYS 46 HA LYS 46 2.972 -13.099 -9.735 335 HB2 LYS 46 2HB LYS 46 1.839 -11.737 -7.936 336 HB3 LYS 46 3HB LYS 46 0.838 -12.132 -9.327 337 HG2 LYS 46 2HG LYS 46 -0.509 -13.541 -8.137 338 HG3 LYS 46 3HG LYS 46 0.754 -13.939 -6.969 339 HD2 LYS 46 2HD LYS 46 -0.656 -11.277 -7.151 340 HD3 LYS 46 3HD LYS 46 -1.061 -12.558 -6.006 341 HE2 LYS 46 2HE LYS 46 0.389 -11.546 -4.635 342 HE3 LYS 46 3HE LYS 46 1.639 -12.273 -5.643 343 HZ1 LYS 46 3HZ LYS 46 1.243 -10.122 -7.050 344 HZ2 LYS 46 1HZ LYS 46 2.261 -10.096 -5.699 345 HZ3 LYS 46 2HZ LYS 46 0.681 -9.505 -5.578 346 H THR 47 H THR 47 4.835 -14.216 -9.070 347 HA THR 47 HA THR 47 5.378 -15.573 -6.788 348 HB THR 47 HB THR 47 7.410 -13.531 -7.544 349 HG1 THR 47 HG1 THR 47 7.194 -13.994 -9.593 350 HG21 THR 47 3HG2 THR 47 7.761 -16.504 -7.456 351 HG22 THR 47 1HG2 THR 47 7.651 -15.579 -5.959 352 HG23 THR 47 2HG2 THR 47 8.934 -15.231 -7.118 353 HA PRO 48 HA PRO 48 4.386 -12.566 -3.626 354 HB2 PRO 48 2HB PRO 48 4.808 -14.250 -1.539 355 HB3 PRO 48 3HB PRO 48 3.339 -14.287 -2.521 356 HG2 PRO 48 2HG PRO 48 5.764 -16.036 -2.674 357 HG3 PRO 48 3HG PRO 48 4.051 -16.486 -2.776 358 HD2 PRO 48 2HD PRO 48 5.624 -16.237 -4.966 359 HD3 PRO 48 3HD PRO 48 3.889 -15.863 -4.989 360 H ASP 49 H ASP 49 5.553 -11.336 -2.160 361 HA ASP 49 HA ASP 49 8.386 -11.299 -2.520 362 HB2 ASP 49 2HB ASP 49 6.840 -9.763 -0.432 363 HB3 ASP 49 3HB ASP 49 8.377 -9.332 -1.177 364 H VAL 50 H VAL 50 6.406 -13.126 -0.558 365 HA VAL 50 HA VAL 50 8.528 -14.351 0.816 366 HB VAL 50 HB VAL 50 8.527 -12.242 2.110 367 HG11 VAL 50 1HG1 VAL 50 5.700 -12.660 2.056 368 HG12 VAL 50 2HG1 VAL 50 6.249 -12.587 3.732 369 HG13 VAL 50 3HG1 VAL 50 6.605 -11.259 2.627 370 HG21 VAL 50 3HG2 VAL 50 9.167 -14.450 3.098 371 HG22 VAL 50 1HG2 VAL 50 8.617 -13.254 4.272 372 HG23 VAL 50 2HG2 VAL 50 7.539 -14.556 3.769 373 H LEU 51 H LEU 51 7.864 -16.158 2.030 374 HA LEU 51 HA LEU 51 4.980 -16.744 1.919 375 HB2 LEU 51 2HB LEU 51 7.006 -18.016 0.484 376 HB3 LEU 51 3HB LEU 51 6.627 -19.114 1.810 377 HG LEU 51 HG LEU 51 4.296 -18.068 0.350 378 HD11 LEU 51 1HD1 LEU 51 5.005 -18.521 -1.703 379 HD12 LEU 51 2HD1 LEU 51 5.130 -20.214 -1.227 380 HD13 LEU 51 3HD1 LEU 51 6.535 -19.156 -1.095 381 HD21 LEU 51 3HD2 LEU 51 4.835 -20.108 2.122 382 HD22 LEU 51 1HD2 LEU 51 4.681 -20.942 0.576 383 HD23 LEU 51 2HD2 LEU 51 3.365 -19.925 1.163 384 H LEU 52 H LEU 52 4.119 -17.968 3.603 385 HA LEU 52 HA LEU 52 5.913 -18.583 5.845 386 HB2 LEU 52 2HB LEU 52 3.574 -16.759 5.810 387 HB3 LEU 52 3HB LEU 52 3.780 -17.788 7.226 388 HG LEU 52 HG LEU 52 6.115 -16.824 7.421 389 HD11 LEU 52 1HD1 LEU 52 6.863 -15.532 5.784 390 HD12 LEU 52 2HD1 LEU 52 5.631 -14.341 6.198 391 HD13 LEU 52 3HD1 LEU 52 5.293 -15.573 4.982 392 HD21 LEU 52 3HD2 LEU 52 4.288 -16.160 8.890 393 HD22 LEU 52 1HD2 LEU 52 3.759 -14.962 7.709 394 HD23 LEU 52 2HD2 LEU 52 5.320 -14.780 8.509 395 H SER 53 H SER 53 5.544 -20.723 4.760 396 HA SER 53 HA SER 53 2.959 -21.936 4.967 397 HB2 SER 53 2HB SER 53 4.518 -22.695 3.258 398 HB3 SER 53 3HB SER 53 5.693 -23.150 4.491 399 HG SER 53 HG SER 53 4.673 -24.963 4.735 400 H ASP 54 H ASP 54 2.373 -23.688 6.339 401 HA ASP 54 HA ASP 54 3.841 -23.721 8.895 402 HB2 ASP 54 2HB ASP 54 1.463 -22.675 8.775 403 HB3 ASP 54 3HB ASP 54 0.910 -24.344 8.681 404 H ILE 55 H ILE 55 4.455 -25.642 9.698 405 HA ILE 55 HA ILE 55 3.742 -28.033 8.151 406 HB ILE 55 HB ILE 55 5.947 -27.928 10.184 407 HG12 ILE 55 2HG1 ILE 55 6.125 -27.103 7.278 408 HG13 ILE 55 3HG1 ILE 55 6.335 -26.046 8.670 409 HG21 ILE 55 1HG2 ILE 55 4.970 -30.033 8.946 410 HG22 ILE 55 2HG2 ILE 55 6.016 -29.473 7.642 411 HG23 ILE 55 3HG2 ILE 55 6.704 -29.861 9.218 412 HD11 ILE 55 3HD1 ILE 55 8.493 -26.526 7.903 413 HD12 ILE 55 1HD1 ILE 55 8.270 -27.542 9.327 414 HD13 ILE 55 2HD1 ILE 55 8.135 -28.242 7.713 415 H ARG 56 H ARG 56 1.643 -27.939 9.364 416 HA ARG 56 HA ARG 56 1.917 -29.242 11.994 417 HB2 ARG 56 2HB ARG 56 -0.109 -28.234 12.706 418 HB3 ARG 56 3HB ARG 56 0.837 -26.953 11.959 419 HG2 ARG 56 2HG ARG 56 -0.481 -27.244 9.887 420 HG3 ARG 56 3HG ARG 56 -1.477 -28.433 10.729 421 HD2 ARG 56 2HD ARG 56 -1.148 -25.520 11.435 422 HD3 ARG 56 3HD ARG 56 -2.581 -26.285 10.751 423 HE ARG 56 HE ARG 56 -3.058 -27.219 12.832 424 HH11 ARG 56 1HH1 ARG 56 -0.056 -25.456 12.884 425 HH12 ARG 56 2HH1 ARG 56 0.042 -25.417 14.613 426 HH21 ARG 56 1HH2 ARG 56 -2.940 -27.174 15.109 427 HH22 ARG 56 2HH2 ARG 56 -1.599 -26.395 15.878 428 H MET 57 H MET 57 0.821 -29.539 8.791 429 HA MET 57 HA MET 57 -1.079 -31.662 9.417 430 HB2 MET 57 2HB MET 57 -1.496 -31.679 6.970 431 HB3 MET 57 3HB MET 57 -1.765 -30.104 7.704 432 HG2 MET 57 2HG MET 57 0.943 -30.523 6.671 433 HG3 MET 57 3HG MET 57 -0.328 -30.545 5.451 434 HE1 MET 57 3HE MET 57 0.705 -28.432 4.236 435 HE2 MET 57 1HE MET 57 1.129 -26.936 5.070 436 HE3 MET 57 2HE MET 57 2.016 -28.421 5.417 437 HA PRO 58 HA PRO 58 1.833 -34.912 8.835 438 HB2 PRO 58 2HB PRO 58 0.119 -36.914 8.187 439 HB3 PRO 58 3HB PRO 58 0.278 -36.280 9.829 440 HG2 PRO 58 2HG PRO 58 -1.787 -35.662 7.752 441 HG3 PRO 58 3HG PRO 58 -1.999 -35.954 9.488 442 HD2 PRO 58 2HD PRO 58 -1.979 -33.465 8.421 443 HD3 PRO 58 3HD PRO 58 -1.371 -33.809 10.054 444 H GLY 59 H GLY 59 1.894 -36.947 7.141 445 HA2 GLY 59 2HA GLY 59 2.476 -37.538 5.001 446 HA3 GLY 59 3HA GLY 59 1.100 -36.568 4.496 447 H MET 60 H MET 60 1.428 -34.586 3.594 448 HA MET 60 HA MET 60 3.847 -34.026 2.353 449 HB2 MET 60 2HB MET 60 1.290 -32.954 2.319 450 HB3 MET 60 3HB MET 60 2.285 -31.625 2.898 451 HG2 MET 60 2HG MET 60 3.219 -31.298 0.901 452 HG3 MET 60 3HG MET 60 3.430 -33.024 0.612 453 HE1 MET 60 3HE MET 60 2.324 -30.209 -1.020 454 HE2 MET 60 1HE MET 60 0.638 -30.358 -1.516 455 HE3 MET 60 2HE MET 60 1.032 -29.907 0.143 456 H ASP 61 H ASP 61 2.827 -33.369 5.574 457 HA ASP 61 HA ASP 61 3.949 -32.534 7.374 458 HB2 ASP 61 2HB ASP 61 6.023 -33.258 5.544 459 HB3 ASP 61 3HB ASP 61 6.463 -31.737 6.315 460 H GLY 62 H GLY 62 5.538 -30.669 4.793 461 HA2 GLY 62 2HA GLY 62 4.031 -28.423 4.649 462 HA3 GLY 62 3HA GLY 62 4.909 -28.201 6.155 463 H LEU 63 H LEU 63 7.356 -29.361 5.436 464 HA LEU 63 HA LEU 63 8.463 -27.203 3.871 465 HB2 LEU 63 2HB LEU 63 10.616 -28.599 4.331 466 HB3 LEU 63 3HB LEU 63 9.853 -27.678 5.625 467 HG LEU 63 HG LEU 63 8.880 -29.686 6.542 468 HD11 LEU 63 1HD1 LEU 63 9.852 -30.886 3.996 469 HD12 LEU 63 2HD1 LEU 63 8.317 -31.105 4.834 470 HD13 LEU 63 3HD1 LEU 63 9.773 -31.891 5.443 471 HD21 LEU 63 3HD2 LEU 63 11.100 -31.021 6.844 472 HD22 LEU 63 1HD2 LEU 63 10.957 -29.386 7.491 473 HD23 LEU 63 2HD2 LEU 63 11.811 -29.662 5.973 474 H ALA 64 H ALA 64 7.341 -30.351 3.273 475 HA ALA 64 HA ALA 64 8.945 -31.419 1.345 476 HB1 ALA 64 1HB ALA 64 6.008 -31.433 1.779 477 HB2 ALA 64 2HB ALA 64 6.624 -32.066 0.252 478 HB3 ALA 64 3HB ALA 64 7.160 -32.768 1.778 479 H LEU 65 H LEU 65 6.709 -28.720 0.993 480 HA LEU 65 HA LEU 65 7.241 -28.498 -1.851 481 HB2 LEU 65 2HB LEU 65 5.803 -26.377 -1.516 482 HB3 LEU 65 3HB LEU 65 5.044 -27.965 -1.413 483 HG LEU 65 HG LEU 65 5.975 -26.655 1.099 484 HD11 LEU 65 1HD1 LEU 65 3.850 -25.654 -0.679 485 HD12 LEU 65 2HD1 LEU 65 4.785 -24.819 0.560 486 HD13 LEU 65 3HD1 LEU 65 3.417 -25.832 1.021 487 HD21 LEU 65 3HD2 LEU 65 5.004 -28.507 1.862 488 HD22 LEU 65 1HD2 LEU 65 4.300 -28.873 0.287 489 HD23 LEU 65 2HD2 LEU 65 3.460 -27.790 1.397 490 H LEU 66 H LEU 66 7.911 -26.692 1.120 491 HA LEU 66 HA LEU 66 9.110 -24.438 0.093 492 HB2 LEU 66 2HB LEU 66 9.301 -25.962 2.601 493 HB3 LEU 66 3HB LEU 66 10.674 -24.913 2.255 494 HG LEU 66 HG LEU 66 8.310 -23.403 1.833 495 HD11 LEU 66 1HD1 LEU 66 6.905 -24.581 3.185 496 HD12 LEU 66 2HD1 LEU 66 7.681 -23.560 4.395 497 HD13 LEU 66 3HD1 LEU 66 8.215 -25.227 4.175 498 HD21 LEU 66 3HD2 LEU 66 9.327 -22.363 4.060 499 HD22 LEU 66 1HD2 LEU 66 10.087 -22.147 2.484 500 HD23 LEU 66 2HD2 LEU 66 10.695 -23.375 3.593 501 H LYS 67 H LYS 67 10.457 -27.664 0.472 502 HA LYS 67 HA LYS 67 13.145 -27.167 0.058 503 HB2 LYS 67 2HB LYS 67 11.484 -29.505 -0.898 504 HB3 LYS 67 3HB LYS 67 13.243 -29.474 -0.890 505 HG2 LYS 67 2HG LYS 67 11.740 -28.953 1.635 506 HG3 LYS 67 3HG LYS 67 11.953 -30.607 1.056 507 HD2 LYS 67 2HD LYS 67 14.216 -28.657 1.468 508 HD3 LYS 67 3HD LYS 67 13.700 -29.840 2.673 509 HE2 LYS 67 2HE LYS 67 15.103 -31.276 1.709 510 HE3 LYS 67 3HE LYS 67 13.994 -31.315 0.340 511 HZ1 LYS 67 3HZ LYS 67 15.240 -29.417 -0.600 512 HZ2 LYS 67 1HZ LYS 67 16.179 -30.816 -0.445 513 HZ3 LYS 67 2HZ LYS 67 16.358 -29.550 0.662 514 H GLN 68 H GLN 68 10.512 -27.093 -2.214 515 HA GLN 68 HA GLN 68 12.271 -27.012 -4.518 516 HB2 GLN 68 2HB GLN 68 10.401 -27.292 -5.811 517 HB3 GLN 68 3HB GLN 68 9.825 -27.997 -4.307 518 HG2 GLN 68 2HG GLN 68 9.046 -25.513 -3.861 519 HG3 GLN 68 3HG GLN 68 9.075 -25.449 -5.622 520 HE21 GLN 68 1HE2 GLN 68 6.912 -25.506 -3.479 521 HE22 GLN 68 2HE2 GLN 68 5.809 -26.710 -4.042 522 H ILE 69 H ILE 69 10.586 -24.812 -2.430 523 HA ILE 69 HA ILE 69 10.531 -22.549 -4.109 524 HB ILE 69 HB ILE 69 10.680 -22.687 -1.095 525 HG12 ILE 69 2HG1 ILE 69 8.303 -22.290 -2.925 526 HG13 ILE 69 3HG1 ILE 69 8.717 -23.809 -2.138 527 HG21 ILE 69 1HG2 ILE 69 9.398 -20.358 -1.713 528 HG22 ILE 69 2HG2 ILE 69 11.095 -20.494 -1.258 529 HG23 ILE 69 3HG2 ILE 69 10.641 -20.437 -2.961 530 HD11 ILE 69 3HD1 ILE 69 7.577 -21.323 -0.991 531 HD12 ILE 69 1HD1 ILE 69 7.153 -23.008 -0.693 532 HD13 ILE 69 2HD1 ILE 69 8.610 -22.324 0.028 533 H LYS 70 H LYS 70 13.087 -24.086 -2.392 534 HA LYS 70 HA LYS 70 14.815 -21.776 -2.335 535 HB2 LYS 70 2HB LYS 70 15.513 -24.682 -1.885 536 HB3 LYS 70 3HB LYS 70 16.493 -23.289 -1.446 537 HG2 LYS 70 2HG LYS 70 13.756 -23.421 -0.326 538 HG3 LYS 70 3HG LYS 70 14.947 -24.566 0.296 539 HD2 LYS 70 2HD LYS 70 15.550 -21.632 0.088 540 HD3 LYS 70 3HD LYS 70 14.708 -22.303 1.487 541 HE2 LYS 70 2HE LYS 70 17.418 -23.165 0.478 542 HE3 LYS 70 3HE LYS 70 17.124 -22.126 1.871 543 HZ1 LYS 70 3HZ LYS 70 15.674 -24.136 2.630 544 HZ2 LYS 70 1HZ LYS 70 17.349 -24.155 2.867 545 HZ3 LYS 70 2HZ LYS 70 16.668 -25.009 1.576 546 H GLN 71 H GLN 71 14.248 -24.522 -4.417 547 HA GLN 71 HA GLN 71 16.598 -23.943 -6.031 548 HB2 GLN 71 2HB GLN 71 16.125 -26.271 -5.686 549 HB3 GLN 71 3HB GLN 71 14.464 -26.068 -6.225 550 HG2 GLN 71 2HG GLN 71 15.013 -26.173 -8.399 551 HG3 GLN 71 3HG GLN 71 16.519 -25.284 -8.171 552 HE21 GLN 71 1HE2 GLN 71 18.382 -26.409 -7.557 553 HE22 GLN 71 2HE2 GLN 71 18.519 -28.119 -7.760 554 H ARG 72 H ARG 72 13.212 -23.298 -5.986 555 HA ARG 72 HA ARG 72 13.228 -22.438 -8.785 556 HB2 ARG 72 2HB ARG 72 11.287 -23.657 -7.172 557 HB3 ARG 72 3HB ARG 72 10.725 -22.007 -7.404 558 HG2 ARG 72 2HG ARG 72 11.684 -23.359 -9.831 559 HG3 ARG 72 3HG ARG 72 10.225 -24.037 -9.104 560 HD2 ARG 72 2HD ARG 72 9.561 -22.387 -10.703 561 HD3 ARG 72 3HD ARG 72 9.250 -21.745 -9.091 562 HE ARG 72 HE ARG 72 11.705 -20.781 -9.656 563 HH11 ARG 72 1HH1 ARG 72 8.690 -20.762 -11.396 564 HH12 ARG 72 2HH1 ARG 72 9.015 -19.265 -12.204 565 HH21 ARG 72 1HH2 ARG 72 12.146 -18.809 -10.715 566 HH22 ARG 72 2HH2 ARG 72 10.982 -18.155 -11.817 567 H HIS 73 H HIS 73 13.055 -21.215 -5.523 568 HA HIS 73 HA HIS 73 13.397 -18.505 -6.550 569 HB2 HIS 73 2HB HIS 73 11.427 -18.963 -4.327 570 HB3 HIS 73 3HB HIS 73 11.622 -17.546 -5.355 571 HD1 HIS 73 HD1 HIS 73 10.795 -17.863 -7.894 572 HD2 HIS 73 HD2 HIS 73 9.556 -20.757 -5.182 573 HE1 HIS 73 HE1 HIS 73 8.874 -19.048 -9.005 574 HA PRO 74 HA PRO 74 16.205 -19.587 -3.017 575 HB2 PRO 74 2HB PRO 74 18.452 -18.639 -4.209 576 HB3 PRO 74 3HB PRO 74 17.857 -20.285 -4.453 577 HG2 PRO 74 2HG PRO 74 17.535 -17.877 -6.202 578 HG3 PRO 74 3HG PRO 74 17.921 -19.547 -6.657 579 HD2 PRO 74 2HD PRO 74 15.431 -18.510 -6.895 580 HD3 PRO 74 3HD PRO 74 15.721 -20.223 -6.528 581 H MET 75 H MET 75 16.256 -16.693 -5.091 582 HA MET 75 HA MET 75 17.277 -14.976 -3.065 583 HB2 MET 75 2HB MET 75 16.930 -14.787 -5.785 584 HB3 MET 75 3HB MET 75 15.696 -13.693 -5.175 585 HG2 MET 75 2HG MET 75 18.540 -13.548 -4.243 586 HG3 MET 75 3HG MET 75 17.988 -12.724 -5.699 587 HE1 MET 75 3HE MET 75 14.940 -11.859 -4.739 588 HE2 MET 75 1HE MET 75 15.377 -10.198 -4.341 589 HE3 MET 75 2HE MET 75 16.087 -10.982 -5.752 590 H LEU 76 H LEU 76 14.194 -16.273 -3.685 591 HA LEU 76 HA LEU 76 12.691 -14.129 -2.475 592 HB2 LEU 76 2HB LEU 76 11.457 -15.272 -4.065 593 HB3 LEU 76 3HB LEU 76 12.047 -16.846 -3.536 594 HG LEU 76 HG LEU 76 10.628 -16.702 -1.542 595 HD11 LEU 76 1HD1 LEU 76 10.277 -14.535 -0.948 596 HD12 LEU 76 2HD1 LEU 76 8.784 -14.824 -1.841 597 HD13 LEU 76 3HD1 LEU 76 10.126 -13.982 -2.617 598 HD21 LEU 76 3HD2 LEU 76 8.397 -16.407 -3.059 599 HD22 LEU 76 1HD2 LEU 76 9.378 -17.871 -2.996 600 HD23 LEU 76 2HD2 LEU 76 9.617 -16.705 -4.298 601 HA PRO 77 HA PRO 77 13.587 -15.552 1.657 602 HB2 PRO 77 2HB PRO 77 12.113 -13.652 2.917 603 HB3 PRO 77 3HB PRO 77 13.711 -13.331 2.232 604 HG2 PRO 77 2HG PRO 77 11.006 -12.749 1.087 605 HG3 PRO 77 3HG PRO 77 12.457 -11.729 1.105 606 HD2 PRO 77 2HD PRO 77 11.701 -13.147 -1.074 607 HD3 PRO 77 3HD PRO 77 13.403 -12.825 -0.688 608 H VAL 78 H VAL 78 12.590 -17.010 2.919 609 HA VAL 78 HA VAL 78 9.660 -17.099 2.977 610 HB VAL 78 HB VAL 78 11.302 -19.599 2.603 611 HG11 VAL 78 1HG1 VAL 78 8.878 -20.284 1.797 612 HG12 VAL 78 2HG1 VAL 78 9.333 -20.326 3.502 613 HG13 VAL 78 3HG1 VAL 78 8.412 -18.962 2.867 614 HG21 VAL 78 3HG2 VAL 78 11.621 -18.703 0.525 615 HG22 VAL 78 1HG2 VAL 78 10.045 -19.455 0.280 616 HG23 VAL 78 2HG2 VAL 78 10.155 -17.725 0.600 617 H ILE 79 H ILE 79 8.809 -18.405 4.752 618 HA ILE 79 HA ILE 79 10.720 -18.690 6.976 619 HB ILE 79 HB ILE 79 7.859 -17.836 7.358 620 HG12 ILE 79 2HG1 ILE 79 10.314 -16.078 7.155 621 HG13 ILE 79 3HG1 ILE 79 8.983 -16.130 6.004 622 HG21 ILE 79 1HG2 ILE 79 9.695 -18.806 9.130 623 HG22 ILE 79 2HG2 ILE 79 9.907 -17.064 9.296 624 HG23 ILE 79 3HG2 ILE 79 8.319 -17.787 9.549 625 HD11 ILE 79 3HD1 ILE 79 9.259 -14.541 8.329 626 HD12 ILE 79 1HD1 ILE 79 7.940 -14.567 7.159 627 HD13 ILE 79 2HD1 ILE 79 7.892 -15.629 8.566 628 H ILE 80 H ILE 80 10.528 -20.480 8.241 629 HA ILE 80 HA ILE 80 8.549 -22.473 7.371 630 HB ILE 80 HB ILE 80 11.277 -22.744 8.598 631 HG12 ILE 80 2HG1 ILE 80 10.746 -22.644 6.056 632 HG13 ILE 80 3HG1 ILE 80 11.833 -23.897 6.646 633 HG21 ILE 80 1HG2 ILE 80 10.650 -25.276 8.527 634 HG22 ILE 80 2HG2 ILE 80 10.208 -24.293 9.922 635 HG23 ILE 80 3HG2 ILE 80 9.002 -24.672 8.692 636 HD11 ILE 80 3HD1 ILE 80 8.899 -24.294 6.121 637 HD12 ILE 80 1HD1 ILE 80 10.190 -24.703 4.992 638 HD13 ILE 80 2HD1 ILE 80 10.081 -25.532 6.545 639 H MET 81 H MET 81 6.792 -22.153 8.640 640 HA MET 81 HA MET 81 7.126 -21.782 11.511 641 HB2 MET 81 2HB MET 81 4.470 -22.015 10.139 642 HB3 MET 81 3HB MET 81 4.897 -21.099 11.579 643 HG2 MET 81 2HG MET 81 6.167 -19.530 10.193 644 HG3 MET 81 3HG MET 81 5.704 -20.439 8.757 645 HE1 MET 81 3HE MET 81 3.257 -21.292 8.729 646 HE2 MET 81 1HE MET 81 2.122 -20.745 9.964 647 HE3 MET 81 2HE MET 81 2.072 -20.042 8.347 648 H THR 82 H THR 82 7.122 -23.431 12.876 649 HA THR 82 HA THR 82 5.293 -25.589 12.736 650 HB THR 82 HB THR 82 6.849 -26.305 10.930 651 HG1 THR 82 HG1 THR 82 5.729 -27.773 12.525 652 HG21 THR 82 3HG2 THR 82 9.096 -27.036 11.492 653 HG22 THR 82 1HG2 THR 82 8.865 -26.539 13.168 654 HG23 THR 82 2HG2 THR 82 8.906 -25.328 11.886 655 H ALA 83 H ALA 83 8.346 -24.344 13.965 656 HA ALA 83 HA ALA 83 9.320 -24.403 16.023 657 HB1 ALA 83 1HB ALA 83 7.602 -23.164 16.920 658 HB2 ALA 83 2HB ALA 83 6.400 -24.423 16.635 659 HB3 ALA 83 3HB ALA 83 7.565 -24.597 17.948 660 H HIS 84 H HIS 84 9.103 -25.753 18.281 661 HA HIS 84 HA HIS 84 9.493 -27.748 19.303 662 HB2 HIS 84 2HB HIS 84 7.997 -29.248 17.198 663 HB3 HIS 84 3HB HIS 84 7.987 -29.462 18.946 664 HD1 HIS 84 HD1 HIS 84 5.390 -29.240 17.209 665 HD2 HIS 84 HD2 HIS 84 7.140 -26.123 19.327 666 HE1 HIS 84 HE1 HIS 84 3.542 -27.584 17.618 667 H SER 85 H SER 85 9.854 -30.323 18.261 668 HA SER 85 HA SER 85 12.522 -30.274 17.493 669 HB2 SER 85 2HB SER 85 10.851 -32.230 18.287 670 HB3 SER 85 3HB SER 85 10.905 -32.585 16.560 671 HG SER 85 HG SER 85 13.352 -32.246 17.063 672 H ASP 86 H ASP 86 9.636 -30.033 15.573 673 HA ASP 86 HA ASP 86 10.499 -30.786 13.066 674 HB2 ASP 86 2HB ASP 86 8.728 -28.421 13.725 675 HB3 ASP 86 3HB ASP 86 8.825 -29.237 12.166 676 H LEU 87 H LEU 87 11.263 -27.895 14.875 677 HA LEU 87 HA LEU 87 12.427 -26.483 12.676 678 HB2 LEU 87 2HB LEU 87 11.786 -25.955 15.388 679 HB3 LEU 87 3HB LEU 87 13.496 -25.595 15.159 680 HG LEU 87 HG LEU 87 12.915 -24.055 13.336 681 HD11 LEU 87 1HD1 LEU 87 10.969 -24.570 12.323 682 HD12 LEU 87 2HD1 LEU 87 10.299 -23.465 13.522 683 HD13 LEU 87 3HD1 LEU 87 10.241 -25.206 13.798 684 HD21 LEU 87 3HD2 LEU 87 11.633 -23.635 16.022 685 HD22 LEU 87 1HD2 LEU 87 11.678 -22.378 14.786 686 HD23 LEU 87 2HD2 LEU 87 13.183 -23.028 15.437 687 H ASP 88 H ASP 88 13.618 -28.612 15.206 688 HA ASP 88 HA ASP 88 16.347 -28.189 14.998 689 HB2 ASP 88 2HB ASP 88 14.769 -29.913 16.404 690 HB3 ASP 88 3HB ASP 88 15.559 -31.015 15.280 691 H ALA 89 H ALA 89 14.185 -29.796 12.811 692 HA ALA 89 HA ALA 89 16.323 -31.044 11.301 693 HB1 ALA 89 1HB ALA 89 14.727 -32.353 10.459 694 HB2 ALA 89 2HB ALA 89 13.647 -31.613 11.642 695 HB3 ALA 89 3HB ALA 89 13.726 -30.975 10.000 696 H ALA 90 H ALA 90 14.384 -28.158 11.197 697 HA ALA 90 HA ALA 90 15.134 -27.511 8.475 698 HB1 ALA 90 1HB ALA 90 14.031 -25.230 9.449 699 HB2 ALA 90 2HB ALA 90 13.119 -26.553 8.722 700 HB3 ALA 90 3HB ALA 90 13.271 -26.447 10.476 701 H VAL 91 H VAL 91 16.361 -27.010 11.635 702 HA VAL 91 HA VAL 91 17.647 -24.588 11.532 703 HB VAL 91 HB VAL 91 18.568 -27.189 12.744 704 HG11 VAL 91 1HG1 VAL 91 19.987 -25.412 14.126 705 HG12 VAL 91 2HG1 VAL 91 20.612 -26.194 12.673 706 HG13 VAL 91 3HG1 VAL 91 19.940 -24.566 12.580 707 HG21 VAL 91 3HG2 VAL 91 16.535 -25.540 13.474 708 HG22 VAL 91 1HG2 VAL 91 17.421 -26.589 14.582 709 HG23 VAL 91 2HG2 VAL 91 17.867 -24.889 14.430 710 H SER 92 H SER 92 19.064 -27.705 10.524 711 HA SER 92 HA SER 92 21.222 -26.317 9.166 712 HB2 SER 92 2HB SER 92 22.082 -28.214 10.168 713 HB3 SER 92 3HB SER 92 20.627 -29.163 9.866 714 HG SER 92 HG SER 92 22.843 -28.755 8.270 715 H ALA 93 H ALA 93 18.468 -28.384 8.342 716 HA ALA 93 HA ALA 93 18.932 -28.587 5.590 717 HB1 ALA 93 1HB ALA 93 16.328 -28.625 7.108 718 HB2 ALA 93 2HB ALA 93 16.519 -29.102 5.420 719 HB3 ALA 93 3HB ALA 93 17.333 -30.013 6.691 720 H TYR 94 H TYR 94 16.558 -26.458 7.199 721 HA TYR 94 HA TYR 94 15.942 -24.916 4.967 722 HB2 TYR 94 2HB TYR 94 14.845 -25.010 7.331 723 HB3 TYR 94 3HB TYR 94 15.973 -23.715 7.718 724 HD1 TYR 94 HD2 TYR 94 14.113 -24.342 4.552 725 HD2 TYR 94 HD1 TYR 94 14.631 -21.821 7.940 726 HE1 TYR 94 HE2 TYR 94 12.566 -22.706 3.564 727 HE2 TYR 94 HE1 TYR 94 13.084 -20.178 6.962 728 HH TYR 94 HH TYR 94 12.367 -19.734 4.216 729 H GLN 95 H GLN 95 18.760 -24.927 6.913 730 HA GLN 95 HA GLN 95 19.603 -22.248 6.446 731 HB2 GLN 95 2HB GLN 95 20.677 -24.646 7.717 732 HB3 GLN 95 3HB GLN 95 21.911 -23.712 6.881 733 HG2 GLN 95 2HG GLN 95 19.994 -22.405 8.772 734 HG3 GLN 95 3HG GLN 95 21.454 -23.207 9.349 735 HE21 GLN 95 1HE2 GLN 95 20.155 -20.502 7.632 736 HE22 GLN 95 2HE2 GLN 95 21.622 -19.594 7.529 737 H GLN 96 H GLN 96 19.062 -24.564 4.267 738 HA GLN 96 HA GLN 96 21.448 -24.481 2.697 739 HB2 GLN 96 2HB GLN 96 18.675 -25.524 2.304 740 HB3 GLN 96 3HB GLN 96 19.721 -25.342 0.902 741 HG2 GLN 96 2HG GLN 96 21.191 -26.963 1.616 742 HG3 GLN 96 3HG GLN 96 20.719 -26.793 3.307 743 HE21 GLN 96 1HE2 GLN 96 20.929 -29.214 1.787 744 HE22 GLN 96 2HE2 GLN 96 19.361 -29.939 1.769 745 H GLY 97 H GLY 97 20.216 -21.896 3.462 746 HA2 GLY 97 2HA GLY 97 20.629 -19.911 2.141 747 HA3 GLY 97 3HA GLY 97 20.029 -20.782 0.738 748 H ALA 98 H ALA 98 18.491 -20.799 3.896 749 HA ALA 98 HA ALA 98 16.209 -19.366 2.701 750 HB1 ALA 98 1HB ALA 98 15.871 -21.076 5.114 751 HB2 ALA 98 2HB ALA 98 14.738 -20.728 3.807 752 HB3 ALA 98 3HB ALA 98 16.069 -21.855 3.544 753 H PHE 99 H PHE 99 14.837 -18.193 4.328 754 HA PHE 99 HA PHE 99 16.560 -16.502 5.931 755 HB2 PHE 99 2HB PHE 99 14.953 -15.324 4.634 756 HB3 PHE 99 3HB PHE 99 13.643 -16.368 5.176 757 HD1 PHE 99 HD2 PHE 99 15.825 -13.569 6.065 758 HD2 PHE 99 HD1 PHE 99 12.595 -16.042 7.317 759 HE1 PHE 99 HE2 PHE 99 15.306 -11.975 7.866 760 HE2 PHE 99 HE1 PHE 99 12.071 -14.451 9.119 761 HZ PHE 99 HZ PHE 99 13.428 -12.415 9.397 762 H ASP 100 H ASP 100 16.303 -16.104 8.147 763 HA ASP 100 HA ASP 100 16.021 -18.241 9.825 764 HB2 ASP 100 2HB ASP 100 16.959 -16.010 10.444 765 HB3 ASP 100 3HB ASP 100 15.313 -15.394 10.560 766 H TYR 101 H TYR 101 14.326 -19.585 9.834 767 HA TYR 101 HA TYR 101 11.678 -18.936 9.257 768 HB2 TYR 101 2HB TYR 101 11.176 -21.107 10.535 769 HB3 TYR 101 3HB TYR 101 12.238 -21.217 9.136 770 HD1 TYR 101 HD1 TYR 101 12.762 -20.326 12.734 771 HD2 TYR 101 HD2 TYR 101 13.882 -22.796 9.455 772 HE1 TYR 101 HE1 TYR 101 14.483 -21.391 14.132 773 HE2 TYR 101 HE2 TYR 101 15.605 -23.869 10.845 774 HH TYR 101 HH TYR 101 16.816 -22.664 13.527 775 H LEU 102 H LEU 102 9.957 -19.706 11.104 776 HA LEU 102 HA LEU 102 10.525 -18.297 13.599 777 HB2 LEU 102 2HB LEU 102 9.535 -16.494 12.607 778 HB3 LEU 102 3HB LEU 102 8.545 -17.488 11.540 779 HG LEU 102 HG LEU 102 7.181 -18.067 13.616 780 HD11 LEU 102 1HD1 LEU 102 7.539 -15.735 15.069 781 HD12 LEU 102 2HD1 LEU 102 9.176 -16.314 14.764 782 HD13 LEU 102 3HD1 LEU 102 8.003 -17.365 15.558 783 HD21 LEU 102 3HD2 LEU 102 5.929 -16.726 12.314 784 HD22 LEU 102 1HD2 LEU 102 7.240 -15.574 12.056 785 HD23 LEU 102 2HD2 LEU 102 6.293 -15.513 13.543 786 HA PRO 103 HA PRO 103 8.416 -22.039 14.864 787 HB2 PRO 103 2HB PRO 103 8.878 -21.693 17.517 788 HB3 PRO 103 3HB PRO 103 10.105 -22.303 16.400 789 HG2 PRO 103 2HG PRO 103 9.734 -19.535 17.478 790 HG3 PRO 103 3HG PRO 103 11.230 -20.465 17.273 791 HD2 PRO 103 2HD PRO 103 10.457 -18.546 15.526 792 HD3 PRO 103 3HD PRO 103 11.370 -19.983 15.023 793 H LYS 104 H LYS 104 6.361 -22.420 15.494 794 HA LYS 104 HA LYS 104 4.788 -20.116 16.410 795 HB2 LYS 104 2HB LYS 104 4.196 -22.521 14.767 796 HB3 LYS 104 3HB LYS 104 2.899 -21.911 15.787 797 HG2 LYS 104 2HG LYS 104 3.050 -19.737 14.722 798 HG3 LYS 104 3HG LYS 104 4.403 -20.297 13.736 799 HD2 LYS 104 2HD LYS 104 2.591 -20.515 12.300 800 HD3 LYS 104 3HD LYS 104 2.767 -22.143 12.959 801 HE2 LYS 104 2HE LYS 104 0.511 -21.841 13.207 802 HE3 LYS 104 3HE LYS 104 1.081 -21.238 14.763 803 HZ1 LYS 104 3HZ LYS 104 0.803 -19.031 14.079 804 HZ2 LYS 104 1HZ LYS 104 -0.589 -19.821 13.531 805 HZ3 LYS 104 2HZ LYS 104 0.653 -19.447 12.447 806 HA PRO 105 HA PRO 105 2.605 -19.928 17.123 807 HB2 PRO 105 2HB PRO 105 2.026 -18.542 19.384 808 HB3 PRO 105 3HB PRO 105 1.111 -19.964 18.868 809 HG2 PRO 105 2HG PRO 105 3.290 -19.753 20.910 810 HG3 PRO 105 3HG PRO 105 1.763 -20.651 20.991 811 HD2 PRO 105 2HD PRO 105 4.125 -21.842 20.413 812 HD3 PRO 105 3HD PRO 105 2.582 -22.404 19.738 813 H PHE 106 H PHE 106 2.731 -17.435 17.457 814 HA PHE 106 HA PHE 106 5.290 -16.463 18.382 815 HB2 PHE 106 2HB PHE 106 5.903 -15.477 16.186 816 HB3 PHE 106 3HB PHE 106 5.922 -17.237 16.173 817 HD1 PHE 106 HD1 PHE 106 3.713 -14.353 15.363 818 HD2 PHE 106 HD2 PHE 106 4.813 -18.373 14.498 819 HE1 PHE 106 HE1 PHE 106 2.195 -14.348 13.426 820 HE2 PHE 106 HE2 PHE 106 3.298 -18.374 12.560 821 HZ PHE 106 HZ PHE 106 1.987 -16.360 12.021 822 H ASP 107 H ASP 107 5.459 -14.092 18.188 823 HA ASP 107 HA ASP 107 2.877 -12.879 18.710 824 HB2 ASP 107 2HB ASP 107 5.530 -11.452 18.750 825 HB3 ASP 107 3HB ASP 107 4.064 -11.066 19.647 826 H ILE 108 H ILE 108 1.714 -12.100 17.089 827 HA ILE 108 HA ILE 108 2.443 -11.735 14.482 828 HB ILE 108 HB ILE 108 0.345 -10.347 16.124 829 HG12 ILE 108 2HG1 ILE 108 -0.154 -12.079 13.738 830 HG13 ILE 108 3HG1 ILE 108 0.352 -12.840 15.242 831 HG21 ILE 108 1HG2 ILE 108 1.006 -9.901 13.224 832 HG22 ILE 108 2HG2 ILE 108 -0.573 -9.534 13.917 833 HG23 ILE 108 3HG2 ILE 108 0.864 -8.700 14.507 834 HD11 ILE 108 3HD1 ILE 108 -1.731 -12.774 15.963 835 HD12 ILE 108 1HD1 ILE 108 -1.718 -11.014 15.857 836 HD13 ILE 108 2HD1 ILE 108 -2.230 -11.977 14.471 837 H ASP 109 H ASP 109 2.866 -9.499 17.154 838 HA ASP 109 HA ASP 109 3.488 -7.179 15.734 839 HB2 ASP 109 2HB ASP 109 4.441 -8.169 18.424 840 HB3 ASP 109 3HB ASP 109 4.814 -6.564 17.801 841 H GLU 110 H GLU 110 5.563 -9.859 16.761 842 HA GLU 110 HA GLU 110 7.924 -8.653 15.624 843 HB2 GLU 110 2HB GLU 110 7.505 -10.525 17.582 844 HB3 GLU 110 3HB GLU 110 8.022 -11.524 16.231 845 HG2 GLU 110 2HG GLU 110 9.700 -9.195 16.510 846 HG3 GLU 110 3HG GLU 110 9.638 -10.128 18.004 847 H ALA 111 H ALA 111 5.474 -10.912 14.643 848 HA ALA 111 HA ALA 111 6.884 -12.106 12.489 849 HB1 ALA 111 1HB ALA 111 4.592 -12.708 13.720 850 HB2 ALA 111 2HB ALA 111 3.941 -11.870 12.311 851 HB3 ALA 111 3HB ALA 111 4.984 -13.276 12.097 852 H VAL 112 H VAL 112 4.394 -9.551 12.550 853 HA VAL 112 HA VAL 112 4.313 -8.943 9.864 854 HB VAL 112 HB VAL 112 3.972 -7.178 12.278 855 HG11 VAL 112 1HG1 VAL 112 2.860 -5.610 10.548 856 HG12 VAL 112 2HG1 VAL 112 4.616 -5.578 10.723 857 HG13 VAL 112 3HG1 VAL 112 3.879 -6.446 9.376 858 HG21 VAL 112 3HG2 VAL 112 2.303 -8.961 11.795 859 HG22 VAL 112 1HG2 VAL 112 1.632 -7.330 11.762 860 HG23 VAL 112 2HG2 VAL 112 1.973 -8.175 10.252 861 H ALA 113 H ALA 113 6.668 -7.940 12.276 862 HA ALA 113 HA ALA 113 8.035 -6.175 10.433 863 HB1 ALA 113 1HB ALA 113 8.099 -5.403 12.636 864 HB2 ALA 113 2HB ALA 113 8.515 -6.992 13.279 865 HB3 ALA 113 3HB ALA 113 9.710 -6.069 12.368 866 H LEU 114 H LEU 114 8.241 -9.467 11.489 867 HA LEU 114 HA LEU 114 10.935 -9.989 10.853 868 HB2 LEU 114 2HB LEU 114 9.702 -11.529 12.204 869 HB3 LEU 114 3HB LEU 114 8.512 -11.775 10.927 870 HG LEU 114 HG LEU 114 10.474 -12.745 9.572 871 HD11 LEU 114 1HD1 LEU 114 12.232 -13.763 10.973 872 HD12 LEU 114 2HD1 LEU 114 11.616 -12.865 12.359 873 HD13 LEU 114 3HD1 LEU 114 12.288 -12.000 10.977 874 HD21 LEU 114 3HD2 LEU 114 8.763 -14.204 10.228 875 HD22 LEU 114 1HD2 LEU 114 9.176 -14.063 11.937 876 HD23 LEU 114 2HD2 LEU 114 10.239 -14.949 10.843 877 H VAL 115 H VAL 115 8.036 -9.825 8.910 878 HA VAL 115 HA VAL 115 9.293 -10.985 6.579 879 HB VAL 115 HB VAL 115 6.955 -11.395 6.789 880 HG11 VAL 115 1HG1 VAL 115 6.249 -9.655 8.241 881 HG12 VAL 115 2HG1 VAL 115 6.685 -8.409 7.069 882 HG13 VAL 115 3HG1 VAL 115 5.320 -9.481 6.752 883 HG21 VAL 115 3HG2 VAL 115 7.329 -9.278 4.671 884 HG22 VAL 115 1HG2 VAL 115 7.795 -10.972 4.512 885 HG23 VAL 115 2HG2 VAL 115 6.095 -10.538 4.690 886 H GLU 116 H GLU 116 8.525 -7.787 7.809 887 HA GLU 116 HA GLU 116 8.864 -6.251 5.530 888 HB2 GLU 116 2HB GLU 116 8.265 -5.622 8.023 889 HB3 GLU 116 3HB GLU 116 9.985 -5.273 8.121 890 HG2 GLU 116 2HG GLU 116 9.726 -3.759 6.167 891 HG3 GLU 116 3HG GLU 116 7.986 -4.025 6.254 892 H ARG 117 H ARG 117 11.310 -7.487 7.769 893 HA ARG 117 HA ARG 117 13.511 -6.188 6.543 894 HB2 ARG 117 2HB ARG 117 14.885 -7.481 7.962 895 HB3 ARG 117 3HB ARG 117 13.411 -7.198 8.878 896 HG2 ARG 117 2HG ARG 117 12.812 -9.542 7.664 897 HG3 ARG 117 3HG ARG 117 14.558 -9.700 7.868 898 HD2 ARG 117 2HD ARG 117 13.023 -8.693 10.189 899 HD3 ARG 117 3HD ARG 117 12.796 -10.389 9.760 900 HE ARG 117 HE ARG 117 15.534 -9.900 9.808 901 HH11 ARG 117 1HH1 ARG 117 12.847 -9.912 12.022 902 HH12 ARG 117 2HH1 ARG 117 13.812 -10.342 13.395 903 HH21 ARG 117 1HH2 ARG 117 16.815 -10.467 11.608 904 HH22 ARG 117 2HH2 ARG 117 16.069 -10.657 13.159 905 H ALA 118 H ALA 118 11.649 -8.916 5.676 906 HA ALA 118 HA ALA 118 13.711 -10.179 4.089 907 HB1 ALA 118 1HB ALA 118 11.098 -10.887 5.062 908 HB2 ALA 118 2HB ALA 118 11.233 -11.226 3.337 909 HB3 ALA 118 3HB ALA 118 12.393 -11.926 4.466 910 H ILE 119 H ILE 119 10.806 -8.235 3.528 911 HA ILE 119 HA ILE 119 11.190 -8.266 0.660 912 HB ILE 119 HB ILE 119 9.242 -6.665 2.323 913 HG12 ILE 119 2HG1 ILE 119 8.817 -9.222 0.762 914 HG13 ILE 119 3HG1 ILE 119 8.958 -9.124 2.514 915 HG21 ILE 119 1HG2 ILE 119 8.197 -7.013 -0.213 916 HG22 ILE 119 2HG2 ILE 119 8.911 -5.535 0.431 917 HG23 ILE 119 3HG2 ILE 119 9.900 -6.658 -0.501 918 HD11 ILE 119 3HD1 ILE 119 6.675 -9.236 2.139 919 HD12 ILE 119 1HD1 ILE 119 6.968 -7.513 2.375 920 HD13 ILE 119 2HD1 ILE 119 6.750 -8.156 0.747 921 H SER 120 H SER 120 12.157 -6.337 3.327 922 HA SER 120 HA SER 120 12.666 -3.972 1.719 923 HB2 SER 120 2HB SER 120 13.213 -4.587 4.631 924 HB3 SER 120 3HB SER 120 13.569 -3.042 3.860 925 HG SER 120 HG SER 120 10.985 -4.108 3.651 926 H HIS 121 H HIS 121 14.133 -6.827 1.889 927 HA HIS 121 HA HIS 121 16.875 -5.917 2.172 928 HB2 HIS 121 2HB HIS 121 16.027 -8.170 2.987 929 HB3 HIS 121 3HB HIS 121 15.945 -8.652 1.295 930 HD1 HIS 121 HD1 HIS 121 18.201 -8.986 0.048 931 HD2 HIS 121 HD2 HIS 121 18.586 -8.070 4.082 932 HE1 HIS 121 HE1 HIS 121 20.593 -9.499 0.629 933 H TYR 122 H TYR 122 14.721 -7.097 -0.373 934 HA TYR 122 HA TYR 122 16.751 -6.330 -2.365 935 HB2 TYR 122 2HB TYR 122 15.870 -7.942 -3.845 936 HB3 TYR 122 3HB TYR 122 15.907 -8.744 -2.279 937 HD1 TYR 122 HD2 TYR 122 13.697 -8.666 -0.903 938 HD2 TYR 122 HD1 TYR 122 13.911 -7.947 -5.091 939 HE1 TYR 122 HE2 TYR 122 11.301 -9.183 -1.108 940 HE2 TYR 122 HE1 TYR 122 11.515 -8.461 -5.308 941 HH TYR 122 HH TYR 122 9.622 -8.909 -4.220 942 H GLN 123 H GLN 123 14.724 -4.628 -0.961 943 HA GLN 123 HA GLN 123 13.742 -3.290 -3.339 944 HB2 GLN 123 2HB GLN 123 12.032 -4.979 -1.886 945 HB3 GLN 123 3HB GLN 123 11.594 -3.343 -1.412 946 HG2 GLN 123 2HG GLN 123 11.730 -3.004 -4.061 947 HG3 GLN 123 3HG GLN 123 11.298 -4.712 -4.007 948 HE21 GLN 123 1HE2 GLN 123 9.601 -4.972 -2.011 949 HE22 GLN 123 2HE2 GLN 123 8.203 -3.979 -2.219 950 H GLU 124 H GLU 124 13.881 -3.349 0.200 951 HA GLU 124 HA GLU 124 14.205 -1.712 1.746 952 HB2 GLU 124 2HB GLU 124 15.888 -1.061 -0.511 953 HB3 GLU 124 3HB GLU 124 15.361 0.402 0.309 954 HG2 GLU 124 2HG GLU 124 16.147 -0.639 2.453 955 HG3 GLU 124 3HG GLU 124 16.868 -1.919 1.479 Start of MODEL 12 1 H1 MET 1 H MET 1 2.942 -0.079 3.241 2 HA MET 1 HA MET 1 2.078 0.972 1.381 3 HB2 MET 1 2HB MET 1 3.806 1.982 0.048 4 HB3 MET 1 3HB MET 1 4.380 1.878 1.708 5 HG2 MET 1 2HG MET 1 6.162 0.751 1.057 6 HG3 MET 1 3HG MET 1 5.148 -0.486 0.320 7 HE1 MET 1 3HE MET 1 8.166 1.678 -0.824 8 HE2 MET 1 1HE MET 1 7.842 -0.023 -0.490 9 HE3 MET 1 2HE MET 1 8.038 0.526 -2.154 10 H GLN 2 H GLN 2 2.043 -1.988 1.232 11 HA GLN 2 HA GLN 2 1.643 -3.661 -0.262 12 HB2 GLN 2 2HB GLN 2 -0.135 -1.941 -0.824 13 HB3 GLN 2 3HB GLN 2 0.890 -1.444 -2.164 14 HG2 GLN 2 2HG GLN 2 0.770 -3.715 -3.082 15 HG3 GLN 2 3HG GLN 2 -0.296 -4.180 -1.756 16 HE21 GLN 2 1HE2 GLN 2 -2.120 -4.606 -2.860 17 HE22 GLN 2 2HE2 GLN 2 -2.986 -3.448 -3.805 18 H ARG 3 H ARG 3 4.128 -3.714 -0.233 19 HA ARG 3 HA ARG 3 5.065 -3.495 -3.015 20 HB2 ARG 3 2HB ARG 3 7.084 -2.568 -2.401 21 HB3 ARG 3 3HB ARG 3 6.009 -1.822 -1.226 22 HG2 ARG 3 2HG ARG 3 7.791 -4.204 -0.762 23 HG3 ARG 3 3HG ARG 3 8.034 -2.567 -0.149 24 HD2 ARG 3 2HD ARG 3 5.585 -3.001 0.808 25 HD3 ARG 3 3HD ARG 3 6.141 -4.673 0.731 26 HE ARG 3 HE ARG 3 8.174 -3.447 1.992 27 HH11 ARG 3 1HH1 ARG 3 4.731 -3.419 2.509 28 HH12 ARG 3 2HH1 ARG 3 4.859 -3.171 4.219 29 HH21 ARG 3 1HH2 ARG 3 8.355 -3.120 4.242 30 HH22 ARG 3 2HH2 ARG 3 6.920 -3.000 5.204 31 H GLY 4 H GLY 4 4.274 -5.552 -0.603 32 HA2 GLY 4 2HA GLY 4 5.778 -7.717 -1.812 33 HA3 GLY 4 3HA GLY 4 6.178 -7.391 -0.133 34 H ILE 5 H ILE 5 4.126 -9.047 -2.224 35 HA ILE 5 HA ILE 5 1.900 -9.302 -0.407 36 HB ILE 5 HB ILE 5 2.554 -10.748 -2.974 37 HG12 ILE 5 2HG1 ILE 5 0.295 -8.822 -2.499 38 HG13 ILE 5 3HG1 ILE 5 1.903 -8.239 -2.915 39 HG21 ILE 5 1HG2 ILE 5 1.241 -12.225 -1.615 40 HG22 ILE 5 2HG2 ILE 5 0.116 -10.929 -1.213 41 HG23 ILE 5 3HG2 ILE 5 0.199 -11.544 -2.864 42 HD11 ILE 5 3HD1 ILE 5 1.279 -8.451 -5.031 43 HD12 ILE 5 1HD1 ILE 5 1.414 -10.193 -4.796 44 HD13 ILE 5 2HD1 ILE 5 -0.146 -9.395 -4.597 45 H VAL 6 H VAL 6 1.388 -11.035 0.873 46 HA VAL 6 HA VAL 6 3.414 -13.166 1.088 47 HB VAL 6 HB VAL 6 1.842 -12.152 3.445 48 HG11 VAL 6 1HG1 VAL 6 3.518 -13.275 4.745 49 HG12 VAL 6 2HG1 VAL 6 2.905 -14.401 3.532 50 HG13 VAL 6 3HG1 VAL 6 4.470 -13.621 3.301 51 HG21 VAL 6 3HG2 VAL 6 3.049 -10.234 2.704 52 HG22 VAL 6 1HG2 VAL 6 3.930 -10.913 4.073 53 HG23 VAL 6 2HG2 VAL 6 4.509 -11.185 2.429 54 H TRP 7 H TRP 7 2.652 -15.165 0.882 55 HA TRP 7 HA TRP 7 -0.257 -15.562 0.984 56 HB2 TRP 7 2HB TRP 7 1.932 -17.140 -0.377 57 HB3 TRP 7 3HB TRP 7 0.256 -17.676 -0.289 58 HD1 TRP 7 HD1 TRP 7 -0.193 -14.172 -0.715 59 HE1 TRP 7 HE1 TRP 7 -0.447 -13.498 -3.186 60 HE3 TRP 7 HE3 TRP 7 1.608 -18.426 -2.905 61 HZ2 TRP 7 HZ2 TRP 7 0.050 -14.621 -5.728 62 HZ3 TRP 7 HZ3 TRP 7 1.684 -18.546 -5.362 63 HH2 TRP 7 HH2 TRP 7 0.920 -16.682 -6.742 64 H VAL 8 H VAL 8 -1.181 -17.035 2.326 65 HA VAL 8 HA VAL 8 0.612 -18.356 4.252 66 HB VAL 8 HB VAL 8 -2.308 -17.694 4.640 67 HG11 VAL 8 1HG1 VAL 8 -1.976 -19.298 6.207 68 HG12 VAL 8 2HG1 VAL 8 -0.231 -19.039 6.263 69 HG13 VAL 8 3HG1 VAL 8 -1.316 -17.934 7.109 70 HG21 VAL 8 3HG2 VAL 8 0.176 -16.174 5.385 71 HG22 VAL 8 1HG2 VAL 8 -1.239 -15.603 4.500 72 HG23 VAL 8 2HG2 VAL 8 -1.357 -15.944 6.226 73 H VAL 9 H VAL 9 0.504 -20.516 4.565 74 HA VAL 9 HA VAL 9 -1.678 -22.023 3.314 75 HB VAL 9 HB VAL 9 0.060 -22.098 1.652 76 HG11 VAL 9 1HG1 VAL 9 2.296 -22.549 2.031 77 HG12 VAL 9 2HG1 VAL 9 1.864 -21.601 3.456 78 HG13 VAL 9 3HG1 VAL 9 1.979 -23.358 3.566 79 HG21 VAL 9 3HG2 VAL 9 -1.181 -24.157 1.993 80 HG22 VAL 9 1HG2 VAL 9 0.489 -24.518 1.556 81 HG23 VAL 9 2HG2 VAL 9 -0.036 -24.666 3.233 82 H ASP 10 H ASP 10 -2.553 -22.750 5.190 83 HA ASP 10 HA ASP 10 -0.916 -24.607 6.754 84 HB2 ASP 10 2HB ASP 10 -2.813 -22.967 8.328 85 HB3 ASP 10 3HB ASP 10 -1.225 -23.589 8.767 86 H ASP 11 H ASP 11 -2.189 -26.124 8.021 87 HA ASP 11 HA ASP 11 -4.622 -26.858 6.610 88 HB2 ASP 11 2HB ASP 11 -2.544 -28.329 7.667 89 HB3 ASP 11 3HB ASP 11 -3.821 -28.555 8.859 90 H ASP 12 H ASP 12 -3.908 -24.941 9.183 91 HA ASP 12 HA ASP 12 -6.443 -25.568 10.548 92 HB2 ASP 12 2HB ASP 12 -3.780 -24.753 11.554 93 HB3 ASP 12 3HB ASP 12 -5.165 -24.001 12.341 94 H SER 13 H SER 13 -7.861 -23.902 11.041 95 HA SER 13 HA SER 13 -7.785 -21.664 9.254 96 HB2 SER 13 2HB SER 13 -9.798 -23.061 10.494 97 HB3 SER 13 3HB SER 13 -9.767 -21.560 11.420 98 HG SER 13 HG SER 13 -11.086 -21.719 9.368 99 H SER 14 H SER 14 -7.678 -22.023 12.791 100 HA SER 14 HA SER 14 -7.385 -19.289 13.377 101 HB2 SER 14 2HB SER 14 -7.277 -19.959 15.546 102 HB3 SER 14 3HB SER 14 -7.762 -21.518 14.879 103 HG SER 14 HG SER 14 -5.694 -21.166 16.291 104 H ILE 15 H ILE 15 -5.181 -21.594 12.128 105 HA ILE 15 HA ILE 15 -2.791 -20.233 12.991 106 HB ILE 15 HB ILE 15 -3.205 -22.448 10.982 107 HG12 ILE 15 2HG1 ILE 15 -3.659 -23.098 13.295 108 HG13 ILE 15 3HG1 ILE 15 -2.174 -23.853 12.726 109 HG21 ILE 15 1HG2 ILE 15 -1.174 -21.970 10.213 110 HG22 ILE 15 2HG2 ILE 15 -0.919 -20.752 11.461 111 HG23 ILE 15 3HG2 ILE 15 -0.544 -22.443 11.791 112 HD11 ILE 15 3HD1 ILE 15 -0.900 -22.065 13.885 113 HD12 ILE 15 1HD1 ILE 15 -2.422 -21.483 14.558 114 HD13 ILE 15 2HD1 ILE 15 -1.840 -23.098 14.961 115 H ARG 16 H ARG 16 -4.751 -20.408 10.068 116 HA ARG 16 HA ARG 16 -2.927 -18.781 8.537 117 HB2 ARG 16 2HB ARG 16 -4.729 -18.842 6.818 118 HB3 ARG 16 3HB ARG 16 -4.213 -20.436 7.354 119 HG2 ARG 16 2HG ARG 16 -6.170 -20.626 8.769 120 HG3 ARG 16 3HG ARG 16 -6.675 -18.996 8.318 121 HD2 ARG 16 2HD ARG 16 -7.950 -20.489 6.992 122 HD3 ARG 16 3HD ARG 16 -6.724 -19.795 5.930 123 HE ARG 16 HE ARG 16 -5.560 -22.075 6.780 124 HH11 ARG 16 1HH1 ARG 16 -8.674 -21.377 5.389 125 HH12 ARG 16 2HH1 ARG 16 -8.823 -22.923 4.623 126 HH21 ARG 16 1HH2 ARG 16 -5.745 -24.114 5.776 127 HH22 ARG 16 2HH2 ARG 16 -7.157 -24.480 4.844 128 H TRP 17 H TRP 17 -5.861 -18.324 10.392 129 HA TRP 17 HA TRP 17 -6.617 -15.797 9.481 130 HB2 TRP 17 2HB TRP 17 -8.163 -16.899 10.867 131 HB3 TRP 17 3HB TRP 17 -6.959 -17.209 12.115 132 HD1 TRP 17 HD1 TRP 17 -9.059 -14.307 10.678 133 HE1 TRP 17 HE1 TRP 17 -9.321 -12.521 12.512 134 HE3 TRP 17 HE3 TRP 17 -6.011 -16.348 14.239 135 HZ2 TRP 17 HZ2 TRP 17 -8.361 -12.039 15.122 136 HZ3 TRP 17 HZ3 TRP 17 -5.737 -15.161 16.377 137 HH2 TRP 17 HH2 TRP 17 -6.888 -13.051 16.807 138 H VAL 18 H VAL 18 -4.586 -16.619 12.295 139 HA VAL 18 HA VAL 18 -3.952 -14.078 13.148 140 HB VAL 18 HB VAL 18 -1.719 -15.117 13.871 141 HG11 VAL 18 1HG1 VAL 18 -3.869 -14.933 15.208 142 HG12 VAL 18 2HG1 VAL 18 -4.157 -16.622 14.783 143 HG13 VAL 18 3HG1 VAL 18 -2.729 -16.178 15.718 144 HG21 VAL 18 3HG2 VAL 18 -1.688 -16.858 12.120 145 HG22 VAL 18 1HG2 VAL 18 -1.549 -17.526 13.746 146 HG23 VAL 18 2HG2 VAL 18 -3.084 -17.620 12.882 147 H LEU 19 H LEU 19 -2.442 -15.966 10.568 148 HA LEU 19 HA LEU 19 -0.442 -13.978 10.021 149 HB2 LEU 19 2HB LEU 19 -1.311 -16.525 8.716 150 HB3 LEU 19 3HB LEU 19 -0.222 -15.424 7.875 151 HG LEU 19 HG LEU 19 0.389 -16.534 10.604 152 HD11 LEU 19 1HD1 LEU 19 0.435 -18.527 9.542 153 HD12 LEU 19 2HD1 LEU 19 2.009 -17.940 9.005 154 HD13 LEU 19 3HD1 LEU 19 0.607 -17.799 7.944 155 HD21 LEU 19 3HD2 LEU 19 2.726 -16.082 9.244 156 HD22 LEU 19 1HD2 LEU 19 1.995 -14.991 10.421 157 HD23 LEU 19 2HD2 LEU 19 1.699 -14.755 8.699 158 H GLU 20 H GLU 20 -3.697 -14.542 9.066 159 HA GLU 20 HA GLU 20 -3.548 -13.005 6.631 160 HB2 GLU 20 2HB GLU 20 -5.314 -14.876 7.627 161 HB3 GLU 20 3HB GLU 20 -6.209 -13.372 7.785 162 HG2 GLU 20 2HG GLU 20 -4.862 -14.126 5.220 163 HG3 GLU 20 3HG GLU 20 -6.472 -14.713 5.628 164 H ARG 21 H ARG 21 -5.257 -12.548 9.731 165 HA ARG 21 HA ARG 21 -6.120 -9.952 9.320 166 HB2 ARG 21 2HB ARG 21 -6.351 -9.775 11.719 167 HB3 ARG 21 3HB ARG 21 -6.801 -11.399 11.217 168 HG2 ARG 21 2HG ARG 21 -4.832 -12.333 12.082 169 HG3 ARG 21 3HG ARG 21 -4.050 -10.757 12.223 170 HD2 ARG 21 2HD ARG 21 -6.477 -10.729 13.723 171 HD3 ARG 21 3HD ARG 21 -5.545 -12.157 14.172 172 HE ARG 21 HE ARG 21 -3.906 -10.788 15.067 173 HH11 ARG 21 1HH1 ARG 21 -6.312 -8.897 13.407 174 HH12 ARG 21 2HH1 ARG 21 -5.767 -7.389 14.061 175 HH21 ARG 21 1HH2 ARG 21 -3.178 -8.808 15.935 176 HH22 ARG 21 2HH2 ARG 21 -3.983 -7.339 15.498 177 H ALA 22 H ALA 22 -2.946 -11.124 10.086 178 HA ALA 22 HA ALA 22 -1.745 -8.888 11.196 179 HB1 ALA 22 1HB ALA 22 0.245 -9.899 9.620 180 HB2 ALA 22 2HB ALA 22 -0.192 -10.500 11.221 181 HB3 ALA 22 3HB ALA 22 -0.842 -11.279 9.778 182 H LEU 23 H LEU 23 -1.680 -9.785 7.739 183 HA LEU 23 HA LEU 23 -0.861 -7.105 7.017 184 HB2 LEU 23 2HB LEU 23 -1.628 -9.302 5.121 185 HB3 LEU 23 3HB LEU 23 -0.564 -7.928 4.829 186 HG LEU 23 HG LEU 23 0.014 -10.416 6.422 187 HD11 LEU 23 1HD1 LEU 23 1.783 -10.732 4.839 188 HD12 LEU 23 2HD1 LEU 23 1.463 -9.166 4.095 189 HD13 LEU 23 3HD1 LEU 23 0.282 -10.467 3.951 190 HD21 LEU 23 3HD2 LEU 23 1.210 -9.093 7.781 191 HD22 LEU 23 1HD2 LEU 23 1.137 -7.722 6.674 192 HD23 LEU 23 2HD2 LEU 23 2.336 -8.992 6.427 193 H ALA 24 H ALA 24 -3.780 -8.883 7.292 194 HA ALA 24 HA ALA 24 -5.443 -7.791 5.394 195 HB1 ALA 24 1HB ALA 24 -6.257 -8.271 8.253 196 HB2 ALA 24 2HB ALA 24 -7.276 -8.337 6.814 197 HB3 ALA 24 3HB ALA 24 -6.030 -9.558 7.069 198 H GLY 25 H GLY 25 -4.389 -6.372 8.453 199 HA2 GLY 25 2HA GLY 25 -6.033 -4.012 8.052 200 HA3 GLY 25 3HA GLY 25 -4.951 -4.314 9.403 201 H ALA 26 H ALA 26 -2.872 -5.038 7.233 202 HA ALA 26 HA ALA 26 -1.830 -2.329 7.015 203 HB1 ALA 26 1HB ALA 26 -0.401 -4.183 7.835 204 HB2 ALA 26 2HB ALA 26 -0.507 -4.923 6.237 205 HB3 ALA 26 3HB ALA 26 0.266 -3.350 6.430 206 H GLY 27 H GLY 27 -0.267 -2.449 4.779 207 HA2 GLY 27 2HA GLY 27 -2.303 -2.337 2.672 208 HA3 GLY 27 3HA GLY 27 -0.731 -1.552 2.631 209 H LEU 28 H LEU 28 -0.805 -4.820 3.686 210 HA LEU 28 HA LEU 28 0.373 -5.642 1.119 211 HB2 LEU 28 2HB LEU 28 0.716 -7.465 3.367 212 HB3 LEU 28 3HB LEU 28 1.905 -6.827 2.234 213 HG LEU 28 HG LEU 28 0.871 -5.303 4.621 214 HD11 LEU 28 1HD1 LEU 28 3.628 -6.246 4.695 215 HD12 LEU 28 2HD1 LEU 28 2.440 -7.548 4.740 216 HD13 LEU 28 3HD1 LEU 28 2.386 -6.265 5.948 217 HD21 LEU 28 3HD2 LEU 28 3.070 -4.066 4.164 218 HD22 LEU 28 1HD2 LEU 28 1.710 -3.759 3.084 219 HD23 LEU 28 2HD2 LEU 28 3.014 -4.832 2.575 220 H THR 29 H THR 29 -0.416 -7.367 0.014 221 HA THR 29 HA THR 29 -3.081 -8.216 0.591 222 HB THR 29 HB THR 29 -1.242 -9.484 -1.434 223 HG1 THR 29 HG1 THR 29 -2.912 -7.231 -1.901 224 HG21 THR 29 3HG2 THR 29 -3.222 -10.710 -1.354 225 HG22 THR 29 1HG2 THR 29 -3.521 -9.562 -2.658 226 HG23 THR 29 2HG2 THR 29 -4.210 -9.280 -1.059 227 H CYS 30 H CYS 30 -3.773 -10.440 0.831 228 HA CYS 30 HA CYS 30 -1.773 -12.296 1.877 229 HB2 CYS 30 2HB CYS 30 -3.596 -10.817 3.522 230 HB3 CYS 30 3HB CYS 30 -4.025 -12.522 3.585 231 HG CYS 30 HG CYS 30 -1.756 -13.419 4.702 232 H THR 31 H THR 31 -2.061 -14.216 0.976 233 HA THR 31 HA THR 31 -4.772 -14.960 0.085 234 HB THR 31 HB THR 31 -2.191 -15.882 -1.186 235 HG1 THR 31 HG1 THR 31 -3.163 -14.394 -2.916 236 HG21 THR 31 3HG2 THR 31 -4.260 -17.310 -1.404 237 HG22 THR 31 1HG2 THR 31 -3.563 -16.756 -2.926 238 HG23 THR 31 2HG2 THR 31 -5.001 -15.969 -2.275 239 H THR 32 H THR 32 -5.568 -16.483 1.372 240 HA THR 32 HA THR 32 -3.742 -18.456 2.555 241 HB THR 32 HB THR 32 -5.353 -18.860 4.244 242 HG1 THR 32 HG1 THR 32 -7.281 -18.931 3.183 243 HG21 THR 32 3HG2 THR 32 -6.006 -16.034 4.208 244 HG22 THR 32 1HG2 THR 32 -4.310 -16.321 3.821 245 HG23 THR 32 2HG2 THR 32 -4.988 -16.939 5.328 246 H PHE 33 H PHE 33 -3.749 -20.497 1.875 247 HA PHE 33 HA PHE 33 -5.942 -21.365 0.115 248 HB2 PHE 33 2HB PHE 33 -3.081 -22.332 0.282 249 HB3 PHE 33 3HB PHE 33 -4.312 -23.026 -0.768 250 HD1 PHE 33 HD1 PHE 33 -2.265 -20.038 -0.111 251 HD2 PHE 33 HD2 PHE 33 -4.933 -21.975 -2.804 252 HE1 PHE 33 HE1 PHE 33 -1.702 -18.390 -1.849 253 HE2 PHE 33 HE2 PHE 33 -4.373 -20.330 -4.547 254 HZ PHE 33 HZ PHE 33 -2.756 -18.535 -4.071 255 H GLU 34 H GLU 34 -3.648 -23.614 1.408 256 HA GLU 34 HA GLU 34 -4.846 -24.441 3.753 257 HB2 GLU 34 2HB GLU 34 -6.056 -26.518 2.831 258 HB3 GLU 34 3HB GLU 34 -6.884 -24.970 2.736 259 HG2 GLU 34 2HG GLU 34 -6.279 -24.755 0.402 260 HG3 GLU 34 3HG GLU 34 -5.363 -26.259 0.481 261 H ASN 35 H ASN 35 -3.523 -25.694 0.710 262 HA ASN 35 HA ASN 35 -1.575 -27.230 2.293 263 HB2 ASN 35 2HB ASN 35 -3.541 -28.251 0.474 264 HB3 ASN 35 3HB ASN 35 -1.938 -28.545 -0.193 265 HD21 ASN 35 1HD2 ASN 35 -3.422 -28.607 3.034 266 HD22 ASN 35 2HD2 ASN 35 -2.814 -30.166 3.467 267 H GLY 36 H GLY 36 0.504 -27.438 1.398 268 HA2 GLY 36 2HA GLY 36 1.424 -25.200 -0.052 269 HA3 GLY 36 3HA GLY 36 2.360 -26.644 0.305 270 H ASN 37 H ASN 37 0.557 -28.455 -1.059 271 HA ASN 37 HA ASN 37 1.713 -28.500 -3.585 272 HB2 ASN 37 2HB ASN 37 0.471 -30.371 -2.338 273 HB3 ASN 37 3HB ASN 37 -1.002 -29.676 -3.010 274 HD21 ASN 37 1HD2 ASN 37 2.244 -30.637 -4.077 275 HD22 ASN 37 2HD2 ASN 37 1.724 -31.389 -5.543 276 H GLU 38 H GLU 38 -1.078 -26.787 -2.431 277 HA GLU 38 HA GLU 38 -1.962 -26.116 -5.123 278 HB2 GLU 38 2HB GLU 38 -3.169 -24.803 -2.749 279 HB3 GLU 38 3HB GLU 38 -3.939 -25.439 -4.196 280 HG2 GLU 38 2HG GLU 38 -2.921 -27.020 -1.849 281 HG3 GLU 38 3HG GLU 38 -4.603 -26.744 -2.298 282 H VAL 39 H VAL 39 0.128 -24.902 -2.745 283 HA VAL 39 HA VAL 39 -0.112 -22.126 -3.578 284 HB VAL 39 HB VAL 39 1.894 -23.342 -1.676 285 HG11 VAL 39 1HG1 VAL 39 1.166 -20.555 -2.459 286 HG12 VAL 39 2HG1 VAL 39 1.744 -20.878 -0.823 287 HG13 VAL 39 3HG1 VAL 39 2.757 -21.275 -2.212 288 HG21 VAL 39 3HG2 VAL 39 -0.081 -21.837 -0.314 289 HG22 VAL 39 1HG2 VAL 39 -0.913 -22.989 -1.359 290 HG23 VAL 39 2HG2 VAL 39 0.267 -23.561 -0.179 291 H LEU 40 H LEU 40 2.189 -24.798 -3.823 292 HA LEU 40 HA LEU 40 4.369 -23.540 -4.921 293 HB2 LEU 40 2HB LEU 40 4.762 -25.753 -4.533 294 HB3 LEU 40 3HB LEU 40 3.197 -26.254 -5.171 295 HG LEU 40 HG LEU 40 4.004 -26.030 -7.438 296 HD11 LEU 40 1HD1 LEU 40 6.768 -25.699 -7.160 297 HD12 LEU 40 2HD1 LEU 40 6.032 -24.429 -6.183 298 HD13 LEU 40 3HD1 LEU 40 5.618 -24.579 -7.891 299 HD21 LEU 40 3HD2 LEU 40 6.308 -27.493 -6.446 300 HD22 LEU 40 1HD2 LEU 40 4.921 -28.059 -7.377 301 HD23 LEU 40 2HD2 LEU 40 4.815 -27.945 -5.620 302 H ALA 41 H ALA 41 1.462 -24.684 -6.595 303 HA ALA 41 HA ALA 41 2.365 -23.858 -9.181 304 HB1 ALA 41 1HB ALA 41 -0.334 -24.080 -9.443 305 HB2 ALA 41 2HB ALA 41 0.806 -25.419 -9.578 306 HB3 ALA 41 3HB ALA 41 -0.026 -25.119 -8.052 307 H ALA 42 H ALA 42 0.620 -22.364 -6.569 308 HA ALA 42 HA ALA 42 -0.661 -20.287 -7.930 309 HB1 ALA 42 1HB ALA 42 -1.047 -20.883 -5.559 310 HB2 ALA 42 2HB ALA 42 0.512 -20.161 -5.156 311 HB3 ALA 42 3HB ALA 42 -0.783 -19.157 -5.807 312 H LEU 43 H LEU 43 2.660 -20.618 -6.828 313 HA LEU 43 HA LEU 43 3.532 -17.994 -7.055 314 HB2 LEU 43 2HB LEU 43 5.208 -20.329 -7.911 315 HB3 LEU 43 3HB LEU 43 5.722 -18.834 -7.132 316 HG LEU 43 HG LEU 43 4.198 -21.096 -5.840 317 HD11 LEU 43 1HD1 LEU 43 7.043 -20.140 -5.596 318 HD12 LEU 43 2HD1 LEU 43 6.479 -21.712 -6.162 319 HD13 LEU 43 3HD1 LEU 43 6.278 -21.261 -4.469 320 HD21 LEU 43 3HD2 LEU 43 3.629 -18.764 -5.047 321 HD22 LEU 43 1HD2 LEU 43 5.304 -18.635 -4.509 322 HD23 LEU 43 2HD2 LEU 43 4.249 -19.870 -3.819 323 H ALA 44 H ALA 44 3.050 -20.432 -9.542 324 HA ALA 44 HA ALA 44 4.347 -19.152 -11.668 325 HB1 ALA 44 1HB ALA 44 3.496 -20.796 -12.972 326 HB2 ALA 44 2HB ALA 44 3.142 -21.524 -11.405 327 HB3 ALA 44 3HB ALA 44 1.878 -20.660 -12.281 328 H SER 45 H SER 45 1.511 -18.298 -9.994 329 HA SER 45 HA SER 45 0.131 -16.976 -12.106 330 HB2 SER 45 2HB SER 45 -1.020 -17.709 -10.059 331 HB3 SER 45 3HB SER 45 -0.068 -16.566 -9.111 332 HG SER 45 HG SER 45 -2.239 -15.869 -9.795 333 H LYS 46 H LYS 46 1.478 -15.427 -9.204 334 HA LYS 46 HA LYS 46 2.615 -13.334 -10.934 335 HB2 LYS 46 2HB LYS 46 2.042 -11.769 -8.954 336 HB3 LYS 46 3HB LYS 46 0.758 -12.229 -10.064 337 HG2 LYS 46 2HG LYS 46 -0.402 -13.258 -8.465 338 HG3 LYS 46 3HG LYS 46 1.031 -14.064 -7.821 339 HD2 LYS 46 2HD LYS 46 1.284 -12.540 -6.200 340 HD3 LYS 46 3HD LYS 46 1.006 -11.194 -7.307 341 HE2 LYS 46 2HE LYS 46 -1.157 -12.927 -6.118 342 HE3 LYS 46 3HE LYS 46 -0.682 -11.346 -5.501 343 HZ1 LYS 46 3HZ LYS 46 -1.683 -10.276 -7.205 344 HZ2 LYS 46 1HZ LYS 46 -2.648 -11.666 -7.224 345 HZ3 LYS 46 2HZ LYS 46 -1.377 -11.504 -8.328 346 H THR 47 H THR 47 3.178 -15.658 -8.635 347 HA THR 47 HA THR 47 4.971 -16.213 -7.348 348 HB THR 47 HB THR 47 6.800 -14.120 -8.249 349 HG1 THR 47 HG1 THR 47 6.142 -14.099 -10.258 350 HG21 THR 47 3HG2 THR 47 7.048 -16.630 -7.304 351 HG22 THR 47 1HG2 THR 47 8.286 -15.833 -8.274 352 HG23 THR 47 2HG2 THR 47 7.150 -16.947 -9.035 353 HA PRO 48 HA PRO 48 4.189 -13.124 -4.157 354 HB2 PRO 48 2HB PRO 48 4.685 -14.814 -2.091 355 HB3 PRO 48 3HB PRO 48 3.147 -14.786 -2.962 356 HG2 PRO 48 2HG PRO 48 5.468 -16.650 -3.277 357 HG3 PRO 48 3HG PRO 48 3.734 -17.018 -3.248 358 HD2 PRO 48 2HD PRO 48 5.150 -16.857 -5.550 359 HD3 PRO 48 3HD PRO 48 3.438 -16.401 -5.449 360 H ASP 49 H ASP 49 5.488 -12.259 -2.375 361 HA ASP 49 HA ASP 49 8.331 -12.351 -3.034 362 HB2 ASP 49 2HB ASP 49 6.691 -10.461 -1.342 363 HB3 ASP 49 3HB ASP 49 8.445 -10.365 -1.475 364 H VAL 50 H VAL 50 6.189 -13.695 -0.813 365 HA VAL 50 HA VAL 50 8.159 -15.120 0.574 366 HB VAL 50 HB VAL 50 8.723 -13.014 1.645 367 HG11 VAL 50 1HG1 VAL 50 6.232 -12.700 3.136 368 HG12 VAL 50 2HG1 VAL 50 7.241 -11.488 2.342 369 HG13 VAL 50 3HG1 VAL 50 6.061 -12.407 1.406 370 HG21 VAL 50 3HG2 VAL 50 7.236 -14.330 3.835 371 HG22 VAL 50 1HG2 VAL 50 8.340 -15.346 2.908 372 HG23 VAL 50 2HG2 VAL 50 8.943 -13.900 3.719 373 H LEU 51 H LEU 51 7.287 -16.679 1.947 374 HA LEU 51 HA LEU 51 4.342 -16.753 2.029 375 HB2 LEU 51 2HB LEU 51 6.187 -18.597 0.950 376 HB3 LEU 51 3HB LEU 51 5.504 -19.340 2.396 377 HG LEU 51 HG LEU 51 3.504 -18.145 0.622 378 HD11 LEU 51 1HD1 LEU 51 3.982 -20.549 -0.666 379 HD12 LEU 51 2HD1 LEU 51 5.579 -19.818 -0.508 380 HD13 LEU 51 3HD1 LEU 51 4.280 -18.933 -1.307 381 HD21 LEU 51 3HD2 LEU 51 3.911 -20.706 2.125 382 HD22 LEU 51 1HD2 LEU 51 2.605 -20.536 0.952 383 HD23 LEU 51 2HD2 LEU 51 2.678 -19.465 2.351 384 H LEU 52 H LEU 52 3.748 -18.616 3.767 385 HA LEU 52 HA LEU 52 5.335 -18.256 6.191 386 HB2 LEU 52 2HB LEU 52 2.398 -17.604 6.001 387 HB3 LEU 52 3HB LEU 52 3.321 -17.693 7.500 388 HG LEU 52 HG LEU 52 4.280 -15.808 5.418 389 HD11 LEU 52 1HD1 LEU 52 2.652 -14.121 6.550 390 HD12 LEU 52 2HD1 LEU 52 1.683 -15.559 6.868 391 HD13 LEU 52 3HD1 LEU 52 2.092 -15.121 5.209 392 HD21 LEU 52 3HD2 LEU 52 5.555 -15.265 7.153 393 HD22 LEU 52 1HD2 LEU 52 4.625 -16.313 8.226 394 HD23 LEU 52 2HD2 LEU 52 4.113 -14.646 7.960 395 H SER 53 H SER 53 5.458 -20.556 4.996 396 HA SER 53 HA SER 53 3.472 -22.452 5.240 397 HB2 SER 53 2HB SER 53 5.222 -23.431 4.180 398 HB3 SER 53 3HB SER 53 6.417 -22.500 5.084 399 HG SER 53 HG SER 53 5.224 -24.951 5.696 400 H ASP 54 H ASP 54 2.359 -23.170 6.917 401 HA ASP 54 HA ASP 54 3.267 -22.656 9.616 402 HB2 ASP 54 2HB ASP 54 0.978 -22.249 9.385 403 HB3 ASP 54 3HB ASP 54 0.723 -23.688 8.402 404 H ILE 55 H ILE 55 2.928 -25.374 7.446 405 HA ILE 55 HA ILE 55 3.682 -27.519 7.559 406 HB ILE 55 HB ILE 55 5.171 -26.693 10.049 407 HG12 ILE 55 2HG1 ILE 55 6.019 -26.512 7.150 408 HG13 ILE 55 3HG1 ILE 55 5.704 -25.154 8.225 409 HG21 ILE 55 1HG2 ILE 55 6.585 -28.543 9.639 410 HG22 ILE 55 2HG2 ILE 55 4.934 -29.141 9.480 411 HG23 ILE 55 3HG2 ILE 55 5.894 -28.808 8.039 412 HD11 ILE 55 3HD1 ILE 55 8.086 -25.542 7.946 413 HD12 ILE 55 1HD1 ILE 55 7.589 -25.813 9.616 414 HD13 ILE 55 2HD1 ILE 55 7.898 -27.187 8.554 415 H ARG 56 H ARG 56 1.523 -28.193 8.028 416 HA ARG 56 HA ARG 56 1.335 -29.616 10.532 417 HB2 ARG 56 2HB ARG 56 0.124 -27.072 10.314 418 HB3 ARG 56 3HB ARG 56 -1.174 -28.255 10.222 419 HG2 ARG 56 2HG ARG 56 -1.038 -27.858 12.483 420 HG3 ARG 56 3HG ARG 56 -0.030 -29.296 12.303 421 HD2 ARG 56 2HD ARG 56 1.928 -28.128 12.631 422 HD3 ARG 56 3HD ARG 56 1.228 -26.600 12.098 423 HE ARG 56 HE ARG 56 -0.128 -27.089 14.364 424 HH11 ARG 56 1HH1 ARG 56 3.272 -27.128 13.615 425 HH12 ARG 56 2HH1 ARG 56 3.762 -26.664 15.211 426 HH21 ARG 56 1HH2 ARG 56 0.505 -26.479 16.469 427 HH22 ARG 56 2HH2 ARG 56 2.187 -26.296 16.834 428 H MET 57 H MET 57 1.355 -30.020 7.545 429 HA MET 57 HA MET 57 -1.266 -31.101 6.972 430 HB2 MET 57 2HB MET 57 1.314 -31.194 5.399 431 HB3 MET 57 3HB MET 57 -0.238 -31.781 4.817 432 HG2 MET 57 2HG MET 57 -0.228 -29.721 3.868 433 HG3 MET 57 3HG MET 57 -1.002 -29.333 5.403 434 HE1 MET 57 3HE MET 57 1.097 -26.168 4.685 435 HE2 MET 57 1HE MET 57 0.986 -27.219 3.273 436 HE3 MET 57 2HE MET 57 -0.410 -27.013 4.331 437 HA PRO 58 HA PRO 58 -0.599 -35.234 8.293 438 HB2 PRO 58 2HB PRO 58 -2.021 -36.617 6.440 439 HB3 PRO 58 3HB PRO 58 -2.782 -35.648 7.706 440 HG2 PRO 58 2HG PRO 58 -2.279 -34.957 4.837 441 HG3 PRO 58 3HG PRO 58 -3.725 -34.664 5.822 442 HD2 PRO 58 2HD PRO 58 -1.893 -32.736 5.312 443 HD3 PRO 58 3HD PRO 58 -2.815 -32.801 6.828 444 H GLY 59 H GLY 59 -0.071 -34.609 4.842 445 HA2 GLY 59 2HA GLY 59 2.082 -36.633 4.907 446 HA3 GLY 59 3HA GLY 59 1.048 -36.399 3.506 447 H MET 60 H MET 60 0.971 -33.694 3.232 448 HA MET 60 HA MET 60 3.291 -33.102 1.846 449 HB2 MET 60 2HB MET 60 1.243 -31.877 1.457 450 HB3 MET 60 3HB MET 60 1.277 -31.224 3.089 451 HG2 MET 60 2HG MET 60 1.981 -29.570 1.455 452 HG3 MET 60 3HG MET 60 3.288 -29.970 2.567 453 HE1 MET 60 3HE MET 60 2.758 -30.966 -1.796 454 HE2 MET 60 1HE MET 60 1.686 -30.126 -0.674 455 HE3 MET 60 2HE MET 60 3.057 -29.276 -1.387 456 H ASP 61 H ASP 61 2.597 -32.775 5.230 457 HA ASP 61 HA ASP 61 3.979 -32.365 7.002 458 HB2 ASP 61 2HB ASP 61 5.754 -33.141 4.980 459 HB3 ASP 61 3HB ASP 61 6.424 -31.647 5.627 460 H GLY 62 H GLY 62 5.240 -30.269 4.398 461 HA2 GLY 62 2HA GLY 62 4.074 -27.920 4.743 462 HA3 GLY 62 3HA GLY 62 5.048 -27.982 6.204 463 H LEU 63 H LEU 63 7.424 -28.836 5.566 464 HA LEU 63 HA LEU 63 8.465 -26.751 3.861 465 HB2 LEU 63 2HB LEU 63 10.676 -27.961 4.516 466 HB3 LEU 63 3HB LEU 63 9.805 -26.992 5.702 467 HG LEU 63 HG LEU 63 8.966 -28.946 6.789 468 HD11 LEU 63 1HD1 LEU 63 8.417 -30.451 5.109 469 HD12 LEU 63 2HD1 LEU 63 9.791 -31.219 5.903 470 HD13 LEU 63 3HD1 LEU 63 10.018 -30.369 4.374 471 HD21 LEU 63 3HD2 LEU 63 11.070 -28.492 7.646 472 HD22 LEU 63 1HD2 LEU 63 11.890 -28.948 6.153 473 HD23 LEU 63 2HD2 LEU 63 11.199 -30.192 7.195 474 H ALA 64 H ALA 64 7.476 -29.948 3.449 475 HA ALA 64 HA ALA 64 9.234 -31.107 1.699 476 HB1 ALA 64 1HB ALA 64 7.277 -32.278 2.455 477 HB2 ALA 64 2HB ALA 64 6.221 -31.153 1.601 478 HB3 ALA 64 3HB ALA 64 7.270 -32.241 0.691 479 H LEU 65 H LEU 65 6.820 -28.622 0.993 480 HA LEU 65 HA LEU 65 7.505 -28.581 -1.820 481 HB2 LEU 65 2HB LEU 65 5.603 -27.432 -2.116 482 HB3 LEU 65 3HB LEU 65 5.231 -28.008 -0.492 483 HG LEU 65 HG LEU 65 6.448 -25.316 -1.097 484 HD11 LEU 65 1HD1 LEU 65 3.803 -26.182 -1.535 485 HD12 LEU 65 2HD1 LEU 65 4.434 -24.537 -1.587 486 HD13 LEU 65 3HD1 LEU 65 3.785 -25.184 -0.081 487 HD21 LEU 65 3HD2 LEU 65 6.508 -24.950 1.115 488 HD22 LEU 65 1HD2 LEU 65 6.476 -26.709 1.239 489 HD23 LEU 65 2HD2 LEU 65 4.981 -25.787 1.398 490 H LEU 66 H LEU 66 8.397 -26.923 1.078 491 HA LEU 66 HA LEU 66 9.372 -24.530 -0.074 492 HB2 LEU 66 2HB LEU 66 9.563 -25.905 2.520 493 HB3 LEU 66 3HB LEU 66 10.905 -24.829 2.139 494 HG LEU 66 HG LEU 66 8.676 -23.300 1.571 495 HD11 LEU 66 1HD1 LEU 66 7.523 -25.286 2.875 496 HD12 LEU 66 2HD1 LEU 66 7.031 -23.610 3.118 497 HD13 LEU 66 3HD1 LEU 66 8.109 -24.389 4.276 498 HD21 LEU 66 3HD2 LEU 66 9.285 -22.387 3.973 499 HD22 LEU 66 1HD2 LEU 66 10.381 -22.189 2.606 500 HD23 LEU 66 2HD2 LEU 66 10.659 -23.476 3.779 501 H LYS 67 H LYS 67 10.696 -27.728 0.272 502 HA LYS 67 HA LYS 67 13.421 -27.181 -0.030 503 HB2 LYS 67 2HB LYS 67 11.839 -29.580 -0.971 504 HB3 LYS 67 3HB LYS 67 13.594 -29.509 -0.872 505 HG2 LYS 67 2HG LYS 67 11.780 -29.114 1.494 506 HG3 LYS 67 3HG LYS 67 12.463 -30.674 1.028 507 HD2 LYS 67 2HD LYS 67 14.490 -28.608 1.144 508 HD3 LYS 67 3HD LYS 67 13.633 -28.766 2.679 509 HE2 LYS 67 2HE LYS 67 14.713 -31.148 1.200 510 HE3 LYS 67 3HE LYS 67 15.703 -30.221 2.326 511 HZ1 LYS 67 3HZ LYS 67 14.431 -32.264 3.183 512 HZ2 LYS 67 1HZ LYS 67 13.072 -31.257 3.159 513 HZ3 LYS 67 2HZ LYS 67 14.407 -30.852 4.115 514 H GLN 68 H GLN 68 10.830 -27.330 -2.372 515 HA GLN 68 HA GLN 68 12.649 -27.212 -4.627 516 HB2 GLN 68 2HB GLN 68 10.805 -27.562 -5.986 517 HB3 GLN 68 3HB GLN 68 10.333 -28.398 -4.513 518 HG2 GLN 68 2HG GLN 68 9.375 -25.892 -4.055 519 HG3 GLN 68 3HG GLN 68 9.173 -26.045 -5.799 520 HE21 GLN 68 1HE2 GLN 68 7.079 -25.851 -3.909 521 HE22 GLN 68 2HE2 GLN 68 6.171 -27.319 -3.973 522 H ILE 69 H ILE 69 10.915 -25.044 -2.596 523 HA ILE 69 HA ILE 69 10.649 -22.849 -4.346 524 HB ILE 69 HB ILE 69 10.898 -22.931 -1.340 525 HG12 ILE 69 2HG1 ILE 69 8.505 -22.586 -3.160 526 HG13 ILE 69 3HG1 ILE 69 8.913 -24.051 -2.275 527 HG21 ILE 69 1HG2 ILE 69 9.934 -20.631 -1.428 528 HG22 ILE 69 2HG2 ILE 69 11.583 -20.752 -2.040 529 HG23 ILE 69 3HG2 ILE 69 10.231 -20.631 -3.166 530 HD11 ILE 69 3HD1 ILE 69 7.415 -23.205 -0.823 531 HD12 ILE 69 1HD1 ILE 69 8.831 -22.332 -0.237 532 HD13 ILE 69 2HD1 ILE 69 7.696 -21.539 -1.330 533 H LYS 70 H LYS 70 13.343 -24.120 -2.573 534 HA LYS 70 HA LYS 70 14.940 -21.737 -2.725 535 HB2 LYS 70 2HB LYS 70 15.095 -24.251 -1.408 536 HB3 LYS 70 3HB LYS 70 16.551 -24.072 -2.378 537 HG2 LYS 70 2HG LYS 70 17.403 -22.817 -0.769 538 HG3 LYS 70 3HG LYS 70 16.170 -21.602 -1.115 539 HD2 LYS 70 2HD LYS 70 15.471 -21.932 0.982 540 HD3 LYS 70 3HD LYS 70 14.813 -23.463 0.400 541 HE2 LYS 70 2HE LYS 70 17.233 -24.338 0.858 542 HE3 LYS 70 3HE LYS 70 17.335 -22.927 1.911 543 HZ1 LYS 70 3HZ LYS 70 15.366 -23.717 3.083 544 HZ2 LYS 70 1HZ LYS 70 16.606 -24.867 3.134 545 HZ3 LYS 70 2HZ LYS 70 15.297 -25.081 2.085 546 H GLN 71 H GLN 71 14.364 -24.512 -4.728 547 HA GLN 71 HA GLN 71 16.670 -23.964 -6.415 548 HB2 GLN 71 2HB GLN 71 15.683 -26.301 -5.786 549 HB3 GLN 71 3HB GLN 71 14.543 -25.966 -7.082 550 HG2 GLN 71 2HG GLN 71 16.032 -26.471 -8.643 551 HG3 GLN 71 3HG GLN 71 17.263 -25.449 -7.903 552 HE21 GLN 71 1HE2 GLN 71 15.581 -28.461 -7.055 553 HE22 GLN 71 2HE2 GLN 71 17.010 -29.347 -6.660 554 H ARG 72 H ARG 72 13.174 -23.641 -6.457 555 HA ARG 72 HA ARG 72 13.150 -22.712 -9.203 556 HB2 ARG 72 2HB ARG 72 11.159 -23.530 -7.209 557 HB3 ARG 72 3HB ARG 72 10.657 -22.161 -8.193 558 HG2 ARG 72 2HG ARG 72 11.488 -23.688 -10.163 559 HG3 ARG 72 3HG ARG 72 11.200 -24.973 -8.987 560 HD2 ARG 72 2HD ARG 72 8.909 -23.815 -8.650 561 HD3 ARG 72 3HD ARG 72 9.257 -23.042 -10.196 562 HE ARG 72 HE ARG 72 8.787 -25.019 -11.235 563 HH11 ARG 72 1HH1 ARG 72 9.413 -25.643 -7.868 564 HH12 ARG 72 2HH1 ARG 72 8.972 -27.316 -7.961 565 HH21 ARG 72 1HH2 ARG 72 8.204 -27.221 -11.371 566 HH22 ARG 72 2HH2 ARG 72 8.286 -28.212 -9.955 567 H HIS 73 H HIS 73 12.608 -21.367 -5.967 568 HA HIS 73 HA HIS 73 13.042 -18.687 -7.105 569 HB2 HIS 73 2HB HIS 73 11.232 -19.134 -4.747 570 HB3 HIS 73 3HB HIS 73 11.322 -17.740 -5.819 571 HD1 HIS 73 HD1 HIS 73 9.962 -17.821 -7.980 572 HD2 HIS 73 HD2 HIS 73 9.747 -21.322 -5.753 573 HE1 HIS 73 HE1 HIS 73 8.108 -19.165 -9.018 574 HA PRO 74 HA PRO 74 16.140 -19.526 -3.775 575 HB2 PRO 74 2HB PRO 74 18.212 -18.393 -5.113 576 HB3 PRO 74 3HB PRO 74 17.732 -20.079 -5.338 577 HG2 PRO 74 2HG PRO 74 17.096 -17.687 -7.023 578 HG3 PRO 74 3HG PRO 74 17.576 -19.318 -7.529 579 HD2 PRO 74 2HD PRO 74 15.002 -18.478 -7.571 580 HD3 PRO 74 3HD PRO 74 15.451 -20.166 -7.252 581 H MET 75 H MET 75 15.554 -16.641 -5.741 582 HA MET 75 HA MET 75 16.624 -14.872 -3.724 583 HB2 MET 75 2HB MET 75 16.471 -14.612 -6.373 584 HB3 MET 75 3HB MET 75 14.947 -13.840 -5.956 585 HG2 MET 75 2HG MET 75 16.548 -12.582 -4.228 586 HG3 MET 75 3HG MET 75 17.719 -12.944 -5.494 587 HE1 MET 75 3HE MET 75 14.203 -10.149 -5.445 588 HE2 MET 75 1HE MET 75 13.698 -11.664 -6.194 589 HE3 MET 75 2HE MET 75 14.386 -11.671 -4.571 590 H LEU 76 H LEU 76 13.886 -16.610 -3.847 591 HA LEU 76 HA LEU 76 12.109 -14.521 -2.838 592 HB2 LEU 76 2HB LEU 76 11.023 -15.904 -4.386 593 HB3 LEU 76 3HB LEU 76 11.711 -17.369 -3.688 594 HG LEU 76 HG LEU 76 10.270 -16.976 -1.673 595 HD11 LEU 76 1HD1 LEU 76 9.457 -14.896 -1.511 596 HD12 LEU 76 2HD1 LEU 76 8.199 -15.478 -2.601 597 HD13 LEU 76 3HD1 LEU 76 9.587 -14.600 -3.245 598 HD21 LEU 76 3HD2 LEU 76 9.176 -17.533 -4.400 599 HD22 LEU 76 1HD2 LEU 76 8.107 -17.528 -2.996 600 HD23 LEU 76 2HD2 LEU 76 9.472 -18.644 -3.061 601 HA PRO 77 HA PRO 77 13.457 -15.774 1.265 602 HB2 PRO 77 2HB PRO 77 12.212 -13.729 2.545 603 HB3 PRO 77 3HB PRO 77 13.759 -13.541 1.712 604 HG2 PRO 77 2HG PRO 77 11.004 -12.845 0.770 605 HG3 PRO 77 3HG PRO 77 12.507 -11.917 0.614 606 HD2 PRO 77 2HD PRO 77 11.483 -13.385 -1.418 607 HD3 PRO 77 3HD PRO 77 13.229 -13.152 -1.194 608 H VAL 78 H VAL 78 12.457 -17.415 2.235 609 HA VAL 78 HA VAL 78 9.524 -17.331 2.500 610 HB VAL 78 HB VAL 78 11.196 -19.821 2.742 611 HG11 VAL 78 1HG1 VAL 78 8.849 -20.639 1.793 612 HG12 VAL 78 2HG1 VAL 78 9.141 -20.410 3.518 613 HG13 VAL 78 3HG1 VAL 78 8.310 -19.161 2.590 614 HG21 VAL 78 3HG2 VAL 78 9.946 -18.699 0.236 615 HG22 VAL 78 1HG2 VAL 78 11.672 -18.866 0.558 616 HG23 VAL 78 2HG2 VAL 78 10.662 -20.302 0.393 617 H ILE 79 H ILE 79 8.625 -18.332 4.453 618 HA ILE 79 HA ILE 79 10.431 -18.147 6.770 619 HB ILE 79 HB ILE 79 7.564 -17.228 6.847 620 HG12 ILE 79 2HG1 ILE 79 10.054 -15.548 6.472 621 HG13 ILE 79 3HG1 ILE 79 8.797 -15.809 5.268 622 HG21 ILE 79 1HG2 ILE 79 8.304 -16.107 8.912 623 HG22 ILE 79 2HG2 ILE 79 8.507 -17.857 8.985 624 HG23 ILE 79 3HG2 ILE 79 9.904 -16.819 8.704 625 HD11 ILE 79 3HD1 ILE 79 7.762 -14.017 6.033 626 HD12 ILE 79 1HD1 ILE 79 7.504 -14.851 7.566 627 HD13 ILE 79 2HD1 ILE 79 8.939 -13.851 7.336 628 H ILE 80 H ILE 80 10.528 -20.040 7.764 629 HA ILE 80 HA ILE 80 8.385 -21.980 7.440 630 HB ILE 80 HB ILE 80 11.167 -22.138 8.559 631 HG12 ILE 80 2HG1 ILE 80 10.508 -22.362 6.055 632 HG13 ILE 80 3HG1 ILE 80 11.610 -23.545 6.751 633 HG21 ILE 80 1HG2 ILE 80 10.120 -23.471 10.129 634 HG22 ILE 80 2HG2 ILE 80 8.884 -24.015 8.996 635 HG23 ILE 80 3HG2 ILE 80 10.529 -24.638 8.872 636 HD11 ILE 80 3HD1 ILE 80 8.648 -23.971 6.462 637 HD12 ILE 80 1HD1 ILE 80 9.851 -24.506 5.289 638 HD13 ILE 80 2HD1 ILE 80 9.864 -25.161 6.927 639 H MET 81 H MET 81 7.105 -22.768 9.059 640 HA MET 81 HA MET 81 7.304 -21.395 11.659 641 HB2 MET 81 2HB MET 81 5.247 -21.117 9.970 642 HB3 MET 81 3HB MET 81 4.717 -22.576 10.797 643 HG2 MET 81 2HG MET 81 5.232 -21.220 12.952 644 HG3 MET 81 3HG MET 81 5.120 -19.827 11.878 645 HE1 MET 81 3HE MET 81 3.202 -20.668 9.799 646 HE2 MET 81 1HE MET 81 1.524 -20.564 10.332 647 HE3 MET 81 2HE MET 81 2.606 -19.189 10.553 648 H THR 82 H THR 82 7.946 -22.697 13.232 649 HA THR 82 HA THR 82 6.680 -25.042 14.002 650 HB THR 82 HB THR 82 7.649 -25.963 11.894 651 HG1 THR 82 HG1 THR 82 7.241 -27.315 13.730 652 HG21 THR 82 3HG2 THR 82 10.339 -26.118 13.105 653 HG22 THR 82 1HG2 THR 82 9.865 -24.544 12.466 654 HG23 THR 82 2HG2 THR 82 9.864 -25.960 11.414 655 H ALA 83 H ALA 83 7.782 -26.158 15.765 656 HA ALA 83 HA ALA 83 10.275 -25.481 16.794 657 HB1 ALA 83 1HB ALA 83 10.067 -23.566 17.908 658 HB2 ALA 83 2HB ALA 83 8.545 -23.329 17.047 659 HB3 ALA 83 3HB ALA 83 8.548 -24.077 18.644 660 H HIS 84 H HIS 84 9.712 -27.835 16.906 661 HA HIS 84 HA HIS 84 9.401 -28.659 19.550 662 HB2 HIS 84 2HB HIS 84 7.190 -29.822 19.382 663 HB3 HIS 84 3HB HIS 84 7.075 -28.065 19.400 664 HD1 HIS 84 HD1 HIS 84 6.273 -31.031 17.365 665 HD2 HIS 84 HD2 HIS 84 6.389 -26.908 16.868 666 HE1 HIS 84 HE1 HIS 84 4.998 -30.573 15.246 667 H SER 85 H SER 85 9.070 -29.439 16.150 668 HA SER 85 HA SER 85 10.781 -31.727 16.451 669 HB2 SER 85 2HB SER 85 8.264 -32.393 16.952 670 HB3 SER 85 3HB SER 85 8.159 -32.408 15.191 671 HG SER 85 HG SER 85 8.767 -34.440 15.816 672 H ASP 86 H ASP 86 11.418 -29.586 15.071 673 HA ASP 86 HA ASP 86 11.719 -30.543 12.409 674 HB2 ASP 86 2HB ASP 86 9.396 -29.646 12.290 675 HB3 ASP 86 3HB ASP 86 10.022 -28.060 12.734 676 H LEU 87 H LEU 87 11.947 -27.889 14.695 677 HA LEU 87 HA LEU 87 13.621 -26.133 13.430 678 HB2 LEU 87 2HB LEU 87 12.948 -26.786 16.150 679 HB3 LEU 87 3HB LEU 87 14.652 -26.354 16.027 680 HG LEU 87 HG LEU 87 14.111 -24.188 15.168 681 HD11 LEU 87 1HD1 LEU 87 11.641 -23.552 15.020 682 HD12 LEU 87 2HD1 LEU 87 11.326 -25.286 14.971 683 HD13 LEU 87 3HD1 LEU 87 12.311 -24.533 13.716 684 HD21 LEU 87 3HD2 LEU 87 13.055 -23.219 17.052 685 HD22 LEU 87 1HD2 LEU 87 13.917 -24.640 17.642 686 HD23 LEU 87 2HD2 LEU 87 12.170 -24.702 17.410 687 H ASP 88 H ASP 88 14.677 -28.913 15.400 688 HA ASP 88 HA ASP 88 17.382 -28.744 15.120 689 HB2 ASP 88 2HB ASP 88 15.527 -30.765 15.848 690 HB3 ASP 88 3HB ASP 88 16.673 -31.489 14.723 691 H ALA 89 H ALA 89 15.059 -29.737 12.701 692 HA ALA 89 HA ALA 89 17.131 -30.569 10.843 693 HB1 ALA 89 1HB ALA 89 14.131 -30.502 10.693 694 HB2 ALA 89 2HB ALA 89 15.140 -30.892 9.300 695 HB3 ALA 89 3HB ALA 89 15.197 -31.906 10.742 696 H ALA 90 H ALA 90 14.467 -28.192 10.751 697 HA ALA 90 HA ALA 90 15.143 -26.839 8.467 698 HB1 ALA 90 1HB ALA 90 13.123 -26.221 9.436 699 HB2 ALA 90 2HB ALA 90 13.858 -25.920 11.011 700 HB3 ALA 90 3HB ALA 90 14.138 -24.799 9.679 701 H VAL 91 H VAL 91 16.557 -26.509 11.673 702 HA VAL 91 HA VAL 91 17.970 -24.188 11.519 703 HB VAL 91 HB VAL 91 18.791 -26.839 12.685 704 HG11 VAL 91 1HG1 VAL 91 20.902 -26.060 12.590 705 HG12 VAL 91 2HG1 VAL 91 20.386 -24.391 12.337 706 HG13 VAL 91 3HG1 VAL 91 20.391 -25.077 13.962 707 HG21 VAL 91 3HG2 VAL 91 16.912 -25.122 13.528 708 HG22 VAL 91 1HG2 VAL 91 17.877 -26.110 14.624 709 HG23 VAL 91 2HG2 VAL 91 18.321 -24.429 14.330 710 H SER 92 H SER 92 19.249 -27.348 10.456 711 HA SER 92 HA SER 92 21.374 -26.017 8.991 712 HB2 SER 92 2HB SER 92 21.835 -28.078 10.299 713 HB3 SER 92 3HB SER 92 20.759 -28.973 9.226 714 HG SER 92 HG SER 92 22.972 -27.505 8.256 715 H ALA 93 H ALA 93 18.590 -28.104 8.304 716 HA ALA 93 HA ALA 93 18.925 -28.305 5.535 717 HB1 ALA 93 1HB ALA 93 17.378 -29.788 6.392 718 HB2 ALA 93 2HB ALA 93 16.570 -28.552 7.358 719 HB3 ALA 93 3HB ALA 93 16.343 -28.593 5.609 720 H TYR 94 H TYR 94 16.585 -26.203 7.227 721 HA TYR 94 HA TYR 94 15.858 -24.671 5.032 722 HB2 TYR 94 2HB TYR 94 14.897 -24.752 7.458 723 HB3 TYR 94 3HB TYR 94 16.033 -23.443 7.765 724 HD1 TYR 94 HD1 TYR 94 14.020 -24.111 4.706 725 HD2 TYR 94 HD2 TYR 94 14.673 -21.568 8.054 726 HE1 TYR 94 HE1 TYR 94 12.403 -22.500 3.789 727 HE2 TYR 94 HE2 TYR 94 13.057 -19.950 7.147 728 HH TYR 94 HH TYR 94 10.862 -20.633 4.852 729 H GLN 95 H GLN 95 18.770 -24.637 6.844 730 HA GLN 95 HA GLN 95 19.571 -21.962 6.286 731 HB2 GLN 95 2HB GLN 95 20.709 -24.317 7.570 732 HB3 GLN 95 3HB GLN 95 21.904 -23.420 6.644 733 HG2 GLN 95 2HG GLN 95 20.088 -22.040 8.583 734 HG3 GLN 95 3HG GLN 95 21.573 -22.830 9.113 735 HE21 GLN 95 1HE2 GLN 95 20.191 -20.140 7.476 736 HE22 GLN 95 2HE2 GLN 95 21.656 -19.257 7.230 737 H GLN 96 H GLN 96 18.958 -24.336 4.185 738 HA GLN 96 HA GLN 96 21.270 -24.259 2.507 739 HB2 GLN 96 2HB GLN 96 18.485 -25.325 2.230 740 HB3 GLN 96 3HB GLN 96 19.518 -25.209 0.811 741 HG2 GLN 96 2HG GLN 96 21.096 -26.421 2.760 742 HG3 GLN 96 3HG GLN 96 19.506 -27.164 2.919 743 HE21 GLN 96 1HE2 GLN 96 22.297 -27.833 1.694 744 HE22 GLN 96 2HE2 GLN 96 21.874 -28.590 0.200 745 H GLY 97 H GLY 97 20.056 -21.671 3.263 746 HA2 GLY 97 2HA GLY 97 20.380 -19.719 1.870 747 HA3 GLY 97 3HA GLY 97 19.708 -20.630 0.525 748 H ALA 98 H ALA 98 18.350 -20.578 3.764 749 HA ALA 98 HA ALA 98 15.994 -19.190 2.665 750 HB1 ALA 98 1HB ALA 98 14.596 -20.511 3.925 751 HB2 ALA 98 2HB ALA 98 15.888 -21.649 3.543 752 HB3 ALA 98 3HB ALA 98 15.837 -20.871 5.125 753 H PHE 99 H PHE 99 14.705 -17.989 4.341 754 HA PHE 99 HA PHE 99 16.520 -16.287 5.846 755 HB2 PHE 99 2HB PHE 99 14.969 -15.040 4.583 756 HB3 PHE 99 3HB PHE 99 13.624 -16.073 5.057 757 HD1 PHE 99 HD1 PHE 99 16.097 -13.678 6.465 758 HD2 PHE 99 HD2 PHE 99 12.227 -15.422 6.781 759 HE1 PHE 99 HE1 PHE 99 15.542 -12.112 8.280 760 HE2 PHE 99 HE2 PHE 99 11.666 -13.858 8.595 761 HZ PHE 99 HZ PHE 99 13.324 -12.199 9.346 762 H ASP 100 H ASP 100 16.254 -15.792 8.057 763 HA ASP 100 HA ASP 100 15.985 -17.855 9.811 764 HB2 ASP 100 2HB ASP 100 16.838 -15.538 10.317 765 HB3 ASP 100 3HB ASP 100 15.160 -15.025 10.476 766 H TYR 101 H TYR 101 14.366 -19.175 10.272 767 HA TYR 101 HA TYR 101 11.667 -18.589 9.547 768 HB2 TYR 101 2HB TYR 101 11.231 -20.788 10.794 769 HB3 TYR 101 3HB TYR 101 12.266 -20.858 9.372 770 HD1 TYR 101 HD2 TYR 101 12.866 -20.001 12.965 771 HD2 TYR 101 HD1 TYR 101 13.921 -22.437 9.640 772 HE1 TYR 101 HE2 TYR 101 14.631 -21.061 14.310 773 HE2 TYR 101 HE1 TYR 101 15.689 -23.505 10.976 774 HH TYR 101 HH TYR 101 15.937 -23.082 14.369 775 H LEU 102 H LEU 102 9.940 -19.256 11.328 776 HA LEU 102 HA LEU 102 10.575 -17.936 13.867 777 HB2 LEU 102 2HB LEU 102 9.540 -16.127 12.960 778 HB3 LEU 102 3HB LEU 102 8.581 -17.099 11.845 779 HG LEU 102 HG LEU 102 7.165 -17.761 13.827 780 HD11 LEU 102 1HD1 LEU 102 7.392 -15.736 15.575 781 HD12 LEU 102 2HD1 LEU 102 9.085 -15.940 15.128 782 HD13 LEU 102 3HD1 LEU 102 8.178 -17.301 15.788 783 HD21 LEU 102 3HD2 LEU 102 7.323 -15.089 12.564 784 HD22 LEU 102 1HD2 LEU 102 6.259 -15.253 13.961 785 HD23 LEU 102 2HD2 LEU 102 6.021 -16.280 12.547 786 HA PRO 103 HA PRO 103 8.521 -21.636 15.255 787 HB2 PRO 103 2HB PRO 103 8.771 -21.112 17.907 788 HB3 PRO 103 3HB PRO 103 10.107 -21.707 16.916 789 HG2 PRO 103 2HG PRO 103 9.500 -18.911 17.796 790 HG3 PRO 103 3HG PRO 103 11.058 -19.755 17.750 791 HD2 PRO 103 2HD PRO 103 10.301 -17.991 15.841 792 HD3 PRO 103 3HD PRO 103 11.330 -19.394 15.490 793 H LYS 104 H LYS 104 6.546 -22.187 16.219 794 HA LYS 104 HA LYS 104 4.774 -19.919 16.851 795 HB2 LYS 104 2HB LYS 104 2.919 -21.206 15.864 796 HB3 LYS 104 3HB LYS 104 4.174 -20.849 14.685 797 HG2 LYS 104 2HG LYS 104 3.898 -23.021 14.170 798 HG3 LYS 104 3HG LYS 104 5.018 -23.253 15.514 799 HD2 LYS 104 2HD LYS 104 3.216 -24.759 15.860 800 HD3 LYS 104 3HD LYS 104 3.002 -23.441 17.015 801 HE2 LYS 104 2HE LYS 104 1.568 -22.461 14.986 802 HE3 LYS 104 3HE LYS 104 1.387 -24.180 14.643 803 HZ1 LYS 104 3HZ LYS 104 -0.146 -24.284 16.216 804 HZ2 LYS 104 1HZ LYS 104 0.055 -22.642 16.571 805 HZ3 LYS 104 2HZ LYS 104 0.983 -23.801 17.380 806 HA PRO 105 HA PRO 105 2.516 -19.872 17.385 807 HB2 PRO 105 2HB PRO 105 1.688 -18.628 19.651 808 HB3 PRO 105 3HB PRO 105 0.891 -20.064 18.998 809 HG2 PRO 105 2HG PRO 105 2.887 -19.850 21.219 810 HG3 PRO 105 3HG PRO 105 1.407 -20.823 21.135 811 HD2 PRO 105 2HD PRO 105 3.866 -21.870 20.699 812 HD3 PRO 105 3HD PRO 105 2.413 -22.471 19.876 813 H PHE 106 H PHE 106 2.537 -17.426 17.683 814 HA PHE 106 HA PHE 106 4.900 -16.333 18.945 815 HB2 PHE 106 2HB PHE 106 5.712 -15.288 16.824 816 HB3 PHE 106 3HB PHE 106 5.878 -17.040 16.859 817 HD1 PHE 106 HD1 PHE 106 3.473 -14.415 15.752 818 HD2 PHE 106 HD2 PHE 106 5.186 -18.244 15.028 819 HE1 PHE 106 HE1 PHE 106 2.227 -14.569 13.635 820 HE2 PHE 106 HE2 PHE 106 3.944 -18.404 12.911 821 HZ PHE 106 HZ PHE 106 2.463 -16.565 12.211 822 H ASP 107 H ASP 107 5.043 -13.882 18.300 823 HA ASP 107 HA ASP 107 2.363 -12.802 18.728 824 HB2 ASP 107 2HB ASP 107 5.119 -11.608 19.048 825 HB3 ASP 107 3HB ASP 107 3.636 -10.676 19.239 826 H ILE 108 H ILE 108 1.256 -12.206 16.992 827 HA ILE 108 HA ILE 108 2.118 -11.951 14.413 828 HB ILE 108 HB ILE 108 -0.155 -10.608 15.844 829 HG12 ILE 108 2HG1 ILE 108 -0.391 -12.503 13.542 830 HG13 ILE 108 3HG1 ILE 108 0.049 -13.138 15.123 831 HG21 ILE 108 1HG2 ILE 108 -0.967 -10.037 13.486 832 HG22 ILE 108 2HG2 ILE 108 0.280 -9.011 14.192 833 HG23 ILE 108 3HG2 ILE 108 0.717 -10.233 12.998 834 HD11 ILE 108 3HD1 ILE 108 -2.139 -11.444 15.552 835 HD12 ILE 108 1HD1 ILE 108 -2.520 -12.394 14.116 836 HD13 ILE 108 2HD1 ILE 108 -2.100 -13.206 15.625 837 H ASP 109 H ASP 109 2.280 -9.557 16.967 838 HA ASP 109 HA ASP 109 2.799 -7.263 15.490 839 HB2 ASP 109 2HB ASP 109 3.966 -8.044 18.171 840 HB3 ASP 109 3HB ASP 109 3.929 -6.413 17.507 841 H GLU 110 H GLU 110 5.012 -9.806 16.558 842 HA GLU 110 HA GLU 110 7.317 -8.490 15.437 843 HB2 GLU 110 2HB GLU 110 7.439 -9.956 17.449 844 HB3 GLU 110 3HB GLU 110 7.045 -11.332 16.428 845 HG2 GLU 110 2HG GLU 110 9.103 -11.398 15.475 846 HG3 GLU 110 3HG GLU 110 9.355 -9.661 15.630 847 H ALA 111 H ALA 111 5.077 -11.013 14.493 848 HA ALA 111 HA ALA 111 6.535 -12.061 12.322 849 HB1 ALA 111 1HB ALA 111 3.640 -12.078 11.965 850 HB2 ALA 111 2HB ALA 111 4.778 -13.421 12.082 851 HB3 ALA 111 3HB ALA 111 4.158 -12.661 13.547 852 H VAL 112 H VAL 112 3.894 -9.664 12.371 853 HA VAL 112 HA VAL 112 3.780 -9.064 9.686 854 HB VAL 112 HB VAL 112 3.334 -7.319 12.096 855 HG11 VAL 112 1HG1 VAL 112 3.901 -5.698 10.523 856 HG12 VAL 112 2HG1 VAL 112 3.175 -6.598 9.191 857 HG13 VAL 112 3HG1 VAL 112 2.146 -5.806 10.384 858 HG21 VAL 112 3HG2 VAL 112 1.323 -8.274 10.081 859 HG22 VAL 112 1HG2 VAL 112 1.808 -9.267 11.455 860 HG23 VAL 112 2HG2 VAL 112 1.050 -7.698 11.725 861 H ALA 113 H ALA 113 6.043 -7.871 12.109 862 HA ALA 113 HA ALA 113 7.311 -6.042 10.269 863 HB1 ALA 113 1HB ALA 113 8.981 -6.414 12.487 864 HB2 ALA 113 2HB ALA 113 7.863 -5.082 12.192 865 HB3 ALA 113 3HB ALA 113 7.331 -6.495 13.103 866 H LEU 114 H LEU 114 7.712 -9.326 11.287 867 HA LEU 114 HA LEU 114 10.437 -9.654 10.594 868 HB2 LEU 114 2HB LEU 114 9.348 -11.240 12.031 869 HB3 LEU 114 3HB LEU 114 8.167 -11.626 10.781 870 HG LEU 114 HG LEU 114 10.176 -12.473 9.423 871 HD11 LEU 114 1HD1 LEU 114 11.927 -11.489 10.790 872 HD12 LEU 114 2HD1 LEU 114 12.069 -13.246 10.770 873 HD13 LEU 114 3HD1 LEU 114 11.394 -12.433 12.181 874 HD21 LEU 114 3HD2 LEU 114 10.207 -14.566 11.106 875 HD22 LEU 114 1HD2 LEU 114 8.868 -14.216 10.013 876 HD23 LEU 114 2HD2 LEU 114 8.779 -13.720 11.703 877 H VAL 115 H VAL 115 7.429 -10.338 8.824 878 HA VAL 115 HA VAL 115 8.607 -11.339 6.489 879 HB VAL 115 HB VAL 115 6.243 -11.628 6.883 880 HG11 VAL 115 1HG1 VAL 115 5.945 -8.652 6.497 881 HG12 VAL 115 2HG1 VAL 115 4.658 -9.812 6.833 882 HG13 VAL 115 3HG1 VAL 115 5.885 -9.475 8.055 883 HG21 VAL 115 3HG2 VAL 115 6.035 -9.871 4.537 884 HG22 VAL 115 1HG2 VAL 115 7.355 -11.039 4.480 885 HG23 VAL 115 2HG2 VAL 115 5.695 -11.594 4.700 886 H GLU 116 H GLU 116 7.816 -8.037 7.461 887 HA GLU 116 HA GLU 116 8.248 -6.728 5.048 888 HB2 GLU 116 2HB GLU 116 8.770 -5.791 7.873 889 HB3 GLU 116 3HB GLU 116 8.812 -4.737 6.466 890 HG2 GLU 116 2HG GLU 116 6.533 -4.855 6.140 891 HG3 GLU 116 3HG GLU 116 6.381 -6.375 7.019 892 H ARG 117 H ARG 117 10.523 -8.042 7.335 893 HA ARG 117 HA ARG 117 12.825 -6.651 6.485 894 HB2 ARG 117 2HB ARG 117 12.819 -9.462 7.570 895 HB3 ARG 117 3HB ARG 117 14.074 -8.241 7.727 896 HG2 ARG 117 2HG ARG 117 11.789 -7.111 8.871 897 HG3 ARG 117 3HG ARG 117 11.831 -8.784 9.432 898 HD2 ARG 117 2HD ARG 117 13.197 -7.924 11.010 899 HD3 ARG 117 3HD ARG 117 14.416 -8.127 9.753 900 HE ARG 117 HE ARG 117 13.425 -5.636 9.307 901 HH11 ARG 117 1HH1 ARG 117 14.783 -7.254 12.074 902 HH12 ARG 117 2HH1 ARG 117 15.440 -5.805 12.762 903 HH21 ARG 117 1HH2 ARG 117 14.285 -3.722 10.202 904 HH22 ARG 117 2HH2 ARG 117 15.155 -3.797 11.696 905 H ALA 118 H ALA 118 11.324 -9.659 5.411 906 HA ALA 118 HA ALA 118 13.407 -10.381 3.608 907 HB1 ALA 118 1HB ALA 118 11.168 -11.645 2.656 908 HB2 ALA 118 2HB ALA 118 12.250 -12.270 3.901 909 HB3 ALA 118 3HB ALA 118 10.783 -11.407 4.361 910 H ILE 119 H ILE 119 10.358 -8.627 3.279 911 HA ILE 119 HA ILE 119 10.514 -8.386 0.438 912 HB ILE 119 HB ILE 119 8.887 -6.839 2.457 913 HG12 ILE 119 2HG1 ILE 119 7.834 -8.851 0.495 914 HG13 ILE 119 3HG1 ILE 119 8.552 -9.391 2.008 915 HG21 ILE 119 1HG2 ILE 119 7.542 -6.107 0.526 916 HG22 ILE 119 2HG2 ILE 119 9.195 -5.496 0.469 917 HG23 ILE 119 3HG2 ILE 119 8.720 -6.852 -0.554 918 HD11 ILE 119 3HD1 ILE 119 5.996 -9.022 1.847 919 HD12 ILE 119 1HD1 ILE 119 6.867 -8.485 3.283 920 HD13 ILE 119 2HD1 ILE 119 6.409 -7.319 2.040 921 H SER 120 H SER 120 11.797 -6.610 3.120 922 HA SER 120 HA SER 120 12.436 -4.284 1.494 923 HB2 SER 120 2HB SER 120 12.850 -4.951 4.408 924 HB3 SER 120 3HB SER 120 13.533 -3.504 3.666 925 HG SER 120 HG SER 120 11.434 -3.221 4.675 926 H HIS 121 H HIS 121 13.909 -7.198 2.606 927 HA HIS 121 HA HIS 121 16.607 -6.545 2.595 928 HB2 HIS 121 2HB HIS 121 15.525 -8.753 3.256 929 HB3 HIS 121 3HB HIS 121 15.513 -9.152 1.541 930 HD1 HIS 121 HD1 HIS 121 17.771 -9.713 0.438 931 HD2 HIS 121 HD2 HIS 121 18.048 -8.808 4.483 932 HE1 HIS 121 HE1 HIS 121 20.085 -10.418 1.127 933 H TYR 122 H TYR 122 14.407 -7.034 -0.064 934 HA TYR 122 HA TYR 122 16.125 -7.542 -2.163 935 HB2 TYR 122 2HB TYR 122 13.683 -5.756 -2.206 936 HB3 TYR 122 3HB TYR 122 14.442 -6.491 -3.613 937 HD1 TYR 122 HD1 TYR 122 14.980 -9.222 -2.588 938 HD2 TYR 122 HD2 TYR 122 11.559 -6.730 -2.150 939 HE1 TYR 122 HE1 TYR 122 13.569 -11.217 -2.311 940 HE2 TYR 122 HE2 TYR 122 10.139 -8.718 -1.870 941 HH TYR 122 HH TYR 122 10.660 -11.492 -2.778 942 H GLN 123 H GLN 123 15.060 -4.339 -1.014 943 HA GLN 123 HA GLN 123 16.702 -2.848 -2.740 944 HB2 GLN 123 2HB GLN 123 15.549 -2.126 -0.041 945 HB3 GLN 123 3HB GLN 123 16.309 -0.978 -1.136 946 HG2 GLN 123 2HG GLN 123 14.148 -0.639 -1.711 947 HG3 GLN 123 3HG GLN 123 14.521 -1.959 -2.819 948 HE21 GLN 123 1HE2 GLN 123 11.939 -1.424 -2.142 949 HE22 GLN 123 2HE2 GLN 123 11.316 -2.690 -1.144 950 H GLU 124 H GLU 124 17.264 -4.215 0.449 951 HA GLU 124 HA GLU 124 19.153 -4.492 1.685 952 HB2 GLU 124 2HB GLU 124 19.950 -4.740 -1.032 953 HB3 GLU 124 3HB GLU 124 21.204 -3.838 -0.192 954 HG2 GLU 124 2HG GLU 124 21.898 -5.626 0.950 955 HG3 GLU 124 3HG GLU 124 20.257 -6.184 1.266 Start of MODEL 13 1 H1 MET 1 H MET 1 0.641 0.290 2.169 2 HA MET 1 HA MET 1 1.018 1.241 -0.582 3 HB2 MET 1 2HB MET 1 2.464 2.358 0.954 4 HB3 MET 1 3HB MET 1 2.945 0.842 1.704 5 HG2 MET 1 2HG MET 1 4.697 1.747 0.272 6 HG3 MET 1 3HG MET 1 4.121 0.184 -0.302 7 HE1 MET 1 3HE MET 1 4.490 3.729 -0.544 8 HE2 MET 1 1HE MET 1 4.703 3.952 -2.281 9 HE3 MET 1 2HE MET 1 3.139 4.280 -1.535 10 H GLN 2 H GLN 2 0.399 -0.548 -1.765 11 HA GLN 2 HA GLN 2 1.246 -3.193 -1.184 12 HB2 GLN 2 2HB GLN 2 -0.651 -2.131 -2.804 13 HB3 GLN 2 3HB GLN 2 0.585 -2.538 -3.987 14 HG2 GLN 2 2HG GLN 2 0.453 -4.807 -3.536 15 HG3 GLN 2 3HG GLN 2 -0.300 -4.550 -1.963 16 HE21 GLN 2 1HE2 GLN 2 -2.460 -4.537 -1.815 17 HE22 GLN 2 2HE2 GLN 2 -3.542 -4.668 -3.155 18 H ARG 3 H ARG 3 2.901 -4.411 -2.013 19 HA ARG 3 HA ARG 3 4.554 -3.747 -4.158 20 HB2 ARG 3 2HB ARG 3 6.626 -3.136 -2.776 21 HB3 ARG 3 3HB ARG 3 5.423 -1.879 -3.035 22 HG2 ARG 3 2HG ARG 3 5.821 -1.604 -0.811 23 HG3 ARG 3 3HG ARG 3 4.488 -2.758 -0.741 24 HD2 ARG 3 2HD ARG 3 5.831 -4.007 0.531 25 HD3 ARG 3 3HD ARG 3 6.704 -4.374 -0.956 26 HE ARG 3 HE ARG 3 8.456 -3.177 -0.134 27 HH11 ARG 3 1HH1 ARG 3 5.551 -2.104 1.457 28 HH12 ARG 3 2HH1 ARG 3 6.380 -1.019 2.523 29 HH21 ARG 3 1HH2 ARG 3 9.559 -1.752 1.264 30 HH22 ARG 3 2HH2 ARG 3 8.660 -0.819 2.412 31 H GLY 4 H GLY 4 4.266 -5.265 -1.004 32 HA2 GLY 4 2HA GLY 4 5.775 -7.570 -2.073 33 HA3 GLY 4 3HA GLY 4 5.965 -7.026 -0.413 34 H ILE 5 H ILE 5 4.203 -9.001 -2.543 35 HA ILE 5 HA ILE 5 1.875 -9.305 -0.877 36 HB ILE 5 HB ILE 5 2.859 -10.827 -3.285 37 HG12 ILE 5 2HG1 ILE 5 0.453 -9.036 -2.887 38 HG13 ILE 5 3HG1 ILE 5 1.967 -8.530 -3.629 39 HG21 ILE 5 1HG2 ILE 5 1.638 -12.541 -2.521 40 HG22 ILE 5 2HG2 ILE 5 0.824 -11.546 -1.314 41 HG23 ILE 5 3HG2 ILE 5 0.247 -11.559 -2.981 42 HD11 ILE 5 3HD1 ILE 5 1.481 -9.510 -5.582 43 HD12 ILE 5 1HD1 ILE 5 0.737 -10.913 -4.816 44 HD13 ILE 5 2HD1 ILE 5 -0.179 -9.416 -4.993 45 H VAL 6 H VAL 6 1.553 -10.724 0.722 46 HA VAL 6 HA VAL 6 3.627 -12.770 1.184 47 HB VAL 6 HB VAL 6 1.910 -11.514 3.323 48 HG11 VAL 6 1HG1 VAL 6 3.993 -12.374 4.659 49 HG12 VAL 6 2HG1 VAL 6 2.693 -13.482 4.216 50 HG13 VAL 6 3HG1 VAL 6 4.183 -13.445 3.271 51 HG21 VAL 6 3HG2 VAL 6 3.122 -9.658 2.855 52 HG22 VAL 6 1HG2 VAL 6 4.338 -10.494 3.821 53 HG23 VAL 6 2HG2 VAL 6 4.409 -10.564 2.060 54 H TRP 7 H TRP 7 2.956 -14.795 1.006 55 HA TRP 7 HA TRP 7 0.077 -15.351 1.211 56 HB2 TRP 7 2HB TRP 7 2.313 -16.811 -0.198 57 HB3 TRP 7 3HB TRP 7 0.706 -17.499 0.013 58 HD1 TRP 7 HD1 TRP 7 -0.058 -14.050 -0.522 59 HE1 TRP 7 HE1 TRP 7 -0.536 -13.521 -2.995 60 HE3 TRP 7 HE3 TRP 7 1.905 -18.265 -2.646 61 HZ2 TRP 7 HZ2 TRP 7 -0.135 -14.732 -5.513 62 HZ3 TRP 7 HZ3 TRP 7 1.817 -18.503 -5.094 63 HH2 TRP 7 HH2 TRP 7 0.818 -16.772 -6.496 64 H VAL 8 H VAL 8 -0.608 -17.320 2.260 65 HA VAL 8 HA VAL 8 1.307 -18.470 4.157 66 HB VAL 8 HB VAL 8 -1.404 -17.395 4.949 67 HG11 VAL 8 1HG1 VAL 8 -0.787 -18.099 7.219 68 HG12 VAL 8 2HG1 VAL 8 -0.897 -19.469 6.112 69 HG13 VAL 8 3HG1 VAL 8 0.682 -18.838 6.582 70 HG21 VAL 8 3HG2 VAL 8 -0.269 -15.749 6.213 71 HG22 VAL 8 1HG2 VAL 8 1.292 -16.532 5.967 72 HG23 VAL 8 2HG2 VAL 8 0.482 -15.737 4.617 73 H VAL 9 H VAL 9 0.861 -20.575 4.797 74 HA VAL 9 HA VAL 9 -1.549 -21.858 3.748 75 HB VAL 9 HB VAL 9 0.236 -22.118 2.025 76 HG11 VAL 9 1HG1 VAL 9 2.119 -22.207 3.663 77 HG12 VAL 9 2HG1 VAL 9 1.612 -23.847 4.075 78 HG13 VAL 9 3HG1 VAL 9 2.160 -23.477 2.440 79 HG21 VAL 9 3HG2 VAL 9 -1.336 -24.196 3.281 80 HG22 VAL 9 1HG2 VAL 9 -1.044 -23.882 1.570 81 HG23 VAL 9 2HG2 VAL 9 0.099 -24.855 2.496 82 H ASP 10 H ASP 10 -2.391 -23.255 5.158 83 HA ASP 10 HA ASP 10 -0.742 -24.780 6.964 84 HB2 ASP 10 2HB ASP 10 -1.590 -23.913 9.021 85 HB3 ASP 10 3HB ASP 10 -1.021 -22.534 8.084 86 H ASP 11 H ASP 11 -2.619 -25.607 8.774 87 HA ASP 11 HA ASP 11 -4.777 -26.704 7.096 88 HB2 ASP 11 2HB ASP 11 -2.717 -28.211 7.944 89 HB3 ASP 11 3HB ASP 11 -3.770 -28.353 9.349 90 H ASP 12 H ASP 12 -4.119 -24.737 9.601 91 HA ASP 12 HA ASP 12 -6.516 -25.510 11.125 92 HB2 ASP 12 2HB ASP 12 -3.903 -24.553 11.915 93 HB3 ASP 12 3HB ASP 12 -5.167 -23.495 12.534 94 H SER 13 H SER 13 -8.011 -23.884 11.753 95 HA SER 13 HA SER 13 -8.450 -21.916 9.710 96 HB2 SER 13 2HB SER 13 -10.106 -23.324 11.373 97 HB3 SER 13 3HB SER 13 -10.101 -21.737 12.142 98 HG SER 13 HG SER 13 -10.904 -20.838 10.307 99 H SER 14 H SER 14 -7.749 -21.810 13.192 100 HA SER 14 HA SER 14 -7.622 -18.958 13.286 101 HB2 SER 14 2HB SER 14 -6.856 -19.248 15.567 102 HB3 SER 14 3HB SER 14 -8.162 -20.392 15.259 103 HG SER 14 HG SER 14 -5.507 -20.850 15.814 104 H ILE 15 H ILE 15 -5.220 -21.551 13.113 105 HA ILE 15 HA ILE 15 -2.891 -20.115 13.441 106 HB ILE 15 HB ILE 15 -3.439 -22.457 11.621 107 HG12 ILE 15 2HG1 ILE 15 -3.730 -22.942 13.984 108 HG13 ILE 15 3HG1 ILE 15 -2.255 -23.710 13.407 109 HG21 ILE 15 1HG2 ILE 15 -1.056 -20.796 11.886 110 HG22 ILE 15 2HG2 ILE 15 -0.752 -22.511 12.154 111 HG23 ILE 15 3HG2 ILE 15 -1.487 -21.972 10.645 112 HD11 ILE 15 3HD1 ILE 15 -2.618 -21.818 15.526 113 HD12 ILE 15 1HD1 ILE 15 -1.191 -22.759 15.093 114 HD13 ILE 15 2HD1 ILE 15 -1.479 -21.193 14.334 115 H ARG 16 H ARG 16 -4.893 -20.432 10.554 116 HA ARG 16 HA ARG 16 -3.060 -18.912 8.922 117 HB2 ARG 16 2HB ARG 16 -4.376 -19.490 7.139 118 HB3 ARG 16 3HB ARG 16 -4.811 -20.783 8.248 119 HG2 ARG 16 2HG ARG 16 -6.673 -19.040 8.962 120 HG3 ARG 16 3HG ARG 16 -6.399 -18.462 7.317 121 HD2 ARG 16 2HD ARG 16 -6.544 -21.306 7.271 122 HD3 ARG 16 3HD ARG 16 -7.927 -20.690 8.175 123 HE ARG 16 HE ARG 16 -7.920 -19.133 5.978 124 HH11 ARG 16 1HH1 ARG 16 -7.771 -22.582 6.429 125 HH12 ARG 16 2HH1 ARG 16 -8.576 -22.943 4.938 126 HH21 ARG 16 1HH2 ARG 16 -8.981 -19.595 4.012 127 HH22 ARG 16 2HH2 ARG 16 -9.263 -21.243 3.563 128 H TRP 17 H TRP 17 -5.749 -18.277 10.979 129 HA TRP 17 HA TRP 17 -6.546 -15.797 9.830 130 HB2 TRP 17 2HB TRP 17 -8.181 -16.783 11.181 131 HB3 TRP 17 3HB TRP 17 -7.034 -17.149 12.467 132 HD1 TRP 17 HD1 TRP 17 -9.168 -14.290 11.082 133 HE1 TRP 17 HE1 TRP 17 -9.314 -12.436 12.861 134 HE3 TRP 17 HE3 TRP 17 -5.803 -16.139 14.457 135 HZ2 TRP 17 HZ2 TRP 17 -8.154 -11.837 15.364 136 HZ3 TRP 17 HZ3 TRP 17 -5.378 -14.864 16.518 137 HH2 TRP 17 HH2 TRP 17 -6.530 -12.757 16.960 138 H VAL 18 H VAL 18 -4.555 -16.619 12.666 139 HA VAL 18 HA VAL 18 -3.925 -14.133 13.606 140 HB VAL 18 HB VAL 18 -1.866 -15.035 14.482 141 HG11 VAL 18 1HG1 VAL 18 -3.888 -15.768 15.580 142 HG12 VAL 18 2HG1 VAL 18 -4.069 -17.095 14.431 143 HG13 VAL 18 3HG1 VAL 18 -2.718 -17.086 15.565 144 HG21 VAL 18 3HG2 VAL 18 -2.124 -16.865 12.185 145 HG22 VAL 18 1HG2 VAL 18 -0.682 -16.211 12.962 146 HG23 VAL 18 2HG2 VAL 18 -1.523 -17.586 13.679 147 H LEU 19 H LEU 19 -2.656 -15.724 10.747 148 HA LEU 19 HA LEU 19 -0.700 -13.642 10.269 149 HB2 LEU 19 2HB LEU 19 -1.450 -16.212 8.972 150 HB3 LEU 19 3HB LEU 19 -0.608 -15.003 8.005 151 HG LEU 19 HG LEU 19 0.477 -16.009 10.624 152 HD11 LEU 19 1HD1 LEU 19 0.130 -17.906 9.086 153 HD12 LEU 19 2HD1 LEU 19 1.835 -17.577 9.394 154 HD13 LEU 19 3HD1 LEU 19 1.100 -17.071 7.873 155 HD21 LEU 19 3HD2 LEU 19 1.958 -14.878 8.269 156 HD22 LEU 19 1HD2 LEU 19 2.505 -15.053 9.936 157 HD23 LEU 19 2HD2 LEU 19 1.280 -13.850 9.533 158 H GLU 20 H GLU 20 -3.846 -14.636 9.051 159 HA GLU 20 HA GLU 20 -3.940 -12.930 6.809 160 HB2 GLU 20 2HB GLU 20 -5.596 -14.852 7.920 161 HB3 GLU 20 3HB GLU 20 -6.524 -13.369 8.088 162 HG2 GLU 20 2HG GLU 20 -5.255 -13.954 5.467 163 HG3 GLU 20 3HG GLU 20 -6.692 -14.862 5.934 164 H ARG 21 H ARG 21 -5.172 -12.516 10.119 165 HA ARG 21 HA ARG 21 -6.255 -9.953 9.754 166 HB2 ARG 21 2HB ARG 21 -6.240 -9.781 12.184 167 HB3 ARG 21 3HB ARG 21 -6.770 -11.383 11.689 168 HG2 ARG 21 2HG ARG 21 -4.837 -12.400 12.433 169 HG3 ARG 21 3HG ARG 21 -3.902 -10.906 12.361 170 HD2 ARG 21 2HD ARG 21 -6.177 -10.806 14.198 171 HD3 ARG 21 3HD ARG 21 -4.959 -12.005 14.630 172 HE ARG 21 HE ARG 21 -3.554 -9.713 14.085 173 HH11 ARG 21 1HH1 ARG 21 -6.097 -10.627 16.281 174 HH12 ARG 21 2HH1 ARG 21 -5.624 -9.496 17.505 175 HH21 ARG 21 1HH2 ARG 21 -2.922 -8.220 15.689 176 HH22 ARG 21 2HH2 ARG 21 -3.819 -8.126 17.167 177 H ALA 22 H ALA 22 -3.000 -11.030 10.140 178 HA ALA 22 HA ALA 22 -1.878 -8.592 11.082 179 HB1 ALA 22 1HB ALA 22 -0.878 -11.178 10.117 180 HB2 ALA 22 2HB ALA 22 0.195 -9.808 9.825 181 HB3 ALA 22 3HB ALA 22 -0.335 -10.179 11.465 182 H LEU 23 H LEU 23 -1.700 -10.119 7.858 183 HA LEU 23 HA LEU 23 -0.667 -7.807 6.590 184 HB2 LEU 23 2HB LEU 23 -2.163 -10.069 5.282 185 HB3 LEU 23 3HB LEU 23 -1.005 -8.975 4.528 186 HG LEU 23 HG LEU 23 -0.231 -10.895 6.712 187 HD11 LEU 23 1HD1 LEU 23 -1.070 -12.304 5.009 188 HD12 LEU 23 2HD1 LEU 23 0.682 -12.279 4.812 189 HD13 LEU 23 3HD1 LEU 23 -0.338 -11.324 3.737 190 HD21 LEU 23 3HD2 LEU 23 1.898 -10.247 6.335 191 HD22 LEU 23 1HD2 LEU 23 1.116 -8.775 5.758 192 HD23 LEU 23 2HD2 LEU 23 1.636 -10.007 4.607 193 H ALA 24 H ALA 24 -3.916 -9.037 7.096 194 HA ALA 24 HA ALA 24 -5.374 -7.536 5.301 195 HB1 ALA 24 1HB ALA 24 -6.644 -9.070 6.453 196 HB2 ALA 24 2HB ALA 24 -5.973 -8.612 8.019 197 HB3 ALA 24 3HB ALA 24 -7.144 -7.562 7.220 198 H GLY 25 H GLY 25 -3.877 -6.532 8.307 199 HA2 GLY 25 2HA GLY 25 -5.184 -3.939 8.267 200 HA3 GLY 25 3HA GLY 25 -4.008 -4.498 9.447 201 H ALA 26 H ALA 26 -2.241 -5.339 7.123 202 HA ALA 26 HA ALA 26 -0.995 -2.715 6.778 203 HB1 ALA 26 1HB ALA 26 0.039 -5.519 6.438 204 HB2 ALA 26 2HB ALA 26 0.956 -4.091 5.957 205 HB3 ALA 26 3HB ALA 26 0.507 -4.323 7.646 206 H GLY 27 H GLY 27 0.236 -2.498 4.605 207 HA2 GLY 27 2HA GLY 27 -1.771 -2.730 2.516 208 HA3 GLY 27 3HA GLY 27 -0.261 -1.837 2.419 209 H LEU 28 H LEU 28 -0.964 -5.252 3.131 210 HA LEU 28 HA LEU 28 0.549 -5.995 0.726 211 HB2 LEU 28 2HB LEU 28 0.943 -7.842 2.930 212 HB3 LEU 28 3HB LEU 28 2.120 -7.121 1.835 213 HG LEU 28 HG LEU 28 1.001 -5.689 4.238 214 HD11 LEU 28 1HD1 LEU 28 3.761 -6.629 4.375 215 HD12 LEU 28 2HD1 LEU 28 2.567 -7.926 4.378 216 HD13 LEU 28 3HD1 LEU 28 2.489 -6.653 5.596 217 HD21 LEU 28 3HD2 LEU 28 3.546 -4.773 3.595 218 HD22 LEU 28 1HD2 LEU 28 2.015 -3.953 3.288 219 HD23 LEU 28 2HD2 LEU 28 2.736 -4.971 2.041 220 H THR 29 H THR 29 -0.263 -7.682 -0.401 221 HA THR 29 HA THR 29 -2.898 -8.484 -0.083 222 HB THR 29 HB THR 29 -0.683 -9.980 -1.499 223 HG1 THR 29 HG1 THR 29 -1.140 -7.774 -2.201 224 HG21 THR 29 3HG2 THR 29 -3.685 -10.229 -1.633 225 HG22 THR 29 1HG2 THR 29 -2.515 -11.479 -1.212 226 HG23 THR 29 2HG2 THR 29 -2.603 -10.874 -2.866 227 H CYS 30 H CYS 30 -3.881 -10.386 0.649 228 HA CYS 30 HA CYS 30 -2.235 -12.067 2.418 229 HB2 CYS 30 2HB CYS 30 -4.316 -12.223 3.881 230 HB3 CYS 30 3HB CYS 30 -3.449 -10.692 3.913 231 HG CYS 30 HG CYS 30 -5.312 -9.658 1.877 232 H THR 31 H THR 31 -2.128 -13.965 1.398 233 HA THR 31 HA THR 31 -4.638 -15.123 0.371 234 HB THR 31 HB THR 31 -1.903 -15.845 -0.670 235 HG1 THR 31 HG1 THR 31 -3.720 -13.873 -1.642 236 HG21 THR 31 3HG2 THR 31 -3.047 -16.888 -2.439 237 HG22 THR 31 1HG2 THR 31 -4.558 -16.062 -2.064 238 HG23 THR 31 2HG2 THR 31 -3.960 -17.333 -0.998 239 H THR 32 H THR 32 -5.307 -16.650 1.727 240 HA THR 32 HA THR 32 -3.313 -18.297 3.122 241 HB THR 32 HB THR 32 -4.950 -18.802 4.762 242 HG1 THR 32 HG1 THR 32 -6.909 -17.458 3.192 243 HG21 THR 32 3HG2 THR 32 -4.832 -16.795 5.733 244 HG22 THR 32 1HG2 THR 32 -5.936 -16.091 4.553 245 HG23 THR 32 2HG2 THR 32 -4.208 -16.172 4.206 246 H PHE 33 H PHE 33 -3.059 -20.377 2.620 247 HA PHE 33 HA PHE 33 -5.052 -21.624 0.847 248 HB2 PHE 33 2HB PHE 33 -2.081 -22.129 1.094 249 HB3 PHE 33 3HB PHE 33 -3.169 -23.104 0.112 250 HD1 PHE 33 HD2 PHE 33 -4.109 -22.237 -1.941 251 HD2 PHE 33 HD1 PHE 33 -1.471 -19.888 0.435 252 HE1 PHE 33 HE2 PHE 33 -3.808 -20.679 -3.821 253 HE2 PHE 33 HE1 PHE 33 -1.167 -18.326 -1.442 254 HZ PHE 33 HZ PHE 33 -2.334 -18.721 -3.574 255 H GLU 34 H GLU 34 -4.432 -24.227 0.995 256 HA GLU 34 HA GLU 34 -4.553 -24.935 3.846 257 HB2 GLU 34 2HB GLU 34 -6.341 -26.532 3.401 258 HB3 GLU 34 3HB GLU 34 -6.841 -24.907 2.955 259 HG2 GLU 34 2HG GLU 34 -6.210 -25.486 0.588 260 HG3 GLU 34 3HG GLU 34 -6.036 -27.153 1.132 261 H ASN 35 H ASN 35 -3.941 -25.965 0.532 262 HA ASN 35 HA ASN 35 -2.407 -28.255 1.564 263 HB2 ASN 35 2HB ASN 35 -4.238 -27.974 -0.633 264 HB3 ASN 35 3HB ASN 35 -2.656 -28.445 -1.247 265 HD21 ASN 35 1HD2 ASN 35 -5.094 -29.981 -1.206 266 HD22 ASN 35 2HD2 ASN 35 -4.768 -31.404 -0.282 267 H GLY 36 H GLY 36 -0.265 -28.130 1.505 268 HA2 GLY 36 2HA GLY 36 1.196 -25.939 0.682 269 HA3 GLY 36 3HA GLY 36 1.865 -27.554 0.864 270 H ASN 37 H ASN 37 0.622 -28.937 -1.144 271 HA ASN 37 HA ASN 37 2.167 -28.294 -3.380 272 HB2 ASN 37 2HB ASN 37 1.472 -30.530 -3.244 273 HB3 ASN 37 3HB ASN 37 -0.210 -30.088 -2.970 274 HD21 ASN 37 1HD2 ASN 37 2.299 -30.513 -5.323 275 HD22 ASN 37 2HD2 ASN 37 1.283 -30.453 -6.719 276 H GLU 38 H GLU 38 -0.933 -27.151 -2.371 277 HA GLU 38 HA GLU 38 -1.759 -26.197 -4.951 278 HB2 GLU 38 2HB GLU 38 -3.044 -26.665 -2.563 279 HB3 GLU 38 3HB GLU 38 -2.977 -24.909 -2.618 280 HG2 GLU 38 2HG GLU 38 -4.271 -24.788 -4.533 281 HG3 GLU 38 3HG GLU 38 -3.936 -26.458 -4.986 282 H VAL 39 H VAL 39 0.390 -25.106 -2.568 283 HA VAL 39 HA VAL 39 0.120 -22.289 -3.236 284 HB VAL 39 HB VAL 39 2.298 -23.474 -1.534 285 HG11 VAL 39 1HG1 VAL 39 1.971 -20.954 -2.386 286 HG12 VAL 39 2HG1 VAL 39 0.992 -20.896 -0.919 287 HG13 VAL 39 3HG1 VAL 39 2.691 -21.360 -0.829 288 HG21 VAL 39 3HG2 VAL 39 0.213 -24.375 -0.680 289 HG22 VAL 39 1HG2 VAL 39 0.833 -23.140 0.416 290 HG23 VAL 39 2HG2 VAL 39 -0.505 -22.764 -0.670 291 H LEU 40 H LEU 40 2.422 -24.933 -3.697 292 HA LEU 40 HA LEU 40 4.551 -23.579 -4.806 293 HB2 LEU 40 2HB LEU 40 5.018 -25.788 -4.506 294 HB3 LEU 40 3HB LEU 40 3.440 -26.312 -5.091 295 HG LEU 40 HG LEU 40 4.147 -25.998 -7.385 296 HD11 LEU 40 1HD1 LEU 40 6.284 -24.486 -6.121 297 HD12 LEU 40 2HD1 LEU 40 5.669 -24.419 -7.773 298 HD13 LEU 40 3HD1 LEU 40 6.874 -25.628 -7.329 299 HD21 LEU 40 3HD2 LEU 40 6.508 -27.455 -6.640 300 HD22 LEU 40 1HD2 LEU 40 5.012 -28.042 -7.365 301 HD23 LEU 40 2HD2 LEU 40 5.151 -27.917 -5.611 302 H ALA 41 H ALA 41 1.661 -24.816 -6.460 303 HA ALA 41 HA ALA 41 2.440 -23.893 -9.035 304 HB1 ALA 41 1HB ALA 41 -0.138 -24.878 -7.867 305 HB2 ALA 41 2HB ALA 41 -0.068 -24.230 -9.506 306 HB3 ALA 41 3HB ALA 41 0.901 -25.639 -9.073 307 H ALA 42 H ALA 42 0.777 -22.454 -6.337 308 HA ALA 42 HA ALA 42 -0.538 -20.348 -7.629 309 HB1 ALA 42 1HB ALA 42 -0.723 -19.320 -5.501 310 HB2 ALA 42 2HB ALA 42 -0.801 -21.062 -5.228 311 HB3 ALA 42 3HB ALA 42 0.689 -20.182 -4.886 312 H LEU 43 H LEU 43 2.784 -20.642 -6.470 313 HA LEU 43 HA LEU 43 3.595 -17.993 -6.771 314 HB2 LEU 43 2HB LEU 43 5.431 -20.251 -7.443 315 HB3 LEU 43 3HB LEU 43 5.773 -18.754 -6.578 316 HG LEU 43 HG LEU 43 4.411 -21.228 -5.539 317 HD11 LEU 43 1HD1 LEU 43 6.247 -20.759 -3.752 318 HD12 LEU 43 2HD1 LEU 43 6.993 -19.816 -5.042 319 HD13 LEU 43 3HD1 LEU 43 6.677 -21.535 -5.277 320 HD21 LEU 43 3HD2 LEU 43 4.010 -18.470 -4.759 321 HD22 LEU 43 1HD2 LEU 43 4.670 -19.434 -3.438 322 HD23 LEU 43 2HD2 LEU 43 3.171 -19.928 -4.226 323 H ALA 44 H ALA 44 3.323 -20.588 -9.130 324 HA ALA 44 HA ALA 44 4.681 -19.321 -11.250 325 HB1 ALA 44 1HB ALA 44 3.628 -21.786 -10.880 326 HB2 ALA 44 2HB ALA 44 2.448 -21.084 -11.988 327 HB3 ALA 44 3HB ALA 44 4.151 -21.153 -12.441 328 H SER 45 H SER 45 1.740 -18.585 -9.770 329 HA SER 45 HA SER 45 0.362 -17.556 -12.063 330 HB2 SER 45 2HB SER 45 -0.809 -18.337 -10.006 331 HB3 SER 45 3HB SER 45 -0.132 -16.960 -9.136 332 HG SER 45 HG SER 45 -2.277 -17.066 -10.787 333 H LYS 46 H LYS 46 1.388 -15.784 -9.152 334 HA LYS 46 HA LYS 46 2.309 -13.605 -10.909 335 HB2 LYS 46 2HB LYS 46 1.601 -12.066 -9.010 336 HB3 LYS 46 3HB LYS 46 0.307 -12.792 -9.954 337 HG2 LYS 46 2HG LYS 46 -0.570 -13.715 -8.145 338 HG3 LYS 46 3HG LYS 46 0.966 -14.480 -7.730 339 HD2 LYS 46 2HD LYS 46 0.494 -11.573 -7.169 340 HD3 LYS 46 3HD LYS 46 -0.089 -12.815 -6.058 341 HE2 LYS 46 2HE LYS 46 1.934 -12.813 -5.134 342 HE3 LYS 46 3HE LYS 46 2.541 -13.536 -6.622 343 HZ1 LYS 46 3HZ LYS 46 2.280 -10.759 -6.981 344 HZ2 LYS 46 1HZ LYS 46 3.683 -11.702 -7.031 345 HZ3 LYS 46 2HZ LYS 46 3.161 -11.040 -5.565 346 H THR 47 H THR 47 3.093 -15.806 -8.499 347 HA THR 47 HA THR 47 4.946 -16.154 -7.224 348 HB THR 47 HB THR 47 6.660 -14.067 -8.294 349 HG1 THR 47 HG1 THR 47 6.607 -15.099 -10.464 350 HG21 THR 47 3HG2 THR 47 7.179 -16.809 -9.120 351 HG22 THR 47 1HG2 THR 47 6.884 -16.668 -7.388 352 HG23 THR 47 2HG2 THR 47 8.164 -15.719 -8.145 353 HA PRO 48 HA PRO 48 4.074 -12.873 -4.255 354 HB2 PRO 48 2HB PRO 48 4.719 -14.369 -2.083 355 HB3 PRO 48 3HB PRO 48 3.159 -14.492 -2.905 356 HG2 PRO 48 2HG PRO 48 5.573 -16.245 -3.149 357 HG3 PRO 48 3HG PRO 48 3.864 -16.704 -3.038 358 HD2 PRO 48 2HD PRO 48 5.207 -16.645 -5.389 359 HD3 PRO 48 3HD PRO 48 3.475 -16.277 -5.270 360 H ASP 49 H ASP 49 5.432 -12.235 -2.189 361 HA ASP 49 HA ASP 49 8.247 -12.092 -3.047 362 HB2 ASP 49 2HB ASP 49 6.435 -10.120 -1.706 363 HB3 ASP 49 3HB ASP 49 8.171 -10.028 -1.421 364 H VAL 50 H VAL 50 6.238 -13.496 -0.810 365 HA VAL 50 HA VAL 50 8.316 -14.605 0.711 366 HB VAL 50 HB VAL 50 8.536 -12.389 1.700 367 HG11 VAL 50 1HG1 VAL 50 5.932 -12.450 3.062 368 HG12 VAL 50 2HG1 VAL 50 6.829 -11.091 2.384 369 HG13 VAL 50 3HG1 VAL 50 5.866 -12.126 1.330 370 HG21 VAL 50 3HG2 VAL 50 8.154 -14.790 3.083 371 HG22 VAL 50 1HG2 VAL 50 9.011 -13.355 3.646 372 HG23 VAL 50 2HG2 VAL 50 7.300 -13.563 4.020 373 H LEU 51 H LEU 51 7.593 -16.387 1.738 374 HA LEU 51 HA LEU 51 4.676 -16.679 2.049 375 HB2 LEU 51 2HB LEU 51 6.430 -18.186 0.483 376 HB3 LEU 51 3HB LEU 51 6.089 -19.190 1.892 377 HG LEU 51 HG LEU 51 3.755 -17.972 0.542 378 HD11 LEU 51 1HD1 LEU 51 3.712 -19.547 -1.250 379 HD12 LEU 51 2HD1 LEU 51 5.185 -20.326 -0.674 380 HD13 LEU 51 3HD1 LEU 51 5.251 -18.688 -1.323 381 HD21 LEU 51 3HD2 LEU 51 4.242 -19.946 2.454 382 HD22 LEU 51 1HD2 LEU 51 3.712 -20.813 1.013 383 HD23 LEU 51 2HD2 LEU 51 2.698 -19.545 1.701 384 H LEU 52 H LEU 52 3.976 -18.128 3.765 385 HA LEU 52 HA LEU 52 5.937 -18.504 5.915 386 HB2 LEU 52 2HB LEU 52 3.273 -17.126 6.116 387 HB3 LEU 52 3HB LEU 52 4.101 -17.795 7.520 388 HG LEU 52 HG LEU 52 6.053 -16.276 6.873 389 HD11 LEU 52 1HD1 LEU 52 4.763 -14.172 5.719 390 HD12 LEU 52 2HD1 LEU 52 4.064 -15.542 4.857 391 HD13 LEU 52 3HD1 LEU 52 5.812 -15.307 4.870 392 HD21 LEU 52 3HD2 LEU 52 3.989 -15.958 8.586 393 HD22 LEU 52 1HD2 LEU 52 3.802 -14.519 7.584 394 HD23 LEU 52 2HD2 LEU 52 5.324 -14.816 8.425 395 H SER 53 H SER 53 5.833 -20.719 5.159 396 HA SER 53 HA SER 53 3.444 -22.229 5.180 397 HB2 SER 53 2HB SER 53 4.778 -24.079 4.733 398 HB3 SER 53 3HB SER 53 5.800 -22.763 4.155 399 HG SER 53 HG SER 53 6.974 -22.877 6.059 400 H ASP 54 H ASP 54 2.416 -23.331 6.756 401 HA ASP 54 HA ASP 54 3.320 -22.878 9.496 402 HB2 ASP 54 2HB ASP 54 0.976 -22.323 8.831 403 HB3 ASP 54 3HB ASP 54 0.698 -24.037 8.535 404 H ILE 55 H ILE 55 3.145 -25.358 7.141 405 HA ILE 55 HA ILE 55 3.557 -27.600 7.174 406 HB ILE 55 HB ILE 55 5.248 -26.834 9.557 407 HG12 ILE 55 2HG1 ILE 55 6.026 -27.132 6.649 408 HG13 ILE 55 3HG1 ILE 55 5.740 -25.590 7.449 409 HG21 ILE 55 1HG2 ILE 55 4.822 -29.364 8.126 410 HG22 ILE 55 2HG2 ILE 55 6.509 -28.927 8.392 411 HG23 ILE 55 3HG2 ILE 55 5.408 -29.067 9.762 412 HD11 ILE 55 3HD1 ILE 55 7.931 -27.570 7.982 413 HD12 ILE 55 1HD1 ILE 55 8.074 -25.914 7.394 414 HD13 ILE 55 2HD1 ILE 55 7.567 -26.220 9.056 415 H ARG 56 H ARG 56 1.327 -28.028 7.765 416 HA ARG 56 HA ARG 56 1.159 -29.709 10.077 417 HB2 ARG 56 2HB ARG 56 0.240 -26.965 10.260 418 HB3 ARG 56 3HB ARG 56 -1.081 -28.097 10.518 419 HG2 ARG 56 2HG ARG 56 -0.210 -28.891 12.460 420 HG3 ARG 56 3HG ARG 56 1.458 -28.608 11.957 421 HD2 ARG 56 2HD ARG 56 1.222 -26.242 12.339 422 HD3 ARG 56 3HD ARG 56 -0.497 -26.431 12.680 423 HE ARG 56 HE ARG 56 1.238 -27.944 14.416 424 HH11 ARG 56 1HH1 ARG 56 -0.391 -24.913 13.888 425 HH12 ARG 56 2HH1 ARG 56 -0.389 -24.471 15.563 426 HH21 ARG 56 1HH2 ARG 56 1.246 -27.374 16.624 427 HH22 ARG 56 2HH2 ARG 56 0.543 -25.871 17.118 428 H MET 57 H MET 57 0.754 -29.687 7.120 429 HA MET 57 HA MET 57 -2.062 -30.540 7.027 430 HB2 MET 57 2HB MET 57 -1.689 -30.348 4.494 431 HB3 MET 57 3HB MET 57 -1.807 -28.856 5.417 432 HG2 MET 57 2HG MET 57 0.921 -29.839 5.189 433 HG3 MET 57 3HG MET 57 0.169 -29.503 3.631 434 HE1 MET 57 3HE MET 57 1.987 -27.400 3.128 435 HE2 MET 57 1HE MET 57 2.490 -26.404 4.495 436 HE3 MET 57 2HE MET 57 2.700 -28.154 4.555 437 HA PRO 58 HA PRO 58 -0.918 -34.719 6.332 438 HB2 PRO 58 2HB PRO 58 -2.852 -35.535 4.610 439 HB3 PRO 58 3HB PRO 58 -3.162 -35.214 6.320 440 HG2 PRO 58 2HG PRO 58 -3.669 -33.466 3.944 441 HG3 PRO 58 3HG PRO 58 -4.704 -33.768 5.352 442 HD2 PRO 58 2HD PRO 58 -3.191 -31.536 5.109 443 HD3 PRO 58 3HD PRO 58 -3.546 -32.282 6.680 444 H GLY 59 H GLY 59 -1.506 -32.744 3.461 445 HA2 GLY 59 2HA GLY 59 -0.546 -34.389 1.464 446 HA3 GLY 59 3HA GLY 59 -0.385 -32.639 1.458 447 H MET 60 H MET 60 1.538 -31.687 2.219 448 HA MET 60 HA MET 60 3.839 -33.482 2.049 449 HB2 MET 60 2HB MET 60 3.352 -30.619 1.491 450 HB3 MET 60 3HB MET 60 4.933 -31.009 2.155 451 HG2 MET 60 2HG MET 60 5.021 -30.978 -0.253 452 HG3 MET 60 3HG MET 60 5.293 -32.613 0.345 453 HE1 MET 60 3HE MET 60 1.799 -30.844 0.255 454 HE2 MET 60 1HE MET 60 2.601 -30.158 -1.158 455 HE3 MET 60 2HE MET 60 1.230 -31.247 -1.366 456 H ASP 61 H ASP 61 5.405 -33.634 3.628 457 HA ASP 61 HA ASP 61 4.609 -33.420 6.295 458 HB2 ASP 61 2HB ASP 61 6.681 -34.625 5.004 459 HB3 ASP 61 3HB ASP 61 7.516 -33.303 5.814 460 H GLY 62 H GLY 62 5.955 -31.071 4.164 461 HA2 GLY 62 2HA GLY 62 5.432 -28.762 5.171 462 HA3 GLY 62 3HA GLY 62 6.550 -29.279 6.424 463 H LEU 63 H LEU 63 8.696 -30.184 5.404 464 HA LEU 63 HA LEU 63 9.799 -27.988 3.888 465 HB2 LEU 63 2HB LEU 63 11.906 -29.508 4.111 466 HB3 LEU 63 3HB LEU 63 11.283 -28.630 5.507 467 HG LEU 63 HG LEU 63 10.276 -30.642 6.379 468 HD11 LEU 63 1HD1 LEU 63 11.028 -31.747 3.713 469 HD12 LEU 63 2HD1 LEU 63 9.524 -31.913 4.618 470 HD13 LEU 63 3HD1 LEU 63 10.955 -32.820 5.111 471 HD21 LEU 63 3HD2 LEU 63 13.153 -30.607 5.662 472 HD22 LEU 63 1HD2 LEU 63 12.495 -32.102 6.328 473 HD23 LEU 63 2HD2 LEU 63 12.376 -30.600 7.246 474 H ALA 64 H ALA 64 8.442 -31.007 3.182 475 HA ALA 64 HA ALA 64 9.877 -32.021 1.075 476 HB1 ALA 64 1HB ALA 64 7.293 -32.355 0.214 477 HB2 ALA 64 2HB ALA 64 8.148 -33.411 1.339 478 HB3 ALA 64 3HB ALA 64 7.099 -32.133 1.953 479 H LEU 65 H LEU 65 7.177 -29.705 0.754 480 HA LEU 65 HA LEU 65 7.894 -29.130 -1.978 481 HB2 LEU 65 2HB LEU 65 5.928 -27.929 -2.113 482 HB3 LEU 65 3HB LEU 65 5.544 -29.170 -0.921 483 HG LEU 65 HG LEU 65 6.360 -26.363 -0.188 484 HD11 LEU 65 1HD1 LEU 65 4.370 -25.711 -0.944 485 HD12 LEU 65 2HD1 LEU 65 3.677 -26.640 0.385 486 HD13 LEU 65 3HD1 LEU 65 3.836 -27.371 -1.212 487 HD21 LEU 65 3HD2 LEU 65 5.346 -26.959 1.966 488 HD22 LEU 65 1HD2 LEU 65 6.695 -28.019 1.558 489 HD23 LEU 65 2HD2 LEU 65 5.037 -28.588 1.364 490 H LEU 66 H LEU 66 8.558 -27.811 1.140 491 HA LEU 66 HA LEU 66 9.210 -25.167 0.338 492 HB2 LEU 66 2HB LEU 66 8.888 -26.418 2.723 493 HB3 LEU 66 3HB LEU 66 10.644 -26.286 2.650 494 HG LEU 66 HG LEU 66 9.889 -24.407 3.858 495 HD11 LEU 66 1HD1 LEU 66 10.364 -23.544 1.009 496 HD12 LEU 66 2HD1 LEU 66 11.607 -23.898 2.209 497 HD13 LEU 66 3HD1 LEU 66 10.526 -22.524 2.439 498 HD21 LEU 66 3HD2 LEU 66 7.647 -24.531 1.997 499 HD22 LEU 66 1HD2 LEU 66 8.230 -22.891 2.284 500 HD23 LEU 66 2HD2 LEU 66 7.725 -23.897 3.642 501 H LYS 67 H LYS 67 10.878 -28.185 0.194 502 HA LYS 67 HA LYS 67 13.534 -27.204 0.085 503 HB2 LYS 67 2HB LYS 67 12.178 -29.746 -0.244 504 HB3 LYS 67 3HB LYS 67 13.459 -29.551 -1.433 505 HG2 LYS 67 2HG LYS 67 14.580 -30.549 0.302 506 HG3 LYS 67 3HG LYS 67 14.890 -28.840 0.619 507 HD2 LYS 67 2HD LYS 67 13.118 -28.790 2.268 508 HD3 LYS 67 3HD LYS 67 12.690 -30.463 1.899 509 HE2 LYS 67 2HE LYS 67 14.192 -31.191 3.363 510 HE3 LYS 67 3HE LYS 67 15.473 -30.341 2.500 511 HZ1 LYS 67 3HZ LYS 67 15.417 -28.608 3.935 512 HZ2 LYS 67 1HZ LYS 67 14.856 -29.799 4.997 513 HZ3 LYS 67 2HZ LYS 67 13.761 -28.750 4.248 514 H GLN 68 H GLN 68 10.973 -27.423 -2.244 515 HA GLN 68 HA GLN 68 12.735 -27.005 -4.508 516 HB2 GLN 68 2HB GLN 68 10.922 -27.439 -5.853 517 HB3 GLN 68 3HB GLN 68 10.461 -28.325 -4.406 518 HG2 GLN 68 2HG GLN 68 9.357 -25.963 -3.827 519 HG3 GLN 68 3HG GLN 68 9.302 -25.883 -5.588 520 HE21 GLN 68 1HE2 GLN 68 7.163 -26.139 -3.568 521 HE22 GLN 68 2HE2 GLN 68 6.270 -27.546 -4.021 522 H ILE 69 H ILE 69 10.879 -25.126 -2.298 523 HA ILE 69 HA ILE 69 10.386 -22.833 -3.830 524 HB ILE 69 HB ILE 69 10.912 -23.062 -0.865 525 HG12 ILE 69 2HG1 ILE 69 8.339 -22.945 -2.455 526 HG13 ILE 69 3HG1 ILE 69 8.982 -24.362 -1.632 527 HG21 ILE 69 1HG2 ILE 69 9.753 -20.886 -0.707 528 HG22 ILE 69 2HG2 ILE 69 11.284 -20.787 -1.574 529 HG23 ILE 69 3HG2 ILE 69 9.763 -20.781 -2.467 530 HD11 ILE 69 3HD1 ILE 69 8.853 -22.407 0.334 531 HD12 ILE 69 1HD1 ILE 69 7.374 -22.206 -0.605 532 HD13 ILE 69 2HD1 ILE 69 7.757 -23.771 0.113 533 H LYS 70 H LYS 70 13.304 -24.070 -2.480 534 HA LYS 70 HA LYS 70 14.739 -21.589 -2.450 535 HB2 LYS 70 2HB LYS 70 15.842 -24.403 -2.472 536 HB3 LYS 70 3HB LYS 70 16.700 -22.944 -1.994 537 HG2 LYS 70 2HG LYS 70 14.198 -23.618 -0.548 538 HG3 LYS 70 3HG LYS 70 15.637 -24.587 -0.223 539 HD2 LYS 70 2HD LYS 70 16.404 -21.852 -0.248 540 HD3 LYS 70 3HD LYS 70 14.972 -22.009 0.772 541 HE2 LYS 70 2HE LYS 70 17.460 -23.697 1.012 542 HE3 LYS 70 3HE LYS 70 17.096 -22.293 2.013 543 HZ1 LYS 70 3HZ LYS 70 15.068 -23.444 2.752 544 HZ2 LYS 70 1HZ LYS 70 16.475 -24.288 3.165 545 HZ3 LYS 70 2HZ LYS 70 15.527 -24.810 1.866 546 H GLN 71 H GLN 71 14.822 -24.460 -4.561 547 HA GLN 71 HA GLN 71 16.595 -23.281 -6.446 548 HB2 GLN 71 2HB GLN 71 16.371 -25.717 -6.176 549 HB3 GLN 71 3HB GLN 71 14.720 -25.629 -6.774 550 HG2 GLN 71 2HG GLN 71 15.442 -25.830 -8.849 551 HG3 GLN 71 3HG GLN 71 16.415 -24.371 -8.670 552 HE21 GLN 71 1HE2 GLN 71 18.184 -25.017 -9.782 553 HE22 GLN 71 2HE2 GLN 71 19.205 -26.325 -9.303 554 H ARG 72 H ARG 72 13.101 -23.503 -6.167 555 HA ARG 72 HA ARG 72 12.619 -22.412 -8.788 556 HB2 ARG 72 2HB ARG 72 10.883 -23.136 -6.448 557 HB3 ARG 72 3HB ARG 72 10.229 -22.202 -7.787 558 HG2 ARG 72 2HG ARG 72 11.321 -24.169 -9.194 559 HG3 ARG 72 3HG ARG 72 11.068 -25.039 -7.679 560 HD2 ARG 72 2HD ARG 72 8.683 -24.116 -7.764 561 HD3 ARG 72 3HD ARG 72 9.034 -23.713 -9.445 562 HE ARG 72 HE ARG 72 8.502 -26.312 -8.370 563 HH11 ARG 72 1HH1 ARG 72 10.151 -24.573 -10.895 564 HH12 ARG 72 2HH1 ARG 72 10.147 -25.910 -11.998 565 HH21 ARG 72 1HH2 ARG 72 8.491 -28.080 -9.812 566 HH22 ARG 72 2HH2 ARG 72 9.202 -27.904 -11.381 567 H HIS 73 H HIS 73 12.751 -21.215 -5.489 568 HA HIS 73 HA HIS 73 12.829 -18.487 -6.517 569 HB2 HIS 73 2HB HIS 73 11.040 -19.141 -4.182 570 HB3 HIS 73 3HB HIS 73 11.123 -17.644 -5.107 571 HD1 HIS 73 HD1 HIS 73 9.891 -17.587 -7.383 572 HD2 HIS 73 HD2 HIS 73 9.467 -21.160 -5.305 573 HE1 HIS 73 HE1 HIS 73 8.027 -18.819 -8.537 574 HA PRO 74 HA PRO 74 15.973 -19.386 -3.230 575 HB2 PRO 74 2HB PRO 74 18.041 -18.256 -4.577 576 HB3 PRO 74 3HB PRO 74 17.553 -19.940 -4.804 577 HG2 PRO 74 2HG PRO 74 16.915 -17.541 -6.477 578 HG3 PRO 74 3HG PRO 74 17.385 -19.171 -6.992 579 HD2 PRO 74 2HD PRO 74 14.814 -18.321 -7.014 580 HD3 PRO 74 3HD PRO 74 15.259 -20.012 -6.704 581 H MET 75 H MET 75 15.615 -16.472 -5.242 582 HA MET 75 HA MET 75 16.636 -14.725 -3.216 583 HB2 MET 75 2HB MET 75 15.882 -12.917 -4.729 584 HB3 MET 75 3HB MET 75 16.873 -14.116 -5.548 585 HG2 MET 75 2HG MET 75 15.229 -14.706 -6.936 586 HG3 MET 75 3HG MET 75 14.012 -14.678 -5.661 587 HE1 MET 75 3HE MET 75 13.327 -11.209 -5.005 588 HE2 MET 75 1HE MET 75 12.041 -12.004 -5.912 589 HE3 MET 75 2HE MET 75 12.983 -12.918 -4.734 590 H LEU 76 H LEU 76 13.757 -16.347 -3.523 591 HA LEU 76 HA LEU 76 12.071 -14.264 -2.401 592 HB2 LEU 76 2HB LEU 76 11.182 -15.826 -4.077 593 HB3 LEU 76 3HB LEU 76 11.478 -17.165 -2.971 594 HG LEU 76 HG LEU 76 9.868 -15.966 -1.381 595 HD11 LEU 76 1HD1 LEU 76 9.834 -13.812 -2.496 596 HD12 LEU 76 2HD1 LEU 76 8.219 -14.520 -2.478 597 HD13 LEU 76 3HD1 LEU 76 9.180 -14.556 -3.956 598 HD21 LEU 76 3HD2 LEU 76 8.404 -16.823 -3.816 599 HD22 LEU 76 1HD2 LEU 76 8.179 -17.294 -2.132 600 HD23 LEU 76 2HD2 LEU 76 9.507 -17.979 -3.069 601 HA PRO 77 HA PRO 77 13.362 -15.537 1.701 602 HB2 PRO 77 2HB PRO 77 12.037 -13.550 2.992 603 HB3 PRO 77 3HB PRO 77 13.587 -13.301 2.178 604 HG2 PRO 77 2HG PRO 77 10.821 -12.683 1.215 605 HG3 PRO 77 3HG PRO 77 12.295 -11.706 1.086 606 HD2 PRO 77 2HD PRO 77 11.340 -13.181 -0.974 607 HD3 PRO 77 3HD PRO 77 13.075 -12.894 -0.728 608 H VAL 78 H VAL 78 12.404 -17.227 2.630 609 HA VAL 78 HA VAL 78 9.479 -17.159 3.003 610 HB VAL 78 HB VAL 78 11.184 -19.629 2.656 611 HG11 VAL 78 1HG1 VAL 78 9.382 -20.370 3.869 612 HG12 VAL 78 2HG1 VAL 78 8.293 -19.150 3.204 613 HG13 VAL 78 3HG1 VAL 78 8.764 -20.542 2.226 614 HG21 VAL 78 3HG2 VAL 78 9.264 -19.302 0.582 615 HG22 VAL 78 1HG2 VAL 78 10.214 -17.821 0.702 616 HG23 VAL 78 2HG2 VAL 78 11.022 -19.369 0.456 617 H ILE 79 H ILE 79 8.663 -18.258 4.896 618 HA ILE 79 HA ILE 79 10.638 -18.517 7.064 619 HB ILE 79 HB ILE 79 7.884 -17.376 7.491 620 HG12 ILE 79 2HG1 ILE 79 10.470 -15.843 7.143 621 HG13 ILE 79 3HG1 ILE 79 9.171 -15.913 5.958 622 HG21 ILE 79 1HG2 ILE 79 9.099 -18.398 9.407 623 HG22 ILE 79 2HG2 ILE 79 10.372 -17.200 9.180 624 HG23 ILE 79 3HG2 ILE 79 8.744 -16.684 9.619 625 HD11 ILE 79 3HD1 ILE 79 7.888 -15.100 8.248 626 HD12 ILE 79 1HD1 ILE 79 9.442 -14.272 8.331 627 HD13 ILE 79 2HD1 ILE 79 8.407 -14.065 6.918 628 H ILE 80 H ILE 80 10.239 -20.092 8.601 629 HA ILE 80 HA ILE 80 8.135 -22.019 7.882 630 HB ILE 80 HB ILE 80 10.622 -22.524 9.518 631 HG12 ILE 80 2HG1 ILE 80 10.946 -21.930 7.046 632 HG13 ILE 80 3HG1 ILE 80 11.646 -23.446 7.602 633 HG21 ILE 80 1HG2 ILE 80 9.911 -24.938 8.709 634 HG22 ILE 80 2HG2 ILE 80 9.233 -24.213 10.166 635 HG23 ILE 80 3HG2 ILE 80 8.316 -24.188 8.659 636 HD11 ILE 80 3HD1 ILE 80 10.111 -23.153 5.386 637 HD12 ILE 80 1HD1 ILE 80 10.351 -24.669 6.256 638 HD13 ILE 80 2HD1 ILE 80 8.921 -23.686 6.573 639 H MET 81 H MET 81 6.720 -22.790 9.403 640 HA MET 81 HA MET 81 6.880 -21.589 12.088 641 HB2 MET 81 2HB MET 81 4.670 -21.576 10.121 642 HB3 MET 81 3HB MET 81 4.214 -21.907 11.787 643 HG2 MET 81 2HG MET 81 4.614 -19.804 12.457 644 HG3 MET 81 3HG MET 81 6.025 -19.628 11.417 645 HE1 MET 81 3HE MET 81 2.512 -20.659 11.071 646 HE2 MET 81 1HE MET 81 1.660 -19.245 10.449 647 HE3 MET 81 2HE MET 81 2.376 -20.405 9.330 648 H THR 82 H THR 82 6.956 -23.045 13.658 649 HA THR 82 HA THR 82 5.300 -25.341 13.769 650 HB THR 82 HB THR 82 6.610 -26.547 12.308 651 HG1 THR 82 HG1 THR 82 7.093 -28.039 13.716 652 HG21 THR 82 3HG2 THR 82 9.303 -26.216 12.913 653 HG22 THR 82 1HG2 THR 82 8.630 -24.590 13.011 654 HG23 THR 82 2HG2 THR 82 8.444 -25.534 11.532 655 H ALA 83 H ALA 83 8.678 -25.085 14.811 656 HA ALA 83 HA ALA 83 9.591 -24.629 16.873 657 HB1 ALA 83 1HB ALA 83 7.050 -24.432 18.342 658 HB2 ALA 83 2HB ALA 83 8.461 -23.374 18.361 659 HB3 ALA 83 3HB ALA 83 7.280 -23.244 17.058 660 H HIS 84 H HIS 84 8.999 -27.221 15.885 661 HA HIS 84 HA HIS 84 9.428 -28.768 18.195 662 HB2 HIS 84 2HB HIS 84 7.365 -30.074 18.270 663 HB3 HIS 84 3HB HIS 84 7.026 -28.372 18.568 664 HD1 HIS 84 HD1 HIS 84 6.215 -31.163 16.311 665 HD2 HIS 84 HD2 HIS 84 5.731 -27.037 16.376 666 HE1 HIS 84 HE1 HIS 84 4.505 -30.659 14.537 667 H SER 85 H SER 85 10.968 -29.951 17.246 668 HA SER 85 HA SER 85 11.897 -31.606 15.977 669 HB2 SER 85 2HB SER 85 9.235 -32.301 16.012 670 HB3 SER 85 3HB SER 85 9.572 -32.189 14.285 671 HG SER 85 HG SER 85 10.972 -33.753 16.195 672 H ASP 86 H ASP 86 9.469 -30.047 13.877 673 HA ASP 86 HA ASP 86 10.836 -30.049 11.513 674 HB2 ASP 86 2HB ASP 86 8.860 -28.144 12.704 675 HB3 ASP 86 3HB ASP 86 9.629 -27.730 11.175 676 H LEU 87 H LEU 87 11.302 -27.897 14.248 677 HA LEU 87 HA LEU 87 13.034 -26.073 12.921 678 HB2 LEU 87 2HB LEU 87 11.998 -26.490 15.593 679 HB3 LEU 87 3HB LEU 87 13.695 -26.016 15.621 680 HG LEU 87 HG LEU 87 13.116 -24.013 14.285 681 HD11 LEU 87 1HD1 LEU 87 10.516 -25.359 14.232 682 HD12 LEU 87 2HD1 LEU 87 11.208 -24.176 13.123 683 HD13 LEU 87 3HD1 LEU 87 10.443 -23.640 14.619 684 HD21 LEU 87 3HD2 LEU 87 11.560 -24.320 16.851 685 HD22 LEU 87 1HD2 LEU 87 12.039 -22.797 16.102 686 HD23 LEU 87 2HD2 LEU 87 13.268 -23.899 16.723 687 H ASP 88 H ASP 88 13.614 -28.839 15.077 688 HA ASP 88 HA ASP 88 16.323 -28.770 15.356 689 HB2 ASP 88 2HB ASP 88 14.281 -30.765 15.568 690 HB3 ASP 88 3HB ASP 88 15.689 -31.477 14.784 691 H ALA 89 H ALA 89 14.521 -29.969 12.557 692 HA ALA 89 HA ALA 89 16.973 -30.581 11.126 693 HB1 ALA 89 1HB ALA 89 15.482 -32.163 10.494 694 HB2 ALA 89 2HB ALA 89 14.091 -31.102 10.719 695 HB3 ALA 89 3HB ALA 89 15.086 -30.957 9.270 696 H ALA 90 H ALA 90 14.269 -28.297 10.891 697 HA ALA 90 HA ALA 90 15.010 -26.997 8.544 698 HB1 ALA 90 1HB ALA 90 13.783 -25.010 9.598 699 HB2 ALA 90 2HB ALA 90 12.878 -26.505 9.361 700 HB3 ALA 90 3HB ALA 90 13.486 -26.089 10.962 701 H VAL 91 H VAL 91 16.472 -26.931 11.647 702 HA VAL 91 HA VAL 91 17.682 -24.392 11.601 703 HB VAL 91 HB VAL 91 18.438 -26.964 12.968 704 HG11 VAL 91 1HG1 VAL 91 19.902 -25.124 14.288 705 HG12 VAL 91 2HG1 VAL 91 20.542 -26.149 13.002 706 HG13 VAL 91 3HG1 VAL 91 20.023 -24.502 12.642 707 HG21 VAL 91 3HG2 VAL 91 17.852 -24.548 14.518 708 HG22 VAL 91 1HG2 VAL 91 16.508 -25.127 13.534 709 HG23 VAL 91 2HG2 VAL 91 17.259 -26.197 14.718 710 H SER 92 H SER 92 19.129 -27.564 10.830 711 HA SER 92 HA SER 92 21.344 -26.250 9.487 712 HB2 SER 92 2HB SER 92 21.284 -28.487 10.973 713 HB3 SER 92 3HB SER 92 21.050 -29.207 9.380 714 HG SER 92 HG SER 92 22.956 -28.062 8.719 715 H ALA 93 H ALA 93 18.305 -27.545 8.684 716 HA ALA 93 HA ALA 93 19.004 -28.167 5.934 717 HB1 ALA 93 1HB ALA 93 16.357 -28.221 7.378 718 HB2 ALA 93 2HB ALA 93 16.605 -28.724 5.705 719 HB3 ALA 93 3HB ALA 93 17.395 -29.600 7.016 720 H TYR 94 H TYR 94 16.553 -26.050 7.441 721 HA TYR 94 HA TYR 94 15.953 -24.558 5.180 722 HB2 TYR 94 2HB TYR 94 14.895 -24.605 7.594 723 HB3 TYR 94 3HB TYR 94 15.959 -23.229 7.860 724 HD1 TYR 94 HD2 TYR 94 14.042 -24.196 4.814 725 HD2 TYR 94 HD1 TYR 94 14.552 -21.378 7.961 726 HE1 TYR 94 HE2 TYR 94 12.389 -22.717 3.750 727 HE2 TYR 94 HE1 TYR 94 12.899 -19.892 6.907 728 HH TYR 94 HH TYR 94 10.836 -20.334 5.226 729 H GLN 95 H GLN 95 18.587 -24.225 7.463 730 HA GLN 95 HA GLN 95 19.444 -21.646 6.736 731 HB2 GLN 95 2HB GLN 95 21.481 -22.154 7.877 732 HB3 GLN 95 3HB GLN 95 20.176 -22.931 8.764 733 HG2 GLN 95 2HG GLN 95 21.777 -24.575 8.727 734 HG3 GLN 95 3HG GLN 95 20.781 -25.007 7.338 735 HE21 GLN 95 1HE2 GLN 95 23.540 -22.892 8.068 736 HE22 GLN 95 2HE2 GLN 95 24.463 -23.332 6.676 737 H GLN 96 H GLN 96 19.211 -24.283 4.813 738 HA GLN 96 HA GLN 96 21.683 -24.097 3.372 739 HB2 GLN 96 2HB GLN 96 19.069 -25.493 2.828 740 HB3 GLN 96 3HB GLN 96 20.401 -25.518 1.680 741 HG2 GLN 96 2HG GLN 96 20.999 -26.300 4.471 742 HG3 GLN 96 3HG GLN 96 20.039 -27.414 3.499 743 HE21 GLN 96 1HE2 GLN 96 22.978 -27.094 4.544 744 HE22 GLN 96 2HE2 GLN 96 23.906 -27.626 3.187 745 H GLY 97 H GLY 97 20.193 -21.608 3.680 746 HA2 GLY 97 2HA GLY 97 20.457 -19.845 2.020 747 HA3 GLY 97 3HA GLY 97 19.861 -20.977 0.815 748 H ALA 98 H ALA 98 18.470 -20.544 4.013 749 HA ALA 98 HA ALA 98 16.099 -19.332 2.746 750 HB1 ALA 98 1HB ALA 98 15.858 -21.045 5.182 751 HB2 ALA 98 2HB ALA 98 14.657 -20.678 3.943 752 HB3 ALA 98 3HB ALA 98 15.979 -21.791 3.588 753 H PHE 99 H PHE 99 14.737 -18.069 4.243 754 HA PHE 99 HA PHE 99 16.385 -16.318 5.831 755 HB2 PHE 99 2HB PHE 99 14.714 -15.254 4.504 756 HB3 PHE 99 3HB PHE 99 13.452 -16.313 5.124 757 HD1 PHE 99 HD1 PHE 99 15.556 -13.407 5.827 758 HD2 PHE 99 HD2 PHE 99 12.454 -15.930 7.283 759 HE1 PHE 99 HE1 PHE 99 15.032 -11.750 7.569 760 HE2 PHE 99 HE2 PHE 99 11.924 -14.278 9.028 761 HZ PHE 99 HZ PHE 99 13.213 -12.184 9.172 762 H ASP 100 H ASP 100 16.088 -15.836 8.040 763 HA ASP 100 HA ASP 100 15.905 -17.951 9.778 764 HB2 ASP 100 2HB ASP 100 16.798 -15.691 10.334 765 HB3 ASP 100 3HB ASP 100 15.143 -15.097 10.431 766 H TYR 101 H TYR 101 14.248 -19.334 9.866 767 HA TYR 101 HA TYR 101 11.576 -18.767 9.295 768 HB2 TYR 101 2HB TYR 101 11.131 -20.915 10.605 769 HB3 TYR 101 3HB TYR 101 12.225 -21.037 9.232 770 HD1 TYR 101 HD1 TYR 101 12.491 -20.214 12.876 771 HD2 TYR 101 HD2 TYR 101 14.060 -22.380 9.567 772 HE1 TYR 101 HE1 TYR 101 14.207 -21.193 14.339 773 HE2 TYR 101 HE2 TYR 101 15.780 -23.367 11.022 774 HH TYR 101 HH TYR 101 16.381 -22.222 14.195 775 H LEU 102 H LEU 102 9.895 -19.524 11.181 776 HA LEU 102 HA LEU 102 10.458 -18.071 13.645 777 HB2 LEU 102 2HB LEU 102 9.499 -16.289 12.532 778 HB3 LEU 102 3HB LEU 102 8.399 -17.320 11.620 779 HG LEU 102 HG LEU 102 7.215 -17.720 13.856 780 HD11 LEU 102 1HD1 LEU 102 8.311 -16.896 15.620 781 HD12 LEU 102 2HD1 LEU 102 7.650 -15.339 15.122 782 HD13 LEU 102 3HD1 LEU 102 9.279 -15.802 14.631 783 HD21 LEU 102 3HD2 LEU 102 7.173 -15.326 12.124 784 HD22 LEU 102 1HD2 LEU 102 6.294 -15.213 13.649 785 HD23 LEU 102 2HD2 LEU 102 5.896 -16.485 12.494 786 HA PRO 103 HA PRO 103 8.320 -21.852 14.829 787 HB2 PRO 103 2HB PRO 103 9.015 -21.688 17.448 788 HB3 PRO 103 3HB PRO 103 10.110 -22.294 16.200 789 HG2 PRO 103 2HG PRO 103 9.986 -19.579 17.456 790 HG3 PRO 103 3HG PRO 103 11.405 -20.572 17.074 791 HD2 PRO 103 2HD PRO 103 10.602 -18.515 15.506 792 HD3 PRO 103 3HD PRO 103 11.388 -19.966 14.851 793 H LYS 104 H LYS 104 6.278 -22.119 15.522 794 HA LYS 104 HA LYS 104 4.929 -19.809 16.721 795 HB2 LYS 104 2HB LYS 104 2.841 -20.930 16.030 796 HB3 LYS 104 3HB LYS 104 3.925 -20.648 14.674 797 HG2 LYS 104 2HG LYS 104 4.061 -22.816 14.206 798 HG3 LYS 104 3HG LYS 104 4.348 -23.246 15.894 799 HD2 LYS 104 2HD LYS 104 1.634 -22.576 14.764 800 HD3 LYS 104 3HD LYS 104 2.263 -24.219 14.910 801 HE2 LYS 104 2HE LYS 104 2.003 -22.311 17.227 802 HE3 LYS 104 3HE LYS 104 0.763 -23.481 16.781 803 HZ1 LYS 104 3HZ LYS 104 1.872 -24.796 18.197 804 HZ2 LYS 104 1HZ LYS 104 3.301 -23.894 18.107 805 HZ3 LYS 104 2HZ LYS 104 2.940 -25.030 16.906 806 HA PRO 105 HA PRO 105 2.697 -19.684 17.520 807 HB2 PRO 105 2HB PRO 105 2.199 -18.407 19.863 808 HB3 PRO 105 3HB PRO 105 1.280 -19.817 19.324 809 HG2 PRO 105 2HG PRO 105 3.542 -19.665 21.278 810 HG3 PRO 105 3HG PRO 105 2.032 -20.588 21.385 811 HD2 PRO 105 2HD PRO 105 4.381 -21.718 20.654 812 HD3 PRO 105 3HD PRO 105 2.817 -22.272 20.022 813 H PHE 106 H PHE 106 2.845 -17.248 17.761 814 HA PHE 106 HA PHE 106 5.374 -16.225 18.729 815 HB2 PHE 106 2HB PHE 106 5.992 -15.244 16.529 816 HB3 PHE 106 3HB PHE 106 6.047 -17.004 16.536 817 HD1 PHE 106 HD2 PHE 106 3.814 -14.164 15.648 818 HD2 PHE 106 HD1 PHE 106 4.956 -18.193 14.883 819 HE1 PHE 106 HE2 PHE 106 2.319 -14.214 13.695 820 HE2 PHE 106 HE1 PHE 106 3.463 -18.248 12.928 821 HZ PHE 106 HZ PHE 106 2.141 -16.258 12.332 822 H ASP 107 H ASP 107 5.530 -13.804 18.221 823 HA ASP 107 HA ASP 107 2.940 -12.630 18.857 824 HB2 ASP 107 2HB ASP 107 5.673 -11.334 18.812 825 HB3 ASP 107 3HB ASP 107 4.199 -10.642 19.482 826 H ILE 108 H ILE 108 1.704 -11.947 17.246 827 HA ILE 108 HA ILE 108 2.332 -11.692 14.599 828 HB ILE 108 HB ILE 108 0.254 -10.317 16.266 829 HG12 ILE 108 2HG1 ILE 108 -0.260 -12.058 13.890 830 HG13 ILE 108 3HG1 ILE 108 0.297 -12.807 15.382 831 HG21 ILE 108 1HG2 ILE 108 0.677 -8.652 14.650 832 HG22 ILE 108 2HG2 ILE 108 0.849 -9.840 13.359 833 HG23 ILE 108 3HG2 ILE 108 -0.735 -9.534 14.070 834 HD11 ILE 108 3HD1 ILE 108 -1.812 -11.011 16.010 835 HD12 ILE 108 1HD1 ILE 108 -2.321 -12.039 14.670 836 HD13 ILE 108 2HD1 ILE 108 -1.761 -12.766 16.177 837 H ASP 109 H ASP 109 2.741 -9.291 17.138 838 HA ASP 109 HA ASP 109 3.286 -7.044 15.589 839 HB2 ASP 109 2HB ASP 109 4.601 -7.752 18.219 840 HB3 ASP 109 3HB ASP 109 4.405 -6.140 17.537 841 H GLU 110 H GLU 110 5.449 -9.626 16.676 842 HA GLU 110 HA GLU 110 7.757 -8.427 15.438 843 HB2 GLU 110 2HB GLU 110 8.026 -9.765 17.457 844 HB3 GLU 110 3HB GLU 110 7.344 -11.167 16.645 845 HG2 GLU 110 2HG GLU 110 9.265 -11.663 15.602 846 HG3 GLU 110 3HG GLU 110 9.661 -9.972 15.303 847 H ALA 111 H ALA 111 5.320 -10.751 14.579 848 HA ALA 111 HA ALA 111 6.692 -11.987 12.428 849 HB1 ALA 111 1HB ALA 111 4.322 -12.588 11.694 850 HB2 ALA 111 2HB ALA 111 4.854 -13.169 13.273 851 HB3 ALA 111 3HB ALA 111 3.789 -11.767 13.162 852 H VAL 112 H VAL 112 4.159 -9.473 12.449 853 HA VAL 112 HA VAL 112 4.054 -8.938 9.747 854 HB VAL 112 HB VAL 112 3.668 -7.125 12.117 855 HG11 VAL 112 1HG1 VAL 112 2.468 -5.706 10.237 856 HG12 VAL 112 2HG1 VAL 112 4.176 -5.478 10.618 857 HG13 VAL 112 3HG1 VAL 112 3.704 -6.449 9.223 858 HG21 VAL 112 3HG2 VAL 112 2.065 -9.008 11.584 859 HG22 VAL 112 1HG2 VAL 112 1.356 -7.397 11.695 860 HG23 VAL 112 2HG2 VAL 112 1.654 -8.122 10.115 861 H ALA 113 H ALA 113 6.402 -7.848 12.120 862 HA ALA 113 HA ALA 113 7.711 -6.069 10.249 863 HB1 ALA 113 1HB ALA 113 8.503 -5.117 12.089 864 HB2 ALA 113 2HB ALA 113 7.628 -6.314 13.045 865 HB3 ALA 113 3HB ALA 113 9.299 -6.616 12.569 866 H LEU 114 H LEU 114 7.998 -9.348 11.323 867 HA LEU 114 HA LEU 114 10.700 -9.798 10.627 868 HB2 LEU 114 2HB LEU 114 9.549 -11.327 12.073 869 HB3 LEU 114 3HB LEU 114 8.348 -11.669 10.829 870 HG LEU 114 HG LEU 114 10.314 -12.612 9.471 871 HD11 LEU 114 1HD1 LEU 114 12.164 -13.475 10.842 872 HD12 LEU 114 2HD1 LEU 114 11.537 -12.581 12.226 873 HD13 LEU 114 3HD1 LEU 114 12.120 -11.712 10.807 874 HD21 LEU 114 3HD2 LEU 114 10.234 -14.756 10.909 875 HD22 LEU 114 1HD2 LEU 114 8.737 -14.154 10.195 876 HD23 LEU 114 2HD2 LEU 114 9.082 -13.858 11.900 877 H VAL 115 H VAL 115 7.738 -9.743 8.788 878 HA VAL 115 HA VAL 115 8.927 -10.959 6.448 879 HB VAL 115 HB VAL 115 6.579 -11.364 6.838 880 HG11 VAL 115 1HG1 VAL 115 5.977 -9.409 8.096 881 HG12 VAL 115 2HG1 VAL 115 6.281 -8.367 6.705 882 HG13 VAL 115 3HG1 VAL 115 4.935 -9.507 6.677 883 HG21 VAL 115 3HG2 VAL 115 7.648 -10.693 4.455 884 HG22 VAL 115 1HG2 VAL 115 5.989 -11.256 4.662 885 HG23 VAL 115 2HG2 VAL 115 6.327 -9.529 4.545 886 H GLU 116 H GLU 116 8.208 -7.745 7.639 887 HA GLU 116 HA GLU 116 8.350 -6.224 5.352 888 HB2 GLU 116 2HB GLU 116 9.123 -5.732 8.194 889 HB3 GLU 116 3HB GLU 116 9.569 -4.538 6.984 890 HG2 GLU 116 2HG GLU 116 6.931 -5.015 6.413 891 HG3 GLU 116 3HG GLU 116 6.979 -5.124 8.171 892 H ARG 117 H ARG 117 11.062 -7.312 7.379 893 HA ARG 117 HA ARG 117 13.113 -6.116 5.894 894 HB2 ARG 117 2HB ARG 117 14.571 -7.882 6.943 895 HB3 ARG 117 3HB ARG 117 13.612 -6.936 8.074 896 HG2 ARG 117 2HG ARG 117 12.000 -8.754 8.245 897 HG3 ARG 117 3HG ARG 117 12.939 -9.701 7.089 898 HD2 ARG 117 2HD ARG 117 13.286 -10.232 9.547 899 HD3 ARG 117 3HD ARG 117 14.736 -9.942 8.587 900 HE ARG 117 HE ARG 117 13.733 -7.599 9.921 901 HH11 ARG 117 1HH1 ARG 117 15.765 -10.412 10.198 902 HH12 ARG 117 2HH1 ARG 117 16.760 -9.732 11.443 903 HH21 ARG 117 1HH2 ARG 117 15.034 -6.693 11.560 904 HH22 ARG 117 2HH2 ARG 117 16.342 -7.617 12.218 905 H ALA 118 H ALA 118 11.313 -9.060 5.395 906 HA ALA 118 HA ALA 118 13.101 -10.199 3.478 907 HB1 ALA 118 1HB ALA 118 11.840 -11.907 4.197 908 HB2 ALA 118 2HB ALA 118 10.486 -10.860 4.622 909 HB3 ALA 118 3HB ALA 118 10.708 -11.379 2.951 910 H ILE 119 H ILE 119 10.230 -8.161 3.313 911 HA ILE 119 HA ILE 119 10.066 -8.263 0.446 912 HB ILE 119 HB ILE 119 8.723 -6.441 2.444 913 HG12 ILE 119 2HG1 ILE 119 7.704 -8.817 0.870 914 HG13 ILE 119 3HG1 ILE 119 8.049 -8.796 2.596 915 HG21 ILE 119 1HG2 ILE 119 8.876 -5.289 0.337 916 HG22 ILE 119 2HG2 ILE 119 8.296 -6.713 -0.527 917 HG23 ILE 119 3HG2 ILE 119 7.218 -5.845 0.567 918 HD11 ILE 119 3HD1 ILE 119 6.266 -6.677 2.087 919 HD12 ILE 119 1HD1 ILE 119 5.653 -8.094 1.236 920 HD13 ILE 119 2HD1 ILE 119 5.965 -8.174 2.970 921 H SER 120 H SER 120 11.576 -6.206 2.826 922 HA SER 120 HA SER 120 12.221 -4.159 0.868 923 HB2 SER 120 2HB SER 120 13.145 -4.356 3.741 924 HB3 SER 120 3HB SER 120 13.173 -2.927 2.709 925 HG SER 120 HG SER 120 11.219 -2.548 3.346 926 H HIS 121 H HIS 121 13.494 -7.095 1.839 927 HA HIS 121 HA HIS 121 16.241 -6.694 1.926 928 HB2 HIS 121 2HB HIS 121 14.960 -8.844 2.374 929 HB3 HIS 121 3HB HIS 121 14.926 -9.082 0.630 930 HD1 HIS 121 HD1 HIS 121 16.805 -10.410 -0.266 931 HD2 HIS 121 HD2 HIS 121 17.785 -8.584 3.335 932 HE1 HIS 121 HE1 HIS 121 19.120 -11.221 0.291 933 H TYR 122 H TYR 122 14.061 -6.590 -0.761 934 HA TYR 122 HA TYR 122 16.091 -6.888 -2.778 935 HB2 TYR 122 2HB TYR 122 13.405 -5.665 -3.305 936 HB3 TYR 122 3HB TYR 122 14.375 -6.706 -4.341 937 HD1 TYR 122 HD1 TYR 122 14.888 -9.089 -2.995 938 HD2 TYR 122 HD2 TYR 122 11.428 -6.637 -2.649 939 HE1 TYR 122 HE1 TYR 122 13.585 -11.041 -2.260 940 HE2 TYR 122 HE2 TYR 122 10.116 -8.582 -1.912 941 HH TYR 122 HH TYR 122 10.674 -11.467 -2.398 942 H GLN 123 H GLN 123 14.302 -4.209 -1.320 943 HA GLN 123 HA GLN 123 15.835 -2.286 -2.898 944 HB2 GLN 123 2HB GLN 123 14.282 -0.634 -2.174 945 HB3 GLN 123 3HB GLN 123 13.344 -2.060 -2.597 946 HG2 GLN 123 2HG GLN 123 13.595 -2.585 -0.037 947 HG3 GLN 123 3HG GLN 123 13.855 -0.844 0.065 948 HE21 GLN 123 1HE2 GLN 123 11.601 -3.362 -0.797 949 HE22 GLN 123 2HE2 GLN 123 10.184 -2.374 -0.775 950 H GLU 124 H GLU 124 16.984 -3.943 -0.704 951 HA GLU 124 HA GLU 124 17.405 -2.561 1.648 952 HB2 GLU 124 2HB GLU 124 18.403 -4.867 0.510 953 HB3 GLU 124 3HB GLU 124 19.831 -3.851 0.645 954 HG2 GLU 124 2HG GLU 124 19.418 -3.558 3.023 955 HG3 GLU 124 3HG GLU 124 17.960 -4.541 2.899 Start of MODEL 14 1 H1 MET 1 H MET 1 1.682 -0.212 1.483 2 HA MET 1 HA MET 1 0.710 0.319 -0.564 3 HB2 MET 1 2HB MET 1 1.983 1.090 -2.431 4 HB3 MET 1 3HB MET 1 2.637 1.874 -0.999 5 HG2 MET 1 2HG MET 1 4.252 -0.242 -1.081 6 HG3 MET 1 3HG MET 1 3.856 -0.130 -2.795 7 HE1 MET 1 3HE MET 1 5.263 1.725 0.320 8 HE2 MET 1 1HE MET 1 6.503 0.712 -0.420 9 HE3 MET 1 2HE MET 1 6.686 2.466 -0.415 10 H GLN 2 H GLN 2 1.641 -2.249 0.589 11 HA GLN 2 HA GLN 2 1.696 -4.459 0.052 12 HB2 GLN 2 2HB GLN 2 0.516 -3.641 -2.601 13 HB3 GLN 2 3HB GLN 2 0.349 -5.189 -1.783 14 HG2 GLN 2 2HG GLN 2 -1.020 -4.210 -0.079 15 HG3 GLN 2 3HG GLN 2 -0.735 -2.593 -0.720 16 HE21 GLN 2 1HE2 GLN 2 -3.276 -3.665 -0.304 17 HE22 GLN 2 2HE2 GLN 2 -4.050 -3.857 -1.837 18 H ARG 3 H ARG 3 4.045 -2.970 -0.464 19 HA ARG 3 HA ARG 3 5.140 -3.542 -3.014 20 HB2 ARG 3 2HB ARG 3 7.134 -2.654 -2.206 21 HB3 ARG 3 3HB ARG 3 5.922 -1.839 -1.227 22 HG2 ARG 3 2HG ARG 3 7.491 -4.261 -0.367 23 HG3 ARG 3 3HG ARG 3 7.864 -2.594 0.078 24 HD2 ARG 3 2HD ARG 3 5.318 -4.076 0.727 25 HD3 ARG 3 3HD ARG 3 6.633 -3.740 1.852 26 HE ARG 3 HE ARG 3 5.496 -1.402 0.602 27 HH11 ARG 3 1HH1 ARG 3 5.342 -3.608 3.291 28 HH12 ARG 3 2HH1 ARG 3 4.536 -2.484 4.335 29 HH21 ARG 3 1HH2 ARG 3 4.436 0.086 1.967 30 HH22 ARG 3 2HH2 ARG 3 4.020 -0.384 3.581 31 H GLY 4 H GLY 4 4.511 -5.503 -0.320 32 HA2 GLY 4 2HA GLY 4 6.037 -7.683 -1.555 33 HA3 GLY 4 3HA GLY 4 6.314 -7.334 0.145 34 H ILE 5 H ILE 5 4.531 -9.146 -2.019 35 HA ILE 5 HA ILE 5 2.150 -9.422 -0.412 36 HB ILE 5 HB ILE 5 3.122 -10.912 -2.848 37 HG12 ILE 5 2HG1 ILE 5 0.682 -9.167 -2.611 38 HG13 ILE 5 3HG1 ILE 5 2.266 -8.471 -2.936 39 HG21 ILE 5 1HG2 ILE 5 1.846 -12.527 -1.756 40 HG22 ILE 5 2HG2 ILE 5 0.701 -11.339 -1.135 41 HG23 ILE 5 3HG2 ILE 5 0.694 -11.759 -2.848 42 HD11 ILE 5 3HD1 ILE 5 0.466 -9.428 -4.795 43 HD12 ILE 5 1HD1 ILE 5 2.163 -9.040 -5.075 44 HD13 ILE 5 2HD1 ILE 5 1.688 -10.694 -4.691 45 H VAL 6 H VAL 6 1.585 -11.128 0.887 46 HA VAL 6 HA VAL 6 3.645 -13.177 1.371 47 HB VAL 6 HB VAL 6 1.950 -11.995 3.564 48 HG11 VAL 6 1HG1 VAL 6 4.503 -13.599 3.654 49 HG12 VAL 6 2HG1 VAL 6 3.546 -13.063 5.036 50 HG13 VAL 6 3HG1 VAL 6 2.886 -14.252 3.913 51 HG21 VAL 6 3HG2 VAL 6 3.937 -10.712 4.242 52 HG22 VAL 6 1HG2 VAL 6 4.761 -11.236 2.774 53 HG23 VAL 6 2HG2 VAL 6 3.330 -10.210 2.664 54 H TRP 7 H TRP 7 2.919 -15.199 1.273 55 HA TRP 7 HA TRP 7 0.007 -15.632 1.361 56 HB2 TRP 7 2HB TRP 7 2.177 -17.160 -0.085 57 HB3 TRP 7 3HB TRP 7 0.509 -17.712 0.038 58 HD1 TRP 7 HD1 TRP 7 0.137 -14.159 -0.326 59 HE1 TRP 7 HE1 TRP 7 -0.233 -13.469 -2.778 60 HE3 TRP 7 HE3 TRP 7 1.633 -18.477 -2.619 61 HZ2 TRP 7 HZ2 TRP 7 0.068 -14.605 -5.345 62 HZ3 TRP 7 HZ3 TRP 7 1.560 -18.593 -5.076 63 HH2 TRP 7 HH2 TRP 7 0.793 -16.697 -6.409 64 H VAL 8 H VAL 8 -0.650 -17.831 2.130 65 HA VAL 8 HA VAL 8 1.167 -18.919 4.163 66 HB VAL 8 HB VAL 8 -1.740 -18.267 4.667 67 HG11 VAL 8 1HG1 VAL 8 0.367 -19.540 6.406 68 HG12 VAL 8 2HG1 VAL 8 -1.185 -18.945 7.002 69 HG13 VAL 8 3HG1 VAL 8 -1.134 -20.268 5.836 70 HG21 VAL 8 3HG2 VAL 8 0.729 -17.039 5.891 71 HG22 VAL 8 1HG2 VAL 8 -0.250 -16.290 4.630 72 HG23 VAL 8 2HG2 VAL 8 -0.947 -16.598 6.220 73 H VAL 9 H VAL 9 0.889 -21.102 4.638 74 HA VAL 9 HA VAL 9 -1.155 -22.564 3.129 75 HB VAL 9 HB VAL 9 0.822 -22.652 1.719 76 HG11 VAL 9 1HG1 VAL 9 2.394 -24.168 3.727 77 HG12 VAL 9 2HG1 VAL 9 2.938 -23.120 2.415 78 HG13 VAL 9 3HG1 VAL 9 2.312 -22.415 3.906 79 HG21 VAL 9 3HG2 VAL 9 1.048 -25.365 2.733 80 HG22 VAL 9 1HG2 VAL 9 -0.627 -24.823 2.618 81 HG23 VAL 9 2HG2 VAL 9 0.413 -24.783 1.194 82 H ASP 10 H ASP 10 -1.955 -22.535 5.418 83 HA ASP 10 HA ASP 10 -0.688 -24.675 7.000 84 HB2 ASP 10 2HB ASP 10 -1.853 -23.657 8.962 85 HB3 ASP 10 3HB ASP 10 -0.654 -22.598 8.223 86 H ASP 11 H ASP 11 -2.336 -25.810 8.466 87 HA ASP 11 HA ASP 11 -4.698 -26.468 6.835 88 HB2 ASP 11 2HB ASP 11 -2.769 -28.188 7.494 89 HB3 ASP 11 3HB ASP 11 -3.740 -28.325 8.957 90 H ASP 12 H ASP 12 -4.308 -24.379 8.987 91 HA ASP 12 HA ASP 12 -6.645 -25.156 10.588 92 HB2 ASP 12 2HB ASP 12 -3.959 -24.471 11.549 93 HB3 ASP 12 3HB ASP 12 -5.243 -23.537 12.311 94 H SER 13 H SER 13 -7.998 -23.449 11.232 95 HA SER 13 HA SER 13 -8.036 -21.239 9.409 96 HB2 SER 13 2HB SER 13 -9.966 -22.591 10.809 97 HB3 SER 13 3HB SER 13 -9.839 -21.091 11.728 98 HG SER 13 HG SER 13 -10.510 -19.962 10.020 99 H SER 14 H SER 14 -7.682 -21.538 12.937 100 HA SER 14 HA SER 14 -7.269 -18.787 13.413 101 HB2 SER 14 2HB SER 14 -7.172 -19.397 15.589 102 HB3 SER 14 3HB SER 14 -7.640 -20.991 14.999 103 HG SER 14 HG SER 14 -5.432 -20.343 16.264 104 H ILE 15 H ILE 15 -5.234 -21.233 12.153 105 HA ILE 15 HA ILE 15 -2.744 -19.979 12.878 106 HB ILE 15 HB ILE 15 -3.378 -22.221 10.961 107 HG12 ILE 15 2HG1 ILE 15 -3.685 -22.767 13.329 108 HG13 ILE 15 3HG1 ILE 15 -2.290 -23.617 12.672 109 HG21 ILE 15 1HG2 ILE 15 -0.927 -22.609 10.916 110 HG22 ILE 15 2HG2 ILE 15 -1.416 -21.102 10.143 111 HG23 ILE 15 3HG2 ILE 15 -0.706 -21.076 11.757 112 HD11 ILE 15 3HD1 ILE 15 -2.450 -21.784 14.877 113 HD12 ILE 15 1HD1 ILE 15 -1.127 -22.842 14.385 114 HD13 ILE 15 2HD1 ILE 15 -1.276 -21.230 13.683 115 H ARG 16 H ARG 16 -4.859 -20.069 10.069 116 HA ARG 16 HA ARG 16 -3.016 -18.587 8.415 117 HB2 ARG 16 2HB ARG 16 -4.888 -18.578 6.780 118 HB3 ARG 16 3HB ARG 16 -4.459 -20.190 7.337 119 HG2 ARG 16 2HG ARG 16 -6.362 -20.211 8.836 120 HG3 ARG 16 3HG ARG 16 -6.773 -18.561 8.364 121 HD2 ARG 16 2HD ARG 16 -6.584 -19.918 5.959 122 HD3 ARG 16 3HD ARG 16 -7.356 -21.078 7.040 123 HE ARG 16 HE ARG 16 -8.666 -18.671 7.406 124 HH11 ARG 16 1HH1 ARG 16 -8.109 -20.916 4.805 125 HH12 ARG 16 2HH1 ARG 16 -9.596 -20.549 3.995 126 HH21 ARG 16 1HH2 ARG 16 -10.627 -18.178 6.349 127 HH22 ARG 16 2HH2 ARG 16 -11.027 -18.991 4.874 128 H TRP 17 H TRP 17 -5.949 -17.942 10.260 129 HA TRP 17 HA TRP 17 -6.569 -15.398 9.383 130 HB2 TRP 17 2HB TRP 17 -8.094 -16.376 10.877 131 HB3 TRP 17 3HB TRP 17 -6.843 -16.729 12.066 132 HD1 TRP 17 HD1 TRP 17 -8.803 -13.713 10.653 133 HE1 TRP 17 HE1 TRP 17 -8.884 -11.891 12.469 134 HE3 TRP 17 HE3 TRP 17 -5.803 -15.923 14.153 135 HZ2 TRP 17 HZ2 TRP 17 -7.816 -11.448 15.044 136 HZ3 TRP 17 HZ3 TRP 17 -5.383 -14.734 16.266 137 HH2 TRP 17 HH2 TRP 17 -6.369 -12.542 16.700 138 H VAL 18 H VAL 18 -4.482 -16.220 12.160 139 HA VAL 18 HA VAL 18 -3.666 -13.700 12.882 140 HB VAL 18 HB VAL 18 -1.457 -14.830 13.539 141 HG11 VAL 18 1HG1 VAL 18 -3.921 -16.178 14.609 142 HG12 VAL 18 2HG1 VAL 18 -2.431 -15.776 15.464 143 HG13 VAL 18 3HG1 VAL 18 -3.534 -14.494 14.962 144 HG21 VAL 18 3HG2 VAL 18 -2.683 -16.908 11.935 145 HG22 VAL 18 1HG2 VAL 18 -1.030 -16.774 12.538 146 HG23 VAL 18 2HG2 VAL 18 -2.287 -17.477 13.557 147 H LEU 19 H LEU 19 -2.136 -15.818 10.465 148 HA LEU 19 HA LEU 19 -0.151 -13.929 9.719 149 HB2 LEU 19 2HB LEU 19 -1.193 -16.473 8.544 150 HB3 LEU 19 3HB LEU 19 -0.090 -15.459 7.615 151 HG LEU 19 HG LEU 19 0.582 -16.497 10.359 152 HD11 LEU 19 1HD1 LEU 19 2.064 -18.057 8.817 153 HD12 LEU 19 2HD1 LEU 19 0.704 -17.841 7.716 154 HD13 LEU 19 3HD1 LEU 19 0.438 -18.518 9.322 155 HD21 LEU 19 3HD2 LEU 19 2.385 -15.232 10.108 156 HD22 LEU 19 1HD2 LEU 19 1.819 -14.701 8.524 157 HD23 LEU 19 2HD2 LEU 19 2.817 -16.148 8.663 158 H GLU 20 H GLU 20 -3.462 -14.330 8.900 159 HA GLU 20 HA GLU 20 -3.313 -12.897 6.401 160 HB2 GLU 20 2HB GLU 20 -5.153 -14.615 7.547 161 HB3 GLU 20 3HB GLU 20 -5.949 -13.051 7.646 162 HG2 GLU 20 2HG GLU 20 -5.419 -12.777 5.188 163 HG3 GLU 20 3HG GLU 20 -4.979 -14.484 5.196 164 H ARG 21 H ARG 21 -5.027 -12.217 9.459 165 HA ARG 21 HA ARG 21 -5.663 -9.580 8.973 166 HB2 ARG 21 2HB ARG 21 -5.717 -9.308 11.450 167 HB3 ARG 21 3HB ARG 21 -6.577 -10.731 10.877 168 HG2 ARG 21 2HG ARG 21 -5.280 -12.105 12.048 169 HG3 ARG 21 3HG ARG 21 -3.804 -11.304 11.506 170 HD2 ARG 21 2HD ARG 21 -5.545 -9.978 13.537 171 HD3 ARG 21 3HD ARG 21 -4.472 -11.286 14.034 172 HE ARG 21 HE ARG 21 -2.831 -9.649 12.650 173 HH11 ARG 21 1HH1 ARG 21 -5.080 -9.116 15.253 174 HH12 ARG 21 2HH1 ARG 21 -4.186 -7.794 15.928 175 HH21 ARG 21 1HH2 ARG 21 -1.645 -7.910 13.529 176 HH22 ARG 21 2HH2 ARG 21 -2.233 -7.109 14.947 177 H ALA 22 H ALA 22 -2.605 -10.960 9.921 178 HA ALA 22 HA ALA 22 -1.317 -8.646 10.849 179 HB1 ALA 22 1HB ALA 22 0.133 -10.268 11.314 180 HB2 ALA 22 2HB ALA 22 -0.559 -11.337 10.093 181 HB3 ALA 22 3HB ALA 22 0.666 -10.153 9.637 182 H LEU 23 H LEU 23 -1.804 -9.912 7.602 183 HA LEU 23 HA LEU 23 -0.131 -7.881 6.398 184 HB2 LEU 23 2HB LEU 23 -2.014 -9.765 5.002 185 HB3 LEU 23 3HB LEU 23 -0.631 -8.916 4.315 186 HG LEU 23 HG LEU 23 -0.341 -11.021 6.445 187 HD11 LEU 23 1HD1 LEU 23 0.117 -12.630 4.711 188 HD12 LEU 23 2HD1 LEU 23 -0.164 -11.417 3.462 189 HD13 LEU 23 3HD1 LEU 23 -1.499 -11.963 4.477 190 HD21 LEU 23 3HD2 LEU 23 1.935 -11.063 5.807 191 HD22 LEU 23 1HD2 LEU 23 1.503 -9.361 5.968 192 HD23 LEU 23 2HD2 LEU 23 1.627 -10.091 4.367 193 H ALA 24 H ALA 24 -3.582 -8.622 6.647 194 HA ALA 24 HA ALA 24 -4.648 -6.711 4.976 195 HB1 ALA 24 1HB ALA 24 -6.148 -8.242 5.915 196 HB2 ALA 24 2HB ALA 24 -5.648 -7.859 7.563 197 HB3 ALA 24 3HB ALA 24 -6.593 -6.694 6.635 198 H GLY 25 H GLY 25 -3.707 -6.330 8.386 199 HA2 GLY 25 2HA GLY 25 -4.325 -3.493 8.314 200 HA3 GLY 25 3HA GLY 25 -3.718 -4.396 9.695 201 H ALA 26 H ALA 26 -1.790 -5.260 7.201 202 HA ALA 26 HA ALA 26 0.255 -3.320 8.001 203 HB1 ALA 26 1HB ALA 26 0.918 -5.603 8.289 204 HB2 ALA 26 2HB ALA 26 0.474 -5.992 6.627 205 HB3 ALA 26 3HB ALA 26 1.840 -4.924 6.947 206 H GLY 27 H GLY 27 -1.727 -4.231 5.333 207 HA2 GLY 27 2HA GLY 27 -2.091 -2.842 3.458 208 HA3 GLY 27 3HA GLY 27 -0.530 -2.087 3.744 209 H LEU 28 H LEU 28 -1.092 -5.556 3.610 210 HA LEU 28 HA LEU 28 0.170 -5.668 0.967 211 HB2 LEU 28 2HB LEU 28 1.060 -7.761 2.811 212 HB3 LEU 28 3HB LEU 28 1.968 -6.844 1.610 213 HG LEU 28 HG LEU 28 1.206 -5.715 4.295 214 HD11 LEU 28 1HD1 LEU 28 2.839 -7.861 4.027 215 HD12 LEU 28 2HD1 LEU 28 2.983 -6.648 5.298 216 HD13 LEU 28 3HD1 LEU 28 3.989 -6.534 3.854 217 HD21 LEU 28 3HD2 LEU 28 3.619 -4.767 2.992 218 HD22 LEU 28 1HD2 LEU 28 2.249 -3.861 3.634 219 HD23 LEU 28 2HD2 LEU 28 2.181 -4.522 2.000 220 H THR 29 H THR 29 -0.430 -7.405 -0.296 221 HA THR 29 HA THR 29 -2.949 -8.470 -0.033 222 HB THR 29 HB THR 29 -0.718 -9.965 -1.405 223 HG1 THR 29 HG1 THR 29 -1.523 -8.547 -3.238 224 HG21 THR 29 3HG2 THR 29 -2.687 -10.284 -3.060 225 HG22 THR 29 1HG2 THR 29 -3.697 -9.811 -1.695 226 HG23 THR 29 2HG2 THR 29 -2.662 -11.234 -1.574 227 H CYS 30 H CYS 30 -3.683 -10.655 0.382 228 HA CYS 30 HA CYS 30 -1.963 -12.279 2.096 229 HB2 CYS 30 2HB CYS 30 -3.889 -12.534 3.722 230 HB3 CYS 30 3HB CYS 30 -3.079 -10.972 3.740 231 HG CYS 30 HG CYS 30 -5.085 -9.501 2.930 232 H THR 31 H THR 31 -1.990 -14.245 1.254 233 HA THR 31 HA THR 31 -4.537 -15.294 0.205 234 HB THR 31 HB THR 31 -1.849 -16.054 -0.928 235 HG1 THR 31 HG1 THR 31 -3.666 -14.104 -1.945 236 HG21 THR 31 3HG2 THR 31 -3.120 -16.937 -2.757 237 HG22 THR 31 1HG2 THR 31 -4.610 -16.233 -2.131 238 HG23 THR 31 2HG2 THR 31 -3.828 -17.555 -1.265 239 H THR 32 H THR 32 -5.207 -16.860 1.510 240 HA THR 32 HA THR 32 -3.222 -18.542 2.870 241 HB THR 32 HB THR 32 -4.866 -19.088 4.483 242 HG1 THR 32 HG1 THR 32 -7.074 -18.482 4.182 243 HG21 THR 32 3HG2 THR 32 -4.823 -17.095 5.492 244 HG22 THR 32 1HG2 THR 32 -5.889 -16.383 4.282 245 HG23 THR 32 2HG2 THR 32 -4.150 -16.448 3.996 246 H PHE 33 H PHE 33 -3.063 -20.683 2.499 247 HA PHE 33 HA PHE 33 -5.003 -21.882 0.633 248 HB2 PHE 33 2HB PHE 33 -2.033 -22.416 0.841 249 HB3 PHE 33 3HB PHE 33 -3.144 -23.288 -0.210 250 HD1 PHE 33 HD2 PHE 33 -4.296 -22.054 -2.056 251 HD2 PHE 33 HD1 PHE 33 -1.119 -20.348 0.205 252 HE1 PHE 33 HE2 PHE 33 -3.948 -20.374 -3.819 253 HE2 PHE 33 HE1 PHE 33 -0.767 -18.664 -1.554 254 HZ PHE 33 HZ PHE 33 -2.181 -18.676 -3.570 255 H GLU 34 H GLU 34 -4.274 -24.485 0.725 256 HA GLU 34 HA GLU 34 -4.242 -25.287 3.537 257 HB2 GLU 34 2HB GLU 34 -6.155 -26.796 3.210 258 HB3 GLU 34 3HB GLU 34 -6.606 -25.113 2.981 259 HG2 GLU 34 2HG GLU 34 -5.822 -26.184 0.467 260 HG3 GLU 34 3HG GLU 34 -6.971 -27.289 1.220 261 H ASN 35 H ASN 35 -2.558 -25.475 0.986 262 HA ASN 35 HA ASN 35 -1.465 -28.031 1.501 263 HB2 ASN 35 2HB ASN 35 -3.666 -28.319 -0.014 264 HB3 ASN 35 3HB ASN 35 -2.490 -27.999 -1.286 265 HD21 ASN 35 1HD2 ASN 35 -3.480 -30.314 -1.591 266 HD22 ASN 35 2HD2 ASN 35 -2.490 -31.592 -0.983 267 H GLY 36 H GLY 36 0.633 -27.738 1.168 268 HA2 GLY 36 2HA GLY 36 1.759 -25.523 -0.086 269 HA3 GLY 36 3HA GLY 36 2.614 -27.018 0.261 270 H ASN 37 H ASN 37 0.560 -28.441 -1.482 271 HA ASN 37 HA ASN 37 2.090 -28.278 -3.903 272 HB2 ASN 37 2HB ASN 37 1.365 -30.450 -3.399 273 HB3 ASN 37 3HB ASN 37 -0.266 -29.915 -3.005 274 HD21 ASN 37 1HD2 ASN 37 -1.708 -30.506 -4.437 275 HD22 ASN 37 2HD2 ASN 37 -1.454 -30.677 -6.137 276 H GLU 38 H GLU 38 -0.823 -26.868 -2.717 277 HA GLU 38 HA GLU 38 -1.767 -26.134 -5.370 278 HB2 GLU 38 2HB GLU 38 -3.059 -26.635 -2.988 279 HB3 GLU 38 3HB GLU 38 -3.094 -24.880 -3.082 280 HG2 GLU 38 2HG GLU 38 -4.769 -24.966 -4.515 281 HG3 GLU 38 3HG GLU 38 -3.795 -25.924 -5.629 282 H VAL 39 H VAL 39 0.278 -24.894 -2.966 283 HA VAL 39 HA VAL 39 -0.132 -22.106 -3.683 284 HB VAL 39 HB VAL 39 2.064 -23.157 -1.915 285 HG11 VAL 39 1HG1 VAL 39 1.180 -20.801 -0.874 286 HG12 VAL 39 2HG1 VAL 39 2.537 -20.964 -1.990 287 HG13 VAL 39 3HG1 VAL 39 0.937 -20.540 -2.601 288 HG21 VAL 39 3HG2 VAL 39 0.175 -22.381 -0.149 289 HG22 VAL 39 1HG2 VAL 39 -0.837 -23.074 -1.416 290 HG23 VAL 39 2HG2 VAL 39 0.419 -24.052 -0.657 291 H LEU 40 H LEU 40 2.290 -24.642 -4.093 292 HA LEU 40 HA LEU 40 4.386 -23.208 -5.157 293 HB2 LEU 40 2HB LEU 40 4.945 -25.392 -4.881 294 HB3 LEU 40 3HB LEU 40 3.384 -25.977 -5.452 295 HG LEU 40 HG LEU 40 4.075 -25.585 -7.762 296 HD11 LEU 40 1HD1 LEU 40 6.895 -25.224 -7.290 297 HD12 LEU 40 2HD1 LEU 40 5.963 -23.886 -6.619 298 HD13 LEU 40 3HD1 LEU 40 5.799 -24.306 -8.324 299 HD21 LEU 40 3HD2 LEU 40 6.409 -27.094 -6.996 300 HD22 LEU 40 1HD2 LEU 40 4.935 -27.633 -7.800 301 HD23 LEU 40 2HD2 LEU 40 5.006 -27.569 -6.038 302 H ALA 41 H ALA 41 1.539 -24.483 -6.843 303 HA ALA 41 HA ALA 41 2.323 -23.592 -9.421 304 HB1 ALA 41 1HB ALA 41 -0.358 -23.773 -9.640 305 HB2 ALA 41 2HB ALA 41 0.731 -25.158 -9.715 306 HB3 ALA 41 3HB ALA 41 -0.089 -24.762 -8.205 307 H ALA 42 H ALA 42 0.557 -22.123 -6.777 308 HA ALA 42 HA ALA 42 -0.595 -19.969 -8.162 309 HB1 ALA 42 1HB ALA 42 -0.756 -18.885 -5.963 310 HB2 ALA 42 2HB ALA 42 -1.287 -20.566 -5.915 311 HB3 ALA 42 3HB ALA 42 0.301 -20.125 -5.287 312 H LEU 43 H LEU 43 2.627 -20.473 -6.888 313 HA LEU 43 HA LEU 43 3.572 -17.852 -6.883 314 HB2 LEU 43 2HB LEU 43 5.269 -20.171 -7.732 315 HB3 LEU 43 3HB LEU 43 5.731 -18.747 -6.803 316 HG LEU 43 HG LEU 43 4.063 -21.063 -5.822 317 HD11 LEU 43 1HD1 LEU 43 6.051 -21.239 -4.232 318 HD12 LEU 43 2HD1 LEU 43 6.908 -20.216 -5.385 319 HD13 LEU 43 3HD1 LEU 43 6.287 -21.786 -5.892 320 HD21 LEU 43 3HD2 LEU 43 5.105 -18.852 -4.101 321 HD22 LEU 43 1HD2 LEU 43 3.780 -19.977 -3.803 322 HD23 LEU 43 2HD2 LEU 43 3.576 -18.661 -4.960 323 H ALA 44 H ALA 44 3.284 -20.176 -9.515 324 HA ALA 44 HA ALA 44 4.748 -18.783 -11.459 325 HB1 ALA 44 1HB ALA 44 2.851 -21.004 -11.410 326 HB2 ALA 44 2HB ALA 44 2.822 -20.074 -12.909 327 HB3 ALA 44 3HB ALA 44 4.331 -20.794 -12.346 328 H SER 45 H SER 45 1.759 -18.058 -10.007 329 HA SER 45 HA SER 45 0.562 -16.649 -12.183 330 HB2 SER 45 2HB SER 45 0.016 -16.373 -9.218 331 HB3 SER 45 3HB SER 45 -1.035 -15.837 -10.529 332 HG SER 45 HG SER 45 -1.383 -18.012 -9.444 333 H LYS 46 H LYS 46 1.569 -15.277 -9.060 334 HA LYS 46 HA LYS 46 2.766 -13.020 -10.527 335 HB2 LYS 46 2HB LYS 46 2.019 -11.624 -8.512 336 HB3 LYS 46 3HB LYS 46 0.784 -12.100 -9.669 337 HG2 LYS 46 2HG LYS 46 -0.368 -13.172 -8.110 338 HG3 LYS 46 3HG LYS 46 1.056 -14.075 -7.588 339 HD2 LYS 46 2HD LYS 46 1.019 -12.889 -5.704 340 HD3 LYS 46 3HD LYS 46 1.455 -11.470 -6.659 341 HE2 LYS 46 2HE LYS 46 -0.540 -11.081 -5.280 342 HE3 LYS 46 3HE LYS 46 -0.889 -10.949 -7.003 343 HZ1 LYS 46 3HZ LYS 46 -2.472 -12.451 -6.728 344 HZ2 LYS 46 1HZ LYS 46 -2.068 -12.651 -5.097 345 HZ3 LYS 46 2HZ LYS 46 -1.313 -13.599 -6.278 346 H THR 47 H THR 47 3.201 -15.491 -8.311 347 HA THR 47 HA THR 47 4.926 -16.106 -6.959 348 HB THR 47 HB THR 47 6.803 -13.980 -7.640 349 HG1 THR 47 HG1 THR 47 5.937 -15.602 -9.803 350 HG21 THR 47 3HG2 THR 47 7.131 -16.788 -8.546 351 HG22 THR 47 1HG2 THR 47 7.033 -16.504 -6.809 352 HG23 THR 47 2HG2 THR 47 8.286 -15.710 -7.763 353 HA PRO 48 HA PRO 48 3.994 -13.234 -3.632 354 HB2 PRO 48 2HB PRO 48 4.575 -14.988 -1.643 355 HB3 PRO 48 3HB PRO 48 3.047 -15.015 -2.532 356 HG2 PRO 48 2HG PRO 48 5.486 -16.711 -2.906 357 HG3 PRO 48 3HG PRO 48 3.779 -17.189 -2.917 358 HD2 PRO 48 2HD PRO 48 5.205 -16.826 -5.190 359 HD3 PRO 48 3HD PRO 48 3.466 -16.485 -5.089 360 H ASP 49 H ASP 49 5.215 -12.264 -1.906 361 HA ASP 49 HA ASP 49 8.024 -12.055 -2.537 362 HB2 ASP 49 2HB ASP 49 6.140 -10.305 -1.527 363 HB3 ASP 49 3HB ASP 49 7.128 -10.679 -0.117 364 H VAL 50 H VAL 50 6.066 -13.737 -0.266 365 HA VAL 50 HA VAL 50 8.115 -15.369 0.674 366 HB VAL 50 HB VAL 50 9.095 -13.574 1.861 367 HG11 VAL 50 1HG1 VAL 50 6.374 -12.925 2.992 368 HG12 VAL 50 2HG1 VAL 50 7.881 -12.068 3.322 369 HG13 VAL 50 3HG1 VAL 50 7.181 -12.031 1.704 370 HG21 VAL 50 3HG2 VAL 50 7.459 -14.699 4.078 371 HG22 VAL 50 1HG2 VAL 50 8.428 -15.804 3.103 372 HG23 VAL 50 2HG2 VAL 50 9.205 -14.475 3.963 373 H LEU 51 H LEU 51 7.306 -17.072 1.821 374 HA LEU 51 HA LEU 51 4.457 -16.914 2.555 375 HB2 LEU 51 2HB LEU 51 5.699 -18.607 0.747 376 HB3 LEU 51 3HB LEU 51 5.498 -19.598 2.191 377 HG LEU 51 HG LEU 51 3.091 -18.119 1.412 378 HD11 LEU 51 1HD1 LEU 51 3.740 -20.451 -0.323 379 HD12 LEU 51 2HD1 LEU 51 4.347 -18.856 -0.766 380 HD13 LEU 51 3HD1 LEU 51 2.613 -19.121 -0.592 381 HD21 LEU 51 3HD2 LEU 51 3.655 -20.190 3.047 382 HD22 LEU 51 1HD2 LEU 51 3.142 -21.057 1.599 383 HD23 LEU 51 2HD2 LEU 51 2.060 -19.887 2.355 384 H LEU 52 H LEU 52 3.795 -18.438 4.292 385 HA LEU 52 HA LEU 52 5.941 -19.006 6.211 386 HB2 LEU 52 2HB LEU 52 3.339 -17.925 7.192 387 HB3 LEU 52 3HB LEU 52 4.918 -17.924 7.975 388 HG LEU 52 HG LEU 52 5.298 -16.300 5.775 389 HD11 LEU 52 1HD1 LEU 52 3.189 -15.845 5.082 390 HD12 LEU 52 2HD1 LEU 52 3.294 -14.654 6.378 391 HD13 LEU 52 3HD1 LEU 52 2.474 -16.190 6.657 392 HD21 LEU 52 3HD2 LEU 52 4.424 -15.006 8.282 393 HD22 LEU 52 1HD2 LEU 52 5.898 -14.784 7.340 394 HD23 LEU 52 2HD2 LEU 52 5.741 -16.172 8.416 395 H SER 53 H SER 53 5.668 -21.197 5.536 396 HA SER 53 HA SER 53 3.180 -22.553 5.734 397 HB2 SER 53 2HB SER 53 4.358 -24.498 5.178 398 HB3 SER 53 3HB SER 53 5.328 -23.227 4.434 399 HG SER 53 HG SER 53 6.478 -23.315 6.600 400 H ASP 54 H ASP 54 2.155 -23.301 7.464 401 HA ASP 54 HA ASP 54 3.317 -22.999 10.080 402 HB2 ASP 54 2HB ASP 54 1.033 -22.454 10.000 403 HB3 ASP 54 3HB ASP 54 0.632 -23.890 9.061 404 H ILE 55 H ILE 55 2.998 -25.527 7.780 405 HA ILE 55 HA ILE 55 3.631 -27.713 7.775 406 HB ILE 55 HB ILE 55 5.134 -26.882 10.259 407 HG12 ILE 55 2HG1 ILE 55 6.061 -27.287 7.406 408 HG13 ILE 55 3HG1 ILE 55 5.791 -25.726 8.173 409 HG21 ILE 55 1HG2 ILE 55 5.532 -29.038 10.612 410 HG22 ILE 55 2HG2 ILE 55 4.676 -29.489 9.139 411 HG23 ILE 55 3HG2 ILE 55 6.390 -29.080 9.072 412 HD11 ILE 55 3HD1 ILE 55 7.883 -27.769 8.859 413 HD12 ILE 55 1HD1 ILE 55 8.123 -26.153 8.194 414 HD13 ILE 55 2HD1 ILE 55 7.538 -26.349 9.847 415 H ARG 56 H ARG 56 1.487 -28.426 8.130 416 HA ARG 56 HA ARG 56 1.187 -30.073 10.438 417 HB2 ARG 56 2HB ARG 56 -0.030 -27.415 10.438 418 HB3 ARG 56 3HB ARG 56 -1.196 -28.705 10.700 419 HG2 ARG 56 2HG ARG 56 -0.603 -28.705 12.832 420 HG3 ARG 56 3HG ARG 56 0.969 -29.338 12.339 421 HD2 ARG 56 2HD ARG 56 1.793 -27.485 13.291 422 HD3 ARG 56 3HD ARG 56 1.250 -26.676 11.821 423 HE ARG 56 HE ARG 56 -0.301 -25.577 13.075 424 HH11 ARG 56 1HH1 ARG 56 0.672 -28.447 14.788 425 HH12 ARG 56 2HH1 ARG 56 -0.254 -28.074 16.203 426 HH21 ARG 56 1HH2 ARG 56 -1.525 -25.075 14.933 427 HH22 ARG 56 2HH2 ARG 56 -1.504 -26.156 16.285 428 H MET 57 H MET 57 1.056 -31.552 8.650 429 HA MET 57 HA MET 57 -1.578 -32.270 7.982 430 HB2 MET 57 2HB MET 57 -1.201 -31.973 5.427 431 HB3 MET 57 3HB MET 57 -1.756 -30.601 6.377 432 HG2 MET 57 2HG MET 57 0.641 -29.874 6.537 433 HG3 MET 57 3HG MET 57 1.019 -31.128 5.357 434 HE1 MET 57 3HE MET 57 0.636 -27.669 5.871 435 HE2 MET 57 1HE MET 57 1.815 -28.066 4.621 436 HE3 MET 57 2HE MET 57 0.437 -27.035 4.237 437 HA PRO 58 HA PRO 58 0.386 -36.103 7.150 438 HB2 PRO 58 2HB PRO 58 -1.270 -37.214 5.308 439 HB3 PRO 58 3HB PRO 58 -1.710 -37.035 7.011 440 HG2 PRO 58 2HG PRO 58 -2.458 -35.323 4.671 441 HG3 PRO 58 3HG PRO 58 -3.470 -35.886 6.015 442 HD2 PRO 58 2HD PRO 58 -2.428 -33.388 5.922 443 HD3 PRO 58 3HD PRO 58 -2.692 -34.257 7.448 444 H GLY 59 H GLY 59 -0.755 -34.606 4.111 445 HA2 GLY 59 2HA GLY 59 1.456 -35.799 2.650 446 HA3 GLY 59 3HA GLY 59 0.158 -34.827 1.971 447 H MET 60 H MET 60 3.398 -34.886 2.706 448 HA MET 60 HA MET 60 5.056 -33.335 2.589 449 HB2 MET 60 2HB MET 60 2.947 -31.415 1.601 450 HB3 MET 60 3HB MET 60 4.683 -31.318 1.340 451 HG2 MET 60 2HG MET 60 4.304 -32.299 -0.611 452 HG3 MET 60 3HG MET 60 4.036 -33.779 0.306 453 HE1 MET 60 3HE MET 60 0.764 -30.996 -1.355 454 HE2 MET 60 1HE MET 60 1.808 -30.481 -0.029 455 HE3 MET 60 2HE MET 60 2.499 -30.816 -1.617 456 H ASP 61 H ASP 61 5.282 -33.299 4.856 457 HA ASP 61 HA ASP 61 3.817 -31.868 6.695 458 HB2 ASP 61 2HB ASP 61 5.770 -31.922 8.131 459 HB3 ASP 61 3HB ASP 61 5.652 -33.444 7.252 460 H GLY 62 H GLY 62 6.003 -30.686 4.288 461 HA2 GLY 62 2HA GLY 62 5.310 -28.182 3.968 462 HA3 GLY 62 3HA GLY 62 6.098 -28.033 5.531 463 H LEU 63 H LEU 63 7.932 -30.308 4.479 464 HA LEU 63 HA LEU 63 9.943 -28.501 3.445 465 HB2 LEU 63 2HB LEU 63 9.887 -31.263 4.517 466 HB3 LEU 63 3HB LEU 63 11.184 -30.861 3.394 467 HG LEU 63 HG LEU 63 12.000 -29.142 4.863 468 HD11 LEU 63 1HD1 LEU 63 10.742 -29.235 7.235 469 HD12 LEU 63 2HD1 LEU 63 9.377 -29.518 6.155 470 HD13 LEU 63 3HD1 LEU 63 10.360 -28.065 5.972 471 HD21 LEU 63 3HD2 LEU 63 11.562 -31.882 5.893 472 HD22 LEU 63 1HD2 LEU 63 12.152 -30.680 7.041 473 HD23 LEU 63 2HD2 LEU 63 13.064 -31.015 5.568 474 H ALA 64 H ALA 64 7.757 -30.886 2.238 475 HA ALA 64 HA ALA 64 9.001 -31.758 -0.073 476 HB1 ALA 64 1HB ALA 64 6.563 -32.144 1.024 477 HB2 ALA 64 2HB ALA 64 6.140 -31.141 -0.364 478 HB3 ALA 64 3HB ALA 64 7.008 -32.658 -0.603 479 H LEU 65 H LEU 65 6.801 -28.963 0.227 480 HA LEU 65 HA LEU 65 7.474 -28.029 -2.412 481 HB2 LEU 65 2HB LEU 65 5.855 -26.377 -2.098 482 HB3 LEU 65 3HB LEU 65 5.230 -27.786 -1.245 483 HG LEU 65 HG LEU 65 6.690 -25.578 0.179 484 HD11 LEU 65 1HD1 LEU 65 4.175 -25.376 -1.122 485 HD12 LEU 65 2HD1 LEU 65 4.975 -24.202 -0.078 486 HD13 LEU 65 3HD1 LEU 65 3.896 -25.410 0.619 487 HD21 LEU 65 3HD2 LEU 65 4.830 -27.791 1.021 488 HD22 LEU 65 1HD2 LEU 65 5.298 -26.456 2.075 489 HD23 LEU 65 2HD2 LEU 65 6.523 -27.569 1.467 490 H LEU 66 H LEU 66 8.342 -27.242 0.895 491 HA LEU 66 HA LEU 66 9.578 -24.774 0.477 492 HB2 LEU 66 2HB LEU 66 9.632 -26.870 2.528 493 HB3 LEU 66 3HB LEU 66 11.093 -25.888 2.448 494 HG LEU 66 HG LEU 66 9.351 -25.147 4.109 495 HD11 LEU 66 1HD1 LEU 66 11.127 -23.718 2.649 496 HD12 LEU 66 2HD1 LEU 66 10.143 -23.053 3.952 497 HD13 LEU 66 3HD1 LEU 66 9.626 -22.870 2.277 498 HD21 LEU 66 3HD2 LEU 66 7.595 -25.503 2.057 499 HD22 LEU 66 1HD2 LEU 66 7.834 -23.756 2.026 500 HD23 LEU 66 2HD2 LEU 66 7.279 -24.544 3.504 501 H LYS 67 H LYS 67 11.014 -28.032 0.485 502 HA LYS 67 HA LYS 67 13.639 -27.364 -0.046 503 HB2 LYS 67 2HB LYS 67 11.953 -29.744 -0.407 504 HB3 LYS 67 3HB LYS 67 13.334 -29.670 -1.492 505 HG2 LYS 67 2HG LYS 67 14.224 -30.799 0.289 506 HG3 LYS 67 3HG LYS 67 14.659 -29.136 0.692 507 HD2 LYS 67 2HD LYS 67 12.742 -28.974 2.179 508 HD3 LYS 67 3HD LYS 67 12.238 -30.607 1.737 509 HE2 LYS 67 2HE LYS 67 13.379 -31.168 3.601 510 HE3 LYS 67 3HE LYS 67 14.769 -31.089 2.519 511 HZ1 LYS 67 3HZ LYS 67 15.069 -29.863 4.628 512 HZ2 LYS 67 1HZ LYS 67 13.820 -28.816 4.175 513 HZ3 LYS 67 2HZ LYS 67 15.241 -28.884 3.260 514 H GLN 68 H GLN 68 10.906 -27.502 -2.232 515 HA GLN 68 HA GLN 68 12.569 -27.114 -4.575 516 HB2 GLN 68 2HB GLN 68 10.774 -27.771 -5.768 517 HB3 GLN 68 3HB GLN 68 10.144 -28.302 -4.214 518 HG2 GLN 68 2HG GLN 68 9.237 -25.850 -4.090 519 HG3 GLN 68 3HG GLN 68 9.418 -25.921 -5.842 520 HE21 GLN 68 1HE2 GLN 68 7.077 -25.890 -3.900 521 HE22 GLN 68 2HE2 GLN 68 6.066 -27.177 -4.454 522 H ILE 69 H ILE 69 10.801 -25.207 -2.311 523 HA ILE 69 HA ILE 69 10.435 -22.905 -3.949 524 HB ILE 69 HB ILE 69 10.336 -23.358 -0.981 525 HG12 ILE 69 2HG1 ILE 69 8.163 -22.265 -2.742 526 HG13 ILE 69 3HG1 ILE 69 8.487 -23.994 -2.703 527 HG21 ILE 69 1HG2 ILE 69 11.095 -21.201 -0.881 528 HG22 ILE 69 2HG2 ILE 69 10.437 -20.780 -2.461 529 HG23 ILE 69 3HG2 ILE 69 9.365 -20.914 -1.067 530 HD11 ILE 69 3HD1 ILE 69 7.920 -24.144 -0.421 531 HD12 ILE 69 1HD1 ILE 69 7.931 -22.391 -0.228 532 HD13 ILE 69 2HD1 ILE 69 6.665 -23.166 -1.181 533 H LYS 70 H LYS 70 13.027 -24.107 -1.953 534 HA LYS 70 HA LYS 70 14.477 -21.621 -1.903 535 HB2 LYS 70 2HB LYS 70 15.277 -24.441 -1.168 536 HB3 LYS 70 3HB LYS 70 16.315 -23.037 -0.954 537 HG2 LYS 70 2HG LYS 70 13.605 -23.341 0.319 538 HG3 LYS 70 3HG LYS 70 15.129 -23.761 1.104 539 HD2 LYS 70 2HD LYS 70 15.663 -21.607 1.492 540 HD3 LYS 70 3HD LYS 70 15.044 -21.069 -0.071 541 HE2 LYS 70 2HE LYS 70 12.755 -21.217 0.799 542 HE3 LYS 70 3HE LYS 70 13.386 -21.735 2.361 543 HZ1 LYS 70 3HZ LYS 70 13.778 -19.642 2.930 544 HZ2 LYS 70 1HZ LYS 70 12.937 -19.152 1.546 545 HZ3 LYS 70 2HZ LYS 70 14.619 -19.323 1.497 546 H GLN 71 H GLN 71 14.292 -24.400 -3.968 547 HA GLN 71 HA GLN 71 16.747 -23.719 -5.371 548 HB2 GLN 71 2HB GLN 71 15.472 -26.104 -4.910 549 HB3 GLN 71 3HB GLN 71 15.007 -25.755 -6.569 550 HG2 GLN 71 2HG GLN 71 17.814 -25.273 -6.191 551 HG3 GLN 71 3HG GLN 71 17.385 -26.902 -5.671 552 HE21 GLN 71 1HE2 GLN 71 17.849 -24.791 -8.317 553 HE22 GLN 71 2HE2 GLN 71 17.506 -25.923 -9.576 554 H ARG 72 H ARG 72 13.271 -23.955 -6.083 555 HA ARG 72 HA ARG 72 13.525 -22.884 -8.713 556 HB2 ARG 72 2HB ARG 72 11.569 -24.247 -7.398 557 HB3 ARG 72 3HB ARG 72 10.917 -22.614 -7.367 558 HG2 ARG 72 2HG ARG 72 11.920 -23.233 -9.985 559 HG3 ARG 72 3HG ARG 72 10.778 -24.468 -9.450 560 HD2 ARG 72 2HD ARG 72 9.176 -22.658 -8.879 561 HD3 ARG 72 3HD ARG 72 10.307 -21.492 -9.565 562 HE ARG 72 HE ARG 72 9.948 -23.225 -11.594 563 HH11 ARG 72 1HH1 ARG 72 7.724 -21.519 -9.529 564 HH12 ARG 72 2HH1 ARG 72 6.480 -21.420 -10.731 565 HH21 ARG 72 1HH2 ARG 72 8.319 -23.100 -13.185 566 HH22 ARG 72 2HH2 ARG 72 6.819 -22.320 -12.810 567 H HIS 73 H HIS 73 12.704 -21.538 -5.557 568 HA HIS 73 HA HIS 73 12.950 -18.847 -6.728 569 HB2 HIS 73 2HB HIS 73 11.160 -19.466 -4.385 570 HB3 HIS 73 3HB HIS 73 11.183 -18.019 -5.388 571 HD1 HIS 73 HD1 HIS 73 10.209 -18.306 -7.852 572 HD2 HIS 73 HD2 HIS 73 9.477 -21.454 -5.242 573 HE1 HIS 73 HE1 HIS 73 8.367 -19.647 -8.916 574 HA PRO 74 HA PRO 74 16.090 -19.419 -3.369 575 HB2 PRO 74 2HB PRO 74 18.106 -18.225 -4.740 576 HB3 PRO 74 3HB PRO 74 17.719 -19.942 -4.902 577 HG2 PRO 74 2HG PRO 74 16.965 -17.653 -6.679 578 HG3 PRO 74 3HG PRO 74 17.536 -19.273 -7.122 579 HD2 PRO 74 2HD PRO 74 14.920 -18.576 -7.206 580 HD3 PRO 74 3HD PRO 74 15.458 -20.224 -6.822 581 H MET 75 H MET 75 15.621 -16.610 -5.509 582 HA MET 75 HA MET 75 16.528 -14.717 -3.581 583 HB2 MET 75 2HB MET 75 15.707 -13.029 -5.136 584 HB3 MET 75 3HB MET 75 16.607 -14.270 -5.997 585 HG2 MET 75 2HG MET 75 14.875 -14.703 -7.299 586 HG3 MET 75 3HG MET 75 13.834 -14.972 -5.903 587 HE1 MET 75 3HE MET 75 12.107 -13.925 -5.340 588 HE2 MET 75 1HE MET 75 12.428 -12.298 -4.737 589 HE3 MET 75 2HE MET 75 11.349 -12.532 -6.112 590 H LEU 76 H LEU 76 13.731 -16.522 -3.779 591 HA LEU 76 HA LEU 76 12.001 -14.502 -2.589 592 HB2 LEU 76 2HB LEU 76 10.859 -15.797 -4.157 593 HB3 LEU 76 3HB LEU 76 11.594 -17.296 -3.590 594 HG LEU 76 HG LEU 76 10.225 -17.135 -1.530 595 HD11 LEU 76 1HD1 LEU 76 8.154 -15.488 -2.119 596 HD12 LEU 76 2HD1 LEU 76 9.516 -14.564 -2.752 597 HD13 LEU 76 3HD1 LEU 76 9.501 -15.065 -1.061 598 HD21 LEU 76 3HD2 LEU 76 9.405 -17.810 -4.157 599 HD22 LEU 76 1HD2 LEU 76 8.031 -17.069 -3.337 600 HD23 LEU 76 2HD2 LEU 76 8.832 -18.469 -2.624 601 HA PRO 77 HA PRO 77 13.413 -15.919 1.430 602 HB2 PRO 77 2HB PRO 77 12.116 -13.986 2.826 603 HB3 PRO 77 3HB PRO 77 13.645 -13.702 1.985 604 HG2 PRO 77 2HG PRO 77 10.854 -13.057 1.113 605 HG3 PRO 77 3HG PRO 77 12.322 -12.071 0.985 606 HD2 PRO 77 2HD PRO 77 11.321 -13.471 -1.105 607 HD3 PRO 77 3HD PRO 77 13.061 -13.188 -0.891 608 H VAL 78 H VAL 78 12.513 -17.356 2.786 609 HA VAL 78 HA VAL 78 9.581 -17.434 3.018 610 HB VAL 78 HB VAL 78 11.317 -19.893 2.777 611 HG11 VAL 78 1HG1 VAL 78 8.418 -19.400 3.236 612 HG12 VAL 78 2HG1 VAL 78 8.896 -20.807 2.285 613 HG13 VAL 78 3HG1 VAL 78 9.481 -20.618 3.938 614 HG21 VAL 78 3HG2 VAL 78 10.300 -18.156 0.734 615 HG22 VAL 78 1HG2 VAL 78 11.283 -19.611 0.574 616 HG23 VAL 78 2HG2 VAL 78 9.525 -19.735 0.619 617 H ILE 79 H ILE 79 8.799 -18.533 4.940 618 HA ILE 79 HA ILE 79 10.782 -18.691 7.108 619 HB ILE 79 HB ILE 79 8.038 -17.473 7.421 620 HG12 ILE 79 2HG1 ILE 79 10.594 -15.918 7.613 621 HG13 ILE 79 3HG1 ILE 79 9.866 -16.204 6.036 622 HG21 ILE 79 1HG2 ILE 79 8.790 -16.839 9.623 623 HG22 ILE 79 2HG2 ILE 79 8.993 -18.578 9.415 624 HG23 ILE 79 3HG2 ILE 79 10.390 -17.508 9.305 625 HD11 ILE 79 3HD1 ILE 79 9.273 -14.165 7.831 626 HD12 ILE 79 1HD1 ILE 79 8.398 -14.583 6.358 627 HD13 ILE 79 2HD1 ILE 79 7.897 -15.265 7.906 628 H ILE 80 H ILE 80 10.439 -20.261 8.642 629 HA ILE 80 HA ILE 80 8.317 -22.195 8.011 630 HB ILE 80 HB ILE 80 10.870 -22.609 9.570 631 HG12 ILE 80 2HG1 ILE 80 10.983 -22.243 7.024 632 HG13 ILE 80 3HG1 ILE 80 11.763 -23.680 7.677 633 HG21 ILE 80 1HG2 ILE 80 10.139 -25.075 9.098 634 HG22 ILE 80 2HG2 ILE 80 9.463 -24.191 10.466 635 HG23 ILE 80 3HG2 ILE 80 8.531 -24.361 8.979 636 HD11 ILE 80 3HD1 ILE 80 9.931 -25.056 6.975 637 HD12 ILE 80 1HD1 ILE 80 9.012 -23.641 6.463 638 HD13 ILE 80 2HD1 ILE 80 10.486 -24.092 5.606 639 H MET 81 H MET 81 6.898 -22.903 9.551 640 HA MET 81 HA MET 81 7.063 -21.603 12.190 641 HB2 MET 81 2HB MET 81 4.855 -21.742 10.239 642 HB3 MET 81 3HB MET 81 4.400 -22.076 11.904 643 HG2 MET 81 2HG MET 81 4.646 -19.945 12.532 644 HG3 MET 81 3HG MET 81 6.108 -19.726 11.572 645 HE1 MET 81 3HE MET 81 2.651 -20.862 11.095 646 HE2 MET 81 1HE MET 81 1.799 -19.380 10.659 647 HE3 MET 81 2HE MET 81 2.383 -20.465 9.397 648 H THR 82 H THR 82 7.245 -22.984 13.817 649 HA THR 82 HA THR 82 5.658 -25.232 14.244 650 HB THR 82 HB THR 82 6.619 -26.532 12.596 651 HG1 THR 82 HG1 THR 82 7.372 -28.059 13.853 652 HG21 THR 82 3HG2 THR 82 8.886 -24.729 12.942 653 HG22 THR 82 1HG2 THR 82 8.330 -25.580 11.502 654 HG23 THR 82 2HG2 THR 82 9.370 -26.402 12.665 655 H ALA 83 H ALA 83 9.129 -25.472 14.682 656 HA ALA 83 HA ALA 83 10.459 -25.414 16.528 657 HB1 ALA 83 1HB ALA 83 9.378 -23.813 18.410 658 HB2 ALA 83 2HB ALA 83 10.288 -23.222 17.019 659 HB3 ALA 83 3HB ALA 83 8.525 -23.240 16.977 660 H HIS 84 H HIS 84 9.622 -27.690 16.700 661 HA HIS 84 HA HIS 84 9.099 -28.337 19.372 662 HB2 HIS 84 2HB HIS 84 6.815 -29.255 19.186 663 HB3 HIS 84 3HB HIS 84 6.845 -27.511 18.947 664 HD1 HIS 84 HD1 HIS 84 6.480 -30.725 17.002 665 HD2 HIS 84 HD2 HIS 84 5.864 -26.643 16.530 666 HE1 HIS 84 HE1 HIS 84 5.243 -30.479 14.827 667 H SER 85 H SER 85 8.875 -29.282 15.999 668 HA SER 85 HA SER 85 10.390 -31.666 16.501 669 HB2 SER 85 2HB SER 85 8.023 -32.333 17.083 670 HB3 SER 85 3HB SER 85 7.600 -32.040 15.396 671 HG SER 85 HG SER 85 8.118 -34.237 15.787 672 H ASP 86 H ASP 86 10.514 -29.227 14.887 673 HA ASP 86 HA ASP 86 11.043 -30.510 12.316 674 HB2 ASP 86 2HB ASP 86 9.063 -28.359 12.802 675 HB3 ASP 86 3HB ASP 86 10.107 -28.152 11.398 676 H LEU 87 H LEU 87 11.388 -27.673 14.386 677 HA LEU 87 HA LEU 87 13.275 -26.232 12.983 678 HB2 LEU 87 2HB LEU 87 12.409 -26.445 15.755 679 HB3 LEU 87 3HB LEU 87 14.100 -25.973 15.600 680 HG LEU 87 HG LEU 87 13.441 -24.056 14.230 681 HD11 LEU 87 1HD1 LEU 87 10.969 -25.489 14.072 682 HD12 LEU 87 2HD1 LEU 87 11.493 -24.065 13.174 683 HD13 LEU 87 3HD1 LEU 87 10.683 -23.877 14.730 684 HD21 LEU 87 3HD2 LEU 87 12.163 -22.828 16.026 685 HD22 LEU 87 1HD2 LEU 87 13.658 -23.606 16.543 686 HD23 LEU 87 2HD2 LEU 87 12.103 -24.354 16.909 687 H ASP 88 H ASP 88 13.795 -28.935 15.216 688 HA ASP 88 HA ASP 88 16.508 -28.998 15.434 689 HB2 ASP 88 2HB ASP 88 14.375 -30.893 15.710 690 HB3 ASP 88 3HB ASP 88 15.742 -31.680 14.925 691 H ALA 89 H ALA 89 14.595 -30.205 12.706 692 HA ALA 89 HA ALA 89 16.996 -30.910 11.231 693 HB1 ALA 89 1HB ALA 89 14.269 -31.708 11.170 694 HB2 ALA 89 2HB ALA 89 14.698 -31.072 9.581 695 HB3 ALA 89 3HB ALA 89 15.638 -32.387 10.288 696 H ALA 90 H ALA 90 14.385 -28.529 11.083 697 HA ALA 90 HA ALA 90 15.061 -27.325 8.651 698 HB1 ALA 90 1HB ALA 90 13.479 -26.556 11.025 699 HB2 ALA 90 2HB ALA 90 14.014 -25.244 9.974 700 HB3 ALA 90 3HB ALA 90 13.039 -26.559 9.317 701 H VAL 91 H VAL 91 16.639 -27.237 11.692 702 HA VAL 91 HA VAL 91 17.910 -24.727 11.539 703 HB VAL 91 HB VAL 91 18.636 -27.278 12.961 704 HG11 VAL 91 1HG1 VAL 91 20.276 -24.874 12.512 705 HG12 VAL 91 2HG1 VAL 91 20.187 -25.437 14.182 706 HG13 VAL 91 3HG1 VAL 91 20.760 -26.521 12.914 707 HG21 VAL 91 3HG2 VAL 91 16.770 -25.377 13.530 708 HG22 VAL 91 1HG2 VAL 91 17.535 -26.426 14.723 709 HG23 VAL 91 2HG2 VAL 91 18.158 -24.799 14.452 710 H SER 92 H SER 92 19.167 -27.970 10.741 711 HA SER 92 HA SER 92 21.420 -26.775 9.344 712 HB2 SER 92 2HB SER 92 21.985 -28.676 10.672 713 HB3 SER 92 3HB SER 92 20.671 -29.631 9.986 714 HG SER 92 HG SER 92 23.110 -28.857 8.805 715 H ALA 93 H ALA 93 18.301 -27.944 8.636 716 HA ALA 93 HA ALA 93 18.897 -28.585 5.864 717 HB1 ALA 93 1HB ALA 93 16.458 -29.040 5.715 718 HB2 ALA 93 2HB ALA 93 17.282 -29.981 6.959 719 HB3 ALA 93 3HB ALA 93 16.311 -28.581 7.412 720 H TYR 94 H TYR 94 16.545 -26.408 7.442 721 HA TYR 94 HA TYR 94 15.928 -24.888 5.207 722 HB2 TYR 94 2HB TYR 94 14.934 -24.912 7.644 723 HB3 TYR 94 3HB TYR 94 16.054 -23.577 7.895 724 HD1 TYR 94 HD1 TYR 94 14.094 -24.405 4.843 725 HD2 TYR 94 HD2 TYR 94 14.652 -21.717 8.094 726 HE1 TYR 94 HE1 TYR 94 12.468 -22.859 3.836 727 HE2 TYR 94 HE2 TYR 94 13.026 -20.164 7.096 728 HH TYR 94 HH TYR 94 10.918 -20.584 5.339 729 H GLN 95 H GLN 95 18.642 -24.647 7.405 730 HA GLN 95 HA GLN 95 19.550 -22.089 6.658 731 HB2 GLN 95 2HB GLN 95 21.611 -22.666 7.732 732 HB3 GLN 95 3HB GLN 95 20.305 -23.384 8.665 733 HG2 GLN 95 2HG GLN 95 21.835 -25.092 8.594 734 HG3 GLN 95 3HG GLN 95 20.784 -25.492 7.236 735 HE21 GLN 95 1HE2 GLN 95 23.725 -23.655 7.975 736 HE22 GLN 95 2HE2 GLN 95 24.558 -24.074 6.520 737 H GLN 96 H GLN 96 19.169 -24.695 4.731 738 HA GLN 96 HA GLN 96 21.607 -24.610 3.227 739 HB2 GLN 96 2HB GLN 96 18.919 -25.883 2.761 740 HB3 GLN 96 3HB GLN 96 20.192 -25.938 1.549 741 HG2 GLN 96 2HG GLN 96 20.993 -26.771 4.250 742 HG3 GLN 96 3HG GLN 96 19.814 -27.810 3.451 743 HE21 GLN 96 1HE2 GLN 96 22.928 -27.624 4.049 744 HE22 GLN 96 2HE2 GLN 96 23.594 -28.313 2.612 745 H GLY 97 H GLY 97 20.229 -22.059 3.598 746 HA2 GLY 97 2HA GLY 97 20.536 -20.286 1.957 747 HA3 GLY 97 3HA GLY 97 19.877 -21.377 0.747 748 H ALA 98 H ALA 98 18.557 -20.919 3.974 749 HA ALA 98 HA ALA 98 16.197 -19.645 2.749 750 HB1 ALA 98 1HB ALA 98 16.006 -22.064 3.643 751 HB2 ALA 98 2HB ALA 98 16.013 -21.301 5.234 752 HB3 ALA 98 3HB ALA 98 14.756 -20.893 4.067 753 H PHE 99 H PHE 99 14.835 -18.481 4.458 754 HA PHE 99 HA PHE 99 16.617 -16.684 5.896 755 HB2 PHE 99 2HB PHE 99 14.993 -15.554 4.578 756 HB3 PHE 99 3HB PHE 99 13.687 -16.564 5.191 757 HD1 PHE 99 HD1 PHE 99 16.046 -13.868 6.072 758 HD2 PHE 99 HD2 PHE 99 12.537 -16.010 7.175 759 HE1 PHE 99 HE1 PHE 99 15.572 -12.191 7.808 760 HE2 PHE 99 HE2 PHE 99 12.057 -14.336 8.913 761 HZ PHE 99 HZ PHE 99 13.575 -12.423 9.231 762 H ASP 100 H ASP 100 16.314 -16.120 8.098 763 HA ASP 100 HA ASP 100 16.094 -18.188 9.887 764 HB2 ASP 100 2HB ASP 100 17.016 -15.918 10.378 765 HB3 ASP 100 3HB ASP 100 15.365 -15.315 10.484 766 H TYR 101 H TYR 101 14.446 -19.509 10.246 767 HA TYR 101 HA TYR 101 11.760 -18.904 9.594 768 HB2 TYR 101 2HB TYR 101 11.308 -21.039 10.951 769 HB3 TYR 101 3HB TYR 101 12.322 -21.184 9.520 770 HD1 TYR 101 HD2 TYR 101 12.850 -20.321 13.125 771 HD2 TYR 101 HD1 TYR 101 14.096 -22.623 9.772 772 HE1 TYR 101 HE2 TYR 101 14.622 -21.341 14.492 773 HE2 TYR 101 HE1 TYR 101 15.871 -23.650 11.129 774 HH TYR 101 HH TYR 101 16.408 -22.672 14.496 775 H LEU 102 H LEU 102 9.990 -19.348 11.330 776 HA LEU 102 HA LEU 102 10.657 -17.945 13.825 777 HB2 LEU 102 2HB LEU 102 9.617 -16.194 12.812 778 HB3 LEU 102 3HB LEU 102 8.649 -17.232 11.768 779 HG LEU 102 HG LEU 102 7.300 -17.783 13.872 780 HD11 LEU 102 1HD1 LEU 102 9.203 -15.827 14.911 781 HD12 LEU 102 2HD1 LEU 102 8.201 -17.002 15.761 782 HD13 LEU 102 3HD1 LEU 102 7.519 -15.450 15.276 783 HD21 LEU 102 3HD2 LEU 102 7.294 -15.321 12.244 784 HD22 LEU 102 1HD2 LEU 102 6.296 -15.300 13.698 785 HD23 LEU 102 2HD2 LEU 102 6.038 -16.539 12.469 786 HA PRO 103 HA PRO 103 8.600 -21.486 15.530 787 HB2 PRO 103 2HB PRO 103 8.637 -20.652 18.113 788 HB3 PRO 103 3HB PRO 103 10.065 -21.288 17.288 789 HG2 PRO 103 2HG PRO 103 9.280 -18.444 17.794 790 HG3 PRO 103 3HG PRO 103 10.871 -19.210 17.950 791 HD2 PRO 103 2HD PRO 103 10.178 -17.714 15.802 792 HD3 PRO 103 3HD PRO 103 11.288 -19.095 15.685 793 H LYS 104 H LYS 104 6.589 -22.021 16.433 794 HA LYS 104 HA LYS 104 4.690 -19.789 16.727 795 HB2 LYS 104 2HB LYS 104 2.974 -21.113 15.637 796 HB3 LYS 104 3HB LYS 104 4.365 -20.954 14.572 797 HG2 LYS 104 2HG LYS 104 4.473 -23.152 14.376 798 HG3 LYS 104 3HG LYS 104 4.714 -23.306 16.118 799 HD2 LYS 104 2HD LYS 104 2.007 -23.029 14.822 800 HD3 LYS 104 3HD LYS 104 2.756 -24.581 15.202 801 HE2 LYS 104 2HE LYS 104 2.954 -23.737 17.585 802 HE3 LYS 104 3HE LYS 104 1.894 -22.414 17.103 803 HZ1 LYS 104 3HZ LYS 104 0.829 -24.458 18.141 804 HZ2 LYS 104 1HZ LYS 104 1.131 -25.235 16.669 805 HZ3 LYS 104 2HZ LYS 104 0.135 -23.869 16.715 806 HA PRO 105 HA PRO 105 2.504 -19.622 17.204 807 HB2 PRO 105 2HB PRO 105 1.647 -18.254 19.387 808 HB3 PRO 105 3HB PRO 105 0.815 -19.683 18.761 809 HG2 PRO 105 2HG PRO 105 2.736 -19.458 21.046 810 HG3 PRO 105 3HG PRO 105 1.220 -20.373 20.944 811 HD2 PRO 105 2HD PRO 105 3.647 -21.536 20.644 812 HD3 PRO 105 3HD PRO 105 2.200 -22.111 19.790 813 H PHE 106 H PHE 106 2.540 -17.116 17.627 814 HA PHE 106 HA PHE 106 4.957 -16.119 18.836 815 HB2 PHE 106 2HB PHE 106 5.821 -15.115 16.724 816 HB3 PHE 106 3HB PHE 106 5.900 -16.874 16.744 817 HD1 PHE 106 HD1 PHE 106 3.814 -14.043 15.546 818 HD2 PHE 106 HD2 PHE 106 4.966 -18.106 15.014 819 HE1 PHE 106 HE1 PHE 106 2.565 -14.117 13.428 820 HE2 PHE 106 HE2 PHE 106 3.720 -18.186 12.895 821 HZ PHE 106 HZ PHE 106 2.517 -16.190 12.099 822 H ASP 107 H ASP 107 5.187 -13.679 18.226 823 HA ASP 107 HA ASP 107 2.560 -12.498 18.668 824 HB2 ASP 107 2HB ASP 107 5.348 -11.748 19.258 825 HB3 ASP 107 3HB ASP 107 4.309 -10.408 18.780 826 H ILE 108 H ILE 108 1.422 -11.855 16.971 827 HA ILE 108 HA ILE 108 2.194 -11.689 14.358 828 HB ILE 108 HB ILE 108 0.052 -10.219 15.858 829 HG12 ILE 108 2HG1 ILE 108 -0.369 -12.077 13.554 830 HG13 ILE 108 3HG1 ILE 108 0.101 -12.752 15.110 831 HG21 ILE 108 1HG2 ILE 108 0.353 -8.617 14.246 832 HG22 ILE 108 2HG2 ILE 108 0.964 -9.770 13.060 833 HG23 ILE 108 3HG2 ILE 108 -0.762 -9.703 13.416 834 HD11 ILE 108 3HD1 ILE 108 -1.999 -12.662 15.776 835 HD12 ILE 108 1HD1 ILE 108 -2.003 -10.912 15.560 836 HD13 ILE 108 2HD1 ILE 108 -2.466 -11.967 14.224 837 H ASP 109 H ASP 109 2.579 -9.258 16.855 838 HA ASP 109 HA ASP 109 3.181 -7.033 15.298 839 HB2 ASP 109 2HB ASP 109 2.923 -7.289 17.882 840 HB3 ASP 109 3HB ASP 109 4.660 -7.578 17.852 841 H GLU 110 H GLU 110 5.288 -9.645 16.426 842 HA GLU 110 HA GLU 110 7.640 -8.499 15.234 843 HB2 GLU 110 2HB GLU 110 7.329 -10.226 17.248 844 HB3 GLU 110 3HB GLU 110 7.539 -11.386 15.945 845 HG2 GLU 110 2HG GLU 110 9.586 -9.689 15.449 846 HG3 GLU 110 3HG GLU 110 9.480 -9.586 17.205 847 H ALA 111 H ALA 111 5.194 -10.812 14.312 848 HA ALA 111 HA ALA 111 6.559 -12.000 12.142 849 HB1 ALA 111 1HB ALA 111 4.557 -13.036 11.613 850 HB2 ALA 111 2HB ALA 111 4.387 -12.735 13.343 851 HB3 ALA 111 3HB ALA 111 3.586 -11.677 12.181 852 H VAL 112 H VAL 112 4.033 -9.477 12.152 853 HA VAL 112 HA VAL 112 4.020 -8.876 9.462 854 HB VAL 112 HB VAL 112 3.549 -7.116 11.857 855 HG11 VAL 112 1HG1 VAL 112 2.445 -5.586 10.098 856 HG12 VAL 112 2HG1 VAL 112 4.196 -5.510 10.305 857 HG13 VAL 112 3HG1 VAL 112 3.505 -6.402 8.949 858 HG21 VAL 112 3HG2 VAL 112 1.847 -8.734 11.604 859 HG22 VAL 112 1HG2 VAL 112 1.193 -7.242 10.927 860 HG23 VAL 112 2HG2 VAL 112 1.788 -8.510 9.856 861 H ALA 113 H ALA 113 6.320 -7.917 11.919 862 HA ALA 113 HA ALA 113 7.664 -6.034 10.177 863 HB1 ALA 113 1HB ALA 113 8.237 -5.184 12.145 864 HB2 ALA 113 2HB ALA 113 7.647 -6.616 12.989 865 HB3 ALA 113 3HB ALA 113 9.302 -6.570 12.382 866 H LEU 114 H LEU 114 7.980 -9.361 11.155 867 HA LEU 114 HA LEU 114 10.672 -9.761 10.399 868 HB2 LEU 114 2HB LEU 114 9.530 -11.330 11.829 869 HB3 LEU 114 3HB LEU 114 8.356 -11.681 10.563 870 HG LEU 114 HG LEU 114 10.365 -12.547 9.216 871 HD11 LEU 114 1HD1 LEU 114 12.183 -11.705 10.479 872 HD12 LEU 114 2HD1 LEU 114 12.167 -13.452 10.720 873 HD13 LEU 114 3HD1 LEU 114 11.547 -12.382 11.978 874 HD21 LEU 114 3HD2 LEU 114 8.959 -14.237 9.800 875 HD22 LEU 114 1HD2 LEU 114 8.980 -13.814 11.513 876 HD23 LEU 114 2HD2 LEU 114 10.343 -14.679 10.802 877 H VAL 115 H VAL 115 7.624 -10.023 8.638 878 HA VAL 115 HA VAL 115 8.724 -11.125 6.268 879 HB VAL 115 HB VAL 115 6.356 -11.323 6.675 880 HG11 VAL 115 1HG1 VAL 115 4.860 -9.388 6.635 881 HG12 VAL 115 2HG1 VAL 115 6.029 -9.270 7.952 882 HG13 VAL 115 3HG1 VAL 115 6.250 -8.314 6.486 883 HG21 VAL 115 3HG2 VAL 115 5.913 -9.597 4.444 884 HG22 VAL 115 1HG2 VAL 115 7.486 -10.375 4.270 885 HG23 VAL 115 2HG2 VAL 115 6.035 -11.356 4.477 886 H GLU 116 H GLU 116 8.156 -7.829 7.377 887 HA GLU 116 HA GLU 116 8.682 -6.520 4.939 888 HB2 GLU 116 2HB GLU 116 8.110 -5.779 7.626 889 HB3 GLU 116 3HB GLU 116 9.544 -4.895 7.122 890 HG2 GLU 116 2HG GLU 116 7.851 -4.646 4.963 891 HG3 GLU 116 3HG GLU 116 6.771 -4.541 6.353 892 H ARG 117 H ARG 117 10.751 -7.988 7.276 893 HA ARG 117 HA ARG 117 13.132 -6.563 6.642 894 HB2 ARG 117 2HB ARG 117 13.087 -7.669 8.736 895 HB3 ARG 117 3HB ARG 117 12.597 -9.192 8.008 896 HG2 ARG 117 2HG ARG 117 14.702 -9.797 7.577 897 HG3 ARG 117 3HG ARG 117 15.150 -8.186 7.014 898 HD2 ARG 117 2HD ARG 117 14.978 -7.596 9.566 899 HD3 ARG 117 3HD ARG 117 15.223 -9.330 9.767 900 HE ARG 117 HE ARG 117 17.169 -8.378 8.005 901 HH11 ARG 117 1HH1 ARG 117 16.256 -8.063 11.350 902 HH12 ARG 117 2HH1 ARG 117 17.872 -7.757 11.897 903 HH21 ARG 117 1HH2 ARG 117 19.299 -7.976 8.712 904 HH22 ARG 117 2HH2 ARG 117 19.602 -7.707 10.395 905 H ALA 118 H ALA 118 11.543 -9.390 5.335 906 HA ALA 118 HA ALA 118 13.804 -10.126 3.685 907 HB1 ALA 118 1HB ALA 118 12.802 -12.103 3.653 908 HB2 ALA 118 2HB ALA 118 11.488 -11.430 4.619 909 HB3 ALA 118 3HB ALA 118 11.389 -11.407 2.859 910 H ILE 119 H ILE 119 10.872 -8.274 3.396 911 HA ILE 119 HA ILE 119 10.975 -8.168 0.508 912 HB ILE 119 HB ILE 119 9.262 -6.609 2.447 913 HG12 ILE 119 2HG1 ILE 119 8.290 -8.822 0.674 914 HG13 ILE 119 3HG1 ILE 119 9.073 -9.213 2.201 915 HG21 ILE 119 1HG2 ILE 119 9.061 -6.903 -0.548 916 HG22 ILE 119 2HG2 ILE 119 7.880 -6.098 0.484 917 HG23 ILE 119 3HG2 ILE 119 9.509 -5.441 0.331 918 HD11 ILE 119 3HD1 ILE 119 6.787 -7.288 2.085 919 HD12 ILE 119 1HD1 ILE 119 6.521 -9.030 2.142 920 HD13 ILE 119 2HD1 ILE 119 7.384 -8.227 3.453 921 H SER 120 H SER 120 11.342 -5.812 3.158 922 HA SER 120 HA SER 120 12.085 -3.627 1.592 923 HB2 SER 120 2HB SER 120 11.515 -3.762 4.125 924 HB3 SER 120 3HB SER 120 13.239 -4.066 4.334 925 HG SER 120 HG SER 120 13.255 -1.941 4.362 926 H HIS 121 H HIS 121 13.876 -6.424 2.543 927 HA HIS 121 HA HIS 121 16.497 -5.541 2.416 928 HB2 HIS 121 2HB HIS 121 15.688 -7.851 3.047 929 HB3 HIS 121 3HB HIS 121 15.539 -8.190 1.325 930 HD1 HIS 121 HD1 HIS 121 17.670 -8.700 0.037 931 HD2 HIS 121 HD2 HIS 121 18.361 -7.580 3.978 932 HE1 HIS 121 HE1 HIS 121 20.098 -9.200 0.462 933 H TYR 122 H TYR 122 14.202 -6.041 -0.143 934 HA TYR 122 HA TYR 122 16.286 -5.659 -2.171 935 HB2 TYR 122 2HB TYR 122 13.381 -6.282 -2.686 936 HB3 TYR 122 3HB TYR 122 14.746 -6.495 -3.776 937 HD1 TYR 122 HD2 TYR 122 16.664 -8.078 -2.683 938 HD2 TYR 122 HD1 TYR 122 12.510 -8.205 -1.776 939 HE1 TYR 122 HE2 TYR 122 16.906 -10.408 -1.932 940 HE2 TYR 122 HE1 TYR 122 12.739 -10.535 -1.022 941 HH TYR 122 HH TYR 122 15.569 -12.382 -1.596 942 H GLN 123 H GLN 123 13.018 -4.452 -1.406 943 HA GLN 123 HA GLN 123 13.143 -2.248 -3.168 944 HB2 GLN 123 2HB GLN 123 11.345 -3.185 -1.026 945 HB3 GLN 123 3HB GLN 123 11.334 -1.448 -1.303 946 HG2 GLN 123 2HG GLN 123 9.885 -1.815 -2.933 947 HG3 GLN 123 3HG GLN 123 11.206 -2.545 -3.843 948 HE21 GLN 123 1HE2 GLN 123 8.435 -3.202 -4.020 949 HE22 GLN 123 2HE2 GLN 123 8.268 -4.857 -3.554 950 H GLU 124 H GLU 124 13.120 -2.154 0.400 951 HA GLU 124 HA GLU 124 14.055 -0.704 1.884 952 HB2 GLU 124 2HB GLU 124 16.088 -1.566 0.183 953 HB3 GLU 124 3HB GLU 124 16.293 0.179 0.255 954 HG2 GLU 124 2HG GLU 124 16.100 -0.142 2.811 955 HG3 GLU 124 3HG GLU 124 16.457 -1.831 2.457 Start of MODEL 15 1 H1 MET 1 H MET 1 1.061 -0.367 -1.146 2 HA MET 1 HA MET 1 -0.476 -0.600 -3.641 3 HB2 MET 1 2HB MET 1 1.357 0.123 -4.964 4 HB3 MET 1 3HB MET 1 1.181 1.312 -3.681 5 HG2 MET 1 2HG MET 1 2.957 -0.585 -2.676 6 HG3 MET 1 3HG MET 1 3.432 -0.343 -4.356 7 HE1 MET 1 3HE MET 1 5.188 0.747 -4.716 8 HE2 MET 1 1HE MET 1 4.644 2.373 -5.129 9 HE3 MET 1 2HE MET 1 5.891 2.146 -3.903 10 H GLN 2 H GLN 2 0.284 -2.462 -1.411 11 HA GLN 2 HA GLN 2 1.049 -4.587 -1.108 12 HB2 GLN 2 2HB GLN 2 0.442 -4.643 -4.066 13 HB3 GLN 2 3HB GLN 2 0.831 -6.076 -3.124 14 HG2 GLN 2 2HG GLN 2 -1.487 -6.072 -3.216 15 HG3 GLN 2 3HG GLN 2 -1.124 -5.401 -1.627 16 HE21 GLN 2 1HE2 GLN 2 -1.487 -4.231 -4.961 17 HE22 GLN 2 2HE2 GLN 2 -2.475 -2.873 -4.557 18 H ARG 3 H ARG 3 3.122 -2.871 -1.157 19 HA ARG 3 HA ARG 3 5.119 -3.275 -3.061 20 HB2 ARG 3 2HB ARG 3 6.692 -2.565 -1.233 21 HB3 ARG 3 3HB ARG 3 5.343 -1.474 -1.513 22 HG2 ARG 3 2HG ARG 3 5.281 -1.552 0.751 23 HG3 ARG 3 3HG ARG 3 4.243 -2.935 0.401 24 HD2 ARG 3 2HD ARG 3 5.891 -3.477 2.119 25 HD3 ARG 3 3HD ARG 3 6.144 -4.440 0.664 26 HE ARG 3 HE ARG 3 8.177 -3.418 0.377 27 HH11 ARG 3 1HH1 ARG 3 6.313 -1.643 2.721 28 HH12 ARG 3 2HH1 ARG 3 7.630 -0.619 3.186 29 HH21 ARG 3 1HH2 ARG 3 9.919 -2.076 0.981 30 HH22 ARG 3 2HH2 ARG 3 9.681 -0.865 2.195 31 H GLY 4 H GLY 4 3.948 -5.363 -0.602 32 HA2 GLY 4 2HA GLY 4 5.770 -7.443 -1.455 33 HA3 GLY 4 3HA GLY 4 5.995 -6.926 0.210 34 H ILE 5 H ILE 5 4.095 -8.776 -1.965 35 HA ILE 5 HA ILE 5 1.897 -9.195 -0.148 36 HB ILE 5 HB ILE 5 2.652 -10.522 -2.748 37 HG12 ILE 5 2HG1 ILE 5 0.179 -8.911 -2.200 38 HG13 ILE 5 3HG1 ILE 5 1.701 -8.100 -2.551 39 HG21 ILE 5 1HG2 ILE 5 0.260 -11.446 -2.558 40 HG22 ILE 5 2HG2 ILE 5 1.537 -12.238 -1.637 41 HG23 ILE 5 3HG2 ILE 5 0.429 -11.127 -0.832 42 HD11 ILE 5 3HD1 ILE 5 1.248 -8.318 -4.700 43 HD12 ILE 5 1HD1 ILE 5 1.410 -10.065 -4.520 44 HD13 ILE 5 2HD1 ILE 5 -0.172 -9.302 -4.345 45 H VAL 6 H VAL 6 1.612 -10.822 1.269 46 HA VAL 6 HA VAL 6 3.711 -12.889 1.406 47 HB VAL 6 HB VAL 6 2.154 -11.924 3.793 48 HG11 VAL 6 1HG1 VAL 6 4.823 -13.310 3.558 49 HG12 VAL 6 2HG1 VAL 6 3.962 -12.928 5.051 50 HG13 VAL 6 3HG1 VAL 6 3.294 -14.109 3.923 51 HG21 VAL 6 3HG2 VAL 6 3.315 -9.994 2.847 52 HG22 VAL 6 1HG2 VAL 6 4.055 -10.497 4.367 53 HG23 VAL 6 2HG2 VAL 6 4.827 -10.902 2.834 54 H TRP 7 H TRP 7 3.020 -14.899 1.126 55 HA TRP 7 HA TRP 7 0.148 -15.448 1.372 56 HB2 TRP 7 2HB TRP 7 2.358 -16.896 -0.093 57 HB3 TRP 7 3HB TRP 7 0.723 -17.533 0.068 58 HD1 TRP 7 HD1 TRP 7 0.041 -14.062 -0.313 59 HE1 TRP 7 HE1 TRP 7 -0.366 -13.394 -2.765 60 HE3 TRP 7 HE3 TRP 7 2.000 -18.186 -2.613 61 HZ2 TRP 7 HZ2 TRP 7 0.084 -14.473 -5.334 62 HZ3 TRP 7 HZ3 TRP 7 1.972 -18.290 -5.071 63 HH2 TRP 7 HH2 TRP 7 1.033 -16.471 -6.402 64 H VAL 8 H VAL 8 -0.624 -17.216 2.540 65 HA VAL 8 HA VAL 8 1.312 -18.464 4.380 66 HB VAL 8 HB VAL 8 -1.496 -17.559 5.031 67 HG11 VAL 8 1HG1 VAL 8 -1.005 -18.342 7.309 68 HG12 VAL 8 2HG1 VAL 8 -0.997 -19.662 6.138 69 HG13 VAL 8 3HG1 VAL 8 0.526 -19.006 6.739 70 HG21 VAL 8 3HG2 VAL 8 -0.601 -15.670 5.790 71 HG22 VAL 8 1HG2 VAL 8 0.570 -16.564 6.760 72 HG23 VAL 8 2HG2 VAL 8 0.937 -16.164 5.082 73 H VAL 9 H VAL 9 0.947 -20.610 4.957 74 HA VAL 9 HA VAL 9 -1.312 -22.012 3.755 75 HB VAL 9 HB VAL 9 0.508 -22.087 2.066 76 HG11 VAL 9 1HG1 VAL 9 2.363 -22.064 3.745 77 HG12 VAL 9 2HG1 VAL 9 2.003 -23.759 4.076 78 HG13 VAL 9 3HG1 VAL 9 2.541 -23.268 2.470 79 HG21 VAL 9 3HG2 VAL 9 -0.767 -23.895 1.643 80 HG22 VAL 9 1HG2 VAL 9 0.621 -24.785 2.269 81 HG23 VAL 9 2HG2 VAL 9 -0.748 -24.430 3.323 82 H ASP 10 H ASP 10 -2.107 -23.479 5.114 83 HA ASP 10 HA ASP 10 -0.429 -25.036 6.850 84 HB2 ASP 10 2HB ASP 10 -1.514 -24.290 8.954 85 HB3 ASP 10 3HB ASP 10 -0.549 -23.024 8.199 86 H ASP 11 H ASP 11 -2.213 -26.016 8.627 87 HA ASP 11 HA ASP 11 -4.326 -27.137 6.905 88 HB2 ASP 11 2HB ASP 11 -2.281 -28.456 8.301 89 HB3 ASP 11 3HB ASP 11 -3.746 -28.753 9.232 90 H ASP 12 H ASP 12 -3.884 -25.005 9.321 91 HA ASP 12 HA ASP 12 -6.497 -25.621 10.538 92 HB2 ASP 12 2HB ASP 12 -3.919 -24.861 11.770 93 HB3 ASP 12 3HB ASP 12 -5.339 -24.039 12.409 94 H SER 13 H SER 13 -7.911 -23.911 10.896 95 HA SER 13 HA SER 13 -7.644 -21.715 9.077 96 HB2 SER 13 2HB SER 13 -9.779 -23.036 10.195 97 HB3 SER 13 3HB SER 13 -9.781 -21.512 11.082 98 HG SER 13 HG SER 13 -10.915 -21.747 8.895 99 H SER 14 H SER 14 -7.901 -21.956 12.622 100 HA SER 14 HA SER 14 -7.573 -19.239 13.182 101 HB2 SER 14 2HB SER 14 -7.527 -19.863 15.384 102 HB3 SER 14 3HB SER 14 -8.122 -21.377 14.704 103 HG SER 14 HG SER 14 -6.228 -21.438 16.197 104 H ILE 15 H ILE 15 -5.308 -21.580 12.119 105 HA ILE 15 HA ILE 15 -2.964 -20.256 13.127 106 HB ILE 15 HB ILE 15 -3.302 -22.434 11.067 107 HG12 ILE 15 2HG1 ILE 15 -3.844 -23.110 13.350 108 HG13 ILE 15 3HG1 ILE 15 -2.337 -23.860 12.836 109 HG21 ILE 15 1HG2 ILE 15 -0.857 -22.736 11.247 110 HG22 ILE 15 2HG2 ILE 15 -1.306 -21.189 10.531 111 HG23 ILE 15 3HG2 ILE 15 -0.772 -21.261 12.210 112 HD11 ILE 15 3HD1 ILE 15 -1.932 -23.174 15.018 113 HD12 ILE 15 1HD1 ILE 15 -1.183 -21.920 14.030 114 HD13 ILE 15 2HD1 ILE 15 -2.751 -21.629 14.785 115 H ARG 16 H ARG 16 -4.710 -20.375 10.062 116 HA ARG 16 HA ARG 16 -2.783 -18.708 8.711 117 HB2 ARG 16 2HB ARG 16 -4.422 -18.762 6.845 118 HB3 ARG 16 3HB ARG 16 -3.965 -20.363 7.411 119 HG2 ARG 16 2HG ARG 16 -6.037 -20.607 8.587 120 HG3 ARG 16 3HG ARG 16 -6.480 -18.934 8.241 121 HD2 ARG 16 2HD ARG 16 -6.352 -19.544 5.791 122 HD3 ARG 16 3HD ARG 16 -6.231 -21.226 6.306 123 HE ARG 16 HE ARG 16 -8.474 -21.207 6.743 124 HH11 ARG 16 1HH1 ARG 16 -7.340 -17.923 6.528 125 HH12 ARG 16 2HH1 ARG 16 -8.926 -17.231 6.619 126 HH21 ARG 16 1HH2 ARG 16 -10.567 -20.309 6.863 127 HH22 ARG 16 2HH2 ARG 16 -10.761 -18.590 6.810 128 H TRP 17 H TRP 17 -5.800 -18.298 10.410 129 HA TRP 17 HA TRP 17 -6.569 -15.786 9.466 130 HB2 TRP 17 2HB TRP 17 -8.153 -16.899 10.790 131 HB3 TRP 17 3HB TRP 17 -6.992 -17.217 12.075 132 HD1 TRP 17 HD1 TRP 17 -9.025 -14.288 10.588 133 HE1 TRP 17 HE1 TRP 17 -9.376 -12.536 12.441 134 HE3 TRP 17 HE3 TRP 17 -6.172 -16.409 14.263 135 HZ2 TRP 17 HZ2 TRP 17 -8.552 -12.109 15.106 136 HZ3 TRP 17 HZ3 TRP 17 -6.005 -15.264 16.434 137 HH2 TRP 17 HH2 TRP 17 -7.171 -13.159 16.845 138 H VAL 18 H VAL 18 -4.657 -16.559 12.377 139 HA VAL 18 HA VAL 18 -4.097 -14.018 13.254 140 HB VAL 18 HB VAL 18 -1.892 -14.984 14.082 141 HG11 VAL 18 1HG1 VAL 18 -4.311 -16.634 14.777 142 HG12 VAL 18 2HG1 VAL 18 -2.946 -16.214 15.814 143 HG13 VAL 18 3HG1 VAL 18 -4.092 -14.969 15.315 144 HG21 VAL 18 3HG2 VAL 18 -3.028 -17.431 12.738 145 HG22 VAL 18 1HG2 VAL 18 -1.485 -16.645 12.407 146 HG23 VAL 18 2HG2 VAL 18 -1.742 -17.473 13.943 147 H LEU 19 H LEU 19 -2.318 -15.890 10.817 148 HA LEU 19 HA LEU 19 -0.395 -13.845 10.322 149 HB2 LEU 19 2HB LEU 19 -1.169 -16.398 8.977 150 HB3 LEU 19 3HB LEU 19 -0.098 -15.265 8.154 151 HG LEU 19 HG LEU 19 0.510 -16.337 10.897 152 HD11 LEU 19 1HD1 LEU 19 1.877 -17.496 8.552 153 HD12 LEU 19 2HD1 LEU 19 0.214 -18.014 8.828 154 HD13 LEU 19 3HD1 LEU 19 1.426 -18.235 10.089 155 HD21 LEU 19 3HD2 LEU 19 1.626 -14.276 9.611 156 HD22 LEU 19 1HD2 LEU 19 2.580 -15.590 8.921 157 HD23 LEU 19 2HD2 LEU 19 2.538 -15.354 10.668 158 H GLU 20 H GLU 20 -3.607 -14.426 9.256 159 HA GLU 20 HA GLU 20 -3.394 -12.867 6.839 160 HB2 GLU 20 2HB GLU 20 -5.208 -14.737 7.832 161 HB3 GLU 20 3HB GLU 20 -6.096 -13.220 7.840 162 HG2 GLU 20 2HG GLU 20 -5.722 -12.908 5.503 163 HG3 GLU 20 3HG GLU 20 -4.624 -14.285 5.445 164 H ARG 21 H ARG 21 -5.256 -12.452 9.857 165 HA ARG 21 HA ARG 21 -6.086 -9.847 9.436 166 HB2 ARG 21 2HB ARG 21 -6.408 -9.698 11.846 167 HB3 ARG 21 3HB ARG 21 -6.917 -11.275 11.258 168 HG2 ARG 21 2HG ARG 21 -5.121 -12.364 12.234 169 HG3 ARG 21 3HG ARG 21 -4.164 -10.886 12.354 170 HD2 ARG 21 2HD ARG 21 -6.732 -11.000 13.839 171 HD3 ARG 21 3HD ARG 21 -5.388 -11.961 14.453 172 HE ARG 21 HE ARG 21 -4.656 -9.251 13.886 173 HH11 ARG 21 1HH1 ARG 21 -6.098 -11.366 16.245 174 HH12 ARG 21 2HH1 ARG 21 -5.711 -10.345 17.590 175 HH21 ARG 21 1HH2 ARG 21 -4.139 -7.898 15.649 176 HH22 ARG 21 2HH2 ARG 21 -4.597 -8.372 17.249 177 H ALA 22 H ALA 22 -2.958 -11.038 10.299 178 HA ALA 22 HA ALA 22 -1.818 -8.823 11.536 179 HB1 ALA 22 1HB ALA 22 -0.216 -10.366 11.619 180 HB2 ALA 22 2HB ALA 22 -0.870 -11.229 10.226 181 HB3 ALA 22 3HB ALA 22 0.221 -9.864 9.985 182 H LEU 23 H LEU 23 -1.565 -9.673 8.076 183 HA LEU 23 HA LEU 23 -0.696 -6.987 7.439 184 HB2 LEU 23 2HB LEU 23 -1.362 -9.175 5.490 185 HB3 LEU 23 3HB LEU 23 -0.310 -7.783 5.245 186 HG LEU 23 HG LEU 23 0.249 -10.238 6.900 187 HD11 LEU 23 1HD1 LEU 23 1.182 -9.167 4.285 188 HD12 LEU 23 2HD1 LEU 23 0.807 -10.823 4.761 189 HD13 LEU 23 3HD1 LEU 23 2.316 -10.075 5.286 190 HD21 LEU 23 3HD2 LEU 23 1.259 -7.546 7.187 191 HD22 LEU 23 1HD2 LEU 23 2.548 -8.679 6.779 192 HD23 LEU 23 2HD2 LEU 23 1.536 -8.968 8.194 193 H ALA 24 H ALA 24 -3.638 -8.712 7.589 194 HA ALA 24 HA ALA 24 -5.207 -7.638 5.606 195 HB1 ALA 24 1HB ALA 24 -5.902 -9.352 7.281 196 HB2 ALA 24 2HB ALA 24 -6.124 -8.047 8.447 197 HB3 ALA 24 3HB ALA 24 -7.106 -8.098 6.983 198 H GLY 25 H GLY 25 -4.048 -6.105 8.535 199 HA2 GLY 25 2HA GLY 25 -5.740 -3.773 8.166 200 HA3 GLY 25 3HA GLY 25 -4.555 -4.013 9.441 201 H ALA 26 H ALA 26 -2.483 -4.756 7.428 202 HA ALA 26 HA ALA 26 -1.585 -2.058 6.892 203 HB1 ALA 26 1HB ALA 26 -0.169 -4.622 6.196 204 HB2 ALA 26 2HB ALA 26 0.531 -3.014 6.392 205 HB3 ALA 26 3HB ALA 26 -0.102 -3.877 7.794 206 H GLY 27 H GLY 27 -0.090 -2.302 4.619 207 HA2 GLY 27 2HA GLY 27 -2.197 -2.489 2.577 208 HA3 GLY 27 3HA GLY 27 -0.716 -1.555 2.436 209 H LEU 28 H LEU 28 -1.235 -4.952 3.343 210 HA LEU 28 HA LEU 28 0.211 -5.761 0.919 211 HB2 LEU 28 2HB LEU 28 0.913 -7.529 3.026 212 HB3 LEU 28 3HB LEU 28 1.961 -6.498 2.053 213 HG LEU 28 HG LEU 28 0.550 -5.487 4.509 214 HD11 LEU 28 1HD1 LEU 28 3.406 -6.187 4.686 215 HD12 LEU 28 2HD1 LEU 28 2.278 -7.542 4.665 216 HD13 LEU 28 3HD1 LEU 28 2.130 -6.291 5.899 217 HD21 LEU 28 3HD2 LEU 28 2.960 -4.193 4.179 218 HD22 LEU 28 1HD2 LEU 28 1.376 -3.575 3.710 219 HD23 LEU 28 2HD2 LEU 28 2.384 -4.407 2.525 220 H THR 29 H THR 29 -0.605 -7.511 -0.080 221 HA THR 29 HA THR 29 -3.144 -8.492 0.588 222 HB THR 29 HB THR 29 -1.169 -9.978 -1.139 223 HG1 THR 29 HG1 THR 29 -2.714 -7.661 -1.728 224 HG21 THR 29 3HG2 THR 29 -3.090 -11.268 -0.991 225 HG22 THR 29 1HG2 THR 29 -3.410 -10.299 -2.428 226 HG23 THR 29 2HG2 THR 29 -4.150 -9.863 -0.887 227 H CYS 30 H CYS 30 -3.748 -10.715 1.094 228 HA CYS 30 HA CYS 30 -1.740 -12.281 2.521 229 HB2 CYS 30 2HB CYS 30 -3.428 -12.575 4.419 230 HB3 CYS 30 3HB CYS 30 -2.577 -11.037 4.343 231 HG CYS 30 HG CYS 30 -4.852 -9.887 2.885 232 H THR 31 H THR 31 -1.891 -13.932 1.053 233 HA THR 31 HA THR 31 -4.534 -15.115 0.577 234 HB THR 31 HB THR 31 -1.944 -15.824 -0.806 235 HG1 THR 31 HG1 THR 31 -3.989 -14.105 -1.788 236 HG21 THR 31 3HG2 THR 31 -3.829 -17.467 -0.889 237 HG22 THR 31 1HG2 THR 31 -3.343 -16.846 -2.466 238 HG23 THR 31 2HG2 THR 31 -4.801 -16.232 -1.687 239 H THR 32 H THR 32 -5.091 -16.652 1.970 240 HA THR 32 HA THR 32 -3.006 -18.377 3.111 241 HB THR 32 HB THR 32 -4.551 -18.939 4.864 242 HG1 THR 32 HG1 THR 32 -6.672 -17.630 4.684 243 HG21 THR 32 3HG2 THR 32 -5.043 -16.685 5.807 244 HG22 THR 32 1HG2 THR 32 -4.578 -15.981 4.259 245 HG23 THR 32 2HG2 THR 32 -3.389 -16.860 5.222 246 H PHE 33 H PHE 33 -2.907 -20.497 2.669 247 HA PHE 33 HA PHE 33 -5.069 -21.648 1.031 248 HB2 PHE 33 2HB PHE 33 -2.118 -22.313 1.014 249 HB3 PHE 33 3HB PHE 33 -3.345 -23.137 0.058 250 HD1 PHE 33 HD2 PHE 33 -4.405 -22.024 -1.830 251 HD2 PHE 33 HD1 PHE 33 -1.333 -20.126 0.422 252 HE1 PHE 33 HE2 PHE 33 -4.116 -20.369 -3.627 253 HE2 PHE 33 HE1 PHE 33 -1.039 -18.466 -1.371 254 HZ PHE 33 HZ PHE 33 -2.431 -18.587 -3.400 255 H GLU 34 H GLU 34 -4.455 -24.278 1.096 256 HA GLU 34 HA GLU 34 -4.523 -24.974 3.958 257 HB2 GLU 34 2HB GLU 34 -6.170 -26.702 3.466 258 HB3 GLU 34 3HB GLU 34 -6.769 -25.124 2.973 259 HG2 GLU 34 2HG GLU 34 -6.127 -25.640 0.650 260 HG3 GLU 34 3HG GLU 34 -5.626 -27.247 1.173 261 H ASN 35 H ASN 35 -3.693 -25.983 0.687 262 HA ASN 35 HA ASN 35 -1.878 -27.996 1.845 263 HB2 ASN 35 2HB ASN 35 -3.894 -28.247 -0.240 264 HB3 ASN 35 3HB ASN 35 -2.304 -28.760 -0.796 265 HD21 ASN 35 1HD2 ASN 35 -4.752 -30.291 -0.232 266 HD22 ASN 35 2HD2 ASN 35 -4.288 -31.500 0.911 267 H GLY 36 H GLY 36 0.211 -27.656 1.472 268 HA2 GLY 36 2HA GLY 36 1.237 -25.435 0.169 269 HA3 GLY 36 3HA GLY 36 2.155 -26.892 0.519 270 H ASN 37 H ASN 37 0.570 -28.643 -1.125 271 HA ASN 37 HA ASN 37 1.947 -28.456 -3.536 272 HB2 ASN 37 2HB ASN 37 0.573 -30.421 -2.442 273 HB3 ASN 37 3HB ASN 37 -0.727 -29.796 -3.452 274 HD21 ASN 37 1HD2 ASN 37 -0.345 -29.667 -5.747 275 HD22 ASN 37 2HD2 ASN 37 0.724 -30.798 -6.497 276 H GLU 38 H GLU 38 -0.963 -26.908 -2.499 277 HA GLU 38 HA GLU 38 -1.730 -26.152 -5.203 278 HB2 GLU 38 2HB GLU 38 -3.046 -25.015 -2.775 279 HB3 GLU 38 3HB GLU 38 -3.749 -25.452 -4.327 280 HG2 GLU 38 2HG GLU 38 -2.826 -27.378 -2.206 281 HG3 GLU 38 3HG GLU 38 -4.497 -26.938 -2.553 282 H VAL 39 H VAL 39 0.240 -24.988 -2.709 283 HA VAL 39 HA VAL 39 -0.036 -22.185 -3.425 284 HB VAL 39 HB VAL 39 2.062 -23.323 -1.594 285 HG11 VAL 39 1HG1 VAL 39 1.682 -20.796 -2.503 286 HG12 VAL 39 2HG1 VAL 39 0.738 -20.767 -1.012 287 HG13 VAL 39 3HG1 VAL 39 2.447 -21.199 -0.966 288 HG21 VAL 39 3HG2 VAL 39 -0.021 -24.239 -0.807 289 HG22 VAL 39 1HG2 VAL 39 0.466 -22.927 0.266 290 HG23 VAL 39 2HG2 VAL 39 -0.805 -22.665 -0.928 291 H LEU 40 H LEU 40 2.309 -24.803 -3.765 292 HA LEU 40 HA LEU 40 4.493 -23.449 -4.743 293 HB2 LEU 40 2HB LEU 40 4.948 -25.659 -4.479 294 HB3 LEU 40 3HB LEU 40 3.386 -26.168 -5.116 295 HG LEU 40 HG LEU 40 4.171 -25.796 -7.389 296 HD11 LEU 40 1HD1 LEU 40 6.971 -25.521 -6.935 297 HD12 LEU 40 2HD1 LEU 40 6.126 -24.207 -6.118 298 HD13 LEU 40 3HD1 LEU 40 5.885 -24.471 -7.845 299 HD21 LEU 40 3HD2 LEU 40 5.304 -27.763 -7.539 300 HD22 LEU 40 1HD2 LEU 40 4.743 -27.900 -5.873 301 HD23 LEU 40 2HD2 LEU 40 6.391 -27.369 -6.207 302 H ALA 41 H ALA 41 1.614 -24.508 -6.508 303 HA ALA 41 HA ALA 41 2.553 -23.595 -9.049 304 HB1 ALA 41 1HB ALA 41 0.982 -25.199 -9.388 305 HB2 ALA 41 2HB ALA 41 0.028 -24.722 -7.984 306 HB3 ALA 41 3HB ALA 41 -0.066 -23.784 -9.474 307 H ALA 42 H ALA 42 0.807 -22.168 -6.397 308 HA ALA 42 HA ALA 42 -0.412 -20.012 -7.690 309 HB1 ALA 42 1HB ALA 42 0.743 -19.912 -4.912 310 HB2 ALA 42 2HB ALA 42 -0.634 -19.012 -5.552 311 HB3 ALA 42 3HB ALA 42 -0.755 -20.755 -5.308 312 H LEU 43 H LEU 43 2.881 -20.433 -6.513 313 HA LEU 43 HA LEU 43 3.772 -17.797 -6.703 314 HB2 LEU 43 2HB LEU 43 5.534 -20.095 -7.446 315 HB3 LEU 43 3HB LEU 43 5.931 -18.633 -6.545 316 HG LEU 43 HG LEU 43 4.493 -21.087 -5.566 317 HD11 LEU 43 1HD1 LEU 43 7.100 -19.741 -5.001 318 HD12 LEU 43 2HD1 LEU 43 6.761 -21.442 -5.321 319 HD13 LEU 43 3HD1 LEU 43 6.325 -20.734 -3.766 320 HD21 LEU 43 3HD2 LEU 43 4.766 -19.379 -3.413 321 HD22 LEU 43 1HD2 LEU 43 3.266 -19.765 -4.257 322 HD23 LEU 43 2HD2 LEU 43 4.187 -18.330 -4.708 323 H ALA 44 H ALA 44 3.505 -20.312 -9.159 324 HA ALA 44 HA ALA 44 4.885 -18.976 -11.219 325 HB1 ALA 44 1HB ALA 44 4.201 -21.417 -11.133 326 HB2 ALA 44 2HB ALA 44 2.603 -20.884 -11.656 327 HB3 ALA 44 3HB ALA 44 4.008 -20.599 -12.684 328 H SER 45 H SER 45 1.922 -18.286 -9.749 329 HA SER 45 HA SER 45 0.583 -17.159 -12.018 330 HB2 SER 45 2HB SER 45 0.042 -16.638 -9.087 331 HB3 SER 45 3HB SER 45 -1.066 -16.374 -10.433 332 HG SER 45 HG SER 45 -1.310 -18.532 -10.670 333 H LYS 46 H LYS 46 1.591 -15.510 -9.028 334 HA LYS 46 HA LYS 46 2.537 -13.267 -10.689 335 HB2 LYS 46 2HB LYS 46 1.831 -11.818 -8.700 336 HB3 LYS 46 3HB LYS 46 0.553 -12.450 -9.730 337 HG2 LYS 46 2HG LYS 46 0.160 -14.251 -8.101 338 HG3 LYS 46 3HG LYS 46 1.400 -13.552 -7.058 339 HD2 LYS 46 2HD LYS 46 -1.138 -12.181 -7.945 340 HD3 LYS 46 3HD LYS 46 -0.850 -12.887 -6.353 341 HE2 LYS 46 2HE LYS 46 -0.308 -10.727 -5.886 342 HE3 LYS 46 3HE LYS 46 1.265 -11.285 -6.453 343 HZ1 LYS 46 3HZ LYS 46 -0.260 -9.203 -7.470 344 HZ2 LYS 46 1HZ LYS 46 -0.282 -10.421 -8.645 345 HZ3 LYS 46 2HZ LYS 46 1.193 -9.812 -8.085 346 H THR 47 H THR 47 3.259 -15.546 -8.312 347 HA THR 47 HA THR 47 5.097 -15.955 -7.034 348 HB THR 47 HB THR 47 6.847 -13.870 -8.062 349 HG1 THR 47 HG1 THR 47 5.909 -13.878 -9.995 350 HG21 THR 47 3HG2 THR 47 7.132 -16.381 -7.090 351 HG22 THR 47 1HG2 THR 47 8.355 -15.553 -8.051 352 HG23 THR 47 2HG2 THR 47 7.248 -16.688 -8.822 353 HA PRO 48 HA PRO 48 4.265 -12.726 -4.002 354 HB2 PRO 48 2HB PRO 48 4.892 -14.270 -1.859 355 HB3 PRO 48 3HB PRO 48 3.332 -14.362 -2.685 356 HG2 PRO 48 2HG PRO 48 5.729 -16.134 -2.961 357 HG3 PRO 48 3HG PRO 48 4.015 -16.578 -2.862 358 HD2 PRO 48 2HD PRO 48 5.362 -16.486 -5.209 359 HD3 PRO 48 3HD PRO 48 3.633 -16.102 -5.085 360 H ASP 49 H ASP 49 5.608 -12.039 -1.995 361 HA ASP 49 HA ASP 49 8.408 -11.858 -2.860 362 HB2 ASP 49 2HB ASP 49 6.567 -10.047 -1.382 363 HB3 ASP 49 3HB ASP 49 8.274 -9.988 -0.953 364 H VAL 50 H VAL 50 6.415 -13.292 -0.524 365 HA VAL 50 HA VAL 50 8.515 -14.679 0.720 366 HB VAL 50 HB VAL 50 9.054 -12.561 1.787 367 HG11 VAL 50 1HG1 VAL 50 6.401 -12.012 1.683 368 HG12 VAL 50 2HG1 VAL 50 6.595 -12.421 3.389 369 HG13 VAL 50 3HG1 VAL 50 7.563 -11.130 2.674 370 HG21 VAL 50 3HG2 VAL 50 9.535 -13.576 3.722 371 HG22 VAL 50 1HG2 VAL 50 7.833 -13.831 4.110 372 HG23 VAL 50 2HG2 VAL 50 8.677 -14.967 3.059 373 H LEU 51 H LEU 51 7.710 -16.460 1.663 374 HA LEU 51 HA LEU 51 4.832 -16.485 2.299 375 HB2 LEU 51 2HB LEU 51 6.093 -17.959 0.379 376 HB3 LEU 51 3HB LEU 51 6.106 -19.066 1.751 377 HG LEU 51 HG LEU 51 3.509 -17.799 1.174 378 HD11 LEU 51 1HD1 LEU 51 4.212 -20.066 -0.603 379 HD12 LEU 51 2HD1 LEU 51 4.773 -18.459 -1.062 380 HD13 LEU 51 3HD1 LEU 51 3.050 -18.760 -0.834 381 HD21 LEU 51 3HD2 LEU 51 4.392 -19.851 2.728 382 HD22 LEU 51 1HD2 LEU 51 3.792 -20.713 1.310 383 HD23 LEU 51 2HD2 LEU 51 2.722 -19.631 2.202 384 H LEU 52 H LEU 52 4.173 -17.988 3.988 385 HA LEU 52 HA LEU 52 6.312 -18.515 5.944 386 HB2 LEU 52 2HB LEU 52 3.509 -17.871 6.769 387 HB3 LEU 52 3HB LEU 52 4.996 -17.772 7.711 388 HG LEU 52 HG LEU 52 5.297 -15.925 5.624 389 HD11 LEU 52 1HD1 LEU 52 2.512 -15.974 6.733 390 HD12 LEU 52 2HD1 LEU 52 3.038 -15.814 5.057 391 HD13 LEU 52 3HD1 LEU 52 3.260 -14.474 6.183 392 HD21 LEU 52 3HD2 LEU 52 5.062 -15.957 8.549 393 HD22 LEU 52 1HD2 LEU 52 4.655 -14.418 7.789 394 HD23 LEU 52 2HD2 LEU 52 6.237 -15.149 7.509 395 H SER 53 H SER 53 6.203 -20.620 4.714 396 HA SER 53 HA SER 53 4.066 -22.358 4.707 397 HB2 SER 53 2HB SER 53 6.335 -22.716 3.646 398 HB3 SER 53 3HB SER 53 6.917 -23.214 5.234 399 HG SER 53 HG SER 53 5.907 -25.056 5.027 400 H ASP 54 H ASP 54 3.186 -23.823 6.114 401 HA ASP 54 HA ASP 54 4.182 -23.761 8.886 402 HB2 ASP 54 2HB ASP 54 1.970 -22.480 8.315 403 HB3 ASP 54 3HB ASP 54 1.262 -24.093 8.291 404 H ILE 55 H ILE 55 5.016 -25.706 9.270 405 HA ILE 55 HA ILE 55 4.031 -28.070 7.942 406 HB ILE 55 HB ILE 55 6.096 -27.872 10.136 407 HG12 ILE 55 2HG1 ILE 55 6.760 -28.203 7.235 408 HG13 ILE 55 3HG1 ILE 55 6.425 -26.593 7.861 409 HG21 ILE 55 1HG2 ILE 55 5.292 -30.109 9.938 410 HG22 ILE 55 2HG2 ILE 55 5.395 -30.050 8.179 411 HG23 ILE 55 3HG2 ILE 55 6.868 -30.038 9.149 412 HD11 ILE 55 3HD1 ILE 55 8.865 -27.672 7.797 413 HD12 ILE 55 1HD1 ILE 55 8.360 -26.492 9.006 414 HD13 ILE 55 2HD1 ILE 55 8.350 -28.213 9.394 415 H ARG 56 H ARG 56 2.181 -28.939 8.623 416 HA ARG 56 HA ARG 56 1.904 -30.164 11.109 417 HB2 ARG 56 2HB ARG 56 0.032 -28.698 12.019 418 HB3 ARG 56 3HB ARG 56 1.668 -28.073 12.178 419 HG2 ARG 56 2HG ARG 56 1.267 -26.723 10.115 420 HG3 ARG 56 3HG ARG 56 -0.419 -27.242 10.179 421 HD2 ARG 56 2HD ARG 56 1.083 -25.626 12.231 422 HD3 ARG 56 3HD ARG 56 -0.254 -25.089 11.215 423 HE ARG 56 HE ARG 56 -1.370 -27.109 12.575 424 HH11 ARG 56 1HH1 ARG 56 0.546 -24.393 13.610 425 HH12 ARG 56 2HH1 ARG 56 -0.209 -24.286 15.166 426 HH21 ARG 56 1HH2 ARG 56 -2.372 -26.979 14.620 427 HH22 ARG 56 2HH2 ARG 56 -1.869 -25.758 15.739 428 H MET 57 H MET 57 1.429 -30.657 8.327 429 HA MET 57 HA MET 57 -1.412 -31.399 8.471 430 HB2 MET 57 2HB MET 57 -1.587 -31.001 6.023 431 HB3 MET 57 3HB MET 57 -1.300 -29.533 6.947 432 HG2 MET 57 2HG MET 57 1.232 -30.216 6.360 433 HG3 MET 57 3HG MET 57 0.396 -30.887 4.962 434 HE1 MET 57 3HE MET 57 1.857 -28.452 3.253 435 HE2 MET 57 1HE MET 57 2.323 -27.404 4.594 436 HE3 MET 57 2HE MET 57 2.532 -29.150 4.726 437 HA PRO 58 HA PRO 58 -0.121 -35.464 7.435 438 HB2 PRO 58 2HB PRO 58 -2.256 -36.355 6.015 439 HB3 PRO 58 3HB PRO 58 -2.300 -36.114 7.766 440 HG2 PRO 58 2HG PRO 58 -3.301 -34.327 5.583 441 HG3 PRO 58 3HG PRO 58 -4.069 -34.748 7.125 442 HD2 PRO 58 2HD PRO 58 -2.761 -32.408 6.739 443 HD3 PRO 58 3HD PRO 58 -2.805 -33.229 8.312 444 H GLY 59 H GLY 59 -0.440 -37.028 5.320 445 HA2 GLY 59 2HA GLY 59 0.372 -37.489 3.224 446 HA3 GLY 59 3HA GLY 59 -0.253 -35.912 2.763 447 H MET 60 H MET 60 1.128 -34.191 2.558 448 HA MET 60 HA MET 60 3.810 -34.716 1.959 449 HB2 MET 60 2HB MET 60 2.044 -32.471 1.883 450 HB3 MET 60 3HB MET 60 3.555 -31.966 2.627 451 HG2 MET 60 2HG MET 60 4.451 -31.785 0.620 452 HG3 MET 60 3HG MET 60 4.249 -33.521 0.394 453 HE1 MET 60 3HE MET 60 2.451 -30.147 -1.744 454 HE2 MET 60 1HE MET 60 1.660 -30.134 -0.167 455 HE3 MET 60 2HE MET 60 3.421 -30.118 -0.270 456 H ASP 61 H ASP 61 5.452 -32.932 3.072 457 HA ASP 61 HA ASP 61 5.423 -33.594 5.945 458 HB2 ASP 61 2HB ASP 61 7.575 -33.781 3.905 459 HB3 ASP 61 3HB ASP 61 8.045 -33.225 5.509 460 H GLY 62 H GLY 62 4.735 -31.152 4.075 461 HA2 GLY 62 2HA GLY 62 4.537 -28.903 4.612 462 HA3 GLY 62 3HA GLY 62 5.546 -29.182 6.023 463 H LEU 63 H LEU 63 7.893 -29.983 5.167 464 HA LEU 63 HA LEU 63 8.924 -27.660 3.796 465 HB2 LEU 63 2HB LEU 63 11.128 -28.998 4.159 466 HB3 LEU 63 3HB LEU 63 10.318 -28.228 5.522 467 HG LEU 63 HG LEU 63 9.431 -30.347 6.254 468 HD11 LEU 63 1HD1 LEU 63 10.352 -32.420 4.995 469 HD12 LEU 63 2HD1 LEU 63 10.505 -31.307 3.636 470 HD13 LEU 63 3HD1 LEU 63 8.927 -31.587 4.373 471 HD21 LEU 63 3HD2 LEU 63 11.703 -31.615 6.442 472 HD22 LEU 63 1HD2 LEU 63 11.494 -30.054 7.235 473 HD23 LEU 63 2HD2 LEU 63 12.359 -30.154 5.701 474 H ALA 64 H ALA 64 7.893 -30.763 2.918 475 HA ALA 64 HA ALA 64 9.549 -31.633 0.933 476 HB1 ALA 64 1HB ALA 64 6.713 -31.893 1.528 477 HB2 ALA 64 2HB ALA 64 7.070 -32.032 -0.193 478 HB3 ALA 64 3HB ALA 64 7.868 -33.100 0.962 479 H LEU 65 H LEU 65 6.938 -29.240 0.538 480 HA LEU 65 HA LEU 65 7.718 -28.663 -2.172 481 HB2 LEU 65 2HB LEU 65 5.768 -27.549 -2.336 482 HB3 LEU 65 3HB LEU 65 5.381 -28.469 -0.884 483 HG LEU 65 HG LEU 65 6.413 -25.635 -0.888 484 HD11 LEU 65 1HD1 LEU 65 3.810 -26.642 -1.472 485 HD12 LEU 65 2HD1 LEU 65 4.355 -24.969 -1.361 486 HD13 LEU 65 3HD1 LEU 65 3.769 -25.802 0.078 487 HD21 LEU 65 3HD2 LEU 65 6.387 -25.703 1.361 488 HD22 LEU 65 1HD2 LEU 65 6.556 -27.442 1.120 489 HD23 LEU 65 2HD2 LEU 65 4.964 -26.744 1.418 490 H LEU 66 H LEU 66 8.489 -27.472 0.967 491 HA LEU 66 HA LEU 66 9.305 -24.855 0.264 492 HB2 LEU 66 2HB LEU 66 8.930 -26.092 2.593 493 HB3 LEU 66 3HB LEU 66 10.677 -26.286 2.470 494 HG LEU 66 HG LEU 66 10.459 -24.357 3.727 495 HD11 LEU 66 1HD1 LEU 66 11.918 -24.013 1.775 496 HD12 LEU 66 2HD1 LEU 66 11.168 -22.517 2.330 497 HD13 LEU 66 3HD1 LEU 66 10.551 -23.332 0.893 498 HD21 LEU 66 3HD2 LEU 66 7.895 -24.236 2.580 499 HD22 LEU 66 1HD2 LEU 66 8.682 -22.703 2.209 500 HD23 LEU 66 2HD2 LEU 66 8.547 -23.242 3.883 501 H LYS 67 H LYS 67 10.993 -27.952 0.403 502 HA LYS 67 HA LYS 67 13.606 -27.072 0.043 503 HB2 LYS 67 2HB LYS 67 12.278 -29.596 -0.959 504 HB3 LYS 67 3HB LYS 67 14.016 -29.323 -0.959 505 HG2 LYS 67 2HG LYS 67 12.240 -29.405 1.472 506 HG3 LYS 67 3HG LYS 67 13.336 -30.681 0.937 507 HD2 LYS 67 2HD LYS 67 14.138 -27.894 1.773 508 HD3 LYS 67 3HD LYS 67 14.324 -29.359 2.741 509 HE2 LYS 67 2HE LYS 67 15.719 -30.271 0.832 510 HE3 LYS 67 3HE LYS 67 15.713 -28.637 0.172 511 HZ1 LYS 67 3HZ LYS 67 16.509 -28.083 2.603 512 HZ2 LYS 67 1HZ LYS 67 17.603 -28.553 1.401 513 HZ3 LYS 67 2HZ LYS 67 17.067 -29.679 2.543 514 H GLN 68 H GLN 68 10.967 -27.179 -2.186 515 HA GLN 68 HA GLN 68 12.665 -26.910 -4.523 516 HB2 GLN 68 2HB GLN 68 10.827 -27.406 -5.750 517 HB3 GLN 68 3HB GLN 68 10.225 -28.008 -4.212 518 HG2 GLN 68 2HG GLN 68 8.458 -26.732 -4.850 519 HG3 GLN 68 3HG GLN 68 9.384 -25.533 -3.948 520 HE21 GLN 68 1HE2 GLN 68 8.482 -23.826 -5.086 521 HE22 GLN 68 2HE2 GLN 68 8.904 -23.483 -6.726 522 H ILE 69 H ILE 69 10.944 -24.891 -2.307 523 HA ILE 69 HA ILE 69 10.585 -22.597 -3.877 524 HB ILE 69 HB ILE 69 11.102 -22.786 -0.907 525 HG12 ILE 69 2HG1 ILE 69 8.518 -22.607 -2.473 526 HG13 ILE 69 3HG1 ILE 69 9.126 -24.045 -1.659 527 HG21 ILE 69 1HG2 ILE 69 11.264 -20.566 -0.986 528 HG22 ILE 69 2HG2 ILE 69 10.761 -20.514 -2.675 529 HG23 ILE 69 3HG2 ILE 69 9.549 -20.552 -1.395 530 HD11 ILE 69 3HD1 ILE 69 9.095 -22.097 0.312 531 HD12 ILE 69 1HD1 ILE 69 7.614 -21.830 -0.606 532 HD13 ILE 69 2HD1 ILE 69 7.941 -23.413 0.099 533 H LYS 70 H LYS 70 13.411 -23.937 -2.382 534 HA LYS 70 HA LYS 70 14.965 -21.515 -2.552 535 HB2 LYS 70 2HB LYS 70 15.913 -24.350 -2.101 536 HB3 LYS 70 3HB LYS 70 16.823 -22.878 -1.787 537 HG2 LYS 70 2HG LYS 70 14.221 -23.432 -0.407 538 HG3 LYS 70 3HG LYS 70 15.749 -24.077 0.197 539 HD2 LYS 70 2HD LYS 70 16.506 -22.037 0.854 540 HD3 LYS 70 3HD LYS 70 15.679 -21.189 -0.455 541 HE2 LYS 70 2HE LYS 70 13.534 -21.952 0.887 542 HE3 LYS 70 3HE LYS 70 14.677 -21.995 2.229 543 HZ1 LYS 70 3HZ LYS 70 15.278 -19.636 1.231 544 HZ2 LYS 70 1HZ LYS 70 14.039 -19.842 2.366 545 HZ3 LYS 70 2HZ LYS 70 13.666 -19.711 0.721 546 H GLN 71 H GLN 71 14.326 -24.287 -4.548 547 HA GLN 71 HA GLN 71 16.519 -23.674 -6.360 548 HB2 GLN 71 2HB GLN 71 15.805 -26.035 -5.760 549 HB3 GLN 71 3HB GLN 71 14.367 -25.755 -6.732 550 HG2 GLN 71 2HG GLN 71 15.474 -26.331 -8.550 551 HG3 GLN 71 3HG GLN 71 16.615 -25.014 -8.284 552 HE21 GLN 71 1HE2 GLN 71 17.036 -27.704 -9.363 553 HE22 GLN 71 2HE2 GLN 71 18.247 -28.428 -8.366 554 H ARG 72 H ARG 72 13.078 -23.235 -6.096 555 HA ARG 72 HA ARG 72 12.869 -22.326 -8.861 556 HB2 ARG 72 2HB ARG 72 11.129 -23.791 -7.621 557 HB3 ARG 72 3HB ARG 72 10.633 -22.288 -6.855 558 HG2 ARG 72 2HG ARG 72 9.666 -21.489 -8.730 559 HG3 ARG 72 3HG ARG 72 10.857 -22.239 -9.795 560 HD2 ARG 72 2HD ARG 72 9.724 -24.460 -9.024 561 HD3 ARG 72 3HD ARG 72 8.380 -23.402 -8.597 562 HE ARG 72 HE ARG 72 9.202 -24.172 -11.231 563 HH11 ARG 72 1HH1 ARG 72 7.628 -21.695 -9.359 564 HH12 ARG 72 2HH1 ARG 72 6.700 -21.094 -10.693 565 HH21 ARG 72 1HH2 ARG 72 7.986 -23.390 -12.995 566 HH22 ARG 72 2HH2 ARG 72 6.903 -22.059 -12.760 567 H HIS 73 H HIS 73 12.921 -21.096 -5.596 568 HA HIS 73 HA HIS 73 13.085 -18.379 -6.658 569 HB2 HIS 73 2HB HIS 73 11.353 -18.937 -4.260 570 HB3 HIS 73 3HB HIS 73 11.430 -17.475 -5.240 571 HD1 HIS 73 HD1 HIS 73 10.260 -17.585 -7.601 572 HD2 HIS 73 HD2 HIS 73 9.569 -20.852 -5.129 573 HE1 HIS 73 HE1 HIS 73 8.301 -18.792 -8.614 574 HA PRO 74 HA PRO 74 16.286 -19.342 -3.444 575 HB2 PRO 74 2HB PRO 74 18.352 -18.291 -4.857 576 HB3 PRO 74 3HB PRO 74 17.807 -19.961 -5.052 577 HG2 PRO 74 2HG PRO 74 17.199 -17.561 -6.735 578 HG3 PRO 74 3HG PRO 74 17.606 -19.210 -7.244 579 HD2 PRO 74 2HD PRO 74 15.063 -18.282 -7.209 580 HD3 PRO 74 3HD PRO 74 15.463 -19.982 -6.891 581 H MET 75 H MET 75 15.963 -16.440 -5.479 582 HA MET 75 HA MET 75 17.078 -14.708 -3.483 583 HB2 MET 75 2HB MET 75 16.317 -12.890 -5.021 584 HB3 MET 75 3HB MET 75 17.352 -14.089 -5.785 585 HG2 MET 75 2HG MET 75 15.821 -14.257 -7.371 586 HG3 MET 75 3HG MET 75 14.787 -15.051 -6.185 587 HE1 MET 75 3HE MET 75 12.856 -13.794 -4.810 588 HE2 MET 75 1HE MET 75 11.852 -12.859 -5.919 589 HE3 MET 75 2HE MET 75 12.452 -14.446 -6.399 590 H LEU 76 H LEU 76 14.179 -16.261 -3.674 591 HA LEU 76 HA LEU 76 12.601 -14.085 -2.528 592 HB2 LEU 76 2HB LEU 76 11.548 -15.417 -4.255 593 HB3 LEU 76 3HB LEU 76 11.850 -16.890 -3.336 594 HG LEU 76 HG LEU 76 10.350 -15.846 -1.536 595 HD11 LEU 76 1HD1 LEU 76 8.640 -14.294 -2.513 596 HD12 LEU 76 2HD1 LEU 76 9.718 -14.082 -3.892 597 HD13 LEU 76 3HD1 LEU 76 10.241 -13.592 -2.281 598 HD21 LEU 76 3HD2 LEU 76 8.297 -16.368 -3.195 599 HD22 LEU 76 1HD2 LEU 76 9.296 -17.618 -2.452 600 HD23 LEU 76 2HD2 LEU 76 9.621 -17.096 -4.106 601 HA PRO 77 HA PRO 77 13.707 -15.604 1.525 602 HB2 PRO 77 2HB PRO 77 12.321 -13.713 2.894 603 HB3 PRO 77 3HB PRO 77 13.889 -13.398 2.140 604 HG2 PRO 77 2HG PRO 77 11.142 -12.756 1.138 605 HG3 PRO 77 3HG PRO 77 12.606 -11.756 1.109 606 HD2 PRO 77 2HD PRO 77 11.728 -13.116 -1.062 607 HD3 PRO 77 3HD PRO 77 13.451 -12.824 -0.750 608 H VAL 78 H VAL 78 12.725 -16.931 2.978 609 HA VAL 78 HA VAL 78 9.798 -17.073 3.014 610 HB VAL 78 HB VAL 78 11.484 -19.565 2.829 611 HG11 VAL 78 1HG1 VAL 78 8.542 -18.981 2.810 612 HG12 VAL 78 2HG1 VAL 78 9.188 -20.479 2.137 613 HG13 VAL 78 3HG1 VAL 78 9.445 -20.093 3.839 614 HG21 VAL 78 3HG2 VAL 78 11.811 -18.929 0.685 615 HG22 VAL 78 1HG2 VAL 78 10.163 -19.523 0.482 616 HG23 VAL 78 2HG2 VAL 78 10.457 -17.798 0.701 617 H ILE 79 H ILE 79 8.946 -18.240 4.872 618 HA ILE 79 HA ILE 79 10.847 -18.483 7.101 619 HB ILE 79 HB ILE 79 8.134 -17.173 7.305 620 HG12 ILE 79 2HG1 ILE 79 10.741 -15.782 7.809 621 HG13 ILE 79 3HG1 ILE 79 10.143 -15.938 6.160 622 HG21 ILE 79 1HG2 ILE 79 8.684 -16.736 9.595 623 HG22 ILE 79 2HG2 ILE 79 8.892 -18.461 9.296 624 HG23 ILE 79 3HG2 ILE 79 10.302 -17.405 9.384 625 HD11 ILE 79 3HD1 ILE 79 8.281 -14.889 8.212 626 HD12 ILE 79 1HD1 ILE 79 9.590 -13.843 7.662 627 HD13 ILE 79 2HD1 ILE 79 8.430 -14.489 6.501 628 H ILE 80 H ILE 80 10.605 -20.268 8.303 629 HA ILE 80 HA ILE 80 8.393 -22.063 7.644 630 HB ILE 80 HB ILE 80 11.057 -22.492 8.966 631 HG12 ILE 80 2HG1 ILE 80 10.645 -22.516 6.417 632 HG13 ILE 80 3HG1 ILE 80 11.534 -23.862 7.123 633 HG21 ILE 80 1HG2 ILE 80 8.665 -24.311 8.982 634 HG22 ILE 80 2HG2 ILE 80 10.311 -24.908 9.182 635 HG23 ILE 80 3HG2 ILE 80 9.638 -23.769 10.348 636 HD11 ILE 80 3HD1 ILE 80 8.627 -24.230 6.957 637 HD12 ILE 80 1HD1 ILE 80 9.473 -24.130 5.413 638 HD13 ILE 80 2HD1 ILE 80 9.942 -25.349 6.599 639 H MET 81 H MET 81 6.941 -22.827 9.125 640 HA MET 81 HA MET 81 7.160 -21.823 11.880 641 HB2 MET 81 2HB MET 81 4.501 -21.961 10.496 642 HB3 MET 81 3HB MET 81 4.956 -21.045 11.927 643 HG2 MET 81 2HG MET 81 6.324 -19.566 10.524 644 HG3 MET 81 3HG MET 81 5.809 -20.467 9.100 645 HE1 MET 81 3HE MET 81 2.096 -20.437 10.028 646 HE2 MET 81 1HE MET 81 2.428 -19.852 8.398 647 HE3 MET 81 2HE MET 81 3.366 -21.189 9.062 648 H THR 82 H THR 82 7.072 -23.427 13.296 649 HA THR 82 HA THR 82 5.147 -25.519 13.165 650 HB THR 82 HB THR 82 6.550 -26.548 11.539 651 HG1 THR 82 HG1 THR 82 5.944 -27.725 13.671 652 HG21 THR 82 3HG2 THR 82 8.575 -25.078 12.408 653 HG22 THR 82 1HG2 THR 82 8.840 -26.580 11.524 654 HG23 THR 82 2HG2 THR 82 8.961 -26.560 13.283 655 H ALA 83 H ALA 83 8.379 -24.725 14.431 656 HA ALA 83 HA ALA 83 9.191 -24.626 16.557 657 HB1 ALA 83 1HB ALA 83 7.070 -24.825 18.298 658 HB2 ALA 83 2HB ALA 83 7.728 -23.330 17.633 659 HB3 ALA 83 3HB ALA 83 6.345 -24.105 16.860 660 H HIS 84 H HIS 84 8.725 -25.867 18.865 661 HA HIS 84 HA HIS 84 9.306 -27.876 19.824 662 HB2 HIS 84 2HB HIS 84 7.467 -29.425 19.881 663 HB3 HIS 84 3HB HIS 84 6.803 -27.794 19.847 664 HD1 HIS 84 HD1 HIS 84 6.934 -30.959 17.924 665 HD2 HIS 84 HD2 HIS 84 5.519 -27.086 17.414 666 HE1 HIS 84 HE1 HIS 84 5.412 -31.057 15.925 667 H SER 85 H SER 85 8.616 -30.514 18.911 668 HA SER 85 HA SER 85 10.914 -31.235 17.553 669 HB2 SER 85 2HB SER 85 8.470 -32.543 18.397 670 HB3 SER 85 3HB SER 85 9.024 -33.178 16.847 671 HG SER 85 HG SER 85 10.635 -32.924 19.172 672 H ASP 86 H ASP 86 11.333 -30.010 15.744 673 HA ASP 86 HA ASP 86 10.582 -30.903 13.271 674 HB2 ASP 86 2HB ASP 86 8.516 -29.252 14.446 675 HB3 ASP 86 3HB ASP 86 9.133 -28.523 12.966 676 H LEU 87 H LEU 87 11.262 -27.987 15.135 677 HA LEU 87 HA LEU 87 12.508 -26.541 13.050 678 HB2 LEU 87 2HB LEU 87 12.045 -26.237 15.876 679 HB3 LEU 87 3HB LEU 87 13.685 -25.743 15.461 680 HG LEU 87 HG LEU 87 12.879 -24.070 13.961 681 HD11 LEU 87 1HD1 LEU 87 11.070 -24.942 12.829 682 HD12 LEU 87 2HD1 LEU 87 10.299 -23.761 13.888 683 HD13 LEU 87 3HD1 LEU 87 10.266 -25.474 14.306 684 HD21 LEU 87 3HD2 LEU 87 11.950 -22.575 15.479 685 HD22 LEU 87 1HD2 LEU 87 12.773 -23.741 16.516 686 HD23 LEU 87 2HD2 LEU 87 11.025 -23.831 16.302 687 H ASP 88 H ASP 88 13.735 -28.767 15.498 688 HA ASP 88 HA ASP 88 16.444 -28.438 15.266 689 HB2 ASP 88 2HB ASP 88 15.106 -30.092 16.723 690 HB3 ASP 88 3HB ASP 88 15.230 -31.191 15.352 691 H ALA 89 H ALA 89 14.257 -29.952 12.996 692 HA ALA 89 HA ALA 89 16.368 -31.033 11.355 693 HB1 ALA 89 1HB ALA 89 13.829 -30.841 10.008 694 HB2 ALA 89 2HB ALA 89 14.739 -32.273 10.491 695 HB3 ALA 89 3HB ALA 89 13.632 -31.506 11.630 696 H ALA 90 H ALA 90 14.109 -28.307 11.187 697 HA ALA 90 HA ALA 90 14.979 -27.391 8.641 698 HB1 ALA 90 1HB ALA 90 13.897 -25.181 9.668 699 HB2 ALA 90 2HB ALA 90 12.926 -26.526 9.067 700 HB3 ALA 90 3HB ALA 90 13.231 -26.362 10.796 701 H VAL 91 H VAL 91 16.304 -27.167 11.780 702 HA VAL 91 HA VAL 91 17.638 -24.713 11.689 703 HB VAL 91 HB VAL 91 18.381 -27.295 13.059 704 HG11 VAL 91 1HG1 VAL 91 19.915 -24.835 12.735 705 HG12 VAL 91 2HG1 VAL 91 19.684 -25.302 14.421 706 HG13 VAL 91 3HG1 VAL 91 20.431 -26.428 13.287 707 HG21 VAL 91 3HG2 VAL 91 16.376 -25.487 13.589 708 HG22 VAL 91 1HG2 VAL 91 17.066 -26.632 14.740 709 HG23 VAL 91 2HG2 VAL 91 17.670 -24.976 14.674 710 H SER 92 H SER 92 18.889 -27.948 10.855 711 HA SER 92 HA SER 92 21.197 -26.738 9.561 712 HB2 SER 92 2HB SER 92 22.058 -28.596 10.533 713 HB3 SER 92 3HB SER 92 20.495 -29.410 10.585 714 HG SER 92 HG SER 92 22.201 -29.157 8.330 715 H ALA 93 H ALA 93 18.107 -27.928 8.737 716 HA ALA 93 HA ALA 93 18.793 -28.512 5.976 717 HB1 ALA 93 1HB ALA 93 17.153 -29.931 7.018 718 HB2 ALA 93 2HB ALA 93 16.150 -28.538 7.425 719 HB3 ALA 93 3HB ALA 93 16.376 -28.999 5.738 720 H TYR 94 H TYR 94 16.376 -26.377 7.510 721 HA TYR 94 HA TYR 94 15.813 -24.826 5.286 722 HB2 TYR 94 2HB TYR 94 14.732 -24.883 7.667 723 HB3 TYR 94 3HB TYR 94 15.869 -23.585 8.015 724 HD1 TYR 94 HD2 TYR 94 13.943 -24.291 4.903 725 HD2 TYR 94 HD1 TYR 94 14.573 -21.660 8.187 726 HE1 TYR 94 HE2 TYR 94 12.394 -22.670 3.893 727 HE2 TYR 94 HE1 TYR 94 13.025 -20.031 7.187 728 HH TYR 94 HH TYR 94 10.921 -20.348 5.405 729 H GLN 95 H GLN 95 18.464 -24.591 7.564 730 HA GLN 95 HA GLN 95 19.380 -22.024 6.856 731 HB2 GLN 95 2HB GLN 95 21.399 -22.584 8.004 732 HB3 GLN 95 3HB GLN 95 20.073 -23.334 8.882 733 HG2 GLN 95 2HG GLN 95 21.618 -25.023 8.849 734 HG3 GLN 95 3HG GLN 95 20.641 -25.414 7.435 735 HE21 GLN 95 1HE2 GLN 95 22.028 -26.334 6.077 736 HE22 GLN 95 2HE2 GLN 95 23.513 -25.635 5.538 737 H GLN 96 H GLN 96 19.079 -24.631 4.913 738 HA GLN 96 HA GLN 96 21.563 -24.535 3.492 739 HB2 GLN 96 2HB GLN 96 18.891 -25.801 2.926 740 HB3 GLN 96 3HB GLN 96 20.205 -25.851 1.758 741 HG2 GLN 96 2HG GLN 96 20.572 -26.809 4.572 742 HG3 GLN 96 3HG GLN 96 19.901 -27.848 3.317 743 HE21 GLN 96 1HE2 GLN 96 21.291 -27.557 1.174 744 HE22 GLN 96 2HE2 GLN 96 22.982 -27.814 1.413 745 H GLY 97 H GLY 97 20.221 -21.977 3.824 746 HA2 GLY 97 2HA GLY 97 20.595 -20.213 2.182 747 HA3 GLY 97 3HA GLY 97 19.920 -21.290 0.968 748 H ALA 98 H ALA 98 18.581 -20.805 4.181 749 HA ALA 98 HA ALA 98 16.274 -19.451 2.940 750 HB1 ALA 98 1HB ALA 98 15.985 -21.877 3.768 751 HB2 ALA 98 2HB ALA 98 16.007 -21.164 5.381 752 HB3 ALA 98 3HB ALA 98 14.773 -20.677 4.219 753 H PHE 99 H PHE 99 14.914 -18.288 4.655 754 HA PHE 99 HA PHE 99 16.728 -16.591 6.180 755 HB2 PHE 99 2HB PHE 99 15.226 -15.333 4.856 756 HB3 PHE 99 3HB PHE 99 13.850 -16.323 5.332 757 HD1 PHE 99 HD2 PHE 99 16.160 -13.676 6.402 758 HD2 PHE 99 HD1 PHE 99 12.661 -15.904 7.357 759 HE1 PHE 99 HE2 PHE 99 15.626 -12.066 8.184 760 HE2 PHE 99 HE1 PHE 99 12.121 -14.297 9.141 761 HZ PHE 99 HZ PHE 99 13.605 -12.376 9.557 762 H ASP 100 H ASP 100 16.417 -16.097 8.382 763 HA ASP 100 HA ASP 100 16.047 -18.160 10.122 764 HB2 ASP 100 2HB ASP 100 16.973 -15.897 10.677 765 HB3 ASP 100 3HB ASP 100 15.319 -15.294 10.754 766 H TYR 101 H TYR 101 14.348 -19.488 10.178 767 HA TYR 101 HA TYR 101 11.711 -18.801 9.498 768 HB2 TYR 101 2HB TYR 101 11.154 -20.980 10.722 769 HB3 TYR 101 3HB TYR 101 12.263 -21.088 9.361 770 HD1 TYR 101 HD1 TYR 101 12.648 -20.264 12.992 771 HD2 TYR 101 HD2 TYR 101 13.896 -22.670 9.712 772 HE1 TYR 101 HE1 TYR 101 14.305 -21.366 14.439 773 HE2 TYR 101 HE2 TYR 101 15.555 -23.780 11.150 774 HH TYR 101 HH TYR 101 16.808 -23.276 13.241 775 H LEU 102 H LEU 102 9.957 -19.587 11.317 776 HA LEU 102 HA LEU 102 10.498 -18.183 13.823 777 HB2 LEU 102 2HB LEU 102 9.486 -16.388 12.863 778 HB3 LEU 102 3HB LEU 102 8.556 -17.377 11.739 779 HG LEU 102 HG LEU 102 7.138 -18.031 13.765 780 HD11 LEU 102 1HD1 LEU 102 8.009 -17.353 15.713 781 HD12 LEU 102 2HD1 LEU 102 7.286 -15.797 15.307 782 HD13 LEU 102 3HD1 LEU 102 8.988 -16.097 14.955 783 HD21 LEU 102 3HD2 LEU 102 6.117 -15.561 13.684 784 HD22 LEU 102 1HD2 LEU 102 5.940 -16.716 12.363 785 HD23 LEU 102 2HD2 LEU 102 7.186 -15.471 12.284 786 HA PRO 103 HA PRO 103 8.414 -21.862 15.214 787 HB2 PRO 103 2HB PRO 103 8.555 -21.281 17.862 788 HB3 PRO 103 3HB PRO 103 9.935 -21.884 16.936 789 HG2 PRO 103 2HG PRO 103 9.269 -19.076 17.733 790 HG3 PRO 103 3HG PRO 103 10.836 -19.906 17.765 791 HD2 PRO 103 2HD PRO 103 10.138 -18.189 15.792 792 HD3 PRO 103 3HD PRO 103 11.192 -19.589 15.510 793 H LYS 104 H LYS 104 6.383 -22.404 15.981 794 HA LYS 104 HA LYS 104 4.576 -20.143 16.544 795 HB2 LYS 104 2HB LYS 104 4.408 -22.265 14.579 796 HB3 LYS 104 3HB LYS 104 3.008 -22.278 15.643 797 HG2 LYS 104 2HG LYS 104 2.827 -19.781 15.153 798 HG3 LYS 104 3HG LYS 104 3.961 -20.085 13.834 799 HD2 LYS 104 2HD LYS 104 2.385 -21.840 12.997 800 HD3 LYS 104 3HD LYS 104 1.231 -21.307 14.222 801 HE2 LYS 104 2HE LYS 104 2.425 -19.469 12.157 802 HE3 LYS 104 3HE LYS 104 0.909 -20.337 11.919 803 HZ1 LYS 104 3HZ LYS 104 1.386 -18.533 14.221 804 HZ2 LYS 104 1HZ LYS 104 -0.088 -19.178 13.699 805 HZ3 LYS 104 2HZ LYS 104 0.700 -18.006 12.768 806 HA PRO 105 HA PRO 105 2.392 -19.968 17.080 807 HB2 PRO 105 2HB PRO 105 1.611 -18.689 19.343 808 HB3 PRO 105 3HB PRO 105 0.742 -20.075 18.674 809 HG2 PRO 105 2HG PRO 105 2.722 -19.984 20.918 810 HG3 PRO 105 3HG PRO 105 1.190 -20.871 20.813 811 HD2 PRO 105 2HD PRO 105 3.590 -22.054 20.398 812 HD3 PRO 105 3HD PRO 105 2.113 -22.568 19.556 813 H PHE 106 H PHE 106 2.437 -17.463 17.799 814 HA PHE 106 HA PHE 106 4.917 -16.576 18.924 815 HB2 PHE 106 2HB PHE 106 5.681 -15.424 16.818 816 HB3 PHE 106 3HB PHE 106 5.834 -17.178 16.797 817 HD1 PHE 106 HD2 PHE 106 3.364 -14.538 15.870 818 HD2 PHE 106 HD1 PHE 106 5.140 -18.286 14.914 819 HE1 PHE 106 HE2 PHE 106 2.060 -14.621 13.786 820 HE2 PHE 106 HE1 PHE 106 3.840 -18.374 12.827 821 HZ PHE 106 HZ PHE 106 2.297 -16.540 12.261 822 H ASP 107 H ASP 107 5.159 -14.080 18.245 823 HA ASP 107 HA ASP 107 2.560 -12.903 18.902 824 HB2 ASP 107 2HB ASP 107 5.401 -11.962 19.204 825 HB3 ASP 107 3HB ASP 107 4.054 -10.831 19.314 826 H ILE 108 H ILE 108 1.393 -12.192 17.250 827 HA ILE 108 HA ILE 108 2.123 -11.882 14.639 828 HB ILE 108 HB ILE 108 0.028 -10.402 16.216 829 HG12 ILE 108 2HG1 ILE 108 -0.490 -12.363 14.018 830 HG13 ILE 108 3HG1 ILE 108 0.025 -12.966 15.589 831 HG21 ILE 108 1HG2 ILE 108 -0.898 -9.932 13.841 832 HG22 ILE 108 2HG2 ILE 108 0.360 -8.887 14.499 833 HG23 ILE 108 3HG2 ILE 108 0.777 -10.142 13.333 834 HD11 ILE 108 3HD1 ILE 108 -2.562 -12.127 14.738 835 HD12 ILE 108 1HD1 ILE 108 -2.074 -12.863 16.264 836 HD13 ILE 108 2HD1 ILE 108 -2.027 -11.110 16.076 837 H ASP 109 H ASP 109 2.531 -9.578 17.254 838 HA ASP 109 HA ASP 109 3.128 -7.286 15.782 839 HB2 ASP 109 2HB ASP 109 3.745 -8.250 18.529 840 HB3 ASP 109 3HB ASP 109 4.684 -6.890 17.919 841 H GLU 110 H GLU 110 5.243 -9.911 16.875 842 HA GLU 110 HA GLU 110 7.595 -8.721 15.729 843 HB2 GLU 110 2HB GLU 110 7.625 -10.223 17.731 844 HB3 GLU 110 3HB GLU 110 7.199 -11.563 16.675 845 HG2 GLU 110 2HG GLU 110 9.436 -10.286 15.528 846 HG3 GLU 110 3HG GLU 110 9.765 -10.475 17.250 847 H ALA 111 H ALA 111 5.193 -11.061 14.749 848 HA ALA 111 HA ALA 111 6.601 -12.175 12.564 849 HB1 ALA 111 1HB ALA 111 4.377 -12.936 11.799 850 HB2 ALA 111 2HB ALA 111 4.686 -13.306 13.496 851 HB3 ALA 111 3HB ALA 111 3.636 -11.956 13.065 852 H VAL 112 H VAL 112 3.994 -9.736 12.610 853 HA VAL 112 HA VAL 112 3.968 -9.085 9.933 854 HB VAL 112 HB VAL 112 3.442 -7.385 12.360 855 HG11 VAL 112 1HG1 VAL 112 2.289 -5.864 10.609 856 HG12 VAL 112 2HG1 VAL 112 4.031 -5.720 10.857 857 HG13 VAL 112 3HG1 VAL 112 3.408 -6.612 9.469 858 HG21 VAL 112 3HG2 VAL 112 1.968 -9.370 11.449 859 HG22 VAL 112 1HG2 VAL 112 1.228 -7.887 12.053 860 HG23 VAL 112 2HG2 VAL 112 1.411 -8.137 10.317 861 H ALA 113 H ALA 113 6.245 -8.115 12.405 862 HA ALA 113 HA ALA 113 7.528 -6.151 10.708 863 HB1 ALA 113 1HB ALA 113 7.923 -7.117 13.502 864 HB2 ALA 113 2HB ALA 113 9.232 -6.256 12.691 865 HB3 ALA 113 3HB ALA 113 7.663 -5.479 12.901 866 H LEU 114 H LEU 114 7.980 -9.484 11.652 867 HA LEU 114 HA LEU 114 10.665 -9.781 10.845 868 HB2 LEU 114 2HB LEU 114 9.604 -11.413 12.262 869 HB3 LEU 114 3HB LEU 114 8.415 -11.778 11.014 870 HG LEU 114 HG LEU 114 10.423 -12.559 9.612 871 HD11 LEU 114 1HD1 LEU 114 12.307 -13.399 10.998 872 HD12 LEU 114 2HD1 LEU 114 11.656 -12.489 12.360 873 HD13 LEU 114 3HD1 LEU 114 12.210 -11.640 10.918 874 HD21 LEU 114 3HD2 LEU 114 9.149 -14.340 10.157 875 HD22 LEU 114 1HD2 LEU 114 9.053 -13.888 11.859 876 HD23 LEU 114 2HD2 LEU 114 10.493 -14.698 11.243 877 H VAL 115 H VAL 115 7.604 -10.259 9.125 878 HA VAL 115 HA VAL 115 8.701 -11.251 6.730 879 HB VAL 115 HB VAL 115 6.339 -11.492 7.178 880 HG11 VAL 115 1HG1 VAL 115 4.804 -9.625 7.200 881 HG12 VAL 115 2HG1 VAL 115 6.049 -9.380 8.426 882 HG13 VAL 115 3HG1 VAL 115 6.125 -8.497 6.901 883 HG21 VAL 115 3HG2 VAL 115 5.969 -9.724 4.914 884 HG22 VAL 115 1HG2 VAL 115 7.432 -10.696 4.758 885 HG23 VAL 115 2HG2 VAL 115 5.872 -11.483 4.998 886 H GLU 116 H GLU 116 8.031 -7.969 7.845 887 HA GLU 116 HA GLU 116 8.421 -6.576 5.475 888 HB2 GLU 116 2HB GLU 116 8.909 -5.852 8.352 889 HB3 GLU 116 3HB GLU 116 9.255 -4.714 7.058 890 HG2 GLU 116 2HG GLU 116 6.584 -5.975 7.043 891 HG3 GLU 116 3HG GLU 116 6.915 -4.810 8.324 892 H ARG 117 H ARG 117 10.761 -7.922 7.713 893 HA ARG 117 HA ARG 117 13.051 -6.609 6.726 894 HB2 ARG 117 2HB ARG 117 13.294 -7.649 8.818 895 HB3 ARG 117 3HB ARG 117 12.619 -9.167 8.243 896 HG2 ARG 117 2HG ARG 117 14.592 -9.902 7.458 897 HG3 ARG 117 3HG ARG 117 15.088 -8.301 6.904 898 HD2 ARG 117 2HD ARG 117 15.239 -7.823 9.489 899 HD3 ARG 117 3HD ARG 117 15.407 -9.576 9.577 900 HE ARG 117 HE ARG 117 17.167 -8.356 7.667 901 HH11 ARG 117 1HH1 ARG 117 16.733 -9.200 11.016 902 HH12 ARG 117 2HH1 ARG 117 18.431 -9.250 11.359 903 HH21 ARG 117 1HH2 ARG 117 19.405 -8.418 8.105 904 HH22 ARG 117 2HH2 ARG 117 19.950 -8.804 9.702 905 H ALA 118 H ALA 118 11.311 -9.456 5.674 906 HA ALA 118 HA ALA 118 13.359 -10.298 3.829 907 HB1 ALA 118 1HB ALA 118 12.243 -12.188 4.242 908 HB2 ALA 118 2HB ALA 118 10.801 -11.324 4.780 909 HB3 ALA 118 3HB ALA 118 11.072 -11.602 3.059 910 H ILE 119 H ILE 119 10.379 -8.444 3.700 911 HA ILE 119 HA ILE 119 10.247 -8.338 0.847 912 HB ILE 119 HB ILE 119 8.924 -6.576 2.913 913 HG12 ILE 119 2HG1 ILE 119 7.895 -8.968 1.370 914 HG13 ILE 119 3HG1 ILE 119 8.273 -8.934 3.088 915 HG21 ILE 119 1HG2 ILE 119 8.317 -6.891 -0.024 916 HG22 ILE 119 2HG2 ILE 119 7.414 -5.905 1.125 917 HG23 ILE 119 3HG2 ILE 119 9.080 -5.489 0.725 918 HD11 ILE 119 3HD1 ILE 119 5.845 -8.259 1.769 919 HD12 ILE 119 1HD1 ILE 119 6.188 -8.339 3.496 920 HD13 ILE 119 2HD1 ILE 119 6.459 -6.837 2.612 921 H SER 120 H SER 120 11.081 -5.901 3.315 922 HA SER 120 HA SER 120 11.856 -3.870 1.584 923 HB2 SER 120 2HB SER 120 13.161 -4.403 4.256 924 HB3 SER 120 3HB SER 120 12.934 -2.848 3.455 925 HG SER 120 HG SER 120 11.395 -3.675 5.231 926 H HIS 121 H HIS 121 13.520 -6.764 2.524 927 HA HIS 121 HA HIS 121 16.163 -6.099 1.992 928 HB2 HIS 121 2HB HIS 121 15.263 -8.273 2.952 929 HB3 HIS 121 3HB HIS 121 14.921 -8.761 1.295 930 HD1 HIS 121 HD1 HIS 121 17.012 -9.116 -0.276 931 HD2 HIS 121 HD2 HIS 121 17.892 -8.526 3.741 932 HE1 HIS 121 HE1 HIS 121 19.401 -9.849 0.004 933 H TYR 122 H TYR 122 13.514 -6.599 -0.183 934 HA TYR 122 HA TYR 122 15.011 -7.123 -2.532 935 HB2 TYR 122 2HB TYR 122 12.206 -6.262 -1.952 936 HB3 TYR 122 3HB TYR 122 12.809 -6.142 -3.601 937 HD1 TYR 122 HD2 TYR 122 14.255 -8.433 -4.212 938 HD2 TYR 122 HD1 TYR 122 10.928 -8.134 -1.577 939 HE1 TYR 122 HE2 TYR 122 13.768 -10.817 -4.566 940 HE2 TYR 122 HE1 TYR 122 10.432 -10.518 -1.923 941 HH TYR 122 HH TYR 122 10.953 -12.236 -3.914 942 H GLN 123 H GLN 123 13.399 -4.143 -1.413 943 HA GLN 123 HA GLN 123 14.909 -2.585 -3.352 944 HB2 GLN 123 2HB GLN 123 12.889 -1.618 -1.325 945 HB3 GLN 123 3HB GLN 123 13.494 -0.734 -2.720 946 HG2 GLN 123 2HG GLN 123 11.926 -1.592 -4.018 947 HG3 GLN 123 3HG GLN 123 12.377 -3.234 -3.560 948 HE21 GLN 123 1HE2 GLN 123 10.170 -3.810 -3.651 949 HE22 GLN 123 2HE2 GLN 123 9.090 -3.401 -2.366 950 H GLU 124 H GLU 124 16.646 -3.683 -1.604 951 HA GLU 124 HA GLU 124 17.222 -2.382 0.762 952 HB2 GLU 124 2HB GLU 124 18.564 -4.175 -1.003 953 HB3 GLU 124 3HB GLU 124 19.691 -2.900 -0.560 954 HG2 GLU 124 2HG GLU 124 19.148 -3.342 1.828 955 HG3 GLU 124 3HG GLU 124 18.189 -4.723 1.300 Start of MODEL 16 1 H1 MET 1 H MET 1 3.284 0.026 4.905 2 HA MET 1 HA MET 1 2.992 1.341 2.290 3 HB2 MET 1 2HB MET 1 5.045 1.859 3.608 4 HB3 MET 1 3HB MET 1 5.488 0.160 3.521 5 HG2 MET 1 2HG MET 1 6.725 1.062 1.813 6 HG3 MET 1 3HG MET 1 5.289 0.497 0.962 7 HE1 MET 1 3HE MET 1 5.045 1.676 -0.973 8 HE2 MET 1 1HE MET 1 3.526 2.278 -0.310 9 HE3 MET 1 2HE MET 1 4.623 3.380 -1.143 10 H GLN 2 H GLN 2 2.483 0.127 0.596 11 HA GLN 2 HA GLN 2 2.684 -2.786 0.842 12 HB2 GLN 2 2HB GLN 2 1.066 -2.907 -0.953 13 HB3 GLN 2 3HB GLN 2 0.476 -1.811 0.289 14 HG2 GLN 2 2HG GLN 2 0.195 -0.249 -1.243 15 HG3 GLN 2 3HG GLN 2 1.930 -0.255 -1.555 16 HE21 GLN 2 1HE2 GLN 2 -0.940 -2.205 -2.306 17 HE22 GLN 2 2HE2 GLN 2 -0.532 -2.478 -3.962 18 H ARG 3 H ARG 3 3.804 -4.040 -0.595 19 HA ARG 3 HA ARG 3 4.841 -3.167 -3.060 20 HB2 ARG 3 2HB ARG 3 7.095 -2.704 -2.619 21 HB3 ARG 3 3HB ARG 3 6.229 -1.826 -1.366 22 HG2 ARG 3 2HG ARG 3 7.437 -4.551 -0.965 23 HG3 ARG 3 3HG ARG 3 8.263 -3.038 -0.587 24 HD2 ARG 3 2HD ARG 3 5.749 -2.832 0.614 25 HD3 ARG 3 3HD ARG 3 6.285 -4.481 0.934 26 HE ARG 3 HE ARG 3 8.379 -2.669 1.471 27 HH11 ARG 3 1HH1 ARG 3 5.314 -3.735 2.733 28 HH12 ARG 3 2HH1 ARG 3 5.713 -3.360 4.377 29 HH21 ARG 3 1HH2 ARG 3 8.916 -2.171 3.631 30 HH22 ARG 3 2HH2 ARG 3 7.762 -2.470 4.886 31 H GLY 4 H GLY 4 5.080 -5.314 -0.300 32 HA2 GLY 4 2HA GLY 4 5.818 -7.494 -2.155 33 HA3 GLY 4 3HA GLY 4 6.415 -7.410 -0.505 34 H ILE 5 H ILE 5 4.267 -8.940 -2.422 35 HA ILE 5 HA ILE 5 2.028 -9.065 -0.607 36 HB ILE 5 HB ILE 5 2.673 -10.580 -3.133 37 HG12 ILE 5 2HG1 ILE 5 0.343 -8.744 -2.673 38 HG13 ILE 5 3HG1 ILE 5 1.927 -8.083 -3.065 39 HG21 ILE 5 1HG2 ILE 5 0.449 -10.937 -1.169 40 HG22 ILE 5 2HG2 ILE 5 0.179 -11.252 -2.882 41 HG23 ILE 5 3HG2 ILE 5 1.412 -12.155 -2.003 42 HD11 ILE 5 3HD1 ILE 5 -0.041 -9.335 -4.777 43 HD12 ILE 5 1HD1 ILE 5 1.339 -8.318 -5.190 44 HD13 ILE 5 2HD1 ILE 5 1.560 -10.052 -4.957 45 H VAL 6 H VAL 6 1.483 -10.713 0.760 46 HA VAL 6 HA VAL 6 3.471 -12.866 1.094 47 HB VAL 6 HB VAL 6 1.845 -11.749 3.366 48 HG11 VAL 6 1HG1 VAL 6 3.166 -14.038 3.285 49 HG12 VAL 6 2HG1 VAL 6 4.532 -12.985 3.655 50 HG13 VAL 6 3HG1 VAL 6 3.140 -13.037 4.736 51 HG21 VAL 6 3HG2 VAL 6 3.807 -10.416 4.003 52 HG22 VAL 6 1HG2 VAL 6 4.603 -10.884 2.500 53 HG23 VAL 6 2HG2 VAL 6 3.140 -9.900 2.455 54 H TRP 7 H TRP 7 2.686 -14.847 0.857 55 HA TRP 7 HA TRP 7 -0.222 -15.226 0.929 56 HB2 TRP 7 2HB TRP 7 1.992 -16.866 -0.312 57 HB3 TRP 7 3HB TRP 7 0.312 -17.392 -0.248 58 HD1 TRP 7 HD1 TRP 7 -0.085 -13.895 -0.816 59 HE1 TRP 7 HE1 TRP 7 -0.282 -13.317 -3.316 60 HE3 TRP 7 HE3 TRP 7 1.692 -18.259 -2.799 61 HZ2 TRP 7 HZ2 TRP 7 0.246 -14.549 -5.801 62 HZ3 TRP 7 HZ3 TRP 7 1.813 -18.479 -5.247 63 HH2 TRP 7 HH2 TRP 7 1.104 -16.661 -6.715 64 H VAL 8 H VAL 8 -1.176 -16.880 2.123 65 HA VAL 8 HA VAL 8 0.540 -18.048 4.218 66 HB VAL 8 HB VAL 8 -2.397 -17.385 4.453 67 HG11 VAL 8 1HG1 VAL 8 -1.829 -17.698 6.923 68 HG12 VAL 8 2HG1 VAL 8 -1.941 -19.151 5.928 69 HG13 VAL 8 3HG1 VAL 8 -0.361 -18.496 6.360 70 HG21 VAL 8 3HG2 VAL 8 -0.015 -15.926 5.594 71 HG22 VAL 8 1HG2 VAL 8 -1.037 -15.357 4.274 72 HG23 VAL 8 2HG2 VAL 8 -1.710 -15.542 5.894 73 H VAL 9 H VAL 9 0.144 -20.178 4.871 74 HA VAL 9 HA VAL 9 -1.933 -21.774 3.744 75 HB VAL 9 HB VAL 9 -0.323 -21.516 1.805 76 HG11 VAL 9 1HG1 VAL 9 1.408 -23.451 3.314 77 HG12 VAL 9 2HG1 VAL 9 1.766 -22.585 1.819 78 HG13 VAL 9 3HG1 VAL 9 1.698 -21.713 3.351 79 HG21 VAL 9 3HG2 VAL 9 -1.662 -23.825 2.823 80 HG22 VAL 9 1HG2 VAL 9 -1.391 -23.348 1.146 81 HG23 VAL 9 2HG2 VAL 9 -0.193 -24.331 1.989 82 H ASP 10 H ASP 10 -2.194 -23.656 4.855 83 HA ASP 10 HA ASP 10 -0.110 -24.945 6.301 84 HB2 ASP 10 2HB ASP 10 -0.314 -23.136 7.860 85 HB3 ASP 10 3HB ASP 10 -2.072 -23.251 7.852 86 H ASP 11 H ASP 11 -3.306 -24.679 7.673 87 HA ASP 11 HA ASP 11 -4.725 -26.569 6.260 88 HB2 ASP 11 2HB ASP 11 -2.566 -27.788 7.632 89 HB3 ASP 11 3HB ASP 11 -4.040 -28.245 8.481 90 H ASP 12 H ASP 12 -3.902 -25.242 9.383 91 HA ASP 12 HA ASP 12 -6.564 -25.777 10.442 92 HB2 ASP 12 2HB ASP 12 -3.949 -25.071 11.563 93 HB3 ASP 12 3HB ASP 12 -5.290 -24.205 12.308 94 H SER 13 H SER 13 -7.957 -24.116 11.197 95 HA SER 13 HA SER 13 -8.041 -21.842 9.453 96 HB2 SER 13 2HB SER 13 -9.949 -23.290 10.775 97 HB3 SER 13 3HB SER 13 -9.859 -21.837 11.770 98 HG SER 13 HG SER 13 -10.279 -21.918 8.962 99 H SER 14 H SER 14 -7.698 -22.267 12.969 100 HA SER 14 HA SER 14 -7.407 -19.558 13.615 101 HB2 SER 14 2HB SER 14 -6.152 -20.515 15.660 102 HB3 SER 14 3HB SER 14 -7.833 -20.995 15.427 103 HG SER 14 HG SER 14 -6.516 -22.795 15.883 104 H ILE 15 H ILE 15 -5.269 -21.719 12.058 105 HA ILE 15 HA ILE 15 -2.846 -20.322 12.764 106 HB ILE 15 HB ILE 15 -3.340 -22.420 10.648 107 HG12 ILE 15 2HG1 ILE 15 -3.715 -23.179 12.981 108 HG13 ILE 15 3HG1 ILE 15 -2.340 -23.975 12.224 109 HG21 ILE 15 1HG2 ILE 15 -0.756 -21.300 11.723 110 HG22 ILE 15 2HG2 ILE 15 -0.895 -22.674 10.628 111 HG23 ILE 15 3HG2 ILE 15 -1.402 -21.070 10.098 112 HD11 ILE 15 3HD1 ILE 15 -0.936 -23.211 13.763 113 HD12 ILE 15 1HD1 ILE 15 -1.574 -21.571 13.649 114 HD13 ILE 15 2HD1 ILE 15 -2.368 -22.757 14.686 115 H ARG 16 H ARG 16 -4.610 -20.824 9.701 116 HA ARG 16 HA ARG 16 -3.128 -18.862 8.286 117 HB2 ARG 16 2HB ARG 16 -5.868 -19.953 7.625 118 HB3 ARG 16 3HB ARG 16 -4.756 -19.165 6.514 119 HG2 ARG 16 2HG ARG 16 -3.240 -20.992 6.605 120 HG3 ARG 16 3HG ARG 16 -4.123 -21.733 7.942 121 HD2 ARG 16 2HD ARG 16 -5.587 -21.202 5.410 122 HD3 ARG 16 3HD ARG 16 -4.438 -22.539 5.441 123 HE ARG 16 HE ARG 16 -5.950 -22.926 7.666 124 HH11 ARG 16 1HH1 ARG 16 -6.664 -22.493 4.286 125 HH12 ARG 16 2HH1 ARG 16 -8.102 -23.459 4.332 126 HH21 ARG 16 1HH2 ARG 16 -7.841 -24.199 7.739 127 HH22 ARG 16 2HH2 ARG 16 -8.771 -24.428 6.297 128 H TRP 17 H TRP 17 -6.218 -18.821 9.987 129 HA TRP 17 HA TRP 17 -7.249 -16.401 9.185 130 HB2 TRP 17 2HB TRP 17 -8.633 -17.634 10.601 131 HB3 TRP 17 3HB TRP 17 -7.357 -17.886 11.789 132 HD1 TRP 17 HD1 TRP 17 -9.701 -15.080 10.532 133 HE1 TRP 17 HE1 TRP 17 -10.067 -13.420 12.465 134 HE3 TRP 17 HE3 TRP 17 -6.487 -17.100 13.956 135 HZ2 TRP 17 HZ2 TRP 17 -9.119 -13.020 15.093 136 HZ3 TRP 17 HZ3 TRP 17 -6.275 -16.018 16.156 137 HH2 TRP 17 HH2 TRP 17 -7.564 -14.020 16.711 138 H VAL 18 H VAL 18 -5.374 -16.809 12.195 139 HA VAL 18 HA VAL 18 -4.969 -14.166 12.800 140 HB VAL 18 HB VAL 18 -4.273 -15.775 14.390 141 HG11 VAL 18 1HG1 VAL 18 -2.096 -16.760 12.571 142 HG12 VAL 18 2HG1 VAL 18 -2.719 -17.499 14.047 143 HG13 VAL 18 3HG1 VAL 18 -3.703 -17.486 12.583 144 HG21 VAL 18 3HG2 VAL 18 -2.494 -14.641 15.155 145 HG22 VAL 18 1HG2 VAL 18 -1.538 -14.979 13.713 146 HG23 VAL 18 2HG2 VAL 18 -2.699 -13.652 13.710 147 H LEU 19 H LEU 19 -2.891 -16.217 10.766 148 HA LEU 19 HA LEU 19 -0.981 -14.248 10.163 149 HB2 LEU 19 2HB LEU 19 -1.451 -16.935 9.503 150 HB3 LEU 19 3HB LEU 19 -1.350 -16.070 7.971 151 HG LEU 19 HG LEU 19 0.757 -16.266 10.115 152 HD11 LEU 19 1HD1 LEU 19 0.769 -17.078 7.212 153 HD12 LEU 19 2HD1 LEU 19 0.538 -18.175 8.573 154 HD13 LEU 19 3HD1 LEU 19 2.068 -17.319 8.382 155 HD21 LEU 19 3HD2 LEU 19 1.938 -14.971 8.035 156 HD22 LEU 19 1HD2 LEU 19 1.326 -14.188 9.492 157 HD23 LEU 19 2HD2 LEU 19 0.331 -14.242 8.037 158 H GLU 20 H GLU 20 -4.181 -14.757 9.007 159 HA GLU 20 HA GLU 20 -3.832 -13.258 6.565 160 HB2 GLU 20 2HB GLU 20 -5.620 -15.133 7.279 161 HB3 GLU 20 3HB GLU 20 -6.546 -13.694 7.681 162 HG2 GLU 20 2HG GLU 20 -5.232 -13.921 5.012 163 HG3 GLU 20 3HG GLU 20 -6.753 -14.755 5.326 164 H ARG 21 H ARG 21 -5.861 -12.733 9.456 165 HA ARG 21 HA ARG 21 -6.488 -10.070 8.916 166 HB2 ARG 21 2HB ARG 21 -6.967 -9.919 11.380 167 HB3 ARG 21 3HB ARG 21 -7.762 -11.251 10.551 168 HG2 ARG 21 2HG ARG 21 -6.647 -12.814 11.717 169 HG3 ARG 21 3HG ARG 21 -5.145 -11.888 11.726 170 HD2 ARG 21 2HD ARG 21 -7.522 -11.100 13.386 171 HD3 ARG 21 3HD ARG 21 -6.317 -12.249 13.965 172 HE ARG 21 HE ARG 21 -5.011 -9.935 13.061 173 HH11 ARG 21 1HH1 ARG 21 -7.099 -10.999 15.635 174 HH12 ARG 21 2HH1 ARG 21 -6.503 -9.838 16.775 175 HH21 ARG 21 1HH2 ARG 21 -4.217 -8.403 14.552 176 HH22 ARG 21 2HH2 ARG 21 -4.864 -8.361 16.157 177 H ALA 22 H ALA 22 -3.584 -11.479 10.102 178 HA ALA 22 HA ALA 22 -2.455 -9.431 11.589 179 HB1 ALA 22 1HB ALA 22 -0.248 -10.351 10.688 180 HB2 ALA 22 2HB ALA 22 -1.299 -11.465 11.563 181 HB3 ALA 22 3HB ALA 22 -1.238 -11.511 9.801 182 H LEU 23 H LEU 23 -2.033 -10.011 8.092 183 HA LEU 23 HA LEU 23 -0.863 -7.387 7.743 184 HB2 LEU 23 2HB LEU 23 -1.645 -9.312 5.572 185 HB3 LEU 23 3HB LEU 23 -0.442 -8.026 5.505 186 HG LEU 23 HG LEU 23 -0.238 -10.689 6.889 187 HD11 LEU 23 1HD1 LEU 23 1.752 -10.913 5.481 188 HD12 LEU 23 2HD1 LEU 23 1.419 -9.337 4.764 189 HD13 LEU 23 3HD1 LEU 23 0.294 -10.672 4.518 190 HD21 LEU 23 3HD2 LEU 23 2.184 -9.477 7.245 191 HD22 LEU 23 1HD2 LEU 23 0.934 -9.636 8.479 192 HD23 LEU 23 2HD2 LEU 23 1.059 -8.150 7.537 193 H ALA 24 H ALA 24 -3.962 -8.862 7.480 194 HA ALA 24 HA ALA 24 -5.253 -7.337 5.576 195 HB1 ALA 24 1HB ALA 24 -7.308 -7.869 6.694 196 HB2 ALA 24 2HB ALA 24 -6.230 -9.261 6.809 197 HB3 ALA 24 3HB ALA 24 -6.455 -8.202 8.201 198 H GLY 25 H GLY 25 -4.195 -6.428 8.770 199 HA2 GLY 25 2HA GLY 25 -5.752 -3.976 8.781 200 HA3 GLY 25 3HA GLY 25 -4.625 -4.505 10.022 201 H ALA 26 H ALA 26 -2.559 -4.995 7.889 202 HA ALA 26 HA ALA 26 -1.583 -2.243 7.799 203 HB1 ALA 26 1HB ALA 26 0.443 -3.113 8.091 204 HB2 ALA 26 2HB ALA 26 -0.350 -4.668 8.343 205 HB3 ALA 26 3HB ALA 26 0.236 -4.227 6.739 206 H GLY 27 H GLY 27 0.121 -2.276 5.676 207 HA2 GLY 27 2HA GLY 27 -1.770 -2.266 3.432 208 HA3 GLY 27 3HA GLY 27 -0.251 -1.385 3.504 209 H LEU 28 H LEU 28 -1.187 -4.807 3.879 210 HA LEU 28 HA LEU 28 0.585 -5.478 1.646 211 HB2 LEU 28 2HB LEU 28 0.654 -7.235 4.043 212 HB3 LEU 28 3HB LEU 28 1.878 -6.974 2.802 213 HG LEU 28 HG LEU 28 1.208 -4.929 4.909 214 HD11 LEU 28 1HD1 LEU 28 2.174 -7.309 5.595 215 HD12 LEU 28 2HD1 LEU 28 2.710 -5.814 6.360 216 HD13 LEU 28 3HD1 LEU 28 3.681 -6.549 5.085 217 HD21 LEU 28 3HD2 LEU 28 2.520 -3.644 3.658 218 HD22 LEU 28 1HD2 LEU 28 2.898 -4.987 2.579 219 HD23 LEU 28 2HD2 LEU 28 3.856 -4.732 4.038 220 H THR 29 H THR 29 -0.082 -7.187 0.423 221 HA THR 29 HA THR 29 -2.798 -7.997 0.650 222 HB THR 29 HB THR 29 -0.729 -9.330 -1.092 223 HG1 THR 29 HG1 THR 29 -1.986 -6.811 -1.340 224 HG21 THR 29 3HG2 THR 29 -2.747 -10.503 -1.251 225 HG22 THR 29 1HG2 THR 29 -2.801 -9.394 -2.621 226 HG23 THR 29 2HG2 THR 29 -3.717 -9.033 -1.157 227 H CYS 30 H CYS 30 -3.568 -10.208 0.795 228 HA CYS 30 HA CYS 30 -1.792 -12.139 2.052 229 HB2 CYS 30 2HB CYS 30 -3.545 -10.509 3.583 230 HB3 CYS 30 3HB CYS 30 -4.211 -12.137 3.579 231 HG CYS 30 HG CYS 30 -1.212 -12.804 4.162 232 H THR 31 H THR 31 -2.113 -13.993 1.037 233 HA THR 31 HA THR 31 -4.846 -14.676 0.172 234 HB THR 31 HB THR 31 -2.267 -15.116 -1.336 235 HG1 THR 31 HG1 THR 31 -3.115 -13.139 -1.830 236 HG21 THR 31 3HG2 THR 31 -3.670 -16.265 -3.025 237 HG22 THR 31 1HG2 THR 31 -5.022 -16.218 -1.895 238 HG23 THR 31 2HG2 THR 31 -3.575 -17.146 -1.501 239 H THR 32 H THR 32 -5.527 -16.321 1.372 240 HA THR 32 HA THR 32 -3.590 -18.350 2.246 241 HB THR 32 HB THR 32 -5.055 -18.921 4.017 242 HG1 THR 32 HG1 THR 32 -6.980 -17.499 2.507 243 HG21 THR 32 3HG2 THR 32 -4.633 -17.089 5.227 244 HG22 THR 32 1HG2 THR 32 -5.743 -16.112 4.267 245 HG23 THR 32 2HG2 THR 32 -4.078 -16.339 3.732 246 H PHE 33 H PHE 33 -3.636 -20.332 1.409 247 HA PHE 33 HA PHE 33 -5.818 -21.023 -0.412 248 HB2 PHE 33 2HB PHE 33 -3.097 -22.282 -0.006 249 HB3 PHE 33 3HB PHE 33 -4.289 -22.827 -1.182 250 HD1 PHE 33 HD2 PHE 33 -2.031 -20.067 -0.262 251 HD2 PHE 33 HD1 PHE 33 -4.587 -21.704 -3.246 252 HE1 PHE 33 HE2 PHE 33 -1.139 -18.463 -1.901 253 HE2 PHE 33 HE1 PHE 33 -3.698 -20.104 -4.890 254 HZ PHE 33 HZ PHE 33 -1.973 -18.480 -4.218 255 H GLU 34 H GLU 34 -3.819 -23.376 1.239 256 HA GLU 34 HA GLU 34 -5.414 -24.116 3.357 257 HB2 GLU 34 2HB GLU 34 -6.526 -26.179 2.252 258 HB3 GLU 34 3HB GLU 34 -7.292 -24.607 2.077 259 HG2 GLU 34 2HG GLU 34 -7.064 -24.621 -0.134 260 HG3 GLU 34 3HG GLU 34 -5.391 -25.169 -0.046 261 H ASN 35 H ASN 35 -3.592 -25.384 0.608 262 HA ASN 35 HA ASN 35 -1.983 -26.958 2.492 263 HB2 ASN 35 2HB ASN 35 -3.812 -28.155 0.843 264 HB3 ASN 35 3HB ASN 35 -2.351 -28.221 -0.139 265 HD21 ASN 35 1HD2 ASN 35 -3.927 -29.322 2.734 266 HD22 ASN 35 2HD2 ASN 35 -2.779 -30.545 3.147 267 H GLY 36 H GLY 36 0.141 -27.567 1.622 268 HA2 GLY 36 2HA GLY 36 1.441 -25.362 0.429 269 HA3 GLY 36 3HA GLY 36 2.152 -26.945 0.707 270 H ASN 37 H ASN 37 0.397 -28.476 -0.888 271 HA ASN 37 HA ASN 37 1.639 -28.298 -3.381 272 HB2 ASN 37 2HB ASN 37 0.321 -30.256 -2.283 273 HB3 ASN 37 3HB ASN 37 -1.081 -29.531 -3.063 274 HD21 ASN 37 1HD2 ASN 37 2.001 -31.077 -3.569 275 HD22 ASN 37 2HD2 ASN 37 1.739 -31.499 -5.224 276 H GLU 38 H GLU 38 -1.004 -26.541 -2.093 277 HA GLU 38 HA GLU 38 -2.034 -25.764 -4.700 278 HB2 GLU 38 2HB GLU 38 -2.939 -24.407 -2.214 279 HB3 GLU 38 3HB GLU 38 -3.869 -24.931 -3.610 280 HG2 GLU 38 2HG GLU 38 -2.815 -26.659 -1.386 281 HG3 GLU 38 3HG GLU 38 -4.497 -26.237 -1.702 282 H VAL 39 H VAL 39 0.326 -24.734 -2.495 283 HA VAL 39 HA VAL 39 0.227 -21.939 -3.297 284 HB VAL 39 HB VAL 39 2.306 -23.287 -1.575 285 HG11 VAL 39 1HG1 VAL 39 1.464 -20.405 -1.532 286 HG12 VAL 39 2HG1 VAL 39 2.930 -21.138 -0.878 287 HG13 VAL 39 3HG1 VAL 39 2.719 -20.993 -2.623 288 HG21 VAL 39 3HG2 VAL 39 0.747 -23.547 -0.010 289 HG22 VAL 39 1HG2 VAL 39 0.573 -21.792 0.036 290 HG23 VAL 39 2HG2 VAL 39 -0.465 -22.754 -1.016 291 H LEU 40 H LEU 40 2.342 -24.753 -3.678 292 HA LEU 40 HA LEU 40 4.487 -23.615 -4.975 293 HB2 LEU 40 2HB LEU 40 4.795 -25.838 -4.516 294 HB3 LEU 40 3HB LEU 40 3.186 -26.287 -5.077 295 HG LEU 40 HG LEU 40 3.896 -26.177 -7.371 296 HD11 LEU 40 1HD1 LEU 40 6.062 -24.614 -6.252 297 HD12 LEU 40 2HD1 LEU 40 5.467 -24.698 -7.910 298 HD13 LEU 40 3HD1 LEU 40 6.646 -25.877 -7.336 299 HD21 LEU 40 3HD2 LEU 40 6.231 -27.640 -6.531 300 HD22 LEU 40 1HD2 LEU 40 4.727 -28.232 -7.238 301 HD23 LEU 40 2HD2 LEU 40 4.852 -28.007 -5.493 302 H ALA 41 H ALA 41 1.430 -24.726 -6.393 303 HA ALA 41 HA ALA 41 2.158 -23.992 -9.060 304 HB1 ALA 41 1HB ALA 41 0.255 -25.016 -9.677 305 HB2 ALA 41 2HB ALA 41 0.259 -25.619 -8.019 306 HB3 ALA 41 3HB ALA 41 -0.706 -24.204 -8.441 307 H ALA 42 H ALA 42 0.793 -22.339 -6.354 308 HA ALA 42 HA ALA 42 -0.544 -20.261 -7.736 309 HB1 ALA 42 1HB ALA 42 -0.635 -19.125 -5.631 310 HB2 ALA 42 2HB ALA 42 -0.894 -20.846 -5.341 311 HB3 ALA 42 3HB ALA 42 0.672 -20.117 -4.983 312 H LEU 43 H LEU 43 2.766 -20.657 -6.587 313 HA LEU 43 HA LEU 43 3.698 -18.060 -6.922 314 HB2 LEU 43 2HB LEU 43 5.342 -20.479 -7.594 315 HB3 LEU 43 3HB LEU 43 5.873 -18.949 -6.897 316 HG LEU 43 HG LEU 43 4.264 -21.089 -5.504 317 HD11 LEU 43 1HD1 LEU 43 6.535 -21.779 -5.728 318 HD12 LEU 43 2HD1 LEU 43 6.309 -21.212 -4.074 319 HD13 LEU 43 3HD1 LEU 43 7.126 -20.187 -5.253 320 HD21 LEU 43 3HD2 LEU 43 4.262 -19.741 -3.578 321 HD22 LEU 43 1HD2 LEU 43 3.760 -18.674 -4.890 322 HD23 LEU 43 2HD2 LEU 43 5.412 -18.598 -4.274 323 H ALA 44 H ALA 44 3.258 -20.633 -9.282 324 HA ALA 44 HA ALA 44 4.625 -19.464 -11.434 325 HB1 ALA 44 1HB ALA 44 3.682 -21.103 -12.765 326 HB2 ALA 44 2HB ALA 44 3.625 -21.842 -11.165 327 HB3 ALA 44 3HB ALA 44 2.171 -21.120 -11.854 328 H SER 45 H SER 45 1.754 -18.527 -9.890 329 HA SER 45 HA SER 45 0.426 -17.348 -12.128 330 HB2 SER 45 2HB SER 45 -0.765 -18.014 -10.057 331 HB3 SER 45 3HB SER 45 0.091 -16.747 -9.178 332 HG SER 45 HG SER 45 -1.491 -16.220 -11.465 333 H LYS 46 H LYS 46 1.674 -15.663 -9.254 334 HA LYS 46 HA LYS 46 2.808 -13.615 -11.041 335 HB2 LYS 46 2HB LYS 46 2.180 -11.953 -9.221 336 HB3 LYS 46 3HB LYS 46 0.857 -12.593 -10.186 337 HG2 LYS 46 2HG LYS 46 0.403 -14.228 -8.369 338 HG3 LYS 46 3HG LYS 46 1.631 -13.415 -7.396 339 HD2 LYS 46 2HD LYS 46 -0.811 -12.068 -8.547 340 HD3 LYS 46 3HD LYS 46 -0.687 -12.676 -6.894 341 HE2 LYS 46 2HE LYS 46 -0.115 -10.481 -6.573 342 HE3 LYS 46 3HE LYS 46 1.477 -11.186 -6.855 343 HZ1 LYS 46 3HZ LYS 46 0.172 -10.367 -9.273 344 HZ2 LYS 46 1HZ LYS 46 1.729 -10.013 -8.714 345 HZ3 LYS 46 2HZ LYS 46 0.414 -9.081 -8.201 346 H THR 47 H THR 47 3.346 -15.832 -8.608 347 HA THR 47 HA THR 47 5.127 -16.316 -7.276 348 HB THR 47 HB THR 47 6.986 -14.305 -8.279 349 HG1 THR 47 HG1 THR 47 6.972 -15.044 -10.428 350 HG21 THR 47 3HG2 THR 47 7.236 -17.199 -8.892 351 HG22 THR 47 1HG2 THR 47 7.235 -16.727 -7.194 352 HG23 THR 47 2HG2 THR 47 8.443 -16.062 -8.293 353 HA PRO 48 HA PRO 48 4.348 -13.028 -4.290 354 HB2 PRO 48 2HB PRO 48 4.822 -14.589 -2.119 355 HB3 PRO 48 3HB PRO 48 3.289 -14.607 -2.999 356 HG2 PRO 48 2HG PRO 48 5.601 -16.499 -3.184 357 HG3 PRO 48 3HG PRO 48 3.865 -16.855 -3.141 358 HD2 PRO 48 2HD PRO 48 5.294 -16.847 -5.441 359 HD3 PRO 48 3HD PRO 48 3.584 -16.375 -5.378 360 H ASP 49 H ASP 49 5.646 -11.981 -2.657 361 HA ASP 49 HA ASP 49 8.483 -12.134 -3.274 362 HB2 ASP 49 2HB ASP 49 6.778 -10.170 -1.757 363 HB3 ASP 49 3HB ASP 49 8.537 -10.100 -1.695 364 H VAL 50 H VAL 50 6.350 -13.349 -0.953 365 HA VAL 50 HA VAL 50 8.348 -14.712 0.475 366 HB VAL 50 HB VAL 50 8.861 -12.517 1.429 367 HG11 VAL 50 1HG1 VAL 50 6.263 -12.397 2.860 368 HG12 VAL 50 2HG1 VAL 50 7.343 -11.094 2.360 369 HG13 VAL 50 3HG1 VAL 50 6.299 -11.879 1.175 370 HG21 VAL 50 3HG2 VAL 50 7.477 -13.971 3.636 371 HG22 VAL 50 1HG2 VAL 50 8.782 -14.771 2.760 372 HG23 VAL 50 2HG2 VAL 50 9.086 -13.249 3.598 373 H LEU 51 H LEU 51 7.498 -16.228 1.900 374 HA LEU 51 HA LEU 51 4.581 -16.202 2.265 375 HB2 LEU 51 2HB LEU 51 5.916 -17.874 0.512 376 HB3 LEU 51 3HB LEU 51 5.685 -18.872 1.946 377 HG LEU 51 HG LEU 51 3.275 -17.445 1.094 378 HD11 LEU 51 1HD1 LEU 51 2.831 -18.739 -0.861 379 HD12 LEU 51 2HD1 LEU 51 4.336 -19.638 -0.675 380 HD13 LEU 51 3HD1 LEU 51 4.378 -17.925 -1.092 381 HD21 LEU 51 3HD2 LEU 51 2.769 -19.033 2.631 382 HD22 LEU 51 1HD2 LEU 51 4.094 -20.089 2.142 383 HD23 LEU 51 2HD2 LEU 51 2.615 -20.029 1.183 384 H LEU 52 H LEU 52 3.936 -17.990 3.878 385 HA LEU 52 HA LEU 52 5.970 -18.308 5.969 386 HB2 LEU 52 2HB LEU 52 3.171 -17.680 6.766 387 HB3 LEU 52 3HB LEU 52 4.676 -17.419 7.646 388 HG LEU 52 HG LEU 52 4.943 -15.703 5.530 389 HD11 LEU 52 1HD1 LEU 52 2.912 -15.544 4.581 390 HD12 LEU 52 2HD1 LEU 52 2.558 -14.510 5.965 391 HD13 LEU 52 3HD1 LEU 52 2.083 -16.208 5.988 392 HD21 LEU 52 3HD2 LEU 52 4.069 -15.438 8.365 393 HD22 LEU 52 1HD2 LEU 52 4.023 -14.016 7.322 394 HD23 LEU 52 2HD2 LEU 52 5.544 -14.872 7.579 395 H SER 53 H SER 53 5.642 -20.396 4.504 396 HA SER 53 HA SER 53 3.479 -22.084 4.779 397 HB2 SER 53 2HB SER 53 5.567 -22.429 3.364 398 HB3 SER 53 3HB SER 53 6.338 -23.056 4.821 399 HG SER 53 HG SER 53 4.663 -24.629 4.914 400 H ASP 54 H ASP 54 2.677 -23.380 6.330 401 HA ASP 54 HA ASP 54 4.134 -23.485 8.891 402 HB2 ASP 54 2HB ASP 54 1.763 -22.271 8.553 403 HB3 ASP 54 3HB ASP 54 1.195 -23.909 8.861 404 H ILE 55 H ILE 55 4.874 -25.434 9.370 405 HA ILE 55 HA ILE 55 3.815 -27.780 8.033 406 HB ILE 55 HB ILE 55 6.014 -27.710 10.093 407 HG12 ILE 55 2HG1 ILE 55 6.546 -27.701 7.146 408 HG13 ILE 55 3HG1 ILE 55 6.229 -26.177 7.968 409 HG21 ILE 55 1HG2 ILE 55 5.494 -29.928 9.792 410 HG22 ILE 55 2HG2 ILE 55 5.008 -29.697 8.113 411 HG23 ILE 55 3HG2 ILE 55 6.718 -29.699 8.543 412 HD11 ILE 55 3HD1 ILE 55 8.159 -26.310 9.228 413 HD12 ILE 55 1HD1 ILE 55 8.299 -28.055 9.016 414 HD13 ILE 55 2HD1 ILE 55 8.660 -26.971 7.672 415 H ARG 56 H ARG 56 1.865 -28.324 8.893 416 HA ARG 56 HA ARG 56 1.895 -29.258 11.666 417 HB2 ARG 56 2HB ARG 56 -0.131 -27.367 10.476 418 HB3 ARG 56 3HB ARG 56 -0.455 -28.320 11.918 419 HG2 ARG 56 2HG ARG 56 1.234 -27.205 13.145 420 HG3 ARG 56 3HG ARG 56 1.880 -26.443 11.691 421 HD2 ARG 56 2HD ARG 56 0.640 -24.683 12.322 422 HD3 ARG 56 3HD ARG 56 -0.702 -25.598 11.636 423 HE ARG 56 HE ARG 56 -0.154 -25.138 14.443 424 HH11 ARG 56 1HH1 ARG 56 -1.924 -26.968 12.069 425 HH12 ARG 56 2HH1 ARG 56 -3.166 -27.451 13.176 426 HH21 ARG 56 1HH2 ARG 56 -1.783 -25.767 15.911 427 HH22 ARG 56 2HH2 ARG 56 -3.085 -26.767 15.361 428 H MET 57 H MET 57 0.204 -29.165 8.559 429 HA MET 57 HA MET 57 -1.682 -31.132 8.923 430 HB2 MET 57 2HB MET 57 -1.351 -31.614 6.450 431 HB3 MET 57 3HB MET 57 -1.707 -29.946 6.877 432 HG2 MET 57 2HG MET 57 0.686 -29.415 6.718 433 HG3 MET 57 3HG MET 57 1.005 -31.078 6.231 434 HE1 MET 57 3HE MET 57 1.181 -27.987 5.357 435 HE2 MET 57 1HE MET 57 1.626 -28.342 3.688 436 HE3 MET 57 2HE MET 57 0.114 -27.505 4.038 437 HA PRO 58 HA PRO 58 0.544 -34.860 9.665 438 HB2 PRO 58 2HB PRO 58 -1.377 -36.640 8.950 439 HB3 PRO 58 3HB PRO 58 -1.442 -35.707 10.450 440 HG2 PRO 58 2HG PRO 58 -2.835 -35.208 7.848 441 HG3 PRO 58 3HG PRO 58 -3.471 -35.086 9.499 442 HD2 PRO 58 2HD PRO 58 -2.696 -32.919 8.073 443 HD3 PRO 58 3HD PRO 58 -2.539 -33.006 9.840 444 H GLY 59 H GLY 59 -1.362 -34.848 6.642 445 HA2 GLY 59 2HA GLY 59 0.012 -36.825 5.275 446 HA3 GLY 59 3HA GLY 59 -0.798 -35.470 4.505 447 H MET 60 H MET 60 0.393 -33.645 3.904 448 HA MET 60 HA MET 60 2.969 -34.091 2.963 449 HB2 MET 60 2HB MET 60 1.164 -32.192 2.492 450 HB3 MET 60 3HB MET 60 2.169 -31.300 3.626 451 HG2 MET 60 2HG MET 60 3.418 -30.749 1.881 452 HG3 MET 60 3HG MET 60 4.000 -32.412 1.902 453 HE1 MET 60 3HE MET 60 0.920 -30.273 -0.343 454 HE2 MET 60 1HE MET 60 2.394 -29.687 0.428 455 HE3 MET 60 2HE MET 60 2.414 -30.151 -1.273 456 H ASP 61 H ASP 61 5.014 -33.404 3.635 457 HA ASP 61 HA ASP 61 5.386 -33.394 6.490 458 HB2 ASP 61 2HB ASP 61 7.278 -33.321 4.145 459 HB3 ASP 61 3HB ASP 61 7.844 -33.170 5.806 460 H GLY 62 H GLY 62 4.567 -31.027 4.376 461 HA2 GLY 62 2HA GLY 62 4.357 -28.750 4.801 462 HA3 GLY 62 3HA GLY 62 5.371 -28.951 6.223 463 H LEU 63 H LEU 63 7.710 -29.816 5.398 464 HA LEU 63 HA LEU 63 8.749 -27.575 3.904 465 HB2 LEU 63 2HB LEU 63 10.945 -28.910 4.318 466 HB3 LEU 63 3HB LEU 63 10.151 -28.068 5.647 467 HG LEU 63 HG LEU 63 9.261 -30.137 6.495 468 HD11 LEU 63 1HD1 LEU 63 10.170 -32.276 5.308 469 HD12 LEU 63 2HD1 LEU 63 10.248 -31.221 3.898 470 HD13 LEU 63 3HD1 LEU 63 8.709 -31.485 4.718 471 HD21 LEU 63 3HD2 LEU 63 11.505 -31.421 6.736 472 HD22 LEU 63 1HD2 LEU 63 11.354 -29.799 7.414 473 HD23 LEU 63 2HD2 LEU 63 12.184 -30.038 5.876 474 H ALA 64 H ALA 64 7.670 -30.695 3.178 475 HA ALA 64 HA ALA 64 9.311 -31.679 1.229 476 HB1 ALA 64 1HB ALA 64 6.686 -32.144 2.065 477 HB2 ALA 64 2HB ALA 64 6.586 -31.868 0.326 478 HB3 ALA 64 3HB ALA 64 7.648 -33.126 0.959 479 H LEU 65 H LEU 65 6.859 -29.143 0.853 480 HA LEU 65 HA LEU 65 7.533 -28.757 -1.935 481 HB2 LEU 65 2HB LEU 65 5.613 -27.603 -2.090 482 HB3 LEU 65 3HB LEU 65 5.252 -28.398 -0.559 483 HG LEU 65 HG LEU 65 6.396 -25.619 -0.813 484 HD11 LEU 65 1HD1 LEU 65 3.776 -25.637 0.260 485 HD12 LEU 65 2HD1 LEU 65 3.745 -26.535 -1.257 486 HD13 LEU 65 3HD1 LEU 65 4.351 -24.879 -1.226 487 HD21 LEU 65 3HD2 LEU 65 6.510 -27.302 1.322 488 HD22 LEU 65 1HD2 LEU 65 4.996 -26.448 1.624 489 HD23 LEU 65 2HD2 LEU 65 6.496 -25.541 1.426 490 H LEU 66 H LEU 66 8.436 -27.454 1.127 491 HA LEU 66 HA LEU 66 9.360 -24.919 0.241 492 HB2 LEU 66 2HB LEU 66 8.955 -26.049 2.662 493 HB3 LEU 66 3HB LEU 66 10.710 -26.166 2.545 494 HG LEU 66 HG LEU 66 10.427 -24.167 3.656 495 HD11 LEU 66 1HD1 LEU 66 11.790 -23.896 1.603 496 HD12 LEU 66 2HD1 LEU 66 11.027 -22.402 2.146 497 HD13 LEU 66 3HD1 LEU 66 10.356 -23.286 0.776 498 HD21 LEU 66 3HD2 LEU 66 8.062 -23.967 3.634 499 HD22 LEU 66 1HD2 LEU 66 8.034 -23.706 1.890 500 HD23 LEU 66 2HD2 LEU 66 8.706 -22.471 2.955 501 H LYS 67 H LYS 67 10.721 -28.117 0.260 502 HA LYS 67 HA LYS 67 13.445 -27.425 -0.005 503 HB2 LYS 67 2HB LYS 67 11.932 -29.881 -0.905 504 HB3 LYS 67 3HB LYS 67 13.684 -29.734 -0.948 505 HG2 LYS 67 2HG LYS 67 12.011 -29.515 1.545 506 HG3 LYS 67 3HG LYS 67 12.846 -30.976 1.013 507 HD2 LYS 67 2HD LYS 67 14.178 -28.337 1.625 508 HD3 LYS 67 3HD LYS 67 14.113 -29.720 2.720 509 HE2 LYS 67 2HE LYS 67 15.068 -30.720 0.285 510 HE3 LYS 67 3HE LYS 67 15.913 -29.194 0.536 511 HZ1 LYS 67 3HZ LYS 67 16.632 -29.953 2.689 512 HZ2 LYS 67 1HZ LYS 67 17.079 -31.092 1.521 513 HZ3 LYS 67 2HZ LYS 67 15.754 -31.390 2.528 514 H GLN 68 H GLN 68 10.807 -27.576 -2.273 515 HA GLN 68 HA GLN 68 12.550 -27.396 -4.582 516 HB2 GLN 68 2HB GLN 68 10.691 -27.798 -5.871 517 HB3 GLN 68 3HB GLN 68 10.193 -28.557 -4.365 518 HG2 GLN 68 2HG GLN 68 9.268 -26.081 -3.938 519 HG3 GLN 68 3HG GLN 68 9.175 -26.134 -5.698 520 HE21 GLN 68 1HE2 GLN 68 7.055 -26.061 -3.673 521 HE22 GLN 68 2HE2 GLN 68 6.067 -27.445 -3.977 522 H ILE 69 H ILE 69 10.870 -25.283 -2.448 523 HA ILE 69 HA ILE 69 10.568 -23.049 -4.154 524 HB ILE 69 HB ILE 69 10.794 -23.239 -1.153 525 HG12 ILE 69 2HG1 ILE 69 8.404 -22.607 -2.892 526 HG13 ILE 69 3HG1 ILE 69 8.792 -24.229 -2.329 527 HG21 ILE 69 1HG2 ILE 69 11.409 -21.058 -1.372 528 HG22 ILE 69 2HG2 ILE 69 10.621 -20.877 -2.938 529 HG23 ILE 69 3HG2 ILE 69 9.659 -20.861 -1.460 530 HD11 ILE 69 3HD1 ILE 69 7.264 -22.289 -1.031 531 HD12 ILE 69 1HD1 ILE 69 7.798 -23.843 -0.394 532 HD13 ILE 69 2HD1 ILE 69 8.773 -22.398 -0.124 533 H LYS 70 H LYS 70 13.269 -24.342 -2.403 534 HA LYS 70 HA LYS 70 14.857 -21.957 -2.478 535 HB2 LYS 70 2HB LYS 70 15.115 -24.668 -1.458 536 HB3 LYS 70 3HB LYS 70 16.602 -24.112 -2.216 537 HG2 LYS 70 2HG LYS 70 17.034 -23.251 -0.198 538 HG3 LYS 70 3HG LYS 70 15.956 -21.953 -0.716 539 HD2 LYS 70 2HD LYS 70 14.621 -24.298 0.456 540 HD3 LYS 70 3HD LYS 70 15.645 -23.385 1.567 541 HE2 LYS 70 2HE LYS 70 13.438 -22.235 -0.140 542 HE3 LYS 70 3HE LYS 70 13.321 -22.589 1.583 543 HZ1 LYS 70 3HZ LYS 70 14.054 -20.537 1.920 544 HZ2 LYS 70 1HZ LYS 70 14.428 -20.311 0.286 545 HZ3 LYS 70 2HZ LYS 70 15.560 -21.023 1.322 546 H GLN 71 H GLN 71 14.319 -24.672 -4.590 547 HA GLN 71 HA GLN 71 16.579 -23.979 -6.287 548 HB2 GLN 71 2HB GLN 71 15.765 -26.370 -5.750 549 HB3 GLN 71 3HB GLN 71 14.493 -26.049 -6.921 550 HG2 GLN 71 2HG GLN 71 15.852 -26.487 -8.608 551 HG3 GLN 71 3HG GLN 71 17.041 -25.327 -8.017 552 HE21 GLN 71 1HE2 GLN 71 18.921 -26.350 -8.135 553 HE22 GLN 71 2HE2 GLN 71 19.266 -27.900 -7.454 554 H ARG 72 H ARG 72 13.051 -23.902 -6.346 555 HA ARG 72 HA ARG 72 12.941 -22.869 -9.032 556 HB2 ARG 72 2HB ARG 72 11.026 -23.736 -6.983 557 HB3 ARG 72 3HB ARG 72 10.472 -22.370 -7.943 558 HG2 ARG 72 2HG ARG 72 11.179 -23.807 -9.970 559 HG3 ARG 72 3HG ARG 72 11.136 -25.147 -8.822 560 HD2 ARG 72 2HD ARG 72 8.779 -23.950 -8.270 561 HD3 ARG 72 3HD ARG 72 8.936 -23.568 -9.984 562 HE ARG 72 HE ARG 72 8.418 -26.143 -8.823 563 HH11 ARG 72 1HH1 ARG 72 9.720 -24.463 -11.581 564 HH12 ARG 72 2HH1 ARG 72 9.465 -25.786 -12.671 565 HH21 ARG 72 1HH2 ARG 72 8.078 -27.891 -10.248 566 HH22 ARG 72 2HH2 ARG 72 8.531 -27.735 -11.912 567 H HIS 73 H HIS 73 12.800 -21.574 -5.771 568 HA HIS 73 HA HIS 73 13.093 -18.881 -6.884 569 HB2 HIS 73 2HB HIS 73 11.280 -19.312 -4.529 570 HB3 HIS 73 3HB HIS 73 11.370 -17.930 -5.618 571 HD1 HIS 73 HD1 HIS 73 10.203 -18.188 -7.947 572 HD2 HIS 73 HD2 HIS 73 9.585 -21.352 -5.328 573 HE1 HIS 73 HE1 HIS 73 8.291 -19.501 -8.919 574 HA PRO 74 HA PRO 74 16.135 -19.829 -3.509 575 HB2 PRO 74 2HB PRO 74 18.283 -18.861 -4.858 576 HB3 PRO 74 3HB PRO 74 17.710 -20.524 -5.031 577 HG2 PRO 74 2HG PRO 74 17.230 -18.161 -6.805 578 HG3 PRO 74 3HG PRO 74 17.622 -19.832 -7.249 579 HD2 PRO 74 2HD PRO 74 15.101 -18.851 -7.353 580 HD3 PRO 74 3HD PRO 74 15.449 -20.549 -6.971 581 H MET 75 H MET 75 15.847 -16.981 -5.610 582 HA MET 75 HA MET 75 16.957 -15.211 -3.632 583 HB2 MET 75 2HB MET 75 16.280 -13.424 -5.238 584 HB3 MET 75 3HB MET 75 17.310 -14.663 -5.945 585 HG2 MET 75 2HG MET 75 15.805 -15.077 -7.505 586 HG3 MET 75 3HG MET 75 14.585 -15.422 -6.282 587 HE1 MET 75 3HE MET 75 13.606 -12.643 -4.917 588 HE2 MET 75 1HE MET 75 12.336 -12.540 -6.136 589 HE3 MET 75 2HE MET 75 12.863 -14.116 -5.544 590 H LEU 76 H LEU 76 14.080 -16.758 -3.804 591 HA LEU 76 HA LEU 76 12.460 -14.531 -2.830 592 HB2 LEU 76 2HB LEU 76 11.315 -15.840 -4.411 593 HB3 LEU 76 3HB LEU 76 11.841 -17.347 -3.663 594 HG LEU 76 HG LEU 76 10.375 -16.804 -1.715 595 HD11 LEU 76 1HD1 LEU 76 9.965 -14.556 -1.673 596 HD12 LEU 76 2HD1 LEU 76 8.499 -15.122 -2.471 597 HD13 LEU 76 3HD1 LEU 76 9.813 -14.436 -3.426 598 HD21 LEU 76 3HD2 LEU 76 9.120 -17.069 -4.442 599 HD22 LEU 76 1HD2 LEU 76 8.253 -17.307 -2.924 600 HD23 LEU 76 2HD2 LEU 76 9.596 -18.369 -3.348 601 HA PRO 77 HA PRO 77 13.517 -15.795 1.328 602 HB2 PRO 77 2HB PRO 77 12.144 -13.798 2.552 603 HB3 PRO 77 3HB PRO 77 13.726 -13.556 1.801 604 HG2 PRO 77 2HG PRO 77 11.002 -12.940 0.722 605 HG3 PRO 77 3HG PRO 77 12.482 -11.966 0.648 606 HD2 PRO 77 2HD PRO 77 11.610 -13.451 -1.441 607 HD3 PRO 77 3HD PRO 77 13.334 -13.166 -1.126 608 H VAL 78 H VAL 78 12.519 -17.148 2.706 609 HA VAL 78 HA VAL 78 9.587 -17.169 2.817 610 HB VAL 78 HB VAL 78 11.154 -19.735 2.664 611 HG11 VAL 78 1HG1 VAL 78 9.154 -20.406 3.464 612 HG12 VAL 78 2HG1 VAL 78 8.318 -18.964 2.885 613 HG13 VAL 78 3HG1 VAL 78 8.674 -20.285 1.772 614 HG21 VAL 78 3HG2 VAL 78 9.794 -18.269 0.404 615 HG22 VAL 78 1HG2 VAL 78 11.525 -18.561 0.574 616 HG23 VAL 78 2HG2 VAL 78 10.424 -19.914 0.319 617 H ILE 79 H ILE 79 8.733 -18.316 4.696 618 HA ILE 79 HA ILE 79 10.666 -18.548 6.903 619 HB ILE 79 HB ILE 79 7.916 -17.377 7.274 620 HG12 ILE 79 2HG1 ILE 79 10.526 -15.878 6.957 621 HG13 ILE 79 3HG1 ILE 79 9.238 -15.933 5.758 622 HG21 ILE 79 1HG2 ILE 79 10.363 -17.167 9.015 623 HG22 ILE 79 2HG2 ILE 79 8.707 -16.715 9.418 624 HG23 ILE 79 3HG2 ILE 79 9.130 -18.413 9.207 625 HD11 ILE 79 3HD1 ILE 79 8.165 -14.275 6.750 626 HD12 ILE 79 1HD1 ILE 79 8.214 -15.096 8.310 627 HD13 ILE 79 2HD1 ILE 79 9.565 -14.081 7.804 628 H ILE 80 H ILE 80 10.483 -20.356 8.068 629 HA ILE 80 HA ILE 80 8.263 -22.160 7.471 630 HB ILE 80 HB ILE 80 10.964 -22.570 8.722 631 HG12 ILE 80 2HG1 ILE 80 10.495 -22.600 6.189 632 HG13 ILE 80 3HG1 ILE 80 11.392 -23.953 6.871 633 HG21 ILE 80 1HG2 ILE 80 9.731 -23.908 10.150 634 HG22 ILE 80 2HG2 ILE 80 8.542 -24.311 8.913 635 HG23 ILE 80 3HG2 ILE 80 10.151 -25.030 8.857 636 HD11 ILE 80 3HD1 ILE 80 9.800 -25.426 6.341 637 HD12 ILE 80 1HD1 ILE 80 8.493 -24.336 6.804 638 HD13 ILE 80 2HD1 ILE 80 9.256 -24.177 5.221 639 H MET 81 H MET 81 6.842 -22.918 8.979 640 HA MET 81 HA MET 81 7.103 -21.871 11.718 641 HB2 MET 81 2HB MET 81 4.817 -21.680 9.820 642 HB3 MET 81 3HB MET 81 4.447 -21.939 11.519 643 HG2 MET 81 2HG MET 81 4.987 -19.847 12.084 644 HG3 MET 81 3HG MET 81 6.405 -19.826 11.039 645 HE1 MET 81 3HE MET 81 3.074 -20.880 9.304 646 HE2 MET 81 1HE MET 81 2.519 -20.099 10.785 647 HE3 MET 81 2HE MET 81 2.204 -19.347 9.221 648 H THR 82 H THR 82 7.169 -23.446 13.166 649 HA THR 82 HA THR 82 5.347 -25.620 13.201 650 HB THR 82 HB THR 82 6.827 -26.464 11.416 651 HG1 THR 82 HG1 THR 82 5.876 -27.817 13.228 652 HG21 THR 82 3HG2 THR 82 8.892 -25.324 12.174 653 HG22 THR 82 1HG2 THR 82 9.133 -27.045 11.877 654 HG23 THR 82 2HG2 THR 82 8.984 -26.447 13.530 655 H ALA 83 H ALA 83 8.427 -24.296 14.281 656 HA ALA 83 HA ALA 83 9.421 -24.183 16.326 657 HB1 ALA 83 1HB ALA 83 7.643 -22.983 17.181 658 HB2 ALA 83 2HB ALA 83 6.520 -24.335 17.028 659 HB3 ALA 83 3HB ALA 83 7.741 -24.343 18.301 660 H HIS 84 H HIS 84 9.100 -25.464 18.703 661 HA HIS 84 HA HIS 84 9.659 -27.385 19.787 662 HB2 HIS 84 2HB HIS 84 8.323 -29.188 17.881 663 HB3 HIS 84 3HB HIS 84 8.103 -29.021 19.620 664 HD1 HIS 84 HD1 HIS 84 5.856 -29.168 17.286 665 HD2 HIS 84 HD2 HIS 84 7.044 -25.835 19.463 666 HE1 HIS 84 HE1 HIS 84 3.916 -27.571 17.183 667 H SER 85 H SER 85 10.127 -29.985 18.863 668 HA SER 85 HA SER 85 12.785 -29.830 18.036 669 HB2 SER 85 2HB SER 85 11.173 -31.826 18.973 670 HB3 SER 85 3HB SER 85 11.384 -32.315 17.292 671 HG SER 85 HG SER 85 13.306 -32.949 17.813 672 H ASP 86 H ASP 86 9.855 -29.806 16.204 673 HA ASP 86 HA ASP 86 10.646 -30.746 13.733 674 HB2 ASP 86 2HB ASP 86 8.893 -28.320 14.152 675 HB3 ASP 86 3HB ASP 86 8.873 -29.427 12.783 676 H LEU 87 H LEU 87 11.354 -27.670 15.258 677 HA LEU 87 HA LEU 87 12.417 -26.410 12.936 678 HB2 LEU 87 2HB LEU 87 11.891 -25.713 15.626 679 HB3 LEU 87 3HB LEU 87 13.593 -25.372 15.321 680 HG LEU 87 HG LEU 87 12.946 -23.950 13.418 681 HD11 LEU 87 1HD1 LEU 87 10.952 -24.507 12.528 682 HD12 LEU 87 2HD1 LEU 87 10.343 -23.326 13.687 683 HD13 LEU 87 3HD1 LEU 87 10.290 -25.046 14.071 684 HD21 LEU 87 3HD2 LEU 87 11.677 -22.219 14.872 685 HD22 LEU 87 1HD2 LEU 87 13.306 -22.707 15.337 686 HD23 LEU 87 2HD2 LEU 87 11.910 -23.392 16.169 687 H ASP 88 H ASP 88 13.752 -28.424 15.474 688 HA ASP 88 HA ASP 88 16.462 -27.968 15.161 689 HB2 ASP 88 2HB ASP 88 15.080 -29.590 16.747 690 HB3 ASP 88 3HB ASP 88 15.544 -30.781 15.536 691 H ALA 89 H ALA 89 14.252 -29.631 13.069 692 HA ALA 89 HA ALA 89 16.352 -30.877 11.507 693 HB1 ALA 89 1HB ALA 89 14.689 -32.007 10.371 694 HB2 ALA 89 2HB ALA 89 13.961 -31.785 11.962 695 HB3 ALA 89 3HB ALA 89 13.500 -30.729 10.627 696 H ALA 90 H ALA 90 14.378 -28.012 11.425 697 HA ALA 90 HA ALA 90 15.048 -27.393 8.675 698 HB1 ALA 90 1HB ALA 90 13.241 -26.298 10.723 699 HB2 ALA 90 2HB ALA 90 13.931 -25.119 9.607 700 HB3 ALA 90 3HB ALA 90 13.010 -26.488 8.985 701 H VAL 91 H VAL 91 16.345 -26.831 11.796 702 HA VAL 91 HA VAL 91 17.596 -24.391 11.616 703 HB VAL 91 HB VAL 91 18.575 -26.952 12.868 704 HG11 VAL 91 1HG1 VAL 91 20.602 -25.965 12.826 705 HG12 VAL 91 2HG1 VAL 91 19.932 -24.355 12.555 706 HG13 VAL 91 3HG1 VAL 91 19.951 -25.042 14.180 707 HG21 VAL 91 3HG2 VAL 91 17.848 -24.616 14.501 708 HG22 VAL 91 1HG2 VAL 91 16.520 -25.350 13.600 709 HG23 VAL 91 2HG2 VAL 91 17.467 -26.324 14.726 710 H SER 92 H SER 92 19.032 -27.515 10.657 711 HA SER 92 HA SER 92 21.149 -26.137 9.228 712 HB2 SER 92 2HB SER 92 21.801 -28.094 10.476 713 HB3 SER 92 3HB SER 92 20.575 -29.074 9.673 714 HG SER 92 HG SER 92 22.779 -27.829 8.387 715 H ALA 93 H ALA 93 18.385 -28.223 8.503 716 HA ALA 93 HA ALA 93 18.805 -28.491 5.746 717 HB1 ALA 93 1HB ALA 93 16.407 -29.043 5.626 718 HB2 ALA 93 2HB ALA 93 17.231 -29.895 6.933 719 HB3 ALA 93 3HB ALA 93 16.216 -28.498 7.293 720 H TYR 94 H TYR 94 16.447 -26.341 7.351 721 HA TYR 94 HA TYR 94 15.773 -24.854 5.102 722 HB2 TYR 94 2HB TYR 94 14.750 -24.892 7.507 723 HB3 TYR 94 3HB TYR 94 15.873 -23.572 7.813 724 HD1 TYR 94 HD1 TYR 94 13.911 -24.335 4.739 725 HD2 TYR 94 HD2 TYR 94 14.528 -21.679 8.005 726 HE1 TYR 94 HE1 TYR 94 12.312 -22.752 3.746 727 HE2 TYR 94 HE2 TYR 94 12.930 -20.089 7.021 728 HH TYR 94 HH TYR 94 10.746 -20.634 5.089 729 H GLN 95 H GLN 95 18.634 -24.794 6.992 730 HA GLN 95 HA GLN 95 19.455 -22.131 6.414 731 HB2 GLN 95 2HB GLN 95 20.584 -24.491 7.726 732 HB3 GLN 95 3HB GLN 95 21.782 -23.532 6.868 733 HG2 GLN 95 2HG GLN 95 19.846 -22.234 8.739 734 HG3 GLN 95 3HG GLN 95 21.303 -23.022 9.345 735 HE21 GLN 95 1HE2 GLN 95 23.357 -22.303 8.364 736 HE22 GLN 95 2HE2 GLN 95 23.524 -20.632 7.962 737 H GLN 96 H GLN 96 18.913 -24.561 4.345 738 HA GLN 96 HA GLN 96 21.267 -24.477 2.723 739 HB2 GLN 96 2HB GLN 96 18.512 -25.610 2.396 740 HB3 GLN 96 3HB GLN 96 19.593 -25.519 1.012 741 HG2 GLN 96 2HG GLN 96 21.099 -27.027 1.926 742 HG3 GLN 96 3HG GLN 96 20.489 -26.792 3.563 743 HE21 GLN 96 1HE2 GLN 96 19.272 -27.812 0.386 744 HE22 GLN 96 2HE2 GLN 96 18.356 -29.152 0.979 745 H GLY 97 H GLY 97 20.002 -21.897 3.379 746 HA2 GLY 97 2HA GLY 97 20.319 -19.984 1.927 747 HA3 GLY 97 3HA GLY 97 19.659 -20.943 0.609 748 H ALA 98 H ALA 98 18.291 -20.813 3.840 749 HA ALA 98 HA ALA 98 15.958 -19.404 2.714 750 HB1 ALA 98 1HB ALA 98 15.656 -21.145 5.105 751 HB2 ALA 98 2HB ALA 98 14.512 -20.791 3.810 752 HB3 ALA 98 3HB ALA 98 15.843 -21.913 3.528 753 H PHE 99 H PHE 99 14.797 -17.991 4.129 754 HA PHE 99 HA PHE 99 16.530 -16.464 5.828 755 HB2 PHE 99 2HB PHE 99 14.985 -15.199 4.553 756 HB3 PHE 99 3HB PHE 99 13.631 -16.210 5.046 757 HD1 PHE 99 HD2 PHE 99 15.931 -13.548 6.088 758 HD2 PHE 99 HD1 PHE 99 12.504 -15.850 7.122 759 HE1 PHE 99 HE2 PHE 99 15.430 -11.975 7.913 760 HE2 PHE 99 HE1 PHE 99 11.996 -14.281 8.948 761 HZ PHE 99 HZ PHE 99 13.461 -12.341 9.346 762 H ASP 100 H ASP 100 16.232 -16.019 8.048 763 HA ASP 100 HA ASP 100 15.919 -18.137 9.738 764 HB2 ASP 100 2HB ASP 100 16.834 -15.885 10.343 765 HB3 ASP 100 3HB ASP 100 15.178 -15.293 10.450 766 H TYR 101 H TYR 101 14.235 -19.483 9.793 767 HA TYR 101 HA TYR 101 11.590 -18.849 9.145 768 HB2 TYR 101 2HB TYR 101 11.078 -21.009 10.441 769 HB3 TYR 101 3HB TYR 101 12.153 -21.128 9.052 770 HD1 TYR 101 HD1 TYR 101 12.735 -20.113 12.603 771 HD2 TYR 101 HD2 TYR 101 13.706 -22.791 9.443 772 HE1 TYR 101 HE1 TYR 101 14.446 -21.161 14.025 773 HE2 TYR 101 HE2 TYR 101 15.420 -23.847 10.857 774 HH TYR 101 HH TYR 101 16.862 -23.017 12.930 775 H LEU 102 H LEU 102 9.854 -19.624 10.987 776 HA LEU 102 HA LEU 102 10.378 -18.140 13.452 777 HB2 LEU 102 2HB LEU 102 9.315 -16.413 12.401 778 HB3 LEU 102 3HB LEU 102 8.356 -17.482 11.379 779 HG LEU 102 HG LEU 102 7.055 -18.044 13.518 780 HD11 LEU 102 1HD1 LEU 102 8.998 -16.273 14.587 781 HD12 LEU 102 2HD1 LEU 102 7.683 -17.102 15.420 782 HD13 LEU 102 3HD1 LEU 102 7.416 -15.504 14.723 783 HD21 LEU 102 3HD2 LEU 102 6.096 -15.481 13.268 784 HD22 LEU 102 1HD2 LEU 102 5.648 -16.854 12.257 785 HD23 LEU 102 2HD2 LEU 102 6.916 -15.748 11.729 786 HA PRO 103 HA PRO 103 8.429 -21.934 14.824 787 HB2 PRO 103 2HB PRO 103 8.907 -21.510 17.462 788 HB3 PRO 103 3HB PRO 103 10.143 -22.101 16.345 789 HG2 PRO 103 2HG PRO 103 9.684 -19.324 17.364 790 HG3 PRO 103 3HG PRO 103 11.210 -20.204 17.163 791 HD2 PRO 103 2HD PRO 103 10.348 -18.356 15.381 792 HD3 PRO 103 3HD PRO 103 11.307 -19.771 14.901 793 H LYS 104 H LYS 104 6.452 -22.433 15.693 794 HA LYS 104 HA LYS 104 4.732 -20.153 16.353 795 HB2 LYS 104 2HB LYS 104 2.887 -21.887 16.039 796 HB3 LYS 104 3HB LYS 104 3.786 -21.419 14.602 797 HG2 LYS 104 2HG LYS 104 4.482 -23.498 14.252 798 HG3 LYS 104 3HG LYS 104 4.994 -23.689 15.931 799 HD2 LYS 104 2HD LYS 104 3.133 -24.809 16.480 800 HD3 LYS 104 3HD LYS 104 2.094 -23.682 15.604 801 HE2 LYS 104 2HE LYS 104 1.764 -25.570 14.359 802 HE3 LYS 104 3HE LYS 104 3.145 -24.884 13.505 803 HZ1 LYS 104 3HZ LYS 104 4.461 -26.329 15.221 804 HZ2 LYS 104 1HZ LYS 104 3.845 -27.017 13.804 805 HZ3 LYS 104 2HZ LYS 104 3.024 -27.221 15.268 806 HA PRO 105 HA PRO 105 2.641 -19.934 17.196 807 HB2 PRO 105 2HB PRO 105 2.145 -18.223 19.245 808 HB3 PRO 105 3HB PRO 105 1.273 -19.745 19.033 809 HG2 PRO 105 2HG PRO 105 3.571 -19.117 20.844 810 HG3 PRO 105 3HG PRO 105 2.102 -20.051 21.183 811 HD2 PRO 105 2HD PRO 105 4.478 -21.224 20.625 812 HD3 PRO 105 3HD PRO 105 2.924 -21.950 20.168 813 H PHE 106 H PHE 106 2.685 -17.477 16.975 814 HA PHE 106 HA PHE 106 5.354 -16.362 17.443 815 HB2 PHE 106 2HB PHE 106 5.418 -15.482 15.128 816 HB3 PHE 106 3HB PHE 106 5.434 -17.242 15.178 817 HD1 PHE 106 HD2 PHE 106 3.214 -14.320 14.655 818 HD2 PHE 106 HD1 PHE 106 3.834 -18.483 14.024 819 HE1 PHE 106 HE2 PHE 106 1.275 -14.375 13.143 820 HE2 PHE 106 HE1 PHE 106 1.896 -18.545 12.509 821 HZ PHE 106 HZ PHE 106 0.613 -16.490 12.068 822 H ASP 107 H ASP 107 5.427 -14.137 17.676 823 HA ASP 107 HA ASP 107 2.922 -12.899 18.393 824 HB2 ASP 107 2HB ASP 107 5.774 -11.898 18.466 825 HB3 ASP 107 3HB ASP 107 4.390 -10.961 19.023 826 H ILE 108 H ILE 108 1.664 -12.109 16.838 827 HA ILE 108 HA ILE 108 2.261 -11.531 14.242 828 HB ILE 108 HB ILE 108 0.232 -10.227 16.047 829 HG12 ILE 108 2HG1 ILE 108 -0.384 -12.014 13.730 830 HG13 ILE 108 3HG1 ILE 108 0.227 -12.735 15.215 831 HG21 ILE 108 1HG2 ILE 108 0.641 -8.608 14.357 832 HG22 ILE 108 2HG2 ILE 108 0.666 -9.838 13.095 833 HG23 ILE 108 3HG2 ILE 108 -0.846 -9.448 13.915 834 HD11 ILE 108 3HD1 ILE 108 -2.414 -11.873 14.582 835 HD12 ILE 108 1HD1 ILE 108 -1.831 -12.722 16.013 836 HD13 ILE 108 2HD1 ILE 108 -1.815 -10.959 15.966 837 H ASP 109 H ASP 109 2.772 -9.485 17.046 838 HA ASP 109 HA ASP 109 3.286 -7.060 15.745 839 HB2 ASP 109 2HB ASP 109 4.098 -8.224 18.385 840 HB3 ASP 109 3HB ASP 109 4.804 -6.701 17.852 841 H GLU 110 H GLU 110 5.468 -9.715 16.623 842 HA GLU 110 HA GLU 110 7.740 -8.393 15.418 843 HB2 GLU 110 2HB GLU 110 8.057 -9.766 17.416 844 HB3 GLU 110 3HB GLU 110 7.444 -11.175 16.562 845 HG2 GLU 110 2HG GLU 110 9.332 -11.193 15.098 846 HG3 GLU 110 3HG GLU 110 9.905 -9.655 15.740 847 H ALA 111 H ALA 111 5.371 -10.780 14.545 848 HA ALA 111 HA ALA 111 6.765 -11.916 12.347 849 HB1 ALA 111 1HB ALA 111 5.055 -13.325 12.402 850 HB2 ALA 111 2HB ALA 111 4.302 -12.331 13.650 851 HB3 ALA 111 3HB ALA 111 3.939 -12.036 11.950 852 H VAL 112 H VAL 112 4.213 -9.438 12.542 853 HA VAL 112 HA VAL 112 3.897 -8.872 9.867 854 HB VAL 112 HB VAL 112 3.748 -7.072 12.274 855 HG11 VAL 112 1HG1 VAL 112 4.314 -5.567 10.536 856 HG12 VAL 112 2HG1 VAL 112 3.250 -6.380 9.388 857 HG13 VAL 112 3HG1 VAL 112 2.565 -5.462 10.730 858 HG21 VAL 112 3HG2 VAL 112 2.060 -8.875 11.956 859 HG22 VAL 112 1HG2 VAL 112 1.375 -7.250 11.962 860 HG23 VAL 112 2HG2 VAL 112 1.592 -8.110 10.438 861 H ALA 113 H ALA 113 6.430 -7.778 12.056 862 HA ALA 113 HA ALA 113 7.620 -6.056 10.055 863 HB1 ALA 113 1HB ALA 113 9.260 -6.663 12.386 864 HB2 ALA 113 2HB ALA 113 8.703 -5.109 11.763 865 HB3 ALA 113 3HB ALA 113 7.651 -6.071 12.801 866 H LEU 114 H LEU 114 7.938 -9.313 11.170 867 HA LEU 114 HA LEU 114 10.592 -9.807 10.328 868 HB2 LEU 114 2HB LEU 114 9.442 -11.273 11.880 869 HB3 LEU 114 3HB LEU 114 8.254 -11.684 10.645 870 HG LEU 114 HG LEU 114 10.242 -12.632 9.326 871 HD11 LEU 114 1HD1 LEU 114 12.044 -11.668 10.589 872 HD12 LEU 114 2HD1 LEU 114 12.096 -13.421 10.767 873 HD13 LEU 114 3HD1 LEU 114 11.462 -12.421 12.074 874 HD21 LEU 114 3HD2 LEU 114 10.228 -14.698 10.943 875 HD22 LEU 114 1HD2 LEU 114 8.775 -14.236 10.056 876 HD23 LEU 114 2HD2 LEU 114 8.953 -13.786 11.752 877 H VAL 115 H VAL 115 7.460 -10.121 8.720 878 HA VAL 115 HA VAL 115 8.481 -11.304 6.343 879 HB VAL 115 HB VAL 115 6.135 -11.547 6.917 880 HG11 VAL 115 1HG1 VAL 115 5.895 -8.577 6.445 881 HG12 VAL 115 2HG1 VAL 115 4.579 -9.687 6.833 882 HG13 VAL 115 3HG1 VAL 115 5.844 -9.368 8.020 883 HG21 VAL 115 3HG2 VAL 115 5.586 -11.695 4.760 884 HG22 VAL 115 1HG2 VAL 115 5.680 -9.947 4.541 885 HG23 VAL 115 2HG2 VAL 115 7.137 -10.932 4.408 886 H GLU 116 H GLU 116 7.850 -7.991 7.363 887 HA GLU 116 HA GLU 116 8.227 -6.771 4.843 888 HB2 GLU 116 2HB GLU 116 8.309 -5.799 7.678 889 HB3 GLU 116 3HB GLU 116 8.816 -4.736 6.373 890 HG2 GLU 116 2HG GLU 116 6.687 -4.711 5.408 891 HG3 GLU 116 3HG GLU 116 6.161 -6.121 6.324 892 H ARG 117 H ARG 117 10.417 -8.104 7.121 893 HA ARG 117 HA ARG 117 12.714 -6.570 6.408 894 HB2 ARG 117 2HB ARG 117 12.848 -7.601 8.510 895 HB3 ARG 117 3HB ARG 117 12.285 -9.147 7.889 896 HG2 ARG 117 2HG ARG 117 14.346 -9.809 7.317 897 HG3 ARG 117 3HG ARG 117 14.798 -8.214 6.710 898 HD2 ARG 117 2HD ARG 117 14.760 -7.604 9.272 899 HD3 ARG 117 3HD ARG 117 15.011 -9.339 9.460 900 HE ARG 117 HE ARG 117 16.900 -8.641 7.659 901 HH11 ARG 117 1HH1 ARG 117 16.016 -7.398 10.788 902 HH12 ARG 117 2HH1 ARG 117 17.621 -6.876 11.179 903 HH21 ARG 117 1HH2 ARG 117 19.018 -7.959 8.162 904 HH22 ARG 117 2HH2 ARG 117 19.328 -7.195 9.685 905 H ALA 118 H ALA 118 11.320 -9.611 5.309 906 HA ALA 118 HA ALA 118 13.520 -10.340 3.645 907 HB1 ALA 118 1HB ALA 118 11.247 -11.601 2.636 908 HB2 ALA 118 2HB ALA 118 12.410 -12.259 3.788 909 HB3 ALA 118 3HB ALA 118 10.958 -11.444 4.369 910 H ILE 119 H ILE 119 10.615 -8.440 3.208 911 HA ILE 119 HA ILE 119 10.921 -8.296 0.335 912 HB ILE 119 HB ILE 119 9.042 -6.866 2.215 913 HG12 ILE 119 2HG1 ILE 119 8.258 -8.862 0.120 914 HG13 ILE 119 3HG1 ILE 119 8.891 -9.424 1.664 915 HG21 ILE 119 1HG2 ILE 119 9.429 -5.442 0.318 916 HG22 ILE 119 2HG2 ILE 119 9.197 -6.791 -0.793 917 HG23 ILE 119 3HG2 ILE 119 7.838 -6.185 0.154 918 HD11 ILE 119 3HD1 ILE 119 7.094 -8.502 2.853 919 HD12 ILE 119 1HD1 ILE 119 6.585 -7.517 1.482 920 HD13 ILE 119 2HD1 ILE 119 6.377 -9.268 1.436 921 H SER 120 H SER 120 11.109 -5.992 3.047 922 HA SER 120 HA SER 120 11.899 -3.753 1.606 923 HB2 SER 120 2HB SER 120 11.243 -3.886 4.065 924 HB3 SER 120 3HB SER 120 12.902 -4.394 4.382 925 HG SER 120 HG SER 120 13.493 -2.395 3.212 926 H HIS 121 H HIS 121 13.696 -6.572 2.497 927 HA HIS 121 HA HIS 121 16.309 -5.687 2.472 928 HB2 HIS 121 2HB HIS 121 15.446 -8.043 2.911 929 HB3 HIS 121 3HB HIS 121 15.430 -8.260 1.163 930 HD1 HIS 121 HD1 HIS 121 17.596 -8.890 0.074 931 HD2 HIS 121 HD2 HIS 121 18.101 -7.594 3.989 932 HE1 HIS 121 HE1 HIS 121 20.006 -9.345 0.628 933 H TYR 122 H TYR 122 14.097 -6.082 -0.190 934 HA TYR 122 HA TYR 122 16.239 -5.497 -2.110 935 HB2 TYR 122 2HB TYR 122 13.398 -6.249 -2.784 936 HB3 TYR 122 3HB TYR 122 14.819 -6.333 -3.820 937 HD1 TYR 122 HD1 TYR 122 16.623 -8.032 -3.238 938 HD2 TYR 122 HD2 TYR 122 12.743 -8.096 -1.494 939 HE1 TYR 122 HE1 TYR 122 16.958 -10.382 -2.594 940 HE2 TYR 122 HE2 TYR 122 13.068 -10.446 -0.844 941 HH TYR 122 HH TYR 122 15.888 -12.266 -1.879 942 H GLN 123 H GLN 123 15.747 -3.342 -0.632 943 HA GLN 123 HA GLN 123 14.989 -1.386 -2.492 944 HB2 GLN 123 2HB GLN 123 12.810 -2.517 -0.977 945 HB3 GLN 123 3HB GLN 123 13.002 -0.813 -0.588 946 HG2 GLN 123 2HG GLN 123 12.557 -0.132 -2.752 947 HG3 GLN 123 3HG GLN 123 12.948 -1.709 -3.435 948 HE21 GLN 123 1HE2 GLN 123 11.480 -3.502 -2.447 949 HE22 GLN 123 2HE2 GLN 123 9.791 -3.141 -2.467 950 H GLU 124 H GLU 124 15.335 -2.262 0.897 951 HA GLU 124 HA GLU 124 16.309 -1.213 2.666 952 HB2 GLU 124 2HB GLU 124 17.775 0.180 0.422 953 HB3 GLU 124 3HB GLU 124 18.202 0.342 2.119 954 HG2 GLU 124 2HG GLU 124 19.263 -1.614 2.156 955 HG3 GLU 124 3HG GLU 124 17.986 -2.429 1.254 Start of MODEL 17 1 H1 MET 1 H MET 1 0.026 -0.398 -0.328 2 HA MET 1 HA MET 1 0.535 -0.971 -3.166 3 HB2 MET 1 2HB MET 1 1.745 1.064 -2.659 4 HB3 MET 1 3HB MET 1 2.447 0.332 -1.222 5 HG2 MET 1 2HG MET 1 4.108 -0.563 -2.383 6 HG3 MET 1 3HG MET 1 3.003 -1.237 -3.578 7 HE1 MET 1 3HE MET 1 6.032 0.563 -5.130 8 HE2 MET 1 1HE MET 1 5.319 -0.953 -4.576 9 HE3 MET 1 2HE MET 1 4.808 -0.247 -6.109 10 H GLN 2 H GLN 2 0.960 -3.051 -3.450 11 HA GLN 2 HA GLN 2 1.583 -4.745 -1.196 12 HB2 GLN 2 2HB GLN 2 1.457 -6.581 -2.869 13 HB3 GLN 2 3HB GLN 2 0.013 -5.578 -2.823 14 HG2 GLN 2 2HG GLN 2 1.908 -4.579 -4.751 15 HG3 GLN 2 3HG GLN 2 1.512 -6.270 -5.056 16 HE21 GLN 2 1HE2 GLN 2 0.156 -6.196 -6.722 17 HE22 GLN 2 2HE2 GLN 2 -1.303 -5.274 -6.783 18 H ARG 3 H ARG 3 3.653 -3.159 -1.231 19 HA ARG 3 HA ARG 3 5.777 -3.723 -2.964 20 HB2 ARG 3 2HB ARG 3 7.219 -2.846 -1.094 21 HB3 ARG 3 3HB ARG 3 5.908 -1.782 -1.587 22 HG2 ARG 3 2HG ARG 3 5.694 -1.638 0.670 23 HG3 ARG 3 3HG ARG 3 4.636 -3.016 0.365 24 HD2 ARG 3 2HD ARG 3 6.145 -3.419 2.256 25 HD3 ARG 3 3HD ARG 3 6.429 -4.549 0.934 26 HE ARG 3 HE ARG 3 8.522 -3.648 0.647 27 HH11 ARG 3 1HH1 ARG 3 6.642 -1.592 2.734 28 HH12 ARG 3 2HH1 ARG 3 7.987 -0.598 3.185 29 HH21 ARG 3 1HH2 ARG 3 10.302 -2.347 1.232 30 HH22 ARG 3 2HH2 ARG 3 10.069 -1.028 2.329 31 H GLY 4 H GLY 4 4.389 -5.607 -0.477 32 HA2 GLY 4 2HA GLY 4 6.289 -7.730 -0.964 33 HA3 GLY 4 3HA GLY 4 6.355 -7.073 0.665 34 H ILE 5 H ILE 5 4.556 -8.996 -1.583 35 HA ILE 5 HA ILE 5 2.285 -9.345 0.163 36 HB ILE 5 HB ILE 5 3.074 -10.753 -2.388 37 HG12 ILE 5 2HG1 ILE 5 0.782 -8.849 -1.911 38 HG13 ILE 5 3HG1 ILE 5 2.371 -8.301 -2.435 39 HG21 ILE 5 1HG2 ILE 5 0.588 -11.034 -0.708 40 HG22 ILE 5 2HG2 ILE 5 0.752 -11.640 -2.355 41 HG23 ILE 5 3HG2 ILE 5 1.777 -12.284 -1.073 42 HD11 ILE 5 3HD1 ILE 5 0.221 -9.469 -3.962 43 HD12 ILE 5 1HD1 ILE 5 1.659 -8.606 -4.509 44 HD13 ILE 5 2HD1 ILE 5 1.736 -10.340 -4.196 45 H VAL 6 H VAL 6 1.795 -11.110 1.410 46 HA VAL 6 HA VAL 6 3.887 -13.169 1.674 47 HB VAL 6 HB VAL 6 2.242 -12.208 4.003 48 HG11 VAL 6 1HG1 VAL 6 4.418 -14.128 3.560 49 HG12 VAL 6 2HG1 VAL 6 4.624 -13.084 4.968 50 HG13 VAL 6 3HG1 VAL 6 3.178 -14.083 4.814 51 HG21 VAL 6 3HG2 VAL 6 4.917 -11.172 3.076 52 HG22 VAL 6 1HG2 VAL 6 3.417 -10.259 3.243 53 HG23 VAL 6 2HG2 VAL 6 4.238 -10.878 4.676 54 H TRP 7 H TRP 7 3.193 -15.196 1.478 55 HA TRP 7 HA TRP 7 0.293 -15.683 1.594 56 HB2 TRP 7 2HB TRP 7 2.483 -17.108 0.074 57 HB3 TRP 7 3HB TRP 7 0.834 -17.716 0.200 58 HD1 TRP 7 HD1 TRP 7 0.308 -14.182 -0.034 59 HE1 TRP 7 HE1 TRP 7 -0.102 -13.414 -2.456 60 HE3 TRP 7 HE3 TRP 7 2.000 -18.329 -2.499 61 HZ2 TRP 7 HZ2 TRP 7 0.245 -14.432 -5.066 62 HZ3 TRP 7 HZ3 TRP 7 1.926 -18.352 -4.958 63 HH2 TRP 7 HH2 TRP 7 1.065 -16.443 -6.213 64 H VAL 8 H VAL 8 -0.338 -17.901 2.301 65 HA VAL 8 HA VAL 8 1.523 -19.149 4.177 66 HB VAL 8 HB VAL 8 -1.221 -18.171 4.980 67 HG11 VAL 8 1HG1 VAL 8 -0.727 -19.146 7.172 68 HG12 VAL 8 2HG1 VAL 8 -0.773 -20.378 5.909 69 HG13 VAL 8 3HG1 VAL 8 0.776 -19.813 6.535 70 HG21 VAL 8 3HG2 VAL 8 1.549 -17.235 5.492 71 HG22 VAL 8 1HG2 VAL 8 0.059 -16.313 5.296 72 HG23 VAL 8 2HG2 VAL 8 0.392 -17.137 6.819 73 H VAL 9 H VAL 9 1.131 -21.317 4.562 74 HA VAL 9 HA VAL 9 -1.180 -22.524 3.208 75 HB VAL 9 HB VAL 9 0.707 -22.775 1.689 76 HG11 VAL 9 1HG1 VAL 9 2.394 -24.593 2.986 77 HG12 VAL 9 2HG1 VAL 9 2.764 -22.932 2.516 78 HG13 VAL 9 3HG1 VAL 9 2.141 -23.275 4.130 79 HG21 VAL 9 3HG2 VAL 9 0.855 -25.428 1.958 80 HG22 VAL 9 1HG2 VAL 9 -0.499 -25.114 3.045 81 HG23 VAL 9 2HG2 VAL 9 -0.588 -24.611 1.357 82 H ASP 10 H ASP 10 -1.871 -22.491 5.517 83 HA ASP 10 HA ASP 10 -0.696 -24.726 7.033 84 HB2 ASP 10 2HB ASP 10 -1.536 -23.701 9.048 85 HB3 ASP 10 3HB ASP 10 -0.639 -22.488 8.139 86 H ASP 11 H ASP 11 -2.405 -25.740 8.566 87 HA ASP 11 HA ASP 11 -4.864 -26.214 7.011 88 HB2 ASP 11 2HB ASP 11 -2.882 -28.060 7.613 89 HB3 ASP 11 3HB ASP 11 -4.123 -28.376 8.822 90 H ASP 12 H ASP 12 -4.120 -24.412 9.368 91 HA ASP 12 HA ASP 12 -6.184 -25.377 11.237 92 HB2 ASP 12 2HB ASP 12 -3.547 -24.561 11.747 93 HB3 ASP 12 3HB ASP 12 -4.564 -23.236 12.307 94 H SER 13 H SER 13 -7.638 -23.830 12.133 95 HA SER 13 HA SER 13 -8.511 -21.888 10.219 96 HB2 SER 13 2HB SER 13 -9.777 -23.350 12.150 97 HB3 SER 13 3HB SER 13 -9.696 -21.762 12.913 98 HG SER 13 HG SER 13 -11.531 -21.721 11.728 99 H SER 14 H SER 14 -7.290 -21.688 13.556 100 HA SER 14 HA SER 14 -7.239 -18.843 13.596 101 HB2 SER 14 2HB SER 14 -5.700 -19.280 15.633 102 HB3 SER 14 3HB SER 14 -7.373 -19.832 15.720 103 HG SER 14 HG SER 14 -6.299 -21.598 16.304 104 H ILE 15 H ILE 15 -4.733 -21.322 13.167 105 HA ILE 15 HA ILE 15 -2.478 -19.767 13.034 106 HB ILE 15 HB ILE 15 -3.143 -22.163 11.320 107 HG12 ILE 15 2HG1 ILE 15 -3.230 -22.640 13.709 108 HG13 ILE 15 3HG1 ILE 15 -1.807 -23.392 12.998 109 HG21 ILE 15 1HG2 ILE 15 -0.489 -20.842 11.864 110 HG22 ILE 15 2HG2 ILE 15 -0.700 -22.397 11.063 111 HG23 ILE 15 3HG2 ILE 15 -1.326 -20.928 10.315 112 HD11 ILE 15 3HD1 ILE 15 -2.001 -21.467 15.126 113 HD12 ILE 15 1HD1 ILE 15 -0.627 -22.445 14.612 114 HD13 ILE 15 2HD1 ILE 15 -0.942 -20.890 13.840 115 H ARG 16 H ARG 16 -4.804 -20.410 10.436 116 HA ARG 16 HA ARG 16 -3.366 -18.788 8.540 117 HB2 ARG 16 2HB ARG 16 -4.830 -19.573 6.970 118 HB3 ARG 16 3HB ARG 16 -5.024 -20.833 8.181 119 HG2 ARG 16 2HG ARG 16 -6.929 -19.251 9.055 120 HG3 ARG 16 3HG ARG 16 -6.884 -18.653 7.395 121 HD2 ARG 16 2HD ARG 16 -6.856 -21.341 6.996 122 HD3 ARG 16 3HD ARG 16 -7.832 -21.222 8.459 123 HE ARG 16 HE ARG 16 -8.588 -20.432 5.815 124 HH11 ARG 16 1HH1 ARG 16 -9.079 -19.805 9.204 125 HH12 ARG 16 2HH1 ARG 16 -10.667 -19.147 8.986 126 HH21 ARG 16 1HH2 ARG 16 -10.677 -19.568 5.515 127 HH22 ARG 16 2HH2 ARG 16 -11.575 -19.014 6.887 128 H TRP 17 H TRP 17 -5.836 -18.308 10.900 129 HA TRP 17 HA TRP 17 -6.969 -15.944 9.784 130 HB2 TRP 17 2HB TRP 17 -8.319 -17.108 11.343 131 HB3 TRP 17 3HB TRP 17 -7.025 -17.169 12.537 132 HD1 TRP 17 HD1 TRP 17 -9.500 -14.655 10.973 133 HE1 TRP 17 HE1 TRP 17 -9.851 -12.728 12.643 134 HE3 TRP 17 HE3 TRP 17 -6.056 -16.004 14.502 135 HZ2 TRP 17 HZ2 TRP 17 -8.805 -11.891 15.128 136 HZ3 TRP 17 HZ3 TRP 17 -5.793 -14.585 16.495 137 HH2 TRP 17 HH2 TRP 17 -7.139 -12.572 16.800 138 H VAL 18 H VAL 18 -5.015 -16.299 12.749 139 HA VAL 18 HA VAL 18 -4.405 -13.651 13.151 140 HB VAL 18 HB VAL 18 -3.717 -14.983 14.899 141 HG11 VAL 18 1HG1 VAL 18 -1.924 -16.893 14.193 142 HG12 VAL 18 2HG1 VAL 18 -3.660 -17.164 14.356 143 HG13 VAL 18 3HG1 VAL 18 -2.960 -16.854 12.767 144 HG21 VAL 18 3HG2 VAL 18 -1.507 -14.466 15.265 145 HG22 VAL 18 1HG2 VAL 18 -1.025 -14.881 13.620 146 HG23 VAL 18 2HG2 VAL 18 -1.885 -13.374 13.933 147 H LEU 19 H LEU 19 -2.687 -15.984 11.112 148 HA LEU 19 HA LEU 19 -0.543 -14.326 10.384 149 HB2 LEU 19 2HB LEU 19 -1.831 -16.739 9.191 150 HB3 LEU 19 3HB LEU 19 -0.624 -15.856 8.259 151 HG LEU 19 HG LEU 19 -0.062 -16.901 11.022 152 HD11 LEU 19 1HD1 LEU 19 0.944 -18.392 8.685 153 HD12 LEU 19 2HD1 LEU 19 -0.770 -18.581 9.053 154 HD13 LEU 19 3HD1 LEU 19 0.442 -18.968 10.275 155 HD21 LEU 19 3HD2 LEU 19 2.201 -16.578 10.467 156 HD22 LEU 19 1HD2 LEU 19 1.374 -15.124 9.908 157 HD23 LEU 19 2HD2 LEU 19 1.838 -16.373 8.753 158 H GLU 20 H GLU 20 -3.839 -14.419 9.337 159 HA GLU 20 HA GLU 20 -3.373 -12.919 6.916 160 HB2 GLU 20 2HB GLU 20 -5.388 -14.571 7.749 161 HB3 GLU 20 3HB GLU 20 -6.110 -12.986 7.987 162 HG2 GLU 20 2HG GLU 20 -4.784 -13.159 5.431 163 HG3 GLU 20 3HG GLU 20 -5.984 -14.435 5.625 164 H ARG 21 H ARG 21 -4.774 -12.282 10.114 165 HA ARG 21 HA ARG 21 -5.558 -9.651 9.746 166 HB2 ARG 21 2HB ARG 21 -4.324 -10.696 12.293 167 HB3 ARG 21 3HB ARG 21 -5.528 -9.425 12.122 168 HG2 ARG 21 2HG ARG 21 -5.900 -12.377 11.690 169 HG3 ARG 21 3HG ARG 21 -6.631 -11.363 12.936 170 HD2 ARG 21 2HD ARG 21 -7.194 -11.394 9.983 171 HD3 ARG 21 3HD ARG 21 -8.309 -11.711 11.312 172 HE ARG 21 HE ARG 21 -7.509 -9.149 11.734 173 HH11 ARG 21 1HH1 ARG 21 -8.883 -10.847 9.022 174 HH12 ARG 21 2HH1 ARG 21 -9.698 -9.453 8.395 175 HH21 ARG 21 1HH2 ARG 21 -8.578 -7.307 10.918 176 HH22 ARG 21 2HH2 ARG 21 -9.523 -7.439 9.474 177 H ALA 22 H ALA 22 -2.372 -10.983 10.148 178 HA ALA 22 HA ALA 22 -0.905 -8.815 11.016 179 HB1 ALA 22 1HB ALA 22 0.326 -10.367 8.833 180 HB2 ALA 22 2HB ALA 22 0.916 -10.024 10.460 181 HB3 ALA 22 3HB ALA 22 -0.273 -11.301 10.204 182 H LEU 23 H LEU 23 -1.462 -9.703 7.601 183 HA LEU 23 HA LEU 23 -0.568 -7.093 6.728 184 HB2 LEU 23 2HB LEU 23 -1.860 -9.087 4.921 185 HB3 LEU 23 3HB LEU 23 -0.567 -7.939 4.578 186 HG LEU 23 HG LEU 23 -0.360 -10.565 6.038 187 HD11 LEU 23 1HD1 LEU 23 0.101 -11.307 3.996 188 HD12 LEU 23 2HD1 LEU 23 1.572 -10.338 4.051 189 HD13 LEU 23 3HD1 LEU 23 0.105 -9.673 3.333 190 HD21 LEU 23 3HD2 LEU 23 1.249 -8.173 6.307 191 HD22 LEU 23 1HD2 LEU 23 2.194 -9.539 5.712 192 HD23 LEU 23 2HD2 LEU 23 1.300 -9.678 7.226 193 H ALA 24 H ALA 24 -3.552 -8.707 7.387 194 HA ALA 24 HA ALA 24 -5.389 -7.405 5.819 195 HB1 ALA 24 1HB ALA 24 -7.029 -7.933 7.440 196 HB2 ALA 24 2HB ALA 24 -5.817 -9.211 7.530 197 HB3 ALA 24 3HB ALA 24 -5.843 -7.934 8.746 198 H GLY 25 H GLY 25 -3.822 -6.220 8.761 199 HA2 GLY 25 2HA GLY 25 -5.315 -3.729 8.675 200 HA3 GLY 25 3HA GLY 25 -4.100 -4.179 9.863 201 H ALA 26 H ALA 26 -2.347 -4.942 7.451 202 HA ALA 26 HA ALA 26 -1.238 -2.255 7.114 203 HB1 ALA 26 1HB ALA 26 0.137 -4.237 7.938 204 HB2 ALA 26 2HB ALA 26 0.084 -4.816 6.272 205 HB3 ALA 26 3HB ALA 26 0.828 -3.260 6.642 206 H GLY 27 H GLY 27 0.206 -2.526 4.808 207 HA2 GLY 27 2HA GLY 27 -1.944 -2.633 2.797 208 HA3 GLY 27 3HA GLY 27 -0.475 -1.678 2.662 209 H LEU 28 H LEU 28 -0.981 -5.108 3.457 210 HA LEU 28 HA LEU 28 0.519 -5.815 1.029 211 HB2 LEU 28 2HB LEU 28 1.010 -7.645 3.215 212 HB3 LEU 28 3HB LEU 28 2.151 -6.834 2.144 213 HG LEU 28 HG LEU 28 0.933 -5.527 4.571 214 HD11 LEU 28 1HD1 LEU 28 2.489 -6.412 5.911 215 HD12 LEU 28 2HD1 LEU 28 3.751 -6.299 4.685 216 HD13 LEU 28 3HD1 LEU 28 2.631 -7.661 4.675 217 HD21 LEU 28 3HD2 LEU 28 2.645 -4.657 2.402 218 HD22 LEU 28 1HD2 LEU 28 3.403 -4.419 3.977 219 HD23 LEU 28 2HD2 LEU 28 1.824 -3.709 3.644 220 H THR 29 H THR 29 -0.186 -7.595 -0.050 221 HA THR 29 HA THR 29 -2.807 -8.546 0.504 222 HB THR 29 HB THR 29 -0.856 -9.840 -1.397 223 HG1 THR 29 HG1 THR 29 -2.619 -7.794 -2.199 224 HG21 THR 29 3HG2 THR 29 -3.247 -9.871 -2.625 225 HG22 THR 29 1HG2 THR 29 -3.779 -9.911 -0.944 226 HG23 THR 29 2HG2 THR 29 -2.695 -11.161 -1.557 227 H CYS 30 H CYS 30 -3.507 -10.425 1.397 228 HA CYS 30 HA CYS 30 -1.457 -12.289 2.395 229 HB2 CYS 30 2HB CYS 30 -3.076 -12.665 4.341 230 HB3 CYS 30 3HB CYS 30 -2.175 -11.154 4.334 231 HG CYS 30 HG CYS 30 -4.225 -9.522 3.739 232 H THR 31 H THR 31 -1.662 -14.127 1.308 233 HA THR 31 HA THR 31 -4.370 -15.070 0.629 234 HB THR 31 HB THR 31 -1.767 -15.844 -0.701 235 HG1 THR 31 HG1 THR 31 -2.832 -13.592 -0.965 236 HG21 THR 31 3HG2 THR 31 -3.176 -16.886 -2.382 237 HG22 THR 31 1HG2 THR 31 -4.626 -16.372 -1.521 238 HG23 THR 31 2HG2 THR 31 -3.544 -17.559 -0.795 239 H THR 32 H THR 32 -5.078 -16.683 1.847 240 HA THR 32 HA THR 32 -3.133 -18.436 3.173 241 HB THR 32 HB THR 32 -4.934 -19.074 4.686 242 HG1 THR 32 HG1 THR 32 -6.941 -17.725 4.423 243 HG21 THR 32 3HG2 THR 32 -5.534 -16.382 5.133 244 HG22 THR 32 1HG2 THR 32 -3.939 -16.381 4.381 245 HG23 THR 32 2HG2 THR 32 -4.219 -17.311 5.852 246 H PHE 33 H PHE 33 -2.972 -20.540 2.686 247 HA PHE 33 HA PHE 33 -4.957 -21.667 0.822 248 HB2 PHE 33 2HB PHE 33 -2.001 -22.264 1.056 249 HB3 PHE 33 3HB PHE 33 -3.115 -23.136 0.009 250 HD1 PHE 33 HD2 PHE 33 -4.139 -22.005 -1.923 251 HD2 PHE 33 HD1 PHE 33 -1.167 -20.118 0.469 252 HE1 PHE 33 HE2 PHE 33 -3.764 -20.348 -3.703 253 HE2 PHE 33 HE1 PHE 33 -0.788 -18.457 -1.306 254 HZ PHE 33 HZ PHE 33 -2.086 -18.571 -3.396 255 H GLU 34 H GLU 34 -4.370 -24.285 0.876 256 HA GLU 34 HA GLU 34 -4.325 -25.158 3.663 257 HB2 GLU 34 2HB GLU 34 -6.344 -26.575 3.287 258 HB3 GLU 34 3HB GLU 34 -6.676 -24.848 3.285 259 HG2 GLU 34 2HG GLU 34 -7.027 -24.790 0.987 260 HG3 GLU 34 3HG GLU 34 -6.203 -26.327 0.728 261 H ASN 35 H ASN 35 -2.858 -25.405 0.925 262 HA ASN 35 HA ASN 35 -1.935 -28.073 1.369 263 HB2 ASN 35 2HB ASN 35 -4.056 -27.661 -0.547 264 HB3 ASN 35 3HB ASN 35 -2.605 -28.246 -1.356 265 HD21 ASN 35 1HD2 ASN 35 -5.133 -29.592 -0.948 266 HD22 ASN 35 2HD2 ASN 35 -4.782 -31.036 -0.065 267 H GLY 36 H GLY 36 0.178 -27.980 1.013 268 HA2 GLY 36 2HA GLY 36 1.538 -25.821 -0.061 269 HA3 GLY 36 3HA GLY 36 2.208 -27.439 0.086 270 H ASN 37 H ASN 37 0.555 -28.816 -1.687 271 HA ASN 37 HA ASN 37 1.834 -28.324 -4.133 272 HB2 ASN 37 2HB ASN 37 0.543 -30.091 -5.017 273 HB3 ASN 37 3HB ASN 37 0.739 -30.489 -3.313 274 HD21 ASN 37 1HD2 ASN 37 -1.018 -30.881 -2.151 275 HD22 ASN 37 2HD2 ASN 37 -2.641 -30.572 -2.654 276 H GLU 38 H GLU 38 -0.932 -26.889 -2.717 277 HA GLU 38 HA GLU 38 -2.007 -25.944 -5.248 278 HB2 GLU 38 2HB GLU 38 -3.154 -26.508 -2.804 279 HB3 GLU 38 3HB GLU 38 -3.099 -24.751 -2.811 280 HG2 GLU 38 2HG GLU 38 -4.546 -24.570 -4.578 281 HG3 GLU 38 3HG GLU 38 -4.147 -26.167 -5.208 282 H VAL 39 H VAL 39 0.155 -24.909 -2.796 283 HA VAL 39 HA VAL 39 -0.080 -22.091 -3.485 284 HB VAL 39 HB VAL 39 1.962 -23.325 -1.643 285 HG11 VAL 39 1HG1 VAL 39 0.885 -20.690 -1.027 286 HG12 VAL 39 2HG1 VAL 39 2.560 -21.232 -1.139 287 HG13 VAL 39 3HG1 VAL 39 1.686 -20.759 -2.597 288 HG21 VAL 39 3HG2 VAL 39 -0.034 -22.215 -0.066 289 HG22 VAL 39 1HG2 VAL 39 -0.906 -23.121 -1.303 290 HG23 VAL 39 2HG2 VAL 39 0.293 -23.933 -0.296 291 H LEU 40 H LEU 40 2.169 -24.775 -3.889 292 HA LEU 40 HA LEU 40 4.405 -23.489 -4.838 293 HB2 LEU 40 2HB LEU 40 4.723 -25.740 -4.614 294 HB3 LEU 40 3HB LEU 40 3.168 -26.141 -5.342 295 HG LEU 40 HG LEU 40 4.055 -25.759 -7.553 296 HD11 LEU 40 1HD1 LEU 40 5.658 -24.226 -7.758 297 HD12 LEU 40 2HD1 LEU 40 6.784 -25.499 -7.290 298 HD13 LEU 40 3HD1 LEU 40 6.150 -24.393 -6.073 299 HD21 LEU 40 3HD2 LEU 40 4.906 -27.785 -5.792 300 HD22 LEU 40 1HD2 LEU 40 6.305 -27.342 -6.771 301 HD23 LEU 40 2HD2 LEU 40 4.806 -27.847 -7.552 302 H ALA 41 H ALA 41 1.536 -24.475 -6.682 303 HA ALA 41 HA ALA 41 2.498 -23.461 -9.166 304 HB1 ALA 41 1HB ALA 41 0.108 -24.794 -8.190 305 HB2 ALA 41 2HB ALA 41 -0.248 -23.562 -9.401 306 HB3 ALA 41 3HB ALA 41 0.878 -24.866 -9.775 307 H ALA 42 H ALA 42 0.805 -22.091 -6.465 308 HA ALA 42 HA ALA 42 -0.388 -19.874 -7.701 309 HB1 ALA 42 1HB ALA 42 -0.586 -18.931 -5.518 310 HB2 ALA 42 2HB ALA 42 -0.820 -20.674 -5.372 311 HB3 ALA 42 3HB ALA 42 0.716 -19.948 -4.900 312 H LEU 43 H LEU 43 2.881 -20.407 -6.514 313 HA LEU 43 HA LEU 43 3.817 -17.776 -6.585 314 HB2 LEU 43 2HB LEU 43 5.562 -20.065 -7.384 315 HB3 LEU 43 3HB LEU 43 5.953 -18.652 -6.405 316 HG LEU 43 HG LEU 43 4.460 -21.129 -5.578 317 HD11 LEU 43 1HD1 LEU 43 6.272 -20.837 -3.713 318 HD12 LEU 43 2HD1 LEU 43 7.090 -19.879 -4.946 319 HD13 LEU 43 3HD1 LEU 43 6.690 -21.566 -5.264 320 HD21 LEU 43 3HD2 LEU 43 3.239 -19.874 -4.205 321 HD22 LEU 43 1HD2 LEU 43 4.149 -18.420 -4.612 322 HD23 LEU 43 2HD2 LEU 43 4.735 -19.501 -3.347 323 H ALA 44 H ALA 44 3.523 -20.190 -9.132 324 HA ALA 44 HA ALA 44 4.966 -18.803 -11.121 325 HB1 ALA 44 1HB ALA 44 4.022 -20.339 -12.679 326 HB2 ALA 44 2HB ALA 44 4.329 -21.223 -11.183 327 HB3 ALA 44 3HB ALA 44 2.688 -20.717 -11.588 328 H SER 45 H SER 45 2.012 -18.105 -9.661 329 HA SER 45 HA SER 45 0.716 -16.893 -11.920 330 HB2 SER 45 2HB SER 45 0.117 -16.485 -8.982 331 HB3 SER 45 3HB SER 45 -0.960 -16.159 -10.340 332 HG SER 45 HG SER 45 -0.903 -18.337 -9.005 333 H LYS 46 H LYS 46 1.690 -15.383 -8.845 334 HA LYS 46 HA LYS 46 2.672 -13.075 -10.393 335 HB2 LYS 46 2HB LYS 46 1.946 -11.685 -8.400 336 HB3 LYS 46 3HB LYS 46 0.653 -12.338 -9.396 337 HG2 LYS 46 2HG LYS 46 0.393 -14.182 -7.757 338 HG3 LYS 46 3HG LYS 46 1.589 -13.384 -6.734 339 HD2 LYS 46 2HD LYS 46 -1.037 -12.197 -7.632 340 HD3 LYS 46 3HD LYS 46 -0.698 -12.856 -6.030 341 HE2 LYS 46 2HE LYS 46 -0.248 -10.692 -5.558 342 HE3 LYS 46 3HE LYS 46 1.327 -11.109 -6.232 343 HZ1 LYS 46 3HZ LYS 46 -0.438 -10.358 -8.304 344 HZ2 LYS 46 1HZ LYS 46 1.026 -9.644 -7.845 345 HZ3 LYS 46 2HZ LYS 46 -0.420 -9.151 -7.118 346 H THR 47 H THR 47 3.381 -15.483 -8.161 347 HA THR 47 HA THR 47 5.203 -15.964 -6.883 348 HB THR 47 HB THR 47 6.986 -13.850 -7.755 349 HG1 THR 47 HG1 THR 47 6.830 -14.107 -9.924 350 HG21 THR 47 3HG2 THR 47 7.372 -16.565 -8.789 351 HG22 THR 47 1HG2 THR 47 7.164 -16.483 -7.040 352 HG23 THR 47 2HG2 THR 47 8.447 -15.559 -7.820 353 HA PRO 48 HA PRO 48 4.348 -12.893 -3.691 354 HB2 PRO 48 2HB PRO 48 4.919 -14.561 -1.627 355 HB3 PRO 48 3HB PRO 48 3.372 -14.586 -2.482 356 HG2 PRO 48 2HG PRO 48 5.750 -16.373 -2.817 357 HG3 PRO 48 3HG PRO 48 4.029 -16.798 -2.769 358 HD2 PRO 48 2HD PRO 48 5.416 -16.596 -5.086 359 HD3 PRO 48 3HD PRO 48 3.691 -16.196 -4.968 360 H ASP 49 H ASP 49 5.662 -12.303 -1.651 361 HA ASP 49 HA ASP 49 8.484 -12.142 -2.448 362 HB2 ASP 49 2HB ASP 49 6.724 -10.399 -0.741 363 HB3 ASP 49 3HB ASP 49 8.480 -10.290 -0.640 364 H VAL 50 H VAL 50 6.450 -13.722 -0.290 365 HA VAL 50 HA VAL 50 8.502 -15.139 0.976 366 HB VAL 50 HB VAL 50 9.030 -13.124 2.187 367 HG11 VAL 50 1HG1 VAL 50 7.541 -11.641 2.966 368 HG12 VAL 50 2HG1 VAL 50 6.389 -12.486 1.931 369 HG13 VAL 50 3HG1 VAL 50 6.502 -12.894 3.643 370 HG21 VAL 50 3HG2 VAL 50 8.666 -15.505 3.334 371 HG22 VAL 50 1HG2 VAL 50 9.200 -14.088 4.238 372 HG23 VAL 50 2HG2 VAL 50 7.504 -14.570 4.276 373 H LEU 51 H LEU 51 7.719 -16.854 2.172 374 HA LEU 51 HA LEU 51 4.785 -17.015 2.398 375 HB2 LEU 51 2HB LEU 51 6.573 -18.663 0.980 376 HB3 LEU 51 3HB LEU 51 6.036 -19.595 2.376 377 HG LEU 51 HG LEU 51 3.863 -18.276 0.922 378 HD11 LEU 51 1HD1 LEU 51 5.386 -18.808 -0.947 379 HD12 LEU 51 2HD1 LEU 51 3.892 -19.744 -0.989 380 HD13 LEU 51 3HD1 LEU 51 5.387 -20.495 -0.433 381 HD21 LEU 51 3HD2 LEU 51 4.208 -20.396 2.682 382 HD22 LEU 51 1HD2 LEU 51 3.803 -21.159 1.144 383 HD23 LEU 51 2HD2 LEU 51 2.722 -19.951 1.840 384 H LEU 52 H LEU 52 4.053 -18.631 4.063 385 HA LEU 52 HA LEU 52 5.895 -18.922 6.313 386 HB2 LEU 52 2HB LEU 52 3.384 -17.319 6.285 387 HB3 LEU 52 3HB LEU 52 3.810 -18.204 7.749 388 HG LEU 52 HG LEU 52 6.052 -16.974 7.620 389 HD11 LEU 52 1HD1 LEU 52 4.772 -15.943 5.277 390 HD12 LEU 52 2HD1 LEU 52 6.410 -15.665 5.868 391 HD13 LEU 52 3HD1 LEU 52 5.090 -14.629 6.410 392 HD21 LEU 52 3HD2 LEU 52 3.665 -15.210 8.098 393 HD22 LEU 52 1HD2 LEU 52 5.224 -15.198 8.924 394 HD23 LEU 52 2HD2 LEU 52 4.100 -16.532 9.183 395 H SER 53 H SER 53 5.726 -21.141 5.482 396 HA SER 53 HA SER 53 3.277 -22.568 5.561 397 HB2 SER 53 2HB SER 53 4.707 -24.589 5.425 398 HB3 SER 53 3HB SER 53 5.160 -23.371 4.233 399 HG SER 53 HG SER 53 6.632 -24.438 6.228 400 H ASP 54 H ASP 54 2.295 -23.680 7.160 401 HA ASP 54 HA ASP 54 3.278 -23.263 9.865 402 HB2 ASP 54 2HB ASP 54 0.932 -22.787 9.444 403 HB3 ASP 54 3HB ASP 54 0.681 -24.420 8.834 404 H ILE 55 H ILE 55 2.992 -25.793 7.522 405 HA ILE 55 HA ILE 55 3.401 -28.044 7.589 406 HB ILE 55 HB ILE 55 5.517 -27.254 9.589 407 HG12 ILE 55 2HG1 ILE 55 5.663 -27.185 6.567 408 HG13 ILE 55 3HG1 ILE 55 5.541 -25.768 7.603 409 HG21 ILE 55 1HG2 ILE 55 6.559 -29.142 7.890 410 HG22 ILE 55 2HG2 ILE 55 5.923 -29.448 9.506 411 HG23 ILE 55 3HG2 ILE 55 4.890 -29.675 8.095 412 HD11 ILE 55 3HD1 ILE 55 7.858 -27.111 6.742 413 HD12 ILE 55 1HD1 ILE 55 7.736 -25.722 7.821 414 HD13 ILE 55 2HD1 ILE 55 7.729 -27.356 8.484 415 H ARG 56 H ARG 56 1.241 -27.980 8.899 416 HA ARG 56 HA ARG 56 1.718 -29.296 11.493 417 HB2 ARG 56 2HB ARG 56 -0.233 -28.351 12.369 418 HB3 ARG 56 3HB ARG 56 0.479 -27.037 11.442 419 HG2 ARG 56 2HG ARG 56 -1.049 -27.529 9.589 420 HG3 ARG 56 3HG ARG 56 -1.776 -28.820 10.548 421 HD2 ARG 56 2HD ARG 56 -1.723 -26.430 12.103 422 HD3 ARG 56 3HD ARG 56 -2.422 -26.065 10.526 423 HE ARG 56 HE ARG 56 -4.235 -27.393 11.043 424 HH11 ARG 56 1HH1 ARG 56 -1.738 -27.792 13.436 425 HH12 ARG 56 2HH1 ARG 56 -2.753 -28.662 14.538 426 HH21 ARG 56 1HH2 ARG 56 -5.581 -28.538 12.486 427 HH22 ARG 56 2HH2 ARG 56 -4.938 -29.086 13.996 428 H MET 57 H MET 57 0.591 -29.678 8.341 429 HA MET 57 HA MET 57 -1.445 -31.622 8.810 430 HB2 MET 57 2HB MET 57 -1.182 -32.106 6.374 431 HB3 MET 57 3HB MET 57 -1.472 -30.410 6.738 432 HG2 MET 57 2HG MET 57 1.265 -30.572 6.747 433 HG3 MET 57 3HG MET 57 0.807 -31.690 5.464 434 HE1 MET 57 3HE MET 57 1.979 -28.093 4.081 435 HE2 MET 57 1HE MET 57 1.844 -27.962 5.834 436 HE3 MET 57 2HE MET 57 2.588 -29.389 5.112 437 HA PRO 58 HA PRO 58 0.982 -35.208 9.573 438 HB2 PRO 58 2HB PRO 58 -0.721 -37.118 8.665 439 HB3 PRO 58 3HB PRO 58 -0.984 -36.236 10.174 440 HG2 PRO 58 2HG PRO 58 -2.199 -35.780 7.477 441 HG3 PRO 58 3HG PRO 58 -2.974 -35.756 9.072 442 HD2 PRO 58 2HD PRO 58 -2.270 -33.494 7.760 443 HD3 PRO 58 3HD PRO 58 -2.249 -33.617 9.531 444 H GLY 59 H GLY 59 -0.672 -35.275 6.405 445 HA2 GLY 59 2HA GLY 59 1.175 -37.038 5.189 446 HA3 GLY 59 3HA GLY 59 0.039 -35.997 4.344 447 H MET 60 H MET 60 0.674 -33.768 3.957 448 HA MET 60 HA MET 60 3.135 -33.496 2.756 449 HB2 MET 60 2HB MET 60 0.900 -31.844 3.241 450 HB3 MET 60 3HB MET 60 2.307 -30.941 3.787 451 HG2 MET 60 2HG MET 60 2.103 -30.313 1.575 452 HG3 MET 60 3HG MET 60 3.333 -31.573 1.520 453 HE1 MET 60 3HE MET 60 1.272 -31.663 -1.782 454 HE2 MET 60 1HE MET 60 0.336 -30.542 -0.792 455 HE3 MET 60 2HE MET 60 2.098 -30.462 -0.789 456 H ASP 61 H ASP 61 5.078 -33.700 3.643 457 HA ASP 61 HA ASP 61 5.680 -33.490 6.358 458 HB2 ASP 61 2HB ASP 61 7.053 -34.600 4.517 459 HB3 ASP 61 3HB ASP 61 7.673 -32.992 4.149 460 H GLY 62 H GLY 62 5.325 -31.045 3.954 461 HA2 GLY 62 2HA GLY 62 4.969 -28.767 4.607 462 HA3 GLY 62 3HA GLY 62 6.053 -29.026 5.966 463 H LEU 63 H LEU 63 8.305 -29.982 4.954 464 HA LEU 63 HA LEU 63 9.347 -27.726 3.485 465 HB2 LEU 63 2HB LEU 63 11.500 -29.175 3.692 466 HB3 LEU 63 3HB LEU 63 10.835 -28.361 5.107 467 HG LEU 63 HG LEU 63 9.872 -30.444 5.889 468 HD11 LEU 63 1HD1 LEU 63 9.256 -31.696 4.060 469 HD12 LEU 63 2HD1 LEU 63 10.705 -32.547 4.593 470 HD13 LEU 63 3HD1 LEU 63 10.788 -31.435 3.227 471 HD21 LEU 63 3HD2 LEU 63 11.975 -30.223 6.792 472 HD22 LEU 63 1HD2 LEU 63 12.779 -30.333 5.226 473 HD23 LEU 63 2HD2 LEU 63 12.116 -31.783 5.981 474 H ALA 64 H ALA 64 8.115 -30.795 2.723 475 HA ALA 64 HA ALA 64 9.564 -31.746 0.620 476 HB1 ALA 64 1HB ALA 64 6.822 -31.936 1.495 477 HB2 ALA 64 2HB ALA 64 6.933 -31.974 -0.265 478 HB3 ALA 64 3HB ALA 64 7.836 -33.141 0.701 479 H LEU 65 H LEU 65 7.057 -29.222 0.424 480 HA LEU 65 HA LEU 65 7.697 -28.687 -2.345 481 HB2 LEU 65 2HB LEU 65 5.746 -27.568 -2.436 482 HB3 LEU 65 3HB LEU 65 5.412 -28.485 -0.969 483 HG LEU 65 HG LEU 65 6.468 -25.660 -1.000 484 HD11 LEU 65 1HD1 LEU 65 4.407 -24.905 -1.302 485 HD12 LEU 65 2HD1 LEU 65 3.796 -25.929 -0.003 486 HD13 LEU 65 3HD1 LEU 65 3.888 -26.554 -1.649 487 HD21 LEU 65 3HD2 LEU 65 6.427 -25.710 1.260 488 HD22 LEU 65 1HD2 LEU 65 6.673 -27.437 0.998 489 HD23 LEU 65 2HD2 LEU 65 5.054 -26.816 1.322 490 H LEU 66 H LEU 66 8.589 -27.497 0.762 491 HA LEU 66 HA LEU 66 9.415 -24.892 -0.022 492 HB2 LEU 66 2HB LEU 66 9.065 -26.142 2.354 493 HB3 LEU 66 3HB LEU 66 10.822 -26.174 2.224 494 HG LEU 66 HG LEU 66 10.428 -24.240 3.431 495 HD11 LEU 66 1HD1 LEU 66 10.965 -22.384 1.985 496 HD12 LEU 66 2HD1 LEU 66 10.407 -23.281 0.573 497 HD13 LEU 66 3HD1 LEU 66 11.838 -23.821 1.452 498 HD21 LEU 66 3HD2 LEU 66 8.660 -22.570 2.680 499 HD22 LEU 66 1HD2 LEU 66 8.086 -24.070 3.408 500 HD23 LEU 66 2HD2 LEU 66 8.032 -23.863 1.658 501 H LYS 67 H LYS 67 10.819 -28.029 -0.288 502 HA LYS 67 HA LYS 67 13.545 -27.276 -0.460 503 HB2 LYS 67 2HB LYS 67 12.022 -29.680 -1.457 504 HB3 LYS 67 3HB LYS 67 13.757 -29.504 -1.682 505 HG2 LYS 67 2HG LYS 67 12.374 -29.475 0.992 506 HG3 LYS 67 3HG LYS 67 13.139 -30.892 0.268 507 HD2 LYS 67 2HD LYS 67 14.532 -28.297 0.926 508 HD3 LYS 67 3HD LYS 67 14.605 -29.770 1.896 509 HE2 LYS 67 2HE LYS 67 15.266 -30.561 -0.699 510 HE3 LYS 67 3HE LYS 67 16.111 -29.033 -0.454 511 HZ1 LYS 67 3HZ LYS 67 16.240 -31.327 1.425 512 HZ2 LYS 67 1HZ LYS 67 17.152 -29.904 1.495 513 HZ3 LYS 67 2HZ LYS 67 17.400 -31.006 0.237 514 H GLN 68 H GLN 68 10.908 -27.245 -2.723 515 HA GLN 68 HA GLN 68 12.642 -26.878 -5.018 516 HB2 GLN 68 2HB GLN 68 10.753 -27.101 -6.337 517 HB3 GLN 68 3HB GLN 68 10.328 -28.078 -4.939 518 HG2 GLN 68 2HG GLN 68 9.370 -25.671 -4.174 519 HG3 GLN 68 3HG GLN 68 9.162 -25.571 -5.922 520 HE21 GLN 68 1HE2 GLN 68 7.089 -25.654 -3.977 521 HE22 GLN 68 2HE2 GLN 68 6.166 -27.086 -4.262 522 H ILE 69 H ILE 69 10.946 -24.947 -2.721 523 HA ILE 69 HA ILE 69 10.614 -22.583 -4.207 524 HB ILE 69 HB ILE 69 11.041 -22.933 -1.238 525 HG12 ILE 69 2HG1 ILE 69 8.525 -22.600 -2.886 526 HG13 ILE 69 3HG1 ILE 69 9.054 -24.082 -2.098 527 HG21 ILE 69 1HG2 ILE 69 10.066 -20.538 -2.788 528 HG22 ILE 69 2HG2 ILE 69 10.037 -20.694 -1.032 529 HG23 ILE 69 3HG2 ILE 69 11.578 -20.665 -1.889 530 HD11 ILE 69 3HD1 ILE 69 7.917 -23.489 -0.303 531 HD12 ILE 69 1HD1 ILE 69 8.977 -22.092 -0.113 532 HD13 ILE 69 2HD1 ILE 69 7.489 -21.950 -1.050 533 H LYS 70 H LYS 70 13.401 -24.036 -2.776 534 HA LYS 70 HA LYS 70 14.985 -21.637 -2.708 535 HB2 LYS 70 2HB LYS 70 15.875 -24.523 -2.567 536 HB3 LYS 70 3HB LYS 70 16.838 -23.116 -2.136 537 HG2 LYS 70 2HG LYS 70 14.244 -23.527 -0.747 538 HG3 LYS 70 3HG LYS 70 15.610 -24.557 -0.312 539 HD2 LYS 70 2HD LYS 70 16.487 -21.839 -0.489 540 HD3 LYS 70 3HD LYS 70 15.067 -21.928 0.555 541 HE2 LYS 70 2HE LYS 70 17.605 -23.537 0.822 542 HE3 LYS 70 3HE LYS 70 17.086 -22.214 1.865 543 HZ1 LYS 70 3HZ LYS 70 15.026 -23.678 2.244 544 HZ2 LYS 70 1HZ LYS 70 16.464 -24.090 3.034 545 HZ3 LYS 70 2HZ LYS 70 15.985 -24.940 1.653 546 H GLN 71 H GLN 71 14.389 -24.230 -4.970 547 HA GLN 71 HA GLN 71 16.557 -23.419 -6.717 548 HB2 GLN 71 2HB GLN 71 15.880 -25.816 -6.414 549 HB3 GLN 71 3HB GLN 71 14.376 -25.441 -7.244 550 HG2 GLN 71 2HG GLN 71 15.334 -25.499 -9.256 551 HG3 GLN 71 3HG GLN 71 16.755 -24.608 -8.711 552 HE21 GLN 71 1HE2 GLN 71 15.240 -27.792 -8.303 553 HE22 GLN 71 2HE2 GLN 71 16.712 -28.693 -8.390 554 H ARG 72 H ARG 72 13.060 -23.152 -6.533 555 HA ARG 72 HA ARG 72 12.872 -21.909 -9.143 556 HB2 ARG 72 2HB ARG 72 10.945 -22.785 -7.047 557 HB3 ARG 72 3HB ARG 72 10.430 -21.520 -8.156 558 HG2 ARG 72 2HG ARG 72 11.337 -23.218 -9.961 559 HG3 ARG 72 3HG ARG 72 11.011 -24.383 -8.676 560 HD2 ARG 72 2HD ARG 72 8.876 -24.374 -9.289 561 HD3 ARG 72 3HD ARG 72 8.778 -22.696 -8.758 562 HE ARG 72 HE ARG 72 8.726 -22.050 -10.949 563 HH11 ARG 72 1HH1 ARG 72 9.898 -25.322 -10.764 564 HH12 ARG 72 2HH1 ARG 72 9.890 -25.560 -12.480 565 HH21 ARG 72 1HH2 ARG 72 8.711 -22.351 -13.210 566 HH22 ARG 72 2HH2 ARG 72 9.216 -23.869 -13.870 567 H HIS 73 H HIS 73 12.949 -20.961 -5.779 568 HA HIS 73 HA HIS 73 13.228 -18.175 -6.602 569 HB2 HIS 73 2HB HIS 73 11.409 -18.817 -4.297 570 HB3 HIS 73 3HB HIS 73 11.538 -17.322 -5.218 571 HD1 HIS 73 HD1 HIS 73 10.356 -17.265 -7.550 572 HD2 HIS 73 HD2 HIS 73 9.668 -20.711 -5.333 573 HE1 HIS 73 HE1 HIS 73 8.411 -18.404 -8.665 574 HA PRO 74 HA PRO 74 16.270 -19.522 -3.372 575 HB2 PRO 74 2HB PRO 74 18.423 -18.435 -4.620 576 HB3 PRO 74 3HB PRO 74 17.827 -20.062 -4.974 577 HG2 PRO 74 2HG PRO 74 17.367 -17.509 -6.468 578 HG3 PRO 74 3HG PRO 74 17.734 -19.124 -7.100 579 HD2 PRO 74 2HD PRO 74 15.225 -18.106 -7.074 580 HD3 PRO 74 3HD PRO 74 15.554 -19.841 -6.888 581 H MET 75 H MET 75 16.162 -16.449 -5.171 582 HA MET 75 HA MET 75 17.237 -14.940 -2.982 583 HB2 MET 75 2HB MET 75 17.278 -13.160 -4.418 584 HB3 MET 75 3HB MET 75 17.224 -14.467 -5.593 585 HG2 MET 75 2HG MET 75 14.876 -12.849 -4.631 586 HG3 MET 75 3HG MET 75 15.688 -12.687 -6.186 587 HE1 MET 75 3HE MET 75 12.614 -12.982 -6.222 588 HE2 MET 75 1HE MET 75 11.942 -14.606 -6.072 589 HE3 MET 75 2HE MET 75 12.624 -13.801 -4.659 590 H LEU 76 H LEU 76 14.289 -16.334 -3.455 591 HA LEU 76 HA LEU 76 12.681 -14.193 -2.332 592 HB2 LEU 76 2HB LEU 76 11.656 -15.543 -4.024 593 HB3 LEU 76 3HB LEU 76 12.041 -17.022 -3.144 594 HG LEU 76 HG LEU 76 10.487 -16.157 -1.322 595 HD11 LEU 76 1HD1 LEU 76 10.314 -13.857 -1.919 596 HD12 LEU 76 2HD1 LEU 76 8.732 -14.592 -2.172 597 HD13 LEU 76 3HD1 LEU 76 9.780 -14.260 -3.551 598 HD21 LEU 76 3HD2 LEU 76 8.454 -16.854 -2.617 599 HD22 LEU 76 1HD2 LEU 76 9.806 -17.984 -2.682 600 HD23 LEU 76 2HD2 LEU 76 9.477 -16.925 -4.053 601 HA PRO 77 HA PRO 77 13.741 -15.612 1.784 602 HB2 PRO 77 2HB PRO 77 12.431 -13.613 3.071 603 HB3 PRO 77 3HB PRO 77 14.019 -13.396 2.326 604 HG2 PRO 77 2HG PRO 77 11.316 -12.664 1.270 605 HG3 PRO 77 3HG PRO 77 12.824 -11.733 1.225 606 HD2 PRO 77 2HD PRO 77 11.907 -13.125 -0.909 607 HD3 PRO 77 3HD PRO 77 13.639 -12.903 -0.587 608 H VAL 78 H VAL 78 12.690 -17.299 2.614 609 HA VAL 78 HA VAL 78 9.760 -17.130 2.898 610 HB VAL 78 HB VAL 78 11.341 -19.677 2.542 611 HG11 VAL 78 1HG1 VAL 78 8.471 -19.007 2.924 612 HG12 VAL 78 2HG1 VAL 78 8.877 -20.354 1.859 613 HG13 VAL 78 3HG1 VAL 78 9.408 -20.368 3.541 614 HG21 VAL 78 3HG2 VAL 78 10.540 -17.732 0.586 615 HG22 VAL 78 1HG2 VAL 78 11.451 -19.226 0.369 616 HG23 VAL 78 2HG2 VAL 78 9.689 -19.252 0.316 617 H ILE 79 H ILE 79 8.850 -18.314 4.710 618 HA ILE 79 HA ILE 79 10.748 -18.638 6.941 619 HB ILE 79 HB ILE 79 7.922 -17.657 7.286 620 HG12 ILE 79 2HG1 ILE 79 10.443 -15.989 7.140 621 HG13 ILE 79 3HG1 ILE 79 9.200 -16.054 5.895 622 HG21 ILE 79 1HG2 ILE 79 8.584 -17.096 9.490 623 HG22 ILE 79 2HG2 ILE 79 9.170 -18.732 9.192 624 HG23 ILE 79 3HG2 ILE 79 10.287 -17.369 9.122 625 HD11 ILE 79 3HD1 ILE 79 7.986 -15.432 8.399 626 HD12 ILE 79 1HD1 ILE 79 9.346 -14.346 8.117 627 HD13 ILE 79 2HD1 ILE 79 8.055 -14.471 6.922 628 H ILE 80 H ILE 80 10.546 -20.434 8.165 629 HA ILE 80 HA ILE 80 8.436 -22.330 7.396 630 HB ILE 80 HB ILE 80 11.201 -22.725 8.498 631 HG12 ILE 80 2HG1 ILE 80 10.629 -22.609 5.996 632 HG13 ILE 80 3HG1 ILE 80 11.575 -23.989 6.545 633 HG21 ILE 80 1HG2 ILE 80 10.319 -25.250 8.376 634 HG22 ILE 80 2HG2 ILE 80 10.277 -24.285 9.851 635 HG23 ILE 80 3HG2 ILE 80 8.826 -24.445 8.861 636 HD11 ILE 80 3HD1 ILE 80 10.014 -25.436 5.910 637 HD12 ILE 80 1HD1 ILE 80 8.712 -24.479 6.617 638 HD13 ILE 80 2HD1 ILE 80 9.315 -24.094 5.005 639 H MET 81 H MET 81 6.757 -21.864 8.740 640 HA MET 81 HA MET 81 7.246 -21.559 11.598 641 HB2 MET 81 2HB MET 81 5.667 -19.997 11.006 642 HB3 MET 81 3HB MET 81 4.956 -21.025 9.768 643 HG2 MET 81 2HG MET 81 3.947 -22.408 11.539 644 HG3 MET 81 3HG MET 81 4.603 -21.301 12.743 645 HE1 MET 81 3HE MET 81 1.363 -20.848 9.714 646 HE2 MET 81 1HE MET 81 2.581 -19.647 9.287 647 HE3 MET 81 2HE MET 81 3.028 -21.348 9.417 648 H THR 82 H THR 82 7.128 -23.208 12.961 649 HA THR 82 HA THR 82 5.132 -25.217 12.841 650 HB THR 82 HB THR 82 6.576 -26.049 11.006 651 HG1 THR 82 HG1 THR 82 6.242 -28.057 11.674 652 HG21 THR 82 3HG2 THR 82 8.723 -25.201 11.876 653 HG22 THR 82 1HG2 THR 82 8.793 -26.922 11.497 654 HG23 THR 82 2HG2 THR 82 8.652 -26.394 13.174 655 H ALA 83 H ALA 83 8.283 -24.202 14.029 656 HA ALA 83 HA ALA 83 9.273 -24.327 16.076 657 HB1 ALA 83 1HB ALA 83 7.543 -24.476 18.025 658 HB2 ALA 83 2HB ALA 83 7.624 -23.028 17.020 659 HB3 ALA 83 3HB ALA 83 6.365 -24.230 16.735 660 H HIS 84 H HIS 84 8.890 -25.713 18.350 661 HA HIS 84 HA HIS 84 9.236 -27.741 19.320 662 HB2 HIS 84 2HB HIS 84 7.741 -29.253 17.264 663 HB3 HIS 84 3HB HIS 84 7.575 -29.266 19.018 664 HD1 HIS 84 HD1 HIS 84 5.239 -29.002 16.822 665 HD2 HIS 84 HD2 HIS 84 6.820 -25.968 19.179 666 HE1 HIS 84 HE1 HIS 84 3.448 -27.240 16.941 667 H SER 85 H SER 85 9.462 -30.312 18.207 668 HA SER 85 HA SER 85 12.137 -30.353 17.424 669 HB2 SER 85 2HB SER 85 10.084 -32.268 17.929 670 HB3 SER 85 3HB SER 85 10.859 -32.690 16.402 671 HG SER 85 HG SER 85 12.895 -32.373 17.641 672 H ASP 86 H ASP 86 9.245 -29.951 15.560 673 HA ASP 86 HA ASP 86 10.019 -30.755 13.035 674 HB2 ASP 86 2HB ASP 86 8.404 -28.280 13.685 675 HB3 ASP 86 3HB ASP 86 8.393 -29.168 12.164 676 H LEU 87 H LEU 87 10.954 -27.901 14.827 677 HA LEU 87 HA LEU 87 12.149 -26.547 12.611 678 HB2 LEU 87 2HB LEU 87 11.569 -25.981 15.317 679 HB3 LEU 87 3HB LEU 87 13.304 -25.755 15.103 680 HG LEU 87 HG LEU 87 12.822 -24.188 13.241 681 HD11 LEU 87 1HD1 LEU 87 10.100 -25.121 13.767 682 HD12 LEU 87 2HD1 LEU 87 10.798 -24.407 12.314 683 HD13 LEU 87 3HD1 LEU 87 10.252 -23.369 13.630 684 HD21 LEU 87 3HD2 LEU 87 11.740 -23.641 15.990 685 HD22 LEU 87 1HD2 LEU 87 11.812 -22.394 14.744 686 HD23 LEU 87 2HD2 LEU 87 13.295 -23.169 15.301 687 H ASP 88 H ASP 88 13.256 -28.805 15.052 688 HA ASP 88 HA ASP 88 16.004 -28.514 14.832 689 HB2 ASP 88 2HB ASP 88 14.379 -30.174 16.228 690 HB3 ASP 88 3HB ASP 88 15.021 -31.296 15.032 691 H ALA 89 H ALA 89 13.741 -29.884 12.600 692 HA ALA 89 HA ALA 89 15.787 -31.217 11.032 693 HB1 ALA 89 1HB ALA 89 13.498 -32.161 11.305 694 HB2 ALA 89 2HB ALA 89 12.880 -30.814 10.348 695 HB3 ALA 89 3HB ALA 89 14.001 -31.968 9.626 696 H ALA 90 H ALA 90 14.001 -28.223 11.030 697 HA ALA 90 HA ALA 90 14.811 -27.520 8.339 698 HB1 ALA 90 1HB ALA 90 13.007 -26.404 10.379 699 HB2 ALA 90 2HB ALA 90 13.808 -25.224 9.341 700 HB3 ALA 90 3HB ALA 90 12.824 -26.501 8.627 701 H VAL 91 H VAL 91 16.003 -27.157 11.540 702 HA VAL 91 HA VAL 91 17.428 -24.805 11.485 703 HB VAL 91 HB VAL 91 18.159 -27.455 12.722 704 HG11 VAL 91 1HG1 VAL 91 20.252 -26.489 12.605 705 HG12 VAL 91 2HG1 VAL 91 19.619 -24.848 12.742 706 HG13 VAL 91 3HG1 VAL 91 19.669 -25.896 14.160 707 HG21 VAL 91 3HG2 VAL 91 17.539 -25.158 14.422 708 HG22 VAL 91 1HG2 VAL 91 16.206 -25.658 13.381 709 HG23 VAL 91 2HG2 VAL 91 16.940 -26.816 14.491 710 H SER 92 H SER 92 18.646 -28.005 10.480 711 HA SER 92 HA SER 92 20.950 -26.765 9.219 712 HB2 SER 92 2HB SER 92 21.345 -28.818 10.440 713 HB3 SER 92 3HB SER 92 20.116 -29.661 9.497 714 HG SER 92 HG SER 92 22.712 -28.933 8.804 715 H ALA 93 H ALA 93 18.092 -28.630 8.272 716 HA ALA 93 HA ALA 93 18.641 -28.797 5.527 717 HB1 ALA 93 1HB ALA 93 15.960 -28.714 6.907 718 HB2 ALA 93 2HB ALA 93 16.255 -29.258 5.255 719 HB3 ALA 93 3HB ALA 93 16.934 -30.156 6.613 720 H TYR 94 H TYR 94 16.310 -26.607 7.117 721 HA TYR 94 HA TYR 94 15.821 -24.983 4.920 722 HB2 TYR 94 2HB TYR 94 14.721 -25.079 7.307 723 HB3 TYR 94 3HB TYR 94 15.869 -23.794 7.667 724 HD1 TYR 94 HD1 TYR 94 13.951 -24.460 4.541 725 HD2 TYR 94 HD2 TYR 94 14.587 -21.860 7.849 726 HE1 TYR 94 HE1 TYR 94 12.419 -22.818 3.538 727 HE2 TYR 94 HE2 TYR 94 13.056 -20.211 6.855 728 HH TYR 94 HH TYR 94 10.907 -20.618 4.937 729 H GLN 95 H GLN 95 18.600 -25.170 6.915 730 HA GLN 95 HA GLN 95 19.586 -22.532 6.526 731 HB2 GLN 95 2HB GLN 95 20.510 -25.006 7.752 732 HB3 GLN 95 3HB GLN 95 21.807 -24.148 6.931 733 HG2 GLN 95 2HG GLN 95 19.974 -22.762 8.854 734 HG3 GLN 95 3HG GLN 95 21.405 -23.638 9.396 735 HE21 GLN 95 1HE2 GLN 95 20.228 -20.700 8.398 736 HE22 GLN 95 2HE2 GLN 95 21.723 -19.916 8.030 737 H GLN 96 H GLN 96 18.965 -24.774 4.281 738 HA GLN 96 HA GLN 96 21.366 -24.753 2.734 739 HB2 GLN 96 2HB GLN 96 18.532 -25.597 2.208 740 HB3 GLN 96 3HB GLN 96 19.707 -25.542 0.900 741 HG2 GLN 96 2HG GLN 96 20.721 -26.938 3.230 742 HG3 GLN 96 3HG GLN 96 19.239 -27.657 2.603 743 HE21 GLN 96 1HE2 GLN 96 20.340 -29.497 1.920 744 HE22 GLN 96 2HE2 GLN 96 21.364 -29.489 0.529 745 H GLY 97 H GLY 97 20.165 -22.141 3.563 746 HA2 GLY 97 2HA GLY 97 20.690 -20.131 2.315 747 HA3 GLY 97 3HA GLY 97 20.107 -20.942 0.868 748 H ALA 98 H ALA 98 18.468 -21.013 3.973 749 HA ALA 98 HA ALA 98 16.249 -19.518 2.744 750 HB1 ALA 98 1HB ALA 98 14.735 -20.815 3.887 751 HB2 ALA 98 2HB ALA 98 16.026 -21.981 3.593 752 HB3 ALA 98 3HB ALA 98 15.877 -21.209 5.172 753 H PHE 99 H PHE 99 14.882 -18.288 4.329 754 HA PHE 99 HA PHE 99 16.612 -16.600 5.923 755 HB2 PHE 99 2HB PHE 99 15.025 -15.428 4.592 756 HB3 PHE 99 3HB PHE 99 13.700 -16.441 5.155 757 HD1 PHE 99 HD1 PHE 99 15.993 -13.717 6.061 758 HD2 PHE 99 HD2 PHE 99 12.585 -15.993 7.212 759 HE1 PHE 99 HE1 PHE 99 15.498 -12.077 7.827 760 HE2 PHE 99 HE2 PHE 99 12.084 -14.356 8.979 761 HZ PHE 99 HZ PHE 99 13.541 -12.394 9.288 762 H ASP 100 H ASP 100 16.309 -16.135 8.132 763 HA ASP 100 HA ASP 100 15.994 -18.255 9.841 764 HB2 ASP 100 2HB ASP 100 16.980 -16.044 10.438 765 HB3 ASP 100 3HB ASP 100 15.351 -15.378 10.518 766 H TYR 101 H TYR 101 14.269 -19.562 9.842 767 HA TYR 101 HA TYR 101 11.634 -18.836 9.263 768 HB2 TYR 101 2HB TYR 101 11.090 -21.015 10.531 769 HB3 TYR 101 3HB TYR 101 12.108 -21.126 9.100 770 HD1 TYR 101 HD1 TYR 101 12.788 -20.290 12.684 771 HD2 TYR 101 HD2 TYR 101 13.689 -22.782 9.355 772 HE1 TYR 101 HE1 TYR 101 14.519 -21.425 14.011 773 HE2 TYR 101 HE2 TYR 101 15.423 -23.925 10.673 774 HH TYR 101 HH TYR 101 15.724 -23.525 14.054 775 H LEU 102 H LEU 102 9.856 -19.486 11.036 776 HA LEU 102 HA LEU 102 10.478 -18.134 13.561 777 HB2 LEU 102 2HB LEU 102 9.485 -16.343 12.522 778 HB3 LEU 102 3HB LEU 102 8.433 -17.361 11.541 779 HG LEU 102 HG LEU 102 7.190 -17.861 13.723 780 HD11 LEU 102 1HD1 LEU 102 9.268 -16.217 14.731 781 HD12 LEU 102 2HD1 LEU 102 7.936 -16.970 15.607 782 HD13 LEU 102 3HD1 LEU 102 7.743 -15.354 14.928 783 HD21 LEU 102 3HD2 LEU 102 7.126 -15.497 11.997 784 HD22 LEU 102 1HD2 LEU 102 6.318 -15.286 13.550 785 HD23 LEU 102 2HD2 LEU 102 5.829 -16.594 12.473 786 HA PRO 103 HA PRO 103 8.384 -21.912 14.793 787 HB2 PRO 103 2HB PRO 103 9.020 -21.679 17.422 788 HB3 PRO 103 3HB PRO 103 10.156 -22.281 16.209 789 HG2 PRO 103 2HG PRO 103 9.937 -19.546 17.407 790 HG3 PRO 103 3HG PRO 103 11.389 -20.509 17.074 791 HD2 PRO 103 2HD PRO 103 10.566 -18.505 15.450 792 HD3 PRO 103 3HD PRO 103 11.402 -19.947 14.839 793 H LYS 104 H LYS 104 6.379 -22.284 15.596 794 HA LYS 104 HA LYS 104 4.864 -19.959 16.511 795 HB2 LYS 104 2HB LYS 104 2.891 -21.510 16.185 796 HB3 LYS 104 3HB LYS 104 3.793 -21.105 14.731 797 HG2 LYS 104 2HG LYS 104 4.723 -23.223 14.563 798 HG3 LYS 104 3HG LYS 104 4.412 -23.601 16.259 799 HD2 LYS 104 2HD LYS 104 2.194 -23.146 14.280 800 HD3 LYS 104 3HD LYS 104 2.923 -24.734 14.531 801 HE2 LYS 104 2HE LYS 104 2.344 -23.677 17.082 802 HE3 LYS 104 3HE LYS 104 0.922 -23.399 16.079 803 HZ1 LYS 104 3HZ LYS 104 0.397 -25.505 16.463 804 HZ2 LYS 104 1HZ LYS 104 1.890 -25.831 17.189 805 HZ3 LYS 104 2HZ LYS 104 1.718 -25.965 15.511 806 HA PRO 105 HA PRO 105 2.788 -19.704 17.442 807 HB2 PRO 105 2HB PRO 105 2.437 -18.072 19.583 808 HB3 PRO 105 3HB PRO 105 1.498 -19.550 19.337 809 HG2 PRO 105 2HG PRO 105 3.886 -19.090 21.083 810 HG3 PRO 105 3HG PRO 105 2.396 -19.984 21.438 811 HD2 PRO 105 2HD PRO 105 4.702 -21.217 20.735 812 HD3 PRO 105 3HD PRO 105 3.105 -21.863 20.307 813 H PHE 106 H PHE 106 2.928 -17.263 17.279 814 HA PHE 106 HA PHE 106 5.616 -16.219 17.767 815 HB2 PHE 106 2HB PHE 106 5.831 -15.402 15.476 816 HB3 PHE 106 3HB PHE 106 5.648 -17.153 15.485 817 HD1 PHE 106 HD2 PHE 106 3.887 -13.969 14.857 818 HD2 PHE 106 HD1 PHE 106 3.852 -18.199 14.379 819 HE1 PHE 106 HE2 PHE 106 1.997 -13.774 13.294 820 HE2 PHE 106 HE1 PHE 106 1.962 -18.010 12.815 821 HZ PHE 106 HZ PHE 106 1.031 -15.795 12.271 822 H ASP 107 H ASP 107 5.710 -14.027 18.091 823 HA ASP 107 HA ASP 107 3.253 -12.730 18.777 824 HB2 ASP 107 2HB ASP 107 6.123 -11.792 18.741 825 HB3 ASP 107 3HB ASP 107 4.785 -10.765 19.249 826 H ILE 108 H ILE 108 1.937 -11.921 17.288 827 HA ILE 108 HA ILE 108 2.394 -11.444 14.646 828 HB ILE 108 HB ILE 108 0.495 -10.137 16.564 829 HG12 ILE 108 2HG1 ILE 108 -0.260 -11.659 14.105 830 HG13 ILE 108 3HG1 ILE 108 0.375 -12.549 15.485 831 HG21 ILE 108 1HG2 ILE 108 -0.611 -9.163 14.492 832 HG22 ILE 108 2HG2 ILE 108 0.849 -8.360 15.067 833 HG23 ILE 108 3HG2 ILE 108 0.927 -9.439 13.675 834 HD11 ILE 108 3HD1 ILE 108 -2.254 -11.683 15.041 835 HD12 ILE 108 1HD1 ILE 108 -1.599 -12.479 16.472 836 HD13 ILE 108 2HD1 ILE 108 -1.625 -10.718 16.376 837 H ASP 109 H ASP 109 3.128 -9.317 17.341 838 HA ASP 109 HA ASP 109 3.675 -6.976 15.889 839 HB2 ASP 109 2HB ASP 109 3.749 -7.755 18.570 840 HB3 ASP 109 3HB ASP 109 5.406 -7.287 18.197 841 H GLU 110 H GLU 110 5.778 -9.655 16.877 842 HA GLU 110 HA GLU 110 8.097 -8.497 15.627 843 HB2 GLU 110 2HB GLU 110 7.636 -10.497 17.532 844 HB3 GLU 110 3HB GLU 110 8.318 -11.336 16.147 845 HG2 GLU 110 2HG GLU 110 9.993 -9.235 16.302 846 HG3 GLU 110 3HG GLU 110 9.557 -9.420 17.999 847 H ALA 111 H ALA 111 5.598 -10.762 14.755 848 HA ALA 111 HA ALA 111 6.895 -11.954 12.539 849 HB1 ALA 111 1HB ALA 111 5.114 -13.247 12.932 850 HB2 ALA 111 2HB ALA 111 4.209 -11.933 13.684 851 HB3 ALA 111 3HB ALA 111 4.231 -12.096 11.929 852 H VAL 112 H VAL 112 4.373 -9.427 12.642 853 HA VAL 112 HA VAL 112 4.250 -8.798 9.973 854 HB VAL 112 HB VAL 112 3.962 -7.033 12.394 855 HG11 VAL 112 1HG1 VAL 112 3.760 -6.308 9.492 856 HG12 VAL 112 2HG1 VAL 112 2.815 -5.457 10.715 857 HG13 VAL 112 3HG1 VAL 112 4.577 -5.450 10.798 858 HG21 VAL 112 3HG2 VAL 112 1.590 -7.158 11.851 859 HG22 VAL 112 1HG2 VAL 112 1.955 -8.133 10.428 860 HG23 VAL 112 2HG2 VAL 112 2.270 -8.774 12.041 861 H ALA 113 H ALA 113 6.692 -7.870 12.311 862 HA ALA 113 HA ALA 113 7.996 -6.046 10.479 863 HB1 ALA 113 1HB ALA 113 9.361 -5.433 12.235 864 HB2 ALA 113 2HB ALA 113 7.883 -5.907 13.075 865 HB3 ALA 113 3HB ALA 113 9.254 -7.014 13.009 866 H LEU 114 H LEU 114 8.374 -9.341 11.610 867 HA LEU 114 HA LEU 114 10.982 -9.838 10.740 868 HB2 LEU 114 2HB LEU 114 9.854 -11.394 12.166 869 HB3 LEU 114 3HB LEU 114 8.595 -11.659 10.962 870 HG LEU 114 HG LEU 114 10.505 -12.589 9.495 871 HD11 LEU 114 1HD1 LEU 114 12.375 -11.843 10.815 872 HD12 LEU 114 2HD1 LEU 114 12.331 -13.605 10.813 873 HD13 LEU 114 3HD1 LEU 114 11.772 -12.712 12.227 874 HD21 LEU 114 3HD2 LEU 114 10.392 -14.773 10.989 875 HD22 LEU 114 1HD2 LEU 114 8.996 -14.194 10.078 876 HD23 LEU 114 2HD2 LEU 114 9.127 -13.851 11.804 877 H VAL 115 H VAL 115 7.903 -10.014 9.018 878 HA VAL 115 HA VAL 115 8.989 -11.091 6.617 879 HB VAL 115 HB VAL 115 6.627 -11.345 7.092 880 HG11 VAL 115 1HG1 VAL 115 6.426 -8.348 6.809 881 HG12 VAL 115 2HG1 VAL 115 5.086 -9.466 7.072 882 HG13 VAL 115 3HG1 VAL 115 6.309 -9.243 8.324 883 HG21 VAL 115 3HG2 VAL 115 7.709 -10.481 4.654 884 HG22 VAL 115 1HG2 VAL 115 6.228 -11.403 4.907 885 HG23 VAL 115 2HG2 VAL 115 6.167 -9.643 4.823 886 H GLU 116 H GLU 116 8.335 -7.827 7.779 887 HA GLU 116 HA GLU 116 8.809 -6.482 5.343 888 HB2 GLU 116 2HB GLU 116 8.040 -5.764 7.921 889 HB3 GLU 116 3HB GLU 116 9.578 -4.945 7.686 890 HG2 GLU 116 2HG GLU 116 8.313 -4.416 5.337 891 HG3 GLU 116 3HG GLU 116 6.967 -4.436 6.475 892 H ARG 117 H ARG 117 10.919 -7.869 7.696 893 HA ARG 117 HA ARG 117 13.243 -6.351 7.154 894 HB2 ARG 117 2HB ARG 117 13.343 -7.557 9.145 895 HB3 ARG 117 3HB ARG 117 12.722 -9.025 8.402 896 HG2 ARG 117 2HG ARG 117 14.759 -9.721 7.763 897 HG3 ARG 117 3HG ARG 117 15.302 -8.092 7.355 898 HD2 ARG 117 2HD ARG 117 14.869 -8.504 10.214 899 HD3 ARG 117 3HD ARG 117 16.111 -9.551 9.531 900 HE ARG 117 HE ARG 117 16.485 -6.879 8.676 901 HH11 ARG 117 1HH1 ARG 117 16.852 -8.951 11.450 902 HH12 ARG 117 2HH1 ARG 117 18.147 -8.025 12.134 903 HH21 ARG 117 1HH2 ARG 117 18.189 -5.652 9.566 904 HH22 ARG 117 2HH2 ARG 117 18.906 -6.148 11.062 905 H ALA 118 H ALA 118 11.815 -9.181 5.659 906 HA ALA 118 HA ALA 118 14.115 -9.663 3.970 907 HB1 ALA 118 1HB ALA 118 13.251 -11.700 3.851 908 HB2 ALA 118 2HB ALA 118 11.870 -11.163 4.808 909 HB3 ALA 118 3HB ALA 118 11.815 -11.063 3.049 910 H ILE 119 H ILE 119 10.895 -8.259 3.681 911 HA ILE 119 HA ILE 119 11.005 -7.909 0.852 912 HB ILE 119 HB ILE 119 9.277 -6.425 2.834 913 HG12 ILE 119 2HG1 ILE 119 8.509 -8.880 1.259 914 HG13 ILE 119 3HG1 ILE 119 9.173 -8.981 2.887 915 HG21 ILE 119 1HG2 ILE 119 8.684 -7.008 -0.053 916 HG22 ILE 119 2HG2 ILE 119 7.883 -5.865 1.024 917 HG23 ILE 119 3HG2 ILE 119 9.523 -5.545 0.462 918 HD11 ILE 119 3HD1 ILE 119 6.906 -7.143 2.565 919 HD12 ILE 119 1HD1 ILE 119 6.546 -8.852 2.324 920 HD13 ILE 119 2HD1 ILE 119 7.260 -8.307 3.842 921 H SER 120 H SER 120 11.256 -5.600 3.560 922 HA SER 120 HA SER 120 11.879 -3.345 2.050 923 HB2 SER 120 2HB SER 120 11.345 -3.590 4.590 924 HB3 SER 120 3HB SER 120 13.089 -3.779 4.767 925 HG SER 120 HG SER 120 12.100 -1.561 4.877 926 H HIS 121 H HIS 121 13.818 -6.073 2.888 927 HA HIS 121 HA HIS 121 16.390 -5.035 2.767 928 HB2 HIS 121 2HB HIS 121 15.735 -7.392 3.375 929 HB3 HIS 121 3HB HIS 121 15.556 -7.717 1.654 930 HD1 HIS 121 HD1 HIS 121 17.662 -8.168 0.327 931 HD2 HIS 121 HD2 HIS 121 18.428 -6.917 4.214 932 HE1 HIS 121 HE1 HIS 121 20.127 -8.523 0.673 933 H TYR 122 H TYR 122 14.079 -5.533 0.244 934 HA TYR 122 HA TYR 122 16.123 -4.994 -1.799 935 HB2 TYR 122 2HB TYR 122 13.286 -5.863 -2.329 936 HB3 TYR 122 3HB TYR 122 14.672 -5.954 -3.409 937 HD1 TYR 122 HD1 TYR 122 16.665 -7.451 -2.499 938 HD2 TYR 122 HD2 TYR 122 12.610 -7.792 -1.255 939 HE1 TYR 122 HE1 TYR 122 17.091 -9.759 -1.763 940 HE2 TYR 122 HE2 TYR 122 13.025 -10.100 -0.515 941 HH TYR 122 HH TYR 122 15.893 -11.798 -1.314 942 H GLN 123 H GLN 123 12.681 -4.200 -1.282 943 HA GLN 123 HA GLN 123 12.695 -1.906 -2.896 944 HB2 GLN 123 2HB GLN 123 10.870 -3.098 -0.897 945 HB3 GLN 123 3HB GLN 123 10.673 -1.374 -1.183 946 HG2 GLN 123 2HG GLN 123 9.349 -1.970 -2.864 947 HG3 GLN 123 3HG GLN 123 10.834 -2.376 -3.723 948 HE21 GLN 123 1HE2 GLN 123 8.307 -3.556 -4.171 949 HE22 GLN 123 2HE2 GLN 123 8.427 -5.232 -3.772 950 H GLU 124 H GLU 124 12.745 -2.146 0.664 951 HA GLU 124 HA GLU 124 13.515 -0.734 2.272 952 HB2 GLU 124 2HB GLU 124 15.513 -0.900 0.409 953 HB3 GLU 124 3HB GLU 124 15.257 0.837 0.500 954 HG2 GLU 124 2HG GLU 124 16.207 0.990 2.509 955 HG3 GLU 124 3HG GLU 124 15.384 -0.447 3.111 Start of MODEL 18 1 H1 MET 1 H MET 1 1.750 -0.012 -0.640 2 HA MET 1 HA MET 1 -0.046 -0.219 -2.963 3 HB2 MET 1 2HB MET 1 1.774 0.529 -4.339 4 HB3 MET 1 3HB MET 1 1.624 1.638 -2.983 5 HG2 MET 1 2HG MET 1 3.424 -0.076 -1.972 6 HG3 MET 1 3HG MET 1 3.800 -0.214 -3.688 7 HE1 MET 1 3HE MET 1 6.658 2.160 -2.796 8 HE2 MET 1 1HE MET 1 6.087 0.876 -1.731 9 HE3 MET 1 2HE MET 1 6.147 0.614 -3.474 10 H GLN 2 H GLN 2 0.613 -2.389 -1.106 11 HA GLN 2 HA GLN 2 1.195 -4.588 -1.131 12 HB2 GLN 2 2HB GLN 2 0.938 -4.147 -4.109 13 HB3 GLN 2 3HB GLN 2 1.093 -5.726 -3.351 14 HG2 GLN 2 2HG GLN 2 -1.141 -5.711 -3.415 15 HG3 GLN 2 3HG GLN 2 -0.993 -4.716 -1.967 16 HE21 GLN 2 1HE2 GLN 2 -1.484 -2.561 -2.060 17 HE22 GLN 2 2HE2 GLN 2 -2.229 -1.818 -3.430 18 H ARG 3 H ARG 3 3.319 -2.666 -1.031 19 HA ARG 3 HA ARG 3 5.458 -3.181 -2.729 20 HB2 ARG 3 2HB ARG 3 6.890 -2.412 -0.817 21 HB3 ARG 3 3HB ARG 3 5.569 -1.325 -1.226 22 HG2 ARG 3 2HG ARG 3 5.448 -1.353 1.062 23 HG3 ARG 3 3HG ARG 3 4.295 -2.620 0.640 24 HD2 ARG 3 2HD ARG 3 5.447 -3.999 1.948 25 HD3 ARG 3 3HD ARG 3 6.771 -3.899 0.787 26 HE ARG 3 HE ARG 3 7.925 -2.603 2.276 27 HH11 ARG 3 1HH1 ARG 3 4.571 -2.682 3.205 28 HH12 ARG 3 2HH1 ARG 3 4.832 -1.859 4.706 29 HH21 ARG 3 1HH2 ARG 3 8.282 -1.518 4.251 30 HH22 ARG 3 2HH2 ARG 3 6.943 -1.196 5.300 31 H GLY 4 H GLY 4 4.082 -5.146 -0.264 32 HA2 GLY 4 2HA GLY 4 6.050 -7.224 -0.842 33 HA3 GLY 4 3HA GLY 4 5.910 -6.715 0.835 34 H ILE 5 H ILE 5 4.444 -8.475 -1.762 35 HA ILE 5 HA ILE 5 1.995 -9.028 -0.352 36 HB ILE 5 HB ILE 5 3.183 -10.146 -2.885 37 HG12 ILE 5 2HG1 ILE 5 0.671 -8.525 -2.437 38 HG13 ILE 5 3HG1 ILE 5 2.227 -7.817 -2.855 39 HG21 ILE 5 1HG2 ILE 5 0.959 -11.262 -3.188 40 HG22 ILE 5 2HG2 ILE 5 1.973 -11.958 -1.925 41 HG23 ILE 5 3HG2 ILE 5 0.624 -10.908 -1.493 42 HD11 ILE 5 3HD1 ILE 5 1.818 -9.797 -4.759 43 HD12 ILE 5 1HD1 ILE 5 0.244 -9.031 -4.549 44 HD13 ILE 5 2HD1 ILE 5 1.649 -8.055 -4.977 45 H VAL 6 H VAL 6 1.691 -10.546 1.132 46 HA VAL 6 HA VAL 6 3.647 -12.745 1.311 47 HB VAL 6 HB VAL 6 2.010 -11.749 3.631 48 HG11 VAL 6 1HG1 VAL 6 3.858 -12.799 4.920 49 HG12 VAL 6 2HG1 VAL 6 2.949 -13.941 3.928 50 HG13 VAL 6 3HG1 VAL 6 4.536 -13.379 3.399 51 HG21 VAL 6 3HG2 VAL 6 3.174 -9.809 3.232 52 HG22 VAL 6 1HG2 VAL 6 4.326 -10.678 4.246 53 HG23 VAL 6 2HG2 VAL 6 4.538 -10.650 2.496 54 H TRP 7 H TRP 7 2.882 -14.727 1.006 55 HA TRP 7 HA TRP 7 -0.023 -15.122 0.997 56 HB2 TRP 7 2HB TRP 7 2.260 -16.635 -0.259 57 HB3 TRP 7 3HB TRP 7 0.640 -17.318 -0.152 58 HD1 TRP 7 HD1 TRP 7 -0.016 -13.831 -0.697 59 HE1 TRP 7 HE1 TRP 7 -0.368 -13.288 -3.189 60 HE3 TRP 7 HE3 TRP 7 1.908 -18.105 -2.740 61 HZ2 TRP 7 HZ2 TRP 7 0.107 -14.510 -5.689 62 HZ3 TRP 7 HZ3 TRP 7 1.921 -18.339 -5.189 63 HH2 TRP 7 HH2 TRP 7 1.038 -16.578 -6.631 64 H VAL 8 H VAL 8 -1.035 -16.587 2.290 65 HA VAL 8 HA VAL 8 0.624 -17.854 4.365 66 HB VAL 8 HB VAL 8 -2.327 -17.232 4.511 67 HG11 VAL 8 1HG1 VAL 8 -1.466 -17.416 7.060 68 HG12 VAL 8 2HG1 VAL 8 -2.141 -18.770 6.151 69 HG13 VAL 8 3HG1 VAL 8 -0.393 -18.577 6.280 70 HG21 VAL 8 3HG2 VAL 8 -1.105 -15.155 4.368 71 HG22 VAL 8 1HG2 VAL 8 -1.656 -15.394 6.026 72 HG23 VAL 8 2HG2 VAL 8 0.029 -15.698 5.605 73 H VAL 9 H VAL 9 0.216 -19.991 4.990 74 HA VAL 9 HA VAL 9 -1.818 -21.602 3.845 75 HB VAL 9 HB VAL 9 -0.317 -21.297 1.857 76 HG11 VAL 9 1HG1 VAL 9 1.867 -21.850 1.851 77 HG12 VAL 9 2HG1 VAL 9 1.730 -21.600 3.592 78 HG13 VAL 9 3HG1 VAL 9 1.630 -23.229 2.924 79 HG21 VAL 9 3HG2 VAL 9 -0.018 -24.138 2.207 80 HG22 VAL 9 1HG2 VAL 9 -1.573 -23.595 2.840 81 HG23 VAL 9 2HG2 VAL 9 -1.132 -23.249 1.167 82 H ASP 10 H ASP 10 -2.034 -23.491 4.942 83 HA ASP 10 HA ASP 10 0.103 -24.803 6.282 84 HB2 ASP 10 2HB ASP 10 0.003 -23.069 7.904 85 HB3 ASP 10 3HB ASP 10 -1.758 -23.082 7.916 86 H ASP 11 H ASP 11 -3.114 -24.483 7.655 87 HA ASP 11 HA ASP 11 -4.471 -26.463 6.275 88 HB2 ASP 11 2HB ASP 11 -2.385 -27.605 7.737 89 HB3 ASP 11 3HB ASP 11 -3.821 -27.900 8.713 90 H ASP 12 H ASP 12 -3.822 -24.930 9.351 91 HA ASP 12 HA ASP 12 -6.565 -25.354 10.251 92 HB2 ASP 12 2HB ASP 12 -4.031 -24.842 11.535 93 HB3 ASP 12 3HB ASP 12 -5.232 -23.666 12.062 94 H SER 13 H SER 13 -7.989 -23.653 10.748 95 HA SER 13 HA SER 13 -7.816 -21.429 8.943 96 HB2 SER 13 2HB SER 13 -9.898 -22.807 10.076 97 HB3 SER 13 3HB SER 13 -9.900 -21.313 11.014 98 HG SER 13 HG SER 13 -9.959 -20.178 9.004 99 H SER 14 H SER 14 -7.830 -21.796 12.477 100 HA SER 14 HA SER 14 -7.549 -19.044 13.053 101 HB2 SER 14 2HB SER 14 -7.562 -19.685 15.240 102 HB3 SER 14 3HB SER 14 -8.094 -21.222 14.558 103 HG SER 14 HG SER 14 -6.404 -21.773 15.801 104 H ILE 15 H ILE 15 -5.326 -21.423 11.981 105 HA ILE 15 HA ILE 15 -2.961 -20.122 12.978 106 HB ILE 15 HB ILE 15 -3.367 -22.357 10.998 107 HG12 ILE 15 2HG1 ILE 15 -3.784 -22.952 13.321 108 HG13 ILE 15 3HG1 ILE 15 -2.285 -23.699 12.778 109 HG21 ILE 15 1HG2 ILE 15 -1.376 -21.766 10.154 110 HG22 ILE 15 2HG2 ILE 15 -1.000 -20.715 11.518 111 HG23 ILE 15 3HG2 ILE 15 -0.722 -22.452 11.640 112 HD11 ILE 15 3HD1 ILE 15 -2.742 -21.929 14.977 113 HD12 ILE 15 1HD1 ILE 15 -1.289 -22.833 14.549 114 HD13 ILE 15 2HD1 ILE 15 -1.561 -21.227 13.871 115 H ARG 16 H ARG 16 -4.770 -20.197 9.962 116 HA ARG 16 HA ARG 16 -2.805 -18.646 8.531 117 HB2 ARG 16 2HB ARG 16 -4.417 -18.676 6.696 118 HB3 ARG 16 3HB ARG 16 -4.196 -20.290 7.357 119 HG2 ARG 16 2HG ARG 16 -6.294 -20.279 8.392 120 HG3 ARG 16 3HG ARG 16 -6.457 -18.529 8.231 121 HD2 ARG 16 2HD ARG 16 -6.275 -19.099 5.662 122 HD3 ARG 16 3HD ARG 16 -6.848 -20.675 6.206 123 HE ARG 16 HE ARG 16 -8.410 -18.479 7.199 124 HH11 ARG 16 1HH1 ARG 16 -7.934 -20.675 4.541 125 HH12 ARG 16 2HH1 ARG 16 -9.563 -20.542 3.968 126 HH21 ARG 16 1HH2 ARG 16 -10.558 -18.294 6.455 127 HH22 ARG 16 2HH2 ARG 16 -11.055 -19.186 5.057 128 H TRP 17 H TRP 17 -5.572 -18.031 10.494 129 HA TRP 17 HA TRP 17 -6.272 -15.478 9.505 130 HB2 TRP 17 2HB TRP 17 -7.890 -16.504 10.864 131 HB3 TRP 17 3HB TRP 17 -6.720 -16.889 12.123 132 HD1 TRP 17 HD1 TRP 17 -8.838 -13.986 10.793 133 HE1 TRP 17 HE1 TRP 17 -8.951 -12.159 12.602 134 HE3 TRP 17 HE3 TRP 17 -5.486 -15.935 14.125 135 HZ2 TRP 17 HZ2 TRP 17 -7.775 -11.615 15.110 136 HZ3 TRP 17 HZ3 TRP 17 -5.037 -14.699 16.205 137 HH2 TRP 17 HH2 TRP 17 -6.158 -12.584 16.685 138 H VAL 18 H VAL 18 -4.286 -16.430 12.308 139 HA VAL 18 HA VAL 18 -3.555 -13.985 13.278 140 HB VAL 18 HB VAL 18 -1.510 -14.981 14.112 141 HG11 VAL 18 1HG1 VAL 18 -3.812 -16.929 14.104 142 HG12 VAL 18 2HG1 VAL 18 -2.449 -16.970 15.224 143 HG13 VAL 18 3HG1 VAL 18 -3.562 -15.602 15.238 144 HG21 VAL 18 3HG2 VAL 18 -0.415 -16.228 12.584 145 HG22 VAL 18 1HG2 VAL 18 -1.338 -17.551 13.297 146 HG23 VAL 18 2HG2 VAL 18 -1.902 -16.781 11.814 147 H LEU 19 H LEU 19 -2.333 -15.595 10.405 148 HA LEU 19 HA LEU 19 -0.313 -13.572 9.943 149 HB2 LEU 19 2HB LEU 19 -1.166 -16.085 8.586 150 HB3 LEU 19 3HB LEU 19 -0.231 -14.899 7.678 151 HG LEU 19 HG LEU 19 0.668 -16.187 10.253 152 HD11 LEU 19 1HD1 LEU 19 2.331 -16.994 8.190 153 HD12 LEU 19 2HD1 LEU 19 0.707 -17.137 7.520 154 HD13 LEU 19 3HD1 LEU 19 1.120 -17.977 9.014 155 HD21 LEU 19 3HD2 LEU 19 1.947 -14.316 10.214 156 HD22 LEU 19 1HD2 LEU 19 1.761 -14.091 8.474 157 HD23 LEU 19 2HD2 LEU 19 2.900 -15.288 9.091 158 H GLU 20 H GLU 20 -3.458 -14.495 8.638 159 HA GLU 20 HA GLU 20 -3.503 -12.751 6.442 160 HB2 GLU 20 2HB GLU 20 -5.201 -14.645 7.460 161 HB3 GLU 20 3HB GLU 20 -6.087 -13.161 7.778 162 HG2 GLU 20 2HG GLU 20 -5.866 -12.558 5.396 163 HG3 GLU 20 3HG GLU 20 -5.074 -14.106 5.107 164 H ARG 21 H ARG 21 -4.535 -12.299 9.799 165 HA ARG 21 HA ARG 21 -5.493 -9.637 9.368 166 HB2 ARG 21 2HB ARG 21 -5.675 -9.540 11.819 167 HB3 ARG 21 3HB ARG 21 -6.397 -11.006 11.170 168 HG2 ARG 21 2HG ARG 21 -4.967 -12.337 12.258 169 HG3 ARG 21 3HG ARG 21 -3.586 -11.291 11.924 170 HD2 ARG 21 2HD ARG 21 -5.588 -10.251 13.829 171 HD3 ARG 21 3HD ARG 21 -4.639 -11.633 14.374 172 HE ARG 21 HE ARG 21 -2.762 -9.947 13.409 173 HH11 ARG 21 1HH1 ARG 21 -5.377 -9.560 15.674 174 HH12 ARG 21 2HH1 ARG 21 -4.571 -8.335 16.596 175 HH21 ARG 21 1HH2 ARG 21 -1.690 -8.335 14.614 176 HH22 ARG 21 2HH2 ARG 21 -2.473 -7.639 15.992 177 H ALA 22 H ALA 22 -2.426 -11.059 10.035 178 HA ALA 22 HA ALA 22 -1.158 -8.825 11.232 179 HB1 ALA 22 1HB ALA 22 0.909 -10.118 10.105 180 HB2 ALA 22 2HB ALA 22 0.136 -10.638 11.603 181 HB3 ALA 22 3HB ALA 22 -0.302 -11.400 10.074 182 H LEU 23 H LEU 23 -1.603 -9.860 7.895 183 HA LEU 23 HA LEU 23 0.058 -7.730 6.857 184 HB2 LEU 23 2HB LEU 23 -1.800 -9.477 5.272 185 HB3 LEU 23 3HB LEU 23 -0.356 -8.633 4.718 186 HG LEU 23 HG LEU 23 -0.231 -10.890 6.702 187 HD11 LEU 23 1HD1 LEU 23 -1.291 -11.863 4.818 188 HD12 LEU 23 2HD1 LEU 23 0.416 -12.290 4.718 189 HD13 LEU 23 3HD1 LEU 23 -0.233 -11.009 3.695 190 HD21 LEU 23 3HD2 LEU 23 1.827 -9.855 4.760 191 HD22 LEU 23 1HD2 LEU 23 2.066 -11.004 6.077 192 HD23 LEU 23 2HD2 LEU 23 1.700 -9.317 6.436 193 H ALA 24 H ALA 24 -3.377 -8.482 7.128 194 HA ALA 24 HA ALA 24 -4.486 -6.514 5.551 195 HB1 ALA 24 1HB ALA 24 -6.378 -6.550 7.282 196 HB2 ALA 24 2HB ALA 24 -5.976 -8.061 6.465 197 HB3 ALA 24 3HB ALA 24 -5.412 -7.772 8.111 198 H GLY 25 H GLY 25 -3.487 -6.252 8.958 199 HA2 GLY 25 2HA GLY 25 -4.082 -3.410 8.982 200 HA3 GLY 25 3HA GLY 25 -3.469 -4.361 10.327 201 H ALA 26 H ALA 26 -1.571 -5.165 7.791 202 HA ALA 26 HA ALA 26 0.506 -3.287 8.644 203 HB1 ALA 26 1HB ALA 26 2.069 -4.842 7.549 204 HB2 ALA 26 2HB ALA 26 1.083 -5.634 8.779 205 HB3 ALA 26 3HB ALA 26 0.704 -5.852 7.070 206 H GLY 27 H GLY 27 -1.560 -3.979 5.989 207 HA2 GLY 27 2HA GLY 27 -1.923 -2.502 4.191 208 HA3 GLY 27 3HA GLY 27 -0.347 -1.785 4.491 209 H LEU 28 H LEU 28 -0.826 -5.240 4.250 210 HA LEU 28 HA LEU 28 0.364 -5.216 1.563 211 HB2 LEU 28 2HB LEU 28 1.237 -7.474 3.151 212 HB3 LEU 28 3HB LEU 28 2.178 -6.348 2.176 213 HG LEU 28 HG LEU 28 1.257 -5.740 4.979 214 HD11 LEU 28 1HD1 LEU 28 4.078 -6.438 4.392 215 HD12 LEU 28 2HD1 LEU 28 2.914 -7.757 4.518 216 HD13 LEU 28 3HD1 LEU 28 3.139 -6.648 5.870 217 HD21 LEU 28 3HD2 LEU 28 3.664 -4.478 3.925 218 HD22 LEU 28 1HD2 LEU 28 2.273 -3.765 4.742 219 HD23 LEU 28 2HD2 LEU 28 2.209 -4.083 3.009 220 H THR 29 H THR 29 -0.316 -6.816 0.186 221 HA THR 29 HA THR 29 -2.848 -7.871 0.448 222 HB THR 29 HB THR 29 -0.691 -9.234 -1.160 223 HG1 THR 29 HG1 THR 29 -2.220 -6.941 -1.896 224 HG21 THR 29 3HG2 THR 29 -2.748 -9.359 -2.750 225 HG22 THR 29 1HG2 THR 29 -3.678 -9.057 -1.283 226 HG23 THR 29 2HG2 THR 29 -2.637 -10.477 -1.391 227 H CYS 30 H CYS 30 -3.607 -10.052 0.725 228 HA CYS 30 HA CYS 30 -1.831 -11.907 2.101 229 HB2 CYS 30 2HB CYS 30 -3.556 -12.222 3.920 230 HB3 CYS 30 3HB CYS 30 -2.675 -10.700 3.977 231 HG CYS 30 HG CYS 30 -4.693 -9.095 3.644 232 H THR 31 H THR 31 -2.091 -13.793 1.128 233 HA THR 31 HA THR 31 -4.798 -14.576 0.266 234 HB THR 31 HB THR 31 -2.200 -15.020 -1.212 235 HG1 THR 31 HG1 THR 31 -2.995 -13.581 -2.607 236 HG21 THR 31 3HG2 THR 31 -3.529 -17.053 -1.319 237 HG22 THR 31 1HG2 THR 31 -3.563 -16.227 -2.877 238 HG23 THR 31 2HG2 THR 31 -4.951 -16.124 -1.794 239 H THR 32 H THR 32 -5.439 -16.203 1.512 240 HA THR 32 HA THR 32 -3.451 -18.147 2.461 241 HB THR 32 HB THR 32 -4.911 -18.705 4.240 242 HG1 THR 32 HG1 THR 32 -7.071 -17.609 4.254 243 HG21 THR 32 3HG2 THR 32 -4.559 -16.823 5.398 244 HG22 THR 32 1HG2 THR 32 -5.677 -15.906 4.390 245 HG23 THR 32 2HG2 THR 32 -4.000 -16.111 3.885 246 H PHE 33 H PHE 33 -3.437 -20.156 1.688 247 HA PHE 33 HA PHE 33 -5.598 -20.969 -0.111 248 HB2 PHE 33 2HB PHE 33 -2.819 -22.090 0.301 249 HB3 PHE 33 3HB PHE 33 -4.000 -22.748 -0.827 250 HD1 PHE 33 HD1 PHE 33 -2.018 -19.724 -0.033 251 HD2 PHE 33 HD2 PHE 33 -4.249 -21.846 -2.971 252 HE1 PHE 33 HE1 PHE 33 -1.239 -18.150 -1.756 253 HE2 PHE 33 HE2 PHE 33 -3.473 -20.276 -4.699 254 HZ PHE 33 HZ PHE 33 -1.965 -18.426 -4.093 255 H GLU 34 H GLU 34 -3.523 -23.260 1.501 256 HA GLU 34 HA GLU 34 -5.048 -23.992 3.684 257 HB2 GLU 34 2HB GLU 34 -6.160 -26.077 2.680 258 HB3 GLU 34 3HB GLU 34 -6.931 -24.523 2.395 259 HG2 GLU 34 2HG GLU 34 -5.838 -24.441 0.175 260 HG3 GLU 34 3HG GLU 34 -5.209 -26.062 0.467 261 H ASN 35 H ASN 35 -3.413 -25.453 0.885 262 HA ASN 35 HA ASN 35 -1.693 -26.917 2.775 263 HB2 ASN 35 2HB ASN 35 -3.477 -28.041 0.912 264 HB3 ASN 35 3HB ASN 35 -1.870 -28.256 0.225 265 HD21 ASN 35 1HD2 ASN 35 -3.665 -28.654 3.249 266 HD22 ASN 35 2HD2 ASN 35 -2.843 -30.089 3.750 267 H GLY 36 H GLY 36 0.467 -27.342 2.046 268 HA2 GLY 36 2HA GLY 36 1.696 -25.147 0.794 269 HA3 GLY 36 3HA GLY 36 2.465 -26.692 1.124 270 H ASN 37 H ASN 37 0.785 -28.321 -0.472 271 HA ASN 37 HA ASN 37 2.077 -28.138 -2.947 272 HB2 ASN 37 2HB ASN 37 0.770 -30.113 -1.778 273 HB3 ASN 37 3HB ASN 37 -0.575 -29.504 -2.738 274 HD21 ASN 37 1HD2 ASN 37 0.513 -32.043 -3.055 275 HD22 ASN 37 2HD2 ASN 37 1.254 -32.137 -4.614 276 H GLU 38 H GLU 38 -0.668 -26.490 -1.738 277 HA GLU 38 HA GLU 38 -1.737 -25.852 -4.360 278 HB2 GLU 38 2HB GLU 38 -2.639 -24.424 -1.906 279 HB3 GLU 38 3HB GLU 38 -3.576 -24.996 -3.279 280 HG2 GLU 38 2HG GLU 38 -2.469 -26.653 -1.027 281 HG3 GLU 38 3HG GLU 38 -4.161 -26.268 -1.337 282 H VAL 39 H VAL 39 0.622 -24.640 -2.249 283 HA VAL 39 HA VAL 39 0.417 -21.891 -3.172 284 HB VAL 39 HB VAL 39 2.589 -23.086 -1.454 285 HG11 VAL 39 1HG1 VAL 39 2.851 -20.809 -2.601 286 HG12 VAL 39 2HG1 VAL 39 1.619 -20.247 -1.470 287 HG13 VAL 39 3HG1 VAL 39 3.145 -20.893 -0.864 288 HG21 VAL 39 3HG2 VAL 39 1.079 -23.365 0.156 289 HG22 VAL 39 1HG2 VAL 39 0.839 -21.617 0.157 290 HG23 VAL 39 2HG2 VAL 39 -0.190 -22.649 -0.838 291 H LEU 40 H LEU 40 2.578 -24.668 -3.518 292 HA LEU 40 HA LEU 40 4.679 -23.542 -4.887 293 HB2 LEU 40 2HB LEU 40 5.046 -25.743 -4.421 294 HB3 LEU 40 3HB LEU 40 3.409 -26.222 -4.868 295 HG LEU 40 HG LEU 40 3.988 -26.135 -7.217 296 HD11 LEU 40 1HD1 LEU 40 5.632 -24.841 -7.942 297 HD12 LEU 40 2HD1 LEU 40 6.801 -25.901 -7.155 298 HD13 LEU 40 3HD1 LEU 40 6.139 -24.518 -6.284 299 HD21 LEU 40 3HD2 LEU 40 5.131 -28.117 -7.284 300 HD22 LEU 40 1HD2 LEU 40 4.639 -28.098 -5.591 301 HD23 LEU 40 2HD2 LEU 40 6.279 -27.626 -6.037 302 H ALA 41 H ALA 41 1.567 -24.624 -6.181 303 HA ALA 41 HA ALA 41 2.243 -23.958 -8.890 304 HB1 ALA 41 1HB ALA 41 -0.517 -24.125 -8.767 305 HB2 ALA 41 2HB ALA 41 0.598 -25.433 -9.164 306 HB3 ALA 41 3HB ALA 41 0.036 -25.227 -7.505 307 H ALA 42 H ALA 42 0.847 -22.303 -6.184 308 HA ALA 42 HA ALA 42 -0.506 -20.249 -7.575 309 HB1 ALA 42 1HB ALA 42 0.714 -20.140 -4.819 310 HB2 ALA 42 2HB ALA 42 -0.528 -19.065 -5.463 311 HB3 ALA 42 3HB ALA 42 -0.889 -20.771 -5.200 312 H LEU 43 H LEU 43 2.819 -20.607 -6.469 313 HA LEU 43 HA LEU 43 3.702 -17.988 -6.850 314 HB2 LEU 43 2HB LEU 43 5.445 -20.335 -7.479 315 HB3 LEU 43 3HB LEU 43 5.867 -18.814 -6.695 316 HG LEU 43 HG LEU 43 4.457 -21.191 -5.508 317 HD11 LEU 43 1HD1 LEU 43 6.342 -20.666 -3.780 318 HD12 LEU 43 2HD1 LEU 43 7.084 -19.827 -5.143 319 HD13 LEU 43 3HD1 LEU 43 6.713 -21.547 -5.262 320 HD21 LEU 43 3HD2 LEU 43 4.781 -19.332 -3.490 321 HD22 LEU 43 1HD2 LEU 43 3.261 -19.781 -4.264 322 HD23 LEU 43 2HD2 LEU 43 4.164 -18.380 -4.841 323 H ALA 44 H ALA 44 3.353 -20.650 -9.129 324 HA ALA 44 HA ALA 44 4.695 -19.476 -11.306 325 HB1 ALA 44 1HB ALA 44 4.347 -21.708 -11.653 326 HB2 ALA 44 2HB ALA 44 2.714 -21.672 -10.987 327 HB3 ALA 44 3HB ALA 44 3.020 -21.042 -12.606 328 H SER 45 H SER 45 1.793 -18.624 -9.804 329 HA SER 45 HA SER 45 0.410 -17.621 -12.104 330 HB2 SER 45 2HB SER 45 -0.741 -18.315 -9.999 331 HB3 SER 45 3HB SER 45 -0.027 -16.919 -9.192 332 HG SER 45 HG SER 45 -1.244 -15.576 -10.418 333 H LYS 46 H LYS 46 1.530 -15.799 -9.259 334 HA LYS 46 HA LYS 46 2.490 -13.698 -11.088 335 HB2 LYS 46 2HB LYS 46 1.817 -12.059 -9.297 336 HB3 LYS 46 3HB LYS 46 0.481 -12.853 -10.122 337 HG2 LYS 46 2HG LYS 46 -0.326 -13.477 -8.163 338 HG3 LYS 46 3HG LYS 46 1.122 -14.449 -7.891 339 HD2 LYS 46 2HD LYS 46 1.463 -13.110 -6.126 340 HD3 LYS 46 3HD LYS 46 2.002 -11.921 -7.315 341 HE2 LYS 46 2HE LYS 46 -0.761 -12.195 -6.140 342 HE3 LYS 46 3HE LYS 46 0.395 -10.898 -5.841 343 HZ1 LYS 46 3HZ LYS 46 -1.327 -11.356 -8.146 344 HZ2 LYS 46 1HZ LYS 46 0.214 -10.735 -8.466 345 HZ3 LYS 46 2HZ LYS 46 -0.835 -9.903 -7.433 346 H THR 47 H THR 47 3.198 -15.817 -8.563 347 HA THR 47 HA THR 47 5.052 -16.179 -7.293 348 HB THR 47 HB THR 47 6.800 -14.173 -8.493 349 HG1 THR 47 HG1 THR 47 5.917 -14.358 -10.429 350 HG21 THR 47 3HG2 THR 47 7.169 -16.520 -7.273 351 HG22 THR 47 1HG2 THR 47 8.318 -15.872 -8.444 352 HG23 THR 47 2HG2 THR 47 7.139 -17.086 -8.943 353 HA PRO 48 HA PRO 48 4.297 -12.746 -4.466 354 HB2 PRO 48 2HB PRO 48 4.891 -14.170 -2.232 355 HB3 PRO 48 3HB PRO 48 3.327 -14.273 -3.049 356 HG2 PRO 48 2HG PRO 48 5.677 -16.120 -3.218 357 HG3 PRO 48 3HG PRO 48 3.953 -16.512 -3.088 358 HD2 PRO 48 2HD PRO 48 5.294 -16.601 -5.439 359 HD3 PRO 48 3HD PRO 48 3.576 -16.166 -5.335 360 H ASP 49 H ASP 49 5.692 -12.139 -2.379 361 HA ASP 49 HA ASP 49 8.501 -12.093 -3.267 362 HB2 ASP 49 2HB ASP 49 6.897 -10.049 -1.725 363 HB3 ASP 49 3HB ASP 49 8.646 -9.965 -1.919 364 H VAL 50 H VAL 50 6.430 -13.302 -0.941 365 HA VAL 50 HA VAL 50 8.483 -14.482 0.577 366 HB VAL 50 HB VAL 50 8.720 -12.158 1.439 367 HG11 VAL 50 1HG1 VAL 50 6.056 -11.974 1.314 368 HG12 VAL 50 2HG1 VAL 50 6.230 -12.410 3.015 369 HG13 VAL 50 3HG1 VAL 50 7.036 -10.973 2.385 370 HG21 VAL 50 3HG2 VAL 50 7.770 -13.451 3.853 371 HG22 VAL 50 1HG2 VAL 50 8.689 -14.554 2.829 372 HG23 VAL 50 2HG2 VAL 50 9.414 -13.039 3.367 373 H LEU 51 H LEU 51 7.706 -16.074 1.928 374 HA LEU 51 HA LEU 51 4.809 -16.203 2.363 375 HB2 LEU 51 2HB LEU 51 6.129 -17.709 0.441 376 HB3 LEU 51 3HB LEU 51 5.948 -18.809 1.805 377 HG LEU 51 HG LEU 51 3.497 -17.363 1.121 378 HD11 LEU 51 1HD1 LEU 51 4.539 -17.656 -1.123 379 HD12 LEU 51 2HD1 LEU 51 3.019 -18.525 -0.912 380 HD13 LEU 51 3HD1 LEU 51 4.550 -19.397 -0.836 381 HD21 LEU 51 3HD2 LEU 51 3.992 -19.434 2.654 382 HD22 LEU 51 1HD2 LEU 51 3.827 -20.325 1.140 383 HD23 LEU 51 2HD2 LEU 51 2.492 -19.334 1.730 384 H LEU 52 H LEU 52 4.226 -17.931 3.955 385 HA LEU 52 HA LEU 52 6.391 -18.511 5.848 386 HB2 LEU 52 2HB LEU 52 3.747 -17.753 6.959 387 HB3 LEU 52 3HB LEU 52 5.358 -17.570 7.651 388 HG LEU 52 HG LEU 52 5.456 -15.804 5.579 389 HD11 LEU 52 1HD1 LEU 52 3.311 -15.696 4.829 390 HD12 LEU 52 2HD1 LEU 52 3.211 -14.513 6.134 391 HD13 LEU 52 3HD1 LEU 52 2.623 -16.156 6.386 392 HD21 LEU 52 3HD2 LEU 52 4.565 -14.240 7.624 393 HD22 LEU 52 1HD2 LEU 52 6.217 -14.833 7.450 394 HD23 LEU 52 2HD2 LEU 52 5.074 -15.695 8.481 395 H SER 53 H SER 53 5.667 -20.444 4.230 396 HA SER 53 HA SER 53 3.425 -21.972 4.701 397 HB2 SER 53 2HB SER 53 5.640 -23.755 4.406 398 HB3 SER 53 3HB SER 53 4.451 -23.274 3.195 399 HG SER 53 HG SER 53 6.880 -21.951 3.828 400 H ASP 54 H ASP 54 2.796 -23.482 6.178 401 HA ASP 54 HA ASP 54 4.441 -23.671 8.611 402 HB2 ASP 54 2HB ASP 54 1.987 -22.695 8.550 403 HB3 ASP 54 3HB ASP 54 1.542 -24.399 8.591 404 H ILE 55 H ILE 55 4.419 -25.704 9.775 405 HA ILE 55 HA ILE 55 4.018 -28.016 7.990 406 HB ILE 55 HB ILE 55 6.138 -27.669 10.114 407 HG12 ILE 55 2HG1 ILE 55 6.667 -28.123 7.199 408 HG13 ILE 55 3HG1 ILE 55 6.285 -26.502 7.768 409 HG21 ILE 55 1HG2 ILE 55 5.853 -29.918 10.215 410 HG22 ILE 55 2HG2 ILE 55 5.166 -30.016 8.595 411 HG23 ILE 55 3HG2 ILE 55 6.909 -29.857 8.804 412 HD11 ILE 55 3HD1 ILE 55 8.564 -28.226 8.708 413 HD12 ILE 55 1HD1 ILE 55 8.676 -26.825 7.643 414 HD13 ILE 55 2HD1 ILE 55 8.174 -26.620 9.322 415 H ARG 56 H ARG 56 2.165 -28.920 8.666 416 HA ARG 56 HA ARG 56 2.028 -30.393 11.025 417 HB2 ARG 56 2HB ARG 56 0.174 -29.048 12.157 418 HB3 ARG 56 3HB ARG 56 1.817 -28.445 12.329 419 HG2 ARG 56 2HG ARG 56 1.344 -26.884 10.426 420 HG3 ARG 56 3HG ARG 56 -0.343 -27.393 10.523 421 HD2 ARG 56 2HD ARG 56 1.110 -26.373 12.938 422 HD3 ARG 56 3HD ARG 56 0.384 -25.261 11.778 423 HE ARG 56 HE ARG 56 -1.629 -26.985 12.360 424 HH11 ARG 56 1HH1 ARG 56 0.496 -25.011 14.285 425 HH12 ARG 56 2HH1 ARG 56 -0.658 -24.778 15.556 426 HH21 ARG 56 1HH2 ARG 56 -3.157 -26.686 14.026 427 HH22 ARG 56 2HH2 ARG 56 -2.736 -25.732 15.408 428 H MET 57 H MET 57 1.456 -30.827 8.343 429 HA MET 57 HA MET 57 -1.416 -31.439 8.487 430 HB2 MET 57 2HB MET 57 -1.252 -31.147 5.872 431 HB3 MET 57 3HB MET 57 -1.551 -29.765 6.918 432 HG2 MET 57 2HG MET 57 0.681 -29.025 6.744 433 HG3 MET 57 3HG MET 57 1.202 -30.542 6.013 434 HE1 MET 57 3HE MET 57 2.144 -27.997 3.972 435 HE2 MET 57 1HE MET 57 0.763 -26.901 3.940 436 HE3 MET 57 2HE MET 57 1.419 -27.447 5.483 437 HA PRO 58 HA PRO 58 -0.386 -35.545 7.336 438 HB2 PRO 58 2HB PRO 58 -2.441 -36.229 5.698 439 HB3 PRO 58 3HB PRO 58 -2.628 -36.038 7.445 440 HG2 PRO 58 2HG PRO 58 -3.292 -34.116 5.248 441 HG3 PRO 58 3HG PRO 58 -4.227 -34.524 6.699 442 HD2 PRO 58 2HD PRO 58 -2.724 -32.279 6.518 443 HD3 PRO 58 3HD PRO 58 -2.972 -33.142 8.050 444 H GLY 59 H GLY 59 0.323 -36.928 5.618 445 HA2 GLY 59 2HA GLY 59 1.305 -37.412 3.596 446 HA3 GLY 59 3HA GLY 59 0.353 -36.110 2.898 447 H MET 60 H MET 60 1.197 -33.968 2.930 448 HA MET 60 HA MET 60 4.098 -33.937 2.768 449 HB2 MET 60 2HB MET 60 1.935 -32.014 1.947 450 HB3 MET 60 3HB MET 60 3.626 -31.531 1.965 451 HG2 MET 60 2HG MET 60 3.795 -33.827 0.566 452 HG3 MET 60 3HG MET 60 2.177 -33.294 0.115 453 HE1 MET 60 3HE MET 60 1.980 -30.614 0.164 454 HE2 MET 60 1HE MET 60 3.472 -29.686 0.317 455 HE3 MET 60 2HE MET 60 2.674 -29.818 -1.250 456 H ASP 61 H ASP 61 5.337 -33.312 4.398 457 HA ASP 61 HA ASP 61 4.146 -31.890 6.648 458 HB2 ASP 61 2HB ASP 61 6.883 -33.141 6.330 459 HB3 ASP 61 3HB ASP 61 6.262 -32.418 7.811 460 H GLY 62 H GLY 62 4.502 -30.425 4.223 461 HA2 GLY 62 2HA GLY 62 5.151 -28.291 3.651 462 HA3 GLY 62 3HA GLY 62 5.831 -28.129 5.264 463 H LEU 63 H LEU 63 7.941 -29.291 5.613 464 HA LEU 63 HA LEU 63 9.940 -28.309 4.060 465 HB2 LEU 63 2HB LEU 63 10.653 -29.219 6.051 466 HB3 LEU 63 3HB LEU 63 9.753 -30.715 5.810 467 HG LEU 63 HG LEU 63 12.247 -30.940 5.737 468 HD11 LEU 63 1HD1 LEU 63 11.975 -32.743 4.450 469 HD12 LEU 63 2HD1 LEU 63 11.484 -31.785 3.054 470 HD13 LEU 63 3HD1 LEU 63 10.300 -32.214 4.288 471 HD21 LEU 63 3HD2 LEU 63 12.009 -28.770 3.950 472 HD22 LEU 63 1HD2 LEU 63 12.589 -30.149 3.015 473 HD23 LEU 63 2HD2 LEU 63 13.474 -29.618 4.446 474 H ALA 64 H ALA 64 8.054 -31.197 3.475 475 HA ALA 64 HA ALA 64 9.552 -32.560 1.629 476 HB1 ALA 64 1HB ALA 64 6.917 -32.631 2.496 477 HB2 ALA 64 2HB ALA 64 6.801 -32.399 0.751 478 HB3 ALA 64 3HB ALA 64 7.699 -33.770 1.401 479 H LEU 65 H LEU 65 7.095 -30.116 0.764 480 HA LEU 65 HA LEU 65 8.275 -29.841 -1.873 481 HB2 LEU 65 2HB LEU 65 6.310 -28.945 -2.525 482 HB3 LEU 65 3HB LEU 65 5.731 -29.771 -1.079 483 HG LEU 65 HG LEU 65 6.503 -26.857 -1.161 484 HD11 LEU 65 1HD1 LEU 65 4.509 -27.597 -2.607 485 HD12 LEU 65 2HD1 LEU 65 4.274 -26.274 -1.465 486 HD13 LEU 65 3HD1 LEU 65 3.694 -27.892 -1.071 487 HD21 LEU 65 3HD2 LEU 65 5.810 -28.721 0.940 488 HD22 LEU 65 1HD2 LEU 65 4.693 -27.357 0.885 489 HD23 LEU 65 2HD2 LEU 65 6.425 -27.071 1.052 490 H LEU 66 H LEU 66 8.287 -28.206 1.170 491 HA LEU 66 HA LEU 66 8.872 -25.597 0.474 492 HB2 LEU 66 2HB LEU 66 8.656 -26.870 2.794 493 HB3 LEU 66 3HB LEU 66 10.415 -26.821 2.696 494 HG LEU 66 HG LEU 66 9.852 -24.953 3.975 495 HD11 LEU 66 1HD1 LEU 66 11.417 -24.424 2.170 496 HD12 LEU 66 2HD1 LEU 66 10.424 -23.032 2.600 497 HD13 LEU 66 3HD1 LEU 66 10.066 -23.952 1.139 498 HD21 LEU 66 3HD2 LEU 66 8.101 -23.318 2.702 499 HD22 LEU 66 1HD2 LEU 66 7.659 -24.469 3.962 500 HD23 LEU 66 2HD2 LEU 66 7.467 -24.905 2.264 501 H LYS 67 H LYS 67 11.055 -28.372 0.701 502 HA LYS 67 HA LYS 67 13.491 -27.112 0.365 503 HB2 LYS 67 2HB LYS 67 12.601 -29.732 0.431 504 HB3 LYS 67 3HB LYS 67 13.288 -29.582 -1.181 505 HG2 LYS 67 2HG LYS 67 14.939 -30.397 0.397 506 HG3 LYS 67 3HG LYS 67 15.392 -28.805 -0.218 507 HD2 LYS 67 2HD LYS 67 15.356 -27.915 1.828 508 HD3 LYS 67 3HD LYS 67 13.771 -28.610 2.176 509 HE2 LYS 67 2HE LYS 67 15.541 -29.384 3.724 510 HE3 LYS 67 3HE LYS 67 14.776 -30.697 2.831 511 HZ1 LYS 67 3HZ LYS 67 17.294 -30.720 3.017 512 HZ2 LYS 67 1HZ LYS 67 17.289 -29.450 1.899 513 HZ3 LYS 67 2HZ LYS 67 16.639 -30.953 1.475 514 H GLN 68 H GLN 68 10.968 -27.678 -1.956 515 HA GLN 68 HA GLN 68 12.564 -27.226 -4.282 516 HB2 GLN 68 2HB GLN 68 9.936 -28.074 -3.745 517 HB3 GLN 68 3HB GLN 68 9.780 -26.599 -4.690 518 HG2 GLN 68 2HG GLN 68 11.800 -28.289 -5.825 519 HG3 GLN 68 3HG GLN 68 10.295 -29.184 -5.619 520 HE21 GLN 68 1HE2 GLN 68 8.430 -27.232 -6.025 521 HE22 GLN 68 2HE2 GLN 68 8.523 -26.663 -7.654 522 H ILE 69 H ILE 69 10.524 -25.219 -2.224 523 HA ILE 69 HA ILE 69 10.325 -22.922 -3.728 524 HB ILE 69 HB ILE 69 10.782 -23.067 -0.745 525 HG12 ILE 69 2HG1 ILE 69 8.201 -23.004 -2.325 526 HG13 ILE 69 3HG1 ILE 69 8.874 -24.431 -1.545 527 HG21 ILE 69 1HG2 ILE 69 10.793 -20.846 -0.823 528 HG22 ILE 69 2HG2 ILE 69 10.428 -20.848 -2.547 529 HG23 ILE 69 3HG2 ILE 69 9.118 -20.918 -1.369 530 HD11 ILE 69 3HD1 ILE 69 7.775 -23.900 0.292 531 HD12 ILE 69 1HD1 ILE 69 8.732 -22.424 0.420 532 HD13 ILE 69 2HD1 ILE 69 7.198 -22.409 -0.452 533 H LYS 70 H LYS 70 13.105 -24.216 -2.088 534 HA LYS 70 HA LYS 70 14.650 -21.795 -2.226 535 HB2 LYS 70 2HB LYS 70 15.023 -24.531 -1.220 536 HB3 LYS 70 3HB LYS 70 16.481 -23.802 -1.881 537 HG2 LYS 70 2HG LYS 70 16.724 -22.993 0.192 538 HG3 LYS 70 3HG LYS 70 15.564 -21.776 -0.346 539 HD2 LYS 70 2HD LYS 70 14.461 -24.308 0.728 540 HD3 LYS 70 3HD LYS 70 15.227 -23.213 1.882 541 HE2 LYS 70 2HE LYS 70 13.067 -22.407 -0.061 542 HE3 LYS 70 3HE LYS 70 12.776 -22.862 1.617 543 HZ1 LYS 70 3HZ LYS 70 13.333 -20.353 0.704 544 HZ2 LYS 70 1HZ LYS 70 14.803 -20.862 1.371 545 HZ3 LYS 70 2HZ LYS 70 13.400 -20.862 2.317 546 H GLN 71 H GLN 71 14.358 -24.753 -4.120 547 HA GLN 71 HA GLN 71 16.530 -24.114 -5.875 548 HB2 GLN 71 2HB GLN 71 15.890 -26.434 -5.501 549 HB3 GLN 71 3HB GLN 71 14.284 -26.120 -6.145 550 HG2 GLN 71 2HG GLN 71 15.036 -26.745 -8.126 551 HG3 GLN 71 3HG GLN 71 16.036 -25.294 -8.144 552 HE21 GLN 71 1HE2 GLN 71 15.955 -28.717 -7.532 553 HE22 GLN 71 2HE2 GLN 71 17.665 -28.962 -7.533 554 H ARG 72 H ARG 72 12.988 -24.182 -6.285 555 HA ARG 72 HA ARG 72 12.967 -23.092 -8.874 556 HB2 ARG 72 2HB ARG 72 11.067 -24.267 -7.650 557 HB3 ARG 72 3HB ARG 72 10.775 -22.737 -6.835 558 HG2 ARG 72 2HG ARG 72 10.187 -21.662 -8.854 559 HG3 ARG 72 3HG ARG 72 10.797 -23.003 -9.826 560 HD2 ARG 72 2HD ARG 72 9.032 -24.409 -8.568 561 HD3 ARG 72 3HD ARG 72 8.312 -22.852 -8.159 562 HE ARG 72 HE ARG 72 7.595 -22.648 -10.328 563 HH11 ARG 72 1HH1 ARG 72 9.949 -25.205 -10.125 564 HH12 ARG 72 2HH1 ARG 72 9.677 -25.761 -11.744 565 HH21 ARG 72 1HH2 ARG 72 7.228 -23.370 -12.460 566 HH22 ARG 72 2HH2 ARG 72 8.129 -24.716 -13.071 567 H HIS 73 H HIS 73 12.226 -21.490 -5.771 568 HA HIS 73 HA HIS 73 12.945 -18.928 -7.036 569 HB2 HIS 73 2HB HIS 73 11.245 -19.189 -4.566 570 HB3 HIS 73 3HB HIS 73 11.378 -17.820 -5.665 571 HD1 HIS 73 HD1 HIS 73 9.841 -17.780 -7.677 572 HD2 HIS 73 HD2 HIS 73 9.642 -21.340 -5.545 573 HE1 HIS 73 HE1 HIS 73 7.870 -19.022 -8.625 574 HA PRO 74 HA PRO 74 16.190 -19.781 -3.852 575 HB2 PRO 74 2HB PRO 74 18.240 -18.852 -5.370 576 HB3 PRO 74 3HB PRO 74 17.648 -20.515 -5.469 577 HG2 PRO 74 2HG PRO 74 17.052 -18.184 -7.250 578 HG3 PRO 74 3HG PRO 74 17.403 -19.866 -7.688 579 HD2 PRO 74 2HD PRO 74 14.885 -18.872 -7.629 580 HD3 PRO 74 3HD PRO 74 15.253 -20.564 -7.240 581 H MET 75 H MET 75 14.972 -17.059 -5.515 582 HA MET 75 HA MET 75 16.479 -15.213 -3.792 583 HB2 MET 75 2HB MET 75 16.333 -14.995 -6.397 584 HB3 MET 75 3HB MET 75 14.748 -14.309 -6.065 585 HG2 MET 75 2HG MET 75 16.206 -12.870 -4.349 586 HG3 MET 75 3HG MET 75 17.438 -13.208 -5.563 587 HE1 MET 75 3HE MET 75 13.422 -12.345 -6.030 588 HE2 MET 75 1HE MET 75 14.186 -11.643 -4.603 589 HE3 MET 75 2HE MET 75 13.716 -10.607 -5.951 590 H LEU 76 H LEU 76 13.615 -16.824 -3.869 591 HA LEU 76 HA LEU 76 12.012 -14.645 -2.765 592 HB2 LEU 76 2HB LEU 76 10.969 -16.078 -4.428 593 HB3 LEU 76 3HB LEU 76 11.299 -17.497 -3.437 594 HG LEU 76 HG LEU 76 9.800 -16.408 -1.680 595 HD11 LEU 76 1HD1 LEU 76 8.049 -14.919 -2.822 596 HD12 LEU 76 2HD1 LEU 76 9.289 -14.639 -4.044 597 HD13 LEU 76 3HD1 LEU 76 9.590 -14.192 -2.365 598 HD21 LEU 76 3HD2 LEU 76 8.820 -17.472 -4.311 599 HD22 LEU 76 1HD2 LEU 76 7.718 -17.099 -2.986 600 HD23 LEU 76 2HD2 LEU 76 8.978 -18.313 -2.769 601 HA PRO 77 HA PRO 77 13.255 -16.006 1.308 602 HB2 PRO 77 2HB PRO 77 11.892 -14.076 2.645 603 HB3 PRO 77 3HB PRO 77 13.436 -13.778 1.839 604 HG2 PRO 77 2HG PRO 77 10.659 -13.191 0.888 605 HG3 PRO 77 3HG PRO 77 12.113 -12.183 0.784 606 HD2 PRO 77 2HD PRO 77 11.188 -13.627 -1.312 607 HD3 PRO 77 3HD PRO 77 12.917 -13.312 -1.058 608 H VAL 78 H VAL 78 12.312 -17.234 2.886 609 HA VAL 78 HA VAL 78 9.402 -17.375 3.056 610 HB VAL 78 HB VAL 78 11.128 -19.785 2.474 611 HG11 VAL 78 1HG1 VAL 78 8.218 -19.598 3.235 612 HG12 VAL 78 2HG1 VAL 78 8.985 -21.045 2.579 613 HG13 VAL 78 3HG1 VAL 78 9.507 -20.397 4.135 614 HG21 VAL 78 3HG2 VAL 78 9.055 -18.283 0.914 615 HG22 VAL 78 1HG2 VAL 78 10.675 -18.777 0.422 616 HG23 VAL 78 2HG2 VAL 78 9.396 -19.981 0.579 617 H ILE 79 H ILE 79 8.627 -18.250 5.006 618 HA ILE 79 HA ILE 79 10.679 -18.668 7.079 619 HB ILE 79 HB ILE 79 8.006 -17.332 7.505 620 HG12 ILE 79 2HG1 ILE 79 10.640 -15.918 7.712 621 HG13 ILE 79 3HG1 ILE 79 9.884 -16.114 6.134 622 HG21 ILE 79 1HG2 ILE 79 9.104 -18.623 9.401 623 HG22 ILE 79 2HG2 ILE 79 10.360 -17.386 9.370 624 HG23 ILE 79 3HG2 ILE 79 8.690 -16.939 9.721 625 HD11 ILE 79 3HD1 ILE 79 8.362 -14.952 8.429 626 HD12 ILE 79 1HD1 ILE 79 9.450 -13.961 7.458 627 HD13 ILE 79 2HD1 ILE 79 8.081 -14.773 6.698 628 H ILE 80 H ILE 80 10.432 -20.391 8.393 629 HA ILE 80 HA ILE 80 8.224 -22.207 7.802 630 HB ILE 80 HB ILE 80 10.672 -22.716 9.494 631 HG12 ILE 80 2HG1 ILE 80 11.064 -22.159 7.028 632 HG13 ILE 80 3HG1 ILE 80 11.719 -23.686 7.609 633 HG21 ILE 80 1HG2 ILE 80 10.032 -25.126 8.871 634 HG22 ILE 80 2HG2 ILE 80 9.085 -24.305 10.110 635 HG23 ILE 80 3HG2 ILE 80 8.454 -24.450 8.469 636 HD11 ILE 80 3HD1 ILE 80 10.237 -23.374 5.359 637 HD12 ILE 80 1HD1 ILE 80 10.428 -24.889 6.242 638 HD13 ILE 80 2HD1 ILE 80 9.011 -23.875 6.524 639 H MET 81 H MET 81 6.745 -22.899 9.287 640 HA MET 81 HA MET 81 6.873 -21.668 11.961 641 HB2 MET 81 2HB MET 81 4.417 -22.101 10.251 642 HB3 MET 81 3HB MET 81 4.406 -21.500 11.903 643 HG2 MET 81 2HG MET 81 5.801 -19.581 11.132 644 HG3 MET 81 3HG MET 81 5.571 -20.154 9.482 645 HE1 MET 81 3HE MET 81 1.789 -20.716 9.868 646 HE2 MET 81 1HE MET 81 2.258 -19.752 8.467 647 HE3 MET 81 2HE MET 81 3.255 -21.116 8.972 648 H THR 82 H THR 82 6.919 -23.098 13.556 649 HA THR 82 HA THR 82 5.229 -25.343 13.744 650 HB THR 82 HB THR 82 6.455 -26.568 12.199 651 HG1 THR 82 HG1 THR 82 6.716 -28.088 13.641 652 HG21 THR 82 3HG2 THR 82 9.181 -26.302 13.010 653 HG22 THR 82 1HG2 THR 82 8.500 -24.696 12.760 654 HG23 THR 82 2HG2 THR 82 8.443 -25.889 11.463 655 H ALA 83 H ALA 83 8.614 -24.610 14.618 656 HA ALA 83 HA ALA 83 9.545 -24.118 16.657 657 HB1 ALA 83 1HB ALA 83 8.275 -23.308 18.362 658 HB2 ALA 83 2HB ALA 83 7.099 -23.174 17.054 659 HB3 ALA 83 3HB ALA 83 7.027 -24.539 18.168 660 H HIS 84 H HIS 84 6.925 -26.461 17.293 661 HA HIS 84 HA HIS 84 8.411 -28.063 19.046 662 HB2 HIS 84 2HB HIS 84 6.645 -29.668 18.860 663 HB3 HIS 84 3HB HIS 84 5.908 -28.071 18.768 664 HD1 HIS 84 HD1 HIS 84 5.828 -31.251 17.157 665 HD2 HIS 84 HD2 HIS 84 5.500 -27.312 15.879 666 HE1 HIS 84 HE1 HIS 84 4.720 -31.366 14.903 667 H SER 85 H SER 85 8.116 -30.673 18.100 668 HA SER 85 HA SER 85 10.515 -31.229 16.930 669 HB2 SER 85 2HB SER 85 8.140 -32.687 17.528 670 HB3 SER 85 3HB SER 85 8.664 -33.147 15.908 671 HG SER 85 HG SER 85 9.611 -34.098 18.086 672 H ASP 86 H ASP 86 11.116 -29.922 15.243 673 HA ASP 86 HA ASP 86 10.641 -30.712 12.652 674 HB2 ASP 86 2HB ASP 86 8.438 -29.217 13.649 675 HB3 ASP 86 3HB ASP 86 9.270 -28.211 12.467 676 H LEU 87 H LEU 87 11.367 -28.089 14.837 677 HA LEU 87 HA LEU 87 12.801 -26.501 12.946 678 HB2 LEU 87 2HB LEU 87 12.063 -26.356 15.723 679 HB3 LEU 87 3HB LEU 87 13.757 -25.919 15.514 680 HG LEU 87 HG LEU 87 13.180 -24.121 14.043 681 HD11 LEU 87 1HD1 LEU 87 10.397 -25.252 14.182 682 HD12 LEU 87 2HD1 LEU 87 11.410 -25.019 12.757 683 HD13 LEU 87 3HD1 LEU 87 10.749 -23.622 13.606 684 HD21 LEU 87 3HD2 LEU 87 13.066 -23.480 16.316 685 HD22 LEU 87 1HD2 LEU 87 11.494 -24.250 16.531 686 HD23 LEU 87 2HD2 LEU 87 11.635 -22.797 15.541 687 H ASP 88 H ASP 88 13.712 -28.890 15.390 688 HA ASP 88 HA ASP 88 16.430 -28.682 15.439 689 HB2 ASP 88 2HB ASP 88 14.908 -30.372 16.635 690 HB3 ASP 88 3HB ASP 88 15.097 -31.373 15.197 691 H ALA 89 H ALA 89 14.453 -30.089 12.892 692 HA ALA 89 HA ALA 89 16.782 -30.926 11.375 693 HB1 ALA 89 1HB ALA 89 14.036 -31.645 11.438 694 HB2 ALA 89 2HB ALA 89 14.422 -31.086 9.810 695 HB3 ALA 89 3HB ALA 89 15.352 -32.397 10.536 696 H ALA 90 H ALA 90 14.179 -28.530 11.112 697 HA ALA 90 HA ALA 90 14.899 -27.446 8.635 698 HB1 ALA 90 1HB ALA 90 13.333 -26.468 10.971 699 HB2 ALA 90 2HB ALA 90 13.781 -25.322 9.706 700 HB3 ALA 90 3HB ALA 90 12.823 -26.748 9.305 701 H VAL 91 H VAL 91 16.415 -27.202 11.698 702 HA VAL 91 HA VAL 91 17.659 -24.698 11.510 703 HB VAL 91 HB VAL 91 18.516 -27.233 12.898 704 HG11 VAL 91 1HG1 VAL 91 19.961 -24.692 12.521 705 HG12 VAL 91 2HG1 VAL 91 19.919 -25.318 14.170 706 HG13 VAL 91 3HG1 VAL 91 20.575 -26.308 12.866 707 HG21 VAL 91 3HG2 VAL 91 17.866 -24.865 14.475 708 HG22 VAL 91 1HG2 VAL 91 16.523 -25.441 13.487 709 HG23 VAL 91 2HG2 VAL 91 17.299 -26.527 14.640 710 H SER 92 H SER 92 19.099 -27.893 10.823 711 HA SER 92 HA SER 92 21.249 -26.637 9.339 712 HB2 SER 92 2HB SER 92 22.122 -28.423 10.505 713 HB3 SER 92 3HB SER 92 20.660 -29.393 10.325 714 HG SER 92 HG SER 92 21.447 -30.213 8.559 715 H ALA 93 H ALA 93 18.202 -28.073 8.701 716 HA ALA 93 HA ALA 93 18.774 -28.768 5.958 717 HB1 ALA 93 1HB ALA 93 17.159 -30.093 7.155 718 HB2 ALA 93 2HB ALA 93 16.179 -28.664 7.488 719 HB3 ALA 93 3HB ALA 93 16.350 -29.250 5.834 720 H TYR 94 H TYR 94 16.451 -26.493 7.435 721 HA TYR 94 HA TYR 94 15.866 -25.092 5.096 722 HB2 TYR 94 2HB TYR 94 14.751 -25.038 7.464 723 HB3 TYR 94 3HB TYR 94 15.866 -23.708 7.755 724 HD1 TYR 94 HD1 TYR 94 13.936 -24.639 4.699 725 HD2 TYR 94 HD2 TYR 94 14.603 -21.763 7.763 726 HE1 TYR 94 HE1 TYR 94 12.380 -23.097 3.582 727 HE2 TYR 94 HE2 TYR 94 13.048 -20.213 6.655 728 HH TYR 94 HH TYR 94 12.236 -19.936 4.100 729 H GLN 95 H GLN 95 18.659 -25.020 7.070 730 HA GLN 95 HA GLN 95 19.537 -22.380 6.481 731 HB2 GLN 95 2HB GLN 95 20.619 -24.761 7.814 732 HB3 GLN 95 3HB GLN 95 21.835 -23.783 7.003 733 HG2 GLN 95 2HG GLN 95 19.841 -22.488 8.806 734 HG3 GLN 95 3HG GLN 95 21.240 -23.321 9.482 735 HE21 GLN 95 1HE2 GLN 95 21.216 -20.836 10.132 736 HE22 GLN 95 2HE2 GLN 95 22.282 -19.867 9.179 737 H GLN 96 H GLN 96 18.979 -24.786 4.406 738 HA GLN 96 HA GLN 96 21.370 -24.801 2.842 739 HB2 GLN 96 2HB GLN 96 18.560 -25.761 2.390 740 HB3 GLN 96 3HB GLN 96 19.735 -25.772 1.082 741 HG2 GLN 96 2HG GLN 96 20.279 -27.088 3.720 742 HG3 GLN 96 3HG GLN 96 19.436 -27.915 2.411 743 HE21 GLN 96 1HE2 GLN 96 22.328 -27.614 3.818 744 HE22 GLN 96 2HE2 GLN 96 23.368 -27.940 2.477 745 H GLY 97 H GLY 97 20.173 -22.168 3.490 746 HA2 GLY 97 2HA GLY 97 20.616 -20.247 2.089 747 HA3 GLY 97 3HA GLY 97 20.014 -21.170 0.720 748 H ALA 98 H ALA 98 18.460 -21.025 3.868 749 HA ALA 98 HA ALA 98 16.185 -19.657 2.590 750 HB1 ALA 98 1HB ALA 98 14.714 -20.876 3.888 751 HB2 ALA 98 2HB ALA 98 15.988 -22.055 3.570 752 HB3 ALA 98 3HB ALA 98 15.925 -21.222 5.123 753 H PHE 99 H PHE 99 14.748 -18.600 4.425 754 HA PHE 99 HA PHE 99 16.517 -16.707 5.785 755 HB2 PHE 99 2HB PHE 99 14.917 -15.596 4.432 756 HB3 PHE 99 3HB PHE 99 13.604 -16.614 5.015 757 HD1 PHE 99 HD2 PHE 99 15.834 -13.817 5.845 758 HD2 PHE 99 HD1 PHE 99 12.475 -16.130 7.060 759 HE1 PHE 99 HE2 PHE 99 15.298 -12.133 7.557 760 HE2 PHE 99 HE1 PHE 99 11.932 -14.450 8.773 761 HZ PHE 99 HZ PHE 99 13.345 -12.448 9.024 762 H ASP 100 H ASP 100 16.202 -16.125 7.973 763 HA ASP 100 HA ASP 100 15.964 -18.149 9.795 764 HB2 ASP 100 2HB ASP 100 16.836 -15.852 10.259 765 HB3 ASP 100 3HB ASP 100 15.172 -15.278 10.326 766 H TYR 101 H TYR 101 14.314 -19.522 9.978 767 HA TYR 101 HA TYR 101 11.633 -18.921 9.343 768 HB2 TYR 101 2HB TYR 101 11.172 -21.101 10.590 769 HB3 TYR 101 3HB TYR 101 12.265 -21.194 9.213 770 HD1 TYR 101 HD2 TYR 101 12.520 -20.500 12.884 771 HD2 TYR 101 HD1 TYR 101 14.104 -22.542 9.504 772 HE1 TYR 101 HE2 TYR 101 14.229 -21.536 14.318 773 HE2 TYR 101 HE1 TYR 101 15.816 -23.585 10.929 774 HH TYR 101 HH TYR 101 16.798 -22.583 13.657 775 H LEU 102 H LEU 102 9.871 -19.511 11.087 776 HA LEU 102 HA LEU 102 10.485 -18.195 13.633 777 HB2 LEU 102 2HB LEU 102 9.552 -16.391 12.504 778 HB3 LEU 102 3HB LEU 102 8.398 -17.406 11.641 779 HG LEU 102 HG LEU 102 7.278 -17.761 13.911 780 HD11 LEU 102 1HD1 LEU 102 9.375 -15.805 14.593 781 HD12 LEU 102 2HD1 LEU 102 8.565 -17.005 15.600 782 HD13 LEU 102 3HD1 LEU 102 7.766 -15.476 15.235 783 HD21 LEU 102 3HD2 LEU 102 7.296 -15.207 12.352 784 HD22 LEU 102 1HD2 LEU 102 6.261 -15.386 13.769 785 HD23 LEU 102 2HD2 LEU 102 6.076 -16.481 12.399 786 HA PRO 103 HA PRO 103 8.314 -21.905 14.880 787 HB2 PRO 103 2HB PRO 103 8.760 -21.569 17.537 788 HB3 PRO 103 3HB PRO 103 9.987 -22.193 16.428 789 HG2 PRO 103 2HG PRO 103 9.644 -19.422 17.508 790 HG3 PRO 103 3HG PRO 103 11.130 -20.371 17.313 791 HD2 PRO 103 2HD PRO 103 10.393 -18.440 15.563 792 HD3 PRO 103 3HD PRO 103 11.292 -19.887 15.065 793 H LYS 104 H LYS 104 6.261 -22.280 15.546 794 HA LYS 104 HA LYS 104 4.746 -19.973 16.578 795 HB2 LYS 104 2HB LYS 104 2.744 -21.170 15.607 796 HB3 LYS 104 3HB LYS 104 3.895 -20.545 14.434 797 HG2 LYS 104 2HG LYS 104 4.225 -22.562 13.579 798 HG3 LYS 104 3HG LYS 104 4.559 -23.248 15.171 799 HD2 LYS 104 2HD LYS 104 1.745 -22.661 14.333 800 HD3 LYS 104 3HD LYS 104 2.545 -24.139 13.796 801 HE2 LYS 104 2HE LYS 104 2.807 -23.558 16.664 802 HE3 LYS 104 3HE LYS 104 1.160 -23.880 16.121 803 HZ1 LYS 104 3HZ LYS 104 1.801 -25.997 16.468 804 HZ2 LYS 104 1HZ LYS 104 3.449 -25.667 16.268 805 HZ3 LYS 104 2HZ LYS 104 2.453 -25.853 14.914 806 HA PRO 105 HA PRO 105 2.481 -19.830 17.164 807 HB2 PRO 105 2HB PRO 105 1.781 -18.724 19.543 808 HB3 PRO 105 3HB PRO 105 0.882 -20.052 18.799 809 HG2 PRO 105 2HG PRO 105 2.933 -20.141 20.977 810 HG3 PRO 105 3HG PRO 105 1.393 -21.011 20.854 811 HD2 PRO 105 2HD PRO 105 3.770 -22.168 20.273 812 HD3 PRO 105 3HD PRO 105 2.265 -22.610 19.443 813 H PHE 106 H PHE 106 2.628 -17.405 17.775 814 HA PHE 106 HA PHE 106 5.061 -16.553 19.044 815 HB2 PHE 106 2HB PHE 106 5.931 -15.411 16.971 816 HB3 PHE 106 3HB PHE 106 6.064 -17.166 16.962 817 HD1 PHE 106 HD1 PHE 106 3.789 -14.437 15.849 818 HD2 PHE 106 HD2 PHE 106 5.321 -18.341 15.125 819 HE1 PHE 106 HE1 PHE 106 2.577 -14.512 13.709 820 HE2 PHE 106 HE2 PHE 106 4.113 -18.422 12.983 821 HZ PHE 106 HZ PHE 106 2.740 -16.506 12.272 822 H ASP 107 H ASP 107 5.365 -14.050 18.252 823 HA ASP 107 HA ASP 107 2.769 -12.832 18.860 824 HB2 ASP 107 2HB ASP 107 5.611 -11.880 19.172 825 HB3 ASP 107 3HB ASP 107 4.244 -10.778 19.302 826 H ILE 108 H ILE 108 1.645 -12.085 17.199 827 HA ILE 108 HA ILE 108 2.449 -11.840 14.588 828 HB ILE 108 HB ILE 108 0.304 -10.358 16.090 829 HG12 ILE 108 2HG1 ILE 108 -0.131 -12.328 13.881 830 HG13 ILE 108 3HG1 ILE 108 0.324 -12.921 15.475 831 HG21 ILE 108 1HG2 ILE 108 1.149 -10.092 13.236 832 HG22 ILE 108 2HG2 ILE 108 -0.546 -9.904 13.679 833 HG23 ILE 108 3HG2 ILE 108 0.672 -8.842 14.384 834 HD11 ILE 108 3HD1 ILE 108 -1.747 -11.067 15.874 835 HD12 ILE 108 1HD1 ILE 108 -2.230 -12.087 14.519 836 HD13 ILE 108 2HD1 ILE 108 -1.800 -12.819 16.065 837 H ASP 109 H ASP 109 2.890 -9.574 17.204 838 HA ASP 109 HA ASP 109 3.481 -7.265 15.728 839 HB2 ASP 109 2HB ASP 109 3.092 -7.109 18.099 840 HB3 ASP 109 3HB ASP 109 4.453 -8.175 18.442 841 H GLU 110 H GLU 110 5.521 -9.957 16.758 842 HA GLU 110 HA GLU 110 7.904 -8.756 15.645 843 HB2 GLU 110 2HB GLU 110 7.333 -10.825 17.505 844 HB3 GLU 110 3HB GLU 110 8.252 -11.541 16.188 845 HG2 GLU 110 2HG GLU 110 10.059 -10.825 17.257 846 HG3 GLU 110 3HG GLU 110 9.620 -9.216 16.688 847 H ALA 111 H ALA 111 5.506 -11.121 14.722 848 HA ALA 111 HA ALA 111 6.938 -12.265 12.556 849 HB1 ALA 111 1HB ALA 111 4.875 -13.288 11.927 850 HB2 ALA 111 2HB ALA 111 4.964 -13.295 13.689 851 HB3 ALA 111 3HB ALA 111 3.945 -12.116 12.862 852 H VAL 112 H VAL 112 4.364 -9.802 12.668 853 HA VAL 112 HA VAL 112 4.158 -9.239 9.977 854 HB VAL 112 HB VAL 112 3.891 -7.397 12.348 855 HG11 VAL 112 1HG1 VAL 112 3.436 -6.859 9.429 856 HG12 VAL 112 2HG1 VAL 112 2.588 -5.957 10.686 857 HG13 VAL 112 3HG1 VAL 112 4.349 -5.906 10.598 858 HG21 VAL 112 3HG2 VAL 112 2.319 -9.441 11.730 859 HG22 VAL 112 1HG2 VAL 112 1.673 -7.928 12.366 860 HG23 VAL 112 2HG2 VAL 112 1.621 -8.251 10.633 861 H ALA 113 H ALA 113 6.587 -8.162 12.273 862 HA ALA 113 HA ALA 113 7.814 -6.346 10.387 863 HB1 ALA 113 1HB ALA 113 8.126 -5.515 12.489 864 HB2 ALA 113 2HB ALA 113 8.290 -7.113 13.218 865 HB3 ALA 113 3HB ALA 113 9.629 -6.419 12.304 866 H LEU 114 H LEU 114 8.356 -9.590 11.621 867 HA LEU 114 HA LEU 114 10.953 -10.018 10.702 868 HB2 LEU 114 2HB LEU 114 9.886 -11.571 12.190 869 HB3 LEU 114 3HB LEU 114 8.644 -11.930 10.992 870 HG LEU 114 HG LEU 114 10.560 -12.839 9.553 871 HD11 LEU 114 1HD1 LEU 114 11.923 -12.773 12.240 872 HD12 LEU 114 2HD1 LEU 114 12.408 -11.886 10.796 873 HD13 LEU 114 3HD1 LEU 114 12.501 -13.647 10.822 874 HD21 LEU 114 3HD2 LEU 114 9.223 -14.023 11.889 875 HD22 LEU 114 1HD2 LEU 114 10.639 -14.898 11.306 876 HD23 LEU 114 2HD2 LEU 114 9.292 -14.575 10.214 877 H VAL 115 H VAL 115 7.856 -10.318 9.036 878 HA VAL 115 HA VAL 115 8.994 -11.381 6.631 879 HB VAL 115 HB VAL 115 6.666 -11.846 7.210 880 HG11 VAL 115 1HG1 VAL 115 6.179 -8.908 6.728 881 HG12 VAL 115 2HG1 VAL 115 4.956 -10.127 7.096 882 HG13 VAL 115 3HG1 VAL 115 6.169 -9.700 8.303 883 HG21 VAL 115 3HG2 VAL 115 7.647 -11.247 4.729 884 HG22 VAL 115 1HG2 VAL 115 6.082 -11.993 5.052 885 HG23 VAL 115 2HG2 VAL 115 6.194 -10.251 4.804 886 H GLU 116 H GLU 116 8.103 -8.189 7.805 887 HA GLU 116 HA GLU 116 8.221 -6.765 5.410 888 HB2 GLU 116 2HB GLU 116 8.446 -6.109 8.284 889 HB3 GLU 116 3HB GLU 116 9.144 -4.934 7.178 890 HG2 GLU 116 2HG GLU 116 7.030 -4.704 6.031 891 HG3 GLU 116 3HG GLU 116 6.316 -5.955 7.047 892 H ARG 117 H ARG 117 10.731 -8.178 7.294 893 HA ARG 117 HA ARG 117 12.884 -6.547 6.413 894 HB2 ARG 117 2HB ARG 117 13.150 -9.427 7.245 895 HB3 ARG 117 3HB ARG 117 14.311 -8.121 7.441 896 HG2 ARG 117 2HG ARG 117 12.066 -7.270 8.837 897 HG3 ARG 117 3HG ARG 117 12.201 -8.992 9.202 898 HD2 ARG 117 2HD ARG 117 14.377 -8.743 10.067 899 HD3 ARG 117 3HD ARG 117 14.556 -7.135 9.367 900 HE ARG 117 HE ARG 117 12.482 -6.830 11.070 901 HH11 ARG 117 1HH1 ARG 117 15.685 -8.146 11.427 902 HH12 ARG 117 2HH1 ARG 117 15.822 -7.701 13.096 903 HH21 ARG 117 1HH2 ARG 117 12.651 -6.239 13.266 904 HH22 ARG 117 2HH2 ARG 117 14.096 -6.618 14.141 905 H ALA 118 H ALA 118 11.961 -9.869 5.487 906 HA ALA 118 HA ALA 118 13.743 -10.224 3.408 907 HB1 ALA 118 1HB ALA 118 12.731 -12.197 3.447 908 HB2 ALA 118 2HB ALA 118 11.387 -11.526 4.372 909 HB3 ALA 118 3HB ALA 118 11.354 -11.479 2.610 910 H ILE 119 H ILE 119 10.606 -8.609 3.382 911 HA ILE 119 HA ILE 119 10.574 -8.203 0.549 912 HB ILE 119 HB ILE 119 8.986 -6.742 2.662 913 HG12 ILE 119 2HG1 ILE 119 8.193 -9.178 1.053 914 HG13 ILE 119 3HG1 ILE 119 8.732 -9.232 2.728 915 HG21 ILE 119 1HG2 ILE 119 7.738 -5.818 1.011 916 HG22 ILE 119 2HG2 ILE 119 9.241 -6.007 0.108 917 HG23 ILE 119 3HG2 ILE 119 7.949 -7.195 -0.071 918 HD11 ILE 119 3HD1 ILE 119 6.709 -7.360 2.756 919 HD12 ILE 119 1HD1 ILE 119 6.133 -8.589 1.631 920 HD13 ILE 119 2HD1 ILE 119 6.592 -9.042 3.273 921 H SER 120 H SER 120 11.002 -5.977 3.305 922 HA SER 120 HA SER 120 11.611 -3.690 1.860 923 HB2 SER 120 2HB SER 120 12.532 -4.583 4.597 924 HB3 SER 120 3HB SER 120 12.860 -2.976 3.947 925 HG SER 120 HG SER 120 10.353 -4.153 4.532 926 H HIS 121 H HIS 121 13.560 -6.479 2.528 927 HA HIS 121 HA HIS 121 16.127 -5.472 2.204 928 HB2 HIS 121 2HB HIS 121 15.435 -7.835 2.851 929 HB3 HIS 121 3HB HIS 121 15.227 -8.145 1.130 930 HD1 HIS 121 HD1 HIS 121 17.394 -8.166 -0.336 931 HD2 HIS 121 HD2 HIS 121 18.059 -7.797 3.748 932 HE1 HIS 121 HE1 HIS 121 19.842 -8.637 -0.008 933 H TYR 122 H TYR 122 13.626 -5.982 -0.136 934 HA TYR 122 HA TYR 122 15.507 -5.495 -2.338 935 HB2 TYR 122 2HB TYR 122 12.603 -6.270 -2.599 936 HB3 TYR 122 3HB TYR 122 13.867 -6.380 -3.819 937 HD1 TYR 122 HD1 TYR 122 15.987 -7.846 -2.888 938 HD2 TYR 122 HD2 TYR 122 11.917 -8.283 -1.729 939 HE1 TYR 122 HE1 TYR 122 16.433 -10.171 -2.223 940 HE2 TYR 122 HE2 TYR 122 12.352 -10.609 -1.060 941 HH TYR 122 HH TYR 122 15.112 -12.291 -1.944 942 H GLN 123 H GLN 123 12.545 -4.286 -0.849 943 HA GLN 123 HA GLN 123 12.669 -1.914 -2.578 944 HB2 GLN 123 2HB GLN 123 10.447 -3.161 -0.981 945 HB3 GLN 123 3HB GLN 123 10.342 -1.500 -1.550 946 HG2 GLN 123 2HG GLN 123 9.677 -2.188 -3.538 947 HG3 GLN 123 3HG GLN 123 11.132 -3.166 -3.720 948 HE21 GLN 123 1HE2 GLN 123 8.277 -3.610 -4.464 949 HE22 GLN 123 2HE2 GLN 123 7.873 -5.140 -3.772 950 H GLU 124 H GLU 124 14.616 -1.934 -0.710 951 HA GLU 124 HA GLU 124 14.056 -0.929 1.817 952 HB2 GLU 124 2HB GLU 124 16.347 -0.064 1.820 953 HB3 GLU 124 3HB GLU 124 16.282 -1.688 1.150 954 HG2 GLU 124 2HG GLU 124 16.867 -1.009 -0.932 955 HG3 GLU 124 3HG GLU 124 16.101 0.569 -0.754 Start of MODEL 19 1 H1 MET 1 H MET 1 2.748 -0.168 3.331 2 HA MET 1 HA MET 1 0.955 0.091 1.556 3 HB2 MET 1 2HB MET 1 1.664 0.480 -0.673 4 HB3 MET 1 3HB MET 1 2.471 1.692 0.313 5 HG2 MET 1 2HG MET 1 4.365 -0.171 0.347 6 HG3 MET 1 3HG MET 1 3.592 -0.604 -1.176 7 HE1 MET 1 3HE MET 1 4.439 1.987 -3.621 8 HE2 MET 1 1HE MET 1 5.137 0.394 -3.326 9 HE3 MET 1 2HE MET 1 3.404 0.647 -3.125 10 H GLN 2 H GLN 2 1.095 -1.541 -0.537 11 HA GLN 2 HA GLN 2 1.849 -4.084 0.681 12 HB2 GLN 2 2HB GLN 2 0.505 -5.074 -1.175 13 HB3 GLN 2 3HB GLN 2 -0.406 -3.986 -0.136 14 HG2 GLN 2 2HG GLN 2 -0.675 -2.423 -1.763 15 HG3 GLN 2 3HG GLN 2 0.832 -2.845 -2.574 16 HE21 GLN 2 1HE2 GLN 2 -0.807 -2.561 -4.390 17 HE22 GLN 2 2HE2 GLN 2 -1.608 -3.997 -4.920 18 H ARG 3 H ARG 3 4.065 -2.707 -0.059 19 HA ARG 3 HA ARG 3 4.962 -3.165 -2.693 20 HB2 ARG 3 2HB ARG 3 7.042 -2.397 -1.977 21 HB3 ARG 3 3HB ARG 3 5.928 -1.611 -0.866 22 HG2 ARG 3 2HG ARG 3 7.463 -4.132 -0.270 23 HG3 ARG 3 3HG ARG 3 7.932 -2.510 0.245 24 HD2 ARG 3 2HD ARG 3 5.395 -3.960 0.996 25 HD3 ARG 3 3HD ARG 3 6.792 -3.697 2.040 26 HE ARG 3 HE ARG 3 4.694 -1.855 1.508 27 HH11 ARG 3 1HH1 ARG 3 8.113 -2.063 2.132 28 HH12 ARG 3 2HH1 ARG 3 8.218 -0.473 2.812 29 HH21 ARG 3 1HH2 ARG 3 4.820 0.240 2.402 30 HH22 ARG 3 2HH2 ARG 3 6.344 0.836 2.966 31 H GLY 4 H GLY 4 4.491 -5.287 -0.082 32 HA2 GLY 4 2HA GLY 4 5.852 -7.415 -1.579 33 HA3 GLY 4 3HA GLY 4 6.250 -7.196 0.119 34 H ILE 5 H ILE 5 4.261 -8.785 -2.049 35 HA ILE 5 HA ILE 5 1.993 -9.124 -0.298 36 HB ILE 5 HB ILE 5 2.745 -10.394 -2.924 37 HG12 ILE 5 2HG1 ILE 5 0.342 -8.695 -2.281 38 HG13 ILE 5 3HG1 ILE 5 1.886 -7.977 -2.728 39 HG21 ILE 5 1HG2 ILE 5 0.418 -11.357 -2.856 40 HG22 ILE 5 2HG2 ILE 5 1.584 -12.104 -1.765 41 HG23 ILE 5 3HG2 ILE 5 0.393 -10.965 -1.137 42 HD11 ILE 5 3HD1 ILE 5 -0.157 -9.110 -4.394 43 HD12 ILE 5 1HD1 ILE 5 1.261 -8.161 -4.839 44 HD13 ILE 5 2HD1 ILE 5 1.389 -9.912 -4.668 45 H VAL 6 H VAL 6 1.505 -10.865 0.961 46 HA VAL 6 HA VAL 6 3.564 -12.966 1.172 47 HB VAL 6 HB VAL 6 1.837 -12.073 3.471 48 HG11 VAL 6 1HG1 VAL 6 4.288 -13.775 3.165 49 HG12 VAL 6 2HG1 VAL 6 3.853 -13.055 4.717 50 HG13 VAL 6 3HG1 VAL 6 2.747 -14.177 3.922 51 HG21 VAL 6 3HG2 VAL 6 4.193 -11.010 4.128 52 HG22 VAL 6 1HG2 VAL 6 4.298 -10.840 2.375 53 HG23 VAL 6 2HG2 VAL 6 2.956 -10.106 3.253 54 H TRP 7 H TRP 7 2.904 -15.042 1.145 55 HA TRP 7 HA TRP 7 0.000 -15.523 1.006 56 HB2 TRP 7 2HB TRP 7 2.305 -16.874 -0.390 57 HB3 TRP 7 3HB TRP 7 0.712 -17.618 -0.282 58 HD1 TRP 7 HD1 TRP 7 -0.119 -14.155 -0.619 59 HE1 TRP 7 HE1 TRP 7 -0.535 -13.482 -3.068 60 HE3 TRP 7 HE3 TRP 7 2.000 -18.187 -2.941 61 HZ2 TRP 7 HZ2 TRP 7 -0.033 -14.523 -5.644 62 HZ3 TRP 7 HZ3 TRP 7 1.990 -18.272 -5.400 63 HH2 TRP 7 HH2 TRP 7 0.994 -16.477 -6.721 64 H VAL 8 H VAL 8 -0.905 -16.953 2.369 65 HA VAL 8 HA VAL 8 0.889 -18.353 4.235 66 HB VAL 8 HB VAL 8 -2.002 -17.551 4.595 67 HG11 VAL 8 1HG1 VAL 8 -1.796 -19.500 5.847 68 HG12 VAL 8 2HG1 VAL 8 -0.123 -19.155 6.291 69 HG13 VAL 8 3HG1 VAL 8 -1.438 -18.230 7.017 70 HG21 VAL 8 3HG2 VAL 8 0.357 -16.545 6.157 71 HG22 VAL 8 1HG2 VAL 8 -0.165 -15.769 4.662 72 HG23 VAL 8 2HG2 VAL 8 -1.264 -15.860 6.039 73 H VAL 9 H VAL 9 0.585 -20.519 4.704 74 HA VAL 9 HA VAL 9 -1.530 -21.983 3.332 75 HB VAL 9 HB VAL 9 0.167 -22.078 1.656 76 HG11 VAL 9 1HG1 VAL 9 1.941 -21.980 3.876 77 HG12 VAL 9 2HG1 VAL 9 2.323 -23.413 2.920 78 HG13 VAL 9 3HG1 VAL 9 2.312 -21.822 2.159 79 HG21 VAL 9 3HG2 VAL 9 -1.044 -24.208 2.370 80 HG22 VAL 9 1HG2 VAL 9 0.414 -24.399 1.395 81 HG23 VAL 9 2HG2 VAL 9 0.475 -24.676 3.136 82 H ASP 10 H ASP 10 -2.301 -22.402 5.434 83 HA ASP 10 HA ASP 10 -0.737 -24.437 6.875 84 HB2 ASP 10 2HB ASP 10 -2.544 -22.607 8.399 85 HB3 ASP 10 3HB ASP 10 -1.108 -23.470 8.943 86 H ASP 11 H ASP 11 -1.897 -26.119 7.796 87 HA ASP 11 HA ASP 11 -4.456 -26.643 6.581 88 HB2 ASP 11 2HB ASP 11 -2.373 -28.235 7.395 89 HB3 ASP 11 3HB ASP 11 -3.556 -28.496 8.675 90 H ASP 12 H ASP 12 -3.581 -24.894 9.210 91 HA ASP 12 HA ASP 12 -5.963 -25.645 10.764 92 HB2 ASP 12 2HB ASP 12 -3.316 -24.489 11.491 93 HB3 ASP 12 3HB ASP 12 -4.712 -23.993 12.444 94 H SER 13 H SER 13 -7.484 -24.115 11.341 95 HA SER 13 HA SER 13 -7.772 -21.911 9.537 96 HB2 SER 13 2HB SER 13 -9.891 -22.535 10.010 97 HB3 SER 13 3HB SER 13 -9.424 -23.280 11.539 98 HG SER 13 HG SER 13 -10.023 -21.536 12.539 99 H SER 14 H SER 14 -7.337 -22.180 13.059 100 HA SER 14 HA SER 14 -7.194 -19.398 13.530 101 HB2 SER 14 2HB SER 14 -6.823 -19.948 15.732 102 HB3 SER 14 3HB SER 14 -7.482 -21.482 15.164 103 HG SER 14 HG SER 14 -5.595 -22.390 15.426 104 H ILE 15 H ILE 15 -4.934 -21.653 12.282 105 HA ILE 15 HA ILE 15 -2.601 -20.066 12.937 106 HB ILE 15 HB ILE 15 -2.873 -22.503 11.175 107 HG12 ILE 15 2HG1 ILE 15 -3.370 -22.976 13.520 108 HG13 ILE 15 3HG1 ILE 15 -1.824 -23.686 13.069 109 HG21 ILE 15 1HG2 ILE 15 -0.237 -22.160 12.144 110 HG22 ILE 15 2HG2 ILE 15 -0.806 -22.110 10.476 111 HG23 ILE 15 3HG2 ILE 15 -0.748 -20.630 11.432 112 HD11 ILE 15 3HD1 ILE 15 -1.318 -21.088 14.062 113 HD12 ILE 15 1HD1 ILE 15 -2.409 -21.898 15.186 114 HD13 ILE 15 2HD1 ILE 15 -0.868 -22.643 14.761 115 H ARG 16 H ARG 16 -4.587 -20.783 10.107 116 HA ARG 16 HA ARG 16 -2.945 -19.196 8.347 117 HB2 ARG 16 2HB ARG 16 -4.466 -19.800 6.624 118 HB3 ARG 16 3HB ARG 16 -4.271 -21.224 7.637 119 HG2 ARG 16 2HG ARG 16 -6.389 -20.682 8.767 120 HG3 ARG 16 3HG ARG 16 -6.590 -19.306 7.681 121 HD2 ARG 16 2HD ARG 16 -6.192 -21.229 5.867 122 HD3 ARG 16 3HD ARG 16 -6.886 -22.205 7.160 123 HE ARG 16 HE ARG 16 -8.499 -19.952 6.810 124 HH11 ARG 16 1HH1 ARG 16 -7.561 -22.823 5.079 125 HH12 ARG 16 2HH1 ARG 16 -9.043 -22.927 4.187 126 HH21 ARG 16 1HH2 ARG 16 -10.454 -20.078 5.642 127 HH22 ARG 16 2HH2 ARG 16 -10.688 -21.364 4.508 128 H TRP 17 H TRP 17 -5.684 -18.700 10.391 129 HA TRP 17 HA TRP 17 -6.656 -16.341 9.100 130 HB2 TRP 17 2HB TRP 17 -8.248 -17.469 10.418 131 HB3 TRP 17 3HB TRP 17 -7.145 -17.612 11.784 132 HD1 TRP 17 HD1 TRP 17 -9.356 -15.012 10.001 133 HE1 TRP 17 HE1 TRP 17 -9.871 -13.115 11.662 134 HE3 TRP 17 HE3 TRP 17 -6.358 -16.485 13.871 135 HZ2 TRP 17 HZ2 TRP 17 -9.107 -12.344 14.268 136 HZ3 TRP 17 HZ3 TRP 17 -6.306 -15.112 15.912 137 HH2 TRP 17 HH2 TRP 17 -7.653 -13.084 16.104 138 H VAL 18 H VAL 18 -4.878 -16.860 12.150 139 HA VAL 18 HA VAL 18 -4.460 -14.274 12.926 140 HB VAL 18 HB VAL 18 -2.212 -15.095 13.828 141 HG11 VAL 18 1HG1 VAL 18 -4.587 -16.787 14.575 142 HG12 VAL 18 2HG1 VAL 18 -3.248 -16.279 15.606 143 HG13 VAL 18 3HG1 VAL 18 -4.422 -15.093 15.035 144 HG21 VAL 18 3HG2 VAL 18 -2.572 -17.821 13.754 145 HG22 VAL 18 1HG2 VAL 18 -2.962 -17.322 12.108 146 HG23 VAL 18 2HG2 VAL 18 -1.397 -16.909 12.807 147 H LEU 19 H LEU 19 -2.418 -16.140 10.686 148 HA LEU 19 HA LEU 19 -0.551 -14.115 10.165 149 HB2 LEU 19 2HB LEU 19 -1.445 -16.548 8.671 150 HB3 LEU 19 3HB LEU 19 -0.299 -15.425 7.942 151 HG LEU 19 HG LEU 19 0.150 -16.834 10.570 152 HD11 LEU 19 1HD1 LEU 19 1.941 -17.925 8.885 153 HD12 LEU 19 2HD1 LEU 19 0.584 -17.686 7.784 154 HD13 LEU 19 3HD1 LEU 19 0.373 -18.645 9.249 155 HD21 LEU 19 3HD2 LEU 19 1.766 -15.316 10.777 156 HD22 LEU 19 1HD2 LEU 19 1.515 -14.720 9.136 157 HD23 LEU 19 2HD2 LEU 19 2.565 -16.109 9.418 158 H GLU 20 H GLU 20 -3.678 -14.834 8.730 159 HA GLU 20 HA GLU 20 -3.503 -13.146 6.493 160 HB2 GLU 20 2HB GLU 20 -5.393 -14.868 7.524 161 HB3 GLU 20 3HB GLU 20 -6.166 -13.299 7.695 162 HG2 GLU 20 2HG GLU 20 -5.790 -12.869 5.309 163 HG3 GLU 20 3HG GLU 20 -5.066 -14.468 5.150 164 H ARG 21 H ARG 21 -4.530 -12.534 9.816 165 HA ARG 21 HA ARG 21 -5.375 -9.854 9.336 166 HB2 ARG 21 2HB ARG 21 -4.497 -10.915 12.011 167 HB3 ARG 21 3HB ARG 21 -5.714 -9.694 11.661 168 HG2 ARG 21 2HG ARG 21 -5.912 -12.663 11.234 169 HG3 ARG 21 3HG ARG 21 -6.849 -11.660 12.344 170 HD2 ARG 21 2HD ARG 21 -6.997 -11.780 9.346 171 HD3 ARG 21 3HD ARG 21 -8.276 -12.084 10.521 172 HE ARG 21 HE ARG 21 -7.615 -9.494 10.963 173 HH11 ARG 21 1HH1 ARG 21 -8.507 -11.300 8.124 174 HH12 ARG 21 2HH1 ARG 21 -9.245 -9.946 7.335 175 HH21 ARG 21 1HH2 ARG 21 -8.584 -7.703 9.935 176 HH22 ARG 21 2HH2 ARG 21 -9.288 -7.900 8.366 177 H ALA 22 H ALA 22 -2.379 -11.350 10.435 178 HA ALA 22 HA ALA 22 -0.974 -9.157 11.334 179 HB1 ALA 22 1HB ALA 22 0.062 -11.227 11.618 180 HB2 ALA 22 2HB ALA 22 -0.090 -11.643 9.911 181 HB3 ALA 22 3HB ALA 22 1.067 -10.413 10.419 182 H LEU 23 H LEU 23 -1.479 -10.230 8.005 183 HA LEU 23 HA LEU 23 0.167 -8.121 6.920 184 HB2 LEU 23 2HB LEU 23 -1.751 -9.790 5.337 185 HB3 LEU 23 3HB LEU 23 -0.232 -9.060 4.821 186 HG LEU 23 HG LEU 23 -0.347 -11.320 6.804 187 HD11 LEU 23 1HD1 LEU 23 -0.346 -11.391 3.808 188 HD12 LEU 23 2HD1 LEU 23 -1.344 -12.301 4.940 189 HD13 LEU 23 3HD1 LEU 23 0.366 -12.693 4.761 190 HD21 LEU 23 3HD2 LEU 23 1.710 -9.988 6.734 191 HD22 LEU 23 1HD2 LEU 23 1.845 -10.296 5.002 192 HD23 LEU 23 2HD2 LEU 23 1.973 -11.631 6.147 193 H ALA 24 H ALA 24 -3.252 -8.776 7.386 194 HA ALA 24 HA ALA 24 -4.417 -6.865 5.778 195 HB1 ALA 24 1HB ALA 24 -6.186 -6.761 7.645 196 HB2 ALA 24 2HB ALA 24 -5.891 -8.309 6.852 197 HB3 ALA 24 3HB ALA 24 -5.200 -7.988 8.443 198 H GLY 25 H GLY 25 -3.177 -6.456 9.088 199 HA2 GLY 25 2HA GLY 25 -3.720 -3.604 9.012 200 HA3 GLY 25 3HA GLY 25 -3.027 -4.500 10.356 201 H ALA 26 H ALA 26 -1.142 -5.667 8.167 202 HA ALA 26 HA ALA 26 0.965 -3.761 8.655 203 HB1 ALA 26 1HB ALA 26 1.394 -6.169 8.767 204 HB2 ALA 26 2HB ALA 26 1.008 -6.316 7.052 205 HB3 ALA 26 3HB ALA 26 2.414 -5.382 7.562 206 H GLY 27 H GLY 27 -1.363 -4.233 6.234 207 HA2 GLY 27 2HA GLY 27 -1.757 -2.842 4.404 208 HA3 GLY 27 3HA GLY 27 -0.154 -2.152 4.615 209 H LEU 28 H LEU 28 -0.654 -5.599 4.439 210 HA LEU 28 HA LEU 28 0.379 -5.604 1.685 211 HB2 LEU 28 2HB LEU 28 1.246 -7.818 3.416 212 HB3 LEU 28 3HB LEU 28 2.125 -6.946 2.161 213 HG LEU 28 HG LEU 28 1.644 -5.881 4.941 214 HD11 LEU 28 1HD1 LEU 28 4.371 -6.588 4.248 215 HD12 LEU 28 2HD1 LEU 28 3.295 -7.985 4.263 216 HD13 LEU 28 3HD1 LEU 28 3.435 -6.965 5.695 217 HD21 LEU 28 3HD2 LEU 28 2.246 -3.969 3.960 218 HD22 LEU 28 1HD2 LEU 28 2.759 -4.787 2.484 219 HD23 LEU 28 2HD2 LEU 28 3.862 -4.669 3.855 220 H THR 29 H THR 29 -0.466 -7.121 0.333 221 HA THR 29 HA THR 29 -2.982 -8.153 0.754 222 HB THR 29 HB THR 29 -0.968 -9.515 -1.031 223 HG1 THR 29 HG1 THR 29 -2.559 -7.354 -1.895 224 HG21 THR 29 3HG2 THR 29 -3.945 -9.315 -0.904 225 HG22 THR 29 1HG2 THR 29 -2.927 -10.725 -1.191 226 HG23 THR 29 2HG2 THR 29 -3.160 -9.531 -2.468 227 H CYS 30 H CYS 30 -3.751 -10.334 1.028 228 HA CYS 30 HA CYS 30 -1.902 -12.195 2.319 229 HB2 CYS 30 2HB CYS 30 -3.670 -12.603 4.102 230 HB3 CYS 30 3HB CYS 30 -2.774 -11.095 4.228 231 HG CYS 30 HG CYS 30 -5.966 -11.451 3.049 232 H THR 31 H THR 31 -2.108 -14.091 1.353 233 HA THR 31 HA THR 31 -4.777 -14.918 0.416 234 HB THR 31 HB THR 31 -2.185 -15.580 -0.990 235 HG1 THR 31 HG1 THR 31 -4.157 -13.606 -1.576 236 HG21 THR 31 3HG2 THR 31 -4.876 -15.741 -2.253 237 HG22 THR 31 1HG2 THR 31 -4.410 -17.009 -1.120 238 HG23 THR 31 2HG2 THR 31 -3.429 -16.703 -2.553 239 H THR 32 H THR 32 -5.425 -16.566 1.629 240 HA THR 32 HA THR 32 -3.430 -18.476 2.632 241 HB THR 32 HB THR 32 -4.975 -19.101 4.337 242 HG1 THR 32 HG1 THR 32 -7.114 -18.357 4.343 243 HG21 THR 32 3HG2 THR 32 -4.061 -16.464 4.036 244 HG22 THR 32 1HG2 THR 32 -4.523 -17.273 5.532 245 HG23 THR 32 2HG2 THR 32 -5.716 -16.337 4.631 246 H PHE 33 H PHE 33 -3.354 -20.486 1.863 247 HA PHE 33 HA PHE 33 -5.469 -21.344 0.021 248 HB2 PHE 33 2HB PHE 33 -2.621 -22.288 0.384 249 HB3 PHE 33 3HB PHE 33 -3.774 -23.056 -0.703 250 HD1 PHE 33 HD2 PHE 33 -2.155 -19.789 0.016 251 HD2 PHE 33 HD1 PHE 33 -4.000 -22.303 -2.882 252 HE1 PHE 33 HE2 PHE 33 -1.542 -18.194 -1.754 253 HE2 PHE 33 HE1 PHE 33 -3.388 -20.712 -4.656 254 HZ PHE 33 HZ PHE 33 -2.159 -18.654 -4.093 255 H GLU 34 H GLU 34 -3.304 -23.628 1.477 256 HA GLU 34 HA GLU 34 -4.709 -24.465 3.702 257 HB2 GLU 34 2HB GLU 34 -5.846 -26.524 2.672 258 HB3 GLU 34 3HB GLU 34 -6.649 -24.970 2.492 259 HG2 GLU 34 2HG GLU 34 -5.580 -24.800 0.225 260 HG3 GLU 34 3HG GLU 34 -5.073 -26.477 0.425 261 H ASN 35 H ASN 35 -3.283 -25.890 0.765 262 HA ASN 35 HA ASN 35 -1.434 -27.382 2.508 263 HB2 ASN 35 2HB ASN 35 -1.791 -28.554 -0.134 264 HB3 ASN 35 3HB ASN 35 -1.900 -29.311 1.453 265 HD21 ASN 35 1HD2 ASN 35 -3.567 -28.770 -1.260 266 HD22 ASN 35 2HD2 ASN 35 -5.181 -28.764 -0.641 267 H GLY 36 H GLY 36 0.699 -27.723 1.698 268 HA2 GLY 36 2HA GLY 36 1.880 -25.484 0.521 269 HA3 GLY 36 3HA GLY 36 2.644 -27.059 0.680 270 H ASN 37 H ASN 37 0.850 -28.532 -0.944 271 HA ASN 37 HA ASN 37 2.004 -28.169 -3.465 272 HB2 ASN 37 2HB ASN 37 1.180 -30.322 -3.035 273 HB3 ASN 37 3HB ASN 37 -0.385 -29.717 -2.498 274 HD21 ASN 37 1HD2 ASN 37 1.675 -30.208 -5.295 275 HD22 ASN 37 2HD2 ASN 37 0.399 -30.258 -6.459 276 H GLU 38 H GLU 38 -0.631 -26.575 -1.975 277 HA GLU 38 HA GLU 38 -1.848 -25.719 -4.462 278 HB2 GLU 38 2HB GLU 38 -2.851 -26.078 -1.961 279 HB3 GLU 38 3HB GLU 38 -2.585 -24.340 -1.960 280 HG2 GLU 38 2HG GLU 38 -3.984 -24.071 -3.893 281 HG3 GLU 38 3HG GLU 38 -4.155 -25.817 -4.059 282 H VAL 39 H VAL 39 0.716 -24.736 -2.495 283 HA VAL 39 HA VAL 39 0.526 -21.915 -3.160 284 HB VAL 39 HB VAL 39 2.877 -23.264 -1.850 285 HG11 VAL 39 1HG1 VAL 39 2.560 -20.709 -2.700 286 HG12 VAL 39 2HG1 VAL 39 1.994 -20.584 -1.034 287 HG13 VAL 39 3HG1 VAL 39 3.614 -21.194 -1.373 288 HG21 VAL 39 3HG2 VAL 39 1.778 -22.645 0.319 289 HG22 VAL 39 1HG2 VAL 39 0.294 -22.361 -0.591 290 HG23 VAL 39 2HG2 VAL 39 1.009 -23.973 -0.550 291 H LEU 40 H LEU 40 2.418 -24.741 -4.070 292 HA LEU 40 HA LEU 40 4.441 -23.552 -5.538 293 HB2 LEU 40 2HB LEU 40 3.216 -26.172 -5.353 294 HB3 LEU 40 3HB LEU 40 3.766 -25.821 -6.990 295 HG LEU 40 HG LEU 40 6.008 -25.209 -5.862 296 HD11 LEU 40 1HD1 LEU 40 6.472 -26.283 -3.772 297 HD12 LEU 40 2HD1 LEU 40 4.855 -26.983 -3.718 298 HD13 LEU 40 3HD1 LEU 40 5.065 -25.240 -3.562 299 HD21 LEU 40 3HD2 LEU 40 6.725 -27.177 -6.640 300 HD22 LEU 40 1HD2 LEU 40 5.038 -27.477 -7.056 301 HD23 LEU 40 2HD2 LEU 40 5.694 -28.092 -5.539 302 H ALA 41 H ALA 41 1.397 -24.858 -6.871 303 HA ALA 41 HA ALA 41 1.734 -23.785 -9.442 304 HB1 ALA 41 1HB ALA 41 0.189 -25.582 -9.076 305 HB2 ALA 41 2HB ALA 41 -0.775 -24.590 -7.980 306 HB3 ALA 41 3HB ALA 41 -0.705 -24.194 -9.697 307 H ALA 42 H ALA 42 0.709 -22.340 -6.486 308 HA ALA 42 HA ALA 42 -0.806 -20.191 -7.534 309 HB1 ALA 42 1HB ALA 42 0.775 -20.053 -4.986 310 HB2 ALA 42 2HB ALA 42 -0.761 -19.279 -5.378 311 HB3 ALA 42 3HB ALA 42 -0.692 -21.022 -5.121 312 H LEU 43 H LEU 43 2.630 -20.610 -6.851 313 HA LEU 43 HA LEU 43 3.444 -17.953 -7.205 314 HB2 LEU 43 2HB LEU 43 5.142 -20.268 -8.049 315 HB3 LEU 43 3HB LEU 43 5.627 -18.755 -7.284 316 HG LEU 43 HG LEU 43 4.294 -21.125 -5.985 317 HD11 LEU 43 1HD1 LEU 43 6.978 -19.803 -5.632 318 HD12 LEU 43 2HD1 LEU 43 6.659 -21.412 -6.279 319 HD13 LEU 43 3HD1 LEU 43 6.335 -21.065 -4.580 320 HD21 LEU 43 3HD2 LEU 43 3.390 -19.724 -4.518 321 HD22 LEU 43 1HD2 LEU 43 4.179 -18.337 -5.270 322 HD23 LEU 43 2HD2 LEU 43 5.024 -19.268 -4.033 323 H ALA 44 H ALA 44 3.020 -20.585 -9.525 324 HA ALA 44 HA ALA 44 4.128 -19.377 -11.777 325 HB1 ALA 44 1HB ALA 44 3.547 -21.318 -12.676 326 HB2 ALA 44 2HB ALA 44 2.642 -21.709 -11.214 327 HB3 ALA 44 3HB ALA 44 1.840 -20.892 -12.556 328 H SER 45 H SER 45 1.261 -18.615 -10.066 329 HA SER 45 HA SER 45 0.040 -17.221 -12.309 330 HB2 SER 45 2HB SER 45 -0.935 -18.399 -9.934 331 HB3 SER 45 3HB SER 45 -1.241 -16.669 -9.790 332 HG SER 45 HG SER 45 -2.044 -18.387 -11.900 333 H LYS 46 H LYS 46 1.756 -16.524 -9.329 334 HA LYS 46 HA LYS 46 2.633 -13.998 -10.215 335 HB2 LYS 46 2HB LYS 46 0.245 -13.435 -9.748 336 HB3 LYS 46 3HB LYS 46 0.509 -13.882 -8.067 337 HG2 LYS 46 2HG LYS 46 2.500 -11.996 -8.920 338 HG3 LYS 46 3HG LYS 46 0.879 -11.378 -9.247 339 HD2 LYS 46 2HD LYS 46 0.865 -10.745 -7.101 340 HD3 LYS 46 3HD LYS 46 0.630 -12.454 -6.728 341 HE2 LYS 46 2HE LYS 46 2.478 -12.173 -5.473 342 HE3 LYS 46 3HE LYS 46 3.315 -12.375 -7.012 343 HZ1 LYS 46 3HZ LYS 46 4.055 -10.300 -6.916 344 HZ2 LYS 46 1HZ LYS 46 3.470 -10.211 -5.330 345 HZ3 LYS 46 2HZ LYS 46 2.511 -9.675 -6.616 346 H THR 47 H THR 47 4.583 -14.916 -9.510 347 HA THR 47 HA THR 47 5.195 -16.064 -7.102 348 HB THR 47 HB THR 47 6.934 -14.150 -8.672 349 HG1 THR 47 HG1 THR 47 7.700 -16.051 -9.635 350 HG21 THR 47 3HG2 THR 47 7.369 -15.469 -6.156 351 HG22 THR 47 1HG2 THR 47 8.430 -14.368 -7.034 352 HG23 THR 47 2HG2 THR 47 8.484 -16.099 -7.368 353 HA PRO 48 HA PRO 48 4.219 -12.714 -4.295 354 HB2 PRO 48 2HB PRO 48 4.688 -14.142 -2.034 355 HB3 PRO 48 3HB PRO 48 3.203 -14.301 -2.980 356 HG2 PRO 48 2HG PRO 48 5.638 -16.042 -2.972 357 HG3 PRO 48 3HG PRO 48 3.928 -16.510 -2.990 358 HD2 PRO 48 2HD PRO 48 5.462 -16.508 -5.221 359 HD3 PRO 48 3HD PRO 48 3.724 -16.149 -5.257 360 H ASP 49 H ASP 49 5.433 -12.207 -2.010 361 HA ASP 49 HA ASP 49 8.269 -11.884 -2.737 362 HB2 ASP 49 2HB ASP 49 6.540 -10.163 -0.946 363 HB3 ASP 49 3HB ASP 49 8.248 -9.889 -1.278 364 H VAL 50 H VAL 50 6.143 -13.367 -0.564 365 HA VAL 50 HA VAL 50 8.186 -14.681 0.852 366 HB VAL 50 HB VAL 50 8.389 -12.406 1.899 367 HG11 VAL 50 1HG1 VAL 50 5.644 -12.477 1.945 368 HG12 VAL 50 2HG1 VAL 50 6.073 -12.795 3.627 369 HG13 VAL 50 3HG1 VAL 50 6.659 -11.337 2.827 370 HG21 VAL 50 3HG2 VAL 50 7.498 -14.168 4.096 371 HG22 VAL 50 1HG2 VAL 50 8.701 -14.837 2.993 372 HG23 VAL 50 2HG2 VAL 50 9.035 -13.337 3.859 373 H LEU 51 H LEU 51 7.362 -16.150 2.477 374 HA LEU 51 HA LEU 51 4.441 -16.490 2.410 375 HB2 LEU 51 2HB LEU 51 6.472 -18.247 1.363 376 HB3 LEU 51 3HB LEU 51 5.548 -19.049 2.631 377 HG LEU 51 HG LEU 51 3.848 -17.681 0.704 378 HD11 LEU 51 1HD1 LEU 51 5.617 -19.915 -0.281 379 HD12 LEU 51 2HD1 LEU 51 5.653 -18.241 -0.834 380 HD13 LEU 51 3HD1 LEU 51 4.231 -19.239 -1.136 381 HD21 LEU 51 3HD2 LEU 51 3.599 -19.691 2.514 382 HD22 LEU 51 1HD2 LEU 51 3.738 -20.597 1.007 383 HD23 LEU 51 2HD2 LEU 51 2.471 -19.385 1.193 384 H LEU 52 H LEU 52 3.788 -18.220 4.105 385 HA LEU 52 HA LEU 52 5.471 -18.077 6.495 386 HB2 LEU 52 2HB LEU 52 2.542 -17.369 6.479 387 HB3 LEU 52 3HB LEU 52 3.596 -17.422 7.890 388 HG LEU 52 HG LEU 52 4.505 -15.600 5.781 389 HD11 LEU 52 1HD1 LEU 52 2.834 -13.872 6.339 390 HD12 LEU 52 2HD1 LEU 52 1.908 -15.085 7.222 391 HD13 LEU 52 3HD1 LEU 52 2.138 -15.247 5.481 392 HD21 LEU 52 3HD2 LEU 52 3.944 -14.578 8.456 393 HD22 LEU 52 1HD2 LEU 52 5.444 -14.570 7.528 394 HD23 LEU 52 2HD2 LEU 52 4.985 -16.003 8.450 395 H SER 53 H SER 53 5.501 -20.329 5.243 396 HA SER 53 HA SER 53 3.438 -22.152 5.428 397 HB2 SER 53 2HB SER 53 5.029 -23.829 5.062 398 HB3 SER 53 3HB SER 53 5.813 -22.395 4.398 399 HG SER 53 HG SER 53 6.774 -22.215 6.594 400 H ASP 54 H ASP 54 2.584 -23.428 6.989 401 HA ASP 54 HA ASP 54 3.480 -22.911 9.738 402 HB2 ASP 54 2HB ASP 54 1.173 -22.330 9.406 403 HB3 ASP 54 3HB ASP 54 0.838 -23.880 8.639 404 H ILE 55 H ILE 55 2.880 -25.444 7.403 405 HA ILE 55 HA ILE 55 3.444 -27.647 7.351 406 HB ILE 55 HB ILE 55 5.202 -27.021 9.725 407 HG12 ILE 55 2HG1 ILE 55 5.907 -26.974 6.783 408 HG13 ILE 55 3HG1 ILE 55 5.613 -25.539 7.759 409 HG21 ILE 55 1HG2 ILE 55 6.482 -28.940 8.325 410 HG22 ILE 55 2HG2 ILE 55 5.391 -29.265 9.671 411 HG23 ILE 55 3HG2 ILE 55 4.803 -29.381 8.012 412 HD11 ILE 55 3HD1 ILE 55 7.953 -25.810 7.602 413 HD12 ILE 55 1HD1 ILE 55 7.496 -26.287 9.237 414 HD13 ILE 55 2HD1 ILE 55 7.853 -27.519 8.025 415 H ARG 56 H ARG 56 1.140 -27.807 8.130 416 HA ARG 56 HA ARG 56 1.095 -29.501 10.505 417 HB2 ARG 56 2HB ARG 56 0.137 -26.844 10.536 418 HB3 ARG 56 3HB ARG 56 -1.280 -27.885 10.509 419 HG2 ARG 56 2HG ARG 56 -1.013 -27.906 12.730 420 HG3 ARG 56 3HG ARG 56 0.220 -29.122 12.390 421 HD2 ARG 56 2HD ARG 56 1.932 -27.712 12.857 422 HD3 ARG 56 3HD ARG 56 1.076 -26.299 12.243 423 HE ARG 56 HE ARG 56 -0.222 -27.067 14.564 424 HH11 ARG 56 1HH1 ARG 56 2.945 -25.959 13.632 425 HH12 ARG 56 2HH1 ARG 56 3.269 -25.199 15.155 426 HH21 ARG 56 1HH2 ARG 56 0.194 -26.070 16.572 427 HH22 ARG 56 2HH2 ARG 56 1.704 -25.263 16.827 428 H MET 57 H MET 57 0.833 -29.805 7.549 429 HA MET 57 HA MET 57 -1.864 -30.992 7.484 430 HB2 MET 57 2HB MET 57 -1.539 -30.832 4.940 431 HB3 MET 57 3HB MET 57 -1.877 -29.345 5.817 432 HG2 MET 57 2HG MET 57 0.965 -29.885 5.615 433 HG3 MET 57 3HG MET 57 0.183 -29.774 4.040 434 HE1 MET 57 3HE MET 57 2.178 -28.223 4.155 435 HE2 MET 57 1HE MET 57 1.562 -26.650 3.645 436 HE3 MET 57 2HE MET 57 2.324 -26.829 5.226 437 HA PRO 58 HA PRO 58 -0.125 -34.977 6.893 438 HB2 PRO 58 2HB PRO 58 -1.908 -36.112 5.190 439 HB3 PRO 58 3HB PRO 58 -2.272 -35.794 6.890 440 HG2 PRO 58 2HG PRO 58 -3.013 -34.204 4.464 441 HG3 PRO 58 3HG PRO 58 -4.003 -34.616 5.877 442 HD2 PRO 58 2HD PRO 58 -2.830 -32.194 5.576 443 HD3 PRO 58 3HD PRO 58 -3.083 -32.941 7.167 444 H GLY 59 H GLY 59 0.364 -36.628 5.050 445 HA2 GLY 59 2HA GLY 59 1.503 -37.124 3.117 446 HA3 GLY 59 3HA GLY 59 0.781 -35.684 2.414 447 H MET 60 H MET 60 1.888 -33.704 2.527 448 HA MET 60 HA MET 60 4.698 -33.902 2.342 449 HB2 MET 60 2HB MET 60 2.800 -31.569 2.466 450 HB3 MET 60 3HB MET 60 4.540 -31.335 2.384 451 HG2 MET 60 2HG MET 60 3.973 -31.205 0.175 452 HG3 MET 60 3HG MET 60 4.372 -32.915 0.321 453 HE1 MET 60 3HE MET 60 2.154 -30.542 -1.209 454 HE2 MET 60 1HE MET 60 0.490 -31.095 -1.022 455 HE3 MET 60 2HE MET 60 1.322 -30.328 0.331 456 H ASP 61 H ASP 61 6.329 -33.228 3.709 457 HA ASP 61 HA ASP 61 5.591 -33.103 6.533 458 HB2 ASP 61 2HB ASP 61 8.096 -33.768 5.038 459 HB3 ASP 61 3HB ASP 61 8.215 -33.228 6.710 460 H GLY 62 H GLY 62 5.365 -30.834 4.549 461 HA2 GLY 62 2HA GLY 62 5.415 -28.536 4.934 462 HA3 GLY 62 3HA GLY 62 6.477 -28.815 6.306 463 H LEU 63 H LEU 63 8.654 -29.963 5.385 464 HA LEU 63 HA LEU 63 9.863 -27.889 3.785 465 HB2 LEU 63 2HB LEU 63 11.899 -29.491 4.094 466 HB3 LEU 63 3HB LEU 63 11.303 -28.527 5.444 467 HG LEU 63 HG LEU 63 10.212 -30.446 6.401 468 HD11 LEU 63 1HD1 LEU 63 9.384 -31.733 4.679 469 HD12 LEU 63 2HD1 LEU 63 10.744 -32.708 5.234 470 HD13 LEU 63 3HD1 LEU 63 10.905 -31.713 3.787 471 HD21 LEU 63 3HD2 LEU 63 13.082 -30.581 5.681 472 HD22 LEU 63 1HD2 LEU 63 12.358 -32.027 6.384 473 HD23 LEU 63 2HD2 LEU 63 12.310 -30.500 7.265 474 H ALA 64 H ALA 64 8.381 -30.871 3.182 475 HA ALA 64 HA ALA 64 9.779 -32.052 1.149 476 HB1 ALA 64 1HB ALA 64 7.936 -33.284 0.872 477 HB2 ALA 64 2HB ALA 64 7.266 -32.343 2.204 478 HB3 ALA 64 3HB ALA 64 6.933 -31.873 0.537 479 H LEU 65 H LEU 65 7.346 -29.474 0.739 480 HA LEU 65 HA LEU 65 8.126 -29.097 -2.023 481 HB2 LEU 65 2HB LEU 65 6.231 -27.851 -2.266 482 HB3 LEU 65 3HB LEU 65 5.762 -28.880 -0.915 483 HG LEU 65 HG LEU 65 6.829 -26.085 -0.567 484 HD11 LEU 65 1HD1 LEU 65 4.899 -25.495 -1.584 485 HD12 LEU 65 2HD1 LEU 65 4.228 -25.838 0.010 486 HD13 LEU 65 3HD1 LEU 65 4.126 -27.048 -1.269 487 HD21 LEU 65 3HD2 LEU 65 5.201 -26.692 1.544 488 HD22 LEU 65 1HD2 LEU 65 6.960 -26.824 1.541 489 HD23 LEU 65 2HD2 LEU 65 5.969 -28.244 1.206 490 H LEU 66 H LEU 66 8.657 -27.581 1.072 491 HA LEU 66 HA LEU 66 9.545 -25.065 0.245 492 HB2 LEU 66 2HB LEU 66 9.274 -26.372 2.639 493 HB3 LEU 66 3HB LEU 66 11.023 -26.201 2.498 494 HG LEU 66 HG LEU 66 10.295 -24.345 3.745 495 HD11 LEU 66 1HD1 LEU 66 10.521 -23.374 0.901 496 HD12 LEU 66 2HD1 LEU 66 11.884 -23.833 1.921 497 HD13 LEU 66 3HD1 LEU 66 10.873 -22.459 2.366 498 HD21 LEU 66 3HD2 LEU 66 8.515 -22.827 2.413 499 HD22 LEU 66 1HD2 LEU 66 8.066 -24.025 3.626 500 HD23 LEU 66 2HD2 LEU 66 7.988 -24.434 1.912 501 H LYS 67 H LYS 67 11.159 -28.167 0.304 502 HA LYS 67 HA LYS 67 13.811 -27.308 0.023 503 HB2 LYS 67 2HB LYS 67 12.328 -29.798 -0.284 504 HB3 LYS 67 3HB LYS 67 13.654 -29.668 -1.431 505 HG2 LYS 67 2HG LYS 67 14.675 -30.694 0.349 506 HG3 LYS 67 3HG LYS 67 15.045 -28.996 0.661 507 HD2 LYS 67 2HD LYS 67 13.256 -28.850 2.267 508 HD3 LYS 67 3HD LYS 67 12.716 -30.483 1.872 509 HE2 LYS 67 2HE LYS 67 15.534 -30.186 2.718 510 HE3 LYS 67 3HE LYS 67 14.309 -29.915 3.956 511 HZ1 LYS 67 3HZ LYS 67 15.242 -32.354 2.936 512 HZ2 LYS 67 1HZ LYS 67 13.603 -32.215 2.543 513 HZ3 LYS 67 2HZ LYS 67 14.098 -32.094 4.155 514 H GLN 68 H GLN 68 11.215 -27.619 -2.296 515 HA GLN 68 HA GLN 68 12.977 -27.182 -4.558 516 HB2 GLN 68 2HB GLN 68 11.248 -27.852 -5.871 517 HB3 GLN 68 3HB GLN 68 10.679 -28.553 -4.362 518 HG2 GLN 68 2HG GLN 68 8.792 -27.491 -5.064 519 HG3 GLN 68 3HG GLN 68 9.519 -26.223 -4.078 520 HE21 GLN 68 1HE2 GLN 68 8.371 -24.652 -5.241 521 HE22 GLN 68 2HE2 GLN 68 8.853 -24.173 -6.830 522 H ILE 69 H ILE 69 10.919 -25.354 -2.458 523 HA ILE 69 HA ILE 69 10.340 -23.131 -4.022 524 HB ILE 69 HB ILE 69 10.866 -23.330 -1.060 525 HG12 ILE 69 2HG1 ILE 69 8.319 -23.089 -2.676 526 HG13 ILE 69 3HG1 ILE 69 8.902 -24.548 -1.882 527 HG21 ILE 69 1HG2 ILE 69 9.895 -20.983 -2.678 528 HG22 ILE 69 2HG2 ILE 69 9.712 -21.113 -0.930 529 HG23 ILE 69 3HG2 ILE 69 11.323 -21.064 -1.645 530 HD11 ILE 69 3HD1 ILE 69 7.360 -22.363 -0.819 531 HD12 ILE 69 1HD1 ILE 69 7.679 -23.957 -0.137 532 HD13 ILE 69 2HD1 ILE 69 8.821 -22.639 0.130 533 H LYS 70 H LYS 70 13.321 -24.102 -2.521 534 HA LYS 70 HA LYS 70 14.606 -21.549 -2.717 535 HB2 LYS 70 2HB LYS 70 15.833 -24.296 -2.408 536 HB3 LYS 70 3HB LYS 70 16.648 -22.762 -2.133 537 HG2 LYS 70 2HG LYS 70 14.201 -23.549 -0.588 538 HG3 LYS 70 3HG LYS 70 15.822 -24.044 -0.095 539 HD2 LYS 70 2HD LYS 70 16.475 -21.885 0.397 540 HD3 LYS 70 3HD LYS 70 15.279 -21.167 -0.685 541 HE2 LYS 70 2HE LYS 70 14.571 -22.627 1.853 542 HE3 LYS 70 3HE LYS 70 14.821 -20.884 1.771 543 HZ1 LYS 70 3HZ LYS 70 12.496 -21.356 1.587 544 HZ2 LYS 70 1HZ LYS 70 12.756 -22.446 0.319 545 HZ3 LYS 70 2HZ LYS 70 13.042 -20.796 0.087 546 H GLN 71 H GLN 71 14.769 -24.570 -4.585 547 HA GLN 71 HA GLN 71 16.584 -23.523 -6.519 548 HB2 GLN 71 2HB GLN 71 16.035 -26.001 -5.877 549 HB3 GLN 71 3HB GLN 71 14.768 -25.836 -7.085 550 HG2 GLN 71 2HG GLN 71 16.343 -26.547 -8.499 551 HG3 GLN 71 3HG GLN 71 16.891 -24.872 -8.450 552 HE21 GLN 71 1HE2 GLN 71 18.440 -27.241 -8.990 553 HE22 GLN 71 2HE2 GLN 71 19.675 -27.315 -7.785 554 H ARG 72 H ARG 72 13.159 -23.434 -6.111 555 HA ARG 72 HA ARG 72 12.680 -22.681 -8.884 556 HB2 ARG 72 2HB ARG 72 11.155 -24.026 -7.041 557 HB3 ARG 72 3HB ARG 72 10.458 -22.413 -6.987 558 HG2 ARG 72 2HG ARG 72 10.823 -23.097 -9.709 559 HG3 ARG 72 3HG ARG 72 10.050 -24.463 -8.903 560 HD2 ARG 72 2HD ARG 72 8.623 -22.446 -7.851 561 HD3 ARG 72 3HD ARG 72 9.044 -21.731 -9.407 562 HE ARG 72 HE ARG 72 8.016 -24.395 -9.640 563 HH11 ARG 72 1HH1 ARG 72 7.155 -21.036 -9.334 564 HH12 ARG 72 2HH1 ARG 72 5.604 -21.230 -10.082 565 HH21 ARG 72 1HH2 ARG 72 5.976 -24.664 -10.625 566 HH22 ARG 72 2HH2 ARG 72 4.934 -23.295 -10.815 567 H HIS 73 H HIS 73 13.062 -21.234 -5.759 568 HA HIS 73 HA HIS 73 12.988 -18.595 -6.964 569 HB2 HIS 73 2HB HIS 73 11.227 -19.255 -4.594 570 HB3 HIS 73 3HB HIS 73 11.417 -17.672 -5.343 571 HD1 HIS 73 HD1 HIS 73 10.329 -17.355 -7.713 572 HD2 HIS 73 HD2 HIS 73 9.432 -20.952 -5.837 573 HE1 HIS 73 HE1 HIS 73 8.377 -18.305 -8.981 574 HA PRO 74 HA PRO 74 16.293 -19.225 -3.775 575 HB2 PRO 74 2HB PRO 74 18.278 -18.168 -5.296 576 HB3 PRO 74 3HB PRO 74 17.803 -19.868 -5.382 577 HG2 PRO 74 2HG PRO 74 17.053 -17.598 -7.183 578 HG3 PRO 74 3HG PRO 74 17.522 -19.255 -7.608 579 HD2 PRO 74 2HD PRO 74 14.941 -18.437 -7.563 580 HD3 PRO 74 3HD PRO 74 15.424 -20.097 -7.160 581 H MET 75 H MET 75 14.790 -16.639 -5.356 582 HA MET 75 HA MET 75 16.217 -14.658 -3.715 583 HB2 MET 75 2HB MET 75 15.224 -12.971 -5.250 584 HB3 MET 75 3HB MET 75 16.291 -14.110 -6.061 585 HG2 MET 75 2HG MET 75 14.682 -14.642 -7.473 586 HG3 MET 75 3HG MET 75 13.652 -15.152 -6.138 587 HE1 MET 75 3HE MET 75 12.066 -14.073 -5.056 588 HE2 MET 75 1HE MET 75 11.390 -12.464 -5.311 589 HE3 MET 75 2HE MET 75 10.960 -13.783 -6.399 590 H LEU 76 H LEU 76 13.446 -16.477 -3.771 591 HA LEU 76 HA LEU 76 11.754 -14.440 -2.537 592 HB2 LEU 76 2HB LEU 76 10.734 -15.849 -4.224 593 HB3 LEU 76 3HB LEU 76 11.193 -17.295 -3.328 594 HG LEU 76 HG LEU 76 9.691 -16.441 -1.466 595 HD11 LEU 76 1HD1 LEU 76 9.027 -14.497 -3.643 596 HD12 LEU 76 2HD1 LEU 76 9.331 -14.195 -1.932 597 HD13 LEU 76 3HD1 LEU 76 7.824 -14.959 -2.439 598 HD21 LEU 76 3HD2 LEU 76 7.612 -16.935 -3.156 599 HD22 LEU 76 1HD2 LEU 76 8.616 -18.172 -2.399 600 HD23 LEU 76 2HD2 LEU 76 8.968 -17.634 -4.041 601 HA PRO 77 HA PRO 77 13.243 -15.929 1.422 602 HB2 PRO 77 2HB PRO 77 11.958 -14.037 2.884 603 HB3 PRO 77 3HB PRO 77 13.465 -13.721 2.016 604 HG2 PRO 77 2HG PRO 77 10.651 -13.087 1.217 605 HG3 PRO 77 3HG PRO 77 12.106 -12.084 1.078 606 HD2 PRO 77 2HD PRO 77 11.073 -13.452 -1.018 607 HD3 PRO 77 3HD PRO 77 12.814 -13.156 -0.836 608 H VAL 78 H VAL 78 12.373 -17.246 2.954 609 HA VAL 78 HA VAL 78 9.450 -17.419 3.164 610 HB VAL 78 HB VAL 78 11.204 -19.865 2.940 611 HG11 VAL 78 1HG1 VAL 78 8.316 -19.368 3.407 612 HG12 VAL 78 2HG1 VAL 78 8.759 -20.748 2.400 613 HG13 VAL 78 3HG1 VAL 78 9.368 -20.628 4.051 614 HG21 VAL 78 3HG2 VAL 78 10.327 -20.171 0.703 615 HG22 VAL 78 1HG2 VAL 78 9.384 -18.687 0.843 616 HG23 VAL 78 2HG2 VAL 78 11.146 -18.613 0.814 617 H ILE 79 H ILE 79 8.706 -18.495 5.106 618 HA ILE 79 HA ILE 79 10.718 -18.668 7.242 619 HB ILE 79 HB ILE 79 8.016 -17.413 7.684 620 HG12 ILE 79 2HG1 ILE 79 10.635 -15.949 7.315 621 HG13 ILE 79 3HG1 ILE 79 9.411 -16.095 6.059 622 HG21 ILE 79 1HG2 ILE 79 8.629 -17.167 9.829 623 HG22 ILE 79 2HG2 ILE 79 9.790 -18.442 9.464 624 HG23 ILE 79 3HG2 ILE 79 10.291 -16.752 9.411 625 HD11 ILE 79 3HD1 ILE 79 8.937 -14.835 8.748 626 HD12 ILE 79 1HD1 ILE 79 9.357 -13.946 7.284 627 HD13 ILE 79 2HD1 ILE 79 7.843 -14.847 7.365 628 H ILE 80 H ILE 80 10.434 -20.298 8.679 629 HA ILE 80 HA ILE 80 8.200 -22.126 8.154 630 HB ILE 80 HB ILE 80 10.735 -22.669 9.702 631 HG12 ILE 80 2HG1 ILE 80 10.989 -22.150 7.212 632 HG13 ILE 80 3HG1 ILE 80 11.640 -23.688 7.769 633 HG21 ILE 80 1HG2 ILE 80 9.361 -24.315 10.453 634 HG22 ILE 80 2HG2 ILE 80 8.331 -24.260 9.023 635 HG23 ILE 80 3HG2 ILE 80 9.892 -25.079 8.955 636 HD11 ILE 80 3HD1 ILE 80 10.030 -23.360 5.611 637 HD12 ILE 80 1HD1 ILE 80 10.238 -24.871 6.497 638 HD13 ILE 80 2HD1 ILE 80 8.867 -23.819 6.855 639 H MET 81 H MET 81 6.795 -22.772 9.728 640 HA MET 81 HA MET 81 7.082 -21.482 12.362 641 HB2 MET 81 2HB MET 81 4.756 -21.671 10.518 642 HB3 MET 81 3HB MET 81 4.432 -21.793 12.242 643 HG2 MET 81 2HG MET 81 4.756 -19.616 12.572 644 HG3 MET 81 3HG MET 81 6.206 -19.589 11.572 645 HE1 MET 81 3HE MET 81 2.314 -20.243 9.577 646 HE2 MET 81 1HE MET 81 2.684 -20.586 11.268 647 HE3 MET 81 2HE MET 81 1.930 -19.054 10.823 648 H THR 82 H THR 82 7.255 -22.855 13.998 649 HA THR 82 HA THR 82 5.626 -25.074 14.451 650 HB THR 82 HB THR 82 6.562 -26.400 12.810 651 HG1 THR 82 HG1 THR 82 7.268 -27.918 14.098 652 HG21 THR 82 3HG2 THR 82 8.866 -24.632 13.142 653 HG22 THR 82 1HG2 THR 82 8.269 -25.453 11.701 654 HG23 THR 82 2HG2 THR 82 9.306 -26.312 12.840 655 H ALA 83 H ALA 83 9.087 -25.391 14.883 656 HA ALA 83 HA ALA 83 10.425 -25.338 16.724 657 HB1 ALA 83 1HB ALA 83 8.547 -23.114 17.146 658 HB2 ALA 83 2HB ALA 83 9.374 -23.694 18.592 659 HB3 ALA 83 3HB ALA 83 10.309 -23.142 17.203 660 H HIS 84 H HIS 84 9.488 -27.595 16.890 661 HA HIS 84 HA HIS 84 8.996 -28.222 19.573 662 HB2 HIS 84 2HB HIS 84 6.672 -29.051 19.429 663 HB3 HIS 84 3HB HIS 84 6.770 -27.307 19.203 664 HD1 HIS 84 HD1 HIS 84 6.236 -30.487 17.239 665 HD2 HIS 84 HD2 HIS 84 5.771 -26.380 16.817 666 HE1 HIS 84 HE1 HIS 84 4.964 -30.172 15.093 667 H SER 85 H SER 85 8.679 -29.150 16.205 668 HA SER 85 HA SER 85 10.081 -31.610 16.695 669 HB2 SER 85 2HB SER 85 7.709 -32.192 17.267 670 HB3 SER 85 3HB SER 85 7.263 -31.799 15.607 671 HG SER 85 HG SER 85 8.197 -33.582 14.916 672 H ASP 86 H ASP 86 10.401 -29.193 15.115 673 HA ASP 86 HA ASP 86 10.887 -30.473 12.542 674 HB2 ASP 86 2HB ASP 86 8.964 -28.262 12.996 675 HB3 ASP 86 3HB ASP 86 10.029 -28.097 11.603 676 H LEU 87 H LEU 87 11.271 -27.635 14.607 677 HA LEU 87 HA LEU 87 13.191 -26.216 13.259 678 HB2 LEU 87 2HB LEU 87 12.346 -26.502 16.025 679 HB3 LEU 87 3HB LEU 87 14.054 -26.093 15.882 680 HG LEU 87 HG LEU 87 13.476 -24.095 14.601 681 HD11 LEU 87 1HD1 LEU 87 10.723 -23.831 15.085 682 HD12 LEU 87 2HD1 LEU 87 10.951 -25.424 14.365 683 HD13 LEU 87 3HD1 LEU 87 11.540 -23.987 13.530 684 HD21 LEU 87 3HD2 LEU 87 13.690 -23.706 16.909 685 HD22 LEU 87 1HD2 LEU 87 12.146 -24.478 17.268 686 HD23 LEU 87 2HD2 LEU 87 12.181 -22.917 16.448 687 H ASP 88 H ASP 88 13.713 -28.965 15.448 688 HA ASP 88 HA ASP 88 16.431 -29.089 15.559 689 HB2 ASP 88 2HB ASP 88 15.028 -30.685 16.734 690 HB3 ASP 88 3HB ASP 88 14.508 -31.398 15.210 691 H ALA 89 H ALA 89 14.376 -30.141 12.886 692 HA ALA 89 HA ALA 89 16.675 -30.994 11.327 693 HB1 ALA 89 1HB ALA 89 14.310 -30.944 9.756 694 HB2 ALA 89 2HB ALA 89 15.190 -32.340 10.379 695 HB3 ALA 89 3HB ALA 89 13.907 -31.605 11.340 696 H ALA 90 H ALA 90 14.093 -28.556 11.071 697 HA ALA 90 HA ALA 90 14.833 -27.326 8.722 698 HB1 ALA 90 1HB ALA 90 12.807 -26.664 9.725 699 HB2 ALA 90 2HB ALA 90 13.611 -26.187 11.220 700 HB3 ALA 90 3HB ALA 90 13.840 -25.235 9.754 701 H VAL 91 H VAL 91 16.292 -27.050 11.891 702 HA VAL 91 HA VAL 91 17.769 -24.749 11.701 703 HB VAL 91 HB VAL 91 18.471 -27.397 12.946 704 HG11 VAL 91 1HG1 VAL 91 20.225 -25.965 14.189 705 HG12 VAL 91 2HG1 VAL 91 20.607 -26.559 12.572 706 HG13 VAL 91 3HG1 VAL 91 20.098 -24.886 12.800 707 HG21 VAL 91 3HG2 VAL 91 16.716 -25.441 13.706 708 HG22 VAL 91 1HG2 VAL 91 17.463 -26.617 14.789 709 HG23 VAL 91 2HG2 VAL 91 18.168 -25.010 14.610 710 H SER 92 H SER 92 18.916 -27.985 10.723 711 HA SER 92 HA SER 92 21.116 -26.791 9.255 712 HB2 SER 92 2HB SER 92 21.988 -28.705 10.110 713 HB3 SER 92 3HB SER 92 20.412 -29.488 10.226 714 HG SER 92 HG SER 92 22.290 -29.829 8.376 715 H ALA 93 H ALA 93 18.191 -28.665 8.582 716 HA ALA 93 HA ALA 93 18.549 -28.954 5.815 717 HB1 ALA 93 1HB ALA 93 16.146 -29.397 5.726 718 HB2 ALA 93 2HB ALA 93 16.908 -30.247 7.071 719 HB3 ALA 93 3HB ALA 93 15.971 -28.784 7.371 720 H TYR 94 H TYR 94 16.360 -26.669 7.471 721 HA TYR 94 HA TYR 94 15.748 -25.131 5.236 722 HB2 TYR 94 2HB TYR 94 14.757 -25.129 7.660 723 HB3 TYR 94 3HB TYR 94 15.947 -23.864 7.945 724 HD1 TYR 94 HD1 TYR 94 13.910 -24.534 4.899 725 HD2 TYR 94 HD2 TYR 94 14.691 -21.912 8.158 726 HE1 TYR 94 HE1 TYR 94 12.374 -22.877 3.927 727 HE2 TYR 94 HE2 TYR 94 13.156 -20.249 7.195 728 HH TYR 94 HH TYR 94 12.322 -19.828 4.554 729 H GLN 95 H GLN 95 18.637 -25.283 7.057 730 HA GLN 95 HA GLN 95 19.614 -22.662 6.540 731 HB2 GLN 95 2HB GLN 95 20.589 -25.105 7.784 732 HB3 GLN 95 3HB GLN 95 21.842 -24.294 6.853 733 HG2 GLN 95 2HG GLN 95 20.154 -22.830 8.851 734 HG3 GLN 95 3HG GLN 95 21.620 -23.692 9.313 735 HE21 GLN 95 1HE2 GLN 95 21.751 -21.193 9.913 736 HE22 GLN 95 2HE2 GLN 95 22.681 -20.267 8.790 737 H GLN 96 H GLN 96 18.833 -24.942 4.395 738 HA GLN 96 HA GLN 96 21.131 -25.019 2.708 739 HB2 GLN 96 2HB GLN 96 19.687 -26.080 1.085 740 HB3 GLN 96 3HB GLN 96 19.358 -26.750 2.677 741 HG2 GLN 96 2HG GLN 96 17.423 -25.161 2.834 742 HG3 GLN 96 3HG GLN 96 17.700 -24.775 1.137 743 HE21 GLN 96 1HE2 GLN 96 17.722 -27.795 3.000 744 HE22 GLN 96 2HE2 GLN 96 16.585 -28.622 1.996 745 H GLY 97 H GLY 97 19.996 -22.357 3.566 746 HA2 GLY 97 2HA GLY 97 20.525 -20.373 2.276 747 HA3 GLY 97 3HA GLY 97 19.886 -21.191 0.858 748 H ALA 98 H ALA 98 18.334 -21.199 4.006 749 HA ALA 98 HA ALA 98 16.101 -19.691 2.820 750 HB1 ALA 98 1HB ALA 98 15.733 -21.257 5.316 751 HB2 ALA 98 2HB ALA 98 14.617 -20.974 3.980 752 HB3 ALA 98 3HB ALA 98 15.926 -22.142 3.802 753 H PHE 99 H PHE 99 14.770 -18.479 4.507 754 HA PHE 99 HA PHE 99 16.580 -16.726 5.943 755 HB2 PHE 99 2HB PHE 99 14.903 -15.607 4.669 756 HB3 PHE 99 3HB PHE 99 13.624 -16.604 5.353 757 HD1 PHE 99 HD1 PHE 99 12.815 -16.210 7.618 758 HD2 PHE 99 HD2 PHE 99 15.792 -13.726 5.860 759 HE1 PHE 99 HE1 PHE 99 12.427 -14.517 9.360 760 HE2 PHE 99 HE2 PHE 99 15.409 -12.030 7.600 761 HZ PHE 99 HZ PHE 99 13.725 -12.424 9.354 762 H ASP 100 H ASP 100 16.301 -16.150 8.159 763 HA ASP 100 HA ASP 100 16.125 -18.258 9.932 764 HB2 ASP 100 2HB ASP 100 16.745 -15.583 10.123 765 HB3 ASP 100 3HB ASP 100 15.284 -15.705 11.100 766 H TYR 101 H TYR 101 14.395 -19.566 10.011 767 HA TYR 101 HA TYR 101 11.741 -18.876 9.557 768 HB2 TYR 101 2HB TYR 101 11.253 -20.994 10.925 769 HB3 TYR 101 3HB TYR 101 12.250 -21.172 9.485 770 HD1 TYR 101 HD2 TYR 101 12.892 -20.238 13.054 771 HD2 TYR 101 HD1 TYR 101 13.928 -22.720 9.757 772 HE1 TYR 101 HE2 TYR 101 14.651 -21.296 14.410 773 HE2 TYR 101 HE1 TYR 101 15.688 -23.785 11.104 774 HH TYR 101 HH TYR 101 16.029 -23.136 14.525 775 H LEU 102 H LEU 102 10.044 -19.437 11.431 776 HA LEU 102 HA LEU 102 10.769 -17.928 13.842 777 HB2 LEU 102 2HB LEU 102 9.651 -16.247 12.746 778 HB3 LEU 102 3HB LEU 102 8.580 -17.365 11.904 779 HG LEU 102 HG LEU 102 7.498 -17.754 14.197 780 HD11 LEU 102 1HD1 LEU 102 9.493 -15.745 14.846 781 HD12 LEU 102 2HD1 LEU 102 8.541 -16.782 15.908 782 HD13 LEU 102 3HD1 LEU 102 7.863 -15.264 15.317 783 HD21 LEU 102 3HD2 LEU 102 6.408 -15.329 13.933 784 HD22 LEU 102 1HD2 LEU 102 6.071 -16.657 12.821 785 HD23 LEU 102 2HD2 LEU 102 7.257 -15.424 12.389 786 HA PRO 103 HA PRO 103 8.893 -21.493 15.707 787 HB2 PRO 103 2HB PRO 103 9.049 -20.614 18.271 788 HB3 PRO 103 3HB PRO 103 10.445 -21.233 17.381 789 HG2 PRO 103 2HG PRO 103 9.623 -18.398 17.882 790 HG3 PRO 103 3HG PRO 103 11.238 -19.126 17.965 791 HD2 PRO 103 2HD PRO 103 10.398 -17.683 15.833 792 HD3 PRO 103 3HD PRO 103 11.531 -19.041 15.680 793 H LYS 104 H LYS 104 6.961 -22.048 16.788 794 HA LYS 104 HA LYS 104 4.992 -19.862 16.980 795 HB2 LYS 104 2HB LYS 104 4.847 -22.535 15.705 796 HB3 LYS 104 3HB LYS 104 3.415 -22.008 16.579 797 HG2 LYS 104 2HG LYS 104 3.692 -19.825 15.204 798 HG3 LYS 104 3HG LYS 104 4.686 -20.832 14.147 799 HD2 LYS 104 2HD LYS 104 2.720 -21.295 13.149 800 HD3 LYS 104 3HD LYS 104 2.523 -22.429 14.487 801 HE2 LYS 104 2HE LYS 104 1.646 -19.595 14.819 802 HE3 LYS 104 3HE LYS 104 0.634 -20.712 13.905 803 HZ1 LYS 104 3HZ LYS 104 0.778 -22.216 15.894 804 HZ2 LYS 104 1HZ LYS 104 -0.108 -20.793 16.123 805 HZ3 LYS 104 2HZ LYS 104 1.461 -20.921 16.742 806 HA PRO 105 HA PRO 105 2.852 -19.699 17.612 807 HB2 PRO 105 2HB PRO 105 2.103 -18.038 19.625 808 HB3 PRO 105 3HB PRO 105 1.295 -19.575 19.298 809 HG2 PRO 105 2HG PRO 105 3.375 -18.928 21.350 810 HG3 PRO 105 3HG PRO 105 1.902 -19.901 21.518 811 HD2 PRO 105 2HD PRO 105 4.351 -21.010 21.195 812 HD3 PRO 105 3HD PRO 105 2.872 -21.762 20.565 813 H PHE 106 H PHE 106 2.848 -17.224 17.470 814 HA PHE 106 HA PHE 106 5.390 -16.027 18.267 815 HB2 PHE 106 2HB PHE 106 5.751 -15.162 15.955 816 HB3 PHE 106 3HB PHE 106 5.899 -16.912 16.080 817 HD1 PHE 106 HD1 PHE 106 3.406 -14.273 15.255 818 HD2 PHE 106 HD2 PHE 106 4.767 -18.249 14.582 819 HE1 PHE 106 HE1 PHE 106 1.742 -14.535 13.461 820 HE2 PHE 106 HE2 PHE 106 3.106 -18.517 12.787 821 HZ PHE 106 HZ PHE 106 1.591 -16.659 12.224 822 H ASP 107 H ASP 107 5.415 -13.709 18.117 823 HA ASP 107 HA ASP 107 2.782 -12.575 18.580 824 HB2 ASP 107 2HB ASP 107 5.591 -11.735 19.113 825 HB3 ASP 107 3HB ASP 107 4.375 -10.471 18.951 826 H ILE 108 H ILE 108 1.660 -11.970 16.846 827 HA ILE 108 HA ILE 108 2.518 -11.513 14.295 828 HB ILE 108 HB ILE 108 0.218 -10.233 15.762 829 HG12 ILE 108 2HG1 ILE 108 0.010 -12.261 13.567 830 HG13 ILE 108 3HG1 ILE 108 0.438 -12.789 15.191 831 HG21 ILE 108 1HG2 ILE 108 0.632 -8.719 14.016 832 HG22 ILE 108 2HG2 ILE 108 1.023 -10.007 12.879 833 HG23 ILE 108 3HG2 ILE 108 -0.643 -9.775 13.409 834 HD11 ILE 108 3HD1 ILE 108 -1.768 -11.107 15.507 835 HD12 ILE 108 1HD1 ILE 108 -2.128 -12.119 14.108 836 HD13 ILE 108 2HD1 ILE 108 -1.720 -12.864 15.654 837 H ASP 109 H ASP 109 2.590 -9.288 17.001 838 HA ASP 109 HA ASP 109 3.086 -6.908 15.607 839 HB2 ASP 109 2HB ASP 109 3.147 -7.810 18.346 840 HB3 ASP 109 3HB ASP 109 4.527 -6.765 18.020 841 H GLU 110 H GLU 110 5.318 -9.345 16.894 842 HA GLU 110 HA GLU 110 7.623 -7.938 15.858 843 HB2 GLU 110 2HB GLU 110 7.736 -9.196 17.984 844 HB3 GLU 110 3HB GLU 110 7.426 -10.686 17.103 845 HG2 GLU 110 2HG GLU 110 9.509 -10.617 16.032 846 HG3 GLU 110 3HG GLU 110 9.769 -8.928 16.465 847 H ALA 111 H ALA 111 5.528 -10.539 14.899 848 HA ALA 111 HA ALA 111 7.241 -11.690 12.941 849 HB1 ALA 111 1HB ALA 111 4.534 -12.123 12.227 850 HB2 ALA 111 2HB ALA 111 5.660 -13.242 12.997 851 HB3 ALA 111 3HB ALA 111 4.646 -12.191 13.986 852 H VAL 112 H VAL 112 4.523 -9.402 12.731 853 HA VAL 112 HA VAL 112 4.493 -9.040 9.978 854 HB VAL 112 HB VAL 112 3.811 -7.130 12.207 855 HG11 VAL 112 1HG1 VAL 112 2.618 -5.820 10.428 856 HG12 VAL 112 2HG1 VAL 112 4.379 -5.729 10.367 857 HG13 VAL 112 3HG1 VAL 112 3.508 -6.762 9.233 858 HG21 VAL 112 3HG2 VAL 112 2.480 -9.275 11.726 859 HG22 VAL 112 1HG2 VAL 112 1.589 -7.759 11.862 860 HG23 VAL 112 2HG2 VAL 112 1.930 -8.442 10.273 861 H ALA 113 H ALA 113 6.703 -7.822 12.366 862 HA ALA 113 HA ALA 113 7.861 -5.850 10.587 863 HB1 ALA 113 1HB ALA 113 8.900 -5.011 12.404 864 HB2 ALA 113 2HB ALA 113 7.687 -5.955 13.270 865 HB3 ALA 113 3HB ALA 113 9.311 -6.604 13.041 866 H LEU 114 H LEU 114 8.284 -9.169 11.305 867 HA LEU 114 HA LEU 114 11.051 -9.299 10.493 868 HB2 LEU 114 2HB LEU 114 11.008 -11.290 11.469 869 HB3 LEU 114 3HB LEU 114 9.356 -10.922 11.960 870 HG LEU 114 HG LEU 114 8.664 -11.981 9.726 871 HD11 LEU 114 1HD1 LEU 114 10.420 -12.418 8.398 872 HD12 LEU 114 2HD1 LEU 114 10.572 -13.874 9.381 873 HD13 LEU 114 3HD1 LEU 114 11.560 -12.459 9.743 874 HD21 LEU 114 3HD2 LEU 114 8.336 -14.007 10.777 875 HD22 LEU 114 1HD2 LEU 114 8.597 -12.930 12.149 876 HD23 LEU 114 2HD2 LEU 114 9.906 -13.967 11.581 877 H VAL 115 H VAL 115 7.896 -9.861 9.064 878 HA VAL 115 HA VAL 115 8.809 -11.141 6.703 879 HB VAL 115 HB VAL 115 6.498 -11.365 7.336 880 HG11 VAL 115 1HG1 VAL 115 4.945 -9.444 7.236 881 HG12 VAL 115 2HG1 VAL 115 6.170 -9.271 8.495 882 HG13 VAL 115 3HG1 VAL 115 6.324 -8.375 6.984 883 HG21 VAL 115 3HG2 VAL 115 7.372 -10.669 4.779 884 HG22 VAL 115 1HG2 VAL 115 5.892 -11.528 5.202 885 HG23 VAL 115 2HG2 VAL 115 5.871 -9.775 5.013 886 H GLU 116 H GLU 116 8.300 -7.780 7.603 887 HA GLU 116 HA GLU 116 8.574 -6.694 4.998 888 HB2 GLU 116 2HB GLU 116 8.653 -4.573 6.043 889 HB3 GLU 116 3HB GLU 116 7.583 -5.551 7.036 890 HG2 GLU 116 2HG GLU 116 8.799 -4.980 8.789 891 HG3 GLU 116 3HG GLU 116 10.124 -5.929 8.116 892 H ARG 117 H ARG 117 10.824 -7.948 7.252 893 HA ARG 117 HA ARG 117 13.107 -6.458 6.404 894 HB2 ARG 117 2HB ARG 117 13.705 -7.335 8.388 895 HB3 ARG 117 3HB ARG 117 12.534 -8.640 8.262 896 HG2 ARG 117 2HG ARG 117 14.024 -10.009 7.073 897 HG3 ARG 117 3HG ARG 117 15.112 -8.663 6.729 898 HD2 ARG 117 2HD ARG 117 15.093 -8.615 9.433 899 HD3 ARG 117 3HD ARG 117 14.864 -10.338 9.138 900 HE ARG 117 HE ARG 117 17.006 -9.184 7.612 901 HH11 ARG 117 1HH1 ARG 117 16.109 -10.610 10.658 902 HH12 ARG 117 2HH1 ARG 117 17.718 -11.131 11.036 903 HH21 ARG 117 1HH2 ARG 117 19.128 -9.865 8.098 904 HH22 ARG 117 2HH2 ARG 117 19.435 -10.706 9.580 905 H ALA 118 H ALA 118 11.602 -9.475 5.434 906 HA ALA 118 HA ALA 118 13.770 -10.288 3.735 907 HB1 ALA 118 1HB ALA 118 12.718 -12.240 3.795 908 HB2 ALA 118 2HB ALA 118 11.462 -11.495 4.785 909 HB3 ALA 118 3HB ALA 118 11.291 -11.541 3.030 910 H ILE 119 H ILE 119 10.892 -8.368 3.393 911 HA ILE 119 HA ILE 119 10.942 -8.426 0.501 912 HB ILE 119 HB ILE 119 9.285 -6.823 2.446 913 HG12 ILE 119 2HG1 ILE 119 8.265 -8.881 0.518 914 HG13 ILE 119 3HG1 ILE 119 8.991 -9.391 2.038 915 HG21 ILE 119 1HG2 ILE 119 7.935 -6.194 0.455 916 HG22 ILE 119 2HG2 ILE 119 9.554 -5.495 0.467 917 HG23 ILE 119 3HG2 ILE 119 9.200 -6.880 -0.565 918 HD11 ILE 119 3HD1 ILE 119 7.300 -8.467 3.304 919 HD12 ILE 119 1HD1 ILE 119 6.813 -7.352 2.028 920 HD13 ILE 119 2HD1 ILE 119 6.436 -9.069 1.890 921 H SER 120 H SER 120 11.423 -5.941 3.011 922 HA SER 120 HA SER 120 12.193 -3.863 1.321 923 HB2 SER 120 2HB SER 120 12.959 -4.441 4.189 924 HB3 SER 120 3HB SER 120 13.345 -2.933 3.361 925 HG SER 120 HG SER 120 10.820 -3.970 4.069 926 H HIS 121 H HIS 121 13.931 -6.656 2.383 927 HA HIS 121 HA HIS 121 16.570 -5.861 2.151 928 HB2 HIS 121 2HB HIS 121 15.683 -8.121 2.895 929 HB3 HIS 121 3HB HIS 121 15.536 -8.529 1.188 930 HD1 HIS 121 HD1 HIS 121 17.708 -8.991 -0.112 931 HD2 HIS 121 HD2 HIS 121 18.310 -8.026 3.884 932 HE1 HIS 121 HE1 HIS 121 20.109 -9.568 0.365 933 H TYR 122 H TYR 122 14.208 -6.435 -0.336 934 HA TYR 122 HA TYR 122 16.261 -6.165 -2.416 935 HB2 TYR 122 2HB TYR 122 13.353 -6.826 -2.860 936 HB3 TYR 122 3HB TYR 122 14.708 -7.098 -3.950 937 HD1 TYR 122 HD2 TYR 122 16.616 -8.655 -2.882 938 HD2 TYR 122 HD1 TYR 122 12.517 -8.657 -1.740 939 HE1 TYR 122 HE2 TYR 122 16.868 -10.938 -2.005 940 HE2 TYR 122 HE1 TYR 122 12.758 -10.940 -0.859 941 HH TYR 122 HH TYR 122 15.736 -12.395 -0.314 942 H GLN 123 H GLN 123 12.913 -5.034 -1.907 943 HA GLN 123 HA GLN 123 13.137 -2.851 -3.677 944 HB2 GLN 123 2HB GLN 123 11.188 -3.720 -1.603 945 HB3 GLN 123 3HB GLN 123 11.111 -2.047 -2.139 946 HG2 GLN 123 2HG GLN 123 10.538 -2.629 -4.305 947 HG3 GLN 123 3HG GLN 123 11.157 -4.271 -4.133 948 HE21 GLN 123 1HE2 GLN 123 9.985 -5.217 -1.941 949 HE22 GLN 123 2HE2 GLN 123 8.265 -5.229 -2.103 950 H GLU 124 H GLU 124 12.757 -2.693 -0.132 951 HA GLU 124 HA GLU 124 13.571 -1.243 1.421 952 HB2 GLU 124 2HB GLU 124 15.740 -2.032 0.112 953 HB3 GLU 124 3HB GLU 124 15.763 -0.348 -0.393 954 HG2 GLU 124 2HG GLU 124 15.327 -0.287 2.362 955 HG3 GLU 124 3HG GLU 124 16.557 -1.522 2.105 Start of MODEL 20 1 H1 MET 1 H MET 1 0.204 -0.434 1.185 2 HA MET 1 HA MET 1 1.128 0.985 -1.074 3 HB2 MET 1 2HB MET 1 2.848 1.668 0.638 4 HB3 MET 1 3HB MET 1 3.339 -0.019 0.722 5 HG2 MET 1 2HG MET 1 4.355 0.027 -1.304 6 HG3 MET 1 3HG MET 1 3.249 1.234 -1.956 7 HE1 MET 1 3HE MET 1 5.170 4.306 -1.969 8 HE2 MET 1 1HE MET 1 5.253 2.926 -3.065 9 HE3 MET 1 2HE MET 1 3.707 3.402 -2.362 10 H GLN 2 H GLN 2 1.569 -1.880 0.955 11 HA GLN 2 HA GLN 2 1.727 -4.097 0.465 12 HB2 GLN 2 2HB GLN 2 0.259 -3.448 -2.086 13 HB3 GLN 2 3HB GLN 2 0.227 -4.949 -1.170 14 HG2 GLN 2 2HG GLN 2 -0.963 -3.844 0.636 15 HG3 GLN 2 3HG GLN 2 -0.897 -2.317 -0.241 16 HE21 GLN 2 1HE2 GLN 2 -2.605 -5.185 0.267 17 HE22 GLN 2 2HE2 GLN 2 -3.791 -4.989 -0.973 18 H ARG 3 H ARG 3 3.954 -2.577 -0.270 19 HA ARG 3 HA ARG 3 4.837 -3.034 -2.906 20 HB2 ARG 3 2HB ARG 3 6.906 -2.214 -2.215 21 HB3 ARG 3 3HB ARG 3 5.786 -1.449 -1.096 22 HG2 ARG 3 2HG ARG 3 7.382 -3.932 -0.503 23 HG3 ARG 3 3HG ARG 3 7.822 -2.298 -0.003 24 HD2 ARG 3 2HD ARG 3 5.326 -3.798 0.785 25 HD3 ARG 3 3HD ARG 3 6.728 -3.496 1.812 26 HE ARG 3 HE ARG 3 4.584 -1.705 1.290 27 HH11 ARG 3 1HH1 ARG 3 8.012 -1.834 1.882 28 HH12 ARG 3 2HH1 ARG 3 8.088 -0.238 2.552 29 HH21 ARG 3 1HH2 ARG 3 4.671 0.397 2.170 30 HH22 ARG 3 2HH2 ARG 3 6.187 1.030 2.716 31 H GLY 4 H GLY 4 4.449 -5.149 -0.273 32 HA2 GLY 4 2HA GLY 4 5.842 -7.255 -1.775 33 HA3 GLY 4 3HA GLY 4 6.249 -7.017 -0.082 34 H ILE 5 H ILE 5 4.321 -8.709 -2.203 35 HA ILE 5 HA ILE 5 2.043 -9.065 -0.469 36 HB ILE 5 HB ILE 5 2.872 -10.426 -3.029 37 HG12 ILE 5 2HG1 ILE 5 0.423 -8.747 -2.543 38 HG13 ILE 5 3HG1 ILE 5 1.970 -8.002 -2.931 39 HG21 ILE 5 1HG2 ILE 5 1.701 -12.087 -1.801 40 HG22 ILE 5 2HG2 ILE 5 0.480 -10.930 -1.276 41 HG23 ILE 5 3HG2 ILE 5 0.562 -11.417 -2.969 42 HD11 ILE 5 3HD1 ILE 5 0.049 -9.277 -4.660 43 HD12 ILE 5 1HD1 ILE 5 1.421 -8.245 -5.062 44 HD13 ILE 5 2HD1 ILE 5 1.655 -9.980 -4.846 45 H VAL 6 H VAL 6 1.585 -10.788 0.830 46 HA VAL 6 HA VAL 6 3.698 -12.823 1.129 47 HB VAL 6 HB VAL 6 1.971 -11.858 3.400 48 HG11 VAL 6 1HG1 VAL 6 4.648 -13.240 3.430 49 HG12 VAL 6 2HG1 VAL 6 3.575 -12.945 4.798 50 HG13 VAL 6 3HG1 VAL 6 3.104 -14.084 3.537 51 HG21 VAL 6 3HG2 VAL 6 3.870 -10.484 4.129 52 HG22 VAL 6 1HG2 VAL 6 4.722 -10.882 2.637 53 HG23 VAL 6 2HG2 VAL 6 3.231 -9.943 2.576 54 H TRP 7 H TRP 7 3.037 -14.834 0.792 55 HA TRP 7 HA TRP 7 0.159 -15.391 0.780 56 HB2 TRP 7 2HB TRP 7 2.529 -16.744 -0.490 57 HB3 TRP 7 3HB TRP 7 0.975 -17.561 -0.352 58 HD1 TRP 7 HD1 TRP 7 -0.010 -14.161 -0.904 59 HE1 TRP 7 HE1 TRP 7 -0.435 -13.659 -3.393 60 HE3 TRP 7 HE3 TRP 7 2.302 -18.232 -2.959 61 HZ2 TRP 7 HZ2 TRP 7 0.134 -14.834 -5.895 62 HZ3 TRP 7 HZ3 TRP 7 2.316 -18.468 -5.408 63 HH2 TRP 7 HH2 TRP 7 1.254 -16.804 -6.844 64 H VAL 8 H VAL 8 -0.775 -16.673 2.248 65 HA VAL 8 HA VAL 8 0.969 -18.008 4.205 66 HB VAL 8 HB VAL 8 -1.943 -17.266 4.511 67 HG11 VAL 8 1HG1 VAL 8 -1.261 -17.590 6.982 68 HG12 VAL 8 2HG1 VAL 8 -1.571 -19.017 5.991 69 HG13 VAL 8 3HG1 VAL 8 0.087 -18.515 6.323 70 HG21 VAL 8 3HG2 VAL 8 0.511 -15.890 5.604 71 HG22 VAL 8 1HG2 VAL 8 -0.530 -15.278 4.318 72 HG23 VAL 8 2HG2 VAL 8 -1.163 -15.458 5.955 73 H VAL 9 H VAL 9 0.568 -20.132 4.843 74 HA VAL 9 HA VAL 9 -1.583 -21.679 3.778 75 HB VAL 9 HB VAL 9 -0.014 -21.450 1.800 76 HG11 VAL 9 1HG1 VAL 9 1.945 -21.992 3.607 77 HG12 VAL 9 2HG1 VAL 9 1.722 -23.569 2.847 78 HG13 VAL 9 3HG1 VAL 9 2.115 -22.160 1.860 79 HG21 VAL 9 3HG2 VAL 9 -0.884 -23.367 1.048 80 HG22 VAL 9 1HG2 VAL 9 -0.038 -24.325 2.263 81 HG23 VAL 9 2HG2 VAL 9 -1.572 -23.550 2.661 82 H ASP 10 H ASP 10 -1.624 -23.829 4.591 83 HA ASP 10 HA ASP 10 0.397 -25.055 6.072 84 HB2 ASP 10 2HB ASP 10 0.320 -23.402 7.739 85 HB3 ASP 10 3HB ASP 10 -1.435 -23.270 7.654 86 H ASP 11 H ASP 11 -2.888 -24.687 7.301 87 HA ASP 11 HA ASP 11 -4.217 -26.658 5.922 88 HB2 ASP 11 2HB ASP 11 -2.796 -28.399 6.507 89 HB3 ASP 11 3HB ASP 11 -2.474 -27.735 8.106 90 H ASP 12 H ASP 12 -3.594 -25.203 9.045 91 HA ASP 12 HA ASP 12 -6.372 -25.585 9.864 92 HB2 ASP 12 2HB ASP 12 -3.834 -24.943 11.240 93 HB3 ASP 12 3HB ASP 12 -5.272 -24.158 11.886 94 H SER 13 H SER 13 -7.680 -23.801 10.552 95 HA SER 13 HA SER 13 -7.475 -21.555 8.781 96 HB2 SER 13 2HB SER 13 -9.693 -21.566 9.086 97 HB3 SER 13 3HB SER 13 -9.522 -22.797 10.337 98 HG SER 13 HG SER 13 -10.352 -21.187 11.472 99 H SER 14 H SER 14 -7.451 -21.922 12.324 100 HA SER 14 HA SER 14 -6.974 -19.246 12.957 101 HB2 SER 14 2HB SER 14 -6.914 -19.985 15.093 102 HB3 SER 14 3HB SER 14 -7.357 -21.545 14.400 103 HG SER 14 HG SER 14 -5.075 -21.978 14.256 104 H ILE 15 H ILE 15 -4.884 -21.633 11.643 105 HA ILE 15 HA ILE 15 -2.423 -20.399 12.471 106 HB ILE 15 HB ILE 15 -3.003 -22.524 10.409 107 HG12 ILE 15 2HG1 ILE 15 -3.363 -23.224 12.723 108 HG13 ILE 15 3HG1 ILE 15 -1.936 -24.014 12.061 109 HG21 ILE 15 1HG2 ILE 15 -0.340 -22.731 10.966 110 HG22 ILE 15 2HG2 ILE 15 -1.021 -21.957 9.536 111 HG23 ILE 15 3HG2 ILE 15 -0.574 -20.983 10.937 112 HD11 ILE 15 3HD1 ILE 15 -2.190 -22.330 14.369 113 HD12 ILE 15 1HD1 ILE 15 -0.831 -23.325 13.846 114 HD13 ILE 15 2HD1 ILE 15 -0.997 -21.674 13.248 115 H ARG 16 H ARG 16 -4.410 -20.422 9.550 116 HA ARG 16 HA ARG 16 -2.557 -18.761 8.089 117 HB2 ARG 16 2HB ARG 16 -4.351 -18.747 6.356 118 HB3 ARG 16 3HB ARG 16 -3.839 -20.360 6.832 119 HG2 ARG 16 2HG ARG 16 -5.803 -20.682 8.141 120 HG3 ARG 16 3HG ARG 16 -6.274 -18.992 7.945 121 HD2 ARG 16 2HD ARG 16 -6.039 -19.786 5.357 122 HD3 ARG 16 3HD ARG 16 -6.598 -21.272 6.123 123 HE ARG 16 HE ARG 16 -8.140 -18.994 6.900 124 HH11 ARG 16 1HH1 ARG 16 -7.695 -21.381 4.405 125 HH12 ARG 16 2HH1 ARG 16 -9.329 -21.281 3.837 126 HH21 ARG 16 1HH2 ARG 16 -10.293 -18.853 6.161 127 HH22 ARG 16 2HH2 ARG 16 -10.805 -19.841 4.835 128 H TRP 17 H TRP 17 -5.497 -18.347 9.943 129 HA TRP 17 HA TRP 17 -6.188 -15.761 9.104 130 HB2 TRP 17 2HB TRP 17 -7.828 -16.887 10.347 131 HB3 TRP 17 3HB TRP 17 -6.694 -17.322 11.623 132 HD1 TRP 17 HD1 TRP 17 -8.693 -14.296 10.324 133 HE1 TRP 17 HE1 TRP 17 -8.963 -12.618 12.257 134 HE3 TRP 17 HE3 TRP 17 -5.741 -16.592 13.810 135 HZ2 TRP 17 HZ2 TRP 17 -8.046 -12.309 14.909 136 HZ3 TRP 17 HZ3 TRP 17 -5.490 -15.539 16.020 137 HH2 TRP 17 HH2 TRP 17 -6.619 -13.442 16.556 138 H VAL 18 H VAL 18 -4.344 -16.769 11.988 139 HA VAL 18 HA VAL 18 -3.704 -14.346 13.061 140 HB VAL 18 HB VAL 18 -1.485 -15.406 13.732 141 HG11 VAL 18 1HG1 VAL 18 -3.936 -17.050 14.334 142 HG12 VAL 18 2HG1 VAL 18 -2.517 -16.815 15.356 143 HG13 VAL 18 3HG1 VAL 18 -3.617 -15.470 15.048 144 HG21 VAL 18 3HG2 VAL 18 -2.698 -17.717 12.222 145 HG22 VAL 18 1HG2 VAL 18 -1.167 -16.908 11.885 146 HG23 VAL 18 2HG2 VAL 18 -1.355 -17.862 13.356 147 H LEU 19 H LEU 19 -2.054 -15.962 10.371 148 HA LEU 19 HA LEU 19 -0.115 -13.882 10.044 149 HB2 LEU 19 2HB LEU 19 -0.910 -16.302 8.476 150 HB3 LEU 19 3HB LEU 19 0.171 -15.102 7.769 151 HG LEU 19 HG LEU 19 0.713 -16.601 10.330 152 HD11 LEU 19 1HD1 LEU 19 2.577 -17.421 8.523 153 HD12 LEU 19 2HD1 LEU 19 1.132 -17.300 7.520 154 HD13 LEU 19 3HD1 LEU 19 1.124 -18.320 8.958 155 HD21 LEU 19 3HD2 LEU 19 2.195 -14.548 8.745 156 HD22 LEU 19 1HD2 LEU 19 3.084 -15.758 9.669 157 HD23 LEU 19 2HD2 LEU 19 1.966 -14.669 10.490 158 H GLU 20 H GLU 20 -3.225 -14.669 8.616 159 HA GLU 20 HA GLU 20 -3.118 -12.871 6.448 160 HB2 GLU 20 2HB GLU 20 -4.901 -14.767 7.338 161 HB3 GLU 20 3HB GLU 20 -5.777 -13.268 7.614 162 HG2 GLU 20 2HG GLU 20 -5.303 -12.655 5.236 163 HG3 GLU 20 3HG GLU 20 -4.661 -14.282 5.014 164 H ARG 21 H ARG 21 -4.766 -12.537 9.595 165 HA ARG 21 HA ARG 21 -5.563 -9.884 9.280 166 HB2 ARG 21 2HB ARG 21 -5.867 -9.840 11.686 167 HB3 ARG 21 3HB ARG 21 -6.397 -11.392 11.052 168 HG2 ARG 21 2HG ARG 21 -4.549 -12.516 11.932 169 HG3 ARG 21 3HG ARG 21 -3.644 -11.020 12.173 170 HD2 ARG 21 2HD ARG 21 -6.222 -11.244 13.598 171 HD3 ARG 21 3HD ARG 21 -4.930 -12.312 14.146 172 HE ARG 21 HE ARG 21 -3.709 -9.913 14.038 173 HH11 ARG 21 1HH1 ARG 21 -6.686 -10.987 15.488 174 HH12 ARG 21 2HH1 ARG 21 -6.627 -9.830 16.777 175 HH21 ARG 21 1HH2 ARG 21 -3.621 -8.385 15.729 176 HH22 ARG 21 2HH2 ARG 21 -4.884 -8.350 16.912 177 H ALA 22 H ALA 22 -2.470 -11.233 10.056 178 HA ALA 22 HA ALA 22 -1.303 -8.949 11.259 179 HB1 ALA 22 1HB ALA 22 0.560 -10.619 9.774 180 HB2 ALA 22 2HB ALA 22 0.479 -10.269 11.502 181 HB3 ALA 22 3HB ALA 22 -0.520 -11.550 10.814 182 H LEU 23 H LEU 23 -1.571 -10.054 7.921 183 HA LEU 23 HA LEU 23 0.094 -7.948 6.886 184 HB2 LEU 23 2HB LEU 23 -1.812 -9.722 5.375 185 HB3 LEU 23 3HB LEU 23 -0.458 -8.806 4.717 186 HG LEU 23 HG LEU 23 -0.077 -11.040 6.695 187 HD11 LEU 23 1HD1 LEU 23 -0.061 -11.229 3.686 188 HD12 LEU 23 2HD1 LEU 23 -1.277 -11.925 4.756 189 HD13 LEU 23 3HD1 LEU 23 0.385 -12.510 4.813 190 HD21 LEU 23 3HD2 LEU 23 1.846 -9.689 6.546 191 HD22 LEU 23 1HD2 LEU 23 1.699 -9.531 4.795 192 HD23 LEU 23 2HD2 LEU 23 2.166 -11.077 5.505 193 H ALA 24 H ALA 24 -3.363 -8.577 7.173 194 HA ALA 24 HA ALA 24 -4.408 -6.577 5.589 195 HB1 ALA 24 1HB ALA 24 -5.367 -7.807 8.149 196 HB2 ALA 24 2HB ALA 24 -6.292 -6.544 7.336 197 HB3 ALA 24 3HB ALA 24 -5.953 -8.062 6.505 198 H GLY 25 H GLY 25 -3.413 -6.342 9.001 199 HA2 GLY 25 2HA GLY 25 -3.897 -3.478 9.011 200 HA3 GLY 25 3HA GLY 25 -3.329 -4.447 10.363 201 H ALA 26 H ALA 26 -1.450 -5.330 7.838 202 HA ALA 26 HA ALA 26 0.688 -3.518 8.688 203 HB1 ALA 26 1HB ALA 26 2.212 -5.143 7.667 204 HB2 ALA 26 2HB ALA 26 1.158 -5.898 8.864 205 HB3 ALA 26 3HB ALA 26 0.830 -6.105 7.143 206 H GLY 27 H GLY 27 -1.470 -3.996 6.124 207 HA2 GLY 27 2HA GLY 27 -1.735 -2.615 4.263 208 HA3 GLY 27 3HA GLY 27 -0.144 -1.936 4.571 209 H LEU 28 H LEU 28 -0.819 -5.372 4.297 210 HA LEU 28 HA LEU 28 0.423 -5.409 1.640 211 HB2 LEU 28 2HB LEU 28 1.199 -7.591 3.467 212 HB3 LEU 28 3HB LEU 28 2.127 -6.783 2.204 213 HG LEU 28 HG LEU 28 1.573 -5.582 4.914 214 HD11 LEU 28 1HD1 LEU 28 3.329 -6.641 5.789 215 HD12 LEU 28 2HD1 LEU 28 4.303 -6.411 4.337 216 HD13 LEU 28 3HD1 LEU 28 3.175 -7.762 4.436 217 HD21 LEU 28 3HD2 LEU 28 2.689 -4.581 2.460 218 HD22 LEU 28 1HD2 LEU 28 3.895 -4.547 3.746 219 HD23 LEU 28 2HD2 LEU 28 2.348 -3.729 3.967 220 H THR 29 H THR 29 -0.335 -6.964 0.270 221 HA THR 29 HA THR 29 -2.877 -7.977 0.564 222 HB THR 29 HB THR 29 -0.769 -9.385 -1.069 223 HG1 THR 29 HG1 THR 29 -2.207 -7.000 -1.688 224 HG21 THR 29 3HG2 THR 29 -2.932 -9.344 -2.617 225 HG22 THR 29 1HG2 THR 29 -3.737 -9.237 -1.052 226 HG23 THR 29 2HG2 THR 29 -2.675 -10.600 -1.406 227 H CYS 30 H CYS 30 -3.653 -10.177 0.795 228 HA CYS 30 HA CYS 30 -1.901 -12.029 2.209 229 HB2 CYS 30 2HB CYS 30 -3.690 -12.359 3.971 230 HB3 CYS 30 3HB CYS 30 -2.801 -10.844 4.067 231 HG CYS 30 HG CYS 30 -6.031 -11.343 3.122 232 H THR 31 H THR 31 -2.104 -13.880 1.157 233 HA THR 31 HA THR 31 -4.790 -14.711 0.274 234 HB THR 31 HB THR 31 -2.182 -15.051 -1.216 235 HG1 THR 31 HG1 THR 31 -4.564 -13.952 -2.254 236 HG21 THR 31 3HG2 THR 31 -4.904 -16.219 -1.807 237 HG22 THR 31 1HG2 THR 31 -3.446 -17.115 -1.385 238 HG23 THR 31 2HG2 THR 31 -3.532 -16.241 -2.914 239 H THR 32 H THR 32 -5.385 -16.379 1.488 240 HA THR 32 HA THR 32 -3.346 -18.333 2.316 241 HB THR 32 HB THR 32 -4.685 -18.907 4.181 242 HG1 THR 32 HG1 THR 32 -6.754 -17.300 3.050 243 HG21 THR 32 3HG2 THR 32 -5.419 -16.111 4.437 244 HG22 THR 32 1HG2 THR 32 -3.786 -16.308 3.803 245 HG23 THR 32 2HG2 THR 32 -4.231 -17.050 5.340 246 H PHE 33 H PHE 33 -3.408 -20.328 1.512 247 HA PHE 33 HA PHE 33 -5.680 -21.079 -0.172 248 HB2 PHE 33 2HB PHE 33 -2.908 -22.260 0.091 249 HB3 PHE 33 3HB PHE 33 -4.157 -22.890 -0.977 250 HD1 PHE 33 HD1 PHE 33 -1.979 -19.990 -0.306 251 HD2 PHE 33 HD2 PHE 33 -4.601 -21.889 -3.069 252 HE1 PHE 33 HE1 PHE 33 -1.261 -18.422 -2.060 253 HE2 PHE 33 HE2 PHE 33 -3.886 -20.325 -4.828 254 HZ PHE 33 HZ PHE 33 -2.213 -18.589 -4.325 255 H GLU 34 H GLU 34 -3.605 -23.472 1.258 256 HA GLU 34 HA GLU 34 -5.005 -24.188 3.531 257 HB2 GLU 34 2HB GLU 34 -6.268 -26.203 2.568 258 HB3 GLU 34 3HB GLU 34 -6.991 -24.614 2.365 259 HG2 GLU 34 2HG GLU 34 -6.033 -24.533 0.077 260 HG3 GLU 34 3HG GLU 34 -5.480 -26.192 0.297 261 H ASN 35 H ASN 35 -3.639 -25.665 0.598 262 HA ASN 35 HA ASN 35 -1.932 -27.319 2.341 263 HB2 ASN 35 2HB ASN 35 -3.466 -27.983 -0.114 264 HB3 ASN 35 3HB ASN 35 -1.870 -28.711 0.043 265 HD21 ASN 35 1HD2 ASN 35 -1.547 -29.419 2.509 266 HD22 ASN 35 2HD2 ASN 35 -2.802 -30.462 3.080 267 H GLY 36 H GLY 36 0.147 -27.985 1.279 268 HA2 GLY 36 2HA GLY 36 1.512 -25.647 0.359 269 HA3 GLY 36 3HA GLY 36 2.206 -27.250 0.548 270 H ASN 37 H ASN 37 0.552 -28.695 -1.178 271 HA ASN 37 HA ASN 37 1.823 -28.318 -3.631 272 HB2 ASN 37 2HB ASN 37 0.503 -30.365 -2.664 273 HB3 ASN 37 3HB ASN 37 -0.869 -29.630 -3.488 274 HD21 ASN 37 1HD2 ASN 37 0.836 -32.111 -3.901 275 HD22 ASN 37 2HD2 ASN 37 1.234 -32.062 -5.581 276 H GLU 38 H GLU 38 -0.883 -26.714 -2.278 277 HA GLU 38 HA GLU 38 -1.942 -25.822 -4.825 278 HB2 GLU 38 2HB GLU 38 -2.764 -24.588 -2.236 279 HB3 GLU 38 3HB GLU 38 -3.734 -24.967 -3.652 280 HG2 GLU 38 2HG GLU 38 -2.690 -26.914 -1.611 281 HG3 GLU 38 3HG GLU 38 -4.362 -26.401 -1.830 282 H VAL 39 H VAL 39 0.496 -24.875 -2.682 283 HA VAL 39 HA VAL 39 0.358 -22.044 -3.242 284 HB VAL 39 HB VAL 39 2.713 -23.472 -2.029 285 HG11 VAL 39 1HG1 VAL 39 1.659 -20.754 -1.333 286 HG12 VAL 39 2HG1 VAL 39 3.283 -21.409 -1.110 287 HG13 VAL 39 3HG1 VAL 39 2.711 -20.994 -2.727 288 HG21 VAL 39 3HG2 VAL 39 1.671 -23.121 0.172 289 HG22 VAL 39 1HG2 VAL 39 0.198 -22.572 -0.627 290 HG23 VAL 39 2HG2 VAL 39 0.743 -24.237 -0.830 291 H LEU 40 H LEU 40 2.412 -24.777 -4.180 292 HA LEU 40 HA LEU 40 4.337 -23.467 -5.657 293 HB2 LEU 40 2HB LEU 40 3.166 -26.165 -5.644 294 HB3 LEU 40 3HB LEU 40 3.965 -25.703 -7.145 295 HG LEU 40 HG LEU 40 5.965 -25.092 -5.632 296 HD11 LEU 40 1HD1 LEU 40 6.098 -26.403 -3.570 297 HD12 LEU 40 2HD1 LEU 40 4.427 -26.919 -3.792 298 HD13 LEU 40 3HD1 LEU 40 4.793 -25.218 -3.506 299 HD21 LEU 40 3HD2 LEU 40 6.838 -26.952 -6.480 300 HD22 LEU 40 1HD2 LEU 40 5.215 -27.391 -7.012 301 HD23 LEU 40 2HD2 LEU 40 5.820 -27.970 -5.459 302 H ALA 41 H ALA 41 1.409 -24.975 -7.037 303 HA ALA 41 HA ALA 41 1.649 -23.919 -9.595 304 HB1 ALA 41 1HB ALA 41 -0.848 -24.276 -9.724 305 HB2 ALA 41 2HB ALA 41 0.110 -25.680 -9.250 306 HB3 ALA 41 3HB ALA 41 -0.776 -24.765 -8.030 307 H ALA 42 H ALA 42 0.600 -22.414 -6.660 308 HA ALA 42 HA ALA 42 -0.887 -20.280 -7.774 309 HB1 ALA 42 1HB ALA 42 -0.942 -19.372 -5.640 310 HB2 ALA 42 2HB ALA 42 -0.761 -21.099 -5.329 311 HB3 ALA 42 3HB ALA 42 0.637 -20.030 -5.210 312 H LEU 43 H LEU 43 2.528 -20.638 -6.911 313 HA LEU 43 HA LEU 43 3.396 -18.038 -7.266 314 HB2 LEU 43 2HB LEU 43 4.936 -20.471 -8.140 315 HB3 LEU 43 3HB LEU 43 5.585 -18.922 -7.603 316 HG LEU 43 HG LEU 43 4.104 -20.883 -5.851 317 HD11 LEU 43 1HD1 LEU 43 6.159 -21.580 -4.988 318 HD12 LEU 43 2HD1 LEU 43 7.031 -20.241 -5.733 319 HD13 LEU 43 3HD1 LEU 43 6.408 -21.553 -6.734 320 HD21 LEU 43 3HD2 LEU 43 5.800 -18.755 -4.718 321 HD22 LEU 43 1HD2 LEU 43 4.259 -19.404 -4.156 322 HD23 LEU 43 2HD2 LEU 43 4.293 -18.224 -5.467 323 H ALA 44 H ALA 44 2.812 -20.538 -9.685 324 HA ALA 44 HA ALA 44 3.936 -19.349 -11.918 325 HB1 ALA 44 1HB ALA 44 1.523 -21.117 -11.628 326 HB2 ALA 44 2HB ALA 44 2.140 -20.599 -13.198 327 HB3 ALA 44 3HB ALA 44 3.155 -21.563 -12.125 328 H SER 45 H SER 45 1.147 -18.417 -10.126 329 HA SER 45 HA SER 45 -0.027 -16.846 -12.242 330 HB2 SER 45 2HB SER 45 -1.268 -17.967 -10.279 331 HB3 SER 45 3HB SER 45 -0.703 -16.602 -9.316 332 HG SER 45 HG SER 45 -1.862 -15.224 -10.589 333 H LYS 46 H LYS 46 1.905 -16.261 -9.345 334 HA LYS 46 HA LYS 46 3.178 -13.992 -10.358 335 HB2 LYS 46 2HB LYS 46 2.112 -12.267 -8.844 336 HB3 LYS 46 3HB LYS 46 1.142 -12.778 -10.220 337 HG2 LYS 46 2HG LYS 46 -0.514 -13.253 -8.836 338 HG3 LYS 46 3HG LYS 46 0.489 -14.500 -8.092 339 HD2 LYS 46 2HD LYS 46 -0.300 -12.975 -6.391 340 HD3 LYS 46 3HD LYS 46 1.444 -12.785 -6.589 341 HE2 LYS 46 2HE LYS 46 0.166 -10.641 -6.386 342 HE3 LYS 46 3HE LYS 46 1.160 -10.775 -7.835 343 HZ1 LYS 46 3HZ LYS 46 -1.350 -9.991 -7.910 344 HZ2 LYS 46 1HZ LYS 46 -1.612 -11.657 -8.042 345 HZ3 LYS 46 2HZ LYS 46 -0.643 -10.862 -9.177 346 H THR 47 H THR 47 4.997 -14.833 -9.438 347 HA THR 47 HA THR 47 5.368 -15.999 -7.000 348 HB THR 47 HB THR 47 7.566 -14.180 -7.523 349 HG1 THR 47 HG1 THR 47 6.930 -15.896 -9.689 350 HG21 THR 47 3HG2 THR 47 8.025 -16.175 -6.369 351 HG22 THR 47 1HG2 THR 47 8.687 -16.438 -7.981 352 HG23 THR 47 2HG2 THR 47 7.139 -17.156 -7.535 353 HA PRO 48 HA PRO 48 4.254 -12.733 -4.175 354 HB2 PRO 48 2HB PRO 48 4.729 -14.157 -1.914 355 HB3 PRO 48 3HB PRO 48 3.279 -14.376 -2.900 356 HG2 PRO 48 2HG PRO 48 5.791 -16.003 -2.839 357 HG3 PRO 48 3HG PRO 48 4.106 -16.549 -2.908 358 HD2 PRO 48 2HD PRO 48 5.697 -16.457 -5.096 359 HD3 PRO 48 3HD PRO 48 3.946 -16.178 -5.177 360 H ASP 49 H ASP 49 5.320 -11.862 -2.090 361 HA ASP 49 HA ASP 49 8.124 -11.377 -2.711 362 HB2 ASP 49 2HB ASP 49 6.103 -9.727 -1.843 363 HB3 ASP 49 3HB ASP 49 7.004 -10.029 -0.359 364 H VAL 50 H VAL 50 6.226 -13.227 -0.556 365 HA VAL 50 HA VAL 50 8.400 -14.596 0.544 366 HB VAL 50 HB VAL 50 8.889 -12.563 1.777 367 HG11 VAL 50 1HG1 VAL 50 6.162 -12.182 1.804 368 HG12 VAL 50 2HG1 VAL 50 6.534 -12.569 3.485 369 HG13 VAL 50 3HG1 VAL 50 7.351 -11.225 2.687 370 HG21 VAL 50 3HG2 VAL 50 9.351 -14.638 2.913 371 HG22 VAL 50 1HG2 VAL 50 8.754 -13.462 4.083 372 HG23 VAL 50 2HG2 VAL 50 7.688 -14.735 3.491 373 H LEU 51 H LEU 51 7.644 -16.510 1.176 374 HA LEU 51 HA LEU 51 4.773 -16.771 1.688 375 HB2 LEU 51 2HB LEU 51 6.639 -18.290 0.232 376 HB3 LEU 51 3HB LEU 51 6.170 -19.275 1.615 377 HG LEU 51 HG LEU 51 3.953 -18.035 0.115 378 HD11 LEU 51 1HD1 LEU 51 5.854 -18.949 -1.502 379 HD12 LEU 51 2HD1 LEU 51 4.138 -19.176 -1.838 380 HD13 LEU 51 3HD1 LEU 51 5.076 -20.484 -1.117 381 HD21 LEU 51 3HD2 LEU 51 2.789 -19.786 0.931 382 HD22 LEU 51 1HD2 LEU 51 4.133 -19.878 2.070 383 HD23 LEU 51 2HD2 LEU 51 4.103 -20.929 0.654 384 H LEU 52 H LEU 52 4.009 -18.100 3.429 385 HA LEU 52 HA LEU 52 5.916 -18.549 5.610 386 HB2 LEU 52 2HB LEU 52 3.446 -16.868 5.680 387 HB3 LEU 52 3HB LEU 52 3.981 -17.710 7.133 388 HG LEU 52 HG LEU 52 6.204 -16.512 6.824 389 HD11 LEU 52 1HD1 LEU 52 4.715 -15.474 4.550 390 HD12 LEU 52 2HD1 LEU 52 6.447 -15.448 4.881 391 HD13 LEU 52 3HD1 LEU 52 5.399 -14.206 5.566 392 HD21 LEU 52 3HD2 LEU 52 4.765 -15.843 8.587 393 HD22 LEU 52 1HD2 LEU 52 3.660 -15.039 7.473 394 HD23 LEU 52 2HD2 LEU 52 5.267 -14.369 7.758 395 H SER 53 H SER 53 5.666 -20.767 4.928 396 HA SER 53 HA SER 53 3.069 -22.010 5.242 397 HB2 SER 53 2HB SER 53 4.096 -24.011 4.447 398 HB3 SER 53 3HB SER 53 4.786 -22.695 3.497 399 HG SER 53 HG SER 53 6.633 -22.790 4.763 400 H ASP 54 H ASP 54 2.659 -23.754 6.714 401 HA ASP 54 HA ASP 54 4.338 -23.688 9.134 402 HB2 ASP 54 2HB ASP 54 1.842 -22.620 9.024 403 HB3 ASP 54 3HB ASP 54 1.468 -24.271 9.510 404 H ILE 55 H ILE 55 5.171 -25.604 9.595 405 HA ILE 55 HA ILE 55 4.244 -27.986 8.279 406 HB ILE 55 HB ILE 55 6.349 -27.702 10.427 407 HG12 ILE 55 2HG1 ILE 55 6.941 -28.063 7.513 408 HG13 ILE 55 3HG1 ILE 55 6.566 -26.455 8.122 409 HG21 ILE 55 1HG2 ILE 55 5.438 -29.981 10.144 410 HG22 ILE 55 2HG2 ILE 55 5.896 -29.926 8.443 411 HG23 ILE 55 3HG2 ILE 55 7.138 -29.863 9.693 412 HD11 ILE 55 3HD1 ILE 55 9.027 -27.245 7.974 413 HD12 ILE 55 1HD1 ILE 55 8.481 -26.346 9.390 414 HD13 ILE 55 2HD1 ILE 55 8.654 -28.100 9.470 415 H ARG 56 H ARG 56 2.323 -28.732 8.992 416 HA ARG 56 HA ARG 56 2.140 -30.162 11.379 417 HB2 ARG 56 2HB ARG 56 0.410 -28.724 12.543 418 HB3 ARG 56 3HB ARG 56 2.066 -28.136 12.610 419 HG2 ARG 56 2HG ARG 56 1.550 -26.602 10.737 420 HG3 ARG 56 3HG ARG 56 -0.130 -27.138 10.810 421 HD2 ARG 56 2HD ARG 56 1.294 -26.018 13.206 422 HD3 ARG 56 3HD ARG 56 0.477 -24.981 12.037 423 HE ARG 56 HE ARG 56 -1.574 -25.786 12.778 424 HH11 ARG 56 1HH1 ARG 56 1.062 -27.446 14.332 425 HH12 ARG 56 2HH1 ARG 56 0.065 -28.157 15.557 426 HH21 ARG 56 1HH2 ARG 56 -2.898 -26.716 14.386 427 HH22 ARG 56 2HH2 ARG 56 -2.188 -27.742 15.586 428 H MET 57 H MET 57 1.486 -31.261 9.252 429 HA MET 57 HA MET 57 -1.321 -31.698 9.329 430 HB2 MET 57 2HB MET 57 -1.701 -31.081 6.897 431 HB3 MET 57 3HB MET 57 -1.566 -29.739 8.025 432 HG2 MET 57 2HG MET 57 0.347 -28.981 7.112 433 HG3 MET 57 3HG MET 57 0.939 -30.599 6.741 434 HE1 MET 57 3HE MET 57 1.098 -27.912 5.336 435 HE2 MET 57 1HE MET 57 1.582 -28.900 3.957 436 HE3 MET 57 2HE MET 57 0.244 -27.762 3.799 437 HA PRO 58 HA PRO 58 0.026 -35.572 7.752 438 HB2 PRO 58 2HB PRO 58 -2.299 -36.501 6.701 439 HB3 PRO 58 3HB PRO 58 -2.002 -36.405 8.441 440 HG2 PRO 58 2HG PRO 58 -3.522 -34.527 6.672 441 HG3 PRO 58 3HG PRO 58 -3.938 -35.125 8.289 442 HD2 PRO 58 2HD PRO 58 -2.868 -32.673 7.874 443 HD3 PRO 58 3HD PRO 58 -2.548 -33.618 9.342 444 H GLY 59 H GLY 59 -1.078 -33.065 5.734 445 HA2 GLY 59 2HA GLY 59 -1.104 -34.353 3.223 446 HA3 GLY 59 3HA GLY 59 -0.852 -32.635 3.490 447 H MET 60 H MET 60 1.079 -31.824 2.995 448 HA MET 60 HA MET 60 3.208 -33.684 2.274 449 HB2 MET 60 2HB MET 60 3.320 -30.703 1.917 450 HB3 MET 60 3HB MET 60 4.149 -31.952 0.997 451 HG2 MET 60 2HG MET 60 1.483 -32.522 0.596 452 HG3 MET 60 3HG MET 60 1.537 -30.761 0.593 453 HE1 MET 60 3HE MET 60 2.899 -29.580 -2.335 454 HE2 MET 60 1HE MET 60 2.942 -29.405 -0.580 455 HE3 MET 60 2HE MET 60 4.375 -29.959 -1.446 456 H ASP 61 H ASP 61 2.399 -32.822 5.088 457 HA ASP 61 HA ASP 61 3.520 -32.636 7.069 458 HB2 ASP 61 2HB ASP 61 5.366 -33.830 5.604 459 HB3 ASP 61 3HB ASP 61 6.156 -32.259 5.712 460 H GLY 62 H GLY 62 5.268 -30.593 4.714 461 HA2 GLY 62 2HA GLY 62 4.301 -28.146 5.153 462 HA3 GLY 62 3HA GLY 62 5.244 -28.389 6.616 463 H LEU 63 H LEU 63 7.497 -29.577 5.827 464 HA LEU 63 HA LEU 63 8.810 -27.473 4.337 465 HB2 LEU 63 2HB LEU 63 10.837 -29.039 4.833 466 HB3 LEU 63 3HB LEU 63 10.118 -28.068 6.116 467 HG LEU 63 HG LEU 63 8.999 -29.982 7.025 468 HD11 LEU 63 1HD1 LEU 63 9.825 -31.264 4.462 469 HD12 LEU 63 2HD1 LEU 63 8.268 -31.297 5.288 470 HD13 LEU 63 3HD1 LEU 63 9.612 -32.256 5.904 471 HD21 LEU 63 3HD2 LEU 63 11.081 -31.551 7.258 472 HD22 LEU 63 1HD2 LEU 63 11.099 -29.931 7.956 473 HD23 LEU 63 2HD2 LEU 63 11.909 -30.238 6.419 474 H ALA 64 H ALA 64 7.474 -30.528 3.680 475 HA ALA 64 HA ALA 64 9.036 -31.696 1.780 476 HB1 ALA 64 1HB ALA 64 6.980 -32.540 0.743 477 HB2 ALA 64 2HB ALA 64 6.916 -32.638 2.504 478 HB3 ALA 64 3HB ALA 64 6.042 -31.360 1.659 479 H LEU 65 H LEU 65 6.524 -29.268 1.037 480 HA LEU 65 HA LEU 65 7.410 -28.924 -1.647 481 HB2 LEU 65 2HB LEU 65 5.608 -27.582 -1.906 482 HB3 LEU 65 3HB LEU 65 5.109 -28.405 -0.429 483 HG LEU 65 HG LEU 65 6.440 -25.699 -0.493 484 HD11 LEU 65 1HD1 LEU 65 3.806 -26.380 -1.236 485 HD12 LEU 65 2HD1 LEU 65 4.489 -24.774 -0.986 486 HD13 LEU 65 3HD1 LEU 65 3.719 -25.623 0.355 487 HD21 LEU 65 3HD2 LEU 65 6.259 -27.461 1.573 488 HD22 LEU 65 1HD2 LEU 65 4.785 -26.515 1.785 489 HD23 LEU 65 2HD2 LEU 65 6.353 -25.708 1.749 490 H LEU 66 H LEU 66 8.180 -27.416 1.393 491 HA LEU 66 HA LEU 66 9.296 -25.018 0.468 492 HB2 LEU 66 2HB LEU 66 8.857 -26.093 2.900 493 HB3 LEU 66 3HB LEU 66 10.600 -26.318 2.773 494 HG LEU 66 HG LEU 66 10.424 -24.295 3.877 495 HD11 LEU 66 1HD1 LEU 66 11.230 -22.629 2.394 496 HD12 LEU 66 2HD1 LEU 66 10.431 -23.377 1.011 497 HD13 LEU 66 3HD1 LEU 66 11.801 -24.181 1.779 498 HD21 LEU 66 3HD2 LEU 66 8.796 -22.605 3.481 499 HD22 LEU 66 1HD2 LEU 66 7.943 -24.147 3.538 500 HD23 LEU 66 2HD2 LEU 66 8.267 -23.376 1.985 501 H LYS 67 H LYS 67 10.663 -28.246 0.816 502 HA LYS 67 HA LYS 67 13.354 -27.667 0.418 503 HB2 LYS 67 2HB LYS 67 11.752 -30.092 -0.411 504 HB3 LYS 67 3HB LYS 67 13.507 -30.009 -0.474 505 HG2 LYS 67 2HG LYS 67 11.892 -29.629 2.036 506 HG3 LYS 67 3HG LYS 67 12.603 -31.164 1.531 507 HD2 LYS 67 2HD LYS 67 14.178 -28.630 1.970 508 HD3 LYS 67 3HD LYS 67 13.971 -29.890 3.188 509 HE2 LYS 67 2HE LYS 67 15.858 -30.740 2.322 510 HE3 LYS 67 3HE LYS 67 14.806 -31.340 1.041 511 HZ1 LYS 67 3HZ LYS 67 15.429 -28.748 0.347 512 HZ2 LYS 67 1HZ LYS 67 16.030 -30.162 -0.361 513 HZ3 LYS 67 2HZ LYS 67 16.884 -29.415 0.893 514 H GLN 68 H GLN 68 10.728 -27.940 -1.888 515 HA GLN 68 HA GLN 68 12.521 -27.749 -4.162 516 HB2 GLN 68 2HB GLN 68 10.783 -28.465 -5.415 517 HB3 GLN 68 3HB GLN 68 10.106 -28.937 -3.862 518 HG2 GLN 68 2HG GLN 68 8.347 -27.808 -4.785 519 HG3 GLN 68 3HG GLN 68 9.132 -26.519 -3.873 520 HE21 GLN 68 1HE2 GLN 68 8.045 -25.062 -5.305 521 HE22 GLN 68 2HE2 GLN 68 8.697 -24.737 -6.871 522 H ILE 69 H ILE 69 10.516 -25.687 -2.219 523 HA ILE 69 HA ILE 69 10.100 -23.538 -3.931 524 HB ILE 69 HB ILE 69 10.457 -23.673 -0.950 525 HG12 ILE 69 2HG1 ILE 69 8.062 -22.956 -2.651 526 HG13 ILE 69 3HG1 ILE 69 8.391 -24.575 -2.045 527 HG21 ILE 69 1HG2 ILE 69 11.197 -21.516 -1.231 528 HG22 ILE 69 2HG2 ILE 69 10.248 -21.267 -2.696 529 HG23 ILE 69 3HG2 ILE 69 9.456 -21.260 -1.120 530 HD11 ILE 69 3HD1 ILE 69 7.585 -24.095 -0.029 531 HD12 ILE 69 1HD1 ILE 69 8.425 -22.546 0.039 532 HD13 ILE 69 2HD1 ILE 69 6.877 -22.674 -0.797 533 H LYS 70 H LYS 70 12.980 -24.552 -2.258 534 HA LYS 70 HA LYS 70 14.402 -22.088 -2.594 535 HB2 LYS 70 2HB LYS 70 15.600 -24.818 -2.122 536 HB3 LYS 70 3HB LYS 70 16.304 -23.254 -1.732 537 HG2 LYS 70 2HG LYS 70 13.827 -24.388 -0.449 538 HG3 LYS 70 3HG LYS 70 15.450 -24.461 0.240 539 HD2 LYS 70 2HD LYS 70 13.937 -21.937 -0.433 540 HD3 LYS 70 3HD LYS 70 14.138 -22.614 1.185 541 HE2 LYS 70 2HE LYS 70 15.868 -21.148 1.229 542 HE3 LYS 70 3HE LYS 70 16.704 -22.499 0.465 543 HZ1 LYS 70 3HZ LYS 70 15.333 -20.762 -1.383 544 HZ2 LYS 70 1HZ LYS 70 16.903 -21.389 -1.448 545 HZ3 LYS 70 2HZ LYS 70 16.583 -20.004 -0.533 546 H GLN 71 H GLN 71 14.468 -25.246 -4.227 547 HA GLN 71 HA GLN 71 16.415 -24.474 -6.150 548 HB2 GLN 71 2HB GLN 71 14.509 -26.775 -5.892 549 HB3 GLN 71 3HB GLN 71 15.416 -26.542 -7.380 550 HG2 GLN 71 2HG GLN 71 17.501 -26.521 -5.963 551 HG3 GLN 71 3HG GLN 71 16.489 -27.063 -4.625 552 HE21 GLN 71 1HE2 GLN 71 16.679 -27.896 -8.071 553 HE22 GLN 71 2HE2 GLN 71 16.849 -29.597 -7.825 554 H ARG 72 H ARG 72 12.955 -24.202 -5.953 555 HA ARG 72 HA ARG 72 12.689 -23.525 -8.767 556 HB2 ARG 72 2HB ARG 72 10.971 -24.612 -6.856 557 HB3 ARG 72 3HB ARG 72 10.351 -22.990 -7.134 558 HG2 ARG 72 2HG ARG 72 11.032 -24.478 -9.567 559 HG3 ARG 72 3HG ARG 72 9.712 -25.161 -8.616 560 HD2 ARG 72 2HD ARG 72 8.648 -23.686 -10.078 561 HD3 ARG 72 3HD ARG 72 8.771 -22.777 -8.572 562 HE ARG 72 HE ARG 72 10.208 -21.312 -9.603 563 HH11 ARG 72 1HH1 ARG 72 9.799 -24.139 -11.593 564 HH12 ARG 72 2HH1 ARG 72 10.617 -23.456 -12.959 565 HH21 ARG 72 1HH2 ARG 72 11.287 -20.402 -11.394 566 HH22 ARG 72 2HH2 ARG 72 11.464 -21.330 -12.844 567 H HIS 73 H HIS 73 13.018 -21.955 -5.703 568 HA HIS 73 HA HIS 73 13.134 -19.375 -7.029 569 HB2 HIS 73 2HB HIS 73 11.277 -19.821 -4.683 570 HB3 HIS 73 3HB HIS 73 11.570 -18.292 -5.507 571 HD1 HIS 73 HD1 HIS 73 10.629 -18.105 -7.980 572 HD2 HIS 73 HD2 HIS 73 9.359 -21.424 -5.827 573 HE1 HIS 73 HE1 HIS 73 8.645 -19.003 -9.237 574 HA PRO 74 HA PRO 74 16.274 -20.077 -3.670 575 HB2 PRO 74 2HB PRO 74 18.407 -19.353 -5.185 576 HB3 PRO 74 3HB PRO 74 17.771 -21.002 -5.147 577 HG2 PRO 74 2HG PRO 74 17.313 -18.841 -7.168 578 HG3 PRO 74 3HG PRO 74 17.632 -20.566 -7.427 579 HD2 PRO 74 2HD PRO 74 15.144 -19.507 -7.569 580 HD3 PRO 74 3HD PRO 74 15.447 -21.163 -7.003 581 H MET 75 H MET 75 15.111 -17.510 -5.553 582 HA MET 75 HA MET 75 16.674 -15.531 -4.044 583 HB2 MET 75 2HB MET 75 15.964 -13.909 -5.733 584 HB3 MET 75 3HB MET 75 16.764 -15.286 -6.479 585 HG2 MET 75 2HG MET 75 14.999 -15.699 -7.742 586 HG3 MET 75 3HG MET 75 13.946 -15.766 -6.331 587 HE1 MET 75 3HE MET 75 12.863 -13.913 -5.241 588 HE2 MET 75 1HE MET 75 12.239 -12.497 -6.087 589 HE3 MET 75 2HE MET 75 11.720 -14.112 -6.570 590 H LEU 76 H LEU 76 13.741 -17.085 -3.999 591 HA LEU 76 HA LEU 76 12.242 -14.800 -2.965 592 HB2 LEU 76 2HB LEU 76 11.049 -16.166 -4.521 593 HB3 LEU 76 3HB LEU 76 11.451 -17.629 -3.626 594 HG LEU 76 HG LEU 76 10.067 -16.626 -1.721 595 HD11 LEU 76 1HD1 LEU 76 8.197 -15.181 -3.030 596 HD12 LEU 76 2HD1 LEU 76 9.662 -14.640 -3.849 597 HD13 LEU 76 3HD1 LEU 76 9.521 -14.479 -2.099 598 HD21 LEU 76 3HD2 LEU 76 8.652 -17.382 -4.275 599 HD22 LEU 76 1HD2 LEU 76 8.015 -17.515 -2.636 600 HD23 LEU 76 2HD2 LEU 76 9.372 -18.523 -3.138 601 HA PRO 77 HA PRO 77 13.412 -16.010 1.163 602 HB2 PRO 77 2HB PRO 77 11.988 -14.074 2.426 603 HB3 PRO 77 3HB PRO 77 13.532 -13.762 1.622 604 HG2 PRO 77 2HG PRO 77 10.749 -13.278 0.632 605 HG3 PRO 77 3HG PRO 77 12.178 -12.236 0.506 606 HD2 PRO 77 2HD PRO 77 11.308 -13.770 -1.549 607 HD3 PRO 77 3HD PRO 77 13.026 -13.403 -1.292 608 H VAL 78 H VAL 78 12.513 -17.334 2.651 609 HA VAL 78 HA VAL 78 9.585 -17.562 2.749 610 HB VAL 78 HB VAL 78 11.347 -19.999 2.839 611 HG11 VAL 78 1HG1 VAL 78 8.417 -19.452 2.696 612 HG12 VAL 78 2HG1 VAL 78 9.057 -20.948 2.013 613 HG13 VAL 78 3HG1 VAL 78 9.302 -20.581 3.721 614 HG21 VAL 78 3HG2 VAL 78 10.736 -20.415 0.494 615 HG22 VAL 78 1HG2 VAL 78 9.971 -18.828 0.423 616 HG23 VAL 78 2HG2 VAL 78 11.712 -18.957 0.673 617 H ILE 79 H ILE 79 8.808 -18.692 4.695 618 HA ILE 79 HA ILE 79 10.701 -18.633 6.937 619 HB ILE 79 HB ILE 79 7.929 -17.467 7.143 620 HG12 ILE 79 2HG1 ILE 79 10.560 -15.994 6.891 621 HG13 ILE 79 3HG1 ILE 79 9.344 -16.113 5.624 622 HG21 ILE 79 1HG2 ILE 79 8.759 -16.573 9.266 623 HG22 ILE 79 2HG2 ILE 79 8.854 -18.333 9.221 624 HG23 ILE 79 3HG2 ILE 79 10.310 -17.366 8.990 625 HD11 ILE 79 3HD1 ILE 79 9.511 -14.302 7.856 626 HD12 ILE 79 1HD1 ILE 79 8.490 -14.233 6.419 627 HD13 ILE 79 2HD1 ILE 79 7.965 -15.151 7.831 628 H ILE 80 H ILE 80 10.601 -20.423 8.119 629 HA ILE 80 HA ILE 80 8.422 -22.299 7.670 630 HB ILE 80 HB ILE 80 11.098 -22.522 9.017 631 HG12 ILE 80 2HG1 ILE 80 10.690 -22.773 6.482 632 HG13 ILE 80 3HG1 ILE 80 11.619 -24.029 7.294 633 HG21 ILE 80 1HG2 ILE 80 9.823 -23.761 10.518 634 HG22 ILE 80 2HG2 ILE 80 8.739 -24.351 9.259 635 HG23 ILE 80 3HG2 ILE 80 10.385 -24.973 9.367 636 HD11 ILE 80 3HD1 ILE 80 8.683 -24.211 6.669 637 HD12 ILE 80 1HD1 ILE 80 9.971 -24.902 5.682 638 HD13 ILE 80 2HD1 ILE 80 9.711 -25.484 7.326 639 H MET 81 H MET 81 6.987 -22.991 9.199 640 HA MET 81 HA MET 81 7.124 -21.701 11.842 641 HB2 MET 81 2HB MET 81 4.798 -21.940 9.958 642 HB3 MET 81 3HB MET 81 4.536 -21.789 11.691 643 HG2 MET 81 2HG MET 81 4.768 -19.599 11.554 644 HG3 MET 81 3HG MET 81 6.391 -19.794 10.899 645 HE1 MET 81 3HE MET 81 3.275 -21.238 8.873 646 HE2 MET 81 1HE MET 81 2.641 -20.046 10.007 647 HE3 MET 81 2HE MET 81 2.604 -19.720 8.274 648 H THR 82 H THR 82 7.059 -23.073 13.495 649 HA THR 82 HA THR 82 5.403 -25.336 13.669 650 HB THR 82 HB THR 82 6.688 -26.570 12.177 651 HG1 THR 82 HG1 THR 82 6.901 -28.071 13.646 652 HG21 THR 82 3HG2 THR 82 8.694 -24.678 12.766 653 HG22 THR 82 1HG2 THR 82 8.711 -25.916 11.511 654 HG23 THR 82 2HG2 THR 82 9.382 -26.266 13.104 655 H ALA 83 H ALA 83 8.740 -24.498 14.627 656 HA ALA 83 HA ALA 83 9.594 -23.951 16.686 657 HB1 ALA 83 1HB ALA 83 7.045 -24.460 18.121 658 HB2 ALA 83 2HB ALA 83 8.245 -23.189 18.358 659 HB3 ALA 83 3HB ALA 83 7.112 -23.092 17.010 660 H HIS 84 H HIS 84 7.047 -26.372 17.318 661 HA HIS 84 HA HIS 84 8.562 -27.906 19.103 662 HB2 HIS 84 2HB HIS 84 6.853 -29.569 18.917 663 HB3 HIS 84 3HB HIS 84 6.064 -28.000 18.787 664 HD1 HIS 84 HD1 HIS 84 6.155 -31.208 17.211 665 HD2 HIS 84 HD2 HIS 84 5.640 -27.300 15.896 666 HE1 HIS 84 HE1 HIS 84 5.078 -31.397 14.946 667 H SER 85 H SER 85 8.386 -30.533 18.201 668 HA SER 85 HA SER 85 10.811 -31.027 17.073 669 HB2 SER 85 2HB SER 85 9.573 -32.855 17.981 670 HB3 SER 85 3HB SER 85 8.250 -32.613 16.839 671 HG SER 85 HG SER 85 10.026 -34.321 16.480 672 H ASP 86 H ASP 86 11.433 -29.754 15.379 673 HA ASP 86 HA ASP 86 11.028 -30.566 12.790 674 HB2 ASP 86 2HB ASP 86 8.777 -29.073 13.738 675 HB3 ASP 86 3HB ASP 86 9.595 -28.134 12.493 676 H LEU 87 H LEU 87 11.568 -27.848 14.932 677 HA LEU 87 HA LEU 87 13.005 -26.249 13.069 678 HB2 LEU 87 2HB LEU 87 12.235 -26.124 15.845 679 HB3 LEU 87 3HB LEU 87 13.906 -25.604 15.634 680 HG LEU 87 HG LEU 87 13.258 -23.832 14.186 681 HD11 LEU 87 1HD1 LEU 87 10.535 -25.112 14.218 682 HD12 LEU 87 2HD1 LEU 87 11.596 -24.854 12.834 683 HD13 LEU 87 3HD1 LEU 87 10.836 -23.476 13.630 684 HD21 LEU 87 3HD2 LEU 87 11.493 -22.666 15.635 685 HD22 LEU 87 1HD2 LEU 87 13.012 -23.133 16.400 686 HD23 LEU 87 2HD2 LEU 87 11.564 -24.110 16.646 687 H ASP 88 H ASP 88 13.952 -28.609 15.523 688 HA ASP 88 HA ASP 88 16.670 -28.294 15.595 689 HB2 ASP 88 2HB ASP 88 14.877 -30.219 16.471 690 HB3 ASP 88 3HB ASP 88 15.949 -31.113 15.396 691 H ALA 89 H ALA 89 14.746 -29.843 13.088 692 HA ALA 89 HA ALA 89 17.104 -30.648 11.599 693 HB1 ALA 89 1HB ALA 89 15.727 -32.178 10.779 694 HB2 ALA 89 2HB ALA 89 14.393 -31.463 11.685 695 HB3 ALA 89 3HB ALA 89 14.739 -30.914 10.045 696 H ALA 90 H ALA 90 14.577 -28.202 11.446 697 HA ALA 90 HA ALA 90 15.186 -27.204 8.876 698 HB1 ALA 90 1HB ALA 90 13.087 -26.620 9.754 699 HB2 ALA 90 2HB ALA 90 13.790 -26.008 11.252 700 HB3 ALA 90 3HB ALA 90 14.014 -25.119 9.745 701 H VAL 91 H VAL 91 16.659 -26.754 11.979 702 HA VAL 91 HA VAL 91 17.908 -24.310 11.749 703 HB VAL 91 HB VAL 91 19.003 -26.850 12.961 704 HG11 VAL 91 1HG1 VAL 91 20.198 -24.218 12.620 705 HG12 VAL 91 2HG1 VAL 91 20.140 -24.736 14.306 706 HG13 VAL 91 3HG1 VAL 91 20.939 -25.744 13.098 707 HG21 VAL 91 3HG2 VAL 91 17.645 -26.466 14.679 708 HG22 VAL 91 1HG2 VAL 91 18.207 -24.799 14.810 709 HG23 VAL 91 2HG2 VAL 91 16.875 -25.197 13.726 710 H SER 92 H SER 92 19.331 -27.449 10.815 711 HA SER 92 HA SER 92 21.396 -26.093 9.295 712 HB2 SER 92 2HB SER 92 22.384 -27.919 10.263 713 HB3 SER 92 3HB SER 92 20.903 -28.875 10.225 714 HG SER 92 HG SER 92 22.388 -28.218 7.903 715 H ALA 93 H ALA 93 18.593 -28.156 8.701 716 HA ALA 93 HA ALA 93 18.947 -28.502 5.936 717 HB1 ALA 93 1HB ALA 93 17.412 -29.885 7.185 718 HB2 ALA 93 2HB ALA 93 16.410 -28.484 7.564 719 HB3 ALA 93 3HB ALA 93 16.541 -29.049 5.899 720 H TYR 94 H TYR 94 16.638 -26.317 7.563 721 HA TYR 94 HA TYR 94 15.895 -24.879 5.304 722 HB2 TYR 94 2HB TYR 94 14.958 -24.866 7.751 723 HB3 TYR 94 3HB TYR 94 16.075 -23.524 7.971 724 HD1 TYR 94 HD2 TYR 94 13.988 -24.423 5.017 725 HD2 TYR 94 HD1 TYR 94 14.735 -21.628 8.136 726 HE1 TYR 94 HE2 TYR 94 12.334 -22.892 4.033 727 HE2 TYR 94 HE1 TYR 94 13.082 -20.089 7.162 728 HH TYR 94 HH TYR 94 10.797 -20.856 5.187 729 H GLN 95 H GLN 95 18.815 -24.785 7.097 730 HA GLN 95 HA GLN 95 19.621 -22.134 6.459 731 HB2 GLN 95 2HB GLN 95 20.799 -24.489 7.737 732 HB3 GLN 95 3HB GLN 95 21.961 -23.535 6.826 733 HG2 GLN 95 2HG GLN 95 20.102 -22.243 8.782 734 HG3 GLN 95 3HG GLN 95 21.601 -23.006 9.311 735 HE21 GLN 95 1HE2 GLN 95 21.768 -20.629 9.995 736 HE22 GLN 95 2HE2 GLN 95 22.594 -19.589 8.891 737 H GLN 96 H GLN 96 18.983 -24.571 4.429 738 HA GLN 96 HA GLN 96 21.269 -24.520 2.713 739 HB2 GLN 96 2HB GLN 96 19.903 -25.801 1.166 740 HB3 GLN 96 3HB GLN 96 19.719 -26.436 2.795 741 HG2 GLN 96 2HG GLN 96 17.614 -25.082 2.976 742 HG3 GLN 96 3HG GLN 96 17.776 -24.742 1.254 743 HE21 GLN 96 1HE2 GLN 96 17.280 -27.249 3.642 744 HE22 GLN 96 2HE2 GLN 96 16.583 -28.406 2.564 745 H GLY 97 H GLY 97 20.059 -21.921 3.413 746 HA2 GLY 97 2HA GLY 97 20.346 -20.012 1.950 747 HA3 GLY 97 3HA GLY 97 19.636 -20.965 0.655 748 H ALA 98 H ALA 98 18.351 -20.858 3.915 749 HA ALA 98 HA ALA 98 15.996 -19.432 2.861 750 HB1 ALA 98 1HB ALA 98 15.895 -21.923 3.711 751 HB2 ALA 98 2HB ALA 98 15.793 -21.140 5.288 752 HB3 ALA 98 3HB ALA 98 14.589 -20.787 4.050 753 H PHE 99 H PHE 99 14.870 -18.020 4.325 754 HA PHE 99 HA PHE 99 16.692 -16.506 5.973 755 HB2 PHE 99 2HB PHE 99 15.267 -15.143 4.702 756 HB3 PHE 99 3HB PHE 99 13.851 -16.121 5.072 757 HD1 PHE 99 HD2 PHE 99 16.237 -13.671 6.460 758 HD2 PHE 99 HD1 PHE 99 12.513 -15.672 6.960 759 HE1 PHE 99 HE2 PHE 99 15.659 -12.131 8.290 760 HE2 PHE 99 HE1 PHE 99 11.929 -14.134 8.790 761 HZ PHE 99 HZ PHE 99 13.503 -12.362 9.458 762 H ASP 100 H ASP 100 16.366 -15.995 8.180 763 HA ASP 100 HA ASP 100 15.983 -18.027 9.927 764 HB2 ASP 100 2HB ASP 100 16.798 -15.677 10.433 765 HB3 ASP 100 3HB ASP 100 15.105 -15.212 10.574 766 H TYR 101 H TYR 101 14.340 -19.356 10.264 767 HA TYR 101 HA TYR 101 11.682 -18.769 9.426 768 HB2 TYR 101 2HB TYR 101 11.175 -20.957 10.651 769 HB3 TYR 101 3HB TYR 101 12.308 -21.041 9.306 770 HD1 TYR 101 HD2 TYR 101 12.617 -20.185 12.938 771 HD2 TYR 101 HD1 TYR 101 13.975 -22.579 9.693 772 HE1 TYR 101 HE2 TYR 101 14.282 -21.231 14.415 773 HE2 TYR 101 HE1 TYR 101 15.644 -23.632 11.162 774 HH TYR 101 HH TYR 101 15.596 -23.268 14.554 775 H LEU 102 H LEU 102 9.864 -19.412 11.120 776 HA LEU 102 HA LEU 102 10.371 -18.061 13.672 777 HB2 LEU 102 2HB LEU 102 9.408 -16.300 12.505 778 HB3 LEU 102 3HB LEU 102 8.316 -17.359 11.617 779 HG LEU 102 HG LEU 102 7.139 -17.736 13.853 780 HD11 LEU 102 1HD1 LEU 102 7.522 -15.419 15.168 781 HD12 LEU 102 2HD1 LEU 102 9.160 -15.725 14.590 782 HD13 LEU 102 3HD1 LEU 102 8.335 -16.929 15.581 783 HD21 LEU 102 3HD2 LEU 102 5.910 -16.507 12.344 784 HD22 LEU 102 1HD2 LEU 102 7.119 -15.227 12.236 785 HD23 LEU 102 2HD2 LEU 102 6.092 -15.351 13.664 786 HA PRO 103 HA PRO 103 8.291 -21.810 14.935 787 HB2 PRO 103 2HB PRO 103 8.589 -21.380 17.599 788 HB3 PRO 103 3HB PRO 103 9.896 -21.976 16.569 789 HG2 PRO 103 2HG PRO 103 9.375 -19.196 17.549 790 HG3 PRO 103 3HG PRO 103 10.910 -20.079 17.453 791 HD2 PRO 103 2HD PRO 103 10.174 -18.233 15.614 792 HD3 PRO 103 3HD PRO 103 11.161 -19.651 15.203 793 H LYS 104 H LYS 104 6.225 -22.260 15.506 794 HA LYS 104 HA LYS 104 4.559 -20.001 16.402 795 HB2 LYS 104 2HB LYS 104 2.663 -21.294 15.358 796 HB3 LYS 104 3HB LYS 104 3.855 -20.667 14.227 797 HG2 LYS 104 2HG LYS 104 4.254 -22.696 13.442 798 HG3 LYS 104 3HG LYS 104 4.601 -23.305 15.062 799 HD2 LYS 104 2HD LYS 104 1.811 -22.954 13.979 800 HD3 LYS 104 3HD LYS 104 2.720 -24.462 13.856 801 HE2 LYS 104 2HE LYS 104 2.122 -23.048 16.450 802 HE3 LYS 104 3HE LYS 104 1.144 -24.358 15.790 803 HZ1 LYS 104 3HZ LYS 104 3.792 -24.449 17.010 804 HZ2 LYS 104 1HZ LYS 104 3.508 -25.510 15.723 805 HZ3 LYS 104 2HZ LYS 104 2.521 -25.563 17.095 806 HA PRO 105 HA PRO 105 2.313 -19.881 16.928 807 HB2 PRO 105 2HB PRO 105 1.524 -18.755 19.269 808 HB3 PRO 105 3HB PRO 105 0.666 -20.104 18.516 809 HG2 PRO 105 2HG PRO 105 2.650 -20.136 20.757 810 HG3 PRO 105 3HG PRO 105 1.126 -21.029 20.599 811 HD2 PRO 105 2HD PRO 105 3.536 -22.162 20.106 812 HD3 PRO 105 3HD PRO 105 2.063 -22.635 19.236 813 H PHE 106 H PHE 106 2.426 -17.455 17.457 814 HA PHE 106 HA PHE 106 4.826 -16.565 18.788 815 HB2 PHE 106 2HB PHE 106 5.721 -15.424 16.749 816 HB3 PHE 106 3HB PHE 106 5.813 -17.180 16.680 817 HD1 PHE 106 HD2 PHE 106 3.731 -14.304 15.590 818 HD2 PHE 106 HD1 PHE 106 4.919 -18.328 14.874 819 HE1 PHE 106 HE2 PHE 106 2.521 -14.277 13.448 820 HE2 PHE 106 HE1 PHE 106 3.712 -18.307 12.730 821 HZ PHE 106 HZ PHE 106 2.509 -16.280 12.015 822 H ASP 107 H ASP 107 5.096 -14.086 18.297 823 HA ASP 107 HA ASP 107 2.482 -12.905 18.810 824 HB2 ASP 107 2HB ASP 107 5.296 -12.162 19.367 825 HB3 ASP 107 3HB ASP 107 4.185 -10.828 19.067 826 H ILE 108 H ILE 108 1.343 -12.160 17.156 827 HA ILE 108 HA ILE 108 2.108 -11.865 14.552 828 HB ILE 108 HB ILE 108 -0.012 -10.439 16.129 829 HG12 ILE 108 2HG1 ILE 108 -0.465 -12.221 13.770 830 HG13 ILE 108 3HG1 ILE 108 0.000 -12.946 15.304 831 HG21 ILE 108 1HG2 ILE 108 -0.808 -9.890 13.652 832 HG22 ILE 108 2HG2 ILE 108 0.207 -8.789 14.582 833 HG23 ILE 108 3HG2 ILE 108 0.934 -9.856 13.382 834 HD11 ILE 108 3HD1 ILE 108 -2.105 -12.866 15.956 835 HD12 ILE 108 1HD1 ILE 108 -2.072 -11.107 15.838 836 HD13 ILE 108 2HD1 ILE 108 -2.559 -12.076 14.447 837 H ASP 109 H ASP 109 2.519 -9.571 17.171 838 HA ASP 109 HA ASP 109 3.132 -7.270 15.736 839 HB2 ASP 109 2HB ASP 109 3.929 -8.299 18.435 840 HB3 ASP 109 3HB ASP 109 4.675 -6.829 17.812 841 H GLU 110 H GLU 110 5.222 -9.963 16.689 842 HA GLU 110 HA GLU 110 7.573 -8.769 15.539 843 HB2 GLU 110 2HB GLU 110 7.076 -10.820 17.360 844 HB3 GLU 110 3HB GLU 110 7.734 -11.640 15.950 845 HG2 GLU 110 2HG GLU 110 9.593 -9.890 16.027 846 HG3 GLU 110 3HG GLU 110 9.005 -9.526 17.648 847 H ALA 111 H ALA 111 5.112 -11.037 14.533 848 HA ALA 111 HA ALA 111 6.444 -12.113 12.289 849 HB1 ALA 111 1HB ALA 111 4.260 -12.866 13.491 850 HB2 ALA 111 2HB ALA 111 3.477 -11.785 12.337 851 HB3 ALA 111 3HB ALA 111 4.449 -13.138 11.759 852 H VAL 112 H VAL 112 3.962 -9.555 12.478 853 HA VAL 112 HA VAL 112 3.905 -8.826 9.815 854 HB VAL 112 HB VAL 112 3.487 -7.190 12.305 855 HG11 VAL 112 1HG1 VAL 112 4.117 -5.497 10.856 856 HG12 VAL 112 2HG1 VAL 112 3.447 -6.316 9.444 857 HG13 VAL 112 3HG1 VAL 112 2.371 -5.566 10.623 858 HG21 VAL 112 3HG2 VAL 112 1.792 -8.834 11.920 859 HG22 VAL 112 1HG2 VAL 112 1.125 -7.258 11.494 860 HG23 VAL 112 2HG2 VAL 112 1.649 -8.367 10.226 861 H ALA 113 H ALA 113 6.241 -7.991 12.290 862 HA ALA 113 HA ALA 113 7.584 -6.051 10.614 863 HB1 ALA 113 1HB ALA 113 7.396 -6.333 13.305 864 HB2 ALA 113 2HB ALA 113 8.989 -7.025 12.998 865 HB3 ALA 113 3HB ALA 113 8.629 -5.377 12.483 866 H LEU 114 H LEU 114 7.820 -9.426 11.354 867 HA LEU 114 HA LEU 114 10.522 -9.821 10.590 868 HB2 LEU 114 2HB LEU 114 9.345 -11.440 11.949 869 HB3 LEU 114 3HB LEU 114 8.186 -11.725 10.652 870 HG LEU 114 HG LEU 114 10.202 -12.542 9.291 871 HD11 LEU 114 1HD1 LEU 114 12.020 -13.478 10.704 872 HD12 LEU 114 2HD1 LEU 114 11.366 -12.573 12.069 873 HD13 LEU 114 3HD1 LEU 114 11.985 -11.715 10.658 874 HD21 LEU 114 3HD2 LEU 114 8.758 -13.888 11.490 875 HD22 LEU 114 1HD2 LEU 114 10.163 -14.728 10.835 876 HD23 LEU 114 2HD2 LEU 114 8.831 -14.277 9.771 877 H VAL 115 H VAL 115 7.448 -10.130 8.848 878 HA VAL 115 HA VAL 115 8.502 -11.076 6.423 879 HB VAL 115 HB VAL 115 6.131 -11.212 6.845 880 HG11 VAL 115 1HG1 VAL 115 6.057 -8.201 6.691 881 HG12 VAL 115 2HG1 VAL 115 4.691 -9.283 6.969 882 HG13 VAL 115 3HG1 VAL 115 5.961 -9.135 8.184 883 HG21 VAL 115 3HG2 VAL 115 5.759 -9.378 4.676 884 HG22 VAL 115 1HG2 VAL 115 7.279 -10.248 4.465 885 HG23 VAL 115 2HG2 VAL 115 5.769 -11.141 4.653 886 H GLU 116 H GLU 116 7.975 -7.797 7.629 887 HA GLU 116 HA GLU 116 8.526 -6.399 5.269 888 HB2 GLU 116 2HB GLU 116 8.145 -5.780 8.043 889 HB3 GLU 116 3HB GLU 116 9.527 -4.878 7.437 890 HG2 GLU 116 2HG GLU 116 8.137 -4.007 5.610 891 HG3 GLU 116 3HG GLU 116 6.752 -4.875 6.271 892 H ARG 117 H ARG 117 10.632 -7.935 7.574 893 HA ARG 117 HA ARG 117 13.028 -6.617 6.762 894 HB2 ARG 117 2HB ARG 117 13.028 -7.576 8.932 895 HB3 ARG 117 3HB ARG 117 12.480 -9.133 8.325 896 HG2 ARG 117 2HG ARG 117 14.554 -9.791 7.747 897 HG3 ARG 117 3HG ARG 117 15.047 -8.171 7.251 898 HD2 ARG 117 2HD ARG 117 14.656 -8.948 10.130 899 HD3 ARG 117 3HD ARG 117 16.199 -9.129 9.296 900 HE ARG 117 HE ARG 117 15.018 -6.689 10.242 901 HH11 ARG 117 1HH1 ARG 117 17.217 -8.089 7.934 902 HH12 ARG 117 2HH1 ARG 117 18.134 -6.634 7.729 903 HH21 ARG 117 1HH2 ARG 117 16.218 -4.767 9.981 904 HH22 ARG 117 2HH2 ARG 117 17.566 -4.745 8.895 905 H ALA 118 H ALA 118 11.203 -9.304 5.577 906 HA ALA 118 HA ALA 118 13.377 -10.386 4.003 907 HB1 ALA 118 1HB ALA 118 10.939 -11.451 3.100 908 HB2 ALA 118 2HB ALA 118 12.123 -12.208 4.166 909 HB3 ALA 118 3HB ALA 118 10.790 -11.277 4.849 910 H ILE 119 H ILE 119 10.584 -8.315 3.538 911 HA ILE 119 HA ILE 119 10.891 -8.259 0.662 912 HB ILE 119 HB ILE 119 9.120 -6.590 2.451 913 HG12 ILE 119 2HG1 ILE 119 8.249 -8.859 0.677 914 HG13 ILE 119 3HG1 ILE 119 8.788 -9.150 2.328 915 HG21 ILE 119 1HG2 ILE 119 7.909 -6.029 0.411 916 HG22 ILE 119 2HG2 ILE 119 9.591 -5.509 0.310 917 HG23 ILE 119 3HG2 ILE 119 9.065 -6.961 -0.541 918 HD11 ILE 119 3HD1 ILE 119 6.251 -8.794 1.736 919 HD12 ILE 119 1HD1 ILE 119 6.941 -8.190 3.243 920 HD13 ILE 119 2HD1 ILE 119 6.697 -7.094 1.882 921 H SER 120 H SER 120 11.199 -5.898 3.313 922 HA SER 120 HA SER 120 12.104 -3.741 1.817 923 HB2 SER 120 2HB SER 120 11.454 -3.818 4.298 924 HB3 SER 120 3HB SER 120 13.113 -4.338 4.596 925 HG SER 120 HG SER 120 12.746 -2.086 2.999 926 H HIS 121 H HIS 121 13.756 -6.625 2.785 927 HA HIS 121 HA HIS 121 16.411 -5.865 2.721 928 HB2 HIS 121 2HB HIS 121 15.497 -8.146 3.289 929 HB3 HIS 121 3HB HIS 121 15.349 -8.444 1.559 930 HD1 HIS 121 HD1 HIS 121 17.419 -9.181 0.336 931 HD2 HIS 121 HD2 HIS 121 18.217 -7.870 4.196 932 HE1 HIS 121 HE1 HIS 121 19.828 -9.767 0.760 933 H TYR 122 H TYR 122 14.163 -6.245 0.092 934 HA TYR 122 HA TYR 122 16.315 -5.871 -1.868 935 HB2 TYR 122 2HB TYR 122 13.420 -6.449 -2.482 936 HB3 TYR 122 3HB TYR 122 14.816 -6.665 -3.532 937 HD1 TYR 122 HD2 TYR 122 16.583 -8.404 -2.745 938 HD2 TYR 122 HD1 TYR 122 12.589 -8.258 -1.284 939 HE1 TYR 122 HE2 TYR 122 16.768 -10.747 -2.021 940 HE2 TYR 122 HE1 TYR 122 12.764 -10.601 -0.555 941 HH TYR 122 HH TYR 122 14.707 -12.182 0.105 942 H GLN 123 H GLN 123 13.089 -4.594 -1.067 943 HA GLN 123 HA GLN 123 13.180 -2.415 -2.845 944 HB2 GLN 123 2HB GLN 123 11.467 -3.325 -0.659 945 HB3 GLN 123 3HB GLN 123 11.556 -1.573 -0.777 946 HG2 GLN 123 2HG GLN 123 9.997 -1.693 -2.340 947 HG3 GLN 123 3HG GLN 123 11.209 -2.422 -3.393 948 HE21 GLN 123 1HE2 GLN 123 8.437 -2.903 -3.538 949 HE22 GLN 123 2HE2 GLN 123 8.164 -4.569 -3.174 950 H GLU 124 H GLU 124 13.428 -2.285 0.714 951 HA GLU 124 HA GLU 124 14.558 -0.888 2.108 952 HB2 GLU 124 2HB GLU 124 16.371 -1.596 0.046 953 HB3 GLU 124 3HB GLU 124 16.612 0.112 0.382 954 HG2 GLU 124 2HG GLU 124 17.705 -0.345 2.248 955 HG3 GLU 124 3HG GLU 124 16.386 -1.354 2.837 Start of MODEL 21 1 H1 MET 1 H MET 1 1.495 -0.116 2.195 2 HA MET 1 HA MET 1 0.474 0.725 -0.281 3 HB2 MET 1 2HB MET 1 2.330 1.759 -1.339 4 HB3 MET 1 3HB MET 1 2.106 2.599 0.190 5 HG2 MET 1 2HG MET 1 3.869 0.715 0.943 6 HG3 MET 1 3HG MET 1 4.332 0.920 -0.744 7 HE1 MET 1 3HE MET 1 5.912 4.224 -1.058 8 HE2 MET 1 1HE MET 1 5.201 2.792 -1.804 9 HE3 MET 1 2HE MET 1 4.180 4.169 -1.389 10 H GLN 2 H GLN 2 0.668 -0.894 -1.728 11 HA GLN 2 HA GLN 2 1.649 -3.391 -0.962 12 HB2 GLN 2 2HB GLN 2 0.002 -2.624 -2.892 13 HB3 GLN 2 3HB GLN 2 1.464 -2.720 -3.863 14 HG2 GLN 2 2HG GLN 2 1.453 -4.949 -3.874 15 HG3 GLN 2 3HG GLN 2 1.041 -5.051 -2.163 16 HE21 GLN 2 1HE2 GLN 2 -0.106 -5.191 -5.375 17 HE22 GLN 2 2HE2 GLN 2 -1.768 -5.494 -5.013 18 H ARG 3 H ARG 3 3.414 -4.636 -1.768 19 HA ARG 3 HA ARG 3 5.463 -3.724 -3.406 20 HB2 ARG 3 2HB ARG 3 7.194 -3.323 -1.533 21 HB3 ARG 3 3HB ARG 3 6.089 -2.017 -1.944 22 HG2 ARG 3 2HG ARG 3 5.735 -1.899 0.256 23 HG3 ARG 3 3HG ARG 3 4.704 -3.310 0.010 24 HD2 ARG 3 2HD ARG 3 6.055 -4.582 1.233 25 HD3 ARG 3 3HD ARG 3 7.450 -4.115 0.261 26 HE ARG 3 HE ARG 3 6.799 -3.172 2.856 27 HH11 ARG 3 1HH1 ARG 3 8.165 -2.168 -0.185 28 HH12 ARG 3 2HH1 ARG 3 9.144 -0.923 0.517 29 HH21 ARG 3 1HH2 ARG 3 8.083 -1.535 3.792 30 HH22 ARG 3 2HH2 ARG 3 9.097 -0.564 2.779 31 H GLY 4 H GLY 4 4.521 -5.630 -0.623 32 HA2 GLY 4 2HA GLY 4 5.992 -7.898 -1.742 33 HA3 GLY 4 3HA GLY 4 6.374 -7.426 -0.093 34 H ILE 5 H ILE 5 4.270 -9.183 -2.106 35 HA ILE 5 HA ILE 5 2.113 -9.394 -0.203 36 HB ILE 5 HB ILE 5 2.681 -10.854 -2.780 37 HG12 ILE 5 2HG1 ILE 5 0.348 -9.053 -2.212 38 HG13 ILE 5 3HG1 ILE 5 1.910 -8.364 -2.639 39 HG21 ILE 5 1HG2 ILE 5 0.477 -11.222 -0.781 40 HG22 ILE 5 2HG2 ILE 5 0.249 -11.609 -2.485 41 HG23 ILE 5 3HG2 ILE 5 1.491 -12.443 -1.550 42 HD11 ILE 5 3HD1 ILE 5 1.432 -10.359 -4.530 43 HD12 ILE 5 1HD1 ILE 5 -0.101 -9.511 -4.326 44 HD13 ILE 5 2HD1 ILE 5 1.353 -8.613 -4.762 45 H VAL 6 H VAL 6 1.753 -10.979 1.253 46 HA VAL 6 HA VAL 6 3.777 -13.115 1.440 47 HB VAL 6 HB VAL 6 2.171 -12.030 3.749 48 HG11 VAL 6 1HG1 VAL 6 3.933 -13.112 5.088 49 HG12 VAL 6 2HG1 VAL 6 3.053 -14.263 4.080 50 HG13 VAL 6 3HG1 VAL 6 4.663 -13.723 3.604 51 HG21 VAL 6 3HG2 VAL 6 4.971 -11.267 2.920 52 HG22 VAL 6 1HG2 VAL 6 3.545 -10.234 2.813 53 HG23 VAL 6 2HG2 VAL 6 4.146 -10.747 4.390 54 H TRP 7 H TRP 7 3.095 -15.162 1.376 55 HA TRP 7 HA TRP 7 0.194 -15.648 1.534 56 HB2 TRP 7 2HB TRP 7 2.349 -17.080 -0.026 57 HB3 TRP 7 3HB TRP 7 0.713 -17.707 0.163 58 HD1 TRP 7 HD1 TRP 7 0.098 -14.200 -0.112 59 HE1 TRP 7 HE1 TRP 7 -0.387 -13.474 -2.533 60 HE3 TRP 7 HE3 TRP 7 1.848 -18.330 -2.565 61 HZ2 TRP 7 HZ2 TRP 7 -0.070 -14.514 -5.138 62 HZ3 TRP 7 HZ3 TRP 7 1.721 -18.385 -5.021 63 HH2 TRP 7 HH2 TRP 7 0.781 -16.516 -6.279 64 H VAL 8 H VAL 8 -0.405 -17.862 2.288 65 HA VAL 8 HA VAL 8 1.507 -19.022 4.179 66 HB VAL 8 HB VAL 8 -1.289 -18.147 4.915 67 HG11 VAL 8 1HG1 VAL 8 -0.765 -20.361 5.837 68 HG12 VAL 8 2HG1 VAL 8 0.704 -19.703 6.561 69 HG13 VAL 8 3HG1 VAL 8 -0.877 -19.132 7.097 70 HG21 VAL 8 3HG2 VAL 8 0.610 -16.454 4.911 71 HG22 VAL 8 1HG2 VAL 8 -0.289 -16.635 6.417 72 HG23 VAL 8 2HG2 VAL 8 1.298 -17.383 6.243 73 H VAL 9 H VAL 9 1.265 -21.203 4.530 74 HA VAL 9 HA VAL 9 -0.986 -22.550 3.205 75 HB VAL 9 HB VAL 9 0.898 -22.676 1.662 76 HG11 VAL 9 1HG1 VAL 9 2.388 -23.085 4.078 77 HG12 VAL 9 2HG1 VAL 9 2.692 -24.409 2.951 78 HG13 VAL 9 3HG1 VAL 9 2.973 -22.740 2.450 79 HG21 VAL 9 3HG2 VAL 9 1.182 -25.281 1.795 80 HG22 VAL 9 1HG2 VAL 9 -0.052 -25.139 3.047 81 HG23 VAL 9 2HG2 VAL 9 -0.385 -24.568 1.412 82 H ASP 10 H ASP 10 -1.650 -22.569 5.519 83 HA ASP 10 HA ASP 10 -0.329 -24.747 7.000 84 HB2 ASP 10 2HB ASP 10 -1.194 -23.768 9.044 85 HB3 ASP 10 3HB ASP 10 -0.307 -22.543 8.141 86 H ASP 11 H ASP 11 -1.944 -25.848 8.565 87 HA ASP 11 HA ASP 11 -4.435 -26.398 7.087 88 HB2 ASP 11 2HB ASP 11 -2.448 -28.186 7.363 89 HB3 ASP 11 3HB ASP 11 -3.315 -28.496 8.864 90 H ASP 12 H ASP 12 -3.835 -24.522 9.335 91 HA ASP 12 HA ASP 12 -5.778 -25.609 11.268 92 HB2 ASP 12 2HB ASP 12 -3.125 -24.730 11.745 93 HB3 ASP 12 3HB ASP 12 -4.202 -23.526 12.448 94 H SER 13 H SER 13 -7.178 -24.058 12.284 95 HA SER 13 HA SER 13 -8.120 -22.081 10.440 96 HB2 SER 13 2HB SER 13 -9.320 -23.568 12.385 97 HB3 SER 13 3HB SER 13 -9.180 -22.007 13.192 98 HG SER 13 HG SER 13 -10.300 -21.069 11.473 99 H SER 14 H SER 14 -6.887 -21.896 13.781 100 HA SER 14 HA SER 14 -6.788 -19.076 13.862 101 HB2 SER 14 2HB SER 14 -5.243 -21.110 15.489 102 HB3 SER 14 3HB SER 14 -5.375 -19.394 15.871 103 HG SER 14 HG SER 14 -7.760 -19.876 15.783 104 H ILE 15 H ILE 15 -4.281 -21.514 13.239 105 HA ILE 15 HA ILE 15 -2.050 -19.948 13.022 106 HB ILE 15 HB ILE 15 -2.814 -22.279 11.263 107 HG12 ILE 15 2HG1 ILE 15 -2.729 -22.835 13.639 108 HG13 ILE 15 3HG1 ILE 15 -1.364 -23.561 12.797 109 HG21 ILE 15 1HG2 ILE 15 -0.141 -20.946 11.662 110 HG22 ILE 15 2HG2 ILE 15 -0.385 -22.485 10.839 111 HG23 ILE 15 3HG2 ILE 15 -1.081 -21.009 10.172 112 HD11 ILE 15 3HD1 ILE 15 -1.328 -21.105 14.532 113 HD12 ILE 15 1HD1 ILE 15 -0.614 -22.678 14.886 114 HD13 ILE 15 2HD1 ILE 15 0.045 -21.682 13.588 115 H ARG 16 H ARG 16 -4.369 -20.646 10.410 116 HA ARG 16 HA ARG 16 -3.091 -18.867 8.569 117 HB2 ARG 16 2HB ARG 16 -4.548 -19.678 7.022 118 HB3 ARG 16 3HB ARG 16 -4.742 -20.947 8.223 119 HG2 ARG 16 2HG ARG 16 -6.696 -19.665 9.127 120 HG3 ARG 16 3HG ARG 16 -6.552 -18.598 7.729 121 HD2 ARG 16 2HD ARG 16 -6.506 -21.143 6.639 122 HD3 ARG 16 3HD ARG 16 -7.699 -21.257 7.933 123 HE ARG 16 HE ARG 16 -7.934 -19.771 5.479 124 HH11 ARG 16 1HH1 ARG 16 -9.051 -20.105 8.759 125 HH12 ARG 16 2HH1 ARG 16 -10.568 -19.325 8.459 126 HH21 ARG 16 1HH2 ARG 16 -9.928 -18.742 5.072 127 HH22 ARG 16 2HH2 ARG 16 -11.067 -18.551 6.362 128 H TRP 17 H TRP 17 -5.506 -18.553 11.018 129 HA TRP 17 HA TRP 17 -6.768 -16.203 10.041 130 HB2 TRP 17 2HB TRP 17 -7.960 -17.469 11.659 131 HB3 TRP 17 3HB TRP 17 -6.598 -17.460 12.777 132 HD1 TRP 17 HD1 TRP 17 -9.296 -15.086 11.372 133 HE1 TRP 17 HE1 TRP 17 -9.659 -13.188 13.072 134 HE3 TRP 17 HE3 TRP 17 -5.586 -16.249 14.692 135 HZ2 TRP 17 HZ2 TRP 17 -8.522 -12.300 15.498 136 HZ3 TRP 17 HZ3 TRP 17 -5.289 -14.824 16.676 137 HH2 TRP 17 HH2 TRP 17 -6.728 -12.891 17.069 138 H VAL 18 H VAL 18 -4.629 -16.530 12.879 139 HA VAL 18 HA VAL 18 -4.096 -13.872 13.301 140 HB VAL 18 HB VAL 18 -3.241 -15.209 14.967 141 HG11 VAL 18 1HG1 VAL 18 -2.566 -17.006 12.750 142 HG12 VAL 18 2HG1 VAL 18 -1.422 -17.029 14.093 143 HG13 VAL 18 3HG1 VAL 18 -3.128 -17.374 14.380 144 HG21 VAL 18 3HG2 VAL 18 -1.021 -14.630 15.195 145 HG22 VAL 18 1HG2 VAL 18 -0.652 -14.958 13.502 146 HG23 VAL 18 2HG2 VAL 18 -1.546 -13.503 13.945 147 H LEU 19 H LEU 19 -2.417 -16.086 11.102 148 HA LEU 19 HA LEU 19 -0.400 -14.315 10.277 149 HB2 LEU 19 2HB LEU 19 -1.688 -16.672 8.923 150 HB3 LEU 19 3HB LEU 19 -0.336 -15.788 8.219 151 HG LEU 19 HG LEU 19 -0.169 -17.079 10.930 152 HD11 LEU 19 1HD1 LEU 19 -0.776 -18.677 9.023 153 HD12 LEU 19 2HD1 LEU 19 0.639 -19.060 10.003 154 HD13 LEU 19 3HD1 LEU 19 0.842 -18.342 8.406 155 HD21 LEU 19 3HD2 LEU 19 1.485 -15.332 10.290 156 HD22 LEU 19 1HD2 LEU 19 1.968 -16.350 8.933 157 HD23 LEU 19 2HD2 LEU 19 2.198 -16.918 10.587 158 H GLU 20 H GLU 20 -3.747 -14.557 9.430 159 HA GLU 20 HA GLU 20 -3.507 -12.996 7.015 160 HB2 GLU 20 2HB GLU 20 -5.365 -14.771 7.883 161 HB3 GLU 20 3HB GLU 20 -6.154 -13.256 8.299 162 HG2 GLU 20 2HG GLU 20 -5.061 -13.141 5.639 163 HG3 GLU 20 3HG GLU 20 -6.131 -14.530 5.825 164 H ARG 21 H ARG 21 -4.732 -12.477 10.305 165 HA ARG 21 HA ARG 21 -5.641 -9.868 10.014 166 HB2 ARG 21 2HB ARG 21 -4.279 -10.906 12.497 167 HB3 ARG 21 3HB ARG 21 -5.549 -9.694 12.388 168 HG2 ARG 21 2HG ARG 21 -5.790 -12.653 11.917 169 HG3 ARG 21 3HG ARG 21 -6.529 -11.696 13.202 170 HD2 ARG 21 2HD ARG 21 -7.187 -11.716 10.269 171 HD3 ARG 21 3HD ARG 21 -8.241 -12.099 11.630 172 HE ARG 21 HE ARG 21 -7.521 -9.499 12.036 173 HH11 ARG 21 1HH1 ARG 21 -8.999 -11.263 9.424 174 HH12 ARG 21 2HH1 ARG 21 -9.921 -9.909 8.858 175 HH21 ARG 21 1HH2 ARG 21 -8.729 -7.709 11.301 176 HH22 ARG 21 2HH2 ARG 21 -9.766 -7.888 9.926 177 H ALA 22 H ALA 22 -2.390 -11.065 10.717 178 HA ALA 22 HA ALA 22 -1.080 -8.735 11.359 179 HB1 ALA 22 1HB ALA 22 -0.332 -11.340 10.336 180 HB2 ALA 22 2HB ALA 22 0.733 -10.065 9.742 181 HB3 ALA 22 3HB ALA 22 0.509 -10.290 11.477 182 H LEU 23 H LEU 23 -1.289 -10.102 8.065 183 HA LEU 23 HA LEU 23 -0.294 -7.740 6.833 184 HB2 LEU 23 2HB LEU 23 -1.915 -9.871 5.471 185 HB3 LEU 23 3HB LEU 23 -0.686 -8.819 4.770 186 HG LEU 23 HG LEU 23 -0.043 -10.920 6.827 187 HD11 LEU 23 1HD1 LEU 23 0.193 -11.222 3.842 188 HD12 LEU 23 2HD1 LEU 23 -1.128 -11.898 4.794 189 HD13 LEU 23 3HD1 LEU 23 0.528 -12.432 5.082 190 HD21 LEU 23 3HD2 LEU 23 2.116 -10.371 6.507 191 HD22 LEU 23 1HD2 LEU 23 1.444 -8.836 5.955 192 HD23 LEU 23 2HD2 LEU 23 1.895 -10.075 4.782 193 H ALA 24 H ALA 24 -3.512 -9.019 7.456 194 HA ALA 24 HA ALA 24 -5.082 -7.426 5.858 195 HB1 ALA 24 1HB ALA 24 -5.585 -8.407 8.660 196 HB2 ALA 24 2HB ALA 24 -6.814 -7.631 7.660 197 HB3 ALA 24 3HB ALA 24 -6.090 -9.154 7.144 198 H GLY 25 H GLY 25 -3.439 -6.577 8.847 199 HA2 GLY 25 2HA GLY 25 -4.714 -3.968 8.963 200 HA3 GLY 25 3HA GLY 25 -3.513 -4.595 10.082 201 H ALA 26 H ALA 26 -1.815 -5.352 7.687 202 HA ALA 26 HA ALA 26 -0.510 -2.754 7.455 203 HB1 ALA 26 1HB ALA 26 0.504 -5.416 6.477 204 HB2 ALA 26 2HB ALA 26 1.430 -3.938 6.740 205 HB3 ALA 26 3HB ALA 26 0.756 -4.812 8.115 206 H GLY 27 H GLY 27 0.841 -2.951 5.099 207 HA2 GLY 27 2HA GLY 27 -1.353 -2.708 3.153 208 HA3 GLY 27 3HA GLY 27 0.207 -1.908 3.036 209 H LEU 28 H LEU 28 -0.562 -5.317 3.660 210 HA LEU 28 HA LEU 28 0.670 -6.012 1.087 211 HB2 LEU 28 2HB LEU 28 1.300 -7.990 3.063 212 HB3 LEU 28 3HB LEU 28 2.380 -7.075 2.013 213 HG LEU 28 HG LEU 28 1.336 -5.975 4.612 214 HD11 LEU 28 1HD1 LEU 28 4.098 -6.887 4.606 215 HD12 LEU 28 2HD1 LEU 28 2.937 -8.203 4.434 216 HD13 LEU 28 3HD1 LEU 28 2.831 -7.109 5.813 217 HD21 LEU 28 3HD2 LEU 28 2.593 -4.738 2.538 218 HD22 LEU 28 1HD2 LEU 28 3.956 -5.191 3.561 219 HD23 LEU 28 2HD2 LEU 28 2.651 -4.202 4.218 220 H THR 29 H THR 29 -0.304 -7.639 0.005 221 HA THR 29 HA THR 29 -2.901 -8.427 0.658 222 HB THR 29 HB THR 29 -1.075 -10.025 -1.134 223 HG1 THR 29 HG1 THR 29 -2.634 -7.900 -2.114 224 HG21 THR 29 3HG2 THR 29 -4.043 -9.590 -0.943 225 HG22 THR 29 1HG2 THR 29 -3.148 -11.109 -0.935 226 HG23 THR 29 2HG2 THR 29 -3.288 -10.176 -2.425 227 H CYS 30 H CYS 30 -3.717 -10.588 1.101 228 HA CYS 30 HA CYS 30 -1.849 -12.302 2.582 229 HB2 CYS 30 2HB CYS 30 -3.673 -12.658 4.288 230 HB3 CYS 30 3HB CYS 30 -2.939 -11.060 4.306 231 HG CYS 30 HG CYS 30 -5.337 -10.104 4.559 232 H THR 31 H THR 31 -1.893 -14.278 1.766 233 HA THR 31 HA THR 31 -4.440 -15.311 0.702 234 HB THR 31 HB THR 31 -1.754 -16.072 -0.435 235 HG1 THR 31 HG1 THR 31 -3.540 -14.029 -1.316 236 HG21 THR 31 3HG2 THR 31 -3.713 -17.564 -0.813 237 HG22 THR 31 1HG2 THR 31 -3.045 -16.887 -2.298 238 HG23 THR 31 2HG2 THR 31 -4.529 -16.222 -1.615 239 H THR 32 H THR 32 -5.113 -16.871 2.015 240 HA THR 32 HA THR 32 -3.128 -18.595 3.326 241 HB THR 32 HB THR 32 -4.855 -19.208 4.905 242 HG1 THR 32 HG1 THR 32 -6.532 -17.727 3.158 243 HG21 THR 32 3HG2 THR 32 -3.948 -16.518 4.506 244 HG22 THR 32 1HG2 THR 32 -4.261 -17.371 6.017 245 HG23 THR 32 2HG2 THR 32 -5.564 -16.499 5.210 246 H PHE 33 H PHE 33 -2.915 -20.666 2.768 247 HA PHE 33 HA PHE 33 -4.961 -21.839 1.002 248 HB2 PHE 33 2HB PHE 33 -1.986 -22.371 1.108 249 HB3 PHE 33 3HB PHE 33 -3.125 -23.265 0.106 250 HD1 PHE 33 HD1 PHE 33 -4.272 -22.138 -1.765 251 HD2 PHE 33 HD2 PHE 33 -1.207 -20.221 0.481 252 HE1 PHE 33 HE1 PHE 33 -4.010 -20.469 -3.554 253 HE2 PHE 33 HE2 PHE 33 -0.940 -18.548 -1.303 254 HZ PHE 33 HZ PHE 33 -2.343 -18.670 -3.324 255 H GLU 34 H GLU 34 -4.287 -24.447 1.024 256 HA GLU 34 HA GLU 34 -4.141 -25.313 3.812 257 HB2 GLU 34 2HB GLU 34 -6.102 -26.879 3.339 258 HB3 GLU 34 3HB GLU 34 -6.481 -25.183 3.601 259 HG2 GLU 34 2HG GLU 34 -7.336 -24.943 1.561 260 HG3 GLU 34 3HG GLU 34 -6.008 -25.819 0.803 261 H ASN 35 H ASN 35 -2.709 -25.505 1.055 262 HA ASN 35 HA ASN 35 -1.650 -28.115 1.486 263 HB2 ASN 35 2HB ASN 35 -3.723 -28.738 0.309 264 HB3 ASN 35 3HB ASN 35 -3.274 -27.688 -1.032 265 HD21 ASN 35 1HD2 ASN 35 -3.672 -29.919 -2.023 266 HD22 ASN 35 2HD2 ASN 35 -2.272 -30.910 -2.223 267 H GLY 36 H GLY 36 0.443 -27.880 1.081 268 HA2 GLY 36 2HA GLY 36 1.631 -25.681 -0.106 269 HA3 GLY 36 3HA GLY 36 2.406 -27.249 0.070 270 H ASN 37 H ASN 37 0.751 -28.768 -1.608 271 HA ASN 37 HA ASN 37 1.944 -28.329 -4.099 272 HB2 ASN 37 2HB ASN 37 1.214 -30.527 -3.663 273 HB3 ASN 37 3HB ASN 37 -0.406 -29.994 -3.223 274 HD21 ASN 37 1HD2 ASN 37 -1.901 -29.579 -4.813 275 HD22 ASN 37 2HD2 ASN 37 -1.656 -30.020 -6.466 276 H GLU 38 H GLU 38 -0.839 -26.920 -2.671 277 HA GLU 38 HA GLU 38 -1.951 -26.051 -5.216 278 HB2 GLU 38 2HB GLU 38 -3.090 -26.631 -2.780 279 HB3 GLU 38 3HB GLU 38 -3.070 -24.873 -2.777 280 HG2 GLU 38 2HG GLU 38 -4.402 -24.749 -4.711 281 HG3 GLU 38 3HG GLU 38 -4.168 -26.458 -5.075 282 H VAL 39 H VAL 39 0.183 -24.919 -2.784 283 HA VAL 39 HA VAL 39 -0.146 -22.117 -3.491 284 HB VAL 39 HB VAL 39 1.971 -23.261 -1.678 285 HG11 VAL 39 1HG1 VAL 39 0.624 -20.586 -1.493 286 HG12 VAL 39 2HG1 VAL 39 2.167 -21.099 -0.807 287 HG13 VAL 39 3HG1 VAL 39 2.013 -20.850 -2.547 288 HG21 VAL 39 3HG2 VAL 39 -0.906 -23.163 -1.283 289 HG22 VAL 39 1HG2 VAL 39 0.340 -23.969 -0.330 290 HG23 VAL 39 2HG2 VAL 39 -0.024 -22.267 -0.046 291 H LEU 40 H LEU 40 2.236 -24.703 -3.846 292 HA LEU 40 HA LEU 40 4.382 -23.330 -4.872 293 HB2 LEU 40 2HB LEU 40 4.855 -25.539 -4.596 294 HB3 LEU 40 3HB LEU 40 3.298 -26.063 -5.234 295 HG LEU 40 HG LEU 40 4.073 -25.700 -7.504 296 HD11 LEU 40 1HD1 LEU 40 6.011 -24.066 -6.236 297 HD12 LEU 40 2HD1 LEU 40 5.723 -24.297 -7.960 298 HD13 LEU 40 3HD1 LEU 40 6.860 -25.343 -7.109 299 HD21 LEU 40 3HD2 LEU 40 6.350 -27.194 -6.335 300 HD22 LEU 40 1HD2 LEU 40 5.253 -27.636 -7.643 301 HD23 LEU 40 2HD2 LEU 40 4.725 -27.771 -5.966 302 H ALA 41 H ALA 41 1.504 -24.458 -6.601 303 HA ALA 41 HA ALA 41 2.381 -23.548 -9.157 304 HB1 ALA 41 1HB ALA 41 -0.215 -24.531 -8.050 305 HB2 ALA 41 2HB ALA 41 -0.156 -23.794 -9.652 306 HB3 ALA 41 3HB ALA 41 0.806 -25.231 -9.307 307 H ALA 42 H ALA 42 0.627 -22.113 -6.502 308 HA ALA 42 HA ALA 42 -0.573 -19.955 -7.811 309 HB1 ALA 42 1HB ALA 42 -0.710 -18.901 -5.644 310 HB2 ALA 42 2HB ALA 42 -1.047 -20.625 -5.482 311 HB3 ALA 42 3HB ALA 42 0.524 -19.985 -5.003 312 H LEU 43 H LEU 43 2.723 -20.460 -6.759 313 HA LEU 43 HA LEU 43 3.620 -17.795 -6.883 314 HB2 LEU 43 2HB LEU 43 5.360 -20.125 -7.591 315 HB3 LEU 43 3HB LEU 43 5.783 -18.645 -6.733 316 HG LEU 43 HG LEU 43 4.151 -20.934 -5.634 317 HD11 LEU 43 1HD1 LEU 43 6.461 -21.548 -5.800 318 HD12 LEU 43 2HD1 LEU 43 6.100 -21.184 -4.113 319 HD13 LEU 43 3HD1 LEU 43 6.969 -20.010 -5.102 320 HD21 LEU 43 3HD2 LEU 43 5.209 -18.673 -3.999 321 HD22 LEU 43 1HD2 LEU 43 3.847 -19.750 -3.688 322 HD23 LEU 43 2HD2 LEU 43 3.700 -18.468 -4.890 323 H ALA 44 H ALA 44 3.063 -20.200 -9.339 324 HA ALA 44 HA ALA 44 4.506 -18.780 -11.392 325 HB1 ALA 44 1HB ALA 44 2.566 -20.753 -12.307 326 HB2 ALA 44 2HB ALA 44 4.307 -20.664 -12.576 327 HB3 ALA 44 3HB ALA 44 3.679 -21.379 -11.091 328 H SER 45 H SER 45 1.677 -18.165 -9.853 329 HA SER 45 HA SER 45 0.312 -17.146 -12.244 330 HB2 SER 45 2HB SER 45 -0.912 -17.095 -9.508 331 HB3 SER 45 3HB SER 45 -1.697 -17.253 -11.080 332 HG SER 45 HG SER 45 -0.461 -19.360 -11.121 333 H LYS 46 H LYS 46 2.361 -16.138 -9.817 334 HA LYS 46 HA LYS 46 2.279 -13.434 -10.564 335 HB2 LYS 46 2HB LYS 46 0.172 -13.340 -9.370 336 HB3 LYS 46 3HB LYS 46 0.901 -14.085 -7.954 337 HG2 LYS 46 2HG LYS 46 2.456 -11.826 -8.502 338 HG3 LYS 46 3HG LYS 46 0.777 -11.318 -8.701 339 HD2 LYS 46 2HD LYS 46 1.455 -12.972 -6.327 340 HD3 LYS 46 3HD LYS 46 1.993 -11.291 -6.339 341 HE2 LYS 46 2HE LYS 46 -0.202 -11.558 -5.266 342 HE3 LYS 46 3HE LYS 46 -0.281 -10.535 -6.700 343 HZ1 LYS 46 3HZ LYS 46 -1.323 -12.202 -7.922 344 HZ2 LYS 46 1HZ LYS 46 -2.072 -12.295 -6.408 345 HZ3 LYS 46 2HZ LYS 46 -0.887 -13.423 -6.836 346 H THR 47 H THR 47 3.065 -15.822 -8.118 347 HA THR 47 HA THR 47 4.981 -16.226 -6.952 348 HB THR 47 HB THR 47 6.621 -14.110 -8.164 349 HG1 THR 47 HG1 THR 47 6.594 -15.604 -10.164 350 HG21 THR 47 3HG2 THR 47 8.174 -15.926 -8.476 351 HG22 THR 47 1HG2 THR 47 6.914 -17.115 -8.152 352 HG23 THR 47 2HG2 THR 47 7.477 -16.054 -6.861 353 HA PRO 48 HA PRO 48 4.190 -12.901 -4.000 354 HB2 PRO 48 2HB PRO 48 4.789 -14.403 -1.820 355 HB3 PRO 48 3HB PRO 48 3.225 -14.481 -2.640 356 HG2 PRO 48 2HG PRO 48 5.582 -16.312 -2.876 357 HG3 PRO 48 3HG PRO 48 3.859 -16.715 -2.761 358 HD2 PRO 48 2HD PRO 48 5.201 -16.714 -5.112 359 HD3 PRO 48 3HD PRO 48 3.481 -16.289 -4.994 360 H ASP 49 H ASP 49 5.602 -12.463 -1.835 361 HA ASP 49 HA ASP 49 8.384 -12.258 -2.776 362 HB2 ASP 49 2HB ASP 49 6.568 -10.370 -1.428 363 HB3 ASP 49 3HB ASP 49 8.203 -10.413 -0.774 364 H VAL 50 H VAL 50 6.398 -13.744 -0.514 365 HA VAL 50 HA VAL 50 8.445 -15.158 0.739 366 HB VAL 50 HB VAL 50 9.158 -13.207 1.880 367 HG11 VAL 50 1HG1 VAL 50 6.323 -12.728 2.782 368 HG12 VAL 50 2HG1 VAL 50 7.724 -11.692 3.059 369 HG13 VAL 50 3HG1 VAL 50 7.085 -11.897 1.427 370 HG21 VAL 50 3HG2 VAL 50 7.433 -14.290 4.034 371 HG22 VAL 50 1HG2 VAL 50 8.496 -15.423 3.198 372 HG23 VAL 50 2HG2 VAL 50 9.174 -14.010 4.008 373 H LEU 51 H LEU 51 7.598 -16.906 1.719 374 HA LEU 51 HA LEU 51 4.691 -16.923 2.151 375 HB2 LEU 51 2HB LEU 51 6.429 -18.696 0.823 376 HB3 LEU 51 3HB LEU 51 5.881 -19.528 2.277 377 HG LEU 51 HG LEU 51 3.700 -18.264 0.820 378 HD11 LEU 51 1HD1 LEU 51 4.350 -18.776 -1.251 379 HD12 LEU 51 2HD1 LEU 51 4.057 -20.454 -0.795 380 HD13 LEU 51 3HD1 LEU 51 5.683 -19.781 -0.681 381 HD21 LEU 51 3HD2 LEU 51 2.585 -19.967 1.731 382 HD22 LEU 51 1HD2 LEU 51 4.074 -20.340 2.599 383 HD23 LEU 51 2HD2 LEU 51 3.712 -21.159 1.080 384 H LEU 52 H LEU 52 3.983 -18.517 3.897 385 HA LEU 52 HA LEU 52 5.828 -18.666 6.151 386 HB2 LEU 52 2HB LEU 52 3.402 -16.973 6.013 387 HB3 LEU 52 3HB LEU 52 3.672 -17.862 7.510 388 HG LEU 52 HG LEU 52 6.024 -16.776 7.446 389 HD11 LEU 52 1HD1 LEU 52 6.456 -15.420 5.749 390 HD12 LEU 52 2HD1 LEU 52 5.165 -14.355 6.305 391 HD13 LEU 52 3HD1 LEU 52 4.818 -15.619 5.126 392 HD21 LEU 52 3HD2 LEU 52 5.277 -15.114 8.876 393 HD22 LEU 52 1HD2 LEU 52 3.967 -16.292 8.942 394 HD23 LEU 52 2HD2 LEU 52 3.798 -14.842 7.953 395 H SER 53 H SER 53 5.575 -20.923 5.334 396 HA SER 53 HA SER 53 3.069 -22.256 5.737 397 HB2 SER 53 2HB SER 53 4.748 -23.018 4.069 398 HB3 SER 53 3HB SER 53 5.828 -23.456 5.392 399 HG SER 53 HG SER 53 4.751 -25.236 5.616 400 H ASP 54 H ASP 54 2.407 -23.504 7.426 401 HA ASP 54 HA ASP 54 3.896 -23.181 9.918 402 HB2 ASP 54 2HB ASP 54 1.438 -22.621 9.752 403 HB3 ASP 54 3HB ASP 54 1.132 -24.345 9.555 404 H ILE 55 H ILE 55 3.592 -25.429 7.482 405 HA ILE 55 HA ILE 55 3.994 -27.671 7.284 406 HB ILE 55 HB ILE 55 5.855 -27.053 9.582 407 HG12 ILE 55 2HG1 ILE 55 6.387 -27.145 6.604 408 HG13 ILE 55 3HG1 ILE 55 6.178 -25.668 7.539 409 HG21 ILE 55 1HG2 ILE 55 6.346 -29.216 9.616 410 HG22 ILE 55 2HG2 ILE 55 5.212 -29.527 8.303 411 HG23 ILE 55 3HG2 ILE 55 6.883 -29.095 7.940 412 HD11 ILE 55 3HD1 ILE 55 8.263 -25.737 8.330 413 HD12 ILE 55 1HD1 ILE 55 8.214 -27.479 8.596 414 HD13 ILE 55 2HD1 ILE 55 8.558 -26.842 6.987 415 H ARG 56 H ARG 56 1.860 -28.282 7.963 416 HA ARG 56 HA ARG 56 1.876 -30.167 10.088 417 HB2 ARG 56 2HB ARG 56 1.575 -28.409 11.611 418 HB3 ARG 56 3HB ARG 56 0.511 -27.528 10.523 419 HG2 ARG 56 2HG ARG 56 -0.561 -30.127 11.226 420 HG3 ARG 56 3HG ARG 56 -0.253 -29.120 12.642 421 HD2 ARG 56 2HD ARG 56 -1.411 -27.339 10.934 422 HD3 ARG 56 3HD ARG 56 -2.249 -28.832 10.514 423 HE ARG 56 HE ARG 56 -2.604 -27.290 12.871 424 HH11 ARG 56 1HH1 ARG 56 -2.565 -30.562 11.683 425 HH12 ARG 56 2HH1 ARG 56 -3.631 -31.159 12.911 426 HH21 ARG 56 1HH2 ARG 56 -4.009 -28.064 14.493 427 HH22 ARG 56 2HH2 ARG 56 -4.453 -29.737 14.508 428 H MET 57 H MET 57 1.044 -31.653 8.701 429 HA MET 57 HA MET 57 -1.714 -31.814 8.325 430 HB2 MET 57 2HB MET 57 -1.671 -31.620 5.760 431 HB3 MET 57 3HB MET 57 -1.708 -30.133 6.697 432 HG2 MET 57 2HG MET 57 0.789 -30.039 6.449 433 HG3 MET 57 3HG MET 57 0.646 -31.369 5.302 434 HE1 MET 57 3HE MET 57 0.415 -27.044 4.425 435 HE2 MET 57 1HE MET 57 0.651 -27.797 6.002 436 HE3 MET 57 2HE MET 57 1.797 -28.107 4.698 437 HA PRO 58 HA PRO 58 -0.637 -35.977 7.453 438 HB2 PRO 58 2HB PRO 58 -2.744 -36.795 5.949 439 HB3 PRO 58 3HB PRO 58 -2.865 -36.490 7.686 440 HG2 PRO 58 2HG PRO 58 -3.645 -34.729 5.395 441 HG3 PRO 58 3HG PRO 58 -4.515 -35.050 6.906 442 HD2 PRO 58 2HD PRO 58 -3.055 -32.803 6.515 443 HD3 PRO 58 3HD PRO 58 -3.229 -33.564 8.110 444 H GLY 59 H GLY 59 -1.728 -34.129 4.617 445 HA2 GLY 59 2HA GLY 59 -0.693 -35.834 2.644 446 HA3 GLY 59 3HA GLY 59 -1.001 -34.115 2.441 447 H MET 60 H MET 60 0.680 -32.704 2.419 448 HA MET 60 HA MET 60 3.303 -33.791 2.070 449 HB2 MET 60 2HB MET 60 2.003 -31.500 1.237 450 HB3 MET 60 3HB MET 60 3.159 -30.893 2.416 451 HG2 MET 60 2HG MET 60 4.552 -30.838 0.670 452 HG3 MET 60 3HG MET 60 4.733 -32.560 0.994 453 HE1 MET 60 3HE MET 60 1.446 -30.999 -1.615 454 HE2 MET 60 1HE MET 60 2.333 -30.120 -0.369 455 HE3 MET 60 2HE MET 60 2.909 -30.107 -2.035 456 H ASP 61 H ASP 61 5.113 -33.548 3.355 457 HA ASP 61 HA ASP 61 4.684 -33.492 6.155 458 HB2 ASP 61 2HB ASP 61 7.363 -33.159 4.814 459 HB3 ASP 61 3HB ASP 61 7.010 -33.894 6.376 460 H GLY 62 H GLY 62 5.014 -31.015 3.896 461 HA2 GLY 62 2HA GLY 62 4.561 -28.757 4.700 462 HA3 GLY 62 3HA GLY 62 5.615 -29.101 6.063 463 H LEU 63 H LEU 63 7.912 -29.839 5.274 464 HA LEU 63 HA LEU 63 8.927 -27.630 3.715 465 HB2 LEU 63 2HB LEU 63 11.143 -28.896 4.200 466 HB3 LEU 63 3HB LEU 63 10.309 -28.046 5.499 467 HG LEU 63 HG LEU 63 9.463 -30.118 6.383 468 HD11 LEU 63 1HD1 LEU 63 8.971 -31.517 4.627 469 HD12 LEU 63 2HD1 LEU 63 10.441 -32.259 5.259 470 HD13 LEU 63 3HD1 LEU 63 10.516 -31.235 3.825 471 HD21 LEU 63 3HD2 LEU 63 11.503 -29.780 7.363 472 HD22 LEU 63 1HD2 LEU 63 12.378 -29.871 5.834 473 HD23 LEU 63 2HD2 LEU 63 11.784 -31.345 6.599 474 H ALA 64 H ALA 64 7.896 -30.780 3.077 475 HA ALA 64 HA ALA 64 9.548 -31.859 1.214 476 HB1 ALA 64 1HB ALA 64 7.834 -33.219 0.763 477 HB2 ALA 64 2HB ALA 64 6.955 -32.302 1.987 478 HB3 ALA 64 3HB ALA 64 6.785 -31.884 0.282 479 H LEU 65 H LEU 65 7.064 -29.397 0.526 480 HA LEU 65 HA LEU 65 8.056 -29.044 -2.169 481 HB2 LEU 65 2HB LEU 65 6.152 -27.869 -2.588 482 HB3 LEU 65 3HB LEU 65 5.606 -28.859 -1.236 483 HG LEU 65 HG LEU 65 6.592 -26.031 -0.913 484 HD11 LEU 65 1HD1 LEU 65 4.738 -25.514 -2.097 485 HD12 LEU 65 2HD1 LEU 65 3.949 -25.816 -0.549 486 HD13 LEU 65 3HD1 LEU 65 3.969 -27.071 -1.788 487 HD21 LEU 65 3HD2 LEU 65 4.803 -26.614 1.081 488 HD22 LEU 65 1HD2 LEU 65 6.559 -26.675 1.227 489 HD23 LEU 65 2HD2 LEU 65 5.654 -28.145 0.867 490 H LEU 66 H LEU 66 8.302 -27.460 0.929 491 HA LEU 66 HA LEU 66 9.138 -24.926 0.213 492 HB2 LEU 66 2HB LEU 66 8.786 -26.118 2.542 493 HB3 LEU 66 3HB LEU 66 10.535 -26.312 2.446 494 HG LEU 66 HG LEU 66 10.173 -24.373 3.726 495 HD11 LEU 66 1HD1 LEU 66 11.158 -22.612 2.402 496 HD12 LEU 66 2HD1 LEU 66 10.684 -23.424 0.910 497 HD13 LEU 66 3HD1 LEU 66 11.890 -24.157 1.968 498 HD21 LEU 66 3HD2 LEU 66 8.735 -22.604 2.073 499 HD22 LEU 66 1HD2 LEU 66 8.236 -23.299 3.615 500 HD23 LEU 66 2HD2 LEU 66 7.830 -24.118 2.106 501 H LYS 67 H LYS 67 11.055 -27.891 0.497 502 HA LYS 67 HA LYS 67 13.593 -26.856 0.115 503 HB2 LYS 67 2HB LYS 67 12.475 -29.477 -0.896 504 HB3 LYS 67 3HB LYS 67 14.186 -29.085 -0.793 505 HG2 LYS 67 2HG LYS 67 12.288 -29.230 1.540 506 HG3 LYS 67 3HG LYS 67 13.439 -30.482 1.071 507 HD2 LYS 67 2HD LYS 67 14.183 -27.659 1.834 508 HD3 LYS 67 3HD LYS 67 14.249 -29.046 2.924 509 HE2 LYS 67 2HE LYS 67 15.835 -30.138 1.374 510 HE3 LYS 67 3HE LYS 67 15.811 -28.690 0.367 511 HZ1 LYS 67 3HZ LYS 67 17.650 -29.036 2.167 512 HZ2 LYS 67 1HZ LYS 67 16.473 -28.413 3.210 513 HZ3 LYS 67 2HZ LYS 67 17.000 -27.499 1.888 514 H GLN 68 H GLN 68 10.997 -27.173 -2.142 515 HA GLN 68 HA GLN 68 12.624 -26.976 -4.500 516 HB2 GLN 68 2HB GLN 68 9.941 -27.605 -3.933 517 HB3 GLN 68 3HB GLN 68 9.894 -26.152 -4.923 518 HG2 GLN 68 2HG GLN 68 11.777 -27.910 -6.086 519 HG3 GLN 68 3HG GLN 68 10.327 -28.843 -5.718 520 HE21 GLN 68 1HE2 GLN 68 8.395 -26.895 -6.061 521 HE22 GLN 68 2HE2 GLN 68 8.332 -26.449 -7.728 522 H ILE 69 H ILE 69 10.694 -24.755 -2.546 523 HA ILE 69 HA ILE 69 10.718 -22.502 -4.131 524 HB ILE 69 HB ILE 69 11.063 -22.566 -1.131 525 HG12 ILE 69 2HG1 ILE 69 8.530 -22.372 -2.774 526 HG13 ILE 69 3HG1 ILE 69 9.096 -23.840 -1.985 527 HG21 ILE 69 1HG2 ILE 69 9.596 -20.342 -1.742 528 HG22 ILE 69 2HG2 ILE 69 11.326 -20.360 -1.402 529 HG23 ILE 69 3HG2 ILE 69 10.755 -20.402 -3.070 530 HD11 ILE 69 3HD1 ILE 69 7.907 -23.224 -0.225 531 HD12 ILE 69 1HD1 ILE 69 9.077 -21.930 0.026 532 HD13 ILE 69 2HD1 ILE 69 7.610 -21.624 -0.905 533 H LYS 70 H LYS 70 13.333 -23.938 -2.342 534 HA LYS 70 HA LYS 70 15.068 -21.691 -2.339 535 HB2 LYS 70 2HB LYS 70 15.216 -24.524 -1.629 536 HB3 LYS 70 3HB LYS 70 16.720 -23.904 -2.298 537 HG2 LYS 70 2HG LYS 70 17.205 -23.110 -0.292 538 HG3 LYS 70 3HG LYS 70 15.872 -21.968 -0.475 539 HD2 LYS 70 2HD LYS 70 14.612 -24.309 0.261 540 HD3 LYS 70 3HD LYS 70 16.095 -24.327 1.219 541 HE2 LYS 70 2HE LYS 70 14.547 -23.191 2.557 542 HE3 LYS 70 3HE LYS 70 15.517 -21.913 1.827 543 HZ1 LYS 70 3HZ LYS 70 13.801 -21.232 0.511 544 HZ2 LYS 70 1HZ LYS 70 12.922 -21.783 1.848 545 HZ3 LYS 70 2HZ LYS 70 13.059 -22.752 0.468 546 H GLN 71 H GLN 71 14.565 -24.381 -4.565 547 HA GLN 71 HA GLN 71 16.723 -23.537 -6.294 548 HB2 GLN 71 2HB GLN 71 15.890 -25.954 -5.882 549 HB3 GLN 71 3HB GLN 71 14.618 -25.550 -7.028 550 HG2 GLN 71 2HG GLN 71 16.060 -25.428 -8.802 551 HG3 GLN 71 3HG GLN 71 17.449 -25.045 -7.786 552 HE21 GLN 71 1HE2 GLN 71 15.241 -27.620 -8.719 553 HE22 GLN 71 2HE2 GLN 71 16.337 -28.920 -8.417 554 H ARG 72 H ARG 72 13.175 -23.712 -6.502 555 HA ARG 72 HA ARG 72 12.978 -22.501 -9.042 556 HB2 ARG 72 2HB ARG 72 11.199 -23.846 -7.813 557 HB3 ARG 72 3HB ARG 72 10.871 -22.386 -6.889 558 HG2 ARG 72 2HG ARG 72 10.040 -21.250 -8.738 559 HG3 ARG 72 3HG ARG 72 10.809 -22.354 -9.880 560 HD2 ARG 72 2HD ARG 72 8.656 -23.243 -7.979 561 HD3 ARG 72 3HD ARG 72 8.291 -22.574 -9.569 562 HE ARG 72 HE ARG 72 10.169 -24.757 -9.611 563 HH11 ARG 72 1HH1 ARG 72 6.809 -23.847 -9.683 564 HH12 ARG 72 2HH1 ARG 72 6.297 -25.303 -10.468 565 HH21 ARG 72 1HH2 ARG 72 9.507 -26.679 -10.645 566 HH22 ARG 72 2HH2 ARG 72 7.832 -26.914 -11.014 567 H HIS 73 H HIS 73 12.704 -21.176 -5.760 568 HA HIS 73 HA HIS 73 13.134 -18.497 -6.906 569 HB2 HIS 73 2HB HIS 73 11.523 -18.933 -4.404 570 HB3 HIS 73 3HB HIS 73 11.564 -17.521 -5.455 571 HD1 HIS 73 HD1 HIS 73 10.027 -17.521 -7.497 572 HD2 HIS 73 HD2 HIS 73 9.888 -21.053 -5.313 573 HE1 HIS 73 HE1 HIS 73 8.050 -18.789 -8.395 574 HA PRO 74 HA PRO 74 16.482 -19.468 -3.861 575 HB2 PRO 74 2HB PRO 74 18.472 -18.410 -5.375 576 HB3 PRO 74 3HB PRO 74 17.911 -20.077 -5.554 577 HG2 PRO 74 2HG PRO 74 17.222 -17.662 -7.183 578 HG3 PRO 74 3HG PRO 74 17.595 -19.308 -7.726 579 HD2 PRO 74 2HD PRO 74 15.060 -18.373 -7.546 580 HD3 PRO 74 3HD PRO 74 15.472 -20.076 -7.264 581 H MET 75 H MET 75 15.290 -16.646 -5.447 582 HA MET 75 HA MET 75 16.742 -14.894 -3.589 583 HB2 MET 75 2HB MET 75 16.059 -13.054 -5.063 584 HB3 MET 75 3HB MET 75 16.941 -14.292 -5.946 585 HG2 MET 75 2HG MET 75 15.283 -14.158 -7.422 586 HG3 MET 75 3HG MET 75 14.365 -15.113 -6.261 587 HE1 MET 75 3HE MET 75 12.293 -14.128 -4.830 588 HE2 MET 75 1HE MET 75 11.348 -13.084 -5.893 589 HE3 MET 75 2HE MET 75 12.074 -14.561 -6.526 590 H LEU 76 H LEU 76 13.945 -16.547 -3.672 591 HA LEU 76 HA LEU 76 12.266 -14.424 -2.571 592 HB2 LEU 76 2HB LEU 76 11.315 -15.942 -4.251 593 HB3 LEU 76 3HB LEU 76 11.622 -17.307 -3.179 594 HG LEU 76 HG LEU 76 10.057 -16.176 -1.529 595 HD11 LEU 76 1HD1 LEU 76 9.981 -13.958 -2.363 596 HD12 LEU 76 2HD1 LEU 76 8.386 -14.659 -2.634 597 HD13 LEU 76 3HD1 LEU 76 9.521 -14.508 -3.975 598 HD21 LEU 76 3HD2 LEU 76 8.888 -17.901 -2.329 599 HD22 LEU 76 1HD2 LEU 76 9.463 -17.640 -3.975 600 HD23 LEU 76 2HD2 LEU 76 8.087 -16.720 -3.367 601 HA PRO 77 HA PRO 77 13.653 -15.803 1.472 602 HB2 PRO 77 2HB PRO 77 12.453 -13.780 2.828 603 HB3 PRO 77 3HB PRO 77 13.986 -13.585 1.971 604 HG2 PRO 77 2HG PRO 77 11.221 -12.838 1.100 605 HG3 PRO 77 3HG PRO 77 12.730 -11.921 0.940 606 HD2 PRO 77 2HD PRO 77 11.653 -13.326 -1.110 607 HD3 PRO 77 3HD PRO 77 13.405 -13.115 -0.913 608 H VAL 78 H VAL 78 12.656 -17.455 2.426 609 HA VAL 78 HA VAL 78 9.731 -17.339 2.765 610 HB VAL 78 HB VAL 78 11.359 -19.867 2.853 611 HG11 VAL 78 1HG1 VAL 78 9.341 -20.530 3.608 612 HG12 VAL 78 2HG1 VAL 78 8.505 -19.143 2.907 613 HG13 VAL 78 3HG1 VAL 78 8.924 -20.525 1.894 614 HG21 VAL 78 3HG2 VAL 78 10.736 -20.236 0.500 615 HG22 VAL 78 1HG2 VAL 78 10.075 -18.602 0.435 616 HG23 VAL 78 2HG2 VAL 78 11.801 -18.845 0.698 617 H ILE 79 H ILE 79 8.885 -18.460 4.696 618 HA ILE 79 HA ILE 79 10.762 -18.448 6.958 619 HB ILE 79 HB ILE 79 8.012 -17.199 7.000 620 HG12 ILE 79 2HG1 ILE 79 10.572 -15.735 7.534 621 HG13 ILE 79 3HG1 ILE 79 10.056 -16.001 5.872 622 HG21 ILE 79 1HG2 ILE 79 8.718 -16.469 9.291 623 HG22 ILE 79 2HG2 ILE 79 8.440 -18.201 9.115 624 HG23 ILE 79 3HG2 ILE 79 10.087 -17.572 9.148 625 HD11 ILE 79 3HD1 ILE 79 8.798 -14.195 6.033 626 HD12 ILE 79 1HD1 ILE 79 7.812 -15.026 7.237 627 HD13 ILE 79 2HD1 ILE 79 9.179 -14.035 7.747 628 H ILE 80 H ILE 80 10.534 -20.106 8.345 629 HA ILE 80 HA ILE 80 8.374 -22.015 7.808 630 HB ILE 80 HB ILE 80 11.057 -22.320 9.136 631 HG12 ILE 80 2HG1 ILE 80 10.690 -22.423 6.585 632 HG13 ILE 80 3HG1 ILE 80 11.587 -23.736 7.339 633 HG21 ILE 80 1HG2 ILE 80 10.228 -24.809 9.244 634 HG22 ILE 80 2HG2 ILE 80 9.862 -23.676 10.544 635 HG23 ILE 80 3HG2 ILE 80 8.640 -24.048 9.329 636 HD11 ILE 80 3HD1 ILE 80 8.685 -24.142 7.125 637 HD12 ILE 80 1HD1 ILE 80 9.571 -24.090 5.602 638 HD13 ILE 80 2HD1 ILE 80 10.018 -25.262 6.843 639 H MET 81 H MET 81 6.968 -22.702 9.366 640 HA MET 81 HA MET 81 7.191 -21.433 12.015 641 HB2 MET 81 2HB MET 81 4.926 -21.479 10.098 642 HB3 MET 81 3HB MET 81 4.527 -21.693 11.798 643 HG2 MET 81 2HG MET 81 4.736 -19.527 12.176 644 HG3 MET 81 3HG MET 81 6.365 -19.521 11.504 645 HE1 MET 81 3HE MET 81 3.269 -20.661 9.397 646 HE2 MET 81 1HE MET 81 2.551 -19.524 10.538 647 HE3 MET 81 2HE MET 81 2.633 -19.119 8.823 648 H THR 82 H THR 82 7.208 -22.823 13.650 649 HA THR 82 HA THR 82 5.533 -25.027 13.965 650 HB THR 82 HB THR 82 6.537 -26.332 12.347 651 HG1 THR 82 HG1 THR 82 8.465 -27.098 14.178 652 HG21 THR 82 3HG2 THR 82 9.291 -26.270 12.582 653 HG22 THR 82 1HG2 THR 82 8.819 -24.587 12.811 654 HG23 THR 82 2HG2 THR 82 8.335 -25.448 11.350 655 H ALA 83 H ALA 83 8.984 -25.319 14.562 656 HA ALA 83 HA ALA 83 10.218 -25.334 16.474 657 HB1 ALA 83 1HB ALA 83 10.077 -23.158 17.018 658 HB2 ALA 83 2HB ALA 83 8.322 -23.121 16.845 659 HB3 ALA 83 3HB ALA 83 9.049 -23.743 18.327 660 H HIS 84 H HIS 84 9.384 -27.593 16.597 661 HA HIS 84 HA HIS 84 8.697 -28.270 19.218 662 HB2 HIS 84 2HB HIS 84 6.414 -29.170 18.882 663 HB3 HIS 84 3HB HIS 84 6.478 -27.419 18.706 664 HD1 HIS 84 HD1 HIS 84 6.237 -30.554 16.606 665 HD2 HIS 84 HD2 HIS 84 5.581 -26.463 16.300 666 HE1 HIS 84 HE1 HIS 84 5.107 -30.218 14.385 667 H SER 85 H SER 85 8.651 -29.164 15.826 668 HA SER 85 HA SER 85 10.103 -31.577 16.377 669 HB2 SER 85 2HB SER 85 7.436 -31.965 15.028 670 HB3 SER 85 3HB SER 85 8.524 -33.190 15.680 671 HG SER 85 HG SER 85 7.515 -32.999 17.500 672 H ASP 86 H ASP 86 10.309 -29.100 14.799 673 HA ASP 86 HA ASP 86 10.992 -30.357 12.249 674 HB2 ASP 86 2HB ASP 86 8.971 -28.237 12.648 675 HB3 ASP 86 3HB ASP 86 10.115 -27.957 11.338 676 H LEU 87 H LEU 87 11.228 -27.551 14.376 677 HA LEU 87 HA LEU 87 13.156 -26.053 13.134 678 HB2 LEU 87 2HB LEU 87 12.221 -26.428 15.857 679 HB3 LEU 87 3HB LEU 87 13.927 -25.991 15.793 680 HG LEU 87 HG LEU 87 13.371 -23.966 14.548 681 HD11 LEU 87 1HD1 LEU 87 10.598 -23.750 14.918 682 HD12 LEU 87 2HD1 LEU 87 10.876 -25.323 14.171 683 HD13 LEU 87 3HD1 LEU 87 11.482 -23.859 13.395 684 HD21 LEU 87 3HD2 LEU 87 13.474 -23.720 16.912 685 HD22 LEU 87 1HD2 LEU 87 11.861 -24.403 17.117 686 HD23 LEU 87 2HD2 LEU 87 12.059 -22.823 16.358 687 H ASP 88 H ASP 88 13.684 -28.832 15.285 688 HA ASP 88 HA ASP 88 16.401 -28.892 15.466 689 HB2 ASP 88 2HB ASP 88 15.269 -30.576 16.637 690 HB3 ASP 88 3HB ASP 88 14.390 -31.109 15.206 691 H ALA 89 H ALA 89 14.441 -29.928 12.719 692 HA ALA 89 HA ALA 89 16.795 -30.718 11.210 693 HB1 ALA 89 1HB ALA 89 14.472 -30.666 9.576 694 HB2 ALA 89 2HB ALA 89 15.358 -32.062 10.190 695 HB3 ALA 89 3HB ALA 89 14.039 -31.370 11.134 696 H ALA 90 H ALA 90 14.197 -28.300 10.947 697 HA ALA 90 HA ALA 90 14.973 -27.015 8.639 698 HB1 ALA 90 1HB ALA 90 13.938 -24.956 9.686 699 HB2 ALA 90 2HB ALA 90 12.919 -26.396 9.625 700 HB3 ALA 90 3HB ALA 90 13.698 -25.930 11.137 701 H VAL 91 H VAL 91 16.345 -26.764 11.855 702 HA VAL 91 HA VAL 91 17.809 -24.459 11.747 703 HB VAL 91 HB VAL 91 18.556 -27.133 12.917 704 HG11 VAL 91 1HG1 VAL 91 20.669 -26.369 12.935 705 HG12 VAL 91 2HG1 VAL 91 20.177 -24.702 12.626 706 HG13 VAL 91 3HG1 VAL 91 20.104 -25.355 14.263 707 HG21 VAL 91 3HG2 VAL 91 17.470 -26.468 14.763 708 HG22 VAL 91 1HG2 VAL 91 18.100 -24.824 14.655 709 HG23 VAL 91 2HG2 VAL 91 16.693 -25.294 13.701 710 H SER 92 H SER 92 19.028 -27.652 10.715 711 HA SER 92 HA SER 92 21.222 -26.381 9.301 712 HB2 SER 92 2HB SER 92 21.884 -28.343 10.439 713 HB3 SER 92 3HB SER 92 20.482 -29.248 9.867 714 HG SER 92 HG SER 92 22.457 -28.236 8.112 715 H ALA 93 H ALA 93 18.364 -28.334 8.555 716 HA ALA 93 HA ALA 93 18.768 -28.560 5.789 717 HB1 ALA 93 1HB ALA 93 16.302 -28.959 5.694 718 HB2 ALA 93 2HB ALA 93 17.163 -29.964 6.860 719 HB3 ALA 93 3HB ALA 93 16.232 -28.573 7.414 720 H TYR 94 H TYR 94 16.471 -26.382 7.443 721 HA TYR 94 HA TYR 94 15.830 -24.824 5.239 722 HB2 TYR 94 2HB TYR 94 14.852 -24.876 7.670 723 HB3 TYR 94 3HB TYR 94 16.007 -23.580 7.960 724 HD1 TYR 94 HD1 TYR 94 13.968 -24.284 4.922 725 HD2 TYR 94 HD2 TYR 94 14.704 -21.662 8.192 726 HE1 TYR 94 HE1 TYR 94 12.381 -22.663 3.972 727 HE2 TYR 94 HE2 TYR 94 13.118 -20.035 7.252 728 HH TYR 94 HH TYR 94 10.873 -20.683 5.106 729 H GLN 95 H GLN 95 18.715 -24.893 7.093 730 HA GLN 95 HA GLN 95 19.619 -22.249 6.559 731 HB2 GLN 95 2HB GLN 95 20.670 -24.663 7.820 732 HB3 GLN 95 3HB GLN 95 21.898 -23.773 6.930 733 HG2 GLN 95 2HG GLN 95 20.086 -22.404 8.881 734 HG3 GLN 95 3HG GLN 95 21.555 -23.227 9.403 735 HE21 GLN 95 1HE2 GLN 95 21.095 -20.492 9.741 736 HE22 GLN 95 2HE2 GLN 95 22.237 -19.621 8.781 737 H GLN 96 H GLN 96 18.943 -24.585 4.434 738 HA GLN 96 HA GLN 96 21.272 -24.574 2.777 739 HB2 GLN 96 2HB GLN 96 18.445 -25.521 2.438 740 HB3 GLN 96 3HB GLN 96 19.534 -25.468 1.057 741 HG2 GLN 96 2HG GLN 96 20.192 -26.914 3.606 742 HG3 GLN 96 3HG GLN 96 19.359 -27.673 2.250 743 HE21 GLN 96 1HE2 GLN 96 22.355 -26.487 3.468 744 HE22 GLN 96 2HE2 GLN 96 23.352 -27.049 2.174 745 H GLY 97 H GLY 97 20.123 -21.953 3.546 746 HA2 GLY 97 2HA GLY 97 20.527 -19.998 2.178 747 HA3 GLY 97 3HA GLY 97 19.854 -20.877 0.813 748 H ALA 98 H ALA 98 18.440 -20.814 4.028 749 HA ALA 98 HA ALA 98 16.133 -19.373 2.896 750 HB1 ALA 98 1HB ALA 98 15.944 -21.033 5.373 751 HB2 ALA 98 2HB ALA 98 14.697 -20.632 4.192 752 HB3 ALA 98 3HB ALA 98 15.947 -21.809 3.790 753 H PHE 99 H PHE 99 14.844 -18.151 4.580 754 HA PHE 99 HA PHE 99 16.691 -16.466 6.076 755 HB2 PHE 99 2HB PHE 99 15.215 -15.178 4.774 756 HB3 PHE 99 3HB PHE 99 13.826 -16.170 5.207 757 HD1 PHE 99 HD1 PHE 99 16.233 -13.688 6.524 758 HD2 PHE 99 HD2 PHE 99 12.480 -15.627 7.046 759 HE1 PHE 99 HE1 PHE 99 15.665 -12.098 8.315 760 HE2 PHE 99 HE2 PHE 99 11.906 -14.040 8.837 761 HZ PHE 99 HZ PHE 99 13.498 -12.273 9.473 762 H ASP 100 H ASP 100 16.381 -15.923 8.274 763 HA ASP 100 HA ASP 100 16.029 -17.944 10.055 764 HB2 ASP 100 2HB ASP 100 16.889 -15.615 10.532 765 HB3 ASP 100 3HB ASP 100 15.209 -15.100 10.660 766 H TYR 101 H TYR 101 14.384 -19.225 10.531 767 HA TYR 101 HA TYR 101 11.705 -18.599 9.724 768 HB2 TYR 101 2HB TYR 101 11.217 -20.803 10.957 769 HB3 TYR 101 3HB TYR 101 12.256 -20.876 9.538 770 HD1 TYR 101 HD1 TYR 101 12.848 -20.072 13.145 771 HD2 TYR 101 HD2 TYR 101 13.895 -22.473 9.792 772 HE1 TYR 101 HE1 TYR 101 14.591 -21.174 14.486 773 HE2 TYR 101 HE2 TYR 101 15.639 -23.582 11.124 774 HH TYR 101 HH TYR 101 15.928 -23.085 14.555 775 H LEU 102 H LEU 102 9.880 -19.042 11.353 776 HA LEU 102 HA LEU 102 10.506 -17.761 13.928 777 HB2 LEU 102 2HB LEU 102 9.440 -16.028 12.854 778 HB3 LEU 102 3HB LEU 102 8.402 -17.105 11.923 779 HG LEU 102 HG LEU 102 7.212 -17.591 14.128 780 HD11 LEU 102 1HD1 LEU 102 7.561 -15.207 15.443 781 HD12 LEU 102 2HD1 LEU 102 9.206 -15.652 14.991 782 HD13 LEU 102 3HD1 LEU 102 8.220 -16.766 15.938 783 HD21 LEU 102 3HD2 LEU 102 5.855 -16.372 12.794 784 HD22 LEU 102 1HD2 LEU 102 7.093 -15.161 12.455 785 HD23 LEU 102 2HD2 LEU 102 6.202 -15.110 13.977 786 HA PRO 103 HA PRO 103 8.553 -21.421 15.508 787 HB2 PRO 103 2HB PRO 103 8.575 -20.678 18.118 788 HB3 PRO 103 3HB PRO 103 10.017 -21.247 17.269 789 HG2 PRO 103 2HG PRO 103 9.159 -18.444 17.876 790 HG3 PRO 103 3HG PRO 103 10.771 -19.172 18.002 791 HD2 PRO 103 2HD PRO 103 10.033 -17.620 15.909 792 HD3 PRO 103 3HD PRO 103 11.178 -18.967 15.743 793 H LYS 104 H LYS 104 6.595 -22.022 16.585 794 HA LYS 104 HA LYS 104 4.613 -19.854 16.805 795 HB2 LYS 104 2HB LYS 104 4.249 -22.590 15.576 796 HB3 LYS 104 3HB LYS 104 2.922 -21.499 15.949 797 HG2 LYS 104 2HG LYS 104 4.495 -19.872 14.477 798 HG3 LYS 104 3HG LYS 104 4.863 -21.436 13.746 799 HD2 LYS 104 2HD LYS 104 3.023 -20.469 12.555 800 HD3 LYS 104 3HD LYS 104 2.409 -21.822 13.508 801 HE2 LYS 104 2HE LYS 104 1.148 -20.491 14.818 802 HE3 LYS 104 3HE LYS 104 2.363 -19.215 14.865 803 HZ1 LYS 104 3HZ LYS 104 0.135 -19.585 13.040 804 HZ2 LYS 104 1HZ LYS 104 1.574 -19.044 12.335 805 HZ3 LYS 104 2HZ LYS 104 0.861 -18.159 13.588 806 HA PRO 105 HA PRO 105 2.539 -19.598 17.428 807 HB2 PRO 105 2HB PRO 105 1.849 -18.139 19.610 808 HB3 PRO 105 3HB PRO 105 0.942 -19.560 19.079 809 HG2 PRO 105 2HG PRO 105 2.998 -19.323 21.243 810 HG3 PRO 105 3HG PRO 105 1.454 -20.195 21.257 811 HD2 PRO 105 2HD PRO 105 3.826 -21.438 20.856 812 HD3 PRO 105 3HD PRO 105 2.317 -21.996 20.106 813 H PHE 106 H PHE 106 2.634 -17.046 17.949 814 HA PHE 106 HA PHE 106 5.202 -16.142 18.881 815 HB2 PHE 106 2HB PHE 106 5.828 -15.097 16.693 816 HB3 PHE 106 3HB PHE 106 5.899 -16.857 16.690 817 HD1 PHE 106 HD1 PHE 106 3.602 -14.052 15.840 818 HD2 PHE 106 HD2 PHE 106 4.873 -18.024 14.988 819 HE1 PHE 106 HE1 PHE 106 2.120 -14.102 13.876 820 HE2 PHE 106 HE2 PHE 106 3.394 -18.080 13.023 821 HZ PHE 106 HZ PHE 106 2.015 -16.117 12.464 822 H ASP 107 H ASP 107 5.430 -13.695 18.302 823 HA ASP 107 HA ASP 107 2.882 -12.463 19.021 824 HB2 ASP 107 2HB ASP 107 5.710 -11.392 19.045 825 HB3 ASP 107 3HB ASP 107 4.293 -10.455 19.509 826 H ILE 108 H ILE 108 1.647 -11.725 17.434 827 HA ILE 108 HA ILE 108 2.250 -11.458 14.783 828 HB ILE 108 HB ILE 108 0.258 -9.953 16.462 829 HG12 ILE 108 2HG1 ILE 108 -0.395 -11.854 14.247 830 HG13 ILE 108 3HG1 ILE 108 0.186 -12.504 15.776 831 HG21 ILE 108 1HG2 ILE 108 0.706 -8.442 14.694 832 HG22 ILE 108 2HG2 ILE 108 0.744 -9.739 13.501 833 HG23 ILE 108 3HG2 ILE 108 -0.781 -9.287 14.263 834 HD11 ILE 108 3HD1 ILE 108 -1.866 -12.373 16.575 835 HD12 ILE 108 1HD1 ILE 108 -1.814 -10.620 16.392 836 HD13 ILE 108 2HD1 ILE 108 -2.426 -11.627 15.079 837 H ASP 109 H ASP 109 2.869 -9.165 17.357 838 HA ASP 109 HA ASP 109 3.437 -6.897 15.811 839 HB2 ASP 109 2HB ASP 109 3.141 -6.928 18.295 840 HB3 ASP 109 3HB ASP 109 4.735 -7.665 18.432 841 H GLU 110 H GLU 110 5.529 -9.539 16.911 842 HA GLU 110 HA GLU 110 7.861 -8.421 15.645 843 HB2 GLU 110 2HB GLU 110 7.322 -10.465 17.556 844 HB3 GLU 110 3HB GLU 110 8.221 -11.187 16.230 845 HG2 GLU 110 2HG GLU 110 10.021 -9.665 16.510 846 HG3 GLU 110 3HG GLU 110 9.092 -8.681 17.639 847 H ALA 111 H ALA 111 5.381 -10.735 14.846 848 HA ALA 111 HA ALA 111 6.710 -11.989 12.679 849 HB1 ALA 111 1HB ALA 111 4.519 -12.624 14.007 850 HB2 ALA 111 2HB ALA 111 3.747 -11.748 12.685 851 HB3 ALA 111 3HB ALA 111 4.769 -13.143 12.340 852 H VAL 112 H VAL 112 4.174 -9.478 12.723 853 HA VAL 112 HA VAL 112 4.018 -8.963 10.022 854 HB VAL 112 HB VAL 112 3.698 -7.115 12.378 855 HG11 VAL 112 1HG1 VAL 112 4.066 -5.447 10.902 856 HG12 VAL 112 2HG1 VAL 112 3.761 -6.474 9.500 857 HG13 VAL 112 3HG1 VAL 112 2.410 -5.803 10.414 858 HG21 VAL 112 3HG2 VAL 112 1.321 -7.305 11.824 859 HG22 VAL 112 1HG2 VAL 112 1.721 -8.368 10.474 860 HG23 VAL 112 2HG2 VAL 112 2.038 -8.887 12.129 861 H ALA 113 H ALA 113 6.420 -7.858 12.334 862 HA ALA 113 HA ALA 113 7.689 -6.084 10.439 863 HB1 ALA 113 1HB ALA 113 7.614 -6.159 13.161 864 HB2 ALA 113 2HB ALA 113 9.215 -6.820 12.826 865 HB3 ALA 113 3HB ALA 113 8.770 -5.230 12.206 866 H LEU 114 H LEU 114 8.134 -9.338 11.654 867 HA LEU 114 HA LEU 114 10.751 -9.816 10.818 868 HB2 LEU 114 2HB LEU 114 9.643 -11.378 12.239 869 HB3 LEU 114 3HB LEU 114 8.376 -11.651 11.044 870 HG LEU 114 HG LEU 114 10.254 -12.601 9.567 871 HD11 LEU 114 1HD1 LEU 114 12.138 -11.788 10.858 872 HD12 LEU 114 2HD1 LEU 114 12.141 -13.551 10.816 873 HD13 LEU 114 3HD1 LEU 114 11.598 -12.704 12.264 874 HD21 LEU 114 3HD2 LEU 114 10.208 -14.705 11.299 875 HD22 LEU 114 1HD2 LEU 114 8.933 -14.316 10.144 876 HD23 LEU 114 2HD2 LEU 114 8.799 -13.779 11.819 877 H VAL 115 H VAL 115 7.694 -10.262 9.066 878 HA VAL 115 HA VAL 115 8.839 -11.281 6.697 879 HB VAL 115 HB VAL 115 6.476 -11.567 7.134 880 HG11 VAL 115 1HG1 VAL 115 6.130 -9.433 8.327 881 HG12 VAL 115 2HG1 VAL 115 6.198 -8.585 6.781 882 HG13 VAL 115 3HG1 VAL 115 4.901 -9.737 7.100 883 HG21 VAL 115 3HG2 VAL 115 5.928 -9.971 4.853 884 HG22 VAL 115 1HG2 VAL 115 7.568 -10.601 4.696 885 HG23 VAL 115 2HG2 VAL 115 6.216 -11.709 4.933 886 H GLU 116 H GLU 116 8.091 -8.003 7.768 887 HA GLU 116 HA GLU 116 8.419 -6.596 5.418 888 HB2 GLU 116 2HB GLU 116 8.201 -5.971 8.140 889 HB3 GLU 116 3HB GLU 116 9.692 -5.204 7.611 890 HG2 GLU 116 2HG GLU 116 8.523 -4.009 5.883 891 HG3 GLU 116 3HG GLU 116 7.027 -4.862 6.257 892 H ARG 117 H ARG 117 10.841 -8.045 7.476 893 HA ARG 117 HA ARG 117 13.092 -6.710 6.386 894 HB2 ARG 117 2HB ARG 117 13.151 -9.474 7.578 895 HB3 ARG 117 3HB ARG 117 14.415 -8.252 7.595 896 HG2 ARG 117 2HG ARG 117 12.270 -7.047 8.881 897 HG3 ARG 117 3HG ARG 117 12.269 -8.713 9.466 898 HD2 ARG 117 2HD ARG 117 13.842 -8.047 10.904 899 HD3 ARG 117 3HD ARG 117 14.933 -8.042 9.520 900 HE ARG 117 HE ARG 117 15.025 -5.775 9.688 901 HH11 ARG 117 1HH1 ARG 117 12.100 -6.875 11.222 902 HH12 ARG 117 2HH1 ARG 117 11.647 -5.300 11.785 903 HH21 ARG 117 1HH2 ARG 117 14.440 -3.696 10.423 904 HH22 ARG 117 2HH2 ARG 117 12.979 -3.492 11.329 905 H ALA 118 H ALA 118 11.453 -9.739 5.604 906 HA ALA 118 HA ALA 118 13.331 -10.627 3.677 907 HB1 ALA 118 1HB ALA 118 10.642 -11.415 4.564 908 HB2 ALA 118 2HB ALA 118 11.037 -11.829 2.895 909 HB3 ALA 118 3HB ALA 118 12.060 -12.403 4.212 910 H ILE 119 H ILE 119 10.437 -8.626 3.493 911 HA ILE 119 HA ILE 119 10.411 -8.515 0.630 912 HB ILE 119 HB ILE 119 9.009 -6.803 2.684 913 HG12 ILE 119 2HG1 ILE 119 7.867 -8.936 0.876 914 HG13 ILE 119 3HG1 ILE 119 8.413 -9.260 2.518 915 HG21 ILE 119 1HG2 ILE 119 8.737 -6.879 -0.315 916 HG22 ILE 119 2HG2 ILE 119 7.571 -6.115 0.764 917 HG23 ILE 119 3HG2 ILE 119 9.225 -5.510 0.684 918 HD11 ILE 119 3HD1 ILE 119 5.941 -8.879 2.194 919 HD12 ILE 119 1HD1 ILE 119 6.724 -7.920 3.449 920 HD13 ILE 119 2HD1 ILE 119 6.338 -7.188 1.891 921 H SER 120 H SER 120 11.399 -6.282 3.210 922 HA SER 120 HA SER 120 12.204 -4.181 1.514 923 HB2 SER 120 2HB SER 120 12.935 -4.914 4.348 924 HB3 SER 120 3HB SER 120 13.596 -3.487 3.550 925 HG SER 120 HG SER 120 11.109 -3.907 4.597 926 H HIS 121 H HIS 121 13.725 -7.145 2.439 927 HA HIS 121 HA HIS 121 16.412 -6.602 2.114 928 HB2 HIS 121 2HB HIS 121 15.321 -8.798 2.799 929 HB3 HIS 121 3HB HIS 121 15.101 -9.117 1.081 930 HD1 HIS 121 HD1 HIS 121 17.197 -9.709 -0.293 931 HD2 HIS 121 HD2 HIS 121 17.961 -9.002 3.729 932 HE1 HIS 121 HE1 HIS 121 19.542 -10.529 0.101 933 H TYR 122 H TYR 122 13.919 -6.915 -0.308 934 HA TYR 122 HA TYR 122 15.594 -7.236 -2.561 935 HB2 TYR 122 2HB TYR 122 12.774 -6.234 -2.217 936 HB3 TYR 122 3HB TYR 122 13.551 -6.288 -3.796 937 HD1 TYR 122 HD1 TYR 122 14.966 -8.766 -3.880 938 HD2 TYR 122 HD2 TYR 122 11.213 -7.924 -2.061 939 HE1 TYR 122 HE1 TYR 122 14.328 -11.130 -4.117 940 HE2 TYR 122 HE2 TYR 122 10.565 -10.285 -2.292 941 HH TYR 122 HH TYR 122 12.833 -12.706 -3.483 942 H GLN 123 H GLN 123 13.634 -4.344 -1.897 943 HA GLN 123 HA GLN 123 15.064 -2.600 -3.492 944 HB2 GLN 123 2HB GLN 123 13.620 -1.922 -0.924 945 HB3 GLN 123 3HB GLN 123 14.037 -0.790 -2.204 946 HG2 GLN 123 2HG GLN 123 11.996 -1.168 -2.990 947 HG3 GLN 123 3HG GLN 123 12.626 -2.718 -3.546 948 HE21 GLN 123 1HE2 GLN 123 9.956 -1.740 -2.500 949 HE22 GLN 123 2HE2 GLN 123 9.530 -2.901 -1.293 950 H GLU 124 H GLU 124 15.734 -3.678 -0.236 951 HA GLU 124 HA GLU 124 17.486 -3.337 1.177 952 HB2 GLU 124 2HB GLU 124 18.568 -3.469 -1.496 953 HB3 GLU 124 3HB GLU 124 19.546 -2.409 -0.491 954 HG2 GLU 124 2HG GLU 124 19.174 -4.527 1.168 955 HG3 GLU 124 3HG GLU 124 19.220 -5.315 -0.408 Start of MODEL 22 1 H1 MET 1 H MET 1 -0.134 0.140 -1.631 2 HA MET 1 HA MET 1 0.097 -0.573 -3.846 3 HB2 MET 1 2HB MET 1 2.183 0.232 -4.663 4 HB3 MET 1 3HB MET 1 1.769 1.227 -3.273 5 HG2 MET 1 2HG MET 1 3.282 -0.929 -2.292 6 HG3 MET 1 3HG MET 1 4.102 -0.349 -3.739 7 HE1 MET 1 3HE MET 1 5.400 1.331 -3.997 8 HE2 MET 1 1HE MET 1 4.596 2.876 -3.719 9 HE3 MET 1 2HE MET 1 6.022 2.443 -2.777 10 H GLN 2 H GLN 2 0.481 -2.785 -1.781 11 HA GLN 2 HA GLN 2 1.157 -4.960 -1.696 12 HB2 GLN 2 2HB GLN 2 1.043 -4.700 -4.706 13 HB3 GLN 2 3HB GLN 2 0.986 -6.202 -3.792 14 HG2 GLN 2 2HG GLN 2 -1.213 -6.046 -3.708 15 HG3 GLN 2 3HG GLN 2 -1.061 -4.554 -2.780 16 HE21 GLN 2 1HE2 GLN 2 -2.067 -5.952 -5.675 17 HE22 GLN 2 2HE2 GLN 2 -2.412 -4.502 -6.548 18 H ARG 3 H ARG 3 3.261 -3.089 -1.527 19 HA ARG 3 HA ARG 3 5.431 -3.572 -3.213 20 HB2 ARG 3 2HB ARG 3 6.823 -2.799 -1.265 21 HB3 ARG 3 3HB ARG 3 5.519 -1.712 -1.723 22 HG2 ARG 3 2HG ARG 3 5.235 -1.697 0.526 23 HG3 ARG 3 3HG ARG 3 4.216 -3.081 0.127 24 HD2 ARG 3 2HD ARG 3 5.679 -3.567 2.023 25 HD3 ARG 3 3HD ARG 3 6.051 -4.597 0.642 26 HE ARG 3 HE ARG 3 8.122 -3.622 0.510 27 HH11 ARG 3 1HH1 ARG 3 6.077 -1.715 2.584 28 HH12 ARG 3 2HH1 ARG 3 7.364 -0.691 3.130 29 HH21 ARG 3 1HH2 ARG 3 9.825 -2.281 1.221 30 HH22 ARG 3 2HH2 ARG 3 9.495 -1.014 2.353 31 H GLY 4 H GLY 4 4.002 -5.568 -0.823 32 HA2 GLY 4 2HA GLY 4 5.890 -7.679 -1.404 33 HA3 GLY 4 3HA GLY 4 5.949 -7.102 0.255 34 H ILE 5 H ILE 5 4.228 -8.984 -2.056 35 HA ILE 5 HA ILE 5 1.886 -9.355 -0.415 36 HB ILE 5 HB ILE 5 2.817 -10.734 -2.932 37 HG12 ILE 5 2HG1 ILE 5 0.390 -8.990 -2.580 38 HG13 ILE 5 3HG1 ILE 5 1.972 -8.290 -2.904 39 HG21 ILE 5 1HG2 ILE 5 1.550 -12.370 -1.804 40 HG22 ILE 5 2HG2 ILE 5 0.364 -11.187 -1.257 41 HG23 ILE 5 3HG2 ILE 5 0.444 -11.631 -2.962 42 HD11 ILE 5 3HD1 ILE 5 1.659 -10.307 -4.801 43 HD12 ILE 5 1HD1 ILE 5 0.098 -9.492 -4.713 44 HD13 ILE 5 2HD1 ILE 5 1.558 -8.565 -5.057 45 H VAL 6 H VAL 6 1.584 -10.846 1.110 46 HA VAL 6 HA VAL 6 3.574 -13.008 1.352 47 HB VAL 6 HB VAL 6 1.961 -11.928 3.651 48 HG11 VAL 6 1HG1 VAL 6 2.968 -14.121 3.958 49 HG12 VAL 6 2HG1 VAL 6 4.547 -13.475 3.504 50 HG13 VAL 6 3HG1 VAL 6 3.761 -12.925 4.984 51 HG21 VAL 6 3HG2 VAL 6 3.911 -10.567 4.265 52 HG22 VAL 6 1HG2 VAL 6 4.694 -11.020 2.751 53 HG23 VAL 6 2HG2 VAL 6 3.216 -10.058 2.726 54 H TRP 7 H TRP 7 2.804 -14.973 0.996 55 HA TRP 7 HA TRP 7 -0.085 -15.427 1.188 56 HB2 TRP 7 2HB TRP 7 2.116 -16.970 -0.191 57 HB3 TRP 7 3HB TRP 7 0.456 -17.546 -0.074 58 HD1 TRP 7 HD1 TRP 7 -0.061 -14.046 -0.515 59 HE1 TRP 7 HE1 TRP 7 -0.379 -13.399 -2.986 60 HE3 TRP 7 HE3 TRP 7 1.750 -18.295 -2.706 61 HZ2 TRP 7 HZ2 TRP 7 0.077 -14.539 -5.528 62 HZ3 TRP 7 HZ3 TRP 7 1.774 -18.437 -5.163 63 HH2 TRP 7 HH2 TRP 7 0.953 -16.597 -6.542 64 H VAL 8 H VAL 8 -0.975 -17.004 2.468 65 HA VAL 8 HA VAL 8 0.856 -18.275 4.398 66 HB VAL 8 HB VAL 8 -2.050 -17.572 4.830 67 HG11 VAL 8 1HG1 VAL 8 -1.144 -17.921 7.281 68 HG12 VAL 8 2HG1 VAL 8 -1.704 -19.283 6.309 69 HG13 VAL 8 3HG1 VAL 8 0.023 -18.954 6.456 70 HG21 VAL 8 3HG2 VAL 8 0.382 -16.213 5.982 71 HG22 VAL 8 1HG2 VAL 8 -0.546 -15.596 4.615 72 HG23 VAL 8 2HG2 VAL 8 -1.305 -15.750 6.200 73 H VAL 9 H VAL 9 0.526 -20.422 4.970 74 HA VAL 9 HA VAL 9 -1.599 -21.921 3.656 75 HB VAL 9 HB VAL 9 0.338 -21.911 2.073 76 HG11 VAL 9 1HG1 VAL 9 2.067 -21.918 3.898 77 HG12 VAL 9 2HG1 VAL 9 1.713 -23.632 4.126 78 HG13 VAL 9 3HG1 VAL 9 2.354 -23.060 2.585 79 HG21 VAL 9 3HG2 VAL 9 -0.791 -23.744 1.472 80 HG22 VAL 9 1HG2 VAL 9 0.444 -24.649 2.348 81 HG23 VAL 9 2HG2 VAL 9 -1.070 -24.223 3.146 82 H ASP 10 H ASP 10 -2.409 -23.384 5.007 83 HA ASP 10 HA ASP 10 -0.768 -24.903 6.802 84 HB2 ASP 10 2HB ASP 10 -1.649 -24.124 8.884 85 HB3 ASP 10 3HB ASP 10 -1.075 -22.709 8.005 86 H ASP 11 H ASP 11 -2.665 -25.794 8.578 87 HA ASP 11 HA ASP 11 -4.746 -26.921 6.820 88 HB2 ASP 11 2HB ASP 11 -2.719 -28.384 7.797 89 HB3 ASP 11 3HB ASP 11 -3.827 -28.502 9.161 90 H ASP 12 H ASP 12 -4.162 -25.002 9.447 91 HA ASP 12 HA ASP 12 -6.687 -25.722 10.771 92 HB2 ASP 12 2HB ASP 12 -4.115 -24.672 11.723 93 HB3 ASP 12 3HB ASP 12 -5.517 -23.841 12.391 94 H SER 13 H SER 13 -8.115 -23.999 11.440 95 HA SER 13 HA SER 13 -8.445 -22.037 9.366 96 HB2 SER 13 2HB SER 13 -10.573 -22.425 9.970 97 HB3 SER 13 3HB SER 13 -10.069 -23.197 11.473 98 HG SER 13 HG SER 13 -11.235 -21.384 12.009 99 H SER 14 H SER 14 -8.090 -21.815 12.909 100 HA SER 14 HA SER 14 -7.741 -19.011 12.943 101 HB2 SER 14 2HB SER 14 -6.825 -19.437 15.268 102 HB3 SER 14 3HB SER 14 -8.438 -20.081 14.964 103 HG SER 14 HG SER 14 -7.571 -21.867 15.666 104 H ILE 15 H ILE 15 -5.457 -21.708 12.883 105 HA ILE 15 HA ILE 15 -3.076 -20.400 13.320 106 HB ILE 15 HB ILE 15 -3.705 -22.705 11.489 107 HG12 ILE 15 2HG1 ILE 15 -3.960 -23.115 13.888 108 HG13 ILE 15 3HG1 ILE 15 -2.582 -24.008 13.253 109 HG21 ILE 15 1HG2 ILE 15 -1.765 -21.717 10.533 110 HG22 ILE 15 2HG2 ILE 15 -1.031 -21.476 12.117 111 HG23 ILE 15 3HG2 ILE 15 -1.227 -23.107 11.475 112 HD11 ILE 15 3HD1 ILE 15 -2.673 -22.159 15.400 113 HD12 ILE 15 1HD1 ILE 15 -1.306 -23.101 14.806 114 HD13 ILE 15 2HD1 ILE 15 -1.631 -21.502 14.138 115 H ARG 16 H ARG 16 -4.941 -20.604 10.326 116 HA ARG 16 HA ARG 16 -2.975 -19.133 8.813 117 HB2 ARG 16 2HB ARG 16 -4.184 -19.695 6.971 118 HB3 ARG 16 3HB ARG 16 -4.836 -20.909 8.064 119 HG2 ARG 16 2HG ARG 16 -6.599 -19.055 8.597 120 HG3 ARG 16 3HG ARG 16 -6.093 -18.417 7.032 121 HD2 ARG 16 2HD ARG 16 -6.437 -20.910 6.273 122 HD3 ARG 16 3HD ARG 16 -7.485 -20.969 7.689 123 HE ARG 16 HE ARG 16 -8.029 -19.673 5.203 124 HH11 ARG 16 1HH1 ARG 16 -8.627 -19.549 8.631 125 HH12 ARG 16 2HH1 ARG 16 -10.132 -18.706 8.469 126 HH21 ARG 16 1HH2 ARG 16 -10.009 -18.563 4.978 127 HH22 ARG 16 2HH2 ARG 16 -10.917 -18.147 6.391 128 H TRP 17 H TRP 17 -5.758 -18.417 10.724 129 HA TRP 17 HA TRP 17 -6.401 -15.897 9.586 130 HB2 TRP 17 2HB TRP 17 -8.116 -16.824 10.876 131 HB3 TRP 17 3HB TRP 17 -7.027 -17.247 12.194 132 HD1 TRP 17 HD1 TRP 17 -8.992 -14.288 10.765 133 HE1 TRP 17 HE1 TRP 17 -9.123 -12.447 12.559 134 HE3 TRP 17 HE3 TRP 17 -5.832 -16.311 14.238 135 HZ2 TRP 17 HZ2 TRP 17 -8.032 -11.921 15.108 136 HZ3 TRP 17 HZ3 TRP 17 -5.429 -15.075 16.327 137 HH2 TRP 17 HH2 TRP 17 -6.507 -12.925 16.751 138 H VAL 18 H VAL 18 -4.535 -16.809 12.479 139 HA VAL 18 HA VAL 18 -3.844 -14.353 13.455 140 HB VAL 18 HB VAL 18 -1.849 -15.336 14.392 141 HG11 VAL 18 1HG1 VAL 18 -2.811 -17.360 15.432 142 HG12 VAL 18 2HG1 VAL 18 -3.936 -16.000 15.416 143 HG13 VAL 18 3HG1 VAL 18 -4.122 -17.315 14.254 144 HG21 VAL 18 3HG2 VAL 18 -2.080 -17.114 12.061 145 HG22 VAL 18 1HG2 VAL 18 -0.650 -16.563 12.934 146 HG23 VAL 18 2HG2 VAL 18 -1.605 -17.905 13.564 147 H LEU 19 H LEU 19 -2.562 -15.964 10.618 148 HA LEU 19 HA LEU 19 -0.494 -13.978 10.221 149 HB2 LEU 19 2HB LEU 19 -1.363 -16.465 8.832 150 HB3 LEU 19 3HB LEU 19 -0.403 -15.287 7.938 151 HG LEU 19 HG LEU 19 0.437 -16.650 10.496 152 HD11 LEU 19 1HD1 LEU 19 0.590 -18.337 8.939 153 HD12 LEU 19 2HD1 LEU 19 2.180 -17.587 8.801 154 HD13 LEU 19 3HD1 LEU 19 0.930 -17.228 7.610 155 HD21 LEU 19 3HD2 LEU 19 1.338 -14.263 9.290 156 HD22 LEU 19 1HD2 LEU 19 2.567 -15.492 8.992 157 HD23 LEU 19 2HD2 LEU 19 2.054 -15.140 10.643 158 H GLU 20 H GLU 20 -3.635 -14.811 8.854 159 HA GLU 20 HA GLU 20 -3.591 -13.042 6.672 160 HB2 GLU 20 2HB GLU 20 -5.356 -14.913 7.650 161 HB3 GLU 20 3HB GLU 20 -6.219 -13.404 7.914 162 HG2 GLU 20 2HG GLU 20 -4.971 -13.782 5.262 163 HG3 GLU 20 3HG GLU 20 -6.368 -14.787 5.645 164 H ARG 21 H ARG 21 -4.867 -12.633 9.965 165 HA ARG 21 HA ARG 21 -5.739 -9.964 9.576 166 HB2 ARG 21 2HB ARG 21 -5.983 -9.885 11.998 167 HB3 ARG 21 3HB ARG 21 -6.604 -11.406 11.372 168 HG2 ARG 21 2HG ARG 21 -5.029 -12.640 12.418 169 HG3 ARG 21 3HG ARG 21 -3.784 -11.402 12.236 170 HD2 ARG 21 2HD ARG 21 -6.045 -10.750 14.024 171 HD3 ARG 21 3HD ARG 21 -4.941 -12.006 14.582 172 HE ARG 21 HE ARG 21 -3.356 -9.908 13.744 173 HH11 ARG 21 1HH1 ARG 21 -5.837 -10.433 16.130 174 HH12 ARG 21 2HH1 ARG 21 -5.210 -9.251 17.231 175 HH21 ARG 21 1HH2 ARG 21 -2.522 -8.350 15.185 176 HH22 ARG 21 2HH2 ARG 21 -3.325 -8.066 16.692 177 H ALA 22 H ALA 22 -2.661 -11.366 10.175 178 HA ALA 22 HA ALA 22 -1.405 -9.137 11.410 179 HB1 ALA 22 1HB ALA 22 -0.019 -10.859 11.763 180 HB2 ALA 22 2HB ALA 22 -0.585 -11.731 10.337 181 HB3 ALA 22 3HB ALA 22 0.633 -10.466 10.172 182 H LEU 23 H LEU 23 -1.534 -10.288 8.049 183 HA LEU 23 HA LEU 23 0.009 -8.103 7.038 184 HB2 LEU 23 2HB LEU 23 -1.835 -9.825 5.414 185 HB3 LEU 23 3HB LEU 23 -0.358 -9.012 4.902 186 HG LEU 23 HG LEU 23 -0.354 -11.287 6.871 187 HD11 LEU 23 1HD1 LEU 23 0.447 -12.593 4.806 188 HD12 LEU 23 2HD1 LEU 23 -0.363 -11.333 3.876 189 HD13 LEU 23 3HD1 LEU 23 -1.284 -12.322 5.008 190 HD21 LEU 23 3HD2 LEU 23 1.941 -11.358 6.540 191 HD22 LEU 23 1HD2 LEU 23 1.600 -9.627 6.555 192 HD23 LEU 23 2HD2 LEU 23 1.852 -10.463 5.022 193 H ALA 24 H ALA 24 -3.435 -8.864 7.224 194 HA ALA 24 HA ALA 24 -4.509 -6.878 5.650 195 HB1 ALA 24 1HB ALA 24 -5.490 -8.170 8.172 196 HB2 ALA 24 2HB ALA 24 -6.439 -6.936 7.342 197 HB3 ALA 24 3HB ALA 24 -6.019 -8.433 6.510 198 H GLY 25 H GLY 25 -3.567 -6.654 9.074 199 HA2 GLY 25 2HA GLY 25 -4.181 -3.816 9.130 200 HA3 GLY 25 3HA GLY 25 -3.578 -4.781 10.469 201 H ALA 26 H ALA 26 -1.645 -5.536 7.944 202 HA ALA 26 HA ALA 26 0.419 -3.679 8.860 203 HB1 ALA 26 1HB ALA 26 0.638 -6.170 7.174 204 HB2 ALA 26 2HB ALA 26 1.992 -5.189 7.734 205 HB3 ALA 26 3HB ALA 26 0.981 -6.042 8.900 206 H GLY 27 H GLY 27 -1.538 -4.407 6.091 207 HA2 GLY 27 2HA GLY 27 -1.926 -2.798 4.382 208 HA3 GLY 27 3HA GLY 27 -0.339 -2.116 4.703 209 H LEU 28 H LEU 28 -0.847 -5.554 4.367 210 HA LEU 28 HA LEU 28 0.284 -5.473 1.659 211 HB2 LEU 28 2HB LEU 28 1.215 -7.673 3.377 212 HB3 LEU 28 3HB LEU 28 2.074 -6.755 2.141 213 HG LEU 28 HG LEU 28 1.515 -5.734 4.923 214 HD11 LEU 28 1HD1 LEU 28 3.376 -6.701 5.692 215 HD12 LEU 28 2HD1 LEU 28 4.272 -6.374 4.210 216 HD13 LEU 28 3HD1 LEU 28 3.219 -7.784 4.310 217 HD21 LEU 28 3HD2 LEU 28 2.162 -3.785 4.081 218 HD22 LEU 28 1HD2 LEU 28 2.481 -4.520 2.510 219 HD23 LEU 28 2HD2 LEU 28 3.740 -4.498 3.745 220 H THR 29 H THR 29 -0.386 -7.090 0.287 221 HA THR 29 HA THR 29 -2.892 -8.184 0.582 222 HB THR 29 HB THR 29 -0.736 -9.540 -1.032 223 HG1 THR 29 HG1 THR 29 -2.320 -7.367 -1.943 224 HG21 THR 29 3HG2 THR 29 -2.712 -10.781 -1.188 225 HG22 THR 29 1HG2 THR 29 -2.766 -9.740 -2.610 226 HG23 THR 29 2HG2 THR 29 -3.728 -9.340 -1.186 227 H CYS 30 H CYS 30 -3.581 -10.426 0.797 228 HA CYS 30 HA CYS 30 -1.782 -12.218 2.215 229 HB2 CYS 30 2HB CYS 30 -3.494 -12.565 4.032 230 HB3 CYS 30 3HB CYS 30 -2.672 -11.010 4.076 231 HG CYS 30 HG CYS 30 -5.105 -10.168 4.692 232 H THR 31 H THR 31 -2.018 -14.159 1.348 233 HA THR 31 HA THR 31 -4.685 -14.965 0.387 234 HB THR 31 HB THR 31 -2.070 -15.713 -0.933 235 HG1 THR 31 HG1 THR 31 -3.045 -14.300 -2.637 236 HG21 THR 31 3HG2 THR 31 -4.799 -15.971 -2.139 237 HG22 THR 31 1HG2 THR 31 -4.187 -17.219 -1.054 238 HG23 THR 31 2HG2 THR 31 -3.315 -16.837 -2.538 239 H THR 32 H THR 32 -5.385 -16.515 1.702 240 HA THR 32 HA THR 32 -3.456 -18.459 2.771 241 HB THR 32 HB THR 32 -4.960 -18.912 4.544 242 HG1 THR 32 HG1 THR 32 -6.894 -17.358 3.135 243 HG21 THR 32 3HG2 THR 32 -5.515 -16.001 4.316 244 HG22 THR 32 1HG2 THR 32 -3.829 -16.517 4.316 245 HG23 THR 32 2HG2 THR 32 -4.877 -16.928 5.674 246 H PHE 33 H PHE 33 -3.470 -20.493 2.071 247 HA PHE 33 HA PHE 33 -5.701 -21.358 0.366 248 HB2 PHE 33 2HB PHE 33 -2.868 -22.403 0.551 249 HB3 PHE 33 3HB PHE 33 -4.112 -23.043 -0.518 250 HD1 PHE 33 HD1 PHE 33 -1.852 -20.241 0.130 251 HD2 PHE 33 HD2 PHE 33 -4.790 -21.850 -2.495 252 HE1 PHE 33 HE1 PHE 33 -1.212 -18.599 -1.588 253 HE2 PHE 33 HE2 PHE 33 -4.155 -20.212 -4.217 254 HZ PHE 33 HZ PHE 33 -2.363 -18.584 -3.765 255 H GLU 34 H GLU 34 -3.708 -23.892 1.286 256 HA GLU 34 HA GLU 34 -4.630 -24.651 3.792 257 HB2 GLU 34 2HB GLU 34 -6.287 -26.449 3.018 258 HB3 GLU 34 3HB GLU 34 -6.858 -24.787 3.075 259 HG2 GLU 34 2HG GLU 34 -6.451 -24.599 0.650 260 HG3 GLU 34 3HG GLU 34 -5.988 -26.299 0.624 261 H ASN 35 H ASN 35 -3.682 -25.637 0.570 262 HA ASN 35 HA ASN 35 -2.202 -27.898 1.747 263 HB2 ASN 35 2HB ASN 35 -4.037 -27.847 -0.435 264 HB3 ASN 35 3HB ASN 35 -2.438 -28.213 -1.076 265 HD21 ASN 35 1HD2 ASN 35 -4.931 -29.827 -0.662 266 HD22 ASN 35 2HD2 ASN 35 -4.400 -31.230 0.196 267 H GLY 36 H GLY 36 -0.052 -27.829 1.610 268 HA2 GLY 36 2HA GLY 36 1.393 -25.634 0.778 269 HA3 GLY 36 3HA GLY 36 2.066 -27.250 0.932 270 H ASN 37 H ASN 37 0.893 -28.649 -1.054 271 HA ASN 37 HA ASN 37 2.355 -27.927 -3.316 272 HB2 ASN 37 2HB ASN 37 1.666 -30.212 -3.005 273 HB3 ASN 37 3HB ASN 37 -0.035 -29.755 -3.028 274 HD21 ASN 37 1HD2 ASN 37 -0.903 -30.557 -4.795 275 HD22 ASN 37 2HD2 ASN 37 -0.239 -30.462 -6.387 276 H GLU 38 H GLU 38 -0.754 -26.898 -2.233 277 HA GLU 38 HA GLU 38 -1.720 -26.008 -4.778 278 HB2 GLU 38 2HB GLU 38 -2.843 -26.405 -2.282 279 HB3 GLU 38 3HB GLU 38 -2.843 -24.655 -2.445 280 HG2 GLU 38 2HG GLU 38 -4.351 -24.667 -4.140 281 HG3 GLU 38 3HG GLU 38 -3.823 -26.236 -4.748 282 H VAL 39 H VAL 39 0.524 -24.804 -2.533 283 HA VAL 39 HA VAL 39 0.177 -22.019 -3.299 284 HB VAL 39 HB VAL 39 2.413 -23.117 -1.610 285 HG11 VAL 39 1HG1 VAL 39 2.841 -20.886 -2.153 286 HG12 VAL 39 2HG1 VAL 39 1.144 -20.427 -2.001 287 HG13 VAL 39 3HG1 VAL 39 2.090 -20.800 -0.560 288 HG21 VAL 39 3HG2 VAL 39 1.012 -22.683 0.360 289 HG22 VAL 39 1HG2 VAL 39 -0.351 -22.322 -0.699 290 HG23 VAL 39 2HG2 VAL 39 0.332 -23.948 -0.663 291 H LEU 40 H LEU 40 2.529 -24.631 -3.705 292 HA LEU 40 HA LEU 40 4.588 -23.293 -4.945 293 HB2 LEU 40 2HB LEU 40 5.108 -25.478 -4.568 294 HB3 LEU 40 3HB LEU 40 3.523 -26.055 -5.076 295 HG LEU 40 HG LEU 40 4.152 -25.806 -7.409 296 HD11 LEU 40 1HD1 LEU 40 6.145 -24.095 -6.354 297 HD12 LEU 40 2HD1 LEU 40 5.768 -24.433 -8.043 298 HD13 LEU 40 3HD1 LEU 40 6.958 -25.418 -7.191 299 HD21 LEU 40 3HD2 LEU 40 5.187 -27.794 -7.455 300 HD22 LEU 40 1HD2 LEU 40 5.028 -27.737 -5.699 301 HD23 LEU 40 2HD2 LEU 40 6.533 -27.228 -6.465 302 H ALA 41 H ALA 41 1.622 -24.563 -6.407 303 HA ALA 41 HA ALA 41 2.315 -23.775 -9.062 304 HB1 ALA 41 1HB ALA 41 0.101 -25.113 -7.748 305 HB2 ALA 41 2HB ALA 41 -0.437 -24.011 -9.016 306 HB3 ALA 41 3HB ALA 41 0.716 -25.291 -9.391 307 H ALA 42 H ALA 42 0.744 -22.234 -6.367 308 HA ALA 42 HA ALA 42 -0.608 -20.182 -7.734 309 HB1 ALA 42 1HB ALA 42 0.575 -20.092 -4.962 310 HB2 ALA 42 2HB ALA 42 -0.680 -19.031 -5.602 311 HB3 ALA 42 3HB ALA 42 -1.009 -20.748 -5.376 312 H LEU 43 H LEU 43 2.721 -20.493 -6.645 313 HA LEU 43 HA LEU 43 3.572 -17.861 -6.895 314 HB2 LEU 43 2HB LEU 43 5.272 -20.192 -7.716 315 HB3 LEU 43 3HB LEU 43 5.767 -18.685 -6.948 316 HG LEU 43 HG LEU 43 4.248 -20.940 -5.640 317 HD11 LEU 43 1HD1 LEU 43 6.556 -21.520 -5.996 318 HD12 LEU 43 2HD1 LEU 43 6.307 -21.154 -4.290 319 HD13 LEU 43 3HD1 LEU 43 7.086 -19.971 -5.340 320 HD21 LEU 43 3HD2 LEU 43 4.192 -19.698 -3.670 321 HD22 LEU 43 1HD2 LEU 43 3.757 -18.522 -4.911 322 HD23 LEU 43 2HD2 LEU 43 5.392 -18.543 -4.250 323 H ALA 44 H ALA 44 3.123 -20.338 -9.351 324 HA ALA 44 HA ALA 44 4.413 -19.065 -11.488 325 HB1 ALA 44 1HB ALA 44 1.961 -20.756 -11.839 326 HB2 ALA 44 2HB ALA 44 3.374 -20.620 -12.886 327 HB3 ALA 44 3HB ALA 44 3.501 -21.455 -11.338 328 H SER 45 H SER 45 1.559 -18.239 -9.837 329 HA SER 45 HA SER 45 0.168 -16.970 -11.980 330 HB2 SER 45 2HB SER 45 -0.080 -16.527 -8.994 331 HB3 SER 45 3HB SER 45 -1.234 -15.992 -10.216 332 HG SER 45 HG SER 45 -1.879 -18.027 -10.527 333 H LYS 46 H LYS 46 1.444 -15.370 -9.073 334 HA LYS 46 HA LYS 46 2.533 -13.254 -10.808 335 HB2 LYS 46 2HB LYS 46 1.944 -11.702 -8.834 336 HB3 LYS 46 3HB LYS 46 0.646 -12.215 -9.904 337 HG2 LYS 46 2HG LYS 46 -0.445 -13.227 -8.254 338 HG3 LYS 46 3HG LYS 46 1.014 -14.038 -7.679 339 HD2 LYS 46 2HD LYS 46 1.319 -12.541 -6.045 340 HD3 LYS 46 3HD LYS 46 1.023 -11.179 -7.128 341 HE2 LYS 46 2HE LYS 46 -1.089 -12.893 -5.822 342 HE3 LYS 46 3HE LYS 46 -0.622 -11.271 -5.316 343 HZ1 LYS 46 3HZ LYS 46 -2.262 -10.619 -6.661 344 HZ2 LYS 46 1HZ LYS 46 -2.332 -12.098 -7.479 345 HZ3 LYS 46 2HZ LYS 46 -1.191 -10.935 -7.932 346 H THR 47 H THR 47 3.150 -15.558 -8.483 347 HA THR 47 HA THR 47 4.967 -16.074 -7.212 348 HB THR 47 HB THR 47 6.771 -13.987 -8.159 349 HG1 THR 47 HG1 THR 47 5.881 -15.756 -10.171 350 HG21 THR 47 3HG2 THR 47 7.164 -16.780 -8.982 351 HG22 THR 47 1HG2 THR 47 6.989 -16.540 -7.244 352 HG23 THR 47 2HG2 THR 47 8.253 -15.686 -8.130 353 HA PRO 48 HA PRO 48 4.204 -12.953 -4.053 354 HB2 PRO 48 2HB PRO 48 4.782 -14.599 -1.973 355 HB3 PRO 48 3HB PRO 48 3.225 -14.618 -2.809 356 HG2 PRO 48 2HG PRO 48 5.579 -16.436 -3.148 357 HG3 PRO 48 3HG PRO 48 3.854 -16.841 -3.074 358 HD2 PRO 48 2HD PRO 48 5.215 -16.686 -5.410 359 HD3 PRO 48 3HD PRO 48 3.495 -16.265 -5.277 360 H ASP 49 H ASP 49 5.548 -12.335 -2.048 361 HA ASP 49 HA ASP 49 8.372 -12.269 -2.857 362 HB2 ASP 49 2HB ASP 49 6.589 -10.354 -1.422 363 HB3 ASP 49 3HB ASP 49 8.306 -10.343 -1.032 364 H VAL 50 H VAL 50 6.275 -13.627 -0.596 365 HA VAL 50 HA VAL 50 8.288 -15.032 0.757 366 HB VAL 50 HB VAL 50 8.843 -12.936 1.835 367 HG11 VAL 50 1HG1 VAL 50 7.363 -11.409 2.531 368 HG12 VAL 50 2HG1 VAL 50 6.185 -12.325 1.587 369 HG13 VAL 50 3HG1 VAL 50 6.349 -12.617 3.319 370 HG21 VAL 50 3HG2 VAL 50 7.371 -14.204 4.049 371 HG22 VAL 50 1HG2 VAL 50 8.414 -15.273 3.111 372 HG23 VAL 50 2HG2 VAL 50 9.089 -13.841 3.888 373 H LEU 51 H LEU 51 7.441 -16.710 1.909 374 HA LEU 51 HA LEU 51 4.507 -16.761 2.171 375 HB2 LEU 51 2HB LEU 51 6.262 -18.525 0.858 376 HB3 LEU 51 3HB LEU 51 5.692 -19.370 2.296 377 HG LEU 51 HG LEU 51 3.561 -18.077 0.762 378 HD11 LEU 51 1HD1 LEU 51 4.575 -20.541 -0.524 379 HD12 LEU 51 2HD1 LEU 51 5.424 -19.038 -0.882 380 HD13 LEU 51 3HD1 LEU 51 3.697 -19.176 -1.214 381 HD21 LEU 51 3HD2 LEU 51 3.421 -20.940 1.113 382 HD22 LEU 51 1HD2 LEU 51 2.383 -19.672 1.767 383 HD23 LEU 51 2HD2 LEU 51 3.859 -20.130 2.618 384 H LEU 52 H LEU 52 3.849 -18.535 3.853 385 HA LEU 52 HA LEU 52 5.612 -18.466 6.190 386 HB2 LEU 52 2HB LEU 52 2.694 -17.719 6.286 387 HB3 LEU 52 3HB LEU 52 3.801 -17.797 7.654 388 HG LEU 52 HG LEU 52 4.615 -15.959 5.509 389 HD11 LEU 52 1HD1 LEU 52 2.328 -15.440 5.317 390 HD12 LEU 52 2HD1 LEU 52 3.002 -14.216 6.393 391 HD13 LEU 52 3HD1 LEU 52 2.071 -15.559 7.058 392 HD21 LEU 52 3HD2 LEU 52 5.816 -15.177 7.202 393 HD22 LEU 52 1HD2 LEU 52 5.094 -16.393 8.256 394 HD23 LEU 52 2HD2 LEU 52 4.347 -14.803 8.105 395 H SER 53 H SER 53 5.688 -20.709 5.083 396 HA SER 53 HA SER 53 3.599 -22.524 5.179 397 HB2 SER 53 2HB SER 53 5.195 -24.202 4.875 398 HB3 SER 53 3HB SER 53 6.024 -22.774 4.256 399 HG SER 53 HG SER 53 7.229 -22.672 6.091 400 H ASP 54 H ASP 54 2.448 -23.356 6.781 401 HA ASP 54 HA ASP 54 3.284 -22.924 9.529 402 HB2 ASP 54 2HB ASP 54 0.757 -23.445 8.132 403 HB3 ASP 54 3HB ASP 54 0.910 -24.302 9.663 404 H ILE 55 H ILE 55 3.147 -25.481 7.214 405 HA ILE 55 HA ILE 55 3.655 -27.701 7.298 406 HB ILE 55 HB ILE 55 5.325 -26.821 9.656 407 HG12 ILE 55 2HG1 ILE 55 6.088 -27.174 6.750 408 HG13 ILE 55 3HG1 ILE 55 5.796 -25.623 7.529 409 HG21 ILE 55 1HG2 ILE 55 5.816 -28.967 9.933 410 HG22 ILE 55 2HG2 ILE 55 4.821 -29.414 8.548 411 HG23 ILE 55 3HG2 ILE 55 6.514 -28.981 8.313 412 HD11 ILE 55 3HD1 ILE 55 7.711 -25.811 8.861 413 HD12 ILE 55 1HD1 ILE 55 7.878 -27.534 8.524 414 HD13 ILE 55 2HD1 ILE 55 8.206 -26.351 7.257 415 H ARG 56 H ARG 56 1.611 -28.495 7.823 416 HA ARG 56 HA ARG 56 1.441 -29.674 10.477 417 HB2 ARG 56 2HB ARG 56 -0.029 -27.350 9.805 418 HB3 ARG 56 3HB ARG 56 -1.171 -28.687 9.819 419 HG2 ARG 56 2HG ARG 56 -1.300 -28.215 12.007 420 HG3 ARG 56 3HG ARG 56 0.174 -29.180 12.102 421 HD2 ARG 56 2HD ARG 56 1.538 -27.203 12.026 422 HD3 ARG 56 3HD ARG 56 0.126 -26.190 11.726 423 HE ARG 56 HE ARG 56 -0.348 -27.490 14.116 424 HH11 ARG 56 1HH1 ARG 56 2.015 -25.275 12.839 425 HH12 ARG 56 2HH1 ARG 56 2.340 -24.535 14.372 426 HH21 ARG 56 1HH2 ARG 56 0.071 -26.524 16.139 427 HH22 ARG 56 2HH2 ARG 56 1.235 -25.247 16.248 428 H MET 57 H MET 57 0.016 -29.308 7.261 429 HA MET 57 HA MET 57 -1.641 -31.573 7.323 430 HB2 MET 57 2HB MET 57 -1.507 -31.447 4.823 431 HB3 MET 57 3HB MET 57 -1.963 -29.940 5.605 432 HG2 MET 57 2HG MET 57 0.853 -29.956 5.368 433 HG3 MET 57 3HG MET 57 0.181 -30.447 3.815 434 HE1 MET 57 3HE MET 57 1.185 -27.053 3.038 435 HE2 MET 57 1HE MET 57 1.518 -26.879 4.762 436 HE3 MET 57 2HE MET 57 1.919 -28.384 3.935 437 HA PRO 58 HA PRO 58 1.292 -34.870 7.201 438 HB2 PRO 58 2HB PRO 58 -0.396 -36.843 6.407 439 HB3 PRO 58 3HB PRO 58 -0.392 -36.185 8.047 440 HG2 PRO 58 2HG PRO 58 -2.213 -35.554 5.756 441 HG3 PRO 58 3HG PRO 58 -2.613 -35.812 7.465 442 HD2 PRO 58 2HD PRO 58 -2.420 -33.343 6.370 443 HD3 PRO 58 3HD PRO 58 -1.994 -33.673 8.062 444 H GLY 59 H GLY 59 1.844 -36.745 5.633 445 HA2 GLY 59 2HA GLY 59 2.453 -37.473 3.533 446 HA3 GLY 59 3HA GLY 59 1.234 -36.397 2.864 447 H MET 60 H MET 60 1.810 -34.087 2.712 448 HA MET 60 HA MET 60 4.247 -33.732 1.374 449 HB2 MET 60 2HB MET 60 2.026 -32.002 2.263 450 HB3 MET 60 3HB MET 60 3.567 -31.187 2.031 451 HG2 MET 60 2HG MET 60 3.335 -31.218 -0.168 452 HG3 MET 60 3HG MET 60 3.016 -32.951 -0.170 453 HE1 MET 60 3HE MET 60 0.232 -30.588 1.823 454 HE2 MET 60 1HE MET 60 1.592 -29.736 1.090 455 HE3 MET 60 2HE MET 60 -0.018 -29.598 0.383 456 H ASP 61 H ASP 61 3.526 -33.752 4.702 457 HA ASP 61 HA ASP 61 4.867 -33.551 6.537 458 HB2 ASP 61 2HB ASP 61 6.697 -33.980 4.416 459 HB3 ASP 61 3HB ASP 61 7.353 -32.681 5.408 460 H GLY 62 H GLY 62 6.330 -31.165 4.327 461 HA2 GLY 62 2HA GLY 62 5.069 -28.872 5.012 462 HA3 GLY 62 3HA GLY 62 6.156 -29.127 6.369 463 H LEU 63 H LEU 63 8.469 -29.870 5.441 464 HA LEU 63 HA LEU 63 9.381 -27.572 3.948 465 HB2 LEU 63 2HB LEU 63 11.632 -28.855 4.267 466 HB3 LEU 63 3HB LEU 63 10.867 -28.031 5.624 467 HG LEU 63 HG LEU 63 10.052 -30.123 6.499 468 HD11 LEU 63 1HD1 LEU 63 10.962 -32.241 5.300 469 HD12 LEU 63 2HD1 LEU 63 11.018 -31.193 3.883 470 HD13 LEU 63 3HD1 LEU 63 9.488 -31.470 4.714 471 HD21 LEU 63 3HD2 LEU 63 12.949 -29.910 5.808 472 HD22 LEU 63 1HD2 LEU 63 12.354 -31.346 6.643 473 HD23 LEU 63 2HD2 LEU 63 12.149 -29.754 7.373 474 H ALA 64 H ALA 64 8.430 -30.751 3.237 475 HA ALA 64 HA ALA 64 10.025 -31.633 1.211 476 HB1 ALA 64 1HB ALA 64 8.075 -32.749 0.275 477 HB2 ALA 64 2HB ALA 64 8.068 -32.851 2.037 478 HB3 ALA 64 3HB ALA 64 7.010 -31.703 1.216 479 H LEU 65 H LEU 65 7.277 -29.395 0.818 480 HA LEU 65 HA LEU 65 7.930 -28.882 -1.934 481 HB2 LEU 65 2HB LEU 65 5.929 -27.856 -2.059 482 HB3 LEU 65 3HB LEU 65 5.640 -28.741 -0.562 483 HG LEU 65 HG LEU 65 6.547 -25.867 -0.697 484 HD11 LEU 65 1HD1 LEU 65 4.290 -26.190 -1.641 485 HD12 LEU 65 2HD1 LEU 65 4.280 -25.263 -0.141 486 HD13 LEU 65 3HD1 LEU 65 3.794 -26.959 -0.133 487 HD21 LEU 65 3HD2 LEU 65 6.593 -25.858 1.553 488 HD22 LEU 65 1HD2 LEU 65 6.836 -27.594 1.362 489 HD23 LEU 65 2HD2 LEU 65 5.223 -26.961 1.691 490 H LEU 66 H LEU 66 8.759 -27.523 1.125 491 HA LEU 66 HA LEU 66 9.470 -24.920 0.221 492 HB2 LEU 66 2HB LEU 66 9.155 -26.079 2.654 493 HB3 LEU 66 3HB LEU 66 10.913 -26.006 2.541 494 HG LEU 66 HG LEU 66 10.286 -24.059 3.685 495 HD11 LEU 66 1HD1 LEU 66 10.547 -23.239 0.796 496 HD12 LEU 66 2HD1 LEU 66 11.889 -23.691 1.847 497 HD13 LEU 66 3HD1 LEU 66 10.927 -22.259 2.212 498 HD21 LEU 66 3HD2 LEU 66 8.571 -22.502 2.382 499 HD22 LEU 66 1HD2 LEU 66 8.042 -23.728 3.534 500 HD23 LEU 66 2HD2 LEU 66 7.993 -24.066 1.804 501 H LYS 67 H LYS 67 11.006 -27.998 0.105 502 HA LYS 67 HA LYS 67 13.701 -27.126 -0.074 503 HB2 LYS 67 2HB LYS 67 12.310 -29.654 -0.952 504 HB3 LYS 67 3HB LYS 67 14.039 -29.406 -1.153 505 HG2 LYS 67 2HG LYS 67 12.599 -29.295 1.488 506 HG3 LYS 67 3HG LYS 67 13.445 -30.712 0.860 507 HD2 LYS 67 2HD LYS 67 14.702 -28.020 1.391 508 HD3 LYS 67 3HD LYS 67 14.821 -29.429 2.449 509 HE2 LYS 67 2HE LYS 67 16.655 -29.979 1.309 510 HE3 LYS 67 3HE LYS 67 15.586 -30.389 -0.031 511 HZ1 LYS 67 3HZ LYS 67 16.723 -27.683 0.403 512 HZ2 LYS 67 1HZ LYS 67 15.873 -28.229 -0.954 513 HZ3 LYS 67 2HZ LYS 67 17.413 -28.841 -0.619 514 H GLN 68 H GLN 68 11.086 -27.333 -2.348 515 HA GLN 68 HA GLN 68 12.817 -27.033 -4.654 516 HB2 GLN 68 2HB GLN 68 10.944 -27.398 -5.964 517 HB3 GLN 68 3HB GLN 68 10.545 -28.307 -4.513 518 HG2 GLN 68 2HG GLN 68 9.501 -25.894 -3.892 519 HG3 GLN 68 3HG GLN 68 9.298 -25.905 -5.643 520 HE21 GLN 68 1HE2 GLN 68 7.202 -25.928 -3.752 521 HE22 GLN 68 2HE2 GLN 68 6.338 -27.413 -3.935 522 H ILE 69 H ILE 69 11.061 -25.035 -2.468 523 HA ILE 69 HA ILE 69 10.666 -22.770 -4.101 524 HB ILE 69 HB ILE 69 11.025 -22.948 -1.108 525 HG12 ILE 69 2HG1 ILE 69 8.517 -22.692 -2.781 526 HG13 ILE 69 3HG1 ILE 69 9.091 -24.191 -2.059 527 HG21 ILE 69 1HG2 ILE 69 9.535 -20.709 -1.582 528 HG22 ILE 69 2HG2 ILE 69 11.262 -20.725 -1.230 529 HG23 ILE 69 3HG2 ILE 69 10.704 -20.662 -2.901 530 HD11 ILE 69 3HD1 ILE 69 7.954 -23.703 -0.233 531 HD12 ILE 69 1HD1 ILE 69 8.976 -22.287 0.007 532 HD13 ILE 69 2HD1 ILE 69 7.478 -22.147 -0.913 533 H LYS 70 H LYS 70 13.457 -24.032 -2.490 534 HA LYS 70 HA LYS 70 14.963 -21.593 -2.505 535 HB2 LYS 70 2HB LYS 70 15.357 -24.352 -1.644 536 HB3 LYS 70 3HB LYS 70 16.799 -23.666 -2.381 537 HG2 LYS 70 2HG LYS 70 17.228 -22.861 -0.348 538 HG3 LYS 70 3HG LYS 70 15.996 -21.653 -0.719 539 HD2 LYS 70 2HD LYS 70 14.549 -23.848 0.163 540 HD3 LYS 70 3HD LYS 70 15.958 -23.806 1.225 541 HE2 LYS 70 2HE LYS 70 14.225 -22.487 2.221 542 HE3 LYS 70 3HE LYS 70 15.488 -21.399 1.648 543 HZ1 LYS 70 3HZ LYS 70 13.652 -20.350 0.848 544 HZ2 LYS 70 1HZ LYS 70 12.764 -21.776 0.646 545 HZ3 LYS 70 2HZ LYS 70 13.965 -21.363 -0.470 546 H GLN 71 H GLN 71 14.419 -24.208 -4.729 547 HA GLN 71 HA GLN 71 16.613 -23.390 -6.456 548 HB2 GLN 71 2HB GLN 71 14.819 -25.725 -6.256 549 HB3 GLN 71 3HB GLN 71 15.267 -25.261 -7.893 550 HG2 GLN 71 2HG GLN 71 16.916 -26.762 -7.369 551 HG3 GLN 71 3HG GLN 71 17.682 -25.233 -6.941 552 HE21 GLN 71 1HE2 GLN 71 15.379 -27.405 -5.332 553 HE22 GLN 71 2HE2 GLN 71 16.278 -27.548 -3.864 554 H ARG 72 H ARG 72 13.067 -23.570 -6.559 555 HA ARG 72 HA ARG 72 12.857 -22.360 -9.131 556 HB2 ARG 72 2HB ARG 72 10.949 -23.090 -6.953 557 HB3 ARG 72 3HB ARG 72 10.411 -21.975 -8.201 558 HG2 ARG 72 2HG ARG 72 11.397 -23.847 -9.788 559 HG3 ARG 72 3HG ARG 72 11.061 -24.860 -8.383 560 HD2 ARG 72 2HD ARG 72 8.740 -24.028 -8.375 561 HD3 ARG 72 3HD ARG 72 9.093 -23.088 -9.825 562 HE ARG 72 HE ARG 72 8.912 -25.002 -11.067 563 HH11 ARG 72 1HH1 ARG 72 9.226 -25.847 -7.705 564 HH12 ARG 72 2HH1 ARG 72 8.900 -27.529 -7.963 565 HH21 ARG 72 1HH2 ARG 72 8.481 -27.214 -11.420 566 HH22 ARG 72 2HH2 ARG 72 8.477 -28.306 -10.076 567 H HIS 73 H HIS 73 12.830 -21.172 -5.829 568 HA HIS 73 HA HIS 73 13.038 -18.441 -6.863 569 HB2 HIS 73 2HB HIS 73 11.295 -19.021 -4.479 570 HB3 HIS 73 3HB HIS 73 11.370 -17.556 -5.454 571 HD1 HIS 73 HD1 HIS 73 9.830 -17.408 -7.443 572 HD2 HIS 73 HD2 HIS 73 9.903 -21.197 -5.739 573 HE1 HIS 73 HE1 HIS 73 7.975 -18.685 -8.563 574 HA PRO 74 HA PRO 74 16.239 -19.413 -3.665 575 HB2 PRO 74 2HB PRO 74 18.278 -18.253 -5.032 576 HB3 PRO 74 3HB PRO 74 17.778 -19.929 -5.291 577 HG2 PRO 74 2HG PRO 74 17.109 -17.484 -6.884 578 HG3 PRO 74 3HG PRO 74 17.561 -19.101 -7.453 579 HD2 PRO 74 2HD PRO 74 14.993 -18.243 -7.390 580 HD3 PRO 74 3HD PRO 74 15.439 -19.943 -7.136 581 H MET 75 H MET 75 15.652 -16.461 -5.537 582 HA MET 75 HA MET 75 16.761 -14.775 -3.466 583 HB2 MET 75 2HB MET 75 16.747 -14.383 -6.050 584 HB3 MET 75 3HB MET 75 15.132 -13.749 -5.763 585 HG2 MET 75 2HG MET 75 16.547 -12.442 -3.859 586 HG3 MET 75 3HG MET 75 17.753 -12.602 -5.134 587 HE1 MET 75 3HE MET 75 14.450 -11.262 -3.949 588 HE2 MET 75 1HE MET 75 13.877 -10.179 -5.218 589 HE3 MET 75 2HE MET 75 13.711 -11.925 -5.408 590 H LEU 76 H LEU 76 14.009 -16.462 -3.615 591 HA LEU 76 HA LEU 76 12.248 -14.367 -2.593 592 HB2 LEU 76 2HB LEU 76 11.260 -15.817 -4.217 593 HB3 LEU 76 3HB LEU 76 11.776 -17.248 -3.329 594 HG LEU 76 HG LEU 76 10.229 -16.424 -1.462 595 HD11 LEU 76 1HD1 LEU 76 9.860 -14.173 -2.194 596 HD12 LEU 76 2HD1 LEU 76 8.331 -15.047 -2.287 597 HD13 LEU 76 3HD1 LEU 76 9.255 -14.729 -3.755 598 HD21 LEU 76 3HD2 LEU 76 9.815 -18.344 -3.011 599 HD22 LEU 76 1HD2 LEU 76 8.920 -17.236 -4.052 600 HD23 LEU 76 2HD2 LEU 76 8.354 -17.556 -2.412 601 HA PRO 77 HA PRO 77 13.557 -15.641 1.510 602 HB2 PRO 77 2HB PRO 77 12.264 -13.631 2.798 603 HB3 PRO 77 3HB PRO 77 13.815 -13.407 1.980 604 HG2 PRO 77 2HG PRO 77 11.056 -12.752 1.021 605 HG3 PRO 77 3HG PRO 77 12.543 -11.796 0.886 606 HD2 PRO 77 2HD PRO 77 11.563 -13.263 -1.168 607 HD3 PRO 77 3HD PRO 77 13.303 -13.001 -0.926 608 H VAL 78 H VAL 78 12.578 -17.307 2.459 609 HA VAL 78 HA VAL 78 9.647 -17.234 2.769 610 HB VAL 78 HB VAL 78 11.306 -19.748 2.755 611 HG11 VAL 78 1HG1 VAL 78 8.437 -19.074 2.899 612 HG12 VAL 78 2HG1 VAL 78 8.865 -20.443 1.871 613 HG13 VAL 78 3HG1 VAL 78 9.318 -20.443 3.576 614 HG21 VAL 78 3HG2 VAL 78 9.985 -19.732 0.356 615 HG22 VAL 78 1HG2 VAL 78 10.508 -18.055 0.513 616 HG23 VAL 78 2HG2 VAL 78 11.693 -19.359 0.583 617 H ILE 79 H ILE 79 8.796 -18.345 4.679 618 HA ILE 79 HA ILE 79 10.686 -18.409 6.932 619 HB ILE 79 HB ILE 79 7.901 -17.276 7.149 620 HG12 ILE 79 2HG1 ILE 79 10.516 -15.762 6.990 621 HG13 ILE 79 3HG1 ILE 79 9.337 -15.869 5.686 622 HG21 ILE 79 1HG2 ILE 79 10.266 -17.287 9.017 623 HG22 ILE 79 2HG2 ILE 79 8.766 -16.405 9.299 624 HG23 ILE 79 3HG2 ILE 79 8.751 -18.167 9.219 625 HD11 ILE 79 3HD1 ILE 79 8.602 -13.935 6.531 626 HD12 ILE 79 1HD1 ILE 79 7.782 -14.967 7.702 627 HD13 ILE 79 2HD1 ILE 79 9.330 -14.226 8.110 628 H ILE 80 H ILE 80 10.449 -20.081 8.310 629 HA ILE 80 HA ILE 80 8.312 -22.001 7.715 630 HB ILE 80 HB ILE 80 10.995 -22.306 9.040 631 HG12 ILE 80 2HG1 ILE 80 10.614 -22.393 6.490 632 HG13 ILE 80 3HG1 ILE 80 11.526 -23.704 7.230 633 HG21 ILE 80 1HG2 ILE 80 9.808 -23.676 10.446 634 HG22 ILE 80 2HG2 ILE 80 8.590 -24.053 9.228 635 HG23 ILE 80 3HG2 ILE 80 10.186 -24.799 9.140 636 HD11 ILE 80 3HD1 ILE 80 9.970 -25.239 6.727 637 HD12 ILE 80 1HD1 ILE 80 8.627 -24.137 7.034 638 HD13 ILE 80 2HD1 ILE 80 9.500 -24.060 5.503 639 H MET 81 H MET 81 6.885 -22.704 9.239 640 HA MET 81 HA MET 81 7.108 -21.540 11.933 641 HB2 MET 81 2HB MET 81 4.850 -21.433 10.002 642 HB3 MET 81 3HB MET 81 4.448 -21.661 11.698 643 HG2 MET 81 2HG MET 81 5.125 -19.577 12.288 644 HG3 MET 81 3HG MET 81 6.356 -19.500 11.029 645 HE1 MET 81 3HE MET 81 1.878 -19.043 10.546 646 HE2 MET 81 1HE MET 81 2.526 -20.323 9.521 647 HE3 MET 81 2HE MET 81 2.773 -20.382 11.266 648 H THR 82 H THR 82 6.983 -22.977 13.528 649 HA THR 82 HA THR 82 5.240 -25.133 13.708 650 HB THR 82 HB THR 82 6.263 -26.352 12.005 651 HG1 THR 82 HG1 THR 82 6.266 -27.845 13.555 652 HG21 THR 82 3HG2 THR 82 9.054 -26.066 12.962 653 HG22 THR 82 1HG2 THR 82 8.331 -24.664 12.174 654 HG23 THR 82 2HG2 THR 82 8.429 -26.204 11.319 655 H ALA 83 H ALA 83 8.736 -24.779 14.344 656 HA ALA 83 HA ALA 83 9.874 -24.494 16.313 657 HB1 ALA 83 1HB ALA 83 8.830 -23.678 18.209 658 HB2 ALA 83 2HB ALA 83 7.746 -23.146 16.924 659 HB3 ALA 83 3HB ALA 83 7.336 -24.561 17.893 660 H HIS 84 H HIS 84 7.006 -26.513 16.988 661 HA HIS 84 HA HIS 84 8.608 -28.416 18.452 662 HB2 HIS 84 2HB HIS 84 6.555 -29.526 18.954 663 HB3 HIS 84 3HB HIS 84 6.234 -27.797 19.051 664 HD1 HIS 84 HD1 HIS 84 4.368 -30.453 18.213 665 HD2 HIS 84 HD2 HIS 84 5.543 -27.185 15.933 666 HE1 HIS 84 HE1 HIS 84 2.685 -30.292 16.351 667 H SER 85 H SER 85 9.431 -30.283 17.727 668 HA SER 85 HA SER 85 10.271 -31.724 16.150 669 HB2 SER 85 2HB SER 85 7.282 -31.969 15.997 670 HB3 SER 85 3HB SER 85 8.303 -32.944 14.940 671 HG SER 85 HG SER 85 9.414 -33.559 16.965 672 H ASP 86 H ASP 86 11.272 -30.031 14.888 673 HA ASP 86 HA ASP 86 10.941 -30.242 12.179 674 HB2 ASP 86 2HB ASP 86 8.971 -28.453 13.355 675 HB3 ASP 86 3HB ASP 86 9.964 -27.636 12.152 676 H LEU 87 H LEU 87 11.396 -27.594 14.522 677 HA LEU 87 HA LEU 87 13.290 -26.116 13.193 678 HB2 LEU 87 2HB LEU 87 12.537 -26.532 15.996 679 HB3 LEU 87 3HB LEU 87 14.187 -25.958 15.764 680 HG LEU 87 HG LEU 87 13.448 -23.954 14.747 681 HD11 LEU 87 1HD1 LEU 87 10.966 -25.484 14.311 682 HD12 LEU 87 2HD1 LEU 87 11.756 -24.282 13.292 683 HD13 LEU 87 3HD1 LEU 87 10.772 -23.767 14.662 684 HD21 LEU 87 3HD2 LEU 87 13.274 -23.886 17.139 685 HD22 LEU 87 1HD2 LEU 87 11.685 -24.652 17.091 686 HD23 LEU 87 2HD2 LEU 87 11.897 -23.021 16.453 687 H ASP 88 H ASP 88 13.817 -28.962 15.239 688 HA ASP 88 HA ASP 88 16.531 -29.071 15.408 689 HB2 ASP 88 2HB ASP 88 14.370 -31.018 15.448 690 HB3 ASP 88 3HB ASP 88 15.858 -31.703 14.802 691 H ALA 89 H ALA 89 14.563 -30.062 12.633 692 HA ALA 89 HA ALA 89 16.936 -30.689 11.077 693 HB1 ALA 89 1HB ALA 89 14.726 -30.781 9.385 694 HB2 ALA 89 2HB ALA 89 15.509 -32.143 10.188 695 HB3 ALA 89 3HB ALA 89 14.130 -31.347 10.945 696 H ALA 90 H ALA 90 14.224 -28.391 10.934 697 HA ALA 90 HA ALA 90 14.862 -27.007 8.649 698 HB1 ALA 90 1HB ALA 90 12.828 -26.547 9.825 699 HB2 ALA 90 2HB ALA 90 13.716 -25.950 11.227 700 HB3 ALA 90 3HB ALA 90 13.751 -25.049 9.712 701 H VAL 91 H VAL 91 16.382 -26.825 11.797 702 HA VAL 91 HA VAL 91 17.761 -24.452 11.670 703 HB VAL 91 HB VAL 91 18.569 -27.111 12.824 704 HG11 VAL 91 1HG1 VAL 91 20.686 -26.299 12.589 705 HG12 VAL 91 2HG1 VAL 91 20.158 -24.615 12.572 706 HG13 VAL 91 3HG1 VAL 91 20.244 -25.498 14.096 707 HG21 VAL 91 3HG2 VAL 91 16.746 -25.292 13.673 708 HG22 VAL 91 1HG2 VAL 91 17.617 -26.399 14.734 709 HG23 VAL 91 2HG2 VAL 91 18.190 -24.744 14.524 710 H SER 92 H SER 92 19.091 -27.606 10.650 711 HA SER 92 HA SER 92 21.188 -26.276 9.159 712 HB2 SER 92 2HB SER 92 21.973 -28.205 10.237 713 HB3 SER 92 3HB SER 92 20.548 -29.145 9.795 714 HG SER 92 HG SER 92 22.858 -28.988 8.513 715 H ALA 93 H ALA 93 18.357 -28.290 8.486 716 HA ALA 93 HA ALA 93 18.685 -28.546 5.722 717 HB1 ALA 93 1HB ALA 93 17.089 -29.932 6.764 718 HB2 ALA 93 2HB ALA 93 16.230 -28.556 7.457 719 HB3 ALA 93 3HB ALA 93 16.168 -28.850 5.719 720 H TYR 94 H TYR 94 16.465 -26.303 7.396 721 HA TYR 94 HA TYR 94 15.810 -24.778 5.160 722 HB2 TYR 94 2HB TYR 94 14.834 -24.806 7.598 723 HB3 TYR 94 3HB TYR 94 15.982 -23.498 7.862 724 HD1 TYR 94 HD2 TYR 94 13.914 -24.282 4.862 725 HD2 TYR 94 HD1 TYR 94 14.690 -21.572 8.048 726 HE1 TYR 94 HE2 TYR 94 12.314 -22.689 3.888 727 HE2 TYR 94 HE1 TYR 94 13.091 -19.971 7.083 728 HH TYR 94 HH TYR 94 10.820 -20.687 4.973 729 H GLN 95 H GLN 95 18.692 -24.845 7.014 730 HA GLN 95 HA GLN 95 19.607 -22.208 6.469 731 HB2 GLN 95 2HB GLN 95 20.654 -24.627 7.728 732 HB3 GLN 95 3HB GLN 95 21.882 -23.731 6.842 733 HG2 GLN 95 2HG GLN 95 20.066 -22.364 8.790 734 HG3 GLN 95 3HG GLN 95 21.526 -23.198 9.321 735 HE21 GLN 95 1HE2 GLN 95 20.378 -20.272 8.676 736 HE22 GLN 95 2HE2 GLN 95 21.804 -19.478 8.109 737 H GLN 96 H GLN 96 18.924 -24.558 4.356 738 HA GLN 96 HA GLN 96 21.250 -24.547 2.693 739 HB2 GLN 96 2HB GLN 96 18.424 -25.501 2.349 740 HB3 GLN 96 3HB GLN 96 19.533 -25.476 0.985 741 HG2 GLN 96 2HG GLN 96 20.466 -26.774 3.477 742 HG3 GLN 96 3HG GLN 96 19.224 -27.601 2.538 743 HE21 GLN 96 1HE2 GLN 96 21.971 -28.387 3.035 744 HE22 GLN 96 2HE2 GLN 96 22.723 -28.537 1.487 745 H GLY 97 H GLY 97 20.096 -21.927 3.445 746 HA2 GLY 97 2HA GLY 97 20.486 -19.983 2.056 747 HA3 GLY 97 3HA GLY 97 19.798 -20.874 0.706 748 H ALA 98 H ALA 98 18.422 -20.786 3.937 749 HA ALA 98 HA ALA 98 16.112 -19.332 2.826 750 HB1 ALA 98 1HB ALA 98 15.901 -21.017 5.280 751 HB2 ALA 98 2HB ALA 98 14.670 -20.612 4.083 752 HB3 ALA 98 3HB ALA 98 15.927 -21.786 3.693 753 H PHE 99 H PHE 99 14.867 -18.055 4.449 754 HA PHE 99 HA PHE 99 16.722 -16.451 6.014 755 HB2 PHE 99 2HB PHE 99 15.316 -15.090 4.728 756 HB3 PHE 99 3HB PHE 99 13.897 -16.074 5.068 757 HD1 PHE 99 HD1 PHE 99 16.258 -13.640 6.535 758 HD2 PHE 99 HD2 PHE 99 12.499 -15.604 6.899 759 HE1 PHE 99 HE1 PHE 99 15.634 -12.102 8.351 760 HE2 PHE 99 HE2 PHE 99 11.869 -14.068 8.715 761 HZ PHE 99 HZ PHE 99 13.436 -12.314 9.443 762 H ASP 100 H ASP 100 16.397 -15.931 8.213 763 HA ASP 100 HA ASP 100 15.994 -17.937 9.978 764 HB2 ASP 100 2HB ASP 100 16.804 -15.585 10.470 765 HB3 ASP 100 3HB ASP 100 15.110 -15.114 10.583 766 H TYR 101 H TYR 101 14.353 -19.222 10.464 767 HA TYR 101 HA TYR 101 11.681 -18.605 9.588 768 HB2 TYR 101 2HB TYR 101 11.172 -20.849 10.685 769 HB3 TYR 101 3HB TYR 101 12.309 -20.874 9.342 770 HD1 TYR 101 HD2 TYR 101 12.587 -20.231 13.020 771 HD2 TYR 101 HD1 TYR 101 13.989 -22.415 9.648 772 HE1 TYR 101 HE2 TYR 101 14.240 -21.363 14.447 773 HE2 TYR 101 HE1 TYR 101 15.645 -23.553 11.066 774 HH TYR 101 HH TYR 101 16.822 -22.736 13.539 775 H LEU 102 H LEU 102 9.858 -19.213 11.222 776 HA LEU 102 HA LEU 102 10.430 -17.993 13.836 777 HB2 LEU 102 2HB LEU 102 9.392 -16.233 12.718 778 HB3 LEU 102 3HB LEU 102 8.277 -17.305 11.873 779 HG LEU 102 HG LEU 102 7.199 -17.724 14.136 780 HD11 LEU 102 1HD1 LEU 102 7.663 -15.432 15.496 781 HD12 LEU 102 2HD1 LEU 102 9.272 -15.775 14.863 782 HD13 LEU 102 3HD1 LEU 102 8.440 -16.975 15.851 783 HD21 LEU 102 3HD2 LEU 102 7.089 -15.257 12.504 784 HD22 LEU 102 1HD2 LEU 102 6.256 -15.230 14.058 785 HD23 LEU 102 2HD2 LEU 102 5.834 -16.447 12.853 786 HA PRO 103 HA PRO 103 8.485 -21.841 15.031 787 HB2 PRO 103 2HB PRO 103 8.905 -21.513 17.693 788 HB3 PRO 103 3HB PRO 103 10.170 -22.046 16.580 789 HG2 PRO 103 2HG PRO 103 9.656 -19.317 17.695 790 HG3 PRO 103 3HG PRO 103 11.197 -20.170 17.491 791 HD2 PRO 103 2HD PRO 103 10.347 -18.264 15.765 792 HD3 PRO 103 3HD PRO 103 11.333 -19.647 15.250 793 H LYS 104 H LYS 104 6.471 -22.368 15.741 794 HA LYS 104 HA LYS 104 4.774 -20.146 16.655 795 HB2 LYS 104 2HB LYS 104 4.396 -22.314 14.757 796 HB3 LYS 104 3HB LYS 104 3.110 -22.270 15.956 797 HG2 LYS 104 2HG LYS 104 2.911 -19.791 15.414 798 HG3 LYS 104 3HG LYS 104 3.917 -20.140 14.006 799 HD2 LYS 104 2HD LYS 104 2.300 -21.636 13.116 800 HD3 LYS 104 3HD LYS 104 1.375 -21.634 14.619 801 HE2 LYS 104 2HE LYS 104 1.762 -19.276 12.777 802 HE3 LYS 104 3HE LYS 104 0.305 -20.262 12.898 803 HZ1 LYS 104 3HZ LYS 104 0.988 -18.029 14.414 804 HZ2 LYS 104 1HZ LYS 104 1.019 -19.357 15.461 805 HZ3 LYS 104 2HZ LYS 104 -0.379 -19.013 14.574 806 HA PRO 105 HA PRO 105 2.602 -20.050 17.376 807 HB2 PRO 105 2HB PRO 105 1.980 -18.757 19.680 808 HB3 PRO 105 3HB PRO 105 1.111 -20.189 19.118 809 HG2 PRO 105 2HG PRO 105 3.282 -19.974 21.167 810 HG3 PRO 105 3HG PRO 105 1.785 -20.923 21.219 811 HD2 PRO 105 2HD PRO 105 4.184 -22.019 20.604 812 HD3 PRO 105 3HD PRO 105 2.659 -22.608 19.911 813 H PHE 106 H PHE 106 2.635 -17.555 17.860 814 HA PHE 106 HA PHE 106 5.108 -16.494 18.847 815 HB2 PHE 106 2HB PHE 106 5.853 -15.527 16.691 816 HB3 PHE 106 3HB PHE 106 5.912 -17.286 16.695 817 HD1 PHE 106 HD2 PHE 106 3.706 -14.457 15.702 818 HD2 PHE 106 HD1 PHE 106 4.948 -18.460 14.958 819 HE1 PHE 106 HE2 PHE 106 2.331 -14.502 13.662 820 HE2 PHE 106 HE1 PHE 106 3.575 -18.510 12.917 821 HZ PHE 106 HZ PHE 106 2.263 -16.530 12.267 822 H ASP 107 H ASP 107 5.227 -14.095 18.482 823 HA ASP 107 HA ASP 107 2.592 -12.969 18.919 824 HB2 ASP 107 2HB ASP 107 5.403 -12.008 19.280 825 HB3 ASP 107 3HB ASP 107 4.101 -10.826 19.184 826 H ILE 108 H ILE 108 1.403 -12.293 17.272 827 HA ILE 108 HA ILE 108 2.121 -12.064 14.642 828 HB ILE 108 HB ILE 108 -0.034 -10.704 16.220 829 HG12 ILE 108 2HG1 ILE 108 -0.439 -12.477 13.848 830 HG13 ILE 108 3HG1 ILE 108 0.075 -13.202 15.367 831 HG21 ILE 108 1HG2 ILE 108 0.818 -10.118 13.427 832 HG22 ILE 108 2HG2 ILE 108 -0.901 -10.112 13.816 833 HG23 ILE 108 3HG2 ILE 108 0.199 -9.030 14.669 834 HD11 ILE 108 3HD1 ILE 108 -2.080 -11.431 15.900 835 HD12 ILE 108 1HD1 ILE 108 -2.527 -12.482 14.556 836 HD13 ILE 108 2HD1 ILE 108 -2.009 -13.183 16.089 837 H ASP 109 H ASP 109 2.497 -9.683 17.186 838 HA ASP 109 HA ASP 109 3.019 -7.414 15.651 839 HB2 ASP 109 2HB ASP 109 3.693 -8.296 18.411 840 HB3 ASP 109 3HB ASP 109 4.596 -6.933 17.757 841 H GLU 110 H GLU 110 5.177 -10.006 16.710 842 HA GLU 110 HA GLU 110 7.506 -8.778 15.549 843 HB2 GLU 110 2HB GLU 110 7.547 -10.301 17.552 844 HB3 GLU 110 3HB GLU 110 7.179 -11.636 16.469 845 HG2 GLU 110 2HG GLU 110 9.250 -11.155 15.222 846 HG3 GLU 110 3HG GLU 110 9.628 -9.889 16.389 847 H ALA 111 H ALA 111 5.113 -11.131 14.587 848 HA ALA 111 HA ALA 111 6.505 -12.244 12.393 849 HB1 ALA 111 1HB ALA 111 4.595 -13.407 11.954 850 HB2 ALA 111 2HB ALA 111 4.271 -12.946 13.626 851 HB3 ALA 111 3HB ALA 111 3.545 -12.033 12.303 852 H VAL 112 H VAL 112 3.908 -9.794 12.455 853 HA VAL 112 HA VAL 112 3.862 -9.142 9.780 854 HB VAL 112 HB VAL 112 3.376 -7.435 12.211 855 HG11 VAL 112 1HG1 VAL 112 3.231 -6.670 9.311 856 HG12 VAL 112 2HG1 VAL 112 2.255 -5.862 10.539 857 HG13 VAL 112 3HG1 VAL 112 4.016 -5.817 10.640 858 HG21 VAL 112 3HG2 VAL 112 1.030 -7.634 11.475 859 HG22 VAL 112 1HG2 VAL 112 1.555 -8.668 10.146 860 HG23 VAL 112 2HG2 VAL 112 1.765 -9.201 11.814 861 H ALA 113 H ALA 113 6.157 -8.159 12.236 862 HA ALA 113 HA ALA 113 7.447 -6.227 10.509 863 HB1 ALA 113 1HB ALA 113 8.901 -7.069 12.904 864 HB2 ALA 113 2HB ALA 113 8.428 -5.456 12.369 865 HB3 ALA 113 3HB ALA 113 7.270 -6.478 13.220 866 H LEU 114 H LEU 114 7.874 -9.552 11.478 867 HA LEU 114 HA LEU 114 10.558 -9.878 10.676 868 HB2 LEU 114 2HB LEU 114 9.442 -11.479 12.111 869 HB3 LEU 114 3HB LEU 114 8.305 -11.874 10.824 870 HG LEU 114 HG LEU 114 10.366 -12.659 9.510 871 HD11 LEU 114 1HD1 LEU 114 12.235 -13.416 10.914 872 HD12 LEU 114 2HD1 LEU 114 11.512 -12.598 12.298 873 HD13 LEU 114 3HD1 LEU 114 12.069 -11.660 10.912 874 HD21 LEU 114 3HD2 LEU 114 9.019 -14.402 10.078 875 HD22 LEU 114 1HD2 LEU 114 9.007 -13.982 11.791 876 HD23 LEU 114 2HD2 LEU 114 10.410 -14.791 11.091 877 H VAL 115 H VAL 115 7.493 -10.309 8.958 878 HA VAL 115 HA VAL 115 8.592 -11.334 6.568 879 HB VAL 115 HB VAL 115 6.230 -11.580 7.020 880 HG11 VAL 115 1HG1 VAL 115 5.907 -9.487 8.261 881 HG12 VAL 115 2HG1 VAL 115 6.033 -8.581 6.752 882 HG13 VAL 115 3HG1 VAL 115 4.692 -9.699 7.002 883 HG21 VAL 115 3HG2 VAL 115 7.309 -10.895 4.599 884 HG22 VAL 115 1HG2 VAL 115 5.679 -11.522 4.850 885 HG23 VAL 115 2HG2 VAL 115 5.947 -9.782 4.731 886 H GLU 116 H GLU 116 7.959 -8.054 7.692 887 HA GLU 116 HA GLU 116 8.383 -6.702 5.273 888 HB2 GLU 116 2HB GLU 116 8.185 -6.012 8.097 889 HB3 GLU 116 3HB GLU 116 9.319 -4.980 7.236 890 HG2 GLU 116 2HG GLU 116 7.525 -4.551 5.553 891 HG3 GLU 116 3HG GLU 116 6.412 -5.421 6.608 892 H ARG 117 H ARG 117 10.610 -7.989 7.640 893 HA ARG 117 HA ARG 117 12.928 -6.611 6.840 894 HB2 ARG 117 2HB ARG 117 13.015 -7.740 8.914 895 HB3 ARG 117 3HB ARG 117 12.484 -9.258 8.202 896 HG2 ARG 117 2HG ARG 117 14.561 -9.855 7.633 897 HG3 ARG 117 3HG ARG 117 14.981 -8.231 7.084 898 HD2 ARG 117 2HD ARG 117 14.950 -7.695 9.650 899 HD3 ARG 117 3HD ARG 117 15.191 -9.435 9.805 900 HE ARG 117 HE ARG 117 17.353 -9.137 9.144 901 HH11 ARG 117 1HH1 ARG 117 15.493 -6.368 8.147 902 HH12 ARG 117 2HH1 ARG 117 16.870 -5.487 7.573 903 HH21 ARG 117 1HH2 ARG 117 19.173 -7.987 8.392 904 HH22 ARG 117 2HH2 ARG 117 18.962 -6.409 7.711 905 H ALA 118 H ALA 118 11.299 -9.417 5.550 906 HA ALA 118 HA ALA 118 13.492 -10.122 3.798 907 HB1 ALA 118 1HB ALA 118 11.004 -11.338 4.652 908 HB2 ALA 118 2HB ALA 118 11.258 -11.494 2.914 909 HB3 ALA 118 3HB ALA 118 12.478 -12.089 4.040 910 H ILE 119 H ILE 119 10.374 -8.498 3.573 911 HA ILE 119 HA ILE 119 10.378 -8.282 0.730 912 HB ILE 119 HB ILE 119 8.855 -6.658 2.771 913 HG12 ILE 119 2HG1 ILE 119 7.942 -9.027 1.128 914 HG13 ILE 119 3HG1 ILE 119 8.443 -9.127 2.813 915 HG21 ILE 119 1HG2 ILE 119 7.407 -5.999 0.972 916 HG22 ILE 119 2HG2 ILE 119 9.066 -5.592 0.540 917 HG23 ILE 119 3HG2 ILE 119 8.294 -7.010 -0.168 918 HD11 ILE 119 3HD1 ILE 119 5.900 -8.842 2.024 919 HD12 ILE 119 1HD1 ILE 119 6.514 -8.262 3.571 920 HD13 ILE 119 2HD1 ILE 119 6.351 -7.148 2.213 921 H SER 120 H SER 120 11.483 -6.239 3.371 922 HA SER 120 HA SER 120 12.101 -4.016 1.643 923 HB2 SER 120 2HB SER 120 11.544 -4.127 4.265 924 HB3 SER 120 3HB SER 120 13.304 -4.189 4.357 925 HG SER 120 HG SER 120 11.645 -2.114 3.637 926 H HIS 121 H HIS 121 13.555 -6.947 2.276 927 HA HIS 121 HA HIS 121 16.290 -6.233 2.375 928 HB2 HIS 121 2HB HIS 121 15.269 -8.482 2.972 929 HB3 HIS 121 3HB HIS 121 15.182 -8.803 1.242 930 HD1 HIS 121 HD1 HIS 121 17.312 -9.518 0.079 931 HD2 HIS 121 HD2 HIS 121 17.927 -8.337 4.014 932 HE1 HIS 121 HE1 HIS 121 19.681 -10.171 0.614 933 H TYR 122 H TYR 122 14.002 -6.486 -0.210 934 HA TYR 122 HA TYR 122 15.856 -6.780 -2.343 935 HB2 TYR 122 2HB TYR 122 13.154 -5.474 -2.593 936 HB3 TYR 122 3HB TYR 122 14.026 -6.421 -3.793 937 HD1 TYR 122 HD2 TYR 122 14.802 -8.777 -2.149 938 HD2 TYR 122 HD1 TYR 122 11.133 -6.632 -2.364 939 HE1 TYR 122 HE2 TYR 122 13.587 -10.796 -1.444 940 HE2 TYR 122 HE1 TYR 122 9.908 -8.645 -1.659 941 HH TYR 122 HH TYR 122 10.309 -11.173 -1.758 942 H GLN 123 H GLN 123 14.207 -3.971 -0.929 943 HA GLN 123 HA GLN 123 15.815 -2.180 -2.584 944 HB2 GLN 123 2HB GLN 123 13.643 -1.463 -0.612 945 HB3 GLN 123 3HB GLN 123 14.350 -0.416 -1.835 946 HG2 GLN 123 2HG GLN 123 12.896 -1.101 -3.353 947 HG3 GLN 123 3HG GLN 123 13.299 -2.791 -3.054 948 HE21 GLN 123 1HE2 GLN 123 11.090 -3.294 -3.401 949 HE22 GLN 123 2HE2 GLN 123 9.918 -3.029 -2.161 950 H GLU 124 H GLU 124 16.875 -3.796 -0.298 951 HA GLU 124 HA GLU 124 17.367 -2.319 1.979 952 HB2 GLU 124 2HB GLU 124 18.062 -4.740 1.356 953 HB3 GLU 124 3HB GLU 124 19.526 -3.993 0.730 954 HG2 GLU 124 2HG GLU 124 19.353 -2.866 3.199 955 HG3 GLU 124 3HG GLU 124 18.685 -4.471 3.489 Start of MODEL 23 1 H1 MET 1 H MET 1 0.924 -0.164 2.277 2 HA MET 1 HA MET 1 0.557 -0.006 -0.360 3 HB2 MET 1 2HB MET 1 2.266 1.652 -0.655 4 HB3 MET 1 3HB MET 1 3.440 0.677 0.219 5 HG2 MET 1 2HG MET 1 3.826 -0.703 -1.547 6 HG3 MET 1 3HG MET 1 2.208 -0.489 -2.211 7 HE1 MET 1 3HE MET 1 2.209 2.248 -4.489 8 HE2 MET 1 1HE MET 1 2.692 0.631 -5.002 9 HE3 MET 1 2HE MET 1 1.486 0.828 -3.730 10 H GLN 2 H GLN 2 0.899 -1.953 -1.427 11 HA GLN 2 HA GLN 2 1.894 -4.111 0.287 12 HB2 GLN 2 2HB GLN 2 0.674 -5.604 -1.295 13 HB3 GLN 2 3HB GLN 2 -0.362 -4.446 -0.470 14 HG2 GLN 2 2HG GLN 2 0.570 -3.319 -2.928 15 HG3 GLN 2 3HG GLN 2 -0.133 -4.907 -3.227 16 HE21 GLN 2 1HE2 GLN 2 -2.032 -4.388 -4.124 17 HE22 GLN 2 2HE2 GLN 2 -3.249 -3.421 -3.370 18 H ARG 3 H ARG 3 4.042 -2.962 -0.496 19 HA ARG 3 HA ARG 3 4.985 -3.555 -3.102 20 HB2 ARG 3 2HB ARG 3 7.028 -2.676 -2.414 21 HB3 ARG 3 3HB ARG 3 5.879 -1.848 -1.372 22 HG2 ARG 3 2HG ARG 3 7.480 -4.275 -0.590 23 HG3 ARG 3 3HG ARG 3 7.887 -2.608 -0.176 24 HD2 ARG 3 2HD ARG 3 5.373 -4.070 0.625 25 HD3 ARG 3 3HD ARG 3 6.753 -3.739 1.671 26 HE ARG 3 HE ARG 3 5.566 -1.397 0.479 27 HH11 ARG 3 1HH1 ARG 3 5.538 -3.595 3.178 28 HH12 ARG 3 2HH1 ARG 3 4.798 -2.462 4.260 29 HH21 ARG 3 1HH2 ARG 3 4.592 0.104 1.894 30 HH22 ARG 3 2HH2 ARG 3 4.259 -0.359 3.529 31 H GLY 4 H GLY 4 4.498 -5.494 -0.362 32 HA2 GLY 4 2HA GLY 4 5.939 -7.692 -1.667 33 HA3 GLY 4 3HA GLY 4 6.308 -7.335 0.014 34 H ILE 5 H ILE 5 4.410 -9.156 -2.037 35 HA ILE 5 HA ILE 5 2.107 -9.402 -0.318 36 HB ILE 5 HB ILE 5 2.955 -10.967 -2.755 37 HG12 ILE 5 2HG1 ILE 5 0.594 -9.120 -2.494 38 HG13 ILE 5 3HG1 ILE 5 2.192 -8.501 -2.897 39 HG21 ILE 5 1HG2 ILE 5 1.635 -12.537 -1.758 40 HG22 ILE 5 2HG2 ILE 5 0.706 -11.342 -0.853 41 HG23 ILE 5 3HG2 ILE 5 0.390 -11.588 -2.571 42 HD11 ILE 5 3HD1 ILE 5 1.871 -10.579 -4.661 43 HD12 ILE 5 1HD1 ILE 5 0.254 -9.884 -4.554 44 HD13 ILE 5 2HD1 ILE 5 1.622 -8.868 -5.011 45 H VAL 6 H VAL 6 1.609 -11.067 1.051 46 HA VAL 6 HA VAL 6 3.701 -13.098 1.488 47 HB VAL 6 HB VAL 6 2.008 -11.960 3.703 48 HG11 VAL 6 1HG1 VAL 6 4.087 -12.825 4.988 49 HG12 VAL 6 2HG1 VAL 6 2.881 -13.982 4.421 50 HG13 VAL 6 3HG1 VAL 6 4.386 -13.765 3.527 51 HG21 VAL 6 3HG2 VAL 6 3.256 -10.099 2.842 52 HG22 VAL 6 1HG2 VAL 6 4.021 -10.637 4.337 53 HG23 VAL 6 2HG2 VAL 6 4.734 -11.059 2.780 54 H TRP 7 H TRP 7 3.017 -15.133 1.389 55 HA TRP 7 HA TRP 7 0.119 -15.635 1.579 56 HB2 TRP 7 2HB TRP 7 2.251 -17.061 -0.020 57 HB3 TRP 7 3HB TRP 7 0.611 -17.671 0.179 58 HD1 TRP 7 HD1 TRP 7 -0.061 -14.200 -0.058 59 HE1 TRP 7 HE1 TRP 7 -0.523 -13.431 -2.471 60 HE3 TRP 7 HE3 TRP 7 1.843 -18.225 -2.570 61 HZ2 TRP 7 HZ2 TRP 7 -0.132 -14.403 -5.092 62 HZ3 TRP 7 HZ3 TRP 7 1.760 -18.227 -5.030 63 HH2 TRP 7 HH2 TRP 7 0.792 -16.355 -6.262 64 H VAL 8 H VAL 8 -0.464 -17.839 2.347 65 HA VAL 8 HA VAL 8 1.493 -19.076 4.126 66 HB VAL 8 HB VAL 8 -1.229 -18.293 5.163 67 HG11 VAL 8 1HG1 VAL 8 -0.521 -19.091 7.237 68 HG12 VAL 8 2HG1 VAL 8 0.098 -20.288 6.098 69 HG13 VAL 8 3HG1 VAL 8 1.179 -19.068 6.772 70 HG21 VAL 8 3HG2 VAL 8 1.422 -16.933 5.642 71 HG22 VAL 8 1HG2 VAL 8 0.059 -16.270 4.741 72 HG23 VAL 8 2HG2 VAL 8 -0.088 -16.562 6.474 73 H VAL 9 H VAL 9 1.229 -21.241 4.352 74 HA VAL 9 HA VAL 9 -1.200 -22.437 3.188 75 HB VAL 9 HB VAL 9 0.631 -22.752 1.626 76 HG11 VAL 9 1HG1 VAL 9 2.243 -24.520 3.288 77 HG12 VAL 9 2HG1 VAL 9 2.739 -23.218 2.205 78 HG13 VAL 9 3HG1 VAL 9 2.237 -22.851 3.856 79 HG21 VAL 9 3HG2 VAL 9 -0.861 -24.843 2.844 80 HG22 VAL 9 1HG2 VAL 9 -0.276 -24.729 1.184 81 HG23 VAL 9 2HG2 VAL 9 0.732 -25.473 2.425 82 H ASP 10 H ASP 10 -1.874 -22.386 5.486 83 HA ASP 10 HA ASP 10 -0.660 -24.567 7.048 84 HB2 ASP 10 2HB ASP 10 -1.540 -23.516 9.037 85 HB3 ASP 10 3HB ASP 10 -0.652 -22.311 8.109 86 H ASP 11 H ASP 11 -2.275 -25.697 8.517 87 HA ASP 11 HA ASP 11 -4.737 -26.235 6.990 88 HB2 ASP 11 2HB ASP 11 -2.724 -28.008 7.600 89 HB3 ASP 11 3HB ASP 11 -3.889 -28.303 8.888 90 H ASP 12 H ASP 12 -4.251 -24.253 9.156 91 HA ASP 12 HA ASP 12 -6.262 -25.249 11.067 92 HB2 ASP 12 2HB ASP 12 -3.642 -24.173 11.557 93 HB3 ASP 12 3HB ASP 12 -4.856 -23.109 12.262 94 H SER 13 H SER 13 -7.749 -23.688 11.902 95 HA SER 13 HA SER 13 -8.606 -21.814 9.909 96 HB2 SER 13 2HB SER 13 -9.913 -23.255 11.816 97 HB3 SER 13 3HB SER 13 -9.859 -21.665 12.578 98 HG SER 13 HG SER 13 -10.877 -20.806 10.761 99 H SER 14 H SER 14 -7.392 -21.544 13.237 100 HA SER 14 HA SER 14 -7.418 -18.687 13.230 101 HB2 SER 14 2HB SER 14 -5.573 -19.874 15.144 102 HB3 SER 14 3HB SER 14 -7.029 -18.922 15.432 103 HG SER 14 HG SER 14 -7.048 -21.174 16.190 104 H ILE 15 H ILE 15 -4.884 -21.143 12.861 105 HA ILE 15 HA ILE 15 -2.643 -19.557 12.752 106 HB ILE 15 HB ILE 15 -3.248 -21.996 11.079 107 HG12 ILE 15 2HG1 ILE 15 -3.358 -22.438 13.468 108 HG13 ILE 15 3HG1 ILE 15 -1.897 -23.160 12.802 109 HG21 ILE 15 1HG2 ILE 15 -1.439 -20.769 10.063 110 HG22 ILE 15 2HG2 ILE 15 -0.627 -20.610 11.619 111 HG23 ILE 15 3HG2 ILE 15 -0.790 -22.197 10.868 112 HD11 ILE 15 3HD1 ILE 15 -1.336 -22.165 14.878 113 HD12 ILE 15 1HD1 ILE 15 -0.645 -21.158 13.607 114 HD13 ILE 15 2HD1 ILE 15 -2.118 -20.649 14.433 115 H ARG 16 H ARG 16 -4.928 -20.265 10.139 116 HA ARG 16 HA ARG 16 -3.476 -18.677 8.226 117 HB2 ARG 16 2HB ARG 16 -4.933 -19.485 6.656 118 HB3 ARG 16 3HB ARG 16 -5.111 -20.734 7.880 119 HG2 ARG 16 2HG ARG 16 -7.045 -19.205 8.742 120 HG3 ARG 16 3HG ARG 16 -6.995 -18.567 7.097 121 HD2 ARG 16 2HD ARG 16 -7.635 -20.576 6.157 122 HD3 ARG 16 3HD ARG 16 -7.061 -21.519 7.531 123 HE ARG 16 HE ARG 16 -9.134 -19.974 8.485 124 HH11 ARG 16 1HH1 ARG 16 -8.703 -22.416 6.041 125 HH12 ARG 16 2HH1 ARG 16 -10.324 -23.014 6.168 126 HH21 ARG 16 1HH2 ARG 16 -11.271 -20.752 8.661 127 HH22 ARG 16 2HH2 ARG 16 -11.784 -22.066 7.657 128 H TRP 17 H TRP 17 -5.981 -18.162 10.545 129 HA TRP 17 HA TRP 17 -7.056 -15.790 9.358 130 HB2 TRP 17 2HB TRP 17 -8.536 -16.900 10.808 131 HB3 TRP 17 3HB TRP 17 -7.311 -17.086 12.060 132 HD1 TRP 17 HD1 TRP 17 -9.221 -14.156 10.362 133 HE1 TRP 17 HE1 TRP 17 -9.699 -12.381 12.164 134 HE3 TRP 17 HE3 TRP 17 -6.875 -16.372 14.326 135 HZ2 TRP 17 HZ2 TRP 17 -9.153 -11.974 14.903 136 HZ3 TRP 17 HZ3 TRP 17 -6.898 -15.225 16.503 137 HH2 TRP 17 HH2 TRP 17 -8.013 -13.071 16.783 138 H VAL 18 H VAL 18 -5.152 -16.272 12.341 139 HA VAL 18 HA VAL 18 -4.594 -13.654 12.937 140 HB VAL 18 HB VAL 18 -3.904 -15.247 14.518 141 HG11 VAL 18 1HG1 VAL 18 -3.230 -16.796 12.289 142 HG12 VAL 18 2HG1 VAL 18 -1.729 -16.584 13.193 143 HG13 VAL 18 3HG1 VAL 18 -3.148 -17.268 13.986 144 HG21 VAL 18 3HG2 VAL 18 -1.940 -14.326 15.135 145 HG22 VAL 18 1HG2 VAL 18 -1.165 -14.693 13.594 146 HG23 VAL 18 2HG2 VAL 18 -2.216 -13.285 13.739 147 H LEU 19 H LEU 19 -2.723 -15.795 10.802 148 HA LEU 19 HA LEU 19 -0.746 -13.898 10.134 149 HB2 LEU 19 2HB LEU 19 -1.307 -16.579 9.541 150 HB3 LEU 19 3HB LEU 19 -1.246 -15.748 7.988 151 HG LEU 19 HG LEU 19 0.963 -15.547 10.022 152 HD11 LEU 19 1HD1 LEU 19 1.694 -17.578 9.520 153 HD12 LEU 19 2HD1 LEU 19 1.618 -17.221 7.795 154 HD13 LEU 19 3HD1 LEU 19 0.201 -17.863 8.625 155 HD21 LEU 19 3HD2 LEU 19 2.002 -14.266 8.522 156 HD22 LEU 19 1HD2 LEU 19 0.440 -14.126 7.715 157 HD23 LEU 19 2HD2 LEU 19 1.595 -15.352 7.192 158 H GLU 20 H GLU 20 -3.992 -14.339 9.074 159 HA GLU 20 HA GLU 20 -3.728 -12.982 6.568 160 HB2 GLU 20 2HB GLU 20 -5.723 -14.470 7.870 161 HB3 GLU 20 3HB GLU 20 -6.398 -12.861 7.660 162 HG2 GLU 20 2HG GLU 20 -5.906 -12.968 5.268 163 HG3 GLU 20 3HG GLU 20 -5.246 -14.588 5.482 164 H ARG 21 H ARG 21 -4.636 -12.056 9.844 165 HA ARG 21 HA ARG 21 -5.420 -9.398 9.157 166 HB2 ARG 21 2HB ARG 21 -4.574 -10.473 11.853 167 HB3 ARG 21 3HB ARG 21 -5.485 -8.999 11.552 168 HG2 ARG 21 2HG ARG 21 -7.328 -10.349 10.641 169 HG3 ARG 21 3HG ARG 21 -6.416 -11.812 11.018 170 HD2 ARG 21 2HD ARG 21 -8.192 -11.068 12.694 171 HD3 ARG 21 3HD ARG 21 -6.594 -11.463 13.327 172 HE ARG 21 HE ARG 21 -7.810 -8.819 13.170 173 HH11 ARG 21 1HH1 ARG 21 -5.022 -10.770 13.903 174 HH12 ARG 21 2HH1 ARG 21 -4.246 -9.540 14.844 175 HH21 ARG 21 1HH2 ARG 21 -6.799 -7.191 14.408 176 HH22 ARG 21 2HH2 ARG 21 -5.258 -7.505 15.132 177 H ALA 22 H ALA 22 -2.453 -10.886 10.365 178 HA ALA 22 HA ALA 22 -0.953 -8.684 11.027 179 HB1 ALA 22 1HB ALA 22 0.983 -10.151 9.973 180 HB2 ALA 22 2HB ALA 22 0.173 -10.615 11.470 181 HB3 ALA 22 3HB ALA 22 -0.292 -11.369 9.946 182 H LEU 23 H LEU 23 -1.586 -9.991 7.805 183 HA LEU 23 HA LEU 23 0.084 -8.001 6.530 184 HB2 LEU 23 2HB LEU 23 -1.856 -9.798 5.121 185 HB3 LEU 23 3HB LEU 23 -0.354 -9.103 4.515 186 HG LEU 23 HG LEU 23 -0.463 -11.228 6.649 187 HD11 LEU 23 1HD1 LEU 23 -1.413 -12.217 4.708 188 HD12 LEU 23 2HD1 LEU 23 0.264 -12.753 4.799 189 HD13 LEU 23 3HD1 LEU 23 -0.195 -11.485 3.662 190 HD21 LEU 23 3HD2 LEU 23 1.875 -11.494 6.199 191 HD22 LEU 23 1HD2 LEU 23 1.564 -9.787 6.519 192 HD23 LEU 23 2HD2 LEU 23 1.798 -10.345 4.862 193 H ALA 24 H ALA 24 -3.358 -8.666 6.944 194 HA ALA 24 HA ALA 24 -4.464 -6.806 5.235 195 HB1 ALA 24 1HB ALA 24 -5.390 -7.768 7.930 196 HB2 ALA 24 2HB ALA 24 -6.360 -6.713 6.901 197 HB3 ALA 24 3HB ALA 24 -5.906 -8.320 6.336 198 H GLY 25 H GLY 25 -3.407 -6.310 8.598 199 HA2 GLY 25 2HA GLY 25 -3.961 -3.465 8.423 200 HA3 GLY 25 3HA GLY 25 -3.339 -4.324 9.824 201 H ALA 26 H ALA 26 -1.496 -5.339 7.322 202 HA ALA 26 HA ALA 26 0.616 -3.423 7.993 203 HB1 ALA 26 1HB ALA 26 2.136 -5.097 6.974 204 HB2 ALA 26 2HB ALA 26 1.211 -5.726 8.338 205 HB3 ALA 26 3HB ALA 26 0.741 -6.138 6.689 206 H GLY 27 H GLY 27 -1.613 -4.063 5.550 207 HA2 GLY 27 2HA GLY 27 -1.944 -2.853 3.593 208 HA3 GLY 27 3HA GLY 27 -0.371 -2.104 3.822 209 H LEU 28 H LEU 28 -0.946 -5.571 3.784 210 HA LEU 28 HA LEU 28 0.245 -5.746 1.110 211 HB2 LEU 28 2HB LEU 28 1.164 -7.833 2.927 212 HB3 LEU 28 3HB LEU 28 2.062 -6.881 1.746 213 HG LEU 28 HG LEU 28 1.296 -5.811 4.453 214 HD11 LEU 28 1HD1 LEU 28 4.080 -6.607 4.040 215 HD12 LEU 28 2HD1 LEU 28 2.946 -7.955 4.121 216 HD13 LEU 28 3HD1 LEU 28 3.038 -6.799 5.450 217 HD21 LEU 28 3HD2 LEU 28 3.659 -4.675 3.542 218 HD22 LEU 28 1HD2 LEU 28 2.061 -3.930 3.544 219 HD23 LEU 28 2HD2 LEU 28 2.637 -4.775 2.107 220 H THR 29 H THR 29 -0.455 -7.448 -0.124 221 HA THR 29 HA THR 29 -2.961 -8.503 0.252 222 HB THR 29 HB THR 29 -0.803 -10.011 -1.220 223 HG1 THR 29 HG1 THR 29 -1.415 -8.623 -3.010 224 HG21 THR 29 3HG2 THR 29 -2.801 -10.376 -2.781 225 HG22 THR 29 1HG2 THR 29 -3.793 -9.793 -1.446 226 HG23 THR 29 2HG2 THR 29 -2.806 -11.240 -1.244 227 H CYS 30 H CYS 30 -3.685 -10.689 0.689 228 HA CYS 30 HA CYS 30 -1.902 -12.311 2.342 229 HB2 CYS 30 2HB CYS 30 -3.758 -12.578 4.032 230 HB3 CYS 30 3HB CYS 30 -2.992 -10.994 4.007 231 HG CYS 30 HG CYS 30 -5.938 -11.636 2.396 232 H THR 31 H THR 31 -1.976 -14.324 1.624 233 HA THR 31 HA THR 31 -4.519 -15.347 0.543 234 HB THR 31 HB THR 31 -1.825 -16.203 -0.502 235 HG1 THR 31 HG1 THR 31 -3.523 -14.097 -1.380 236 HG21 THR 31 3HG2 THR 31 -3.786 -17.686 -0.866 237 HG22 THR 31 1HG2 THR 31 -3.099 -17.063 -2.365 238 HG23 THR 31 2HG2 THR 31 -4.584 -16.365 -1.719 239 H THR 32 H THR 32 -5.256 -16.865 1.869 240 HA THR 32 HA THR 32 -3.343 -18.541 3.336 241 HB THR 32 HB THR 32 -5.309 -19.190 4.730 242 HG1 THR 32 HG1 THR 32 -7.192 -18.728 3.889 243 HG21 THR 32 3HG2 THR 32 -4.146 -16.500 4.538 244 HG22 THR 32 1HG2 THR 32 -4.280 -17.580 5.925 245 HG23 THR 32 2HG2 THR 32 -5.656 -16.586 5.446 246 H PHE 33 H PHE 33 -3.080 -20.620 2.842 247 HA PHE 33 HA PHE 33 -5.031 -21.868 1.020 248 HB2 PHE 33 2HB PHE 33 -2.065 -22.387 1.308 249 HB3 PHE 33 3HB PHE 33 -3.146 -23.316 0.275 250 HD1 PHE 33 HD1 PHE 33 -4.078 -22.341 -1.748 251 HD2 PHE 33 HD2 PHE 33 -1.364 -20.170 0.709 252 HE1 PHE 33 HE1 PHE 33 -3.717 -20.732 -3.574 253 HE2 PHE 33 HE2 PHE 33 -1.000 -18.557 -1.113 254 HZ PHE 33 HZ PHE 33 -2.177 -18.836 -3.258 255 H GLU 34 H GLU 34 -4.336 -24.473 1.175 256 HA GLU 34 HA GLU 34 -4.080 -25.365 3.892 257 HB2 GLU 34 2HB GLU 34 -6.313 -26.524 3.902 258 HB3 GLU 34 3HB GLU 34 -6.384 -24.774 4.053 259 HG2 GLU 34 2HG GLU 34 -7.415 -24.503 2.066 260 HG3 GLU 34 3HG GLU 34 -6.566 -25.854 1.316 261 H ASN 35 H ASN 35 -2.330 -26.165 2.297 262 HA ASN 35 HA ASN 35 -2.572 -28.924 2.015 263 HB2 ASN 35 2HB ASN 35 -3.680 -27.429 -0.203 264 HB3 ASN 35 3HB ASN 35 -2.329 -28.428 -0.733 265 HD21 ASN 35 1HD2 ASN 35 -3.936 -29.591 -1.945 266 HD22 ASN 35 2HD2 ASN 35 -4.878 -30.812 -1.167 267 H GLY 36 H GLY 36 -1.177 -26.642 -0.332 268 HA2 GLY 36 2HA GLY 36 1.196 -25.922 0.276 269 HA3 GLY 36 3HA GLY 36 1.486 -27.648 0.443 270 H ASN 37 H ASN 37 0.666 -28.911 -1.600 271 HA ASN 37 HA ASN 37 2.324 -28.192 -3.731 272 HB2 ASN 37 2HB ASN 37 1.230 -29.990 -4.977 273 HB3 ASN 37 3HB ASN 37 1.552 -30.497 -3.321 274 HD21 ASN 37 1HD2 ASN 37 -0.466 -31.279 -5.419 275 HD22 ASN 37 2HD2 ASN 37 -1.983 -31.206 -4.595 276 H GLU 38 H GLU 38 -0.829 -27.134 -2.911 277 HA GLU 38 HA GLU 38 -1.549 -26.298 -5.581 278 HB2 GLU 38 2HB GLU 38 -2.934 -25.288 -3.130 279 HB3 GLU 38 3HB GLU 38 -3.606 -25.689 -4.704 280 HG2 GLU 38 2HG GLU 38 -2.653 -27.637 -2.619 281 HG3 GLU 38 3HG GLU 38 -4.327 -27.289 -3.048 282 H VAL 39 H VAL 39 0.332 -25.066 -3.049 283 HA VAL 39 HA VAL 39 -0.084 -22.273 -3.729 284 HB VAL 39 HB VAL 39 2.051 -23.331 -1.891 285 HG11 VAL 39 1HG1 VAL 39 1.514 -20.803 -2.776 286 HG12 VAL 39 2HG1 VAL 39 0.630 -20.856 -1.249 287 HG13 VAL 39 3HG1 VAL 39 2.360 -21.198 -1.280 288 HG21 VAL 39 3HG2 VAL 39 -0.846 -23.411 -1.547 289 HG22 VAL 39 1HG2 VAL 39 0.428 -24.223 -0.636 290 HG23 VAL 39 2HG2 VAL 39 -0.009 -22.558 -0.249 291 H LEU 40 H LEU 40 2.326 -24.794 -4.180 292 HA LEU 40 HA LEU 40 4.495 -23.348 -5.062 293 HB2 LEU 40 2HB LEU 40 5.007 -25.552 -4.941 294 HB3 LEU 40 3HB LEU 40 3.441 -26.060 -5.569 295 HG LEU 40 HG LEU 40 4.174 -25.541 -7.840 296 HD11 LEU 40 1HD1 LEU 40 6.122 -24.001 -6.534 297 HD12 LEU 40 2HD1 LEU 40 5.905 -24.226 -8.269 298 HD13 LEU 40 3HD1 LEU 40 6.988 -25.289 -7.372 299 HD21 LEU 40 3HD2 LEU 40 6.450 -27.161 -6.953 300 HD22 LEU 40 1HD2 LEU 40 5.147 -27.547 -8.078 301 HD23 LEU 40 2HD2 LEU 40 4.885 -27.696 -6.340 302 H ALA 41 H ALA 41 1.644 -24.354 -6.902 303 HA ALA 41 HA ALA 41 2.572 -23.293 -9.385 304 HB1 ALA 41 1HB ALA 41 -0.057 -24.325 -8.396 305 HB2 ALA 41 2HB ALA 41 0.061 -23.522 -9.962 306 HB3 ALA 41 3HB ALA 41 1.003 -24.979 -9.646 307 H ALA 42 H ALA 42 0.794 -22.021 -6.670 308 HA ALA 42 HA ALA 42 -0.396 -19.789 -7.868 309 HB1 ALA 42 1HB ALA 42 0.654 -19.964 -5.048 310 HB2 ALA 42 2HB ALA 42 -0.604 -18.885 -5.651 311 HB3 ALA 42 3HB ALA 42 -0.891 -20.623 -5.584 312 H LEU 43 H LEU 43 2.876 -20.345 -6.749 313 HA LEU 43 HA LEU 43 3.722 -17.635 -6.804 314 HB2 LEU 43 2HB LEU 43 5.637 -19.852 -7.317 315 HB3 LEU 43 3HB LEU 43 5.818 -18.418 -6.309 316 HG LEU 43 HG LEU 43 4.302 -20.937 -5.637 317 HD11 LEU 43 1HD1 LEU 43 6.006 -20.684 -3.653 318 HD12 LEU 43 2HD1 LEU 43 6.922 -19.766 -4.848 319 HD13 LEU 43 3HD1 LEU 43 6.484 -21.443 -5.172 320 HD21 LEU 43 3HD2 LEU 43 3.757 -18.317 -4.784 321 HD22 LEU 43 1HD2 LEU 43 4.600 -19.108 -3.451 322 HD23 LEU 43 2HD2 LEU 43 3.131 -19.825 -4.115 323 H ALA 44 H ALA 44 3.447 -20.137 -9.214 324 HA ALA 44 HA ALA 44 5.067 -18.810 -11.176 325 HB1 ALA 44 1HB ALA 44 3.513 -20.566 -12.586 326 HB2 ALA 44 2HB ALA 44 5.064 -20.947 -11.837 327 HB3 ALA 44 3HB ALA 44 3.562 -21.304 -10.985 328 H SER 45 H SER 45 2.117 -18.078 -9.915 329 HA SER 45 HA SER 45 1.320 -16.658 -12.365 330 HB2 SER 45 2HB SER 45 -0.131 -18.733 -11.101 331 HB3 SER 45 3HB SER 45 -0.986 -17.231 -10.749 332 HG SER 45 HG SER 45 -0.936 -16.804 -13.023 333 H LYS 46 H LYS 46 2.816 -15.905 -9.891 334 HA LYS 46 HA LYS 46 1.808 -13.329 -9.543 335 HB2 LYS 46 2HB LYS 46 0.318 -15.196 -8.086 336 HB3 LYS 46 3HB LYS 46 1.386 -14.450 -6.904 337 HG2 LYS 46 2HG LYS 46 0.085 -12.552 -8.713 338 HG3 LYS 46 3HG LYS 46 -1.023 -13.461 -7.682 339 HD2 LYS 46 2HD LYS 46 1.139 -12.677 -6.054 340 HD3 LYS 46 3HD LYS 46 0.685 -11.262 -7.007 341 HE2 LYS 46 2HE LYS 46 -1.526 -12.825 -5.820 342 HE3 LYS 46 3HE LYS 46 -0.503 -11.933 -4.695 343 HZ1 LYS 46 3HZ LYS 46 -1.622 -10.114 -5.221 344 HZ2 LYS 46 1HZ LYS 46 -2.541 -10.953 -6.368 345 HZ3 LYS 46 2HZ LYS 46 -1.079 -10.231 -6.819 346 H THR 47 H THR 47 3.454 -15.984 -7.870 347 HA THR 47 HA THR 47 5.411 -16.084 -6.707 348 HB THR 47 HB THR 47 6.844 -13.865 -7.790 349 HG1 THR 47 HG1 THR 47 5.545 -13.658 -9.521 350 HG21 THR 47 3HG2 THR 47 7.713 -16.048 -9.166 351 HG22 THR 47 1HG2 THR 47 6.945 -16.802 -7.769 352 HG23 THR 47 2HG2 THR 47 8.234 -15.621 -7.537 353 HA PRO 48 HA PRO 48 4.274 -12.804 -3.740 354 HB2 PRO 48 2HB PRO 48 4.697 -14.355 -1.552 355 HB3 PRO 48 3HB PRO 48 3.190 -14.386 -2.475 356 HG2 PRO 48 2HG PRO 48 5.519 -16.263 -2.589 357 HG3 PRO 48 3HG PRO 48 3.784 -16.631 -2.594 358 HD2 PRO 48 2HD PRO 48 5.278 -16.619 -4.853 359 HD3 PRO 48 3HD PRO 48 3.563 -16.159 -4.839 360 H ASP 49 H ASP 49 5.515 -11.774 -2.035 361 HA ASP 49 HA ASP 49 8.323 -11.709 -2.656 362 HB2 ASP 49 2HB ASP 49 6.509 -9.866 -1.686 363 HB3 ASP 49 3HB ASP 49 7.491 -10.234 -0.271 364 H VAL 50 H VAL 50 6.370 -13.417 -0.468 365 HA VAL 50 HA VAL 50 8.465 -14.938 0.581 366 HB VAL 50 HB VAL 50 9.162 -13.020 1.842 367 HG11 VAL 50 1HG1 VAL 50 6.905 -12.609 3.563 368 HG12 VAL 50 2HG1 VAL 50 7.759 -11.447 2.545 369 HG13 VAL 50 3HG1 VAL 50 6.425 -12.391 1.881 370 HG21 VAL 50 3HG2 VAL 50 9.434 -14.095 3.814 371 HG22 VAL 50 1HG2 VAL 50 7.710 -14.423 3.996 372 HG23 VAL 50 2HG2 VAL 50 8.692 -15.430 2.933 373 H LEU 51 H LEU 51 7.714 -16.699 1.709 374 HA LEU 51 HA LEU 51 4.796 -16.820 2.081 375 HB2 LEU 51 2HB LEU 51 6.512 -18.471 0.626 376 HB3 LEU 51 3HB LEU 51 6.112 -19.389 2.076 377 HG LEU 51 HG LEU 51 3.814 -18.167 0.705 378 HD11 LEU 51 1HD1 LEU 51 5.760 -19.685 -0.792 379 HD12 LEU 51 2HD1 LEU 51 4.307 -18.857 -1.348 380 HD13 LEU 51 3HD1 LEU 51 4.202 -20.509 -0.740 381 HD21 LEU 51 3HD2 LEU 51 4.221 -20.083 2.622 382 HD22 LEU 51 1HD2 LEU 51 3.887 -21.045 1.181 383 HD23 LEU 51 2HD2 LEU 51 2.724 -19.833 1.721 384 H LEU 52 H LEU 52 4.105 -18.434 3.782 385 HA LEU 52 HA LEU 52 5.978 -18.591 6.028 386 HB2 LEU 52 2HB LEU 52 3.405 -17.122 5.936 387 HB3 LEU 52 3HB LEU 52 3.766 -18.027 7.404 388 HG LEU 52 HG LEU 52 6.007 -16.718 7.361 389 HD11 LEU 52 1HD1 LEU 52 5.124 -14.329 6.381 390 HD12 LEU 52 2HD1 LEU 52 4.499 -15.470 5.190 391 HD13 LEU 52 3HD1 LEU 52 6.225 -15.427 5.549 392 HD21 LEU 52 3HD2 LEU 52 4.081 -14.709 8.046 393 HD22 LEU 52 1HD2 LEU 52 5.072 -15.713 9.104 394 HD23 LEU 52 2HD2 LEU 52 3.500 -16.295 8.555 395 H SER 53 H SER 53 5.941 -20.828 5.147 396 HA SER 53 HA SER 53 3.652 -22.451 5.213 397 HB2 SER 53 2HB SER 53 5.345 -23.497 4.067 398 HB3 SER 53 3HB SER 53 6.593 -22.928 5.176 399 HG SER 53 HG SER 53 4.662 -24.896 5.841 400 H ASP 54 H ASP 54 2.592 -23.461 6.805 401 HA ASP 54 HA ASP 54 3.504 -23.014 9.545 402 HB2 ASP 54 2HB ASP 54 1.264 -22.355 9.316 403 HB3 ASP 54 3HB ASP 54 0.860 -23.751 8.320 404 H ILE 55 H ILE 55 3.053 -25.546 7.223 405 HA ILE 55 HA ILE 55 3.573 -27.761 7.240 406 HB ILE 55 HB ILE 55 5.037 -27.140 9.807 407 HG12 ILE 55 2HG1 ILE 55 6.091 -27.210 6.972 408 HG13 ILE 55 3HG1 ILE 55 5.746 -25.738 7.874 409 HG21 ILE 55 1HG2 ILE 55 5.270 -29.361 9.874 410 HG22 ILE 55 2HG2 ILE 55 4.682 -29.559 8.224 411 HG23 ILE 55 3HG2 ILE 55 6.374 -29.160 8.514 412 HD11 ILE 55 3HD1 ILE 55 7.409 -26.520 9.580 413 HD12 ILE 55 1HD1 ILE 55 7.853 -27.798 8.449 414 HD13 ILE 55 2HD1 ILE 55 8.075 -26.106 8.000 415 H ARG 56 H ARG 56 1.369 -28.312 7.567 416 HA ARG 56 HA ARG 56 0.930 -29.749 10.047 417 HB2 ARG 56 2HB ARG 56 -0.088 -27.188 9.837 418 HB3 ARG 56 3HB ARG 56 -1.446 -28.196 9.354 419 HG2 ARG 56 2HG ARG 56 -1.889 -28.534 11.494 420 HG3 ARG 56 3HG ARG 56 -0.364 -29.410 11.635 421 HD2 ARG 56 2HD ARG 56 0.444 -26.793 11.723 422 HD3 ARG 56 3HD ARG 56 -1.098 -26.742 12.576 423 HE ARG 56 HE ARG 56 0.168 -28.856 13.698 424 HH11 ARG 56 1HH1 ARG 56 1.062 -25.537 13.145 425 HH12 ARG 56 2HH1 ARG 56 2.093 -25.447 14.534 426 HH21 ARG 56 1HH2 ARG 56 1.523 -28.750 15.530 427 HH22 ARG 56 2HH2 ARG 56 2.356 -27.275 15.889 428 H MET 57 H MET 57 1.382 -30.660 7.434 429 HA MET 57 HA MET 57 -1.269 -31.648 6.622 430 HB2 MET 57 2HB MET 57 1.135 -31.951 4.878 431 HB3 MET 57 3HB MET 57 -0.554 -31.763 4.429 432 HG2 MET 57 2HG MET 57 0.175 -29.714 3.834 433 HG3 MET 57 3HG MET 57 -0.176 -29.377 5.528 434 HE1 MET 57 3HE MET 57 3.046 -28.130 3.338 435 HE2 MET 57 1HE MET 57 1.319 -27.851 3.567 436 HE3 MET 57 2HE MET 57 2.483 -27.134 4.682 437 HA PRO 58 HA PRO 58 -0.168 -35.684 7.989 438 HB2 PRO 58 2HB PRO 58 -1.837 -37.144 6.423 439 HB3 PRO 58 3HB PRO 58 -2.401 -36.194 7.803 440 HG2 PRO 58 2HG PRO 58 -2.447 -35.513 4.888 441 HG3 PRO 58 3HG PRO 58 -3.705 -35.269 6.114 442 HD2 PRO 58 2HD PRO 58 -2.077 -33.272 5.281 443 HD3 PRO 58 3HD PRO 58 -2.710 -33.360 6.937 444 H GLY 59 H GLY 59 -0.580 -35.433 4.447 445 HA2 GLY 59 2HA GLY 59 1.265 -37.569 3.938 446 HA3 GLY 59 3HA GLY 59 0.540 -36.510 2.738 447 H MET 60 H MET 60 1.403 -34.041 3.481 448 HA MET 60 HA MET 60 4.217 -34.204 2.786 449 HB2 MET 60 2HB MET 60 2.149 -32.045 2.789 450 HB3 MET 60 3HB MET 60 3.848 -31.593 2.817 451 HG2 MET 60 2HG MET 60 3.942 -33.327 0.810 452 HG3 MET 60 3HG MET 60 2.250 -32.853 0.670 453 HE1 MET 60 3HE MET 60 2.515 -30.043 -1.623 454 HE2 MET 60 1HE MET 60 1.923 -31.666 -1.267 455 HE3 MET 60 2HE MET 60 1.485 -30.318 -0.217 456 H ASP 61 H ASP 61 5.885 -33.734 4.096 457 HA ASP 61 HA ASP 61 5.400 -33.478 6.911 458 HB2 ASP 61 2HB ASP 61 7.475 -34.458 5.358 459 HB3 ASP 61 3HB ASP 61 8.148 -32.989 6.059 460 H GLY 62 H GLY 62 5.376 -31.265 4.463 461 HA2 GLY 62 2HA GLY 62 4.901 -28.963 4.955 462 HA3 GLY 62 3HA GLY 62 5.957 -29.085 6.354 463 H LEU 63 H LEU 63 8.239 -30.140 5.342 464 HA LEU 63 HA LEU 63 9.289 -27.898 3.855 465 HB2 LEU 63 2HB LEU 63 11.434 -29.355 4.063 466 HB3 LEU 63 3HB LEU 63 10.780 -28.529 5.476 467 HG LEU 63 HG LEU 63 9.803 -30.605 6.270 468 HD11 LEU 63 1HD1 LEU 63 9.192 -31.888 4.470 469 HD12 LEU 63 2HD1 LEU 63 10.665 -32.713 4.979 470 HD13 LEU 63 3HD1 LEU 63 10.705 -31.601 3.610 471 HD21 LEU 63 3HD2 LEU 63 12.066 -31.946 6.344 472 HD22 LEU 63 1HD2 LEU 63 11.887 -30.413 7.198 473 HD23 LEU 63 2HD2 LEU 63 12.709 -30.462 5.638 474 H ALA 64 H ALA 64 8.029 -30.958 3.120 475 HA ALA 64 HA ALA 64 9.451 -31.957 1.030 476 HB1 ALA 64 1HB ALA 64 6.503 -31.780 1.502 477 HB2 ALA 64 2HB ALA 64 7.129 -32.510 0.023 478 HB3 ALA 64 3HB ALA 64 7.569 -33.183 1.593 479 H LEU 65 H LEU 65 6.838 -29.555 0.636 480 HA LEU 65 HA LEU 65 7.647 -28.987 -2.067 481 HB2 LEU 65 2HB LEU 65 5.736 -27.721 -2.240 482 HB3 LEU 65 3HB LEU 65 5.278 -28.909 -1.022 483 HG LEU 65 HG LEU 65 6.197 -26.107 -0.392 484 HD11 LEU 65 1HD1 LEU 65 4.169 -25.371 -0.891 485 HD12 LEU 65 2HD1 LEU 65 3.461 -26.540 0.223 486 HD13 LEU 65 3HD1 LEU 65 3.721 -26.977 -1.465 487 HD21 LEU 65 3HD2 LEU 65 5.350 -28.459 1.204 488 HD22 LEU 65 1HD2 LEU 65 4.813 -26.868 1.742 489 HD23 LEU 65 2HD2 LEU 65 6.536 -27.206 1.571 490 H LEU 66 H LEU 66 8.333 -27.732 1.069 491 HA LEU 66 HA LEU 66 9.107 -25.109 0.324 492 HB2 LEU 66 2HB LEU 66 8.740 -26.398 2.679 493 HB3 LEU 66 3HB LEU 66 10.500 -26.348 2.599 494 HG LEU 66 HG LEU 66 9.852 -24.464 3.854 495 HD11 LEU 66 1HD1 LEU 66 11.565 -23.999 2.181 496 HD12 LEU 66 2HD1 LEU 66 10.560 -22.580 2.476 497 HD13 LEU 66 3HD1 LEU 66 10.318 -23.545 1.020 498 HD21 LEU 66 3HD2 LEU 66 7.713 -23.844 3.683 499 HD22 LEU 66 1HD2 LEU 66 7.578 -24.451 2.032 500 HD23 LEU 66 2HD2 LEU 66 8.239 -22.843 2.329 501 H LYS 67 H LYS 67 10.651 -28.192 0.116 502 HA LYS 67 HA LYS 67 13.342 -27.316 0.004 503 HB2 LYS 67 2HB LYS 67 11.944 -29.801 -0.970 504 HB3 LYS 67 3HB LYS 67 13.669 -29.550 -1.209 505 HG2 LYS 67 2HG LYS 67 12.320 -29.511 1.481 506 HG3 LYS 67 3HG LYS 67 13.091 -30.933 0.774 507 HD2 LYS 67 2HD LYS 67 14.470 -28.305 1.320 508 HD3 LYS 67 3HD LYS 67 14.560 -29.731 2.357 509 HE2 LYS 67 2HE LYS 67 15.360 -30.935 0.205 510 HE3 LYS 67 3HE LYS 67 15.689 -29.306 -0.384 511 HZ1 LYS 67 3HZ LYS 67 17.674 -30.010 0.585 512 HZ2 LYS 67 1HZ LYS 67 16.903 -30.701 1.922 513 HZ3 LYS 67 2HZ LYS 67 16.981 -29.019 1.767 514 H GLN 68 H GLN 68 10.770 -27.461 -2.335 515 HA GLN 68 HA GLN 68 12.548 -27.023 -4.583 516 HB2 GLN 68 2HB GLN 68 10.751 -27.457 -5.938 517 HB3 GLN 68 3HB GLN 68 10.243 -28.317 -4.490 518 HG2 GLN 68 2HG GLN 68 9.155 -25.968 -3.931 519 HG3 GLN 68 3HG GLN 68 9.190 -25.822 -5.688 520 HE21 GLN 68 1HE2 GLN 68 6.971 -26.140 -3.722 521 HE22 GLN 68 2HE2 GLN 68 6.059 -27.490 -4.298 522 H ILE 69 H ILE 69 10.676 -25.164 -2.365 523 HA ILE 69 HA ILE 69 10.166 -22.854 -3.833 524 HB ILE 69 HB ILE 69 10.776 -23.190 -0.898 525 HG12 ILE 69 2HG1 ILE 69 8.192 -22.760 -2.414 526 HG13 ILE 69 3HG1 ILE 69 8.725 -24.276 -1.696 527 HG21 ILE 69 1HG2 ILE 69 9.851 -20.741 -2.390 528 HG22 ILE 69 2HG2 ILE 69 9.766 -20.926 -0.639 529 HG23 ILE 69 3HG2 ILE 69 11.332 -20.928 -1.450 530 HD11 ILE 69 3HD1 ILE 69 7.288 -22.110 -0.508 531 HD12 ILE 69 1HD1 ILE 69 7.655 -23.705 0.149 532 HD13 ILE 69 2HD1 ILE 69 8.799 -22.380 0.361 533 H LYS 70 H LYS 70 13.129 -24.038 -2.444 534 HA LYS 70 HA LYS 70 14.528 -21.527 -2.726 535 HB2 LYS 70 2HB LYS 70 15.073 -24.162 -1.579 536 HB3 LYS 70 3HB LYS 70 16.460 -23.472 -2.411 537 HG2 LYS 70 2HG LYS 70 16.866 -22.455 -0.468 538 HG3 LYS 70 3HG LYS 70 15.579 -21.347 -0.951 539 HD2 LYS 70 2HD LYS 70 14.164 -23.400 0.158 540 HD3 LYS 70 3HD LYS 70 15.622 -23.390 1.152 541 HE2 LYS 70 2HE LYS 70 14.145 -21.928 2.238 542 HE3 LYS 70 3HE LYS 70 15.257 -20.876 1.365 543 HZ1 LYS 70 3HZ LYS 70 12.421 -21.401 0.872 544 HZ2 LYS 70 1HZ LYS 70 13.408 -21.087 -0.466 545 HZ3 LYS 70 2HZ LYS 70 13.283 -19.948 0.778 546 H GLN 71 H GLN 71 14.024 -24.419 -4.591 547 HA GLN 71 HA GLN 71 16.174 -23.897 -6.435 548 HB2 GLN 71 2HB GLN 71 14.882 -26.156 -5.776 549 HB3 GLN 71 3HB GLN 71 13.952 -25.709 -7.200 550 HG2 GLN 71 2HG GLN 71 15.564 -27.024 -8.135 551 HG3 GLN 71 3HG GLN 71 16.308 -25.434 -8.290 552 HE21 GLN 71 1HE2 GLN 71 18.178 -25.013 -7.249 553 HE22 GLN 71 2HE2 GLN 71 19.027 -26.159 -6.273 554 H ARG 72 H ARG 72 12.659 -23.514 -6.404 555 HA ARG 72 HA ARG 72 12.636 -22.407 -9.078 556 HB2 ARG 72 2HB ARG 72 10.673 -23.406 -7.181 557 HB3 ARG 72 3HB ARG 72 10.159 -21.893 -7.915 558 HG2 ARG 72 2HG ARG 72 11.088 -23.329 -10.064 559 HG3 ARG 72 3HG ARG 72 10.329 -24.562 -9.055 560 HD2 ARG 72 2HD ARG 72 8.422 -22.727 -8.902 561 HD3 ARG 72 3HD ARG 72 9.126 -22.223 -10.438 562 HE ARG 72 HE ARG 72 8.731 -24.978 -10.552 563 HH11 ARG 72 1HH1 ARG 72 6.837 -22.067 -10.310 564 HH12 ARG 72 2HH1 ARG 72 5.462 -22.739 -11.123 565 HH21 ARG 72 1HH2 ARG 72 6.927 -25.874 -11.623 566 HH22 ARG 72 2HH2 ARG 72 5.514 -24.904 -11.868 567 H HIS 73 H HIS 73 12.691 -21.271 -5.794 568 HA HIS 73 HA HIS 73 12.984 -18.537 -6.765 569 HB2 HIS 73 2HB HIS 73 11.117 -19.109 -4.469 570 HB3 HIS 73 3HB HIS 73 11.330 -17.598 -5.349 571 HD1 HIS 73 HD1 HIS 73 10.298 -17.507 -7.781 572 HD2 HIS 73 HD2 HIS 73 9.257 -20.841 -5.531 573 HE1 HIS 73 HE1 HIS 73 8.324 -18.526 -8.961 574 HA PRO 74 HA PRO 74 16.010 -19.730 -3.460 575 HB2 PRO 74 2HB PRO 74 18.173 -18.728 -4.759 576 HB3 PRO 74 3HB PRO 74 17.565 -20.367 -5.027 577 HG2 PRO 74 2HG PRO 74 17.127 -17.894 -6.657 578 HG3 PRO 74 3HG PRO 74 17.484 -19.544 -7.200 579 HD2 PRO 74 2HD PRO 74 14.983 -18.507 -7.235 580 HD3 PRO 74 3HD PRO 74 15.298 -20.232 -6.955 581 H MET 75 H MET 75 15.926 -16.758 -5.421 582 HA MET 75 HA MET 75 17.042 -15.130 -3.354 583 HB2 MET 75 2HB MET 75 17.102 -14.697 -5.874 584 HB3 MET 75 3HB MET 75 15.444 -14.137 -5.708 585 HG2 MET 75 2HG MET 75 16.638 -12.703 -3.762 586 HG3 MET 75 3HG MET 75 17.965 -12.859 -4.911 587 HE1 MET 75 3HE MET 75 14.315 -10.313 -5.002 588 HE2 MET 75 1HE MET 75 13.838 -11.921 -5.546 589 HE3 MET 75 2HE MET 75 14.640 -11.720 -3.989 590 H LEU 76 H LEU 76 14.047 -16.527 -3.713 591 HA LEU 76 HA LEU 76 12.518 -14.355 -2.539 592 HB2 LEU 76 2HB LEU 76 11.315 -15.584 -4.134 593 HB3 LEU 76 3HB LEU 76 11.850 -17.127 -3.470 594 HG LEU 76 HG LEU 76 10.433 -16.705 -1.477 595 HD11 LEU 76 1HD1 LEU 76 9.876 -14.195 -2.980 596 HD12 LEU 76 2HD1 LEU 76 10.107 -14.449 -1.250 597 HD13 LEU 76 3HD1 LEU 76 8.589 -14.920 -2.015 598 HD21 LEU 76 3HD2 LEU 76 9.147 -18.057 -2.702 599 HD22 LEU 76 1HD2 LEU 76 9.528 -17.204 -4.199 600 HD23 LEU 76 2HD2 LEU 76 8.247 -16.605 -3.145 601 HA PRO 77 HA PRO 77 13.649 -15.784 1.547 602 HB2 PRO 77 2HB PRO 77 12.348 -13.803 2.871 603 HB3 PRO 77 3HB PRO 77 13.917 -13.569 2.093 604 HG2 PRO 77 2HG PRO 77 11.185 -12.858 1.098 605 HG3 PRO 77 3HG PRO 77 12.683 -11.912 1.024 606 HD2 PRO 77 2HD PRO 77 11.733 -13.305 -1.095 607 HD3 PRO 77 3HD PRO 77 13.469 -13.067 -0.810 608 H VAL 78 H VAL 78 12.652 -17.156 2.909 609 HA VAL 78 HA VAL 78 9.718 -17.140 3.048 610 HB VAL 78 HB VAL 78 11.366 -19.653 2.741 611 HG11 VAL 78 1HG1 VAL 78 8.481 -19.102 3.252 612 HG12 VAL 78 2HG1 VAL 78 8.931 -20.516 2.297 613 HG13 VAL 78 3HG1 VAL 78 9.532 -20.335 3.946 614 HG21 VAL 78 3HG2 VAL 78 10.328 -17.839 0.770 615 HG22 VAL 78 1HG2 VAL 78 11.295 -19.297 0.549 616 HG23 VAL 78 2HG2 VAL 78 9.537 -19.409 0.629 617 H ILE 79 H ILE 79 8.847 -18.200 4.938 618 HA ILE 79 HA ILE 79 10.785 -18.495 7.135 619 HB ILE 79 HB ILE 79 8.079 -17.182 7.395 620 HG12 ILE 79 2HG1 ILE 79 10.690 -15.753 7.753 621 HG13 ILE 79 3HG1 ILE 79 10.025 -15.956 6.136 622 HG21 ILE 79 1HG2 ILE 79 8.753 -16.661 9.648 623 HG22 ILE 79 2HG2 ILE 79 8.901 -18.398 9.387 624 HG23 ILE 79 3HG2 ILE 79 10.340 -17.380 9.378 625 HD11 ILE 79 3HD1 ILE 79 9.434 -13.954 7.980 626 HD12 ILE 79 1HD1 ILE 79 8.627 -14.273 6.445 627 HD13 ILE 79 2HD1 ILE 79 8.007 -14.989 7.933 628 H ILE 80 H ILE 80 10.381 -20.101 8.607 629 HA ILE 80 HA ILE 80 8.216 -21.955 7.896 630 HB ILE 80 HB ILE 80 10.696 -22.481 9.539 631 HG12 ILE 80 2HG1 ILE 80 10.963 -22.014 7.028 632 HG13 ILE 80 3HG1 ILE 80 11.650 -23.512 7.647 633 HG21 ILE 80 1HG2 ILE 80 9.169 -24.045 10.291 634 HG22 ILE 80 2HG2 ILE 80 8.368 -24.169 8.725 635 HG23 ILE 80 3HG2 ILE 80 9.953 -24.904 8.965 636 HD11 ILE 80 3HD1 ILE 80 8.890 -23.730 6.689 637 HD12 ILE 80 1HD1 ILE 80 10.082 -23.324 5.455 638 HD13 ILE 80 2HD1 ILE 80 10.278 -24.785 6.423 639 H MET 81 H MET 81 6.741 -22.657 9.386 640 HA MET 81 HA MET 81 6.849 -21.378 12.039 641 HB2 MET 81 2HB MET 81 4.677 -21.557 10.042 642 HB3 MET 81 3HB MET 81 4.202 -21.848 11.710 643 HG2 MET 81 2HG MET 81 4.377 -19.697 12.252 644 HG3 MET 81 3HG MET 81 5.912 -19.516 11.406 645 HE1 MET 81 3HE MET 81 2.860 -20.993 9.610 646 HE2 MET 81 1HE MET 81 1.991 -19.917 10.706 647 HE3 MET 81 2HE MET 81 2.007 -19.586 8.974 648 H THR 82 H THR 82 7.011 -22.759 13.667 649 HA THR 82 HA THR 82 5.424 -25.002 14.085 650 HB THR 82 HB THR 82 6.378 -26.300 12.427 651 HG1 THR 82 HG1 THR 82 7.025 -27.828 13.730 652 HG21 THR 82 3HG2 THR 82 8.673 -24.534 12.808 653 HG22 THR 82 1HG2 THR 82 8.106 -25.353 11.353 654 HG23 THR 82 2HG2 THR 82 9.126 -26.212 12.508 655 H ALA 83 H ALA 83 8.874 -25.344 14.534 656 HA ALA 83 HA ALA 83 10.208 -25.288 16.378 657 HB1 ALA 83 1HB ALA 83 10.098 -23.102 16.886 658 HB2 ALA 83 2HB ALA 83 8.336 -23.063 16.795 659 HB3 ALA 83 3HB ALA 83 9.131 -23.658 18.253 660 H HIS 84 H HIS 84 9.317 -27.546 16.550 661 HA HIS 84 HA HIS 84 8.792 -28.183 19.221 662 HB2 HIS 84 2HB HIS 84 6.474 -29.061 19.016 663 HB3 HIS 84 3HB HIS 84 6.562 -27.309 18.863 664 HD1 HIS 84 HD1 HIS 84 6.117 -30.406 16.743 665 HD2 HIS 84 HD2 HIS 84 5.555 -26.295 16.522 666 HE1 HIS 84 HE1 HIS 84 4.864 -30.013 14.598 667 H SER 85 H SER 85 8.526 -29.109 15.848 668 HA SER 85 HA SER 85 9.952 -31.551 16.347 669 HB2 SER 85 2HB SER 85 7.632 -32.220 16.917 670 HB3 SER 85 3HB SER 85 7.117 -31.743 15.300 671 HG SER 85 HG SER 85 7.579 -34.012 15.525 672 H ASP 86 H ASP 86 10.154 -29.091 14.747 673 HA ASP 86 HA ASP 86 10.688 -30.376 12.177 674 HB2 ASP 86 2HB ASP 86 8.771 -28.158 12.646 675 HB3 ASP 86 3HB ASP 86 9.823 -28.010 11.241 676 H LEU 87 H LEU 87 11.069 -27.548 14.256 677 HA LEU 87 HA LEU 87 13.017 -26.158 12.882 678 HB2 LEU 87 2HB LEU 87 12.091 -26.335 15.636 679 HB3 LEU 87 3HB LEU 87 13.798 -25.913 15.517 680 HG LEU 87 HG LEU 87 13.204 -23.994 14.095 681 HD11 LEU 87 1HD1 LEU 87 11.231 -23.880 13.097 682 HD12 LEU 87 2HD1 LEU 87 10.438 -23.774 14.668 683 HD13 LEU 87 3HD1 LEU 87 10.714 -25.349 13.925 684 HD21 LEU 87 3HD2 LEU 87 12.105 -22.657 15.868 685 HD22 LEU 87 1HD2 LEU 87 13.456 -23.624 16.460 686 HD23 LEU 87 2HD2 LEU 87 11.798 -24.148 16.759 687 H ASP 88 H ASP 88 13.425 -28.870 15.128 688 HA ASP 88 HA ASP 88 16.129 -29.000 15.405 689 HB2 ASP 88 2HB ASP 88 14.911 -30.640 16.551 690 HB3 ASP 88 3HB ASP 88 14.072 -31.168 15.095 691 H ALA 89 H ALA 89 14.249 -30.163 12.635 692 HA ALA 89 HA ALA 89 16.668 -30.917 11.211 693 HB1 ALA 89 1HB ALA 89 15.305 -32.366 10.234 694 HB2 ALA 89 2HB ALA 89 13.932 -31.669 11.095 695 HB3 ALA 89 3HB ALA 89 14.398 -31.035 9.516 696 H ALA 90 H ALA 90 14.110 -28.483 11.014 697 HA ALA 90 HA ALA 90 14.860 -27.296 8.594 698 HB1 ALA 90 1HB ALA 90 13.237 -26.500 10.930 699 HB2 ALA 90 2HB ALA 90 13.824 -25.195 9.898 700 HB3 ALA 90 3HB ALA 90 12.840 -26.488 9.211 701 H VAL 91 H VAL 91 16.372 -27.236 11.668 702 HA VAL 91 HA VAL 91 17.690 -24.751 11.552 703 HB VAL 91 HB VAL 91 18.345 -27.323 12.970 704 HG11 VAL 91 1HG1 VAL 91 19.914 -25.526 14.227 705 HG12 VAL 91 2HG1 VAL 91 20.485 -26.609 12.956 706 HG13 VAL 91 3HG1 VAL 91 20.040 -24.947 12.567 707 HG21 VAL 91 3HG2 VAL 91 17.897 -24.847 14.472 708 HG22 VAL 91 1HG2 VAL 91 16.513 -25.380 13.517 709 HG23 VAL 91 2HG2 VAL 91 17.226 -26.459 14.715 710 H SER 92 H SER 92 18.913 -28.008 10.757 711 HA SER 92 HA SER 92 21.205 -26.838 9.404 712 HB2 SER 92 2HB SER 92 20.438 -29.566 10.324 713 HB3 SER 92 3HB SER 92 21.555 -29.448 8.965 714 HG SER 92 HG SER 92 23.047 -28.995 10.356 715 H ALA 93 H ALA 93 18.083 -27.958 8.638 716 HA ALA 93 HA ALA 93 18.717 -28.599 5.875 717 HB1 ALA 93 1HB ALA 93 16.104 -28.560 7.378 718 HB2 ALA 93 2HB ALA 93 16.275 -29.020 5.683 719 HB3 ALA 93 3HB ALA 93 17.063 -29.974 6.940 720 H TYR 94 H TYR 94 16.372 -26.392 7.421 721 HA TYR 94 HA TYR 94 15.815 -24.856 5.181 722 HB2 TYR 94 2HB TYR 94 14.771 -24.872 7.591 723 HB3 TYR 94 3HB TYR 94 15.914 -23.566 7.883 724 HD1 TYR 94 HD2 TYR 94 13.948 -24.346 4.816 725 HD2 TYR 94 HD1 TYR 94 14.605 -21.646 8.037 726 HE1 TYR 94 HE2 TYR 94 12.381 -22.752 3.791 727 HE2 TYR 94 HE1 TYR 94 13.039 -20.044 7.022 728 HH TYR 94 HH TYR 94 10.960 -20.324 5.330 729 H GLN 95 H GLN 95 18.489 -24.654 7.435 730 HA GLN 95 HA GLN 95 19.450 -22.111 6.717 731 HB2 GLN 95 2HB GLN 95 21.486 -22.727 7.815 732 HB3 GLN 95 3HB GLN 95 20.155 -23.432 8.724 733 HG2 GLN 95 2HG GLN 95 21.660 -25.163 8.661 734 HG3 GLN 95 3HG GLN 95 20.623 -25.536 7.285 735 HE21 GLN 95 1HE2 GLN 95 22.132 -26.680 6.151 736 HE22 GLN 95 2HE2 GLN 95 23.542 -25.965 5.454 737 H GLN 96 H GLN 96 19.058 -24.695 4.762 738 HA GLN 96 HA GLN 96 21.518 -24.647 3.298 739 HB2 GLN 96 2HB GLN 96 18.808 -25.849 2.785 740 HB3 GLN 96 3HB GLN 96 20.081 -25.904 1.573 741 HG2 GLN 96 2HG GLN 96 20.828 -26.817 4.272 742 HG3 GLN 96 3HG GLN 96 19.670 -27.821 3.402 743 HE21 GLN 96 1HE2 GLN 96 21.474 -29.370 3.574 744 HE22 GLN 96 2HE2 GLN 96 22.682 -29.354 2.339 745 H GLY 97 H GLY 97 20.213 -22.063 3.679 746 HA2 GLY 97 2HA GLY 97 20.594 -20.278 2.068 747 HA3 GLY 97 3HA GLY 97 19.927 -21.335 0.832 748 H ALA 98 H ALA 98 18.564 -20.882 4.042 749 HA ALA 98 HA ALA 98 16.248 -19.556 2.787 750 HB1 ALA 98 1HB ALA 98 16.048 -21.205 5.283 751 HB2 ALA 98 2HB ALA 98 14.774 -20.736 4.156 752 HB3 ALA 98 3HB ALA 98 15.968 -21.945 3.684 753 H PHE 99 H PHE 99 14.855 -18.494 4.649 754 HA PHE 99 HA PHE 99 16.678 -16.664 6.024 755 HB2 PHE 99 2HB PHE 99 15.105 -15.489 4.695 756 HB3 PHE 99 3HB PHE 99 13.768 -16.483 5.262 757 HD1 PHE 99 HD1 PHE 99 16.108 -13.796 6.186 758 HD2 PHE 99 HD2 PHE 99 12.611 -15.969 7.268 759 HE1 PHE 99 HE1 PHE 99 15.614 -12.129 7.926 760 HE2 PHE 99 HE2 PHE 99 12.112 -14.305 9.010 761 HZ PHE 99 HZ PHE 99 13.614 -12.381 9.340 762 H ASP 100 H ASP 100 16.354 -16.083 8.221 763 HA ASP 100 HA ASP 100 16.072 -18.137 10.014 764 HB2 ASP 100 2HB ASP 100 17.021 -15.875 10.504 765 HB3 ASP 100 3HB ASP 100 15.376 -15.253 10.595 766 H TYR 101 H TYR 101 14.373 -19.461 10.145 767 HA TYR 101 HA TYR 101 11.722 -18.795 9.520 768 HB2 TYR 101 2HB TYR 101 11.206 -20.929 10.859 769 HB3 TYR 101 3HB TYR 101 12.243 -21.084 9.445 770 HD1 TYR 101 HD2 TYR 101 12.705 -20.266 13.071 771 HD2 TYR 101 HD1 TYR 101 14.003 -22.536 9.715 772 HE1 TYR 101 HE2 TYR 101 14.435 -21.324 14.463 773 HE2 TYR 101 HE1 TYR 101 15.736 -23.601 11.097 774 HH TYR 101 HH TYR 101 16.222 -22.659 14.480 775 H LEU 102 H LEU 102 9.952 -19.370 11.309 776 HA LEU 102 HA LEU 102 10.571 -17.883 13.764 777 HB2 LEU 102 2HB LEU 102 9.468 -16.194 12.697 778 HB3 LEU 102 3HB LEU 102 8.499 -17.297 11.722 779 HG LEU 102 HG LEU 102 7.236 -17.811 13.889 780 HD11 LEU 102 1HD1 LEU 102 7.568 -15.280 15.073 781 HD12 LEU 102 2HD1 LEU 102 9.181 -15.962 14.869 782 HD13 LEU 102 3HD1 LEU 102 7.951 -16.860 15.757 783 HD21 LEU 102 3HD2 LEU 102 5.845 -16.658 12.558 784 HD22 LEU 102 1HD2 LEU 102 7.083 -15.483 12.111 785 HD23 LEU 102 2HD2 LEU 102 6.209 -15.307 13.633 786 HA PRO 103 HA PRO 103 8.658 -21.472 15.538 787 HB2 PRO 103 2HB PRO 103 8.676 -20.595 18.107 788 HB3 PRO 103 3HB PRO 103 10.124 -21.189 17.285 789 HG2 PRO 103 2HG PRO 103 9.232 -18.369 17.749 790 HG3 PRO 103 3HG PRO 103 10.853 -19.071 17.908 791 HD2 PRO 103 2HD PRO 103 10.092 -17.638 15.740 792 HD3 PRO 103 3HD PRO 103 11.254 -18.977 15.641 793 H LYS 104 H LYS 104 6.697 -22.052 16.585 794 HA LYS 104 HA LYS 104 4.676 -19.906 16.632 795 HB2 LYS 104 2HB LYS 104 4.487 -22.752 15.669 796 HB3 LYS 104 3HB LYS 104 3.053 -21.836 16.115 797 HG2 LYS 104 2HG LYS 104 4.553 -20.197 14.385 798 HG3 LYS 104 3HG LYS 104 4.519 -21.810 13.668 799 HD2 LYS 104 2HD LYS 104 2.059 -20.393 14.679 800 HD3 LYS 104 3HD LYS 104 2.622 -20.288 13.009 801 HE2 LYS 104 2HE LYS 104 1.184 -22.036 12.786 802 HE3 LYS 104 3HE LYS 104 2.628 -22.932 13.253 803 HZ1 LYS 104 3HZ LYS 104 0.323 -23.268 14.461 804 HZ2 LYS 104 1HZ LYS 104 0.890 -21.977 15.396 805 HZ3 LYS 104 2HZ LYS 104 1.791 -23.405 15.290 806 HA PRO 105 HA PRO 105 2.606 -19.618 17.244 807 HB2 PRO 105 2HB PRO 105 1.901 -17.894 19.219 808 HB3 PRO 105 3HB PRO 105 1.026 -19.396 18.896 809 HG2 PRO 105 2HG PRO 105 3.096 -18.820 20.980 810 HG3 PRO 105 3HG PRO 105 1.575 -19.719 21.133 811 HD2 PRO 105 2HD PRO 105 3.974 -20.948 20.871 812 HD3 PRO 105 3HD PRO 105 2.472 -21.637 20.223 813 H PHE 106 H PHE 106 2.681 -17.084 17.220 814 HA PHE 106 HA PHE 106 5.312 -16.059 17.959 815 HB2 PHE 106 2HB PHE 106 5.666 -15.151 15.670 816 HB3 PHE 106 3HB PHE 106 5.689 -16.910 15.723 817 HD1 PHE 106 HD1 PHE 106 3.382 -14.061 15.072 818 HD2 PHE 106 HD2 PHE 106 4.408 -18.104 14.222 819 HE1 PHE 106 HE1 PHE 106 1.652 -14.130 13.324 820 HE2 PHE 106 HE2 PHE 106 2.681 -18.178 12.473 821 HZ PHE 106 HZ PHE 106 1.300 -16.190 12.020 822 H ASP 107 H ASP 107 5.452 -13.761 17.956 823 HA ASP 107 HA ASP 107 2.932 -12.495 18.571 824 HB2 ASP 107 2HB ASP 107 5.686 -11.249 18.506 825 HB3 ASP 107 3HB ASP 107 4.255 -10.621 19.319 826 H ILE 108 H ILE 108 1.688 -11.765 16.981 827 HA ILE 108 HA ILE 108 2.271 -11.368 14.355 828 HB ILE 108 HB ILE 108 0.306 -9.895 16.096 829 HG12 ILE 108 2HG1 ILE 108 -0.391 -11.764 13.869 830 HG13 ILE 108 3HG1 ILE 108 0.211 -12.437 15.379 831 HG21 ILE 108 1HG2 ILE 108 0.738 -9.655 13.128 832 HG22 ILE 108 2HG2 ILE 108 -0.761 -9.188 13.930 833 HG23 ILE 108 3HG2 ILE 108 0.747 -8.368 14.334 834 HD11 ILE 108 3HD1 ILE 108 -1.775 -10.543 16.035 835 HD12 ILE 108 1HD1 ILE 108 -2.407 -11.554 14.736 836 HD13 ILE 108 2HD1 ILE 108 -1.821 -12.295 16.225 837 H ASP 109 H ASP 109 2.823 -9.115 17.000 838 HA ASP 109 HA ASP 109 3.427 -6.822 15.526 839 HB2 ASP 109 2HB ASP 109 3.459 -7.558 18.218 840 HB3 ASP 109 3HB ASP 109 5.122 -7.094 17.868 841 H GLU 110 H GLU 110 5.552 -9.446 16.627 842 HA GLU 110 HA GLU 110 7.869 -8.300 15.368 843 HB2 GLU 110 2HB GLU 110 7.456 -10.172 17.363 844 HB3 GLU 110 3HB GLU 110 8.035 -11.142 16.017 845 HG2 GLU 110 2HG GLU 110 10.113 -10.298 16.124 846 HG3 GLU 110 3HG GLU 110 9.550 -8.678 16.532 847 H ALA 111 H ALA 111 5.406 -10.610 14.525 848 HA ALA 111 HA ALA 111 6.753 -11.852 12.364 849 HB1 ALA 111 1HB ALA 111 4.957 -13.152 12.394 850 HB2 ALA 111 2HB ALA 111 4.266 -12.115 13.643 851 HB3 ALA 111 3HB ALA 111 3.920 -11.799 11.943 852 H VAL 112 H VAL 112 4.209 -9.347 12.380 853 HA VAL 112 HA VAL 112 4.117 -8.805 9.681 854 HB VAL 112 HB VAL 112 3.720 -6.989 12.048 855 HG11 VAL 112 1HG1 VAL 112 2.600 -5.455 10.352 856 HG12 VAL 112 2HG1 VAL 112 4.365 -5.463 10.378 857 HG13 VAL 112 3HG1 VAL 112 3.496 -6.345 9.122 858 HG21 VAL 112 3HG2 VAL 112 1.341 -7.147 11.264 859 HG22 VAL 112 1HG2 VAL 112 1.872 -8.371 10.112 860 HG23 VAL 112 2HG2 VAL 112 2.033 -8.661 11.844 861 H ALA 113 H ALA 113 6.482 -7.768 12.048 862 HA ALA 113 HA ALA 113 7.775 -5.941 10.212 863 HB1 ALA 113 1HB ALA 113 9.490 -5.838 12.107 864 HB2 ALA 113 2HB ALA 113 7.872 -5.217 12.433 865 HB3 ALA 113 3HB ALA 113 8.341 -6.810 13.027 866 H LEU 114 H LEU 114 8.122 -9.235 11.282 867 HA LEU 114 HA LEU 114 10.794 -9.665 10.493 868 HB2 LEU 114 2HB LEU 114 9.653 -11.203 11.959 869 HB3 LEU 114 3HB LEU 114 8.470 -11.571 10.706 870 HG LEU 114 HG LEU 114 10.484 -12.457 9.364 871 HD11 LEU 114 1HD1 LEU 114 12.268 -13.365 10.883 872 HD12 LEU 114 2HD1 LEU 114 11.644 -12.292 12.135 873 HD13 LEU 114 3HD1 LEU 114 12.297 -11.618 10.642 874 HD21 LEU 114 3HD2 LEU 114 9.077 -14.142 9.938 875 HD22 LEU 114 1HD2 LEU 114 9.048 -13.689 11.642 876 HD23 LEU 114 2HD2 LEU 114 10.428 -14.572 10.988 877 H VAL 115 H VAL 115 7.728 -9.937 8.765 878 HA VAL 115 HA VAL 115 8.806 -11.079 6.401 879 HB VAL 115 HB VAL 115 6.447 -11.284 6.823 880 HG11 VAL 115 1HG1 VAL 115 6.345 -8.273 6.658 881 HG12 VAL 115 2HG1 VAL 115 4.943 -9.340 6.772 882 HG13 VAL 115 3HG1 VAL 115 6.097 -9.251 8.104 883 HG21 VAL 115 3HG2 VAL 115 6.093 -9.490 4.576 884 HG22 VAL 115 1HG2 VAL 115 7.544 -10.477 4.408 885 HG23 VAL 115 2HG2 VAL 115 5.976 -11.248 4.644 886 H GLU 116 H GLU 116 8.257 -7.770 7.476 887 HA GLU 116 HA GLU 116 8.766 -6.505 5.002 888 HB2 GLU 116 2HB GLU 116 8.190 -5.713 7.684 889 HB3 GLU 116 3HB GLU 116 9.593 -4.809 7.132 890 HG2 GLU 116 2HG GLU 116 8.406 -3.875 5.324 891 HG3 GLU 116 3HG GLU 116 7.068 -5.004 5.523 892 H ARG 117 H ARG 117 10.830 -7.934 7.356 893 HA ARG 117 HA ARG 117 13.202 -6.487 6.732 894 HB2 ARG 117 2HB ARG 117 13.153 -7.573 8.836 895 HB3 ARG 117 3HB ARG 117 12.680 -9.108 8.120 896 HG2 ARG 117 2HG ARG 117 14.793 -9.699 7.705 897 HG3 ARG 117 3HG ARG 117 15.233 -8.087 7.136 898 HD2 ARG 117 2HD ARG 117 15.055 -7.468 9.669 899 HD3 ARG 117 3HD ARG 117 15.271 -9.202 9.905 900 HE ARG 117 HE ARG 117 17.226 -8.070 8.147 901 HH11 ARG 117 1HH1 ARG 117 16.376 -8.580 11.485 902 HH12 ARG 117 2HH1 ARG 117 18.012 -8.503 12.049 903 HH21 ARG 117 1HH2 ARG 117 19.384 -7.966 8.878 904 HH22 ARG 117 2HH2 ARG 117 19.722 -8.152 10.565 905 H ALA 118 H ALA 118 11.616 -9.289 5.397 906 HA ALA 118 HA ALA 118 13.901 -10.069 3.801 907 HB1 ALA 118 1HB ALA 118 11.483 -11.298 4.643 908 HB2 ALA 118 2HB ALA 118 11.534 -11.328 2.879 909 HB3 ALA 118 3HB ALA 118 12.859 -12.025 3.812 910 H ILE 119 H ILE 119 10.969 -8.211 3.426 911 HA ILE 119 HA ILE 119 11.192 -8.074 0.546 912 HB ILE 119 HB ILE 119 9.382 -6.570 2.440 913 HG12 ILE 119 2HG1 ILE 119 8.514 -8.731 0.551 914 HG13 ILE 119 3HG1 ILE 119 9.222 -9.164 2.103 915 HG21 ILE 119 1HG2 ILE 119 9.347 -6.755 -0.569 916 HG22 ILE 119 2HG2 ILE 119 8.084 -6.023 0.418 917 HG23 ILE 119 3HG2 ILE 119 9.701 -5.320 0.392 918 HD11 ILE 119 3HD1 ILE 119 6.925 -7.256 1.922 919 HD12 ILE 119 1HD1 ILE 119 6.679 -9.002 1.931 920 HD13 ILE 119 2HD1 ILE 119 7.468 -8.215 3.299 921 H SER 120 H SER 120 11.440 -5.749 3.236 922 HA SER 120 HA SER 120 12.212 -3.532 1.736 923 HB2 SER 120 2HB SER 120 11.568 -3.689 4.235 924 HB3 SER 120 3HB SER 120 13.274 -4.042 4.507 925 HG SER 120 HG SER 120 13.788 -2.055 3.570 926 H HIS 121 H HIS 121 14.005 -6.330 2.692 927 HA HIS 121 HA HIS 121 16.619 -5.430 2.650 928 HB2 HIS 121 2HB HIS 121 15.827 -7.757 3.206 929 HB3 HIS 121 3HB HIS 121 15.695 -8.056 1.476 930 HD1 HIS 121 HD1 HIS 121 17.800 -8.683 0.251 931 HD2 HIS 121 HD2 HIS 121 18.530 -7.343 4.115 932 HE1 HIS 121 HE1 HIS 121 20.236 -9.145 0.673 933 H TYR 122 H TYR 122 14.407 -5.915 0.008 934 HA TYR 122 HA TYR 122 16.543 -5.443 -1.944 935 HB2 TYR 122 2HB TYR 122 13.666 -6.110 -2.555 936 HB3 TYR 122 3HB TYR 122 15.061 -6.262 -3.617 937 HD1 TYR 122 HD2 TYR 122 16.946 -7.893 -2.709 938 HD2 TYR 122 HD1 TYR 122 12.860 -8.016 -1.530 939 HE1 TYR 122 HE2 TYR 122 17.223 -10.237 -2.018 940 HE2 TYR 122 HE1 TYR 122 13.125 -10.360 -0.834 941 HH TYR 122 HH TYR 122 15.923 -12.203 -1.612 942 H GLN 123 H GLN 123 13.519 -4.109 -0.739 943 HA GLN 123 HA GLN 123 13.838 -1.779 -2.492 944 HB2 GLN 123 2HB GLN 123 11.497 -2.654 -0.792 945 HB3 GLN 123 3HB GLN 123 11.528 -1.207 -1.792 946 HG2 GLN 123 2HG GLN 123 11.721 -2.531 -3.790 947 HG3 GLN 123 3HG GLN 123 11.855 -4.009 -2.838 948 HE21 GLN 123 1HE2 GLN 123 10.038 -4.926 -1.971 949 HE22 GLN 123 2HE2 GLN 123 8.438 -4.401 -2.354 950 H GLU 124 H GLU 124 15.696 -1.958 -0.466 951 HA GLU 124 HA GLU 124 15.106 -0.801 1.973 952 HB2 GLU 124 2HB GLU 124 17.401 -1.591 0.687 953 HB3 GLU 124 3HB GLU 124 17.624 0.149 0.805 954 HG2 GLU 124 2HG GLU 124 16.897 -0.266 3.299 955 HG3 GLU 124 3HG GLU 124 17.470 -1.896 2.952 Start of MODEL 24 1 H1 MET 1 H MET 1 1.012 0.039 2.473 2 HA MET 1 HA MET 1 0.520 0.164 -0.355 3 HB2 MET 1 2HB MET 1 2.138 1.975 -0.161 4 HB3 MET 1 3HB MET 1 3.245 0.923 0.712 5 HG2 MET 1 2HG MET 1 3.787 -0.295 -1.179 6 HG3 MET 1 3HG MET 1 2.331 0.201 -2.037 7 HE1 MET 1 3HE MET 1 3.330 2.803 -4.229 8 HE2 MET 1 1HE MET 1 2.151 1.653 -3.600 9 HE3 MET 1 2HE MET 1 2.268 3.267 -2.899 10 H GLN 2 H GLN 2 0.503 -1.872 -1.024 11 HA GLN 2 HA GLN 2 1.790 -3.925 0.580 12 HB2 GLN 2 2HB GLN 2 0.591 -5.491 -0.958 13 HB3 GLN 2 3HB GLN 2 -0.465 -4.392 -0.081 14 HG2 GLN 2 2HG GLN 2 -1.361 -3.758 -1.994 15 HG3 GLN 2 3HG GLN 2 0.202 -3.120 -2.501 16 HE21 GLN 2 1HE2 GLN 2 0.093 -3.663 -4.619 17 HE22 GLN 2 2HE2 GLN 2 0.044 -5.290 -5.198 18 H ARG 3 H ARG 3 3.860 -2.712 -0.276 19 HA ARG 3 HA ARG 3 4.756 -3.201 -2.901 20 HB2 ARG 3 2HB ARG 3 6.827 -2.382 -2.206 21 HB3 ARG 3 3HB ARG 3 5.698 -1.593 -1.113 22 HG2 ARG 3 2HG ARG 3 7.272 -4.074 -0.455 23 HG3 ARG 3 3HG ARG 3 7.725 -2.434 0.011 24 HD2 ARG 3 2HD ARG 3 5.214 -3.897 0.819 25 HD3 ARG 3 3HD ARG 3 6.608 -3.569 1.848 26 HE ARG 3 HE ARG 3 4.471 -1.790 1.257 27 HH11 ARG 3 1HH1 ARG 3 7.895 -1.907 1.878 28 HH12 ARG 3 2HH1 ARG 3 7.969 -0.292 2.501 29 HH21 ARG 3 1HH2 ARG 3 4.556 0.337 2.076 30 HH22 ARG 3 2HH2 ARG 3 6.069 0.983 2.614 31 H GLY 4 H GLY 4 4.371 -5.284 -0.237 32 HA2 GLY 4 2HA GLY 4 5.744 -7.413 -1.719 33 HA3 GLY 4 3HA GLY 4 6.181 -7.147 -0.038 34 H ILE 5 H ILE 5 4.170 -8.825 -2.119 35 HA ILE 5 HA ILE 5 1.957 -9.175 -0.300 36 HB ILE 5 HB ILE 5 2.665 -10.502 -2.913 37 HG12 ILE 5 2HG1 ILE 5 0.257 -8.809 -2.281 38 HG13 ILE 5 3HG1 ILE 5 1.788 -8.079 -2.750 39 HG21 ILE 5 1HG2 ILE 5 0.329 -11.015 -1.084 40 HG22 ILE 5 2HG2 ILE 5 0.372 -11.498 -2.778 41 HG23 ILE 5 3HG2 ILE 5 1.538 -12.172 -1.640 42 HD11 ILE 5 3HD1 ILE 5 1.333 -10.044 -4.657 43 HD12 ILE 5 1HD1 ILE 5 -0.244 -9.303 -4.380 44 HD13 ILE 5 2HD1 ILE 5 1.131 -8.302 -4.850 45 H VAL 6 H VAL 6 1.546 -10.895 1.011 46 HA VAL 6 HA VAL 6 3.644 -12.959 1.196 47 HB VAL 6 HB VAL 6 2.003 -12.039 3.545 48 HG11 VAL 6 1HG1 VAL 6 3.082 -13.648 4.629 49 HG12 VAL 6 2HG1 VAL 6 3.838 -14.138 3.111 50 HG13 VAL 6 3HG1 VAL 6 4.636 -12.962 4.157 51 HG21 VAL 6 3HG2 VAL 6 3.920 -10.654 4.220 52 HG22 VAL 6 1HG2 VAL 6 4.700 -11.001 2.677 53 HG23 VAL 6 2HG2 VAL 6 3.192 -10.088 2.718 54 H TRP 7 H TRP 7 2.956 -14.958 0.844 55 HA TRP 7 HA TRP 7 0.077 -15.496 0.931 56 HB2 TRP 7 2HB TRP 7 2.382 -16.896 -0.419 57 HB3 TRP 7 3HB TRP 7 0.783 -17.624 -0.295 58 HD1 TRP 7 HD1 TRP 7 0.018 -14.147 -0.743 59 HE1 TRP 7 HE1 TRP 7 -0.398 -13.554 -3.213 60 HE3 TRP 7 HE3 TRP 7 2.023 -18.312 -2.927 61 HZ2 TRP 7 HZ2 TRP 7 0.062 -14.700 -5.751 62 HZ3 TRP 7 HZ3 TRP 7 1.995 -18.486 -5.381 63 HH2 TRP 7 HH2 TRP 7 1.034 -16.717 -6.762 64 H VAL 8 H VAL 8 -0.806 -16.764 2.437 65 HA VAL 8 HA VAL 8 1.002 -18.165 4.286 66 HB VAL 8 HB VAL 8 -1.872 -17.338 4.723 67 HG11 VAL 8 1HG1 VAL 8 0.125 -18.815 6.378 68 HG12 VAL 8 2HG1 VAL 8 -1.070 -17.784 7.168 69 HG13 VAL 8 3HG1 VAL 8 -1.596 -19.125 6.150 70 HG21 VAL 8 3HG2 VAL 8 0.578 -16.147 6.000 71 HG22 VAL 8 1HG2 VAL 8 -0.154 -15.486 4.538 72 HG23 VAL 8 2HG2 VAL 8 -1.078 -15.542 6.039 73 H VAL 9 H VAL 9 0.597 -20.294 4.905 74 HA VAL 9 HA VAL 9 -1.619 -21.768 3.806 75 HB VAL 9 HB VAL 9 0.020 -21.653 1.903 76 HG11 VAL 9 1HG1 VAL 9 2.149 -22.341 2.072 77 HG12 VAL 9 2HG1 VAL 9 1.911 -22.113 3.806 78 HG13 VAL 9 3HG1 VAL 9 1.728 -23.716 3.092 79 HG21 VAL 9 3HG2 VAL 9 0.084 -24.467 2.209 80 HG22 VAL 9 1HG2 VAL 9 -1.398 -23.881 2.965 81 HG23 VAL 9 2HG2 VAL 9 -1.055 -23.494 1.279 82 H ASP 10 H ASP 10 -1.945 -23.731 4.822 83 HA ASP 10 HA ASP 10 -0.021 -25.088 6.372 84 HB2 ASP 10 2HB ASP 10 -0.084 -23.322 7.950 85 HB3 ASP 10 3HB ASP 10 -1.837 -23.182 7.839 86 H ASP 11 H ASP 11 -3.292 -24.501 7.520 87 HA ASP 11 HA ASP 11 -4.744 -26.371 6.136 88 HB2 ASP 11 2HB ASP 11 -3.444 -28.211 6.691 89 HB3 ASP 11 3HB ASP 11 -3.062 -27.587 8.293 90 H ASP 12 H ASP 12 -4.027 -24.912 9.220 91 HA ASP 12 HA ASP 12 -6.798 -25.186 10.103 92 HB2 ASP 12 2HB ASP 12 -4.214 -24.649 11.408 93 HB3 ASP 12 3HB ASP 12 -5.562 -23.708 12.042 94 H SER 13 H SER 13 -8.071 -23.372 10.703 95 HA SER 13 HA SER 13 -7.792 -21.160 8.899 96 HB2 SER 13 2HB SER 13 -10.013 -21.105 9.179 97 HB3 SER 13 3HB SER 13 -9.888 -22.334 10.438 98 HG SER 13 HG SER 13 -10.389 -20.831 11.800 99 H SER 14 H SER 14 -7.796 -21.481 12.446 100 HA SER 14 HA SER 14 -7.267 -18.796 13.033 101 HB2 SER 14 2HB SER 14 -6.278 -19.818 15.202 102 HB3 SER 14 3HB SER 14 -7.986 -20.087 14.853 103 HG SER 14 HG SER 14 -5.830 -21.875 14.716 104 H ILE 15 H ILE 15 -5.234 -21.260 11.786 105 HA ILE 15 HA ILE 15 -2.751 -20.082 12.641 106 HB ILE 15 HB ILE 15 -3.356 -22.252 10.636 107 HG12 ILE 15 2HG1 ILE 15 -3.770 -22.882 12.955 108 HG13 ILE 15 3HG1 ILE 15 -2.340 -23.712 12.353 109 HG21 ILE 15 1HG2 ILE 15 -1.361 -21.500 9.795 110 HG22 ILE 15 2HG2 ILE 15 -0.802 -20.904 11.356 111 HG23 ILE 15 3HG2 ILE 15 -0.784 -22.634 11.016 112 HD11 ILE 15 3HD1 ILE 15 -1.223 -22.961 14.101 113 HD12 ILE 15 1HD1 ILE 15 -1.443 -21.315 13.506 114 HD13 ILE 15 2HD1 ILE 15 -2.616 -22.013 14.623 115 H ARG 16 H ARG 16 -4.682 -20.139 9.684 116 HA ARG 16 HA ARG 16 -2.756 -18.571 8.213 117 HB2 ARG 16 2HB ARG 16 -4.478 -18.583 6.429 118 HB3 ARG 16 3HB ARG 16 -4.075 -20.196 7.003 119 HG2 ARG 16 2HG ARG 16 -6.101 -20.367 8.220 120 HG3 ARG 16 3HG ARG 16 -6.458 -18.654 7.988 121 HD2 ARG 16 2HD ARG 16 -6.561 -19.100 5.527 122 HD3 ARG 16 3HD ARG 16 -6.425 -20.819 5.893 123 HE ARG 16 HE ARG 16 -8.615 -20.819 6.581 124 HH11 ARG 16 1HH1 ARG 16 -7.501 -17.538 6.247 125 HH12 ARG 16 2HH1 ARG 16 -9.077 -16.845 6.443 126 HH21 ARG 16 1HH2 ARG 16 -10.695 -19.919 6.840 127 HH22 ARG 16 2HH2 ARG 16 -10.893 -18.200 6.781 128 H TRP 17 H TRP 17 -5.700 -18.025 10.015 129 HA TRP 17 HA TRP 17 -6.326 -15.455 9.078 130 HB2 TRP 17 2HB TRP 17 -8.006 -16.496 10.338 131 HB3 TRP 17 3HB TRP 17 -6.896 -16.919 11.639 132 HD1 TRP 17 HD1 TRP 17 -8.814 -13.892 10.229 133 HE1 TRP 17 HE1 TRP 17 -9.058 -12.146 12.104 134 HE3 TRP 17 HE3 TRP 17 -5.935 -16.137 13.808 135 HZ2 TRP 17 HZ2 TRP 17 -8.150 -11.770 14.750 136 HZ3 TRP 17 HZ3 TRP 17 -5.673 -15.018 15.984 137 HH2 TRP 17 HH2 TRP 17 -6.758 -12.879 16.443 138 H VAL 18 H VAL 18 -4.503 -16.423 11.986 139 HA VAL 18 HA VAL 18 -3.827 -13.970 12.990 140 HB VAL 18 HB VAL 18 -1.646 -15.062 13.729 141 HG11 VAL 18 1HG1 VAL 18 -3.797 -15.024 15.016 142 HG12 VAL 18 2HG1 VAL 18 -4.142 -16.626 14.360 143 HG13 VAL 18 3HG1 VAL 18 -2.732 -16.379 15.391 144 HG21 VAL 18 3HG2 VAL 18 -1.486 -17.486 13.418 145 HG22 VAL 18 1HG2 VAL 18 -2.909 -17.446 12.377 146 HG23 VAL 18 2HG2 VAL 18 -1.426 -16.634 11.875 147 H LEU 19 H LEU 19 -2.336 -15.665 10.281 148 HA LEU 19 HA LEU 19 -0.308 -13.640 9.926 149 HB2 LEU 19 2HB LEU 19 -1.080 -16.135 8.461 150 HB3 LEU 19 3HB LEU 19 0.045 -14.983 7.745 151 HG LEU 19 HG LEU 19 0.483 -16.310 10.416 152 HD11 LEU 19 1HD1 LEU 19 2.300 -17.473 8.864 153 HD12 LEU 19 2HD1 LEU 19 1.041 -17.225 7.655 154 HD13 LEU 19 3HD1 LEU 19 0.692 -18.155 9.112 155 HD21 LEU 19 3HD2 LEU 19 2.237 -14.683 8.584 156 HD22 LEU 19 1HD2 LEU 19 2.836 -15.609 9.961 157 HD23 LEU 19 2HD2 LEU 19 1.714 -14.273 10.219 158 H GLU 20 H GLU 20 -3.451 -14.410 8.629 159 HA GLU 20 HA GLU 20 -3.287 -12.762 6.317 160 HB2 GLU 20 2HB GLU 20 -5.083 -14.622 7.283 161 HB3 GLU 20 3HB GLU 20 -5.968 -13.110 7.432 162 HG2 GLU 20 2HG GLU 20 -4.571 -13.711 4.875 163 HG3 GLU 20 3HG GLU 20 -6.084 -14.537 5.242 164 H ARG 21 H ARG 21 -4.338 -12.241 9.634 165 HA ARG 21 HA ARG 21 -5.317 -9.582 9.101 166 HB2 ARG 21 2HB ARG 21 -5.729 -9.459 11.490 167 HB3 ARG 21 3HB ARG 21 -6.311 -10.996 10.863 168 HG2 ARG 21 2HG ARG 21 -4.600 -12.200 11.876 169 HG3 ARG 21 3HG ARG 21 -3.590 -10.768 12.086 170 HD2 ARG 21 2HD ARG 21 -6.203 -10.668 13.430 171 HD3 ARG 21 3HD ARG 21 -5.092 -11.892 14.044 172 HE ARG 21 HE ARG 21 -3.560 -9.665 13.928 173 HH11 ARG 21 1HH1 ARG 21 -6.662 -10.370 15.344 174 HH12 ARG 21 2HH1 ARG 21 -6.480 -9.224 16.631 175 HH21 ARG 21 1HH2 ARG 21 -3.310 -8.154 15.619 176 HH22 ARG 21 2HH2 ARG 21 -4.574 -7.964 16.786 177 H ALA 22 H ALA 22 -2.321 -11.041 9.982 178 HA ALA 22 HA ALA 22 -1.004 -9.060 11.371 179 HB1 ALA 22 1HB ALA 22 0.342 -10.867 11.207 180 HB2 ALA 22 2HB ALA 22 -0.172 -11.238 9.561 181 HB3 ALA 22 3HB ALA 22 1.011 -9.963 9.848 182 H LEU 23 H LEU 23 -1.127 -9.441 7.827 183 HA LEU 23 HA LEU 23 0.128 -6.883 7.404 184 HB2 LEU 23 2HB LEU 23 -1.282 -8.461 5.286 185 HB3 LEU 23 3HB LEU 23 0.111 -7.393 5.130 186 HG LEU 23 HG LEU 23 0.205 -10.057 6.535 187 HD11 LEU 23 1HD1 LEU 23 1.503 -9.797 3.922 188 HD12 LEU 23 2HD1 LEU 23 -0.259 -9.772 3.872 189 HD13 LEU 23 3HD1 LEU 23 0.582 -11.136 4.608 190 HD21 LEU 23 3HD2 LEU 23 2.673 -9.180 5.421 191 HD22 LEU 23 1HD2 LEU 23 2.258 -9.455 7.113 192 HD23 LEU 23 2HD2 LEU 23 1.993 -7.869 6.387 193 H ALA 24 H ALA 24 -3.108 -8.151 7.527 194 HA ALA 24 HA ALA 24 -4.564 -6.296 6.110 195 HB1 ALA 24 1HB ALA 24 -6.416 -6.766 7.684 196 HB2 ALA 24 2HB ALA 24 -5.612 -8.224 7.100 197 HB3 ALA 24 3HB ALA 24 -5.275 -7.621 8.723 198 H GLY 25 H GLY 25 -3.181 -5.991 9.344 199 HA2 GLY 25 2HA GLY 25 -4.370 -3.369 9.730 200 HA3 GLY 25 3HA GLY 25 -3.323 -4.218 10.857 201 H ALA 26 H ALA 26 -1.473 -4.654 8.426 202 HA ALA 26 HA ALA 26 0.065 -2.231 8.876 203 HB1 ALA 26 1HB ALA 26 1.247 -4.324 9.017 204 HB2 ALA 26 2HB ALA 26 0.730 -4.768 7.390 205 HB3 ALA 26 3HB ALA 26 1.840 -3.418 7.625 206 H GLY 27 H GLY 27 -0.310 -4.089 5.868 207 HA2 GLY 27 2HA GLY 27 -1.798 -2.471 4.297 208 HA3 GLY 27 3HA GLY 27 -0.251 -1.639 4.332 209 H LEU 28 H LEU 28 -0.780 -5.130 4.355 210 HA LEU 28 HA LEU 28 0.281 -5.276 1.620 211 HB2 LEU 28 2HB LEU 28 1.153 -7.409 3.444 212 HB3 LEU 28 3HB LEU 28 2.030 -6.591 2.152 213 HG LEU 28 HG LEU 28 1.554 -5.405 4.883 214 HD11 LEU 28 1HD1 LEU 28 3.344 -6.456 5.688 215 HD12 LEU 28 2HD1 LEU 28 4.277 -6.166 4.220 216 HD13 LEU 28 3HD1 LEU 28 3.188 -7.550 4.313 217 HD21 LEU 28 3HD2 LEU 28 2.221 -3.537 3.876 218 HD22 LEU 28 1HD2 LEU 28 2.609 -4.398 2.387 219 HD23 LEU 28 2HD2 LEU 28 3.801 -4.296 3.683 220 H THR 29 H THR 29 -0.601 -6.831 0.346 221 HA THR 29 HA THR 29 -3.069 -7.984 1.138 222 HB THR 29 HB THR 29 -1.458 -8.827 -1.269 223 HG1 THR 29 HG1 THR 29 -3.033 -6.498 -0.848 224 HG21 THR 29 3HG2 THR 29 -4.247 -9.124 -0.350 225 HG22 THR 29 1HG2 THR 29 -3.282 -10.162 -1.399 226 HG23 THR 29 2HG2 THR 29 -4.040 -8.709 -2.051 227 H CYS 30 H CYS 30 -3.621 -10.231 1.230 228 HA CYS 30 HA CYS 30 -1.420 -12.105 1.649 229 HB2 CYS 30 2HB CYS 30 -2.417 -10.906 3.831 230 HB3 CYS 30 3HB CYS 30 -3.592 -12.206 3.674 231 HG CYS 30 HG CYS 30 -0.522 -13.388 3.370 232 H THR 31 H THR 31 -1.865 -14.132 0.976 233 HA THR 31 HA THR 31 -4.658 -14.756 0.271 234 HB THR 31 HB THR 31 -2.188 -15.414 -1.345 235 HG1 THR 31 HG1 THR 31 -2.696 -13.538 -2.186 236 HG21 THR 31 3HG2 THR 31 -3.728 -16.448 -2.942 237 HG22 THR 31 1HG2 THR 31 -5.077 -16.142 -1.850 238 HG23 THR 31 2HG2 THR 31 -3.798 -17.262 -1.380 239 H THR 32 H THR 32 -5.338 -16.369 1.509 240 HA THR 32 HA THR 32 -3.413 -18.392 2.415 241 HB THR 32 HB THR 32 -4.884 -18.915 4.199 242 HG1 THR 32 HG1 THR 32 -6.892 -18.939 3.311 243 HG21 THR 32 3HG2 THR 32 -5.283 -15.950 3.987 244 HG22 THR 32 1HG2 THR 32 -3.671 -16.630 4.201 245 HG23 THR 32 2HG2 THR 32 -4.919 -16.923 5.412 246 H PHE 33 H PHE 33 -3.472 -20.401 1.642 247 HA PHE 33 HA PHE 33 -5.705 -21.147 -0.108 248 HB2 PHE 33 2HB PHE 33 -2.914 -22.287 0.141 249 HB3 PHE 33 3HB PHE 33 -4.152 -22.912 -0.945 250 HD1 PHE 33 HD1 PHE 33 -1.994 -20.015 -0.215 251 HD2 PHE 33 HD2 PHE 33 -4.621 -21.859 -3.011 252 HE1 PHE 33 HE1 PHE 33 -1.290 -18.403 -1.935 253 HE2 PHE 33 HE2 PHE 33 -3.920 -20.251 -4.735 254 HZ PHE 33 HZ PHE 33 -2.252 -18.520 -4.199 255 H GLU 34 H GLU 34 -3.550 -23.457 1.380 256 HA GLU 34 HA GLU 34 -5.000 -24.235 3.601 257 HB2 GLU 34 2HB GLU 34 -6.109 -26.324 2.598 258 HB3 GLU 34 3HB GLU 34 -6.911 -24.778 2.362 259 HG2 GLU 34 2HG GLU 34 -5.897 -24.641 0.112 260 HG3 GLU 34 3HG GLU 34 -5.221 -26.251 0.356 261 H ASN 35 H ASN 35 -3.420 -25.630 0.737 262 HA ASN 35 HA ASN 35 -1.608 -27.071 2.555 263 HB2 ASN 35 2HB ASN 35 -3.465 -28.243 0.796 264 HB3 ASN 35 3HB ASN 35 -1.892 -28.440 0.030 265 HD21 ASN 35 1HD2 ASN 35 -3.783 -29.104 2.895 266 HD22 ASN 35 2HD2 ASN 35 -2.813 -30.416 3.464 267 H GLY 36 H GLY 36 0.445 -27.752 1.432 268 HA2 GLY 36 2HA GLY 36 1.673 -25.475 0.270 269 HA3 GLY 36 3HA GLY 36 2.398 -27.067 0.433 270 H ASN 37 H ASN 37 0.530 -28.532 -1.096 271 HA ASN 37 HA ASN 37 1.593 -28.245 -3.662 272 HB2 ASN 37 2HB ASN 37 -0.460 -29.886 -2.375 273 HB3 ASN 37 3HB ASN 37 -0.802 -29.560 -4.072 274 HD21 ASN 37 1HD2 ASN 37 -0.137 -32.073 -2.852 275 HD22 ASN 37 2HD2 ASN 37 1.315 -32.628 -3.607 276 H GLU 38 H GLU 38 -0.961 -26.564 -2.115 277 HA GLU 38 HA GLU 38 -2.159 -25.674 -4.615 278 HB2 GLU 38 2HB GLU 38 -2.956 -24.444 -2.036 279 HB3 GLU 38 3HB GLU 38 -3.950 -24.971 -3.386 280 HG2 GLU 38 2HG GLU 38 -2.699 -26.713 -1.278 281 HG3 GLU 38 3HG GLU 38 -4.411 -26.338 -1.471 282 H VAL 39 H VAL 39 0.312 -24.731 -2.498 283 HA VAL 39 HA VAL 39 0.127 -21.896 -3.119 284 HB VAL 39 HB VAL 39 2.218 -23.410 -1.548 285 HG11 VAL 39 1HG1 VAL 39 2.262 -20.792 -2.636 286 HG12 VAL 39 2HG1 VAL 39 2.089 -20.649 -0.885 287 HG13 VAL 39 3HG1 VAL 39 3.439 -21.557 -1.568 288 HG21 VAL 39 3HG2 VAL 39 0.370 -21.529 -0.224 289 HG22 VAL 39 1HG2 VAL 39 -0.337 -23.040 -0.795 290 HG23 VAL 39 2HG2 VAL 39 1.016 -23.071 0.336 291 H LEU 40 H LEU 40 2.383 -24.584 -3.696 292 HA LEU 40 HA LEU 40 4.326 -23.272 -5.142 293 HB2 LEU 40 2HB LEU 40 4.877 -25.447 -4.705 294 HB3 LEU 40 3HB LEU 40 3.274 -26.049 -5.121 295 HG LEU 40 HG LEU 40 3.801 -25.791 -7.501 296 HD11 LEU 40 1HD1 LEU 40 5.715 -24.026 -6.679 297 HD12 LEU 40 2HD1 LEU 40 5.600 -24.727 -8.293 298 HD13 LEU 40 3HD1 LEU 40 6.674 -25.448 -7.094 299 HD21 LEU 40 3HD2 LEU 40 4.636 -27.855 -7.509 300 HD22 LEU 40 1HD2 LEU 40 4.745 -27.723 -5.754 301 HD23 LEU 40 2HD2 LEU 40 6.142 -27.329 -6.755 302 H ALA 41 H ALA 41 1.293 -24.671 -6.337 303 HA ALA 41 HA ALA 41 1.729 -24.027 -9.060 304 HB1 ALA 41 1HB ALA 41 -0.898 -24.458 -7.642 305 HB2 ALA 41 2HB ALA 41 -0.613 -24.548 -9.380 306 HB3 ALA 41 3HB ALA 41 0.123 -25.735 -8.304 307 H ALA 42 H ALA 42 0.393 -22.259 -6.355 308 HA ALA 42 HA ALA 42 -0.936 -20.223 -7.752 309 HB1 ALA 42 1HB ALA 42 -0.841 -18.956 -5.703 310 HB2 ALA 42 2HB ALA 42 -1.168 -20.649 -5.328 311 HB3 ALA 42 3HB ALA 42 0.449 -19.989 -5.085 312 H LEU 43 H LEU 43 2.445 -20.646 -6.900 313 HA LEU 43 HA LEU 43 3.413 -18.086 -7.338 314 HB2 LEU 43 2HB LEU 43 4.863 -20.581 -8.177 315 HB3 LEU 43 3HB LEU 43 5.554 -19.057 -7.626 316 HG LEU 43 HG LEU 43 4.024 -21.014 -5.912 317 HD11 LEU 43 1HD1 LEU 43 6.352 -21.659 -6.745 318 HD12 LEU 43 2HD1 LEU 43 6.066 -21.700 -5.005 319 HD13 LEU 43 3HD1 LEU 43 6.943 -20.349 -5.723 320 HD21 LEU 43 3HD2 LEU 43 3.984 -18.465 -5.408 321 HD22 LEU 43 1HD2 LEU 43 5.654 -18.720 -4.903 322 HD23 LEU 43 2HD2 LEU 43 4.350 -19.603 -4.110 323 H ALA 44 H ALA 44 2.900 -20.703 -9.678 324 HA ALA 44 HA ALA 44 3.959 -19.516 -11.942 325 HB1 ALA 44 1HB ALA 44 1.740 -21.482 -11.531 326 HB2 ALA 44 2HB ALA 44 2.129 -20.891 -13.147 327 HB3 ALA 44 3HB ALA 44 3.352 -21.739 -12.201 328 H SER 45 H SER 45 1.088 -18.722 -10.203 329 HA SER 45 HA SER 45 -0.113 -17.246 -12.384 330 HB2 SER 45 2HB SER 45 -0.929 -17.156 -9.478 331 HB3 SER 45 3HB SER 45 -1.917 -16.798 -10.894 332 HG SER 45 HG SER 45 -1.088 -19.275 -9.873 333 H LYS 46 H LYS 46 1.779 -16.593 -9.503 334 HA LYS 46 HA LYS 46 2.806 -14.173 -10.439 335 HB2 LYS 46 2HB LYS 46 1.642 -12.630 -8.798 336 HB3 LYS 46 3HB LYS 46 0.687 -13.144 -10.183 337 HG2 LYS 46 2HG LYS 46 -0.720 -14.420 -8.919 338 HG3 LYS 46 3HG LYS 46 0.497 -14.731 -7.678 339 HD2 LYS 46 2HD LYS 46 -0.854 -12.072 -8.137 340 HD3 LYS 46 3HD LYS 46 -1.333 -13.246 -6.908 341 HE2 LYS 46 2HE LYS 46 0.082 -12.147 -5.567 342 HE3 LYS 46 3HE LYS 46 1.354 -12.985 -6.454 343 HZ1 LYS 46 3HZ LYS 46 0.511 -10.197 -6.605 344 HZ2 LYS 46 1HZ LYS 46 0.998 -10.925 -8.052 345 HZ3 LYS 46 2HZ LYS 46 2.058 -10.869 -6.736 346 H THR 47 H THR 47 4.675 -15.131 -9.623 347 HA THR 47 HA THR 47 5.164 -16.243 -7.183 348 HB THR 47 HB THR 47 7.261 -14.350 -8.058 349 HG1 THR 47 HG1 THR 47 6.878 -14.821 -10.102 350 HG21 THR 47 3HG2 THR 47 7.230 -17.338 -7.617 351 HG22 THR 47 1HG2 THR 47 7.662 -16.131 -6.407 352 HG23 THR 47 2HG2 THR 47 8.662 -16.335 -7.845 353 HA PRO 48 HA PRO 48 4.184 -12.894 -4.396 354 HB2 PRO 48 2HB PRO 48 4.687 -14.290 -2.123 355 HB3 PRO 48 3HB PRO 48 3.204 -14.489 -3.064 356 HG2 PRO 48 2HG PRO 48 5.675 -16.178 -3.042 357 HG3 PRO 48 3HG PRO 48 3.975 -16.683 -3.053 358 HD2 PRO 48 2HD PRO 48 5.505 -16.670 -5.287 359 HD3 PRO 48 3HD PRO 48 3.760 -16.348 -5.324 360 H ASP 49 H ASP 49 5.361 -12.199 -2.211 361 HA ASP 49 HA ASP 49 8.165 -11.773 -2.954 362 HB2 ASP 49 2HB ASP 49 6.223 -9.998 -2.133 363 HB3 ASP 49 3HB ASP 49 7.148 -10.266 -0.658 364 H VAL 50 H VAL 50 6.198 -13.432 -0.707 365 HA VAL 50 HA VAL 50 8.338 -14.826 0.453 366 HB VAL 50 HB VAL 50 8.834 -12.744 1.616 367 HG11 VAL 50 1HG1 VAL 50 6.415 -12.747 3.271 368 HG12 VAL 50 2HG1 VAL 50 7.310 -11.398 2.568 369 HG13 VAL 50 3HG1 VAL 50 6.149 -12.294 1.588 370 HG21 VAL 50 3HG2 VAL 50 7.686 -14.168 3.887 371 HG22 VAL 50 1HG2 VAL 50 8.545 -15.222 2.764 372 HG23 VAL 50 2HG2 VAL 50 9.373 -13.844 3.488 373 H LEU 51 H LEU 51 7.607 -16.638 1.437 374 HA LEU 51 HA LEU 51 4.698 -16.849 1.823 375 HB2 LEU 51 2HB LEU 51 6.582 -18.490 0.482 376 HB3 LEU 51 3HB LEU 51 5.973 -19.394 1.868 377 HG LEU 51 HG LEU 51 3.878 -18.106 0.278 378 HD11 LEU 51 1HD1 LEU 51 5.756 -18.875 -1.362 379 HD12 LEU 51 2HD1 LEU 51 4.070 -19.272 -1.693 380 HD13 LEU 51 3HD1 LEU 51 5.142 -20.488 -0.998 381 HD21 LEU 51 3HD2 LEU 51 3.794 -20.981 0.546 382 HD22 LEU 51 1HD2 LEU 51 2.696 -19.757 1.184 383 HD23 LEU 51 2HD2 LEU 51 4.143 -20.201 2.090 384 H LEU 52 H LEU 52 3.940 -18.211 3.589 385 HA LEU 52 HA LEU 52 5.827 -18.562 5.797 386 HB2 LEU 52 2HB LEU 52 3.421 -16.803 5.774 387 HB3 LEU 52 3HB LEU 52 3.840 -17.654 7.259 388 HG LEU 52 HG LEU 52 6.132 -16.572 7.055 389 HD11 LEU 52 1HD1 LEU 52 6.575 -15.436 5.204 390 HD12 LEU 52 2HD1 LEU 52 5.368 -14.248 5.694 391 HD13 LEU 52 3HD1 LEU 52 4.908 -15.593 4.650 392 HD21 LEU 52 3HD2 LEU 52 5.427 -14.623 8.201 393 HD22 LEU 52 1HD2 LEU 52 4.259 -15.885 8.597 394 HD23 LEU 52 2HD2 LEU 52 3.848 -14.644 7.413 395 H SER 53 H SER 53 5.596 -20.798 5.334 396 HA SER 53 HA SER 53 2.976 -22.013 5.594 397 HB2 SER 53 2HB SER 53 4.798 -22.799 3.983 398 HB3 SER 53 3HB SER 53 5.615 -23.465 5.396 399 HG SER 53 HG SER 53 4.223 -25.041 5.442 400 H ASP 54 H ASP 54 2.372 -23.473 7.213 401 HA ASP 54 HA ASP 54 3.814 -23.100 9.744 402 HB2 ASP 54 2HB ASP 54 1.210 -22.652 9.263 403 HB3 ASP 54 3HB ASP 54 1.121 -24.354 9.710 404 H ILE 55 H ILE 55 3.235 -25.381 7.323 405 HA ILE 55 HA ILE 55 3.573 -27.628 7.131 406 HB ILE 55 HB ILE 55 5.501 -27.266 9.423 407 HG12 ILE 55 2HG1 ILE 55 6.000 -26.815 6.473 408 HG13 ILE 55 3HG1 ILE 55 5.825 -25.535 7.668 409 HG21 ILE 55 1HG2 ILE 55 5.306 -29.550 8.940 410 HG22 ILE 55 2HG2 ILE 55 5.226 -29.265 7.203 411 HG23 ILE 55 3HG2 ILE 55 6.746 -29.032 8.064 412 HD11 ILE 55 3HD1 ILE 55 8.101 -25.704 7.494 413 HD12 ILE 55 1HD1 ILE 55 7.780 -26.771 8.861 414 HD13 ILE 55 2HD1 ILE 55 8.063 -27.452 7.258 415 H ARG 56 H ARG 56 1.523 -28.315 7.816 416 HA ARG 56 HA ARG 56 1.568 -29.819 10.301 417 HB2 ARG 56 2HB ARG 56 0.456 -27.335 10.390 418 HB3 ARG 56 3HB ARG 56 -0.939 -28.309 9.946 419 HG2 ARG 56 2HG ARG 56 -1.189 -28.917 12.055 420 HG3 ARG 56 3HG ARG 56 0.418 -29.647 12.042 421 HD2 ARG 56 2HD ARG 56 1.362 -27.903 13.120 422 HD3 ARG 56 3HD ARG 56 0.358 -26.715 12.290 423 HE ARG 56 HE ARG 56 -1.071 -26.761 14.067 424 HH11 ARG 56 1HH1 ARG 56 0.879 -29.644 14.130 425 HH12 ARG 56 2HH1 ARG 56 0.267 -30.181 15.659 426 HH21 ARG 56 1HH2 ARG 56 -1.885 -27.458 16.081 427 HH22 ARG 56 2HH2 ARG 56 -1.306 -28.938 16.767 428 H MET 57 H MET 57 1.668 -30.723 7.671 429 HA MET 57 HA MET 57 -1.026 -31.840 7.257 430 HB2 MET 57 2HB MET 57 1.109 -31.936 5.160 431 HB3 MET 57 3HB MET 57 -0.639 -31.942 4.968 432 HG2 MET 57 2HG MET 57 -0.224 -29.829 4.288 433 HG3 MET 57 3HG MET 57 -0.385 -29.524 6.016 434 HE1 MET 57 3HE MET 57 0.637 -27.812 3.944 435 HE2 MET 57 1HE MET 57 1.860 -26.984 4.909 436 HE3 MET 57 2HE MET 57 2.333 -27.880 3.465 437 HA PRO 58 HA PRO 58 0.423 -35.878 8.191 438 HB2 PRO 58 2HB PRO 58 -1.103 -37.382 6.523 439 HB3 PRO 58 3HB PRO 58 -1.752 -36.581 7.960 440 HG2 PRO 58 2HG PRO 58 -1.865 -35.717 5.096 441 HG3 PRO 58 3HG PRO 58 -3.139 -35.674 6.328 442 HD2 PRO 58 2HD PRO 58 -1.707 -33.483 5.637 443 HD3 PRO 58 3HD PRO 58 -2.327 -33.738 7.280 444 H GLY 59 H GLY 59 -0.019 -35.442 4.670 445 HA2 GLY 59 2HA GLY 59 2.031 -37.350 4.039 446 HA3 GLY 59 3HA GLY 59 1.193 -36.304 2.902 447 H MET 60 H MET 60 1.894 -34.034 2.807 448 HA MET 60 HA MET 60 4.746 -33.886 2.676 449 HB2 MET 60 2HB MET 60 2.667 -31.725 2.289 450 HB3 MET 60 3HB MET 60 4.369 -31.591 1.865 451 HG2 MET 60 2HG MET 60 3.940 -32.437 -0.126 452 HG3 MET 60 3HG MET 60 3.368 -33.924 0.626 453 HE1 MET 60 3HE MET 60 2.313 -30.231 -0.024 454 HE2 MET 60 1HE MET 60 2.388 -30.979 -1.620 455 HE3 MET 60 2HE MET 60 0.837 -30.453 -0.966 456 H ASP 61 H ASP 61 6.059 -33.409 4.298 457 HA ASP 61 HA ASP 61 4.999 -32.149 6.700 458 HB2 ASP 61 2HB ASP 61 7.811 -33.151 6.250 459 HB3 ASP 61 3HB ASP 61 7.005 -32.855 7.788 460 H GLY 62 H GLY 62 5.160 -30.483 4.413 461 HA2 GLY 62 2HA GLY 62 5.670 -28.225 4.167 462 HA3 GLY 62 3HA GLY 62 6.777 -28.355 5.526 463 H LEU 63 H LEU 63 8.560 -30.217 4.788 464 HA LEU 63 HA LEU 63 10.320 -28.866 3.124 465 HB2 LEU 63 2HB LEU 63 10.148 -31.735 3.979 466 HB3 LEU 63 3HB LEU 63 11.436 -31.170 2.917 467 HG LEU 63 HG LEU 63 12.065 -29.530 4.712 468 HD11 LEU 63 1HD1 LEU 63 10.315 -29.246 6.145 469 HD12 LEU 63 2HD1 LEU 63 11.224 -30.470 7.030 470 HD13 LEU 63 3HD1 LEU 63 9.825 -30.938 6.064 471 HD21 LEU 63 3HD2 LEU 63 12.253 -32.230 5.924 472 HD22 LEU 63 1HD2 LEU 63 13.507 -31.021 5.642 473 HD23 LEU 63 2HD2 LEU 63 12.920 -32.011 4.306 474 H ALA 64 H ALA 64 7.818 -31.170 2.344 475 HA ALA 64 HA ALA 64 8.487 -32.100 -0.126 476 HB1 ALA 64 1HB ALA 64 6.243 -32.519 -0.500 477 HB2 ALA 64 2HB ALA 64 6.315 -32.394 1.258 478 HB3 ALA 64 3HB ALA 64 5.725 -31.035 0.301 479 H LEU 65 H LEU 65 6.712 -29.050 0.424 480 HA LEU 65 HA LEU 65 7.303 -28.207 -2.296 481 HB2 LEU 65 2HB LEU 65 5.859 -26.293 -1.779 482 HB3 LEU 65 3HB LEU 65 5.065 -27.838 -1.482 483 HG LEU 65 HG LEU 65 6.358 -26.397 0.792 484 HD11 LEU 65 1HD1 LEU 65 3.832 -25.538 1.025 485 HD12 LEU 65 2HD1 LEU 65 3.991 -25.508 -0.731 486 HD13 LEU 65 3HD1 LEU 65 5.112 -24.587 0.272 487 HD21 LEU 65 3HD2 LEU 65 4.489 -28.601 0.365 488 HD22 LEU 65 1HD2 LEU 65 3.965 -27.453 1.598 489 HD23 LEU 65 2HD2 LEU 65 5.534 -28.247 1.742 490 H LEU 66 H LEU 66 8.105 -27.333 1.019 491 HA LEU 66 HA LEU 66 9.408 -24.919 0.582 492 HB2 LEU 66 2HB LEU 66 9.612 -27.068 2.626 493 HB3 LEU 66 3HB LEU 66 10.869 -25.833 2.590 494 HG LEU 66 HG LEU 66 8.015 -24.974 2.673 495 HD11 LEU 66 1HD1 LEU 66 8.287 -25.004 5.215 496 HD12 LEU 66 2HD1 LEU 66 9.552 -26.200 4.938 497 HD13 LEU 66 3HD1 LEU 66 7.901 -26.527 4.414 498 HD21 LEU 66 3HD2 LEU 66 9.257 -23.311 4.276 499 HD22 LEU 66 1HD2 LEU 66 9.384 -23.139 2.525 500 HD23 LEU 66 2HD2 LEU 66 10.690 -23.901 3.433 501 H LYS 67 H LYS 67 10.815 -28.192 0.659 502 HA LYS 67 HA LYS 67 13.445 -27.551 0.115 503 HB2 LYS 67 2HB LYS 67 11.848 -29.956 -0.779 504 HB3 LYS 67 3HB LYS 67 13.599 -29.837 -0.900 505 HG2 LYS 67 2HG LYS 67 12.147 -29.535 1.710 506 HG3 LYS 67 3HG LYS 67 12.670 -31.101 1.086 507 HD2 LYS 67 2HD LYS 67 14.500 -28.745 1.531 508 HD3 LYS 67 3HD LYS 67 14.275 -30.064 2.682 509 HE2 LYS 67 2HE LYS 67 15.742 -31.321 1.585 510 HE3 LYS 67 3HE LYS 67 14.824 -31.145 0.091 511 HZ1 LYS 67 3HZ LYS 67 17.084 -30.343 -0.167 512 HZ2 LYS 67 1HZ LYS 67 16.869 -29.241 1.099 513 HZ3 LYS 67 2HZ LYS 67 15.986 -29.067 -0.332 514 H GLN 68 H GLN 68 10.711 -27.705 -2.064 515 HA GLN 68 HA GLN 68 12.373 -27.409 -4.420 516 HB2 GLN 68 2HB GLN 68 10.564 -28.070 -5.584 517 HB3 GLN 68 3HB GLN 68 9.916 -28.527 -4.014 518 HG2 GLN 68 2HG GLN 68 9.088 -26.037 -3.991 519 HG3 GLN 68 3HG GLN 68 9.249 -26.202 -5.739 520 HE21 GLN 68 1HE2 GLN 68 6.937 -26.021 -3.751 521 HE22 GLN 68 2HE2 GLN 68 5.881 -27.296 -4.242 522 H ILE 69 H ILE 69 10.666 -25.408 -2.194 523 HA ILE 69 HA ILE 69 10.289 -23.144 -3.864 524 HB ILE 69 HB ILE 69 10.368 -23.493 -0.879 525 HG12 ILE 69 2HG1 ILE 69 8.084 -22.452 -2.522 526 HG13 ILE 69 3HG1 ILE 69 8.412 -24.181 -2.470 527 HG21 ILE 69 1HG2 ILE 69 10.426 -20.986 -2.465 528 HG22 ILE 69 2HG2 ILE 69 9.378 -21.041 -1.049 529 HG23 ILE 69 3HG2 ILE 69 11.108 -21.338 -0.878 530 HD11 ILE 69 3HD1 ILE 69 6.911 -22.679 -0.669 531 HD12 ILE 69 1HD1 ILE 69 7.407 -24.364 -0.511 532 HD13 ILE 69 2HD1 ILE 69 8.402 -23.082 0.181 533 H LYS 70 H LYS 70 12.963 -24.331 -1.963 534 HA LYS 70 HA LYS 70 14.462 -21.872 -2.126 535 HB2 LYS 70 2HB LYS 70 15.060 -24.635 -1.101 536 HB3 LYS 70 3HB LYS 70 16.333 -23.430 -1.257 537 HG2 LYS 70 2HG LYS 70 15.645 -22.287 0.542 538 HG3 LYS 70 3HG LYS 70 13.937 -22.496 0.148 539 HD2 LYS 70 2HD LYS 70 14.288 -23.673 2.168 540 HD3 LYS 70 3HD LYS 70 14.196 -24.900 0.902 541 HE2 LYS 70 2HE LYS 70 16.891 -24.188 1.040 542 HE3 LYS 70 3HE LYS 70 16.355 -24.279 2.717 543 HZ1 LYS 70 3HZ LYS 70 15.427 -26.460 1.084 544 HZ2 LYS 70 1HZ LYS 70 16.164 -26.486 2.607 545 HZ3 LYS 70 2HZ LYS 70 17.113 -26.387 1.210 546 H GLN 71 H GLN 71 14.149 -24.804 -3.959 547 HA GLN 71 HA GLN 71 16.567 -24.330 -5.487 548 HB2 GLN 71 2HB GLN 71 15.258 -26.607 -4.848 549 HB3 GLN 71 3HB GLN 71 14.591 -26.309 -6.447 550 HG2 GLN 71 2HG GLN 71 17.357 -25.913 -6.673 551 HG3 GLN 71 3HG GLN 71 17.142 -27.375 -5.711 552 HE21 GLN 71 1HE2 GLN 71 15.771 -25.837 -8.603 553 HE22 GLN 71 2HE2 GLN 71 15.691 -27.284 -9.543 554 H ARG 72 H ARG 72 13.075 -24.078 -5.914 555 HA ARG 72 HA ARG 72 13.289 -23.276 -8.671 556 HB2 ARG 72 2HB ARG 72 11.291 -24.400 -7.258 557 HB3 ARG 72 3HB ARG 72 10.805 -22.713 -7.154 558 HG2 ARG 72 2HG ARG 72 11.496 -23.949 -9.790 559 HG3 ARG 72 3HG ARG 72 9.894 -24.153 -9.078 560 HD2 ARG 72 2HD ARG 72 9.296 -22.139 -9.792 561 HD3 ARG 72 3HD ARG 72 10.629 -21.407 -8.901 562 HE ARG 72 HE ARG 72 11.842 -22.323 -11.123 563 HH11 ARG 72 1HH1 ARG 72 8.990 -20.392 -10.620 564 HH12 ARG 72 2HH1 ARG 72 9.159 -19.520 -12.107 565 HH21 ARG 72 1HH2 ARG 72 12.075 -21.183 -13.085 566 HH22 ARG 72 2HH2 ARG 72 10.913 -19.972 -13.509 567 H HIS 73 H HIS 73 12.714 -21.684 -5.568 568 HA HIS 73 HA HIS 73 13.237 -19.105 -6.888 569 HB2 HIS 73 2HB HIS 73 11.347 -19.447 -4.559 570 HB3 HIS 73 3HB HIS 73 11.589 -18.010 -5.549 571 HD1 HIS 73 HD1 HIS 73 10.536 -18.039 -7.946 572 HD2 HIS 73 HD2 HIS 73 9.564 -21.309 -5.576 573 HE1 HIS 73 HE1 HIS 73 8.595 -19.150 -9.097 574 HA PRO 74 HA PRO 74 16.275 -19.832 -3.464 575 HB2 PRO 74 2HB PRO 74 18.421 -18.956 -4.877 576 HB3 PRO 74 3HB PRO 74 17.842 -20.625 -4.944 577 HG2 PRO 74 2HG PRO 74 17.363 -18.375 -6.860 578 HG3 PRO 74 3HG PRO 74 17.749 -20.072 -7.201 579 HD2 PRO 74 2HD PRO 74 15.230 -19.090 -7.357 580 HD3 PRO 74 3HD PRO 74 15.575 -20.762 -6.872 581 H MET 75 H MET 75 15.161 -17.190 -5.317 582 HA MET 75 HA MET 75 16.604 -15.244 -3.665 583 HB2 MET 75 2HB MET 75 15.843 -13.568 -5.265 584 HB3 MET 75 3HB MET 75 16.655 -14.889 -6.095 585 HG2 MET 75 2HG MET 75 14.839 -15.416 -7.268 586 HG3 MET 75 3HG MET 75 13.784 -15.286 -5.863 587 HE1 MET 75 3HE MET 75 11.886 -13.760 -5.939 588 HE2 MET 75 1HE MET 75 12.975 -12.829 -4.911 589 HE3 MET 75 2HE MET 75 12.064 -12.022 -6.187 590 H LEU 76 H LEU 76 13.600 -16.793 -3.932 591 HA LEU 76 HA LEU 76 12.063 -14.660 -2.715 592 HB2 LEU 76 2HB LEU 76 11.005 -16.108 -4.354 593 HB3 LEU 76 3HB LEU 76 11.354 -17.520 -3.357 594 HG LEU 76 HG LEU 76 9.865 -16.456 -1.593 595 HD11 LEU 76 1HD1 LEU 76 8.100 -14.987 -2.971 596 HD12 LEU 76 2HD1 LEU 76 9.582 -14.525 -3.808 597 HD13 LEU 76 3HD1 LEU 76 9.443 -14.288 -2.066 598 HD21 LEU 76 3HD2 LEU 76 7.799 -16.945 -3.300 599 HD22 LEU 76 1HD2 LEU 76 8.712 -18.183 -2.437 600 HD23 LEU 76 2HD2 LEU 76 9.131 -17.778 -4.102 601 HA PRO 77 HA PRO 77 13.318 -15.960 1.369 602 HB2 PRO 77 2HB PRO 77 11.897 -14.063 2.692 603 HB3 PRO 77 3HB PRO 77 13.432 -13.724 1.883 604 HG2 PRO 77 2HG PRO 77 10.638 -13.228 0.930 605 HG3 PRO 77 3HG PRO 77 12.061 -12.177 0.817 606 HD2 PRO 77 2HD PRO 77 11.180 -13.663 -1.267 607 HD3 PRO 77 3HD PRO 77 12.898 -13.294 -1.017 608 H VAL 78 H VAL 78 12.423 -17.245 2.915 609 HA VAL 78 HA VAL 78 9.507 -17.489 3.049 610 HB VAL 78 HB VAL 78 11.329 -19.882 2.770 611 HG11 VAL 78 1HG1 VAL 78 9.593 -20.706 4.008 612 HG12 VAL 78 2HG1 VAL 78 8.439 -19.529 3.379 613 HG13 VAL 78 3HG1 VAL 78 8.926 -20.904 2.388 614 HG21 VAL 78 3HG2 VAL 78 11.259 -19.250 0.593 615 HG22 VAL 78 1HG2 VAL 78 9.695 -20.063 0.657 616 HG23 VAL 78 2HG2 VAL 78 9.783 -18.307 0.799 617 H ILE 79 H ILE 79 8.732 -18.474 4.993 618 HA ILE 79 HA ILE 79 10.726 -18.627 7.154 619 HB ILE 79 HB ILE 79 7.977 -17.400 7.395 620 HG12 ILE 79 2HG1 ILE 79 10.548 -15.907 7.776 621 HG13 ILE 79 3HG1 ILE 79 9.918 -16.148 6.150 622 HG21 ILE 79 1HG2 ILE 79 8.621 -16.828 9.651 623 HG22 ILE 79 2HG2 ILE 79 8.782 -18.567 9.416 624 HG23 ILE 79 3HG2 ILE 79 10.215 -17.541 9.409 625 HD11 ILE 79 3HD1 ILE 79 9.328 -14.022 7.621 626 HD12 ILE 79 1HD1 ILE 79 8.196 -14.717 6.460 627 HD13 ILE 79 2HD1 ILE 79 8.043 -15.095 8.177 628 H ILE 80 H ILE 80 10.427 -20.204 8.680 629 HA ILE 80 HA ILE 80 8.341 -22.179 8.068 630 HB ILE 80 HB ILE 80 10.853 -22.534 9.707 631 HG12 ILE 80 2HG1 ILE 80 11.090 -22.116 7.182 632 HG13 ILE 80 3HG1 ILE 80 11.859 -23.557 7.839 633 HG21 ILE 80 1HG2 ILE 80 8.563 -24.300 9.029 634 HG22 ILE 80 2HG2 ILE 80 10.174 -25.013 9.092 635 HG23 ILE 80 3HG2 ILE 80 9.515 -24.198 10.510 636 HD11 ILE 80 3HD1 ILE 80 10.082 -24.940 7.015 637 HD12 ILE 80 1HD1 ILE 80 9.173 -23.525 6.486 638 HD13 ILE 80 2HD1 ILE 80 10.696 -23.940 5.699 639 H MET 81 H MET 81 6.920 -22.901 9.600 640 HA MET 81 HA MET 81 7.038 -21.596 12.238 641 HB2 MET 81 2HB MET 81 4.907 -21.594 10.229 642 HB3 MET 81 3HB MET 81 4.357 -22.072 11.829 643 HG2 MET 81 2HG MET 81 4.408 -19.982 12.550 644 HG3 MET 81 3HG MET 81 6.067 -19.769 11.996 645 HE1 MET 81 3HE MET 81 2.152 -19.277 10.716 646 HE2 MET 81 1HE MET 81 2.606 -19.498 9.025 647 HE3 MET 81 2HE MET 81 2.925 -20.776 10.198 648 H THR 82 H THR 82 7.162 -22.996 13.855 649 HA THR 82 HA THR 82 5.526 -25.229 14.208 650 HB THR 82 HB THR 82 6.538 -26.532 12.597 651 HG1 THR 82 HG1 THR 82 7.241 -28.062 13.877 652 HG21 THR 82 3HG2 THR 82 8.794 -24.731 13.016 653 HG22 THR 82 1HG2 THR 82 8.282 -25.580 11.558 654 HG23 THR 82 2HG2 THR 82 9.285 -26.404 12.751 655 H ALA 83 H ALA 83 8.986 -25.450 14.773 656 HA ALA 83 HA ALA 83 10.239 -25.428 16.673 657 HB1 ALA 83 1HB ALA 83 8.292 -23.254 17.064 658 HB2 ALA 83 2HB ALA 83 9.092 -23.838 18.524 659 HB3 ALA 83 3HB ALA 83 10.053 -23.239 17.172 660 H HIS 84 H HIS 84 9.410 -27.701 16.806 661 HA HIS 84 HA HIS 84 8.772 -28.365 19.447 662 HB2 HIS 84 2HB HIS 84 6.499 -29.274 19.173 663 HB3 HIS 84 3HB HIS 84 6.536 -27.532 18.918 664 HD1 HIS 84 HD1 HIS 84 6.267 -30.766 16.988 665 HD2 HIS 84 HD2 HIS 84 5.644 -26.693 16.458 666 HE1 HIS 84 HE1 HIS 84 5.118 -30.546 14.762 667 H SER 85 H SER 85 8.708 -29.285 16.062 668 HA SER 85 HA SER 85 10.197 -31.672 16.613 669 HB2 SER 85 2HB SER 85 7.888 -32.433 17.115 670 HB3 SER 85 3HB SER 85 7.406 -31.983 15.479 671 HG SER 85 HG SER 85 9.109 -34.058 16.327 672 H ASP 86 H ASP 86 10.400 -29.229 15.024 673 HA ASP 86 HA ASP 86 11.039 -30.493 12.471 674 HB2 ASP 86 2HB ASP 86 9.019 -28.367 12.878 675 HB3 ASP 86 3HB ASP 86 10.128 -28.129 11.531 676 H LEU 87 H LEU 87 11.276 -27.667 14.570 677 HA LEU 87 HA LEU 87 13.169 -26.157 13.292 678 HB2 LEU 87 2HB LEU 87 12.299 -26.542 16.041 679 HB3 LEU 87 3HB LEU 87 13.991 -26.060 15.927 680 HG LEU 87 HG LEU 87 13.361 -24.051 14.714 681 HD11 LEU 87 1HD1 LEU 87 10.596 -23.884 15.062 682 HD12 LEU 87 2HD1 LEU 87 10.887 -25.479 14.368 683 HD13 LEU 87 3HD1 LEU 87 11.477 -24.037 13.542 684 HD21 LEU 87 3HD2 LEU 87 13.459 -23.733 17.042 685 HD22 LEU 87 1HD2 LEU 87 11.932 -24.576 17.305 686 HD23 LEU 87 2HD2 LEU 87 11.941 -22.989 16.536 687 H ASP 88 H ASP 88 13.772 -28.908 15.463 688 HA ASP 88 HA ASP 88 16.494 -28.936 15.577 689 HB2 ASP 88 2HB ASP 88 14.766 -30.603 16.549 690 HB3 ASP 88 3HB ASP 88 15.003 -31.492 15.046 691 H ALA 89 H ALA 89 14.476 -30.009 12.892 692 HA ALA 89 HA ALA 89 16.792 -30.825 11.339 693 HB1 ALA 89 1HB ALA 89 14.431 -30.774 9.757 694 HB2 ALA 89 2HB ALA 89 15.326 -32.170 10.361 695 HB3 ALA 89 3HB ALA 89 14.033 -31.465 11.331 696 H ALA 90 H ALA 90 14.171 -28.428 11.051 697 HA ALA 90 HA ALA 90 14.941 -27.164 8.732 698 HB1 ALA 90 1HB ALA 90 13.675 -26.024 11.214 699 HB2 ALA 90 2HB ALA 90 13.865 -25.114 9.714 700 HB3 ALA 90 3HB ALA 90 12.875 -26.574 9.741 701 H VAL 91 H VAL 91 16.352 -26.922 11.919 702 HA VAL 91 HA VAL 91 17.784 -24.580 11.782 703 HB VAL 91 HB VAL 91 18.501 -27.225 13.024 704 HG11 VAL 91 1HG1 VAL 91 20.155 -25.608 14.319 705 HG12 VAL 91 2HG1 VAL 91 20.638 -26.452 12.846 706 HG13 VAL 91 3HG1 VAL 91 20.138 -24.762 12.772 707 HG21 VAL 91 3HG2 VAL 91 18.107 -24.823 14.665 708 HG22 VAL 91 1HG2 VAL 91 16.684 -25.348 13.765 709 HG23 VAL 91 2HG2 VAL 91 17.483 -26.459 14.877 710 H SER 92 H SER 92 19.040 -27.788 10.845 711 HA SER 92 HA SER 92 21.229 -26.539 9.407 712 HB2 SER 92 2HB SER 92 20.840 -29.022 10.692 713 HB3 SER 92 3HB SER 92 21.059 -29.382 8.979 714 HG SER 92 HG SER 92 22.906 -27.747 9.296 715 H ALA 93 H ALA 93 18.347 -28.458 8.697 716 HA ALA 93 HA ALA 93 18.769 -28.781 5.941 717 HB1 ALA 93 1HB ALA 93 16.279 -28.770 7.622 718 HB2 ALA 93 2HB ALA 93 16.239 -29.049 5.881 719 HB3 ALA 93 3HB ALA 93 17.134 -30.148 6.930 720 H TYR 94 H TYR 94 16.519 -26.505 7.527 721 HA TYR 94 HA TYR 94 15.936 -25.002 5.257 722 HB2 TYR 94 2HB TYR 94 14.906 -24.995 7.681 723 HB3 TYR 94 3HB TYR 94 16.044 -23.677 7.939 724 HD1 TYR 94 HD1 TYR 94 14.045 -24.534 4.911 725 HD2 TYR 94 HD2 TYR 94 14.737 -21.755 8.058 726 HE1 TYR 94 HE1 TYR 94 12.458 -22.969 3.871 727 HE2 TYR 94 HE2 TYR 94 13.151 -20.183 7.026 728 HH TYR 94 HH TYR 94 11.044 -20.520 5.363 729 H GLN 95 H GLN 95 18.780 -25.095 7.149 730 HA GLN 95 HA GLN 95 19.731 -22.464 6.646 731 HB2 GLN 95 2HB GLN 95 20.721 -24.896 7.903 732 HB3 GLN 95 3HB GLN 95 21.978 -24.057 7.003 733 HG2 GLN 95 2HG GLN 95 20.220 -22.634 8.970 734 HG3 GLN 95 3HG GLN 95 21.692 -23.471 9.460 735 HE21 GLN 95 1HE2 GLN 95 22.174 -21.220 10.170 736 HE22 GLN 95 2HE2 GLN 95 22.953 -20.176 9.035 737 H GLN 96 H GLN 96 19.027 -24.758 4.487 738 HA GLN 96 HA GLN 96 21.358 -24.798 2.844 739 HB2 GLN 96 2HB GLN 96 18.517 -25.666 2.537 740 HB3 GLN 96 3HB GLN 96 19.510 -25.514 1.094 741 HG2 GLN 96 2HG GLN 96 21.152 -26.933 2.728 742 HG3 GLN 96 3HG GLN 96 19.565 -27.522 3.221 743 HE21 GLN 96 1HE2 GLN 96 21.151 -26.633 0.168 744 HE22 GLN 96 2HE2 GLN 96 20.690 -28.064 -0.684 745 H GLY 97 H GLY 97 20.153 -22.155 3.679 746 HA2 GLY 97 2HA GLY 97 20.678 -20.163 2.400 747 HA3 GLY 97 3HA GLY 97 20.083 -20.991 0.969 748 H ALA 98 H ALA 98 18.464 -21.028 4.083 749 HA ALA 98 HA ALA 98 16.213 -19.599 2.842 750 HB1 ALA 98 1HB ALA 98 15.937 -21.128 5.389 751 HB2 ALA 98 2HB ALA 98 14.751 -20.834 4.116 752 HB3 ALA 98 3HB ALA 98 16.048 -22.002 3.860 753 H PHE 99 H PHE 99 14.797 -18.503 4.648 754 HA PHE 99 HA PHE 99 16.580 -16.627 6.009 755 HB2 PHE 99 2HB PHE 99 14.998 -15.495 4.664 756 HB3 PHE 99 3HB PHE 99 13.675 -16.516 5.219 757 HD1 PHE 99 HD1 PHE 99 15.999 -13.830 6.236 758 HD2 PHE 99 HD2 PHE 99 12.417 -15.951 7.124 759 HE1 PHE 99 HE1 PHE 99 15.442 -12.162 7.957 760 HE2 PHE 99 HE2 PHE 99 11.853 -14.286 8.845 761 HZ PHE 99 HZ PHE 99 13.366 -12.388 9.263 762 H ASP 100 H ASP 100 16.253 -16.020 8.194 763 HA ASP 100 HA ASP 100 16.018 -18.027 10.032 764 HB2 ASP 100 2HB ASP 100 16.854 -15.696 10.458 765 HB3 ASP 100 3HB ASP 100 15.176 -15.172 10.557 766 H TYR 101 H TYR 101 14.408 -19.350 10.513 767 HA TYR 101 HA TYR 101 11.701 -18.787 9.778 768 HB2 TYR 101 2HB TYR 101 11.280 -20.979 11.042 769 HB3 TYR 101 3HB TYR 101 12.311 -21.055 9.618 770 HD1 TYR 101 HD1 TYR 101 12.749 -20.364 13.273 771 HD2 TYR 101 HD2 TYR 101 14.145 -22.425 9.822 772 HE1 TYR 101 HE1 TYR 101 14.523 -21.407 14.620 773 HE2 TYR 101 HE2 TYR 101 15.922 -23.474 11.160 774 HH TYR 101 HH TYR 101 16.899 -22.407 14.077 775 H LEU 102 H LEU 102 9.912 -19.192 11.429 776 HA LEU 102 HA LEU 102 10.574 -17.941 14.008 777 HB2 LEU 102 2HB LEU 102 9.542 -16.132 13.135 778 HB3 LEU 102 3HB LEU 102 8.655 -17.081 11.943 779 HG LEU 102 HG LEU 102 7.190 -17.821 13.923 780 HD11 LEU 102 1HD1 LEU 102 7.291 -15.537 15.453 781 HD12 LEU 102 2HD1 LEU 102 8.991 -15.933 15.207 782 HD13 LEU 102 3HD1 LEU 102 7.903 -17.125 15.917 783 HD21 LEU 102 3HD2 LEU 102 6.200 -15.291 13.824 784 HD22 LEU 102 1HD2 LEU 102 5.934 -16.524 12.591 785 HD23 LEU 102 2HD2 LEU 102 7.211 -15.327 12.379 786 HA PRO 103 HA PRO 103 8.455 -21.498 15.581 787 HB2 PRO 103 2HB PRO 103 8.366 -20.706 18.176 788 HB3 PRO 103 3HB PRO 103 9.837 -21.312 17.406 789 HG2 PRO 103 2HG PRO 103 8.995 -18.486 17.921 790 HG3 PRO 103 3HG PRO 103 10.587 -19.236 18.136 791 HD2 PRO 103 2HD PRO 103 9.973 -17.713 15.983 792 HD3 PRO 103 3HD PRO 103 11.104 -19.079 15.895 793 H LYS 104 H LYS 104 6.421 -22.066 16.449 794 HA LYS 104 HA LYS 104 4.479 -19.861 16.652 795 HB2 LYS 104 2HB LYS 104 2.861 -21.085 15.416 796 HB3 LYS 104 3HB LYS 104 4.350 -21.155 14.483 797 HG2 LYS 104 2HG LYS 104 3.803 -23.335 14.346 798 HG3 LYS 104 3HG LYS 104 4.630 -23.403 15.904 799 HD2 LYS 104 2HD LYS 104 2.761 -24.123 16.866 800 HD3 LYS 104 3HD LYS 104 1.933 -22.643 16.373 801 HE2 LYS 104 2HE LYS 104 0.777 -24.653 15.571 802 HE3 LYS 104 3HE LYS 104 1.354 -23.650 14.241 803 HZ1 LYS 104 3HZ LYS 104 1.834 -26.328 14.605 804 HZ2 LYS 104 1HZ LYS 104 3.300 -25.581 15.001 805 HZ3 LYS 104 2HZ LYS 104 2.594 -25.310 13.488 806 HA PRO 105 HA PRO 105 2.306 -19.677 17.081 807 HB2 PRO 105 2HB PRO 105 1.400 -18.316 19.249 808 HB3 PRO 105 3HB PRO 105 0.574 -19.734 18.590 809 HG2 PRO 105 2HG PRO 105 2.433 -19.541 20.929 810 HG3 PRO 105 3HG PRO 105 0.913 -20.442 20.779 811 HD2 PRO 105 2HD PRO 105 3.338 -21.624 20.537 812 HD3 PRO 105 3HD PRO 105 1.911 -22.181 19.640 813 H PHE 106 H PHE 106 2.354 -17.176 17.513 814 HA PHE 106 HA PHE 106 4.768 -16.224 18.781 815 HB2 PHE 106 2HB PHE 106 5.624 -15.159 16.683 816 HB3 PHE 106 3HB PHE 106 5.725 -16.916 16.684 817 HD1 PHE 106 HD1 PHE 106 3.673 -14.076 15.473 818 HD2 PHE 106 HD2 PHE 106 4.743 -18.166 14.980 819 HE1 PHE 106 HE1 PHE 106 2.429 -14.142 13.351 820 HE2 PHE 106 HE2 PHE 106 3.501 -18.238 12.857 821 HZ PHE 106 HZ PHE 106 2.342 -16.224 12.040 822 H ASP 107 H ASP 107 5.021 -13.762 18.164 823 HA ASP 107 HA ASP 107 2.389 -12.578 18.625 824 HB2 ASP 107 2HB ASP 107 5.145 -11.353 18.870 825 HB3 ASP 107 3HB ASP 107 3.631 -10.581 19.333 826 H ILE 108 H ILE 108 1.310 -11.851 16.924 827 HA ILE 108 HA ILE 108 2.179 -11.592 14.344 828 HB ILE 108 HB ILE 108 -0.006 -10.130 15.802 829 HG12 ILE 108 2HG1 ILE 108 -0.387 -12.023 13.521 830 HG13 ILE 108 3HG1 ILE 108 0.049 -12.677 15.096 831 HG21 ILE 108 1HG2 ILE 108 -0.820 -9.470 13.508 832 HG22 ILE 108 2HG2 ILE 108 0.591 -8.596 14.102 833 HG23 ILE 108 3HG2 ILE 108 0.788 -9.882 12.912 834 HD11 ILE 108 3HD1 ILE 108 -2.042 -10.838 15.518 835 HD12 ILE 108 1HD1 ILE 108 -2.496 -11.843 14.141 836 HD13 ILE 108 2HD1 ILE 108 -2.077 -12.594 15.682 837 H ASP 109 H ASP 109 2.550 -9.316 16.966 838 HA ASP 109 HA ASP 109 3.168 -7.002 15.534 839 HB2 ASP 109 2HB ASP 109 4.078 -7.987 18.237 840 HB3 ASP 109 3HB ASP 109 4.524 -6.403 17.608 841 H GLU 110 H GLU 110 5.218 -9.708 16.517 842 HA GLU 110 HA GLU 110 7.598 -8.497 15.423 843 HB2 GLU 110 2HB GLU 110 7.276 -10.272 17.390 844 HB3 GLU 110 3HB GLU 110 7.499 -11.401 16.062 845 HG2 GLU 110 2HG GLU 110 9.682 -11.158 16.285 846 HG3 GLU 110 3HG GLU 110 9.513 -9.481 15.771 847 H ALA 111 H ALA 111 5.217 -10.874 14.445 848 HA ALA 111 HA ALA 111 6.613 -11.951 12.242 849 HB1 ALA 111 1HB ALA 111 4.305 -12.576 13.480 850 HB2 ALA 111 2HB ALA 111 3.678 -11.786 12.033 851 HB3 ALA 111 3HB ALA 111 4.754 -13.176 11.883 852 H VAL 112 H VAL 112 4.117 -9.410 12.393 853 HA VAL 112 HA VAL 112 3.983 -8.762 9.713 854 HB VAL 112 HB VAL 112 3.661 -7.042 12.162 855 HG11 VAL 112 1HG1 VAL 112 2.462 -5.519 10.380 856 HG12 VAL 112 2HG1 VAL 112 4.189 -5.357 10.702 857 HG13 VAL 112 3HG1 VAL 112 3.634 -6.257 9.290 858 HG21 VAL 112 3HG2 VAL 112 1.989 -8.800 11.737 859 HG22 VAL 112 1HG2 VAL 112 1.301 -7.180 11.617 860 HG23 VAL 112 2HG2 VAL 112 1.668 -8.092 10.153 861 H ALA 113 H ALA 113 6.373 -7.807 12.105 862 HA ALA 113 HA ALA 113 7.694 -5.978 10.290 863 HB1 ALA 113 1HB ALA 113 7.624 -5.475 12.677 864 HB2 ALA 113 2HB ALA 113 8.526 -6.952 13.021 865 HB3 ALA 113 3HB ALA 113 9.286 -5.646 12.111 866 H LEU 114 H LEU 114 7.906 -9.305 11.191 867 HA LEU 114 HA LEU 114 10.607 -9.766 10.461 868 HB2 LEU 114 2HB LEU 114 9.380 -11.302 11.885 869 HB3 LEU 114 3HB LEU 114 8.255 -11.648 10.573 870 HG LEU 114 HG LEU 114 10.305 -12.533 9.308 871 HD11 LEU 114 1HD1 LEU 114 12.043 -11.636 10.701 872 HD12 LEU 114 2HD1 LEU 114 12.088 -13.396 10.796 873 HD13 LEU 114 3HD1 LEU 114 11.391 -12.460 12.118 874 HD21 LEU 114 3HD2 LEU 114 8.875 -13.795 11.591 875 HD22 LEU 114 1HD2 LEU 114 10.217 -14.669 10.851 876 HD23 LEU 114 2HD2 LEU 114 8.831 -14.187 9.872 877 H VAL 115 H VAL 115 7.543 -10.017 8.710 878 HA VAL 115 HA VAL 115 8.631 -11.091 6.327 879 HB VAL 115 HB VAL 115 6.260 -11.273 6.759 880 HG11 VAL 115 1HG1 VAL 115 5.995 -9.168 8.004 881 HG12 VAL 115 2HG1 VAL 115 6.138 -8.271 6.491 882 HG13 VAL 115 3HG1 VAL 115 4.773 -9.357 6.747 883 HG21 VAL 115 3HG2 VAL 115 7.393 -10.394 4.339 884 HG22 VAL 115 1HG2 VAL 115 5.907 -11.316 4.567 885 HG23 VAL 115 2HG2 VAL 115 5.851 -9.554 4.503 886 H GLU 116 H GLU 116 8.045 -7.795 7.443 887 HA GLU 116 HA GLU 116 8.552 -6.457 5.032 888 HB2 GLU 116 2HB GLU 116 8.447 -5.738 7.892 889 HB3 GLU 116 3HB GLU 116 9.422 -4.673 6.890 890 HG2 GLU 116 2HG GLU 116 7.522 -4.290 5.421 891 HG3 GLU 116 3HG GLU 116 6.540 -5.384 6.393 892 H ARG 117 H ARG 117 10.676 -7.972 7.298 893 HA ARG 117 HA ARG 117 13.052 -6.578 6.554 894 HB2 ARG 117 2HB ARG 117 13.101 -7.606 8.676 895 HB3 ARG 117 3HB ARG 117 12.512 -9.136 8.042 896 HG2 ARG 117 2HG ARG 117 14.564 -9.833 7.457 897 HG3 ARG 117 3HG ARG 117 15.070 -8.229 6.923 898 HD2 ARG 117 2HD ARG 117 14.741 -8.942 9.825 899 HD3 ARG 117 3HD ARG 117 16.254 -9.190 8.956 900 HE ARG 117 HE ARG 117 15.524 -6.561 8.516 901 HH11 ARG 117 1HH1 ARG 117 16.319 -8.575 11.242 902 HH12 ARG 117 2HH1 ARG 117 16.967 -7.271 12.182 903 HH21 ARG 117 1HH2 ARG 117 16.374 -4.837 9.743 904 HH22 ARG 117 2HH2 ARG 117 16.997 -5.145 11.329 905 H ALA 118 H ALA 118 11.325 -9.330 5.317 906 HA ALA 118 HA ALA 118 13.526 -10.238 3.671 907 HB1 ALA 118 1HB ALA 118 12.387 -12.135 3.841 908 HB2 ALA 118 2HB ALA 118 10.997 -11.294 4.530 909 HB3 ALA 118 3HB ALA 118 11.160 -11.441 2.780 910 H ILE 119 H ILE 119 10.654 -8.271 3.338 911 HA ILE 119 HA ILE 119 10.834 -8.163 0.453 912 HB ILE 119 HB ILE 119 9.102 -6.589 2.362 913 HG12 ILE 119 2HG1 ILE 119 8.138 -8.736 0.506 914 HG13 ILE 119 3HG1 ILE 119 8.857 -9.179 2.050 915 HG21 ILE 119 1HG2 ILE 119 7.790 -6.015 0.358 916 HG22 ILE 119 2HG2 ILE 119 9.428 -5.366 0.301 917 HG23 ILE 119 3HG2 ILE 119 9.013 -6.796 -0.644 918 HD11 ILE 119 3HD1 ILE 119 6.630 -7.190 1.912 919 HD12 ILE 119 1HD1 ILE 119 6.309 -8.924 1.895 920 HD13 ILE 119 2HD1 ILE 119 7.147 -8.195 3.266 921 H SER 120 H SER 120 11.318 -5.905 3.158 922 HA SER 120 HA SER 120 12.092 -3.690 1.627 923 HB2 SER 120 2HB SER 120 12.912 -4.427 4.447 924 HB3 SER 120 3HB SER 120 13.091 -2.831 3.717 925 HG SER 120 HG SER 120 11.190 -2.665 4.715 926 H HIS 121 H HIS 121 13.789 -6.565 2.497 927 HA HIS 121 HA HIS 121 16.440 -5.739 2.377 928 HB2 HIS 121 2HB HIS 121 15.568 -8.030 3.013 929 HB3 HIS 121 3HB HIS 121 15.419 -8.365 1.290 930 HD1 HIS 121 HD1 HIS 121 17.543 -8.924 0.012 931 HD2 HIS 121 HD2 HIS 121 18.243 -7.818 3.955 932 HE1 HIS 121 HE1 HIS 121 19.957 -9.478 0.448 933 H TYR 122 H TYR 122 14.106 -6.113 -0.151 934 HA TYR 122 HA TYR 122 16.187 -5.805 -2.200 935 HB2 TYR 122 2HB TYR 122 13.264 -6.379 -2.678 936 HB3 TYR 122 3HB TYR 122 14.605 -6.593 -3.798 937 HD1 TYR 122 HD1 TYR 122 16.496 -8.249 -2.882 938 HD2 TYR 122 HD2 TYR 122 12.421 -8.264 -1.656 939 HE1 TYR 122 HE1 TYR 122 16.727 -10.590 -2.163 940 HE2 TYR 122 HE2 TYR 122 12.642 -10.605 -0.933 941 HH TYR 122 HH TYR 122 15.197 -12.568 -1.817 942 H GLN 123 H GLN 123 12.826 -4.665 -1.851 943 HA GLN 123 HA GLN 123 13.182 -2.370 -3.424 944 HB2 GLN 123 2HB GLN 123 11.103 -3.400 -1.591 945 HB3 GLN 123 3HB GLN 123 11.094 -1.662 -1.859 946 HG2 GLN 123 2HG GLN 123 10.841 -1.962 -4.219 947 HG3 GLN 123 3HG GLN 123 11.054 -3.705 -4.064 948 HE21 GLN 123 1HE2 GLN 123 9.459 -4.633 -2.328 949 HE22 GLN 123 2HE2 GLN 123 7.812 -4.164 -2.554 950 H GLU 124 H GLU 124 13.079 -2.723 0.118 951 HA GLU 124 HA GLU 124 13.911 -1.436 1.799 952 HB2 GLU 124 2HB GLU 124 15.881 -1.485 -0.149 953 HB3 GLU 124 3HB GLU 124 15.697 0.228 0.202 954 HG2 GLU 124 2HG GLU 124 16.340 -0.023 2.415 955 HG3 GLU 124 3HG GLU 124 15.997 -1.752 2.421 Start of MODEL 25 1 H1 MET 1 H MET 1 1.350 0.378 1.670 2 HA MET 1 HA MET 1 0.640 -0.080 -0.543 3 HB2 MET 1 2HB MET 1 2.111 0.043 -2.409 4 HB3 MET 1 3HB MET 1 2.444 1.455 -1.415 5 HG2 MET 1 2HG MET 1 4.238 -0.283 -0.404 6 HG3 MET 1 3HG MET 1 4.148 -0.844 -2.072 7 HE1 MET 1 3HE MET 1 6.034 0.552 0.100 8 HE2 MET 1 1HE MET 1 7.267 0.969 -1.090 9 HE3 MET 1 2HE MET 1 6.438 2.243 -0.197 10 H GLN 2 H GLN 2 1.159 -2.032 -2.027 11 HA GLN 2 HA GLN 2 1.884 -4.244 -0.260 12 HB2 GLN 2 2HB GLN 2 0.819 -5.661 -2.017 13 HB3 GLN 2 3HB GLN 2 -0.266 -4.473 -1.306 14 HG2 GLN 2 2HG GLN 2 0.951 -3.271 -3.556 15 HG3 GLN 2 3HG GLN 2 0.401 -4.875 -4.037 16 HE21 GLN 2 1HE2 GLN 2 -0.903 -2.484 -1.770 17 HE22 GLN 2 2HE2 GLN 2 -2.456 -2.368 -2.517 18 H ARG 3 H ARG 3 4.158 -3.156 -0.758 19 HA ARG 3 HA ARG 3 5.386 -3.841 -3.234 20 HB2 ARG 3 2HB ARG 3 7.337 -2.928 -2.361 21 HB3 ARG 3 3HB ARG 3 6.086 -2.058 -1.484 22 HG2 ARG 3 2HG ARG 3 7.563 -4.460 -0.431 23 HG3 ARG 3 3HG ARG 3 7.960 -2.782 -0.056 24 HD2 ARG 3 2HD ARG 3 5.339 -4.152 0.540 25 HD3 ARG 3 3HD ARG 3 6.614 -3.817 1.711 26 HE ARG 3 HE ARG 3 5.613 -1.499 0.309 27 HH11 ARG 3 1HH1 ARG 3 5.307 -3.561 3.097 28 HH12 ARG 3 2HH1 ARG 3 4.513 -2.360 4.061 29 HH21 ARG 3 1HH2 ARG 3 4.569 0.091 1.568 30 HH22 ARG 3 2HH2 ARG 3 4.093 -0.283 3.189 31 H GLY 4 H GLY 4 4.571 -5.638 -0.473 32 HA2 GLY 4 2HA GLY 4 6.034 -7.937 -1.529 33 HA3 GLY 4 3HA GLY 4 6.385 -7.464 0.127 34 H ILE 5 H ILE 5 4.392 -9.297 -1.874 35 HA ILE 5 HA ILE 5 2.153 -9.421 -0.036 36 HB ILE 5 HB ILE 5 2.730 -10.949 -2.575 37 HG12 ILE 5 2HG1 ILE 5 0.568 -8.907 -2.090 38 HG13 ILE 5 3HG1 ILE 5 2.176 -8.441 -2.633 39 HG21 ILE 5 1HG2 ILE 5 1.395 -12.341 -1.141 40 HG22 ILE 5 2HG2 ILE 5 0.306 -11.002 -0.786 41 HG23 ILE 5 3HG2 ILE 5 0.364 -11.683 -2.411 42 HD11 ILE 5 3HD1 ILE 5 1.460 -8.756 -4.701 43 HD12 ILE 5 1HD1 ILE 5 1.411 -10.484 -4.352 44 HD13 ILE 5 2HD1 ILE 5 -0.036 -9.499 -4.135 45 H VAL 6 H VAL 6 1.707 -11.036 1.377 46 HA VAL 6 HA VAL 6 3.689 -13.209 1.594 47 HB VAL 6 HB VAL 6 2.113 -12.148 3.926 48 HG11 VAL 6 1HG1 VAL 6 3.266 -13.618 5.154 49 HG12 VAL 6 2HG1 VAL 6 3.681 -14.383 3.619 50 HG13 VAL 6 3HG1 VAL 6 4.788 -13.223 4.355 51 HG21 VAL 6 3HG2 VAL 6 3.354 -10.264 3.035 52 HG22 VAL 6 1HG2 VAL 6 4.092 -10.817 4.538 53 HG23 VAL 6 2HG2 VAL 6 4.830 -11.228 2.989 54 H TRP 7 H TRP 7 2.905 -15.183 1.310 55 HA TRP 7 HA TRP 7 0.003 -15.587 1.519 56 HB2 TRP 7 2HB TRP 7 2.147 -17.089 0.014 57 HB3 TRP 7 3HB TRP 7 0.503 -17.695 0.195 58 HD1 TRP 7 HD1 TRP 7 -0.148 -14.222 -0.131 59 HE1 TRP 7 HE1 TRP 7 -0.569 -13.510 -2.568 60 HE3 TRP 7 HE3 TRP 7 1.765 -18.319 -2.516 61 HZ2 TRP 7 HZ2 TRP 7 -0.147 -14.548 -5.159 62 HZ3 TRP 7 HZ3 TRP 7 1.718 -18.381 -4.976 63 HH2 TRP 7 HH2 TRP 7 0.780 -16.533 -6.268 64 H VAL 8 H VAL 8 -0.868 -17.099 2.856 65 HA VAL 8 HA VAL 8 1.010 -18.558 4.600 66 HB VAL 8 HB VAL 8 -1.742 -17.526 5.299 67 HG11 VAL 8 1HG1 VAL 8 -1.189 -18.263 7.582 68 HG12 VAL 8 2HG1 VAL 8 -1.262 -19.609 6.443 69 HG13 VAL 8 3HG1 VAL 8 0.301 -18.984 6.972 70 HG21 VAL 8 3HG2 VAL 8 0.501 -16.571 6.880 71 HG22 VAL 8 1HG2 VAL 8 0.632 -16.122 5.180 72 HG23 VAL 8 2HG2 VAL 8 -0.800 -15.668 6.104 73 H VAL 9 H VAL 9 0.544 -20.682 5.146 74 HA VAL 9 HA VAL 9 -1.836 -21.940 4.033 75 HB VAL 9 HB VAL 9 -0.068 -22.046 2.256 76 HG11 VAL 9 1HG1 VAL 9 1.310 -23.857 4.237 77 HG12 VAL 9 2HG1 VAL 9 1.799 -23.587 2.563 78 HG13 VAL 9 3HG1 VAL 9 1.873 -22.265 3.729 79 HG21 VAL 9 3HG2 VAL 9 -1.129 -23.875 1.568 80 HG22 VAL 9 1HG2 VAL 9 -0.321 -24.861 2.787 81 HG23 VAL 9 2HG2 VAL 9 -1.821 -24.023 3.183 82 H ASP 10 H ASP 10 -2.538 -23.641 5.217 83 HA ASP 10 HA ASP 10 -0.921 -25.296 6.821 84 HB2 ASP 10 2HB ASP 10 -0.739 -23.199 8.161 85 HB3 ASP 10 3HB ASP 10 -2.487 -23.229 8.378 86 H ASP 11 H ASP 11 -2.265 -26.681 8.305 87 HA ASP 11 HA ASP 11 -4.704 -27.397 6.917 88 HB2 ASP 11 2HB ASP 11 -2.769 -28.899 8.075 89 HB3 ASP 11 3HB ASP 11 -3.955 -28.858 9.376 90 H ASP 12 H ASP 12 -3.834 -25.535 9.612 91 HA ASP 12 HA ASP 12 -6.495 -25.810 10.824 92 HB2 ASP 12 2HB ASP 12 -3.818 -25.069 11.851 93 HB3 ASP 12 3HB ASP 12 -5.179 -24.187 12.537 94 H SER 13 H SER 13 -7.869 -24.082 11.047 95 HA SER 13 HA SER 13 -7.543 -21.952 9.156 96 HB2 SER 13 2HB SER 13 -9.713 -23.199 10.317 97 HB3 SER 13 3HB SER 13 -9.702 -21.624 11.109 98 HG SER 13 HG SER 13 -10.877 -21.821 9.035 99 H SER 14 H SER 14 -7.829 -22.087 12.703 100 HA SER 14 HA SER 14 -7.496 -19.368 13.208 101 HB2 SER 14 2HB SER 14 -7.027 -19.977 15.477 102 HB3 SER 14 3HB SER 14 -8.192 -21.150 14.863 103 HG SER 14 HG SER 14 -6.562 -22.251 15.926 104 H ILE 15 H ILE 15 -5.219 -21.723 12.184 105 HA ILE 15 HA ILE 15 -2.863 -20.428 13.148 106 HB ILE 15 HB ILE 15 -3.297 -22.526 11.030 107 HG12 ILE 15 2HG1 ILE 15 -3.637 -23.242 13.349 108 HG13 ILE 15 3HG1 ILE 15 -2.193 -23.987 12.672 109 HG21 ILE 15 1HG2 ILE 15 -0.954 -20.870 11.546 110 HG22 ILE 15 2HG2 ILE 15 -0.622 -22.599 11.632 111 HG23 ILE 15 3HG2 ILE 15 -1.328 -21.910 10.171 112 HD11 ILE 15 3HD1 ILE 15 -1.417 -21.564 13.911 113 HD12 ILE 15 1HD1 ILE 15 -2.454 -22.447 15.031 114 HD13 ILE 15 2HD1 ILE 15 -1.013 -23.218 14.370 115 H ARG 16 H ARG 16 -4.545 -20.502 10.024 116 HA ARG 16 HA ARG 16 -2.680 -18.668 8.816 117 HB2 ARG 16 2HB ARG 16 -3.833 -19.006 6.831 118 HB3 ARG 16 3HB ARG 16 -4.092 -20.528 7.672 119 HG2 ARG 16 2HG ARG 16 -6.252 -19.255 8.530 120 HG3 ARG 16 3HG ARG 16 -6.007 -18.363 7.027 121 HD2 ARG 16 2HD ARG 16 -5.674 -20.917 6.179 122 HD3 ARG 16 3HD ARG 16 -6.856 -21.143 7.467 123 HE ARG 16 HE ARG 16 -7.332 -20.015 4.910 124 HH11 ARG 16 1HH1 ARG 16 -8.234 -19.730 8.260 125 HH12 ARG 16 2HH1 ARG 16 -9.800 -19.073 7.918 126 HH21 ARG 16 1HH2 ARG 16 -9.391 -19.150 4.446 127 HH22 ARG 16 2HH2 ARG 16 -10.458 -18.744 5.748 128 H TRP 17 H TRP 17 -5.649 -18.464 10.569 129 HA TRP 17 HA TRP 17 -6.625 -16.004 9.653 130 HB2 TRP 17 2HB TRP 17 -8.048 -17.337 11.018 131 HB3 TRP 17 3HB TRP 17 -6.861 -17.399 12.318 132 HD1 TRP 17 HD1 TRP 17 -9.303 -14.918 10.651 133 HE1 TRP 17 HE1 TRP 17 -9.892 -13.095 12.370 134 HE3 TRP 17 HE3 TRP 17 -6.132 -16.298 14.417 135 HZ2 TRP 17 HZ2 TRP 17 -9.115 -12.341 14.977 136 HZ3 TRP 17 HZ3 TRP 17 -6.116 -14.973 16.490 137 HH2 TRP 17 HH2 TRP 17 -7.577 -13.036 16.762 138 H VAL 18 H VAL 18 -4.669 -16.651 12.570 139 HA VAL 18 HA VAL 18 -4.236 -14.043 13.363 140 HB VAL 18 HB VAL 18 -1.972 -14.973 14.231 141 HG11 VAL 18 1HG1 VAL 18 -4.255 -14.720 15.414 142 HG12 VAL 18 2HG1 VAL 18 -4.367 -16.471 15.227 143 HG13 VAL 18 3HG1 VAL 18 -3.033 -15.764 16.139 144 HG21 VAL 18 3HG2 VAL 18 -2.492 -16.987 12.480 145 HG22 VAL 18 1HG2 VAL 18 -1.422 -17.123 13.875 146 HG23 VAL 18 2HG2 VAL 18 -3.093 -17.675 13.988 147 H LEU 19 H LEU 19 -2.535 -15.924 10.916 148 HA LEU 19 HA LEU 19 -0.538 -13.913 10.452 149 HB2 LEU 19 2HB LEU 19 -1.303 -16.493 9.158 150 HB3 LEU 19 3HB LEU 19 -0.231 -15.379 8.311 151 HG LEU 19 HG LEU 19 0.373 -16.376 11.082 152 HD11 LEU 19 1HD1 LEU 19 1.347 -18.280 10.318 153 HD12 LEU 19 2HD1 LEU 19 1.689 -17.602 8.726 154 HD13 LEU 19 3HD1 LEU 19 0.057 -18.140 9.123 155 HD21 LEU 19 3HD2 LEU 19 1.610 -14.424 10.383 156 HD22 LEU 19 1HD2 LEU 19 2.051 -15.207 8.865 157 HD23 LEU 19 2HD2 LEU 19 2.680 -15.826 10.392 158 H GLU 20 H GLU 20 -3.757 -14.416 9.446 159 HA GLU 20 HA GLU 20 -3.543 -13.000 6.946 160 HB2 GLU 20 2HB GLU 20 -5.417 -14.709 8.091 161 HB3 GLU 20 3HB GLU 20 -6.223 -13.148 8.063 162 HG2 GLU 20 2HG GLU 20 -5.728 -12.965 5.658 163 HG3 GLU 20 3HG GLU 20 -5.005 -14.572 5.709 164 H ARG 21 H ARG 21 -4.715 -12.291 10.210 165 HA ARG 21 HA ARG 21 -5.688 -9.704 9.674 166 HB2 ARG 21 2HB ARG 21 -4.523 -10.559 12.316 167 HB3 ARG 21 3HB ARG 21 -5.826 -9.416 12.018 168 HG2 ARG 21 2HG ARG 21 -5.898 -12.409 11.787 169 HG3 ARG 21 3HG ARG 21 -6.829 -11.371 12.869 170 HD2 ARG 21 2HD ARG 21 -7.127 -11.736 9.903 171 HD3 ARG 21 3HD ARG 21 -8.326 -12.004 11.168 172 HE ARG 21 HE ARG 21 -7.782 -9.359 11.371 173 HH11 ARG 21 1HH1 ARG 21 -8.707 -11.424 8.725 174 HH12 ARG 21 2HH1 ARG 21 -9.551 -10.174 7.873 175 HH21 ARG 21 1HH2 ARG 21 -8.889 -7.704 10.258 176 HH22 ARG 21 2HH2 ARG 21 -9.652 -8.058 8.745 177 H ALA 22 H ALA 22 -2.497 -10.929 10.032 178 HA ALA 22 HA ALA 22 -1.099 -8.715 10.967 179 HB1 ALA 22 1HB ALA 22 0.356 -10.423 10.825 180 HB2 ALA 22 2HB ALA 22 -0.444 -11.125 9.418 181 HB3 ALA 22 3HB ALA 22 0.672 -9.774 9.215 182 H LEU 23 H LEU 23 -1.570 -9.649 7.551 183 HA LEU 23 HA LEU 23 -0.735 -7.023 6.669 184 HB2 LEU 23 2HB LEU 23 -1.929 -9.124 4.902 185 HB3 LEU 23 3HB LEU 23 -0.746 -7.881 4.502 186 HG LEU 23 HG LEU 23 -0.310 -10.476 5.954 187 HD11 LEU 23 1HD1 LEU 23 0.065 -9.546 3.287 188 HD12 LEU 23 2HD1 LEU 23 0.395 -11.141 3.963 189 HD13 LEU 23 3HD1 LEU 23 1.641 -9.893 4.000 190 HD21 LEU 23 3HD2 LEU 23 1.110 -7.944 6.267 191 HD22 LEU 23 1HD2 LEU 23 2.151 -9.289 5.801 192 HD23 LEU 23 2HD2 LEU 23 1.160 -9.405 7.255 193 H ALA 24 H ALA 24 -3.682 -8.697 7.319 194 HA ALA 24 HA ALA 24 -5.535 -7.473 5.707 195 HB1 ALA 24 1HB ALA 24 -6.013 -9.253 7.366 196 HB2 ALA 24 2HB ALA 24 -5.927 -8.038 8.642 197 HB3 ALA 24 3HB ALA 24 -7.177 -7.928 7.403 198 H GLY 25 H GLY 25 -4.043 -6.194 8.650 199 HA2 GLY 25 2HA GLY 25 -5.589 -3.740 8.488 200 HA3 GLY 25 3HA GLY 25 -4.385 -4.138 9.704 201 H ALA 26 H ALA 26 -2.582 -4.908 7.326 202 HA ALA 26 HA ALA 26 -1.505 -2.212 6.977 203 HB1 ALA 26 1HB ALA 26 0.559 -3.256 6.367 204 HB2 ALA 26 2HB ALA 26 -0.052 -4.058 7.815 205 HB3 ALA 26 3HB ALA 26 -0.218 -4.835 6.240 206 H GLY 27 H GLY 27 -0.055 -2.482 4.668 207 HA2 GLY 27 2HA GLY 27 -2.207 -2.585 2.659 208 HA3 GLY 27 3HA GLY 27 -0.738 -1.630 2.524 209 H LEU 28 H LEU 28 -1.202 -5.057 3.343 210 HA LEU 28 HA LEU 28 0.251 -5.771 0.890 211 HB2 LEU 28 2HB LEU 28 0.836 -7.569 3.074 212 HB3 LEU 28 3HB LEU 28 1.933 -6.735 1.976 213 HG LEU 28 HG LEU 28 0.737 -5.434 4.415 214 HD11 LEU 28 1HD1 LEU 28 3.561 -6.154 4.519 215 HD12 LEU 28 2HD1 LEU 28 2.478 -7.546 4.498 216 HD13 LEU 28 3HD1 LEU 28 2.301 -6.311 5.744 217 HD21 LEU 28 3HD2 LEU 28 3.180 -4.296 3.790 218 HD22 LEU 28 1HD2 LEU 28 1.588 -3.617 3.449 219 HD23 LEU 28 2HD2 LEU 28 2.422 -4.568 2.220 220 H THR 29 H THR 29 -0.433 -7.596 -0.135 221 HA THR 29 HA THR 29 -3.024 -8.590 0.527 222 HB THR 29 HB THR 29 -1.122 -9.790 -1.487 223 HG1 THR 29 HG1 THR 29 -2.927 -7.602 -1.800 224 HG21 THR 29 3HG2 THR 29 -2.837 -11.165 -1.859 225 HG22 THR 29 1HG2 THR 29 -3.770 -9.774 -2.407 226 HG23 THR 29 2HG2 THR 29 -3.854 -10.283 -0.720 227 H CYS 30 H CYS 30 -3.635 -10.609 1.259 228 HA CYS 30 HA CYS 30 -1.503 -12.420 2.150 229 HB2 CYS 30 2HB CYS 30 -2.758 -10.803 3.924 230 HB3 CYS 30 3HB CYS 30 -3.842 -12.188 3.945 231 HG CYS 30 HG CYS 30 -0.883 -13.445 4.151 232 H THR 31 H THR 31 -1.828 -14.224 1.033 233 HA THR 31 HA THR 31 -4.580 -15.098 0.496 234 HB THR 31 HB THR 31 -2.032 -16.130 -0.761 235 HG1 THR 31 HG1 THR 31 -3.022 -14.849 -2.598 236 HG21 THR 31 3HG2 THR 31 -3.992 -17.660 -0.796 237 HG22 THR 31 1HG2 THR 31 -3.484 -17.139 -2.402 238 HG23 THR 31 2HG2 THR 31 -4.904 -16.414 -1.648 239 H THR 32 H THR 32 -5.410 -16.754 1.580 240 HA THR 32 HA THR 32 -3.610 -18.422 3.191 241 HB THR 32 HB THR 32 -5.446 -18.932 4.607 242 HG1 THR 32 HG1 THR 32 -7.577 -17.873 3.895 243 HG21 THR 32 3HG2 THR 32 -4.571 -16.350 4.250 244 HG22 THR 32 1HG2 THR 32 -5.547 -16.924 5.601 245 HG23 THR 32 2HG2 THR 32 -6.325 -16.176 4.206 246 H PHE 33 H PHE 33 -3.299 -20.503 2.726 247 HA PHE 33 HA PHE 33 -5.094 -21.764 0.758 248 HB2 PHE 33 2HB PHE 33 -2.132 -22.167 1.206 249 HB3 PHE 33 3HB PHE 33 -3.113 -23.188 0.160 250 HD1 PHE 33 HD2 PHE 33 -3.954 -22.361 -1.954 251 HD2 PHE 33 HD1 PHE 33 -1.565 -19.909 0.576 252 HE1 PHE 33 HE2 PHE 33 -3.592 -20.797 -3.818 253 HE2 PHE 33 HE1 PHE 33 -1.200 -18.341 -1.285 254 HZ PHE 33 HZ PHE 33 -2.212 -18.784 -3.485 255 H GLU 34 H GLU 34 -4.464 -24.344 0.914 256 HA GLU 34 HA GLU 34 -4.517 -25.165 3.715 257 HB2 GLU 34 2HB GLU 34 -6.496 -26.628 3.284 258 HB3 GLU 34 3HB GLU 34 -6.857 -24.907 3.252 259 HG2 GLU 34 2HG GLU 34 -6.692 -25.002 0.762 260 HG3 GLU 34 3HG GLU 34 -6.560 -26.755 0.899 261 H ASN 35 H ASN 35 -2.886 -25.426 1.108 262 HA ASN 35 HA ASN 35 -1.939 -28.057 1.616 263 HB2 ASN 35 2HB ASN 35 -3.940 -28.659 0.320 264 HB3 ASN 35 3HB ASN 35 -3.402 -27.623 -0.998 265 HD21 ASN 35 1HD2 ASN 35 -3.849 -29.976 -1.852 266 HD22 ASN 35 2HD2 ASN 35 -2.426 -30.940 -2.028 267 H GLY 36 H GLY 36 0.180 -27.887 1.334 268 HA2 GLY 36 2HA GLY 36 1.500 -25.733 0.211 269 HA3 GLY 36 3HA GLY 36 2.218 -27.321 0.439 270 H ASN 37 H ASN 37 0.676 -28.823 -1.326 271 HA ASN 37 HA ASN 37 2.009 -28.398 -3.747 272 HB2 ASN 37 2HB ASN 37 1.262 -30.591 -3.374 273 HB3 ASN 37 3HB ASN 37 -0.370 -30.066 -2.974 274 HD21 ASN 37 1HD2 ASN 37 -1.839 -29.727 -4.582 275 HD22 ASN 37 2HD2 ASN 37 -1.545 -30.125 -6.237 276 H GLU 38 H GLU 38 -0.849 -26.978 -2.486 277 HA GLU 38 HA GLU 38 -1.817 -26.122 -5.092 278 HB2 GLU 38 2HB GLU 38 -3.099 -26.693 -2.739 279 HB3 GLU 38 3HB GLU 38 -3.049 -24.936 -2.705 280 HG2 GLU 38 2HG GLU 38 -4.240 -24.774 -4.747 281 HG3 GLU 38 3HG GLU 38 -4.074 -26.502 -5.054 282 H VAL 39 H VAL 39 0.296 -25.026 -2.673 283 HA VAL 39 HA VAL 39 -0.039 -22.205 -3.299 284 HB VAL 39 HB VAL 39 2.132 -23.378 -1.576 285 HG11 VAL 39 1HG1 VAL 39 0.765 -20.787 -1.063 286 HG12 VAL 39 2HG1 VAL 39 2.439 -21.262 -0.768 287 HG13 VAL 39 3HG1 VAL 39 1.904 -20.881 -2.405 288 HG21 VAL 39 3HG2 VAL 39 0.304 -24.311 -0.514 289 HG22 VAL 39 1HG2 VAL 39 0.442 -22.755 0.304 290 HG23 VAL 39 2HG2 VAL 39 -0.766 -22.981 -0.960 291 H LEU 40 H LEU 40 2.326 -24.788 -3.776 292 HA LEU 40 HA LEU 40 4.446 -23.379 -4.822 293 HB2 LEU 40 2HB LEU 40 4.955 -25.582 -4.594 294 HB3 LEU 40 3HB LEU 40 3.380 -26.117 -5.178 295 HG LEU 40 HG LEU 40 4.069 -25.717 -7.474 296 HD11 LEU 40 1HD1 LEU 40 5.637 -24.195 -7.866 297 HD12 LEU 40 2HD1 LEU 40 6.826 -25.383 -7.334 298 HD13 LEU 40 3HD1 LEU 40 6.171 -24.217 -6.185 299 HD21 LEU 40 3HD2 LEU 40 4.984 -27.730 -5.804 300 HD22 LEU 40 1HD2 LEU 40 6.419 -27.221 -6.695 301 HD23 LEU 40 2HD2 LEU 40 4.980 -27.746 -7.569 302 H ALA 41 H ALA 41 1.575 -24.572 -6.533 303 HA ALA 41 HA ALA 41 2.379 -23.593 -9.081 304 HB1 ALA 41 1HB ALA 41 0.331 -25.216 -8.100 305 HB2 ALA 41 2HB ALA 41 -0.480 -23.828 -8.825 306 HB3 ALA 41 3HB ALA 41 0.645 -24.791 -9.783 307 H ALA 42 H ALA 42 0.665 -22.222 -6.372 308 HA ALA 42 HA ALA 42 -0.603 -20.071 -7.639 309 HB1 ALA 42 1HB ALA 42 -0.993 -20.828 -5.294 310 HB2 ALA 42 2HB ALA 42 0.531 -20.058 -4.847 311 HB3 ALA 42 3HB ALA 42 -0.800 -19.083 -5.471 312 H LEU 43 H LEU 43 2.693 -20.462 -6.467 313 HA LEU 43 HA LEU 43 3.542 -17.808 -6.601 314 HB2 LEU 43 2HB LEU 43 5.348 -20.054 -7.389 315 HB3 LEU 43 3HB LEU 43 5.710 -18.611 -6.444 316 HG LEU 43 HG LEU 43 4.300 -21.112 -5.543 317 HD11 LEU 43 1HD1 LEU 43 6.145 -20.751 -3.726 318 HD12 LEU 43 2HD1 LEU 43 6.913 -19.791 -4.990 319 HD13 LEU 43 3HD1 LEU 43 6.547 -21.492 -5.275 320 HD21 LEU 43 3HD2 LEU 43 3.932 -18.398 -4.627 321 HD22 LEU 43 1HD2 LEU 43 4.597 -19.422 -3.354 322 HD23 LEU 43 2HD2 LEU 43 3.089 -19.873 -4.149 323 H ALA 44 H ALA 44 3.275 -20.265 -9.108 324 HA ALA 44 HA ALA 44 4.655 -18.881 -11.140 325 HB1 ALA 44 1HB ALA 44 3.455 -21.353 -10.893 326 HB2 ALA 44 2HB ALA 44 2.480 -20.540 -12.119 327 HB3 ALA 44 3HB ALA 44 4.222 -20.706 -12.344 328 H SER 45 H SER 45 1.707 -18.218 -9.643 329 HA SER 45 HA SER 45 0.353 -17.058 -11.890 330 HB2 SER 45 2HB SER 45 -0.832 -17.966 -9.885 331 HB3 SER 45 3HB SER 45 -0.184 -16.623 -8.943 332 HG SER 45 HG SER 45 -2.105 -16.604 -10.990 333 H LYS 46 H LYS 46 1.352 -15.471 -8.864 334 HA LYS 46 HA LYS 46 2.285 -13.186 -10.473 335 HB2 LYS 46 2HB LYS 46 1.566 -11.775 -8.475 336 HB3 LYS 46 3HB LYS 46 0.283 -12.425 -9.486 337 HG2 LYS 46 2HG LYS 46 0.012 -14.274 -7.846 338 HG3 LYS 46 3HG LYS 46 1.183 -13.459 -6.807 339 HD2 LYS 46 2HD LYS 46 -1.439 -12.304 -7.758 340 HD3 LYS 46 3HD LYS 46 -1.118 -12.945 -6.145 341 HE2 LYS 46 2HE LYS 46 -0.681 -10.783 -5.671 342 HE3 LYS 46 3HE LYS 46 0.897 -11.174 -6.354 343 HZ1 LYS 46 3HZ LYS 46 0.555 -9.791 -8.041 344 HZ2 LYS 46 1HZ LYS 46 -0.795 -9.204 -7.206 345 HZ3 LYS 46 2HZ LYS 46 -0.982 -10.421 -8.366 346 H THR 47 H THR 47 3.045 -15.531 -8.189 347 HA THR 47 HA THR 47 4.887 -15.959 -6.923 348 HB THR 47 HB THR 47 6.621 -13.826 -7.857 349 HG1 THR 47 HG1 THR 47 6.396 -14.058 -9.994 350 HG21 THR 47 3HG2 THR 47 6.915 -16.382 -7.026 351 HG22 THR 47 1HG2 THR 47 8.129 -15.508 -7.960 352 HG23 THR 47 2HG2 THR 47 7.009 -16.602 -8.773 353 HA PRO 48 HA PRO 48 4.005 -12.844 -3.781 354 HB2 PRO 48 2HB PRO 48 4.620 -14.464 -1.691 355 HB3 PRO 48 3HB PRO 48 3.067 -14.530 -2.533 356 HG2 PRO 48 2HG PRO 48 5.472 -16.284 -2.854 357 HG3 PRO 48 3HG PRO 48 3.758 -16.736 -2.784 358 HD2 PRO 48 2HD PRO 48 5.124 -16.555 -5.115 359 HD3 PRO 48 3HD PRO 48 3.393 -16.181 -4.991 360 H ASP 49 H ASP 49 5.342 -12.297 -1.693 361 HA ASP 49 HA ASP 49 8.115 -11.953 -2.574 362 HB2 ASP 49 2HB ASP 49 6.329 -10.132 -1.585 363 HB3 ASP 49 3HB ASP 49 7.245 -10.550 -0.139 364 H VAL 50 H VAL 50 6.202 -13.616 -0.266 365 HA VAL 50 HA VAL 50 8.294 -15.225 0.650 366 HB VAL 50 HB VAL 50 9.171 -13.345 1.845 367 HG11 VAL 50 1HG1 VAL 50 7.038 -12.038 1.811 368 HG12 VAL 50 2HG1 VAL 50 6.492 -13.007 3.182 369 HG13 VAL 50 3HG1 VAL 50 7.913 -11.974 3.341 370 HG21 VAL 50 3HG2 VAL 50 7.923 -14.460 4.207 371 HG22 VAL 50 1HG2 VAL 50 8.394 -15.715 3.061 372 HG23 VAL 50 2HG2 VAL 50 9.595 -14.570 3.658 373 H LEU 51 H LEU 51 7.426 -17.030 1.466 374 HA LEU 51 HA LEU 51 4.575 -17.000 2.123 375 HB2 LEU 51 2HB LEU 51 6.257 -18.775 0.715 376 HB3 LEU 51 3HB LEU 51 5.718 -19.621 2.164 377 HG LEU 51 HG LEU 51 3.536 -18.286 0.776 378 HD11 LEU 51 1HD1 LEU 51 5.126 -18.899 -1.113 379 HD12 LEU 51 2HD1 LEU 51 3.483 -19.530 -1.211 380 HD13 LEU 51 3HD1 LEU 51 4.801 -20.580 -0.691 381 HD21 LEU 51 3HD2 LEU 51 3.903 -20.407 2.501 382 HD22 LEU 51 1HD2 LEU 51 3.499 -21.186 0.971 383 HD23 LEU 51 2HD2 LEU 51 2.405 -19.990 1.667 384 H LEU 52 H LEU 52 3.893 -18.566 3.879 385 HA LEU 52 HA LEU 52 5.827 -18.782 6.059 386 HB2 LEU 52 2HB LEU 52 3.396 -17.089 6.032 387 HB3 LEU 52 3HB LEU 52 3.724 -17.997 7.506 388 HG LEU 52 HG LEU 52 6.045 -16.912 7.435 389 HD11 LEU 52 1HD1 LEU 52 4.852 -15.766 5.082 390 HD12 LEU 52 2HD1 LEU 52 6.512 -15.659 5.665 391 HD13 LEU 52 3HD1 LEU 52 5.304 -14.505 6.229 392 HD21 LEU 52 3HD2 LEU 52 4.068 -16.353 8.943 393 HD22 LEU 52 1HD2 LEU 52 3.776 -14.990 7.861 394 HD23 LEU 52 2HD2 LEU 52 5.301 -15.108 8.740 395 H SER 53 H SER 53 5.709 -21.029 5.595 396 HA SER 53 HA SER 53 3.202 -22.424 5.787 397 HB2 SER 53 2HB SER 53 4.391 -24.356 5.238 398 HB3 SER 53 3HB SER 53 5.341 -23.094 4.454 399 HG SER 53 HG SER 53 6.914 -23.363 5.877 400 H ASP 54 H ASP 54 2.488 -23.748 7.444 401 HA ASP 54 HA ASP 54 3.727 -23.221 10.056 402 HB2 ASP 54 2HB ASP 54 1.447 -22.489 9.997 403 HB3 ASP 54 3HB ASP 54 0.915 -24.012 9.290 404 H ILE 55 H ILE 55 3.278 -25.638 7.730 405 HA ILE 55 HA ILE 55 3.514 -27.914 7.721 406 HB ILE 55 HB ILE 55 5.525 -27.359 9.901 407 HG12 ILE 55 2HG1 ILE 55 5.915 -27.245 6.903 408 HG13 ILE 55 3HG1 ILE 55 5.805 -25.839 7.955 409 HG21 ILE 55 1HG2 ILE 55 6.512 -29.291 8.190 410 HG22 ILE 55 2HG2 ILE 55 5.810 -29.566 9.783 411 HG23 ILE 55 3HG2 ILE 55 4.802 -29.696 8.342 412 HD11 ILE 55 3HD1 ILE 55 7.783 -27.251 9.159 413 HD12 ILE 55 1HD1 ILE 55 8.041 -27.656 7.462 414 HD13 ILE 55 2HD1 ILE 55 8.033 -25.968 7.974 415 H ARG 56 H ARG 56 1.426 -28.396 8.563 416 HA ARG 56 HA ARG 56 1.543 -29.878 11.039 417 HB2 ARG 56 2HB ARG 56 0.672 -27.242 11.172 418 HB3 ARG 56 3HB ARG 56 -0.816 -28.176 11.103 419 HG2 ARG 56 2HG ARG 56 -0.600 -28.426 13.298 420 HG3 ARG 56 3HG ARG 56 0.713 -29.549 12.939 421 HD2 ARG 56 2HD ARG 56 2.323 -28.068 13.531 422 HD3 ARG 56 3HD ARG 56 1.407 -26.679 12.949 423 HE ARG 56 HE ARG 56 0.201 -27.794 15.262 424 HH11 ARG 56 1HH1 ARG 56 2.880 -25.832 14.216 425 HH12 ARG 56 2HH1 ARG 56 3.005 -24.973 15.715 426 HH21 ARG 56 1HH2 ARG 56 0.356 -26.669 17.241 427 HH22 ARG 56 2HH2 ARG 56 1.570 -25.450 17.435 428 H MET 57 H MET 57 1.133 -30.478 8.239 429 HA MET 57 HA MET 57 -1.615 -31.535 8.355 430 HB2 MET 57 2HB MET 57 -1.435 -31.590 5.815 431 HB3 MET 57 3HB MET 57 -1.593 -30.005 6.559 432 HG2 MET 57 2HG MET 57 0.931 -29.850 6.431 433 HG3 MET 57 3HG MET 57 0.862 -31.270 5.390 434 HE1 MET 57 3HE MET 57 0.824 -27.749 5.864 435 HE2 MET 57 1HE MET 57 1.861 -27.894 4.444 436 HE3 MET 57 2HE MET 57 0.349 -26.992 4.343 437 HA PRO 58 HA PRO 58 -0.020 -35.614 8.072 438 HB2 PRO 58 2HB PRO 58 -1.927 -36.841 6.580 439 HB3 PRO 58 3HB PRO 58 -2.188 -36.354 8.259 440 HG2 PRO 58 2HG PRO 58 -3.014 -34.972 5.735 441 HG3 PRO 58 3HG PRO 58 -3.936 -35.216 7.230 442 HD2 PRO 58 2HD PRO 58 -2.711 -32.874 6.640 443 HD3 PRO 58 3HD PRO 58 -2.898 -33.461 8.305 444 H GLY 59 H GLY 59 -1.311 -34.503 4.930 445 HA2 GLY 59 2HA GLY 59 0.227 -36.220 3.330 446 HA3 GLY 59 3HA GLY 59 -0.486 -34.704 2.799 447 H MET 60 H MET 60 0.790 -32.940 2.522 448 HA MET 60 HA MET 60 3.494 -33.217 2.056 449 HB2 MET 60 2HB MET 60 1.789 -31.279 1.510 450 HB3 MET 60 3HB MET 60 2.456 -30.569 2.974 451 HG2 MET 60 2HG MET 60 3.723 -29.657 1.248 452 HG3 MET 60 3HG MET 60 4.739 -30.932 1.917 453 HE1 MET 60 3HE MET 60 2.176 -29.920 -0.476 454 HE2 MET 60 1HE MET 60 2.970 -30.214 -2.023 455 HE3 MET 60 2HE MET 60 1.853 -31.409 -1.364 456 H ASP 61 H ASP 61 5.226 -33.403 3.311 457 HA ASP 61 HA ASP 61 5.065 -33.499 6.118 458 HB2 ASP 61 2HB ASP 61 7.027 -34.028 4.113 459 HB3 ASP 61 3HB ASP 61 7.763 -33.011 5.349 460 H GLY 62 H GLY 62 5.344 -30.862 3.987 461 HA2 GLY 62 2HA GLY 62 4.934 -28.663 4.995 462 HA3 GLY 62 3HA GLY 62 6.074 -29.114 6.254 463 H LEU 63 H LEU 63 8.309 -29.780 5.291 464 HA LEU 63 HA LEU 63 9.231 -27.485 3.802 465 HB2 LEU 63 2HB LEU 63 11.468 -28.801 4.076 466 HB3 LEU 63 3HB LEU 63 10.734 -27.981 5.452 467 HG LEU 63 HG LEU 63 9.898 -30.074 6.313 468 HD11 LEU 63 1HD1 LEU 63 10.863 -31.142 3.691 469 HD12 LEU 63 2HD1 LEU 63 9.310 -31.377 4.492 470 HD13 LEU 63 3HD1 LEU 63 10.748 -32.194 5.102 471 HD21 LEU 63 3HD2 LEU 63 12.197 -31.321 6.412 472 HD22 LEU 63 1HD2 LEU 63 12.000 -29.746 7.182 473 HD23 LEU 63 2HD2 LEU 63 12.789 -29.866 5.609 474 H ALA 64 H ALA 64 8.206 -30.631 3.070 475 HA ALA 64 HA ALA 64 9.762 -31.527 1.016 476 HB1 ALA 64 1HB ALA 64 8.113 -33.021 1.202 477 HB2 ALA 64 2HB ALA 64 6.961 -31.812 1.769 478 HB3 ALA 64 3HB ALA 64 7.244 -32.017 0.041 479 H LEU 65 H LEU 65 7.167 -29.108 0.773 480 HA LEU 65 HA LEU 65 7.760 -28.616 -2.016 481 HB2 LEU 65 2HB LEU 65 5.772 -27.573 -2.107 482 HB3 LEU 65 3HB LEU 65 5.489 -28.435 -0.596 483 HG LEU 65 HG LEU 65 6.467 -25.587 -0.768 484 HD11 LEU 65 1HD1 LEU 65 3.907 -26.565 -1.341 485 HD12 LEU 65 2HD1 LEU 65 4.380 -24.893 -1.043 486 HD13 LEU 65 3HD1 LEU 65 3.818 -25.900 0.291 487 HD21 LEU 65 3HD2 LEU 65 6.719 -27.302 1.304 488 HD22 LEU 65 1HD2 LEU 65 5.123 -26.627 1.634 489 HD23 LEU 65 2HD2 LEU 65 6.517 -25.558 1.482 490 H LEU 66 H LEU 66 8.648 -27.332 1.057 491 HA LEU 66 HA LEU 66 9.401 -24.727 0.203 492 HB2 LEU 66 2HB LEU 66 9.084 -25.905 2.610 493 HB3 LEU 66 3HB LEU 66 10.841 -25.932 2.476 494 HG LEU 66 HG LEU 66 10.359 -23.976 3.663 495 HD11 LEU 66 1HD1 LEU 66 11.942 -23.620 1.833 496 HD12 LEU 66 2HD1 LEU 66 11.011 -22.163 2.177 497 HD13 LEU 66 3HD1 LEU 66 10.612 -23.153 0.773 498 HD21 LEU 66 3HD2 LEU 66 8.005 -23.848 1.878 499 HD22 LEU 66 1HD2 LEU 66 8.692 -22.310 2.401 500 HD23 LEU 66 2HD2 LEU 66 8.149 -23.485 3.599 501 H LYS 67 H LYS 67 10.928 -27.838 0.113 502 HA LYS 67 HA LYS 67 13.612 -26.985 -0.151 503 HB2 LYS 67 2HB LYS 67 12.202 -29.509 -1.019 504 HB3 LYS 67 3HB LYS 67 13.935 -29.269 -1.193 505 HG2 LYS 67 2HG LYS 67 12.425 -29.201 1.411 506 HG3 LYS 67 3HG LYS 67 13.364 -30.567 0.805 507 HD2 LYS 67 2HD LYS 67 14.443 -27.819 1.437 508 HD3 LYS 67 3HD LYS 67 14.639 -29.262 2.435 509 HE2 LYS 67 2HE LYS 67 15.583 -30.202 0.111 510 HE3 LYS 67 3HE LYS 67 15.974 -28.495 -0.092 511 HZ1 LYS 67 3HZ LYS 67 16.971 -28.712 2.244 512 HZ2 LYS 67 1HZ LYS 67 17.836 -29.361 0.943 513 HZ3 LYS 67 2HZ LYS 67 16.944 -30.379 1.959 514 H GLN 68 H GLN 68 10.955 -27.206 -2.379 515 HA GLN 68 HA GLN 68 12.650 -26.916 -4.714 516 HB2 GLN 68 2HB GLN 68 10.785 -27.360 -5.981 517 HB3 GLN 68 3HB GLN 68 10.348 -28.176 -4.485 518 HG2 GLN 68 2HG GLN 68 9.322 -25.764 -3.971 519 HG3 GLN 68 3HG GLN 68 9.214 -25.753 -5.730 520 HE21 GLN 68 1HE2 GLN 68 7.149 -25.893 -3.602 521 HE22 GLN 68 2HE2 GLN 68 6.202 -27.286 -3.984 522 H ILE 69 H ILE 69 10.877 -24.916 -2.531 523 HA ILE 69 HA ILE 69 10.378 -22.673 -4.113 524 HB ILE 69 HB ILE 69 11.009 -22.872 -1.170 525 HG12 ILE 69 2HG1 ILE 69 8.405 -22.445 -2.652 526 HG13 ILE 69 3HG1 ILE 69 8.932 -23.970 -1.949 527 HG21 ILE 69 1HG2 ILE 69 11.563 -20.657 -1.659 528 HG22 ILE 69 2HG2 ILE 69 10.269 -20.499 -2.847 529 HG23 ILE 69 3HG2 ILE 69 9.884 -20.569 -1.127 530 HD11 ILE 69 3HD1 ILE 69 7.541 -21.805 -0.726 531 HD12 ILE 69 1HD1 ILE 69 7.943 -23.388 -0.063 532 HD13 ILE 69 2HD1 ILE 69 9.081 -22.050 0.096 533 H LYS 70 H LYS 70 13.342 -23.925 -2.888 534 HA LYS 70 HA LYS 70 14.828 -21.477 -3.028 535 HB2 LYS 70 2HB LYS 70 15.855 -24.321 -3.005 536 HB3 LYS 70 3HB LYS 70 16.787 -22.871 -2.655 537 HG2 LYS 70 2HG LYS 70 14.372 -23.411 -1.014 538 HG3 LYS 70 3HG LYS 70 15.814 -24.391 -0.738 539 HD2 LYS 70 2HD LYS 70 15.783 -21.375 -0.743 540 HD3 LYS 70 3HD LYS 70 15.665 -22.368 0.712 541 HE2 LYS 70 2HE LYS 70 17.898 -22.226 0.764 542 HE3 LYS 70 3HE LYS 70 17.860 -23.424 -0.528 543 HZ1 LYS 70 3HZ LYS 70 18.467 -20.580 -0.651 544 HZ2 LYS 70 1HZ LYS 70 17.580 -21.211 -1.946 545 HZ3 LYS 70 2HZ LYS 70 19.093 -21.862 -1.560 546 H GLN 71 H GLN 71 14.604 -24.379 -5.073 547 HA GLN 71 HA GLN 71 16.352 -23.373 -7.080 548 HB2 GLN 71 2HB GLN 71 15.951 -25.780 -6.751 549 HB3 GLN 71 3HB GLN 71 14.280 -25.568 -7.255 550 HG2 GLN 71 2HG GLN 71 15.537 -26.467 -9.079 551 HG3 GLN 71 3HG GLN 71 15.080 -24.809 -9.463 552 HE21 GLN 71 1HE2 GLN 71 17.726 -26.779 -8.209 553 HE22 GLN 71 2HE2 GLN 71 18.997 -25.776 -8.810 554 H ARG 72 H ARG 72 12.856 -23.381 -6.638 555 HA ARG 72 HA ARG 72 12.336 -22.238 -9.228 556 HB2 ARG 72 2HB ARG 72 10.673 -22.940 -6.838 557 HB3 ARG 72 3HB ARG 72 10.006 -21.884 -8.076 558 HG2 ARG 72 2HG ARG 72 10.843 -23.804 -9.677 559 HG3 ARG 72 3HG ARG 72 10.692 -24.768 -8.207 560 HD2 ARG 72 2HD ARG 72 8.367 -24.010 -7.969 561 HD3 ARG 72 3HD ARG 72 8.527 -23.082 -9.460 562 HE ARG 72 HE ARG 72 8.069 -25.894 -9.226 563 HH11 ARG 72 1HH1 ARG 72 9.502 -23.426 -11.220 564 HH12 ARG 72 2HH1 ARG 72 9.367 -24.345 -12.682 565 HH21 ARG 72 1HH2 ARG 72 7.886 -27.114 -11.144 566 HH22 ARG 72 2HH2 ARG 72 8.447 -26.443 -12.638 567 H HIS 73 H HIS 73 12.658 -21.081 -5.927 568 HA HIS 73 HA HIS 73 12.856 -18.353 -6.938 569 HB2 HIS 73 2HB HIS 73 11.126 -18.905 -4.535 570 HB3 HIS 73 3HB HIS 73 11.243 -17.425 -5.484 571 HD1 HIS 73 HD1 HIS 73 9.910 -17.326 -7.696 572 HD2 HIS 73 HD2 HIS 73 9.421 -20.865 -5.575 573 HE1 HIS 73 HE1 HIS 73 7.943 -18.480 -8.757 574 HA PRO 74 HA PRO 74 16.057 -19.460 -3.771 575 HB2 PRO 74 2HB PRO 74 18.137 -18.435 -5.183 576 HB3 PRO 74 3HB PRO 74 17.546 -20.086 -5.406 577 HG2 PRO 74 2HG PRO 74 16.987 -17.638 -7.036 578 HG3 PRO 74 3HG PRO 74 17.346 -19.287 -7.580 579 HD2 PRO 74 2HD PRO 74 14.828 -18.294 -7.503 580 HD3 PRO 74 3HD PRO 74 15.186 -20.010 -7.223 581 H MET 75 H MET 75 15.690 -16.512 -5.719 582 HA MET 75 HA MET 75 16.900 -14.847 -3.706 583 HB2 MET 75 2HB MET 75 16.196 -12.981 -5.196 584 HB3 MET 75 3HB MET 75 17.160 -14.204 -6.013 585 HG2 MET 75 2HG MET 75 15.586 -14.227 -7.570 586 HG3 MET 75 3HG MET 75 14.573 -15.066 -6.398 587 HE1 MET 75 3HE MET 75 12.656 -13.818 -4.918 588 HE2 MET 75 1HE MET 75 11.659 -12.876 -6.027 589 HE3 MET 75 2HE MET 75 12.278 -14.452 -6.520 590 H LEU 76 H LEU 76 14.003 -16.360 -3.838 591 HA LEU 76 HA LEU 76 12.445 -14.169 -2.696 592 HB2 LEU 76 2HB LEU 76 11.323 -15.485 -4.361 593 HB3 LEU 76 3HB LEU 76 11.707 -16.976 -3.503 594 HG LEU 76 HG LEU 76 10.262 -16.023 -1.605 595 HD11 LEU 76 1HD1 LEU 76 9.464 -14.225 -3.883 596 HD12 LEU 76 2HD1 LEU 76 10.056 -13.755 -2.291 597 HD13 LEU 76 3HD1 LEU 76 8.466 -14.500 -2.455 598 HD21 LEU 76 3HD2 LEU 76 9.673 -17.897 -3.157 599 HD22 LEU 76 1HD2 LEU 76 8.862 -16.713 -4.182 600 HD23 LEU 76 2HD2 LEU 76 8.292 -16.991 -2.536 601 HA PRO 77 HA PRO 77 13.636 -15.635 1.355 602 HB2 PRO 77 2HB PRO 77 12.303 -13.705 2.724 603 HB3 PRO 77 3HB PRO 77 13.857 -13.421 1.931 604 HG2 PRO 77 2HG PRO 77 11.096 -12.763 0.979 605 HG3 PRO 77 3HG PRO 77 12.571 -11.780 0.902 606 HD2 PRO 77 2HD PRO 77 11.629 -13.164 -1.227 607 HD3 PRO 77 3HD PRO 77 13.362 -12.888 -0.958 608 H VAL 78 H VAL 78 12.688 -17.047 2.712 609 HA VAL 78 HA VAL 78 9.748 -17.152 2.799 610 HB VAL 78 HB VAL 78 11.442 -19.638 2.852 611 HG11 VAL 78 1HG1 VAL 78 9.434 -20.365 3.577 612 HG12 VAL 78 2HG1 VAL 78 8.567 -18.992 2.885 613 HG13 VAL 78 3HG1 VAL 78 9.039 -20.347 1.859 614 HG21 VAL 78 3HG2 VAL 78 11.865 -18.534 0.722 615 HG22 VAL 78 1HG2 VAL 78 10.875 -19.975 0.490 616 HG23 VAL 78 2HG2 VAL 78 10.131 -18.377 0.444 617 H ILE 79 H ILE 79 8.893 -18.281 4.700 618 HA ILE 79 HA ILE 79 10.745 -18.308 6.983 619 HB ILE 79 HB ILE 79 7.983 -17.086 7.036 620 HG12 ILE 79 2HG1 ILE 79 10.526 -15.588 7.559 621 HG13 ILE 79 3HG1 ILE 79 9.998 -15.849 5.900 622 HG21 ILE 79 1HG2 ILE 79 8.777 -16.334 9.327 623 HG22 ILE 79 2HG2 ILE 79 8.379 -18.042 9.149 624 HG23 ILE 79 3HG2 ILE 79 10.065 -17.526 9.156 625 HD11 ILE 79 3HD1 ILE 79 8.991 -14.015 7.922 626 HD12 ILE 79 1HD1 ILE 79 8.866 -13.953 6.164 627 HD13 ILE 79 2HD1 ILE 79 7.724 -14.922 7.096 628 H ILE 80 H ILE 80 10.607 -20.100 8.166 629 HA ILE 80 HA ILE 80 8.393 -21.943 7.650 630 HB ILE 80 HB ILE 80 11.129 -22.317 8.836 631 HG12 ILE 80 2HG1 ILE 80 10.582 -22.370 6.308 632 HG13 ILE 80 3HG1 ILE 80 11.544 -23.682 6.980 633 HG21 ILE 80 1HG2 ILE 80 8.781 -24.191 8.959 634 HG22 ILE 80 2HG2 ILE 80 10.450 -24.729 9.132 635 HG23 ILE 80 3HG2 ILE 80 9.767 -23.591 10.292 636 HD11 ILE 80 3HD1 ILE 80 8.638 -24.119 6.960 637 HD12 ILE 80 1HD1 ILE 80 9.417 -24.038 5.381 638 HD13 ILE 80 2HD1 ILE 80 9.960 -25.219 6.573 639 H MET 81 H MET 81 7.044 -22.709 9.227 640 HA MET 81 HA MET 81 7.432 -21.739 11.967 641 HB2 MET 81 2HB MET 81 4.672 -21.695 10.831 642 HB3 MET 81 3HB MET 81 5.357 -20.742 12.140 643 HG2 MET 81 2HG MET 81 6.602 -19.404 10.542 644 HG3 MET 81 3HG MET 81 5.972 -20.380 9.217 645 HE1 MET 81 3HE MET 81 2.506 -19.691 8.766 646 HE2 MET 81 1HE MET 81 3.507 -21.016 9.360 647 HE3 MET 81 2HE MET 81 2.371 -20.215 10.445 648 H THR 82 H THR 82 7.079 -23.258 13.459 649 HA THR 82 HA THR 82 5.104 -25.267 13.296 650 HB THR 82 HB THR 82 6.385 -26.397 11.664 651 HG1 THR 82 HG1 THR 82 5.832 -27.943 13.097 652 HG21 THR 82 3HG2 THR 82 8.475 -25.001 12.194 653 HG22 THR 82 1HG2 THR 82 8.715 -26.660 11.646 654 HG23 THR 82 2HG2 THR 82 8.862 -26.267 13.359 655 H ALA 83 H ALA 83 8.393 -24.686 14.532 656 HA ALA 83 HA ALA 83 9.211 -24.607 16.659 657 HB1 ALA 83 1HB ALA 83 6.980 -24.892 18.337 658 HB2 ALA 83 2HB ALA 83 7.827 -23.405 17.908 659 HB3 ALA 83 3HB ALA 83 6.440 -23.936 16.956 660 H HIS 84 H HIS 84 8.660 -25.907 18.956 661 HA HIS 84 HA HIS 84 9.231 -27.943 19.867 662 HB2 HIS 84 2HB HIS 84 7.394 -29.521 19.790 663 HB3 HIS 84 3HB HIS 84 6.746 -27.885 19.873 664 HD1 HIS 84 HD1 HIS 84 6.825 -30.910 17.747 665 HD2 HIS 84 HD2 HIS 84 5.521 -26.975 17.465 666 HE1 HIS 84 HE1 HIS 84 5.325 -30.842 15.729 667 H SER 85 H SER 85 8.501 -30.547 18.802 668 HA SER 85 HA SER 85 10.859 -31.217 17.482 669 HB2 SER 85 2HB SER 85 9.806 -33.386 17.033 670 HB3 SER 85 3HB SER 85 9.451 -32.852 18.675 671 HG SER 85 HG SER 85 7.451 -33.157 18.118 672 H ASP 86 H ASP 86 11.242 -29.884 15.724 673 HA ASP 86 HA ASP 86 10.493 -30.754 13.217 674 HB2 ASP 86 2HB ASP 86 8.510 -28.997 14.434 675 HB3 ASP 86 3HB ASP 86 9.105 -28.373 12.898 676 H LEU 87 H LEU 87 11.258 -27.903 15.146 677 HA LEU 87 HA LEU 87 12.573 -26.484 13.064 678 HB2 LEU 87 2HB LEU 87 12.043 -26.142 15.887 679 HB3 LEU 87 3HB LEU 87 13.678 -25.632 15.472 680 HG LEU 87 HG LEU 87 12.843 -24.015 13.910 681 HD11 LEU 87 1HD1 LEU 87 11.009 -25.030 12.881 682 HD12 LEU 87 2HD1 LEU 87 10.308 -23.695 13.795 683 HD13 LEU 87 3HD1 LEU 87 10.201 -25.342 14.417 684 HD21 LEU 87 3HD2 LEU 87 11.857 -22.486 15.397 685 HD22 LEU 87 1HD2 LEU 87 12.835 -23.547 16.411 686 HD23 LEU 87 2HD2 LEU 87 11.086 -23.766 16.336 687 H ASP 88 H ASP 88 13.650 -28.727 15.560 688 HA ASP 88 HA ASP 88 16.371 -28.445 15.468 689 HB2 ASP 88 2HB ASP 88 14.885 -30.111 16.804 690 HB3 ASP 88 3HB ASP 88 15.162 -31.194 15.442 691 H ALA 89 H ALA 89 14.278 -29.911 13.077 692 HA ALA 89 HA ALA 89 16.505 -30.920 11.516 693 HB1 ALA 89 1HB ALA 89 14.933 -32.366 10.908 694 HB2 ALA 89 2HB ALA 89 13.661 -31.371 11.619 695 HB3 ALA 89 3HB ALA 89 14.193 -31.072 9.965 696 H ALA 90 H ALA 90 13.945 -28.478 11.124 697 HA ALA 90 HA ALA 90 14.776 -27.499 8.635 698 HB1 ALA 90 1HB ALA 90 12.731 -26.656 9.044 699 HB2 ALA 90 2HB ALA 90 12.992 -26.587 10.788 700 HB3 ALA 90 3HB ALA 90 13.636 -25.316 9.749 701 H VAL 91 H VAL 91 16.129 -27.108 11.762 702 HA VAL 91 HA VAL 91 17.308 -24.668 11.827 703 HB VAL 91 HB VAL 91 18.439 -27.344 12.607 704 HG11 VAL 91 1HG1 VAL 91 20.466 -26.360 12.449 705 HG12 VAL 91 2HG1 VAL 91 19.798 -24.728 12.485 706 HG13 VAL 91 3HG1 VAL 91 19.994 -25.635 13.985 707 HG21 VAL 91 3HG2 VAL 91 17.341 -27.005 14.512 708 HG22 VAL 91 1HG2 VAL 91 18.073 -25.413 14.707 709 HG23 VAL 91 2HG2 VAL 91 16.590 -25.593 13.770 710 H SER 92 H SER 92 18.978 -27.500 10.436 711 HA SER 92 HA SER 92 20.739 -25.734 8.946 712 HB2 SER 92 2HB SER 92 21.986 -27.495 9.786 713 HB3 SER 92 3HB SER 92 20.685 -28.663 9.557 714 HG SER 92 HG SER 92 22.135 -27.447 7.442 715 H ALA 93 H ALA 93 18.454 -28.366 8.233 716 HA ALA 93 HA ALA 93 18.583 -28.477 5.512 717 HB1 ALA 93 1HB ALA 93 17.148 -30.015 6.481 718 HB2 ALA 93 2HB ALA 93 16.281 -28.783 7.398 719 HB3 ALA 93 3HB ALA 93 16.037 -28.921 5.657 720 H TYR 94 H TYR 94 17.060 -25.993 7.469 721 HA TYR 94 HA TYR 94 15.930 -24.665 5.149 722 HB2 TYR 94 2HB TYR 94 14.914 -24.790 7.541 723 HB3 TYR 94 3HB TYR 94 16.030 -23.479 7.907 724 HD1 TYR 94 HD2 TYR 94 14.137 -24.070 4.761 725 HD2 TYR 94 HD1 TYR 94 14.610 -21.646 8.226 726 HE1 TYR 94 HE2 TYR 94 12.531 -22.450 3.841 727 HE2 TYR 94 HE1 TYR 94 13.004 -20.021 7.316 728 HH TYR 94 HH TYR 94 10.901 -20.634 4.965 729 H GLN 95 H GLN 95 18.590 -24.244 7.416 730 HA GLN 95 HA GLN 95 19.371 -21.660 6.643 731 HB2 GLN 95 2HB GLN 95 21.180 -21.962 8.009 732 HB3 GLN 95 3HB GLN 95 20.158 -23.261 8.607 733 HG2 GLN 95 2HG GLN 95 22.049 -24.453 8.343 734 HG3 GLN 95 3HG GLN 95 21.445 -24.596 6.693 735 HE21 GLN 95 1HE2 GLN 95 23.561 -24.911 5.941 736 HE22 GLN 95 2HE2 GLN 95 24.670 -23.596 5.789 737 H GLN 96 H GLN 96 19.220 -24.346 4.766 738 HA GLN 96 HA GLN 96 21.668 -24.114 3.303 739 HB2 GLN 96 2HB GLN 96 19.082 -25.575 2.832 740 HB3 GLN 96 3HB GLN 96 20.347 -25.541 1.611 741 HG2 GLN 96 2HG GLN 96 21.499 -26.247 4.121 742 HG3 GLN 96 3HG GLN 96 20.095 -27.269 3.817 743 HE21 GLN 96 1HE2 GLN 96 23.277 -26.382 2.783 744 HE22 GLN 96 2HE2 GLN 96 23.495 -27.668 1.650 745 H GLY 97 H GLY 97 20.229 -21.629 3.588 746 HA2 GLY 97 2HA GLY 97 20.475 -19.907 1.872 747 HA3 GLY 97 3HA GLY 97 19.780 -21.046 0.728 748 H ALA 98 H ALA 98 18.564 -20.539 3.980 749 HA ALA 98 HA ALA 98 16.188 -19.230 2.827 750 HB1 ALA 98 1HB ALA 98 16.009 -21.008 5.229 751 HB2 ALA 98 2HB ALA 98 14.742 -20.521 4.103 752 HB3 ALA 98 3HB ALA 98 15.968 -21.684 3.601 753 H PHE 99 H PHE 99 14.840 -18.174 4.643 754 HA PHE 99 HA PHE 99 16.668 -16.487 6.173 755 HB2 PHE 99 2HB PHE 99 15.148 -15.197 4.904 756 HB3 PHE 99 3HB PHE 99 13.782 -16.209 5.359 757 HD1 PHE 99 HD2 PHE 99 16.175 -13.689 6.608 758 HD2 PHE 99 HD1 PHE 99 12.517 -15.755 7.290 759 HE1 PHE 99 HE2 PHE 99 15.646 -12.139 8.444 760 HE2 PHE 99 HE1 PHE 99 11.982 -14.208 9.127 761 HZ PHE 99 HZ PHE 99 13.548 -12.398 9.707 762 H ASP 100 H ASP 100 16.381 -16.065 8.392 763 HA ASP 100 HA ASP 100 16.043 -18.175 10.075 764 HB2 ASP 100 2HB ASP 100 16.945 -15.920 10.692 765 HB3 ASP 100 3HB ASP 100 15.286 -15.336 10.789 766 H TYR 101 H TYR 101 14.395 -19.462 10.525 767 HA TYR 101 HA TYR 101 11.716 -18.806 9.759 768 HB2 TYR 101 2HB TYR 101 11.217 -21.032 10.927 769 HB3 TYR 101 3HB TYR 101 12.280 -21.081 9.525 770 HD1 TYR 101 HD2 TYR 101 12.778 -20.387 13.170 771 HD2 TYR 101 HD1 TYR 101 13.940 -22.656 9.764 772 HE1 TYR 101 HE2 TYR 101 14.493 -21.521 14.519 773 HE2 TYR 101 HE1 TYR 101 15.658 -23.798 11.103 774 HH TYR 101 HH TYR 101 16.281 -22.879 14.460 775 H LEU 102 H LEU 102 9.913 -19.358 11.426 776 HA LEU 102 HA LEU 102 10.550 -18.171 14.036 777 HB2 LEU 102 2HB LEU 102 9.580 -16.316 13.142 778 HB3 LEU 102 3HB LEU 102 8.602 -17.242 12.005 779 HG LEU 102 HG LEU 102 7.219 -17.923 14.062 780 HD11 LEU 102 1HD1 LEU 102 7.451 -15.671 15.595 781 HD12 LEU 102 2HD1 LEU 102 9.133 -16.056 15.232 782 HD13 LEU 102 3HD1 LEU 102 8.101 -17.259 16.004 783 HD21 LEU 102 3HD2 LEU 102 6.269 -15.400 14.012 784 HD22 LEU 102 1HD2 LEU 102 5.970 -16.589 12.744 785 HD23 LEU 102 2HD2 LEU 102 7.255 -15.396 12.549 786 HA PRO 103 HA PRO 103 8.385 -21.891 15.228 787 HB2 PRO 103 2HB PRO 103 8.742 -21.553 17.897 788 HB3 PRO 103 3HB PRO 103 10.015 -22.151 16.826 789 HG2 PRO 103 2HG PRO 103 9.584 -19.390 17.900 790 HG3 PRO 103 3HG PRO 103 11.093 -20.309 17.749 791 HD2 PRO 103 2HD PRO 103 10.374 -18.388 15.981 792 HD3 PRO 103 3HD PRO 103 11.315 -19.817 15.508 793 H LYS 104 H LYS 104 6.341 -22.339 15.929 794 HA LYS 104 HA LYS 104 4.704 -20.033 16.737 795 HB2 LYS 104 2HB LYS 104 4.163 -22.475 15.115 796 HB3 LYS 104 3HB LYS 104 2.838 -21.799 16.053 797 HG2 LYS 104 2HG LYS 104 3.001 -19.709 14.905 798 HG3 LYS 104 3HG LYS 104 4.480 -20.219 14.088 799 HD2 LYS 104 2HD LYS 104 3.288 -21.124 12.444 800 HD3 LYS 104 3HD LYS 104 2.435 -22.151 13.598 801 HE2 LYS 104 2HE LYS 104 1.699 -19.346 12.773 802 HE3 LYS 104 3HE LYS 104 0.837 -20.829 12.366 803 HZ1 LYS 104 3HZ LYS 104 1.051 -19.501 14.999 804 HZ2 LYS 104 1HZ LYS 104 0.578 -21.119 14.857 805 HZ3 LYS 104 2HZ LYS 104 -0.346 -19.901 14.133 806 HA PRO 105 HA PRO 105 2.480 -19.894 17.368 807 HB2 PRO 105 2HB PRO 105 1.789 -18.516 19.602 808 HB3 PRO 105 3HB PRO 105 0.926 -19.960 19.059 809 HG2 PRO 105 2HG PRO 105 3.026 -19.692 21.176 810 HG3 PRO 105 3HG PRO 105 1.518 -20.625 21.207 811 HD2 PRO 105 2HD PRO 105 3.926 -21.763 20.717 812 HD3 PRO 105 3HD PRO 105 2.421 -22.362 19.990 813 H PHE 106 H PHE 106 2.538 -17.400 17.688 814 HA PHE 106 HA PHE 106 5.033 -16.359 18.708 815 HB2 PHE 106 2HB PHE 106 5.696 -15.367 16.518 816 HB3 PHE 106 3HB PHE 106 5.796 -17.124 16.548 817 HD1 PHE 106 HD1 PHE 106 3.422 -14.402 15.630 818 HD2 PHE 106 HD2 PHE 106 4.888 -18.310 14.800 819 HE1 PHE 106 HE1 PHE 106 1.992 -14.510 13.631 820 HE2 PHE 106 HE2 PHE 106 3.462 -18.425 12.799 821 HZ PHE 106 HZ PHE 106 2.012 -16.523 12.212 822 H ASP 107 H ASP 107 5.176 -13.953 18.313 823 HA ASP 107 HA ASP 107 2.546 -12.803 18.793 824 HB2 ASP 107 2HB ASP 107 5.343 -11.697 19.069 825 HB3 ASP 107 3HB ASP 107 3.893 -10.735 19.343 826 H ILE 108 H ILE 108 1.411 -12.148 17.094 827 HA ILE 108 HA ILE 108 2.192 -11.824 14.508 828 HB ILE 108 HB ILE 108 0.033 -10.419 16.054 829 HG12 ILE 108 2HG1 ILE 108 -0.384 -12.251 13.729 830 HG13 ILE 108 3HG1 ILE 108 0.104 -12.944 15.272 831 HG21 ILE 108 1HG2 ILE 108 0.752 -10.074 13.154 832 HG22 ILE 108 2HG2 ILE 108 -0.850 -9.713 13.795 833 HG23 ILE 108 3HG2 ILE 108 0.556 -8.827 14.385 834 HD11 ILE 108 3HD1 ILE 108 -1.995 -12.893 15.943 835 HD12 ILE 108 1HD1 ILE 108 -2.009 -11.137 15.777 836 HD13 ILE 108 2HD1 ILE 108 -2.477 -12.156 14.415 837 H ASP 109 H ASP 109 2.472 -9.475 17.108 838 HA ASP 109 HA ASP 109 3.068 -7.182 15.673 839 HB2 ASP 109 2HB ASP 109 2.911 -7.740 18.296 840 HB3 ASP 109 3HB ASP 109 4.664 -7.678 18.128 841 H GLU 110 H GLU 110 5.246 -9.779 16.719 842 HA GLU 110 HA GLU 110 7.554 -8.541 15.535 843 HB2 GLU 110 2HB GLU 110 7.439 -10.190 17.544 844 HB3 GLU 110 3HB GLU 110 7.405 -11.438 16.307 845 HG2 GLU 110 2HG GLU 110 9.536 -9.337 16.334 846 HG3 GLU 110 3HG GLU 110 9.661 -10.789 17.325 847 H ALA 111 H ALA 111 5.159 -10.885 14.577 848 HA ALA 111 HA ALA 111 6.544 -12.015 12.388 849 HB1 ALA 111 1HB ALA 111 4.442 -12.923 11.713 850 HB2 ALA 111 2HB ALA 111 4.505 -12.969 13.475 851 HB3 ALA 111 3HB ALA 111 3.558 -11.725 12.659 852 H VAL 112 H VAL 112 4.008 -9.504 12.463 853 HA VAL 112 HA VAL 112 3.963 -8.865 9.778 854 HB VAL 112 HB VAL 112 3.497 -7.157 12.211 855 HG11 VAL 112 1HG1 VAL 112 2.353 -5.639 10.401 856 HG12 VAL 112 2HG1 VAL 112 4.070 -5.463 10.770 857 HG13 VAL 112 3HG1 VAL 112 3.562 -6.361 9.339 858 HG21 VAL 112 3HG2 VAL 112 1.172 -7.357 11.587 859 HG22 VAL 112 1HG2 VAL 112 1.610 -8.211 10.107 860 HG23 VAL 112 2HG2 VAL 112 1.893 -8.964 11.677 861 H ALA 113 H ALA 113 6.247 -7.868 12.250 862 HA ALA 113 HA ALA 113 7.583 -5.994 10.493 863 HB1 ALA 113 1HB ALA 113 9.214 -5.855 12.427 864 HB2 ALA 113 2HB ALA 113 7.557 -5.349 12.760 865 HB3 ALA 113 3HB ALA 113 8.120 -6.931 13.298 866 H LEU 114 H LEU 114 7.854 -9.321 11.393 867 HA LEU 114 HA LEU 114 10.579 -9.724 10.750 868 HB2 LEU 114 2HB LEU 114 9.368 -11.320 12.090 869 HB3 LEU 114 3HB LEU 114 8.243 -11.627 10.769 870 HG LEU 114 HG LEU 114 10.310 -12.467 9.484 871 HD11 LEU 114 1HD1 LEU 114 12.067 -11.690 10.873 872 HD12 LEU 114 2HD1 LEU 114 12.025 -13.445 11.037 873 HD13 LEU 114 3HD1 LEU 114 11.350 -12.424 12.307 874 HD21 LEU 114 3HD2 LEU 114 10.174 -14.637 11.056 875 HD22 LEU 114 1HD2 LEU 114 8.910 -14.189 9.911 876 HD23 LEU 114 2HD2 LEU 114 8.741 -13.774 11.617 877 H VAL 115 H VAL 115 7.594 -10.140 8.874 878 HA VAL 115 HA VAL 115 8.786 -11.115 6.526 879 HB VAL 115 HB VAL 115 6.399 -11.299 6.851 880 HG11 VAL 115 1HG1 VAL 115 6.254 -8.300 6.573 881 HG12 VAL 115 2HG1 VAL 115 4.909 -9.410 6.844 882 HG13 VAL 115 3HG1 VAL 115 6.125 -9.173 8.100 883 HG21 VAL 115 3HG2 VAL 115 6.201 -11.346 4.639 884 HG22 VAL 115 1HG2 VAL 115 6.034 -9.590 4.606 885 HG23 VAL 115 2HG2 VAL 115 7.633 -10.327 4.491 886 H GLU 116 H GLU 116 8.120 -7.823 7.624 887 HA GLU 116 HA GLU 116 8.679 -6.427 5.292 888 HB2 GLU 116 2HB GLU 116 8.121 -5.769 7.927 889 HB3 GLU 116 3HB GLU 116 9.727 -5.101 7.667 890 HG2 GLU 116 2HG GLU 116 8.964 -3.778 5.839 891 HG3 GLU 116 3HG GLU 116 7.393 -4.577 5.847 892 H ARG 117 H ARG 117 10.841 -7.928 7.583 893 HA ARG 117 HA ARG 117 13.216 -6.633 6.685 894 HB2 ARG 117 2HB ARG 117 13.353 -7.527 8.848 895 HB3 ARG 117 3HB ARG 117 12.654 -9.064 8.356 896 HG2 ARG 117 2HG ARG 117 14.631 -9.891 7.624 897 HG3 ARG 117 3HG ARG 117 15.233 -8.310 7.122 898 HD2 ARG 117 2HD ARG 117 14.909 -9.117 10.004 899 HD3 ARG 117 3HD ARG 117 16.402 -9.355 9.097 900 HE ARG 117 HE ARG 117 15.668 -6.683 8.828 901 HH11 ARG 117 1HH1 ARG 117 16.673 -8.884 11.331 902 HH12 ARG 117 2HH1 ARG 117 17.416 -7.652 12.297 903 HH21 ARG 117 1HH2 ARG 117 16.643 -5.052 10.091 904 HH22 ARG 117 2HH2 ARG 117 17.398 -5.473 11.591 905 H ALA 118 H ALA 118 11.374 -9.360 5.609 906 HA ALA 118 HA ALA 118 13.510 -10.453 3.991 907 HB1 ALA 118 1HB ALA 118 12.280 -12.280 4.267 908 HB2 ALA 118 2HB ALA 118 10.935 -11.337 4.913 909 HB3 ALA 118 3HB ALA 118 11.086 -11.582 3.173 910 H ILE 119 H ILE 119 10.635 -8.475 3.549 911 HA ILE 119 HA ILE 119 10.806 -8.482 0.680 912 HB ILE 119 HB ILE 119 9.223 -6.681 2.518 913 HG12 ILE 119 2HG1 ILE 119 8.075 -8.902 0.865 914 HG13 ILE 119 3HG1 ILE 119 8.821 -9.271 2.416 915 HG21 ILE 119 1HG2 ILE 119 9.034 -7.116 -0.460 916 HG22 ILE 119 2HG2 ILE 119 7.882 -6.195 0.506 917 HG23 ILE 119 3HG2 ILE 119 9.550 -5.642 0.359 918 HD11 ILE 119 3HD1 ILE 119 7.189 -8.197 3.608 919 HD12 ILE 119 1HD1 ILE 119 6.765 -7.125 2.273 920 HD13 ILE 119 2HD1 ILE 119 6.262 -8.816 2.242 921 H SER 120 H SER 120 11.434 -6.070 3.223 922 HA SER 120 HA SER 120 12.314 -4.007 1.562 923 HB2 SER 120 2HB SER 120 13.063 -4.675 4.416 924 HB3 SER 120 3HB SER 120 13.515 -3.173 3.610 925 HG SER 120 HG SER 120 11.638 -2.728 4.646 926 H HIS 121 H HIS 121 13.907 -6.897 2.628 927 HA HIS 121 HA HIS 121 16.581 -6.234 2.354 928 HB2 HIS 121 2HB HIS 121 15.601 -8.431 3.157 929 HB3 HIS 121 3HB HIS 121 15.400 -8.866 1.463 930 HD1 HIS 121 HD1 HIS 121 17.532 -9.429 0.122 931 HD2 HIS 121 HD2 HIS 121 18.237 -8.483 4.106 932 HE1 HIS 121 HE1 HIS 121 19.907 -10.125 0.568 933 H TYR 122 H TYR 122 14.161 -6.732 -0.091 934 HA TYR 122 HA TYR 122 15.834 -7.198 -2.302 935 HB2 TYR 122 2HB TYR 122 13.043 -6.162 -1.969 936 HB3 TYR 122 3HB TYR 122 13.809 -6.099 -3.552 937 HD1 TYR 122 HD1 TYR 122 12.776 -8.394 -0.832 938 HD2 TYR 122 HD2 TYR 122 13.974 -8.032 -4.899 939 HE1 TYR 122 HE1 TYR 122 12.154 -10.742 -1.219 940 HE2 TYR 122 HE2 TYR 122 13.354 -10.378 -5.297 941 HH TYR 122 HH TYR 122 11.509 -12.053 -3.925 942 H GLN 123 H GLN 123 14.478 -4.184 -0.997 943 HA GLN 123 HA GLN 123 16.128 -2.635 -2.845 944 HB2 GLN 123 2HB GLN 123 14.064 -1.679 -0.854 945 HB3 GLN 123 3HB GLN 123 14.843 -0.705 -2.093 946 HG2 GLN 123 2HG GLN 123 13.457 -1.411 -3.691 947 HG3 GLN 123 3HG GLN 123 13.513 -3.083 -3.136 948 HE21 GLN 123 1HE2 GLN 123 11.749 -3.875 -2.235 949 HE22 GLN 123 2HE2 GLN 123 10.423 -2.953 -1.621 950 H GLU 124 H GLU 124 17.455 -4.104 -0.797 951 HA GLU 124 HA GLU 124 18.075 -2.729 1.515 952 HB2 GLU 124 2HB GLU 124 19.077 -4.969 0.145 953 HB3 GLU 124 3HB GLU 124 20.460 -3.915 0.406 954 HG2 GLU 124 2HG GLU 124 19.973 -3.853 2.793 955 HG3 GLU 124 3HG GLU 124 18.576 -4.897 2.538
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