NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
572997 | 2mao | 19366 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 0.524 5.205 5.447 2 H2 MET 1 H2 MET 1 1.792 4.735 6.380 3 H3 MET 1 H3 MET 1 0.593 3.664 6.021 4 HA MET 1 HA MET 1 1.151 3.713 3.705 5 HB2 MET 1 2HB MET 1 3.411 5.518 4.646 6 HB3 MET 1 3HB MET 1 3.262 4.817 3.021 7 HG2 MET 1 2HG MET 1 1.298 6.731 4.333 8 HG3 MET 1 3HG MET 1 2.452 7.128 3.061 9 HE1 MET 1 1HE MET 1 -0.619 7.842 2.958 10 HE2 MET 1 2HE MET 1 0.531 8.249 1.659 11 HE3 MET 1 3HE MET 1 -1.004 7.451 1.264 12 H SER 2 H SER 2 2.935 2.394 2.780 13 HA SER 2 HA SER 2 4.564 0.956 4.802 14 HB2 SER 2 2HB SER 2 2.678 -0.376 2.818 15 HB3 SER 2 3HB SER 2 3.816 -1.217 3.891 16 HG SER 2 HG SER 2 1.693 -1.122 4.745 17 H GLU 3 H GLU 3 6.227 -0.403 3.799 18 HA GLU 3 HA GLU 3 7.371 0.949 1.464 19 HB2 GLU 3 2HB GLU 3 8.422 -1.315 3.207 20 HB3 GLU 3 3HB GLU 3 9.340 -0.474 1.954 21 HG2 GLU 3 2HG GLU 3 8.178 0.786 4.475 22 HG3 GLU 3 3HG GLU 3 9.877 0.413 4.179 23 H GLN 4 H GLN 4 8.294 -0.292 -0.348 24 HA GLN 4 HA GLN 4 6.349 -2.300 -1.279 25 HB2 GLN 4 2HB GLN 4 8.636 -0.821 -2.644 26 HB3 GLN 4 3HB GLN 4 7.598 -2.017 -3.443 27 HG2 GLN 4 2HG GLN 4 5.599 -0.644 -2.907 28 HG3 GLN 4 3HG GLN 4 6.645 0.572 -2.140 29 HE21 GLN 4 2HE2 GLN 4 5.952 -1.088 -5.246 30 HE22 GLN 4 1HE2 GLN 4 6.528 0.220 -6.266 31 H LEU 5 H LEU 5 9.149 -2.419 0.490 32 HA LEU 5 HA LEU 5 9.859 -5.088 -0.643 33 HB2 LEU 5 2HB LEU 5 11.685 -3.137 0.804 34 HB3 LEU 5 3HB LEU 5 12.123 -4.727 0.189 35 HG LEU 5 HG LEU 5 13.053 -3.117 -1.261 36 HD11 LEU 5 1HD1 LEU 5 12.029 -3.643 -3.430 37 HD12 LEU 5 2HD1 LEU 5 12.169 -5.075 -2.400 38 HD13 LEU 5 3HD1 LEU 5 10.586 -4.272 -2.611 39 HD21 LEU 5 3HD2 LEU 5 10.336 -1.899 -1.825 40 HD22 LEU 5 1HD2 LEU 5 11.523 -1.222 -0.677 41 HD23 LEU 5 2HD2 LEU 5 11.922 -1.372 -2.401 42 H THR 6 H THR 6 10.357 -6.725 0.842 43 HA THR 6 HA THR 6 9.584 -6.258 3.671 44 HB THR 6 HB THR 6 8.387 -8.414 1.886 45 HG1 THR 6 1HG THR 6 6.509 -7.156 2.050 46 HG21 THR 6 1HG2 THR 6 6.750 -8.546 3.838 47 HG22 THR 6 2HG2 THR 6 8.369 -9.186 4.146 48 HG23 THR 6 3HG2 THR 6 7.920 -7.580 4.770 49 H ASP 7 H ASP 7 9.965 -8.440 4.911 50 HA ASP 7 HA ASP 7 12.692 -9.062 4.797 51 HB2 ASP 7 2HB ASP 7 12.142 -10.862 6.345 52 HB3 ASP 7 3HB ASP 7 11.261 -9.379 6.749 53 H GLN 8 H GLN 8 10.138 -10.274 2.777 54 HA GLN 8 HA GLN 8 11.287 -12.802 2.095 55 HB2 GLN 8 2HB GLN 8 8.961 -12.226 1.599 56 HB3 GLN 8 3HB GLN 8 9.482 -10.883 0.569 57 HG2 GLN 8 2HG GLN 8 8.819 -12.805 -0.797 58 HG3 GLN 8 3HG GLN 8 10.543 -12.477 -0.999 59 HE21 GLN 8 2HE2 GLN 8 12.103 -13.896 0.021 60 HE22 GLN 8 1HE2 GLN 8 11.648 -15.529 0.471 61 H VAL 9 H VAL 9 11.484 -9.560 0.519 62 HA VAL 9 HA VAL 9 13.461 -10.593 -1.383 63 HB VAL 9 HB VAL 9 11.765 -9.156 -2.255 64 HG11 VAL 9 1HG1 VAL 9 12.627 -7.073 -0.221 65 HG12 VAL 9 2HG1 VAL 9 11.415 -6.862 -1.508 66 HG13 VAL 9 3HG1 VAL 9 11.103 -8.006 -0.196 67 HG21 VAL 9 3HG2 VAL 9 14.305 -7.495 -2.007 68 HG22 VAL 9 1HG2 VAL 9 14.069 -8.834 -3.159 69 HG23 VAL 9 2HG2 VAL 9 13.066 -7.369 -3.270 70 H LEU 10 H LEU 10 13.405 -8.765 1.647 71 HA LEU 10 HA LEU 10 16.046 -7.652 1.353 72 HB2 LEU 10 2HB LEU 10 13.993 -7.959 3.506 73 HB3 LEU 10 3HB LEU 10 15.672 -7.758 4.024 74 HG LEU 10 HG LEU 10 15.910 -5.700 2.788 75 HD11 LEU 10 1HD1 LEU 10 13.990 -4.625 1.662 76 HD12 LEU 10 2HD1 LEU 10 14.481 -6.123 0.853 77 HD13 LEU 10 3HD1 LEU 10 13.034 -6.106 1.901 78 HD21 LEU 10 3HD2 LEU 10 13.312 -5.766 4.381 79 HD22 LEU 10 1HD2 LEU 10 14.950 -5.602 5.061 80 HD23 LEU 10 2HD2 LEU 10 14.280 -4.310 4.039 81 H VAL 11 H VAL 11 14.809 -10.832 2.424 82 HA VAL 11 HA VAL 11 17.461 -11.556 3.446 83 HB VAL 11 HB VAL 11 14.900 -13.129 3.044 84 HG11 VAL 11 1HG1 VAL 11 17.606 -14.029 4.141 85 HG12 VAL 11 2HG1 VAL 11 16.085 -14.934 4.313 86 HG13 VAL 11 3HG1 VAL 11 16.778 -14.680 2.705 87 HG21 VAL 11 3HG2 VAL 11 15.014 -11.484 4.947 88 HG22 VAL 11 1HG2 VAL 11 14.948 -13.163 5.513 89 HG23 VAL 11 2HG2 VAL 11 16.496 -12.286 5.511 90 H GLU 12 H GLU 12 15.641 -11.811 0.389 91 HA GLU 12 HA GLU 12 17.508 -13.670 -0.816 92 HB2 GLU 12 2HB GLU 12 15.523 -11.652 -1.928 93 HB3 GLU 12 3HB GLU 12 16.545 -12.667 -2.960 94 HG2 GLU 12 2HG GLU 12 15.643 -14.695 -1.901 95 HG3 GLU 12 3HG GLU 12 14.591 -13.708 -0.872 96 H ARG 13 H ARG 13 17.349 -10.120 -0.479 97 HA ARG 13 HA ARG 13 19.382 -9.635 -2.457 98 HB2 ARG 13 2HB ARG 13 17.627 -8.029 -1.887 99 HB3 ARG 13 3HB ARG 13 18.278 -7.858 -0.242 100 HG2 ARG 13 2HG ARG 13 20.299 -6.872 -1.065 101 HG3 ARG 13 3HG ARG 13 19.939 -7.368 -2.742 102 HD2 ARG 13 2HD ARG 13 17.929 -5.868 -2.683 103 HD3 ARG 13 3HD ARG 13 18.477 -5.260 -1.103 104 HE ARG 13 HE ARG 13 20.634 -5.058 -2.942 105 HH11 ARG 13 1HH1 ARG 13 17.465 -3.608 -2.359 106 HH12 ARG 13 2HH1 ARG 13 17.877 -2.112 -3.172 107 HH21 ARG 13 1HH2 ARG 13 21.126 -3.149 -4.011 108 HH22 ARG 13 2HH2 ARG 13 19.962 -1.842 -4.089 109 H VAL 14 H VAL 14 19.478 -10.030 1.117 110 HA VAL 14 HA VAL 14 22.273 -9.308 1.288 111 HB VAL 14 HB VAL 14 22.158 -10.250 3.538 112 HG11 VAL 14 1HG1 VAL 14 19.784 -8.542 2.697 113 HG12 VAL 14 2HG1 VAL 14 20.297 -8.804 4.376 114 HG13 VAL 14 3HG1 VAL 14 21.389 -7.987 3.219 115 HG21 VAL 14 3HG2 VAL 14 19.358 -11.114 2.756 116 HG22 VAL 14 1HG2 VAL 14 20.719 -12.182 3.202 117 HG23 VAL 14 2HG2 VAL 14 20.014 -11.083 4.409 118 H GLN 15 H GLN 15 20.532 -12.272 0.453 119 HA GLN 15 HA GLN 15 22.885 -13.971 0.739 120 HB2 GLN 15 2HB GLN 15 20.170 -14.336 -0.568 121 HB3 GLN 15 3HB GLN 15 21.418 -15.594 -0.529 122 HG2 GLN 15 2HG GLN 15 21.436 -15.561 1.928 123 HG3 GLN 15 3HG GLN 15 20.255 -14.264 1.959 124 HE21 GLN 15 2HE2 GLN 15 19.588 -16.505 3.353 125 HE22 GLN 15 1HE2 GLN 15 18.359 -17.423 2.511 126 H LYS 16 H LYS 16 21.645 -11.739 -1.655 127 HA LYS 16 HA LYS 16 23.263 -12.828 -3.812 128 HB2 LYS 16 2HB LYS 16 21.049 -11.013 -3.516 129 HB3 LYS 16 3HB LYS 16 22.385 -10.121 -4.258 130 HG2 LYS 16 2HG LYS 16 21.129 -11.149 -6.036 131 HG3 LYS 16 3HG LYS 16 22.679 -12.004 -5.875 132 HD2 LYS 16 2HD LYS 16 21.012 -13.682 -6.171 133 HD3 LYS 16 3HD LYS 16 21.441 -13.744 -4.457 134 HE2 LYS 16 2HE LYS 16 19.448 -12.373 -3.915 135 HE3 LYS 16 3HE LYS 16 19.026 -12.309 -5.639 136 HZ1 LYS 16 3HZ LYS 16 18.834 -14.699 -5.604 137 HZ2 LYS 16 1HZ LYS 16 19.188 -14.746 -3.999 138 HZ3 LYS 16 2HZ LYS 16 17.807 -14.020 -4.515 139 H GLY 17 H GLY 17 23.978 -11.079 -1.031 140 HA2 GLY 17 2HA GLY 17 26.330 -10.743 -0.587 141 HA3 GLY 17 3HA GLY 17 26.558 -10.225 -2.261 142 H ASP 18 H ASP 18 23.691 -8.789 -1.276 143 HA ASP 18 HA ASP 18 25.064 -6.221 -0.782 144 HB2 ASP 18 2HB ASP 18 22.265 -7.115 -1.464 145 HB3 ASP 18 3HB ASP 18 22.521 -5.515 -0.781 146 H GLN 19 H GLN 19 25.944 -6.724 1.311 147 HA GLN 19 HA GLN 19 24.347 -7.557 3.514 148 HB2 GLN 19 2HB GLN 19 26.798 -7.717 3.334 149 HB3 GLN 19 3HB GLN 19 26.950 -5.963 3.425 150 HG2 GLN 19 2HG GLN 19 25.546 -7.555 5.602 151 HG3 GLN 19 3HG GLN 19 27.303 -7.412 5.577 152 HE21 GLN 19 2HE2 GLN 19 25.899 -6.474 7.774 153 HE22 GLN 19 1HE2 GLN 19 25.986 -4.728 7.804 154 H LYS 20 H LYS 20 24.632 -4.492 1.885 155 HA LYS 20 HA LYS 20 23.876 -2.731 3.988 156 HB2 LYS 20 2HB LYS 20 23.275 -1.224 2.132 157 HB3 LYS 20 3HB LYS 20 24.829 -2.029 1.842 158 HG2 LYS 20 2HG LYS 20 23.609 -3.729 0.416 159 HG3 LYS 20 3HG LYS 20 22.138 -2.746 0.602 160 HD2 LYS 20 2HD LYS 20 23.328 -0.812 -0.407 161 HD3 LYS 20 3HD LYS 20 24.792 -1.816 -0.572 162 HE2 LYS 20 2HE LYS 20 23.530 -3.402 -1.995 163 HE3 LYS 20 3HE LYS 20 22.099 -2.362 -1.878 164 HZ1 LYS 20 3HZ LYS 20 23.361 -1.954 -3.894 165 HZ2 LYS 20 1HZ LYS 20 23.358 -0.616 -2.942 166 HZ3 LYS 20 2HZ LYS 20 24.695 -1.564 -3.022 167 H ALA 21 H ALA 21 22.028 -5.088 2.142 168 HA ALA 21 HA ALA 21 19.468 -3.868 2.838 169 HB1 ALA 21 1HB ALA 21 20.149 -6.579 1.642 170 HB2 ALA 21 2HB ALA 21 18.517 -5.876 1.785 171 HB3 ALA 21 3HB ALA 21 19.736 -5.105 0.739 172 H PHE 22 H PHE 22 21.762 -6.013 4.375 173 HA PHE 22 HA PHE 22 19.802 -7.259 6.131 174 HB2 PHE 22 2HB PHE 22 21.974 -8.332 5.574 175 HB3 PHE 22 3HB PHE 22 22.822 -7.027 6.391 176 HD1 PHE 22 HD1 PHE 22 20.046 -9.503 7.009 177 HD2 PHE 22 HD2 PHE 22 23.407 -7.367 8.634 178 HE1 PHE 22 HE1 PHE 22 19.798 -10.739 9.132 179 HE2 PHE 22 HE2 PHE 22 23.152 -8.594 10.774 180 HZ PHE 22 HZ PHE 22 21.351 -10.289 11.024 181 H ASN 23 H ASN 23 21.978 -4.429 6.191 182 HA ASN 23 HA ASN 23 21.577 -3.698 8.919 183 HB2 ASN 23 2HB ASN 23 23.355 -2.709 7.651 184 HB3 ASN 23 3HB ASN 23 22.252 -2.234 6.350 185 HD21 ASN 23 2HD2 ASN 23 21.225 -0.291 6.401 186 HD22 ASN 23 1HD2 ASN 23 21.377 0.860 7.708 187 H LEU 24 H LEU 24 19.801 -2.922 5.914 188 HA LEU 24 HA LEU 24 17.846 -1.260 7.257 189 HB2 LEU 24 2HB LEU 24 17.854 -2.627 4.539 190 HB3 LEU 24 3HB LEU 24 16.668 -1.417 5.062 191 HG LEU 24 HG LEU 24 19.673 -0.928 4.877 192 HD11 LEU 24 1HD1 LEU 24 17.402 -0.107 3.014 193 HD12 LEU 24 2HD1 LEU 24 19.110 0.376 2.861 194 HD13 LEU 24 3HD1 LEU 24 18.651 -1.331 2.672 195 HD21 LEU 24 3HD2 LEU 24 18.573 0.545 6.512 196 HD22 LEU 24 1HD2 LEU 24 19.001 1.464 5.063 197 HD23 LEU 24 2HD2 LEU 24 17.319 0.959 5.315 198 H LEU 25 H LEU 25 18.248 -4.702 6.848 199 HA LEU 25 HA LEU 25 15.416 -5.293 7.282 200 HB2 LEU 25 2HB LEU 25 16.777 -6.743 5.857 201 HB3 LEU 25 3HB LEU 25 17.921 -7.020 7.171 202 HG LEU 25 HG LEU 25 16.144 -8.163 8.479 203 HD11 LEU 25 1HD1 LEU 25 14.465 -7.767 5.964 204 HD12 LEU 25 2HD1 LEU 25 14.027 -8.783 7.357 205 HD13 LEU 25 3HD1 LEU 25 14.150 -7.032 7.563 206 HD21 LEU 25 3HD2 LEU 25 17.630 -9.441 6.998 207 HD22 LEU 25 1HD2 LEU 25 16.008 -10.164 7.024 208 HD23 LEU 25 2HD2 LEU 25 16.514 -9.179 5.632 209 H VAL 26 H VAL 26 18.472 -5.489 9.252 210 HA VAL 26 HA VAL 26 17.059 -6.705 11.430 211 HB VAL 26 HB VAL 26 18.993 -6.285 12.786 212 HG11 VAL 26 1HG1 VAL 26 20.697 -7.421 11.481 213 HG12 VAL 26 2HG1 VAL 26 19.094 -8.128 11.175 214 HG13 VAL 26 3HG1 VAL 26 19.846 -7.051 9.972 215 HG21 VAL 26 3HG2 VAL 26 20.950 -5.030 11.931 216 HG22 VAL 26 1HG2 VAL 26 19.982 -4.503 10.531 217 HG23 VAL 26 2HG2 VAL 26 19.533 -4.003 12.187 218 H VAL 27 H VAL 27 17.354 -3.320 10.420 219 HA VAL 27 HA VAL 27 16.831 -2.296 13.060 220 HB VAL 27 HB VAL 27 17.936 -0.978 11.330 221 HG11 VAL 27 1HG1 VAL 27 16.648 0.041 9.510 222 HG12 VAL 27 2HG1 VAL 27 16.654 -1.726 9.364 223 HG13 VAL 27 3HG1 VAL 27 15.207 -0.893 9.979 224 HG21 VAL 27 3HG2 VAL 27 15.293 0.256 12.207 225 HG22 VAL 27 1HG2 VAL 27 16.768 0.138 13.207 226 HG23 VAL 27 2HG2 VAL 27 16.765 1.124 11.734 227 H ARG 28 H ARG 28 14.758 -3.546 10.473 228 HA ARG 28 HA ARG 28 12.285 -2.475 11.490 229 HB2 ARG 28 2HB ARG 28 12.714 -5.111 10.021 230 HB3 ARG 28 3HB ARG 28 11.229 -4.151 10.092 231 HG2 ARG 28 2HG ARG 28 12.400 -2.329 8.820 232 HG3 ARG 28 3HG ARG 28 13.847 -3.370 8.755 233 HD2 ARG 28 2HD ARG 28 12.695 -3.589 6.665 234 HD3 ARG 28 3HD ARG 28 12.509 -5.104 7.561 235 HE ARG 28 HE ARG 28 10.241 -3.881 8.279 236 HH11 ARG 28 1HH1 ARG 28 11.751 -4.060 5.084 237 HH12 ARG 28 2HH1 ARG 28 10.230 -3.953 4.228 238 HH21 ARG 28 1HH2 ARG 28 8.273 -3.757 7.138 239 HH22 ARG 28 2HH2 ARG 28 8.268 -3.793 5.391 240 H TYR 29 H TYR 29 14.330 -5.236 12.263 241 HA TYR 29 HA TYR 29 12.294 -6.258 14.161 242 HB2 TYR 29 2HB TYR 29 14.800 -7.478 12.960 243 HB3 TYR 29 3HB TYR 29 13.819 -8.246 14.212 244 HD1 TYR 29 HD2 TYR 29 13.818 -7.065 10.693 245 HD2 TYR 29 HD1 TYR 29 11.703 -9.249 13.729 246 HE1 TYR 29 HE2 TYR 29 12.238 -7.889 8.980 247 HE2 TYR 29 HE1 TYR 29 10.138 -10.120 12.031 248 HH TYR 29 HH TYR 29 9.533 -10.105 9.797 249 H GLN 30 H GLN 30 15.014 -4.226 14.210 250 HA GLN 30 HA GLN 30 16.380 -5.142 16.526 251 HB2 GLN 30 2HB GLN 30 17.207 -3.506 14.845 252 HB3 GLN 30 3HB GLN 30 16.060 -2.306 15.463 253 HG2 GLN 30 2HG GLN 30 17.180 -2.336 17.646 254 HG3 GLN 30 3HG GLN 30 18.245 -3.656 17.100 255 HE21 GLN 30 2HE2 GLN 30 19.439 -3.123 14.924 256 HE22 GLN 30 1HE2 GLN 30 20.129 -1.516 14.825 257 H HIS 31 H HIS 31 13.388 -3.288 16.123 258 HA HIS 31 HA HIS 31 13.235 -2.706 19.002 259 HB2 HIS 31 2HB HIS 31 12.378 -1.123 17.304 260 HB3 HIS 31 3HB HIS 31 11.230 -2.349 16.749 261 HD2 HIS 31 HD2 HIS 31 12.060 -0.428 20.060 262 HE1 HIS 31 HE1 HIS 31 7.874 -1.161 19.997 263 HE2 HIS 31 HE2 HIS 31 9.782 -0.058 21.284 264 H LYS 32 H LYS 32 12.064 -5.119 16.676 265 HA LYS 32 HA LYS 32 9.996 -6.130 18.442 266 HB2 LYS 32 2HB LYS 32 11.264 -7.350 15.961 267 HB3 LYS 32 3HB LYS 32 9.763 -7.888 16.744 268 HG2 LYS 32 2HG LYS 32 8.743 -5.670 16.317 269 HG3 LYS 32 3HG LYS 32 10.228 -5.142 15.499 270 HD2 LYS 32 2HD LYS 32 9.971 -6.989 13.857 271 HD3 LYS 32 3HD LYS 32 8.466 -7.480 14.667 272 HE2 LYS 32 2HE LYS 32 7.491 -5.249 14.206 273 HE3 LYS 32 3HE LYS 32 8.996 -4.756 13.408 274 HZ1 LYS 32 3HZ LYS 32 7.355 -5.472 11.823 275 HZ2 LYS 32 1HZ LYS 32 8.628 -6.515 11.805 276 HZ3 LYS 32 2HZ LYS 32 7.219 -6.940 12.544 277 H VAL 33 H VAL 33 13.353 -7.192 17.636 278 HA VAL 33 HA VAL 33 12.989 -9.555 19.306 279 HB VAL 33 HB VAL 33 15.212 -10.161 18.742 280 HG11 VAL 33 1HG1 VAL 33 13.467 -10.496 17.021 281 HG12 VAL 33 2HG1 VAL 33 13.879 -8.921 16.301 282 HG13 VAL 33 3HG1 VAL 33 15.072 -10.236 16.299 283 HG21 VAL 33 3HG2 VAL 33 15.560 -7.385 17.559 284 HG22 VAL 33 1HG2 VAL 33 16.391 -8.070 18.973 285 HG23 VAL 33 2HG2 VAL 33 16.684 -8.752 17.363 286 H ALA 34 H ALA 34 14.243 -6.270 19.723 287 HA ALA 34 HA ALA 34 15.700 -6.858 22.132 288 HB1 ALA 34 1HB ALA 34 15.637 -4.430 22.484 289 HB2 ALA 34 2HB ALA 34 16.072 -4.808 20.802 290 HB3 ALA 34 3HB ALA 34 14.423 -4.261 21.195 291 H SER 35 H SER 35 12.302 -6.466 21.353 292 HA SER 35 HA SER 35 11.451 -5.832 24.055 293 HB2 SER 35 2HB SER 35 10.177 -5.230 21.996 294 HB3 SER 35 3HB SER 35 9.901 -6.959 21.691 295 HG SER 35 HG SER 35 8.172 -5.958 22.827 296 H LEU 36 H LEU 36 11.605 -8.792 22.022 297 HA LEU 36 HA LEU 36 10.441 -10.381 24.173 298 HB2 LEU 36 2HB LEU 36 10.592 -12.239 22.671 299 HB3 LEU 36 3HB LEU 36 9.981 -10.825 21.807 300 HG LEU 36 HG LEU 36 12.468 -10.482 21.068 301 HD11 LEU 36 1HD1 LEU 36 13.527 -12.260 22.453 302 HD12 LEU 36 2HD1 LEU 36 12.445 -13.467 21.718 303 HD13 LEU 36 3HD1 LEU 36 13.665 -12.628 20.729 304 HD21 LEU 36 3HD2 LEU 36 10.777 -12.801 20.042 305 HD22 LEU 36 1HD2 LEU 36 10.564 -11.090 19.600 306 HD23 LEU 36 2HD2 LEU 36 12.045 -11.949 19.127 307 H VAL 37 H VAL 37 13.704 -9.504 23.195 308 HA VAL 37 HA VAL 37 14.822 -11.740 24.730 309 HB VAL 37 HB VAL 37 15.757 -10.869 22.539 310 HG11 VAL 37 1HG1 VAL 37 15.756 -8.416 23.393 311 HG12 VAL 37 2HG1 VAL 37 17.228 -8.891 24.288 312 HG13 VAL 37 3HG1 VAL 37 17.198 -9.004 22.522 313 HG21 VAL 37 3HG2 VAL 37 17.649 -11.097 24.905 314 HG22 VAL 37 1HG2 VAL 37 16.911 -12.464 24.033 315 HG23 VAL 37 2HG2 VAL 37 18.042 -11.379 23.196 316 H SER 38 H SER 38 13.860 -8.448 25.334 317 HA SER 38 HA SER 38 15.523 -7.998 27.631 318 HB2 SER 38 2HB SER 38 14.266 -6.221 26.426 319 HB3 SER 38 3HB SER 38 12.747 -6.914 27.019 320 HG SER 38 HG SER 38 13.570 -6.583 29.153 321 H ARG 39 H ARG 39 13.071 -10.285 27.020 322 HA ARG 39 HA ARG 39 12.232 -10.541 29.832 323 HB2 ARG 39 2HB ARG 39 11.617 -12.269 27.408 324 HB3 ARG 39 3HB ARG 39 10.867 -12.398 29.006 325 HG2 ARG 39 2HG ARG 39 10.035 -10.042 28.759 326 HG3 ARG 39 3HG ARG 39 10.660 -10.035 27.093 327 HD2 ARG 39 2HD ARG 39 8.584 -11.969 28.207 328 HD3 ARG 39 3HD ARG 39 8.239 -10.572 27.184 329 HE ARG 39 HE ARG 39 9.229 -11.655 25.321 330 HH11 ARG 39 1HH1 ARG 39 9.201 -13.714 28.206 331 HH12 ARG 39 2HH1 ARG 39 9.499 -15.174 27.292 332 HH21 ARG 39 1HH2 ARG 39 9.559 -13.594 24.171 333 HH22 ARG 39 2HH2 ARG 39 9.697 -15.108 25.033 334 H TYR 40 H TYR 40 14.961 -11.457 28.069 335 HA TYR 40 HA TYR 40 15.342 -13.857 29.797 336 HB2 TYR 40 2HB TYR 40 16.294 -13.405 26.955 337 HB3 TYR 40 3HB TYR 40 16.685 -14.807 27.954 338 HD1 TYR 40 HD1 TYR 40 14.799 -16.313 28.769 339 HD2 TYR 40 HD2 TYR 40 14.276 -13.347 25.697 340 HE1 TYR 40 HE1 TYR 40 12.711 -17.439 28.036 341 HE2 TYR 40 HE2 TYR 40 12.202 -14.465 24.955 342 HH TYR 40 HH TYR 40 10.957 -17.428 26.552 343 H VAL 41 H VAL 41 16.524 -10.744 28.931 344 HA VAL 41 HA VAL 41 18.766 -11.137 30.808 345 HB VAL 41 HB VAL 41 20.206 -9.671 29.307 346 HG11 VAL 41 1HG1 VAL 41 21.078 -11.553 28.029 347 HG12 VAL 41 2HG1 VAL 41 20.620 -12.075 29.663 348 HG13 VAL 41 3HG1 VAL 41 19.572 -12.463 28.279 349 HG21 VAL 41 3HG2 VAL 41 18.324 -10.652 27.133 350 HG22 VAL 41 1HG2 VAL 41 18.403 -8.975 27.729 351 HG23 VAL 41 2HG2 VAL 41 19.806 -9.704 26.914 352 HA PRO 42 HA PRO 42 17.243 -7.312 32.342 353 HB2 PRO 42 2HB PRO 42 19.458 -6.137 33.422 354 HB3 PRO 42 3HB PRO 42 18.711 -7.620 34.108 355 HG2 PRO 42 2HG PRO 42 21.057 -7.447 32.185 356 HG3 PRO 42 3HG PRO 42 20.963 -8.355 33.735 357 HD2 PRO 42 2HD PRO 42 20.501 -9.586 31.372 358 HD3 PRO 42 3HD PRO 42 19.488 -9.962 32.796 359 H SER 43 H SER 43 17.441 -4.919 32.122 360 HA SER 43 HA SER 43 17.623 -4.265 29.363 361 HB2 SER 43 2HB SER 43 17.099 -1.966 30.149 362 HB3 SER 43 3HB SER 43 16.050 -3.192 30.888 363 HG SER 43 HG SER 43 16.883 -1.694 32.410 364 H GLY 44 H GLY 44 20.132 -4.472 31.697 365 HA2 GLY 44 2HA GLY 44 21.802 -2.383 30.471 366 HA3 GLY 44 3HA GLY 44 22.233 -3.477 31.805 367 H ASP 45 H ASP 45 21.167 -5.812 30.025 368 HA ASP 45 HA ASP 45 23.618 -6.041 28.338 369 HB2 ASP 45 2HB ASP 45 22.087 -8.163 29.874 370 HB3 ASP 45 3HB ASP 45 23.434 -8.473 28.767 371 H VAL 46 H VAL 46 20.295 -5.590 28.153 372 HA VAL 46 HA VAL 46 19.639 -7.533 26.166 373 HB VAL 46 HB VAL 46 18.037 -6.334 27.653 374 HG11 VAL 46 1HG1 VAL 46 18.321 -4.090 25.610 375 HG12 VAL 46 2HG1 VAL 46 17.078 -4.222 26.877 376 HG13 VAL 46 3HG1 VAL 46 18.772 -3.997 27.338 377 HG21 VAL 46 3HG2 VAL 46 16.278 -6.186 25.906 378 HG22 VAL 46 1HG2 VAL 46 17.534 -6.372 24.668 379 HG23 VAL 46 2HG2 VAL 46 17.251 -7.673 25.859 380 HA PRO 47 HA PRO 47 20.492 -4.222 22.907 381 HB2 PRO 47 2HB PRO 47 22.422 -2.355 23.198 382 HB3 PRO 47 3HB PRO 47 20.786 -2.134 23.903 383 HG2 PRO 47 2HG PRO 47 23.285 -3.158 25.289 384 HG3 PRO 47 3HG PRO 47 22.176 -1.860 25.839 385 HD2 PRO 47 2HD PRO 47 21.987 -4.439 26.704 386 HD3 PRO 47 3HD PRO 47 20.539 -3.413 26.483 387 H ASP 48 H ASP 48 23.107 -5.560 24.880 388 HA ASP 48 HA ASP 48 24.986 -5.727 22.666 389 HB2 ASP 48 2HB ASP 48 25.641 -5.456 25.066 390 HB3 ASP 48 3HB ASP 48 24.989 -7.067 25.393 391 H VAL 49 H VAL 49 22.513 -7.774 24.161 392 HA VAL 49 HA VAL 49 23.388 -10.184 22.767 393 HB VAL 49 HB VAL 49 20.965 -9.458 24.449 394 HG11 VAL 49 1HG1 VAL 49 21.728 -12.165 23.273 395 HG12 VAL 49 2HG1 VAL 49 20.453 -11.871 24.479 396 HG13 VAL 49 3HG1 VAL 49 20.290 -11.203 22.842 397 HG21 VAL 49 3HG2 VAL 49 23.143 -9.656 25.630 398 HG22 VAL 49 1HG2 VAL 49 22.031 -10.970 26.069 399 HG23 VAL 49 2HG2 VAL 49 23.366 -11.273 24.926 400 H VAL 50 H VAL 50 21.194 -7.468 22.134 401 HA VAL 50 HA VAL 50 19.781 -8.779 19.970 402 HB VAL 50 HB VAL 50 20.233 -5.882 20.763 403 HG11 VAL 50 1HG1 VAL 50 18.529 -6.983 18.487 404 HG12 VAL 50 2HG1 VAL 50 18.470 -5.313 19.100 405 HG13 VAL 50 3HG1 VAL 50 19.946 -5.920 18.318 406 HG21 VAL 50 3HG2 VAL 50 17.885 -5.992 21.407 407 HG22 VAL 50 1HG2 VAL 50 17.731 -7.626 20.712 408 HG23 VAL 50 2HG2 VAL 50 18.726 -7.372 22.153 409 H GLN 51 H GLN 51 22.832 -6.884 20.245 410 HA GLN 51 HA GLN 51 23.166 -6.778 17.378 411 HB2 GLN 51 2HB GLN 51 24.260 -5.224 19.074 412 HB3 GLN 51 3HB GLN 51 25.298 -6.586 19.532 413 HG2 GLN 51 2HG GLN 51 26.529 -5.303 17.904 414 HG3 GLN 51 3HG GLN 51 25.984 -6.771 17.086 415 HE21 GLN 51 2HE2 GLN 51 26.618 -5.124 15.271 416 HE22 GLN 51 1HE2 GLN 51 25.289 -4.174 14.634 417 H GLU 52 H GLU 52 24.317 -9.019 19.983 418 HA GLU 52 HA GLU 52 25.957 -10.541 18.196 419 HB2 GLU 52 2HB GLU 52 26.138 -10.585 20.685 420 HB3 GLU 52 3HB GLU 52 24.573 -11.420 20.769 421 HG2 GLU 52 2HG GLU 52 25.463 -13.304 19.478 422 HG3 GLU 52 3HG GLU 52 27.002 -12.459 19.259 423 H ALA 53 H ALA 53 22.478 -10.536 18.927 424 HA ALA 53 HA ALA 53 21.952 -13.081 17.687 425 HB1 ALA 53 1HB ALA 53 20.145 -10.683 18.192 426 HB2 ALA 53 2HB ALA 53 19.605 -12.319 17.759 427 HB3 ALA 53 3HB ALA 53 20.420 -12.038 19.316 428 H PHE 54 H PHE 54 22.372 -9.766 16.459 429 HA PHE 54 HA PHE 54 21.332 -10.533 13.816 430 HB2 PHE 54 2HB PHE 54 22.631 -8.012 14.901 431 HB3 PHE 54 3HB PHE 54 22.118 -8.203 13.233 432 HD1 PHE 54 HD1 PHE 54 19.517 -9.813 13.813 433 HD2 PHE 54 HD2 PHE 54 21.163 -6.208 15.517 434 HE1 PHE 54 HE1 PHE 54 17.256 -9.057 14.410 435 HE2 PHE 54 HE2 PHE 54 18.875 -5.443 16.073 436 HZ PHE 54 HZ PHE 54 16.922 -6.871 15.525 437 H ILE 55 H ILE 55 24.511 -10.188 15.409 438 HA ILE 55 HA ILE 55 26.004 -10.499 12.947 439 HB ILE 55 HB ILE 55 26.715 -11.004 15.859 440 HG12 ILE 55 2HG1 ILE 55 27.393 -8.669 14.014 441 HG13 ILE 55 3HG1 ILE 55 26.110 -8.639 15.222 442 HG21 ILE 55 1HG2 ILE 55 29.071 -10.985 15.100 443 HG22 ILE 55 2HG2 ILE 55 28.179 -12.297 14.335 444 HG23 ILE 55 3HG2 ILE 55 28.528 -10.818 13.411 445 HD11 ILE 55 3HD1 ILE 55 27.799 -9.092 17.004 446 HD12 ILE 55 1HD1 ILE 55 29.090 -8.991 15.777 447 HD13 ILE 55 2HD1 ILE 55 28.095 -7.574 16.131 448 H LYS 56 H LYS 56 24.623 -12.677 15.415 449 HA LYS 56 HA LYS 56 25.778 -15.082 14.289 450 HB2 LYS 56 2HB LYS 56 25.164 -14.790 16.669 451 HB3 LYS 56 3HB LYS 56 23.460 -14.618 16.209 452 HG2 LYS 56 2HG LYS 56 23.512 -16.923 15.250 453 HG3 LYS 56 3HG LYS 56 25.196 -17.088 15.791 454 HD2 LYS 56 2HD LYS 56 22.805 -16.521 17.597 455 HD3 LYS 56 3HD LYS 56 23.576 -18.110 17.390 456 HE2 LYS 56 2HE LYS 56 25.707 -17.184 18.244 457 HE3 LYS 56 3HE LYS 56 24.941 -15.595 18.433 458 HZ1 LYS 56 3HZ LYS 56 24.959 -16.777 20.497 459 HZ2 LYS 56 1HZ LYS 56 23.409 -16.581 19.981 460 HZ3 LYS 56 2HZ LYS 56 24.142 -18.048 19.846 461 H ALA 57 H ALA 57 22.746 -13.236 13.861 462 HA ALA 57 HA ALA 57 21.379 -15.346 12.465 463 HB1 ALA 57 1HB ALA 57 20.982 -12.326 12.458 464 HB2 ALA 57 2HB ALA 57 19.866 -13.499 11.729 465 HB3 ALA 57 3HB ALA 57 20.128 -13.515 13.478 466 H TYR 58 H TYR 58 23.379 -12.526 11.341 467 HA TYR 58 HA TYR 58 22.799 -12.876 8.597 468 HB2 TYR 58 2HB TYR 58 23.903 -10.906 9.670 469 HB3 TYR 58 3HB TYR 58 25.357 -11.879 9.903 470 HD1 TYR 58 HD1 TYR 58 22.979 -10.884 7.159 471 HD2 TYR 58 HD2 TYR 58 27.025 -11.787 8.294 472 HE1 TYR 58 HE1 TYR 58 23.751 -10.236 4.891 473 HE2 TYR 58 HE2 TYR 58 27.809 -11.170 6.028 474 HH TYR 58 HH TYR 58 25.540 -10.065 3.470 475 H ARG 59 H ARG 59 25.273 -14.387 10.673 476 HA ARG 59 HA ARG 59 26.688 -15.692 8.520 477 HB2 ARG 59 2HB ARG 59 26.548 -16.165 11.522 478 HB3 ARG 59 3HB ARG 59 27.708 -16.954 10.436 479 HG2 ARG 59 2HG ARG 59 28.697 -14.826 9.823 480 HG3 ARG 59 3HG ARG 59 27.440 -13.919 10.696 481 HD2 ARG 59 2HD ARG 59 28.156 -14.835 12.819 482 HD3 ARG 59 3HD ARG 59 29.304 -15.916 12.007 483 HE ARG 59 HE ARG 59 29.944 -13.260 11.254 484 HH11 ARG 59 1HH1 ARG 59 29.898 -15.229 14.192 485 HH12 ARG 59 2HH1 ARG 59 31.177 -14.323 14.960 486 HH21 ARG 59 1HH2 ARG 59 31.611 -12.096 12.276 487 HH22 ARG 59 2HH2 ARG 59 32.139 -12.545 13.880 488 H ALA 60 H ALA 60 23.845 -16.462 10.440 489 HA ALA 60 HA ALA 60 23.770 -19.235 9.418 490 HB1 ALA 60 1HB ALA 60 21.916 -17.708 11.286 491 HB2 ALA 60 2HB ALA 60 21.827 -19.445 10.899 492 HB3 ALA 60 3HB ALA 60 23.227 -18.808 11.778 493 H LEU 61 H LEU 61 22.722 -16.115 8.445 494 HA LEU 61 HA LEU 61 20.176 -16.877 7.314 495 HB2 LEU 61 2HB LEU 61 20.900 -14.572 8.144 496 HB3 LEU 61 3HB LEU 61 21.905 -14.457 6.687 497 HG LEU 61 HG LEU 61 19.810 -14.826 5.322 498 HD11 LEU 61 1HD1 LEU 61 18.555 -14.496 8.076 499 HD12 LEU 61 2HD1 LEU 61 17.656 -14.343 6.544 500 HD13 LEU 61 3HD1 LEU 61 18.376 -15.901 7.004 501 HD21 LEU 61 3HD2 LEU 61 19.835 -12.484 7.282 502 HD22 LEU 61 1HD2 LEU 61 20.763 -12.588 5.763 503 HD23 LEU 61 2HD2 LEU 61 18.984 -12.523 5.719 504 H ASP 62 H ASP 62 23.530 -16.853 6.239 505 HA ASP 62 HA ASP 62 23.012 -17.006 3.415 506 HB2 ASP 62 2HB ASP 62 25.184 -16.368 4.428 507 HB3 ASP 62 3HB ASP 62 25.355 -18.008 5.076 508 H SER 63 H SER 63 22.490 -19.216 6.001 509 HA SER 63 HA SER 63 22.364 -21.494 4.096 510 HB2 SER 63 2HB SER 63 22.733 -22.971 5.943 511 HB3 SER 63 3HB SER 63 24.018 -21.751 5.913 512 HG SER 63 HG SER 63 22.818 -20.620 7.542 513 H PHE 64 H PHE 64 20.336 -19.225 5.240 514 HA PHE 64 HA PHE 64 18.191 -21.037 6.094 515 HB2 PHE 64 2HB PHE 64 18.398 -18.884 7.192 516 HB3 PHE 64 3HB PHE 64 18.305 -18.043 5.645 517 HD1 PHE 64 HD2 PHE 64 16.276 -20.737 7.347 518 HD2 PHE 64 HD1 PHE 64 16.293 -16.938 5.341 519 HE1 PHE 64 HE2 PHE 64 13.811 -20.622 7.548 520 HE2 PHE 64 HE1 PHE 64 13.820 -16.816 5.554 521 HZ PHE 64 HZ PHE 64 12.581 -18.658 6.657 522 H ARG 65 H ARG 65 17.184 -22.195 4.627 523 HA ARG 65 HA ARG 65 16.068 -20.859 2.241 524 HB2 ARG 65 2HB ARG 65 17.428 -23.591 2.132 525 HB3 ARG 65 3HB ARG 65 16.555 -22.795 0.827 526 HG2 ARG 65 2HG ARG 65 18.694 -22.272 0.219 527 HG3 ARG 65 3HG ARG 65 18.304 -20.849 1.198 528 HD2 ARG 65 2HD ARG 65 19.387 -22.015 3.166 529 HD3 ARG 65 3HD ARG 65 19.831 -23.340 2.098 530 HE ARG 65 HE ARG 65 21.043 -20.668 2.233 531 HH11 ARG 65 1HH1 ARG 65 20.690 -23.615 0.308 532 HH12 ARG 65 2HH1 ARG 65 22.178 -23.353 -0.571 533 HH21 ARG 65 1HH2 ARG 65 22.990 -20.395 1.149 534 HH22 ARG 65 2HH2 ARG 65 23.474 -21.502 -0.117 535 H GLY 66 H GLY 66 15.022 -21.508 4.862 536 HA2 GLY 66 2HA GLY 66 13.689 -24.024 4.938 537 HA3 GLY 66 3HA GLY 66 13.389 -22.616 5.973 538 H ASP 67 H ASP 67 12.945 -21.352 2.970 539 HA ASP 67 HA ASP 67 11.087 -20.613 1.926 540 HB2 ASP 67 2HB ASP 67 11.388 -22.876 0.965 541 HB3 ASP 67 3HB ASP 67 10.224 -23.509 2.139 542 H SER 68 H SER 68 11.087 -20.344 4.786 543 HA SER 68 HA SER 68 8.154 -20.237 5.318 544 HB2 SER 68 2HB SER 68 9.267 -22.114 6.531 545 HB3 SER 68 3HB SER 68 10.343 -20.934 7.311 546 HG SER 68 HG SER 68 8.487 -21.444 8.574 547 H ALA 69 H ALA 69 7.913 -18.719 7.418 548 HA ALA 69 HA ALA 69 8.710 -16.145 6.445 549 HB1 ALA 69 1HB ALA 69 7.495 -16.940 9.122 550 HB2 ALA 69 2HB ALA 69 7.538 -15.304 8.430 551 HB3 ALA 69 3HB ALA 69 6.583 -16.575 7.634 552 H PHE 70 H PHE 70 10.094 -14.624 7.221 553 HA PHE 70 HA PHE 70 12.551 -15.649 8.351 554 HB2 PHE 70 2HB PHE 70 12.595 -14.010 6.592 555 HB3 PHE 70 3HB PHE 70 11.547 -12.921 7.511 556 HD1 PHE 70 HD2 PHE 70 14.880 -14.644 7.854 557 HD2 PHE 70 HD1 PHE 70 12.485 -11.166 8.674 558 HE1 PHE 70 HE2 PHE 70 16.851 -13.512 8.840 559 HE2 PHE 70 HE1 PHE 70 14.450 -10.036 9.654 560 HZ PHE 70 HZ PHE 70 16.656 -11.199 9.718 561 H TYR 71 H TYR 71 9.744 -13.872 9.679 562 HA TYR 71 HA TYR 71 11.225 -12.765 11.872 563 HB2 TYR 71 2HB TYR 71 9.082 -12.169 12.801 564 HB3 TYR 71 3HB TYR 71 9.148 -11.783 11.087 565 HD1 TYR 71 HD1 TYR 71 7.762 -14.177 13.579 566 HD2 TYR 71 HD2 TYR 71 7.590 -12.697 9.540 567 HE1 TYR 71 HE1 TYR 71 5.628 -15.393 13.226 568 HE2 TYR 71 HE2 TYR 71 5.447 -13.911 9.187 569 HH TYR 71 HH TYR 71 3.938 -15.886 11.758 570 H THR 72 H THR 72 9.420 -15.858 11.492 571 HA THR 72 HA THR 72 9.613 -16.523 14.296 572 HB THR 72 HB THR 72 9.328 -18.366 11.889 573 HG1 THR 72 1HG THR 72 7.113 -18.099 12.282 574 HG21 THR 72 1HG2 THR 72 9.843 -19.551 13.989 575 HG22 THR 72 2HG2 THR 72 8.541 -18.675 14.823 576 HG23 THR 72 3HG2 THR 72 8.157 -19.830 13.517 577 H TRP 73 H TRP 73 11.668 -16.938 11.446 578 HA TRP 73 HA TRP 73 13.496 -18.804 12.693 579 HB2 TRP 73 2HB TRP 73 13.134 -18.752 10.281 580 HB3 TRP 73 3HB TRP 73 13.629 -17.061 10.210 581 HD1 TRP 73 HD1 TRP 73 14.997 -20.554 10.212 582 HE1 TRP 73 HE1 TRP 73 17.533 -20.530 9.854 583 HE3 TRP 73 HE3 TRP 73 15.829 -15.529 10.717 584 HZ2 TRP 73 HZ2 TRP 73 19.665 -18.590 9.918 585 HZ3 TRP 73 HZ3 TRP 73 18.119 -14.633 10.560 586 HH2 TRP 73 HH2 TRP 73 20.039 -16.145 10.191 587 H LEU 74 H LEU 74 13.205 -15.283 12.516 588 HA LEU 74 HA LEU 74 15.962 -14.851 13.403 589 HB2 LEU 74 2HB LEU 74 14.885 -13.316 11.819 590 HB3 LEU 74 3HB LEU 74 13.599 -12.982 12.985 591 HG LEU 74 HG LEU 74 15.278 -12.028 14.557 592 HD11 LEU 74 1HD1 LEU 74 17.555 -11.509 13.686 593 HD12 LEU 74 2HD1 LEU 74 17.295 -13.256 13.809 594 HD13 LEU 74 3HD1 LEU 74 17.204 -12.452 12.223 595 HD21 LEU 74 3HD2 LEU 74 15.657 -9.965 13.298 596 HD22 LEU 74 1HD2 LEU 74 15.368 -10.824 11.766 597 HD23 LEU 74 2HD2 LEU 74 14.044 -10.615 12.937 598 H TYR 75 H TYR 75 12.654 -14.788 14.806 599 HA TYR 75 HA TYR 75 13.370 -13.566 17.281 600 HB2 TYR 75 2HB TYR 75 11.216 -15.608 16.615 601 HB3 TYR 75 3HB TYR 75 11.334 -14.756 18.146 602 HD1 TYR 75 HD1 TYR 75 12.288 -12.185 16.097 603 HD2 TYR 75 HD2 TYR 75 8.848 -14.671 16.837 604 HE1 TYR 75 HE1 TYR 75 10.811 -10.390 15.266 605 HE2 TYR 75 HE2 TYR 75 7.367 -12.878 15.976 606 HH TYR 75 HH TYR 75 8.657 -9.742 14.823 607 H ARG 76 H ARG 76 13.682 -16.947 16.120 608 HA ARG 76 HA ARG 76 14.273 -17.914 18.788 609 HB2 ARG 76 2HB ARG 76 14.797 -20.013 17.750 610 HB3 ARG 76 3HB ARG 76 13.283 -19.372 17.095 611 HG2 ARG 76 2HG ARG 76 14.418 -18.622 15.072 612 HG3 ARG 76 3HG ARG 76 15.994 -19.138 15.727 613 HD2 ARG 76 2HD ARG 76 15.070 -21.471 15.911 614 HD3 ARG 76 3HD ARG 76 13.607 -20.915 15.070 615 HE ARG 76 HE ARG 76 15.772 -20.155 13.462 616 HH11 ARG 76 1HH1 ARG 76 14.376 -23.162 14.694 617 HH12 ARG 76 2HH1 ARG 76 14.955 -24.119 13.351 618 HH21 ARG 76 1HH2 ARG 76 16.524 -21.429 11.728 619 HH22 ARG 76 2HH2 ARG 76 16.163 -23.140 11.674 620 H ILE 77 H ILE 77 16.221 -16.375 16.265 621 HA ILE 77 HA ILE 77 18.741 -17.398 17.233 622 HB ILE 77 HB ILE 77 18.238 -14.715 15.894 623 HG12 ILE 77 2HG1 ILE 77 17.278 -16.412 14.449 624 HG13 ILE 77 3HG1 ILE 77 18.764 -15.769 13.760 625 HG21 ILE 77 1HG2 ILE 77 20.683 -16.511 16.143 626 HG22 ILE 77 2HG2 ILE 77 20.592 -15.054 15.122 627 HG23 ILE 77 3HG2 ILE 77 20.440 -14.911 16.879 628 HD11 ILE 77 3HD1 ILE 77 18.523 -18.434 15.218 629 HD12 ILE 77 1HD1 ILE 77 18.621 -18.210 13.463 630 HD13 ILE 77 2HD1 ILE 77 20.008 -17.777 14.475 631 H ALA 78 H ALA 78 16.610 -14.675 18.146 632 HA ALA 78 HA ALA 78 18.648 -13.372 19.726 633 HB1 ALA 78 1HB ALA 78 16.854 -12.137 18.605 634 HB2 ALA 78 2HB ALA 78 15.636 -12.973 19.602 635 HB3 ALA 78 3HB ALA 78 16.802 -11.866 20.359 636 H VAL 79 H VAL 79 15.902 -15.575 20.516 637 HA VAL 79 HA VAL 79 16.362 -15.203 23.375 638 HB VAL 79 HB VAL 79 14.137 -15.647 22.536 639 HG11 VAL 79 1HG1 VAL 79 15.176 -18.404 21.762 640 HG12 VAL 79 2HG1 VAL 79 13.491 -17.843 21.664 641 HG13 VAL 79 3HG1 VAL 79 14.728 -17.109 20.623 642 HG21 VAL 79 3HG2 VAL 79 15.161 -18.019 24.159 643 HG22 VAL 79 1HG2 VAL 79 14.814 -16.406 24.832 644 HG23 VAL 79 2HG2 VAL 79 13.505 -17.383 24.132 645 H ASN 80 H ASN 80 17.477 -17.470 20.881 646 HA ASN 80 HA ASN 80 18.592 -19.328 22.826 647 HB2 ASN 80 2HB ASN 80 19.034 -18.926 19.841 648 HB3 ASN 80 3HB ASN 80 19.804 -20.202 20.782 649 HD21 ASN 80 2HD2 ASN 80 18.296 -21.016 18.691 650 HD22 ASN 80 1HD2 ASN 80 16.797 -21.724 19.258 651 H THR 81 H THR 81 19.629 -16.285 21.370 652 HA THR 81 HA THR 81 22.422 -16.734 22.055 653 HB THR 81 HB THR 81 20.927 -14.211 21.222 654 HG1 THR 81 1HG THR 81 21.011 -15.671 19.581 655 HG21 THR 81 1HG2 THR 81 23.918 -14.802 21.444 656 HG22 THR 81 2HG2 THR 81 23.200 -13.338 20.725 657 HG23 THR 81 3HG2 THR 81 23.024 -13.664 22.460 658 H ALA 82 H ALA 82 19.560 -15.322 23.601 659 HA ALA 82 HA ALA 82 21.040 -13.965 25.686 660 HB1 ALA 82 1HB ALA 82 18.134 -14.875 25.506 661 HB2 ALA 82 2HB ALA 82 18.795 -13.739 26.703 662 HB3 ALA 82 3HB ALA 82 18.776 -13.301 24.979 663 H LYS 83 H LYS 83 19.754 -17.234 25.206 664 HA LYS 83 HA LYS 83 20.080 -17.954 28.019 665 HB2 LYS 83 2HB LYS 83 19.390 -19.511 25.503 666 HB3 LYS 83 3HB LYS 83 19.545 -20.263 27.106 667 HG2 LYS 83 2HG LYS 83 17.818 -18.801 28.024 668 HG3 LYS 83 3HG LYS 83 17.673 -17.932 26.484 669 HD2 LYS 83 2HD LYS 83 16.929 -19.982 25.365 670 HD3 LYS 83 3HD LYS 83 17.112 -20.901 26.877 671 HE2 LYS 83 2HE LYS 83 15.248 -18.525 26.496 672 HE3 LYS 83 3HE LYS 83 14.748 -20.217 26.397 673 HZ1 LYS 83 3HZ LYS 83 15.488 -20.506 28.671 674 HZ2 LYS 83 1HZ LYS 83 15.914 -18.924 28.770 675 HZ3 LYS 83 2HZ LYS 83 14.335 -19.340 28.570 676 H ASN 84 H ASN 84 22.075 -18.148 25.054 677 HA ASN 84 HA ASN 84 23.996 -19.799 26.526 678 HB2 ASN 84 2HB ASN 84 25.132 -20.126 24.594 679 HB3 ASN 84 3HB ASN 84 23.491 -19.913 23.976 680 HD21 ASN 84 2HD2 ASN 84 26.513 -18.046 24.667 681 HD22 ASN 84 1HD2 ASN 84 26.365 -16.993 23.276 682 H TYR 85 H TYR 85 23.273 -16.434 26.155 683 HA TYR 85 HA TYR 85 25.957 -15.452 26.571 684 HB2 TYR 85 2HB TYR 85 24.193 -14.140 25.480 685 HB3 TYR 85 3HB TYR 85 23.223 -14.176 26.958 686 HD1 TYR 85 HD1 TYR 85 26.403 -12.943 25.459 687 HD2 TYR 85 HD2 TYR 85 23.580 -12.580 28.685 688 HE1 TYR 85 HE1 TYR 85 27.531 -10.868 26.202 689 HE2 TYR 85 HE2 TYR 85 24.702 -10.491 29.434 690 HH TYR 85 HH TYR 85 27.558 -9.150 27.737 691 H LEU 86 H LEU 86 23.144 -16.148 28.701 692 HA LEU 86 HA LEU 86 24.569 -15.130 31.036 693 HB2 LEU 86 2HB LEU 86 21.955 -16.664 30.730 694 HB3 LEU 86 3HB LEU 86 22.576 -16.035 32.260 695 HG LEU 86 HG LEU 86 21.832 -14.361 29.829 696 HD11 LEU 86 1HD1 LEU 86 20.583 -14.694 32.590 697 HD12 LEU 86 2HD1 LEU 86 20.038 -13.548 31.352 698 HD13 LEU 86 3HD1 LEU 86 19.910 -15.293 31.052 699 HD21 LEU 86 3HD2 LEU 86 22.855 -13.566 32.592 700 HD22 LEU 86 1HD2 LEU 86 23.681 -13.282 31.038 701 HD23 LEU 86 2HD2 LEU 86 22.167 -12.438 31.400 702 H VAL 87 H VAL 87 24.223 -18.308 29.469 703 HA VAL 87 HA VAL 87 25.167 -19.649 31.886 704 HB VAL 87 HB VAL 87 23.635 -20.604 30.042 705 HG11 VAL 87 1HG1 VAL 87 26.336 -21.276 28.805 706 HG12 VAL 87 2HG1 VAL 87 24.733 -21.764 28.219 707 HG13 VAL 87 3HG1 VAL 87 25.217 -20.052 28.158 708 HG21 VAL 87 3HG2 VAL 87 26.023 -22.225 31.000 709 HG22 VAL 87 1HG2 VAL 87 24.550 -21.899 31.948 710 HG23 VAL 87 2HG2 VAL 87 24.457 -22.873 30.465 711 H ALA 88 H ALA 88 26.606 -18.047 29.121 712 HA ALA 88 HA ALA 88 29.119 -19.473 29.331 713 HB1 ALA 88 1HB ALA 88 28.355 -16.910 27.869 714 HB2 ALA 88 2HB ALA 88 29.881 -17.794 27.659 715 HB3 ALA 88 3HB ALA 88 28.349 -18.553 27.184 716 H GLN 89 H GLN 89 27.666 -16.871 31.070 717 HA GLN 89 HA GLN 89 30.345 -16.119 32.154 718 HB2 GLN 89 2HB GLN 89 29.387 -13.980 32.752 719 HB3 GLN 89 3HB GLN 89 29.108 -14.298 31.028 720 HG2 GLN 89 2HG GLN 89 26.793 -15.120 31.633 721 HG3 GLN 89 3HG GLN 89 27.088 -14.576 33.295 722 HE21 GLN 89 2HE2 GLN 89 26.644 -13.582 29.922 723 HE22 GLN 89 1HE2 GLN 89 26.322 -11.893 30.248 724 H GLY 90 H GLY 90 27.256 -17.577 32.856 725 HA2 GLY 90 2HA GLY 90 27.541 -17.245 35.754 726 HA3 GLY 90 3HA GLY 90 26.262 -18.113 34.880 727 H ARG 91 H ARG 91 28.474 -19.556 33.277 728 HA ARG 91 HA ARG 91 29.100 -21.565 35.385 729 HB2 ARG 91 2HB ARG 91 28.809 -22.007 32.395 730 HB3 ARG 91 3HB ARG 91 29.077 -23.245 33.630 731 HG2 ARG 91 2HG ARG 91 26.605 -21.485 33.349 732 HG3 ARG 91 3HG ARG 91 26.731 -23.216 32.980 733 HD2 ARG 91 2HD ARG 91 27.277 -23.666 35.364 734 HD3 ARG 91 3HD ARG 91 27.075 -21.932 35.716 735 HE ARG 91 HE ARG 91 24.745 -23.048 34.421 736 HH11 ARG 91 1HH1 ARG 91 26.413 -22.752 37.525 737 HH12 ARG 91 2HH1 ARG 91 24.952 -22.931 38.464 738 HH21 ARG 91 1HH2 ARG 91 22.854 -23.292 35.660 739 HH22 ARG 91 2HH2 ARG 91 22.929 -23.240 37.404 740 H ARG 92 H ARG 92 30.615 -19.079 34.165 741 HA ARG 92 HA ARG 92 33.200 -20.517 33.835 742 HB2 ARG 92 2HB ARG 92 32.244 -19.501 31.740 743 HB3 ARG 92 3HB ARG 92 32.387 -17.907 32.499 744 HG2 ARG 92 2HG ARG 92 34.822 -18.145 32.622 745 HG3 ARG 92 3HG ARG 92 34.706 -19.846 32.122 746 HD2 ARG 92 2HD ARG 92 35.397 -18.448 30.238 747 HD3 ARG 92 3HD ARG 92 33.792 -19.141 29.942 748 HE ARG 92 HE ARG 92 33.678 -16.505 31.168 749 HH11 ARG 92 1HH1 ARG 92 34.039 -18.218 28.102 750 HH12 ARG 92 2HH1 ARG 92 33.435 -16.888 27.146 751 HH21 ARG 92 1HH2 ARG 92 32.879 -14.782 29.910 752 HH22 ARG 92 2HH2 ARG 92 32.790 -14.940 28.170 753 H LEU 93 H LEU 93 31.465 -18.842 35.994 754 HA LEU 93 HA LEU 93 33.860 -17.424 37.064 755 HB2 LEU 93 2HB LEU 93 32.153 -15.885 36.085 756 HB3 LEU 93 3HB LEU 93 30.951 -16.535 37.205 757 HG LEU 93 HG LEU 93 32.280 -15.692 39.124 758 HD11 LEU 93 1HD1 LEU 93 34.101 -14.581 36.943 759 HD12 LEU 93 2HD1 LEU 93 34.177 -14.131 38.666 760 HD13 LEU 93 3HD1 LEU 93 34.545 -15.792 38.172 761 HD21 LEU 93 3HD2 LEU 93 31.761 -13.608 36.966 762 HD22 LEU 93 1HD2 LEU 93 30.553 -14.267 38.096 763 HD23 LEU 93 2HD2 LEU 93 31.903 -13.295 38.714 764 H GLU 94 H GLU 94 31.405 -19.803 37.572 765 HA GLU 94 HA GLU 94 31.329 -19.548 40.454 766 HB2 GLU 94 2HB GLU 94 30.050 -21.619 40.392 767 HB3 GLU 94 3HB GLU 94 29.433 -20.463 39.200 768 HG2 GLU 94 2HG GLU 94 30.565 -21.666 37.389 769 HG3 GLU 94 3HG GLU 94 31.369 -22.726 38.557 770 H LEU 95 H LEU 95 33.840 -20.417 38.509 771 HA LEU 95 HA LEU 95 34.781 -22.739 40.019 772 HB2 LEU 95 2HB LEU 95 36.120 -20.968 37.933 773 HB3 LEU 95 3HB LEU 95 36.838 -22.407 38.650 774 HG LEU 95 HG LEU 95 36.046 -23.030 36.526 775 HD11 LEU 95 1HD1 LEU 95 33.960 -24.000 38.518 776 HD12 LEU 95 2HD1 LEU 95 34.453 -24.802 37.011 777 HD13 LEU 95 3HD1 LEU 95 35.609 -24.655 38.355 778 HD21 LEU 95 3HD2 LEU 95 33.247 -22.066 37.202 779 HD22 LEU 95 1HD2 LEU 95 34.417 -21.157 36.206 780 HD23 LEU 95 2HD2 LEU 95 33.825 -22.743 35.675 781 H VAL 96 H VAL 96 34.646 -19.412 40.622 782 HA VAL 96 HA VAL 96 37.192 -19.187 42.022 783 HB VAL 96 HB VAL 96 34.749 -17.371 41.939 784 HG11 VAL 96 1HG1 VAL 96 37.605 -16.812 42.849 785 HG12 VAL 96 2HG1 VAL 96 36.300 -15.616 42.708 786 HG13 VAL 96 3HG1 VAL 96 36.174 -16.915 43.911 787 HG21 VAL 96 3HG2 VAL 96 37.381 -17.284 40.401 788 HG22 VAL 96 1HG2 VAL 96 35.786 -17.679 39.720 789 HG23 VAL 96 2HG2 VAL 96 36.102 -16.052 40.347 790 HA PRO 97 HA PRO 97 35.871 -20.987 45.863 791 HB2 PRO 97 2HB PRO 97 37.376 -18.662 47.065 792 HB3 PRO 97 3HB PRO 97 37.439 -20.399 47.525 793 HG2 PRO 97 2HG PRO 97 39.415 -19.362 46.003 794 HG3 PRO 97 3HG PRO 97 38.684 -20.940 45.535 795 HD2 PRO 97 2HD PRO 97 38.081 -18.192 44.430 796 HD3 PRO 97 3HD PRO 97 38.370 -19.728 43.546 797 H ARG 98 H ARG 98 34.406 -20.612 47.629 798 HA ARG 98 HA ARG 98 32.366 -18.705 46.917 799 HB2 ARG 98 2HB ARG 98 32.633 -20.496 49.361 800 HB3 ARG 98 3HB ARG 98 31.164 -19.639 48.857 801 HG2 ARG 98 2HG ARG 98 32.604 -21.814 47.274 802 HG3 ARG 98 3HG ARG 98 31.082 -21.994 48.156 803 HD2 ARG 98 2HD ARG 98 30.034 -20.283 46.693 804 HD3 ARG 98 3HD ARG 98 31.544 -20.137 45.781 805 HE ARG 98 HE ARG 98 29.797 -22.555 45.879 806 HH11 ARG 98 1HH1 ARG 98 32.373 -20.690 44.287 807 HH12 ARG 98 2HH1 ARG 98 32.355 -21.698 42.865 808 HH21 ARG 98 1HH2 ARG 98 29.842 -23.846 43.998 809 HH22 ARG 98 2HH2 ARG 98 30.963 -23.467 42.711 810 H GLY 99 H GLY 99 31.354 -17.188 48.390 811 HA2 GLY 99 2HA GLY 99 31.425 -15.541 50.060 812 HA3 GLY 99 3HA GLY 99 33.136 -15.900 50.357 813 H SER 100 H SER 100 33.129 -15.816 47.104 814 HA SER 100 HA SER 100 32.801 -12.951 46.623 815 HB2 SER 100 2HB SER 100 35.069 -13.067 47.619 816 HB3 SER 100 3HB SER 100 35.537 -14.275 46.400 817 HG SER 100 HG SER 100 36.117 -12.125 45.819 818 H HIS 101 H HIS 101 32.369 -12.574 44.483 819 HA HIS 101 HA HIS 101 31.593 -13.095 42.416 820 HB2 HIS 101 2HB HIS 101 34.222 -14.602 42.298 821 HB3 HIS 101 3HB HIS 101 33.245 -14.117 40.906 822 HD2 HIS 101 HD2 HIS 101 36.099 -12.938 42.909 823 HE1 HIS 101 HE1 HIS 101 34.511 -9.372 41.224 824 HE2 HIS 101 HE2 HIS 101 36.505 -10.396 42.433 825 H HIS 102 H HIS 102 30.780 -15.010 44.585 826 HA HIS 102 HA HIS 102 30.719 -17.610 43.260 827 HB2 HIS 102 2HB HIS 102 29.594 -18.333 45.320 828 HB3 HIS 102 3HB HIS 102 31.100 -17.463 45.647 829 HD2 HIS 102 HD2 HIS 102 27.296 -17.182 46.098 830 HE1 HIS 102 HE1 HIS 102 29.006 -13.885 48.173 831 HE2 HIS 102 HE2 HIS 102 26.854 -15.170 47.717 832 H HIS 103 H HIS 103 28.975 -14.882 42.677 833 HA HIS 103 HA HIS 103 26.303 -16.021 42.588 834 HB2 HIS 103 2HB HIS 103 26.683 -13.620 42.904 835 HB3 HIS 103 3HB HIS 103 27.480 -13.523 41.324 836 HD2 HIS 103 HD2 HIS 103 25.944 -12.676 39.450 837 HE1 HIS 103 HE1 HIS 103 22.172 -13.997 40.911 838 HE2 HIS 103 HE2 HIS 103 23.355 -12.731 39.039 839 H HIS 104 H HIS 104 25.113 -16.602 40.734 840 HA HIS 104 HA HIS 104 26.485 -16.844 38.152 841 HB2 HIS 104 2HB HIS 104 26.139 -19.259 38.001 842 HB3 HIS 104 3HB HIS 104 27.214 -18.877 39.347 843 HD2 HIS 104 HD2 HIS 104 23.794 -20.384 38.533 844 HE1 HIS 104 HE1 HIS 104 24.252 -20.736 42.746 845 HE2 HIS 104 HE2 HIS 104 22.827 -21.407 40.743 846 H HIS 105 H HIS 105 24.992 -17.708 36.473 847 HA HIS 105 HA HIS 105 22.199 -16.872 37.042 848 HB2 HIS 105 2HB HIS 105 23.648 -17.305 34.413 849 HB3 HIS 105 3HB HIS 105 21.989 -16.724 34.601 850 HD2 HIS 105 HD2 HIS 105 21.641 -14.218 35.585 851 HE1 HIS 105 HE1 HIS 105 25.676 -12.954 35.119 852 HE2 HIS 105 HE2 HIS 105 23.291 -12.182 35.584 853 H HIS 106 H HIS 106 20.436 -18.189 36.361 854 HA HIS 106 HA HIS 106 21.002 -20.976 35.606 855 HB2 HIS 106 2HB HIS 106 21.205 -20.906 38.085 856 HB3 HIS 106 3HB HIS 106 19.570 -20.242 38.187 857 HD2 HIS 106 HD2 HIS 106 17.518 -21.927 37.732 858 HE1 HIS 106 HE1 HIS 106 19.801 -25.510 37.519 859 HE2 HIS 106 HE2 HIS 106 17.448 -24.547 37.672 Start of MODEL 2 1 H1 MET 1 H1 MET 1 1.851 3.835 2.771 2 H2 MET 1 H2 MET 1 1.377 3.430 4.295 3 H3 MET 1 H3 MET 1 0.251 3.651 3.118 4 HA MET 1 HA MET 1 0.585 1.329 3.602 5 HB2 MET 1 2HB MET 1 0.864 0.560 1.312 6 HB3 MET 1 3HB MET 1 -0.141 2.010 1.344 7 HG2 MET 1 2HG MET 1 1.808 3.388 0.696 8 HG3 MET 1 3HG MET 1 2.835 1.947 0.692 9 HE1 MET 1 1HE MET 1 3.699 2.502 -1.690 10 HE2 MET 1 2HE MET 1 2.648 2.869 -3.078 11 HE3 MET 1 3HE MET 1 2.702 3.976 -1.690 12 H SER 2 H SER 2 2.045 -0.574 3.024 13 HA SER 2 HA SER 2 4.583 -0.230 4.321 14 HB2 SER 2 2HB SER 2 3.480 -2.564 2.714 15 HB3 SER 2 3HB SER 2 4.871 -2.617 3.820 16 HG SER 2 HG SER 2 2.917 -3.301 4.802 17 H GLU 3 H GLU 3 6.625 -1.143 3.323 18 HA GLU 3 HA GLU 3 7.320 0.434 1.011 19 HB2 GLU 3 2HB GLU 3 8.827 -1.748 2.515 20 HB3 GLU 3 3HB GLU 3 9.506 -0.763 1.219 21 HG2 GLU 3 2HG GLU 3 10.200 0.224 3.267 22 HG3 GLU 3 3HG GLU 3 9.002 1.299 2.546 23 H GLN 4 H GLN 4 8.392 -0.489 -0.945 24 HA GLN 4 HA GLN 4 6.634 -2.477 -2.137 25 HB2 GLN 4 2HB GLN 4 9.052 -0.971 -3.211 26 HB3 GLN 4 3HB GLN 4 7.986 -2.012 -4.174 27 HG2 GLN 4 2HG GLN 4 6.050 -0.567 -3.577 28 HG3 GLN 4 3HG GLN 4 7.140 0.503 -2.674 29 HE21 GLN 4 2HE2 GLN 4 8.968 1.507 -3.915 30 HE22 GLN 4 1HE2 GLN 4 8.687 1.923 -5.595 31 H LEU 5 H LEU 5 9.187 -2.835 -0.117 32 HA LEU 5 HA LEU 5 9.865 -5.497 -1.264 33 HB2 LEU 5 2HB LEU 5 11.753 -3.549 0.118 34 HB3 LEU 5 3HB LEU 5 12.171 -5.185 -0.412 35 HG LEU 5 HG LEU 5 11.361 -2.876 -2.230 36 HD11 LEU 5 1HD1 LEU 5 14.039 -4.243 -1.740 37 HD12 LEU 5 2HD1 LEU 5 13.736 -2.924 -2.896 38 HD13 LEU 5 3HD1 LEU 5 13.584 -2.626 -1.152 39 HD21 LEU 5 3HD2 LEU 5 12.482 -5.619 -2.953 40 HD22 LEU 5 1HD2 LEU 5 10.781 -5.145 -3.167 41 HD23 LEU 5 2HD2 LEU 5 12.057 -4.314 -4.077 42 H THR 6 H THR 6 10.464 -7.073 0.342 43 HA THR 6 HA THR 6 9.542 -6.510 3.111 44 HB THR 6 HB THR 6 8.516 -8.801 1.377 45 HG1 THR 6 1HG THR 6 7.632 -6.822 0.735 46 HG21 THR 6 1HG2 THR 6 7.875 -7.855 4.194 47 HG22 THR 6 2HG2 THR 6 6.808 -8.928 3.261 48 HG23 THR 6 3HG2 THR 6 8.440 -9.472 3.673 49 H ASP 7 H ASP 7 9.944 -8.640 4.455 50 HA ASP 7 HA ASP 7 12.697 -9.130 4.494 51 HB2 ASP 7 2HB ASP 7 12.144 -10.887 6.115 52 HB3 ASP 7 3HB ASP 7 11.203 -9.416 6.397 53 H GLN 8 H GLN 8 10.314 -10.532 2.395 54 HA GLN 8 HA GLN 8 11.627 -13.030 1.883 55 HB2 GLN 8 2HB GLN 8 9.291 -12.613 1.262 56 HB3 GLN 8 3HB GLN 8 9.781 -11.279 0.208 57 HG2 GLN 8 2HG GLN 8 9.303 -13.286 -1.127 58 HG3 GLN 8 3HG GLN 8 11.010 -12.848 -1.252 59 HE21 GLN 8 2HE2 GLN 8 12.597 -14.150 -0.129 60 HE22 GLN 8 1HE2 GLN 8 12.216 -15.797 0.350 61 H VAL 9 H VAL 9 11.703 -9.854 0.196 62 HA VAL 9 HA VAL 9 13.808 -10.804 -1.605 63 HB VAL 9 HB VAL 9 12.096 -9.508 -2.608 64 HG11 VAL 9 1HG1 VAL 9 12.608 -7.379 -0.509 65 HG12 VAL 9 2HG1 VAL 9 11.500 -7.235 -1.905 66 HG13 VAL 9 3HG1 VAL 9 11.168 -8.425 -0.636 67 HG21 VAL 9 3HG2 VAL 9 14.422 -7.582 -2.215 68 HG22 VAL 9 1HG2 VAL 9 14.440 -8.966 -3.336 69 HG23 VAL 9 2HG2 VAL 9 13.291 -7.631 -3.577 70 H LEU 10 H LEU 10 13.533 -8.885 1.353 71 HA LEU 10 HA LEU 10 16.124 -7.655 1.142 72 HB2 LEU 10 2HB LEU 10 14.024 -8.057 3.233 73 HB3 LEU 10 3HB LEU 10 15.677 -7.781 3.810 74 HG LEU 10 HG LEU 10 15.850 -5.713 2.564 75 HD11 LEU 10 1HD1 LEU 10 14.451 -6.214 0.616 76 HD12 LEU 10 2HD1 LEU 10 12.999 -6.215 1.656 77 HD13 LEU 10 3HD1 LEU 10 13.927 -4.718 1.408 78 HD21 LEU 10 3HD2 LEU 10 13.238 -5.886 4.139 79 HD22 LEU 10 1HD2 LEU 10 14.865 -5.681 4.838 80 HD23 LEU 10 2HD2 LEU 10 14.165 -4.405 3.822 81 H VAL 11 H VAL 11 15.016 -10.888 2.189 82 HA VAL 11 HA VAL 11 17.650 -11.468 3.329 83 HB VAL 11 HB VAL 11 15.188 -13.166 2.844 84 HG11 VAL 11 1HG1 VAL 11 16.410 -14.880 4.222 85 HG12 VAL 11 2HG1 VAL 11 17.103 -14.646 2.601 86 HG13 VAL 11 3HG1 VAL 11 17.894 -13.918 4.018 87 HG21 VAL 11 3HG2 VAL 11 15.119 -13.162 5.307 88 HG22 VAL 11 1HG2 VAL 11 16.639 -12.241 5.373 89 HG23 VAL 11 2HG2 VAL 11 15.167 -11.485 4.721 90 H GLU 12 H GLU 12 15.981 -11.864 0.197 91 HA GLU 12 HA GLU 12 17.982 -13.666 -0.878 92 HB2 GLU 12 2HB GLU 12 15.920 -11.814 -2.130 93 HB3 GLU 12 3HB GLU 12 17.002 -12.842 -3.076 94 HG2 GLU 12 2HG GLU 12 16.150 -14.846 -1.902 95 HG3 GLU 12 3HG GLU 12 15.042 -13.833 -0.966 96 H ARG 13 H ARG 13 17.613 -10.129 -0.655 97 HA ARG 13 HA ARG 13 19.690 -9.527 -2.552 98 HB2 ARG 13 2HB ARG 13 17.847 -8.024 -2.005 99 HB3 ARG 13 3HB ARG 13 18.411 -7.885 -0.328 100 HG2 ARG 13 2HG ARG 13 20.417 -6.758 -1.006 101 HG3 ARG 13 3HG ARG 13 20.110 -7.091 -2.729 102 HD2 ARG 13 2HD ARG 13 18.314 -5.401 -0.947 103 HD3 ARG 13 3HD ARG 13 19.536 -4.750 -2.060 104 HE ARG 13 HE ARG 13 17.890 -6.469 -3.563 105 HH11 ARG 13 1HH1 ARG 13 17.588 -3.435 -1.775 106 HH12 ARG 13 2HH1 ARG 13 16.296 -2.832 -2.790 107 HH21 ARG 13 1HH2 ARG 13 16.195 -5.661 -4.862 108 HH22 ARG 13 2HH2 ARG 13 15.506 -4.090 -4.527 109 H VAL 14 H VAL 14 19.698 -9.961 1.018 110 HA VAL 14 HA VAL 14 22.465 -9.137 1.247 111 HB VAL 14 HB VAL 14 22.329 -10.016 3.519 112 HG11 VAL 14 1HG1 VAL 14 20.386 -8.635 4.285 113 HG12 VAL 14 2HG1 VAL 14 21.464 -7.795 3.130 114 HG13 VAL 14 3HG1 VAL 14 19.893 -8.436 2.595 115 HG21 VAL 14 3HG2 VAL 14 20.241 -10.958 4.370 116 HG22 VAL 14 1HG2 VAL 14 19.568 -10.986 2.720 117 HG23 VAL 14 2HG2 VAL 14 20.961 -12.022 3.141 118 H GLN 15 H GLN 15 20.848 -12.154 0.399 119 HA GLN 15 HA GLN 15 23.232 -13.789 0.774 120 HB2 GLN 15 2HB GLN 15 20.593 -14.204 -0.674 121 HB3 GLN 15 3HB GLN 15 21.864 -15.431 -0.593 122 HG2 GLN 15 2HG GLN 15 21.765 -15.470 1.852 123 HG3 GLN 15 3HG GLN 15 20.575 -14.180 1.875 124 HE21 GLN 15 2HE2 GLN 15 19.900 -16.525 3.150 125 HE22 GLN 15 1HE2 GLN 15 18.690 -17.382 2.220 126 H LYS 16 H LYS 16 22.113 -11.527 -1.592 127 HA LYS 16 HA LYS 16 23.785 -12.646 -3.744 128 HB2 LYS 16 2HB LYS 16 21.796 -10.379 -3.561 129 HB3 LYS 16 3HB LYS 16 22.799 -10.651 -5.002 130 HG2 LYS 16 2HG LYS 16 21.923 -12.883 -5.298 131 HG3 LYS 16 3HG LYS 16 21.106 -12.840 -3.728 132 HD2 LYS 16 2HD LYS 16 19.720 -10.916 -4.560 133 HD3 LYS 16 3HD LYS 16 20.428 -11.151 -6.173 134 HE2 LYS 16 2HE LYS 16 18.932 -13.278 -4.578 135 HE3 LYS 16 3HE LYS 16 18.215 -12.296 -5.866 136 HZ1 LYS 16 3HZ LYS 16 20.470 -14.164 -6.190 137 HZ2 LYS 16 1HZ LYS 16 18.928 -14.418 -6.691 138 HZ3 LYS 16 2HZ LYS 16 19.827 -13.232 -7.385 139 H GLY 17 H GLY 17 24.458 -10.909 -1.028 140 HA2 GLY 17 2HA GLY 17 26.736 -10.332 -0.646 141 HA3 GLY 17 3HA GLY 17 26.901 -9.839 -2.340 142 H ASP 18 H ASP 18 23.946 -8.610 -1.265 143 HA ASP 18 HA ASP 18 25.159 -5.948 -0.847 144 HB2 ASP 18 2HB ASP 18 22.431 -7.005 -1.606 145 HB3 ASP 18 3HB ASP 18 22.623 -5.352 -1.043 146 H GLN 19 H GLN 19 25.960 -6.366 1.287 147 HA GLN 19 HA GLN 19 24.287 -7.278 3.416 148 HB2 GLN 19 2HB GLN 19 26.734 -7.444 3.343 149 HB3 GLN 19 3HB GLN 19 26.887 -5.689 3.429 150 HG2 GLN 19 2HG GLN 19 25.396 -7.259 5.558 151 HG3 GLN 19 3HG GLN 19 27.155 -7.153 5.588 152 HE21 GLN 19 2HE2 GLN 19 25.834 -6.191 7.765 153 HE22 GLN 19 1HE2 GLN 19 25.904 -4.442 7.794 154 H LYS 20 H LYS 20 24.544 -4.220 1.793 155 HA LYS 20 HA LYS 20 23.757 -2.447 3.863 156 HB2 LYS 20 2HB LYS 20 23.088 -0.986 2.018 157 HB3 LYS 20 3HB LYS 20 24.612 -1.798 1.621 158 HG2 LYS 20 2HG LYS 20 23.314 -3.504 0.306 159 HG3 LYS 20 3HG LYS 20 21.834 -2.572 0.626 160 HD2 LYS 20 2HD LYS 20 22.874 -0.598 -0.490 161 HD3 LYS 20 3HD LYS 20 24.308 -1.600 -0.853 162 HE2 LYS 20 2HE LYS 20 22.854 -3.193 -2.089 163 HE3 LYS 20 3HE LYS 20 21.458 -2.144 -1.780 164 HZ1 LYS 20 3HZ LYS 20 22.412 -1.740 -3.943 165 HZ2 LYS 20 1HZ LYS 20 22.593 -0.407 -2.997 166 HZ3 LYS 20 2HZ LYS 20 23.878 -1.388 -3.284 167 H ALA 21 H ALA 21 21.938 -4.892 2.072 168 HA ALA 21 HA ALA 21 19.357 -3.756 2.813 169 HB1 ALA 21 1HB ALA 21 18.458 -5.798 1.764 170 HB2 ALA 21 2HB ALA 21 19.636 -4.975 0.718 171 HB3 ALA 21 3HB ALA 21 20.110 -6.442 1.608 172 H PHE 22 H PHE 22 21.734 -5.836 4.320 173 HA PHE 22 HA PHE 22 19.818 -7.154 6.067 174 HB2 PHE 22 2HB PHE 22 22.047 -8.135 5.500 175 HB3 PHE 22 3HB PHE 22 22.826 -6.817 6.364 176 HD1 PHE 22 HD2 PHE 22 20.086 -9.353 6.914 177 HD2 PHE 22 HD1 PHE 22 23.446 -7.241 8.581 178 HE1 PHE 22 HE2 PHE 22 19.848 -10.632 9.014 179 HE2 PHE 22 HE1 PHE 22 23.198 -8.515 10.691 180 HZ PHE 22 HZ PHE 22 21.398 -10.215 10.912 181 H ASN 23 H ASN 23 21.903 -4.257 6.156 182 HA ASN 23 HA ASN 23 21.493 -3.562 8.894 183 HB2 ASN 23 2HB ASN 23 23.238 -2.519 7.633 184 HB3 ASN 23 3HB ASN 23 22.126 -2.080 6.333 185 HD21 ASN 23 2HD2 ASN 23 21.040 -0.161 6.369 186 HD22 ASN 23 1HD2 ASN 23 21.144 0.989 7.684 187 H LEU 24 H LEU 24 19.685 -2.825 5.899 188 HA LEU 24 HA LEU 24 17.698 -1.217 7.259 189 HB2 LEU 24 2HB LEU 24 17.735 -2.552 4.530 190 HB3 LEU 24 3HB LEU 24 16.525 -1.376 5.063 191 HG LEU 24 HG LEU 24 19.517 -0.814 4.886 192 HD11 LEU 24 1HD1 LEU 24 18.929 0.504 2.888 193 HD12 LEU 24 2HD1 LEU 24 18.525 -1.215 2.680 194 HD13 LEU 24 3HD1 LEU 24 17.238 -0.040 3.028 195 HD21 LEU 24 3HD2 LEU 24 18.796 1.553 5.096 196 HD22 LEU 24 1HD2 LEU 24 17.118 1.014 5.345 197 HD23 LEU 24 2HD2 LEU 24 18.379 0.614 6.538 198 H LEU 25 H LEU 25 18.182 -4.647 6.821 199 HA LEU 25 HA LEU 25 15.359 -5.308 7.233 200 HB2 LEU 25 2HB LEU 25 16.779 -6.685 5.784 201 HB3 LEU 25 3HB LEU 25 17.898 -6.982 7.121 202 HG LEU 25 HG LEU 25 16.091 -8.178 8.349 203 HD11 LEU 25 1HD1 LEU 25 14.034 -8.819 7.137 204 HD12 LEU 25 2HD1 LEU 25 14.108 -7.065 7.382 205 HD13 LEU 25 3HD1 LEU 25 14.495 -7.767 5.786 206 HD21 LEU 25 3HD2 LEU 25 16.609 -9.103 5.491 207 HD22 LEU 25 1HD2 LEU 25 17.654 -9.397 6.899 208 HD23 LEU 25 2HD2 LEU 25 16.042 -10.141 6.822 209 H VAL 26 H VAL 26 18.415 -5.457 9.196 210 HA VAL 26 HA VAL 26 17.030 -6.699 11.374 211 HB VAL 26 HB VAL 26 18.969 -6.258 12.723 212 HG11 VAL 26 1HG1 VAL 26 19.104 -8.096 11.094 213 HG12 VAL 26 2HG1 VAL 26 19.824 -6.997 9.899 214 HG13 VAL 26 3HG1 VAL 26 20.692 -7.356 11.405 215 HG21 VAL 26 3HG2 VAL 26 19.933 -4.460 10.477 216 HG22 VAL 26 1HG2 VAL 26 19.458 -3.968 12.129 217 HG23 VAL 26 2HG2 VAL 26 20.896 -4.970 11.880 218 H VAL 27 H VAL 27 17.271 -3.304 10.377 219 HA VAL 27 HA VAL 27 16.743 -2.297 13.027 220 HB VAL 27 HB VAL 27 17.826 -0.963 11.278 221 HG11 VAL 27 1HG1 VAL 27 15.067 -0.863 9.984 222 HG12 VAL 27 2HG1 VAL 27 16.500 0.072 9.501 223 HG13 VAL 27 3HG1 VAL 27 16.508 -1.696 9.337 224 HG21 VAL 27 3HG2 VAL 27 15.195 0.236 12.229 225 HG22 VAL 27 1HG2 VAL 27 16.686 0.114 13.194 226 HG23 VAL 27 2HG2 VAL 27 16.647 1.127 11.733 227 H ARG 28 H ARG 28 14.675 -3.565 10.435 228 HA ARG 28 HA ARG 28 12.195 -2.531 11.476 229 HB2 ARG 28 2HB ARG 28 12.638 -5.164 10.006 230 HB3 ARG 28 3HB ARG 28 11.158 -4.204 10.076 231 HG2 ARG 28 2HG ARG 28 12.332 -2.384 8.802 232 HG3 ARG 28 3HG ARG 28 13.767 -3.441 8.714 233 HD2 ARG 28 2HD ARG 28 12.566 -3.675 6.648 234 HD3 ARG 28 3HD ARG 28 12.380 -5.170 7.565 235 HE ARG 28 HE ARG 28 10.098 -4.657 7.975 236 HH11 ARG 28 1HH1 ARG 28 11.686 -2.135 6.055 237 HH12 ARG 28 2HH1 ARG 28 10.162 -1.447 5.527 238 HH21 ARG 28 1HH2 ARG 28 8.138 -3.688 7.250 239 HH22 ARG 28 2HH2 ARG 28 8.222 -2.294 6.193 240 H TYR 29 H TYR 29 14.288 -5.259 12.234 241 HA TYR 29 HA TYR 29 12.282 -6.320 14.139 242 HB2 TYR 29 2HB TYR 29 14.782 -7.484 12.886 243 HB3 TYR 29 3HB TYR 29 13.851 -8.287 14.158 244 HD1 TYR 29 HD1 TYR 29 13.783 -7.142 10.639 245 HD2 TYR 29 HD2 TYR 29 11.704 -9.249 13.740 246 HE1 TYR 29 HE1 TYR 29 12.168 -7.985 8.956 247 HE2 TYR 29 HE2 TYR 29 10.096 -10.139 12.077 248 HH TYR 29 HH TYR 29 10.296 -9.283 8.590 249 H GLN 30 H GLN 30 14.979 -4.256 14.184 250 HA GLN 30 HA GLN 30 16.368 -5.154 16.482 251 HB2 GLN 30 2HB GLN 30 17.162 -3.508 14.817 252 HB3 GLN 30 3HB GLN 30 15.973 -2.334 15.411 253 HG2 GLN 30 2HG GLN 30 17.072 -2.297 17.595 254 HG3 GLN 30 3HG GLN 30 18.181 -3.589 17.083 255 HE21 GLN 30 2HE2 GLN 30 19.351 -3.079 14.888 256 HE22 GLN 30 1HE2 GLN 30 20.022 -1.466 14.770 257 H HIS 31 H HIS 31 13.358 -3.324 16.107 258 HA HIS 31 HA HIS 31 13.210 -2.775 18.997 259 HB2 HIS 31 2HB HIS 31 11.235 -2.382 16.725 260 HB3 HIS 31 3HB HIS 31 11.000 -1.837 18.389 261 HD2 HIS 31 HD2 HIS 31 12.949 0.012 19.299 262 HE1 HIS 31 HE1 HIS 31 13.765 1.522 15.408 263 HE2 HIS 31 HE2 HIS 31 14.047 1.940 17.896 264 H LYS 32 H LYS 32 12.005 -5.152 16.655 265 HA LYS 32 HA LYS 32 9.969 -6.212 18.426 266 HB2 LYS 32 2HB LYS 32 11.266 -7.337 15.913 267 HB3 LYS 32 3HB LYS 32 9.853 -8.034 16.728 268 HG2 LYS 32 2HG LYS 32 8.577 -5.979 16.382 269 HG3 LYS 32 3HG LYS 32 9.982 -5.204 15.607 270 HD2 LYS 32 2HD LYS 32 9.973 -6.872 13.817 271 HD3 LYS 32 3HD LYS 32 8.635 -7.741 14.602 272 HE2 LYS 32 2HE LYS 32 7.800 -6.348 12.765 273 HE3 LYS 32 3HE LYS 32 7.171 -5.789 14.326 274 HZ1 LYS 32 3HZ LYS 32 8.794 -4.057 14.323 275 HZ2 LYS 32 1HZ LYS 32 9.468 -4.587 12.924 276 HZ3 LYS 32 2HZ LYS 32 7.932 -3.984 12.930 277 H VAL 33 H VAL 33 13.356 -7.217 17.627 278 HA VAL 33 HA VAL 33 13.023 -9.590 19.286 279 HB VAL 33 HB VAL 33 15.271 -10.140 18.750 280 HG11 VAL 33 1HG1 VAL 33 13.911 -8.945 16.301 281 HG12 VAL 33 2HG1 VAL 33 15.150 -10.216 16.303 282 HG13 VAL 33 3HG1 VAL 33 13.558 -10.532 17.020 283 HG21 VAL 33 3HG2 VAL 33 16.726 -8.702 17.398 284 HG22 VAL 33 1HG2 VAL 33 15.562 -7.365 17.555 285 HG23 VAL 33 2HG2 VAL 33 16.389 -8.008 18.994 286 H ALA 34 H ALA 34 14.184 -6.282 19.746 287 HA ALA 34 HA ALA 34 15.610 -6.852 22.186 288 HB1 ALA 34 1HB ALA 34 14.310 -4.278 21.210 289 HB2 ALA 34 2HB ALA 34 15.493 -4.427 22.532 290 HB3 ALA 34 3HB ALA 34 15.979 -4.804 20.867 291 H SER 35 H SER 35 12.221 -6.560 21.338 292 HA SER 35 HA SER 35 11.296 -5.933 24.022 293 HB2 SER 35 2HB SER 35 10.040 -5.369 21.949 294 HB3 SER 35 3HB SER 35 9.820 -7.106 21.633 295 HG SER 35 HG SER 35 8.048 -6.130 22.749 296 H LEU 36 H LEU 36 11.645 -8.884 22.013 297 HA LEU 36 HA LEU 36 10.493 -10.515 24.147 298 HB2 LEU 36 2HB LEU 36 10.666 -12.349 22.616 299 HB3 LEU 36 3HB LEU 36 10.008 -10.934 21.791 300 HG LEU 36 HG LEU 36 12.489 -10.528 21.029 301 HD11 LEU 36 1HD1 LEU 36 13.563 -12.341 22.369 302 HD12 LEU 36 2HD1 LEU 36 12.493 -13.533 21.595 303 HD13 LEU 36 3HD1 LEU 36 13.705 -12.659 20.635 304 HD21 LEU 36 3HD2 LEU 36 10.794 -12.823 19.957 305 HD22 LEU 36 1HD2 LEU 36 10.596 -11.102 19.549 306 HD23 LEU 36 2HD2 LEU 36 12.068 -11.973 19.055 307 H VAL 37 H VAL 37 13.731 -9.550 23.156 308 HA VAL 37 HA VAL 37 14.891 -11.789 24.651 309 HB VAL 37 HB VAL 37 15.751 -10.886 22.435 310 HG11 VAL 37 1HG1 VAL 37 17.236 -9.056 22.418 311 HG12 VAL 37 2HG1 VAL 37 15.831 -8.467 23.348 312 HG13 VAL 37 3HG1 VAL 37 17.318 -8.991 24.188 313 HG21 VAL 37 3HG2 VAL 37 17.709 -11.211 24.736 314 HG22 VAL 37 1HG2 VAL 37 16.902 -12.544 23.870 315 HG23 VAL 37 2HG2 VAL 37 18.034 -11.476 23.010 316 H SER 38 H SER 38 13.994 -8.466 25.267 317 HA SER 38 HA SER 38 15.713 -8.054 27.540 318 HB2 SER 38 2HB SER 38 14.476 -6.248 26.337 319 HB3 SER 38 3HB SER 38 12.952 -6.911 26.959 320 HG SER 38 HG SER 38 13.789 -5.213 28.250 321 H ARG 39 H ARG 39 13.195 -10.248 26.929 322 HA ARG 39 HA ARG 39 12.326 -10.489 29.725 323 HB2 ARG 39 2HB ARG 39 11.580 -12.184 27.322 324 HB3 ARG 39 3HB ARG 39 10.719 -12.075 28.869 325 HG2 ARG 39 2HG ARG 39 10.229 -9.673 28.419 326 HG3 ARG 39 3HG ARG 39 11.100 -9.800 26.876 327 HD2 ARG 39 2HD ARG 39 9.496 -11.636 26.215 328 HD3 ARG 39 3HD ARG 39 8.543 -11.229 27.658 329 HE ARG 39 HE ARG 39 9.206 -8.984 25.877 330 HH11 ARG 39 1HH1 ARG 39 6.809 -11.443 26.706 331 HH12 ARG 39 2HH1 ARG 39 5.491 -10.586 25.941 332 HH21 ARG 39 1HH2 ARG 39 7.486 -7.900 24.874 333 HH22 ARG 39 2HH2 ARG 39 5.877 -8.583 24.897 334 H TYR 40 H TYR 40 14.995 -11.524 27.976 335 HA TYR 40 HA TYR 40 15.266 -13.958 29.685 336 HB2 TYR 40 2HB TYR 40 16.264 -13.501 26.856 337 HB3 TYR 40 3HB TYR 40 16.650 -14.901 27.863 338 HD1 TYR 40 HD1 TYR 40 14.669 -16.324 28.748 339 HD2 TYR 40 HD2 TYR 40 14.369 -13.552 25.471 340 HE1 TYR 40 HE1 TYR 40 12.602 -17.463 27.976 341 HE2 TYR 40 HE2 TYR 40 12.313 -14.695 24.685 342 HH TYR 40 HH TYR 40 10.933 -17.514 26.410 343 H VAL 41 H VAL 41 16.569 -10.869 28.830 344 HA VAL 41 HA VAL 41 18.741 -11.355 30.764 345 HB VAL 41 HB VAL 41 20.282 -9.952 29.285 346 HG11 VAL 41 1HG1 VAL 41 21.122 -11.873 28.060 347 HG12 VAL 41 2HG1 VAL 41 20.613 -12.365 29.691 348 HG13 VAL 41 3HG1 VAL 41 19.585 -12.738 28.294 349 HG21 VAL 41 3HG2 VAL 41 18.546 -9.209 27.663 350 HG22 VAL 41 1HG2 VAL 41 19.940 -9.992 26.897 351 HG23 VAL 41 2HG2 VAL 41 18.418 -10.891 27.082 352 HA PRO 42 HA PRO 42 17.357 -7.498 32.288 353 HB2 PRO 42 2HB PRO 42 19.592 -6.364 33.368 354 HB3 PRO 42 3HB PRO 42 18.838 -7.841 34.046 355 HG2 PRO 42 2HG PRO 42 21.158 -7.688 32.096 356 HG3 PRO 42 3HG PRO 42 21.083 -8.593 33.647 357 HD2 PRO 42 2HD PRO 42 20.566 -9.832 31.303 358 HD3 PRO 42 3HD PRO 42 19.546 -10.174 32.735 359 H SER 43 H SER 43 17.602 -5.107 32.102 360 HA SER 43 HA SER 43 17.799 -4.400 29.350 361 HB2 SER 43 2HB SER 43 17.304 -2.127 30.169 362 HB3 SER 43 3HB SER 43 16.234 -3.344 30.902 363 HG SER 43 HG SER 43 17.095 -1.882 32.441 364 H GLY 44 H GLY 44 20.283 -4.699 31.689 365 HA2 GLY 44 2HA GLY 44 22.011 -2.645 30.490 366 HA3 GLY 44 3HA GLY 44 22.407 -3.760 31.816 367 H ASP 45 H ASP 45 21.243 -6.012 29.967 368 HA ASP 45 HA ASP 45 23.731 -6.362 28.355 369 HB2 ASP 45 2HB ASP 45 22.019 -8.413 29.797 370 HB3 ASP 45 3HB ASP 45 23.386 -8.784 28.740 371 H VAL 46 H VAL 46 20.408 -5.811 28.126 372 HA VAL 46 HA VAL 46 19.742 -7.667 26.063 373 HB VAL 46 HB VAL 46 18.130 -6.477 27.542 374 HG11 VAL 46 1HG1 VAL 46 19.016 -4.188 27.396 375 HG12 VAL 46 2HG1 VAL 46 18.572 -4.134 25.663 376 HG13 VAL 46 3HG1 VAL 46 17.311 -4.281 26.905 377 HG21 VAL 46 3HG2 VAL 46 17.311 -7.652 25.647 378 HG22 VAL 46 1HG2 VAL 46 16.434 -6.116 25.755 379 HG23 VAL 46 2HG2 VAL 46 17.714 -6.309 24.537 380 HA PRO 47 HA PRO 47 20.667 -4.252 22.925 381 HB2 PRO 47 2HB PRO 47 22.682 -2.483 23.264 382 HB3 PRO 47 3HB PRO 47 21.067 -2.207 23.998 383 HG2 PRO 47 2HG PRO 47 23.523 -3.419 25.317 384 HG3 PRO 47 3HG PRO 47 22.498 -2.081 25.922 385 HD2 PRO 47 2HD PRO 47 22.158 -4.653 26.710 386 HD3 PRO 47 3HD PRO 47 20.756 -3.558 26.499 387 H ASP 48 H ASP 48 23.268 -5.764 24.802 388 HA ASP 48 HA ASP 48 25.052 -5.947 22.495 389 HB2 ASP 48 2HB ASP 48 25.851 -5.714 24.848 390 HB3 ASP 48 3HB ASP 48 25.147 -7.299 25.225 391 H VAL 49 H VAL 49 22.592 -7.935 24.093 392 HA VAL 49 HA VAL 49 23.325 -10.354 22.641 393 HB VAL 49 HB VAL 49 20.925 -9.566 24.337 394 HG11 VAL 49 1HG1 VAL 49 20.377 -11.970 24.365 395 HG12 VAL 49 2HG1 VAL 49 20.243 -11.315 22.723 396 HG13 VAL 49 3HG1 VAL 49 21.665 -12.288 23.182 397 HG21 VAL 49 3HG2 VAL 49 21.968 -11.094 25.972 398 HG22 VAL 49 1HG2 VAL 49 23.291 -11.427 24.839 399 HG23 VAL 49 2HG2 VAL 49 23.104 -9.804 25.530 400 H VAL 50 H VAL 50 21.193 -7.561 22.088 401 HA VAL 50 HA VAL 50 19.778 -8.776 19.874 402 HB VAL 50 HB VAL 50 20.262 -5.904 20.745 403 HG11 VAL 50 1HG1 VAL 50 18.493 -5.287 19.109 404 HG12 VAL 50 2HG1 VAL 50 19.962 -5.878 18.307 405 HG13 VAL 50 3HG1 VAL 50 18.544 -6.942 18.453 406 HG21 VAL 50 3HG2 VAL 50 17.756 -7.643 20.682 407 HG22 VAL 50 1HG2 VAL 50 18.744 -7.376 22.129 408 HG23 VAL 50 2HG2 VAL 50 17.899 -6.007 21.365 409 H GLN 51 H GLN 51 22.844 -6.973 20.262 410 HA GLN 51 HA GLN 51 23.279 -6.735 17.404 411 HB2 GLN 51 2HB GLN 51 24.299 -5.204 19.027 412 HB3 GLN 51 3HB GLN 51 25.203 -6.558 19.756 413 HG2 GLN 51 2HG GLN 51 26.411 -6.938 17.688 414 HG3 GLN 51 3HG GLN 51 25.445 -5.712 16.844 415 HE21 GLN 51 2HE2 GLN 51 27.970 -5.210 16.525 416 HE22 GLN 51 1HE2 GLN 51 28.582 -3.985 17.619 417 H GLU 52 H GLU 52 24.363 -9.058 19.968 418 HA GLU 52 HA GLU 52 25.980 -10.556 18.131 419 HB2 GLU 52 2HB GLU 52 26.207 -10.614 20.612 420 HB3 GLU 52 3HB GLU 52 24.662 -11.481 20.722 421 HG2 GLU 52 2HG GLU 52 25.548 -13.357 19.471 422 HG3 GLU 52 3HG GLU 52 27.021 -12.460 19.069 423 H ALA 53 H ALA 53 22.508 -10.503 18.841 424 HA ALA 53 HA ALA 53 21.959 -13.058 17.625 425 HB1 ALA 53 1HB ALA 53 20.434 -12.019 19.250 426 HB2 ALA 53 2HB ALA 53 20.167 -10.650 18.146 427 HB3 ALA 53 3HB ALA 53 19.614 -12.275 17.691 428 H PHE 54 H PHE 54 22.354 -9.722 16.402 429 HA PHE 54 HA PHE 54 21.325 -10.496 13.761 430 HB2 PHE 54 2HB PHE 54 22.598 -7.962 14.836 431 HB3 PHE 54 3HB PHE 54 22.069 -8.156 13.174 432 HD1 PHE 54 HD1 PHE 54 19.499 -9.781 13.753 433 HD2 PHE 54 HD2 PHE 54 21.121 -6.185 15.490 434 HE1 PHE 54 HE1 PHE 54 17.226 -9.047 14.366 435 HE2 PHE 54 HE2 PHE 54 18.820 -5.440 16.050 436 HZ PHE 54 HZ PHE 54 16.882 -6.876 15.487 437 H ILE 55 H ILE 55 24.480 -10.216 15.384 438 HA ILE 55 HA ILE 55 25.979 -10.468 12.907 439 HB ILE 55 HB ILE 55 26.691 -11.002 15.819 440 HG12 ILE 55 2HG1 ILE 55 27.396 -8.666 13.979 441 HG13 ILE 55 3HG1 ILE 55 26.112 -8.618 15.171 442 HG21 ILE 55 1HG2 ILE 55 28.489 -10.818 13.365 443 HG22 ILE 55 2HG2 ILE 55 29.038 -10.989 15.053 444 HG23 ILE 55 3HG2 ILE 55 28.142 -12.298 14.281 445 HD11 ILE 55 3HD1 ILE 55 28.103 -7.567 16.086 446 HD12 ILE 55 1HD1 ILE 55 27.787 -9.074 16.974 447 HD13 ILE 55 2HD1 ILE 55 29.077 -9.007 15.746 448 H LYS 56 H LYS 56 24.626 -12.682 15.359 449 HA LYS 56 HA LYS 56 25.768 -15.069 14.180 450 HB2 LYS 56 2HB LYS 56 25.177 -14.818 16.566 451 HB3 LYS 56 3HB LYS 56 23.471 -14.624 16.133 452 HG2 LYS 56 2HG LYS 56 23.478 -16.910 15.141 453 HG3 LYS 56 3HG LYS 56 25.178 -17.103 15.635 454 HD2 LYS 56 2HD LYS 56 22.846 -16.531 17.518 455 HD3 LYS 56 3HD LYS 56 23.556 -18.132 17.245 456 HE2 LYS 56 2HE LYS 56 25.747 -17.289 18.049 457 HE3 LYS 56 3HE LYS 56 25.021 -15.692 18.326 458 HZ1 LYS 56 3HZ LYS 56 24.210 -18.190 19.656 459 HZ2 LYS 56 1HZ LYS 56 25.082 -16.976 20.340 460 HZ3 LYS 56 2HZ LYS 56 23.522 -16.708 19.883 461 H ALA 57 H ALA 57 22.731 -13.219 13.798 462 HA ALA 57 HA ALA 57 21.326 -15.310 12.423 463 HB1 ALA 57 1HB ALA 57 20.994 -12.282 12.352 464 HB2 ALA 57 2HB ALA 57 19.853 -13.443 11.653 465 HB3 ALA 57 3HB ALA 57 20.118 -13.423 13.405 466 H TYR 58 H TYR 58 23.389 -12.555 11.266 467 HA TYR 58 HA TYR 58 22.822 -12.919 8.519 468 HB2 TYR 58 2HB TYR 58 23.949 -10.967 9.590 469 HB3 TYR 58 3HB TYR 58 25.390 -11.966 9.829 470 HD1 TYR 58 HD2 TYR 58 23.104 -10.630 7.189 471 HD2 TYR 58 HD1 TYR 58 26.986 -12.218 8.111 472 HE1 TYR 58 HE2 TYR 58 23.903 -9.961 4.938 473 HE2 TYR 58 HE1 TYR 58 27.792 -11.589 5.855 474 HH TYR 58 HH TYR 58 27.253 -10.602 3.845 475 H ARG 59 H ARG 59 25.223 -14.469 10.642 476 HA ARG 59 HA ARG 59 26.649 -15.816 8.515 477 HB2 ARG 59 2HB ARG 59 26.459 -16.257 11.522 478 HB3 ARG 59 3HB ARG 59 27.625 -17.076 10.463 479 HG2 ARG 59 2HG ARG 59 28.683 -14.996 9.873 480 HG3 ARG 59 3HG ARG 59 27.414 -14.040 10.677 481 HD2 ARG 59 2HD ARG 59 28.032 -14.934 12.847 482 HD3 ARG 59 3HD ARG 59 29.198 -16.042 12.094 483 HE ARG 59 HE ARG 59 29.892 -13.413 11.316 484 HH11 ARG 59 1HH1 ARG 59 29.739 -15.342 14.272 485 HH12 ARG 59 2HH1 ARG 59 31.022 -14.459 15.062 486 HH21 ARG 59 1HH2 ARG 59 31.570 -12.275 12.359 487 HH22 ARG 59 2HH2 ARG 59 32.065 -12.726 13.974 488 H ALA 60 H ALA 60 23.770 -16.508 10.395 489 HA ALA 60 HA ALA 60 23.655 -19.282 9.374 490 HB1 ALA 60 1HB ALA 60 21.840 -17.740 11.264 491 HB2 ALA 60 2HB ALA 60 21.717 -19.471 10.871 492 HB3 ALA 60 3HB ALA 60 23.139 -18.856 11.742 493 H LEU 61 H LEU 61 22.700 -16.147 8.401 494 HA LEU 61 HA LEU 61 20.136 -16.816 7.265 495 HB2 LEU 61 2HB LEU 61 20.953 -14.536 8.058 496 HB3 LEU 61 3HB LEU 61 21.993 -14.494 6.625 497 HG LEU 61 HG LEU 61 19.908 -14.736 5.210 498 HD11 LEU 61 1HD1 LEU 61 18.587 -14.372 7.923 499 HD12 LEU 61 2HD1 LEU 61 17.742 -14.206 6.367 500 HD13 LEU 61 3HD1 LEU 61 18.402 -15.785 6.851 501 HD21 LEU 61 3HD2 LEU 61 19.157 -12.417 5.602 502 HD22 LEU 61 1HD2 LEU 61 19.951 -12.424 7.198 503 HD23 LEU 61 2HD2 LEU 61 20.931 -12.544 5.714 504 H ASP 62 H ASP 62 23.489 -17.008 6.237 505 HA ASP 62 HA ASP 62 23.016 -17.300 3.422 506 HB2 ASP 62 2HB ASP 62 25.212 -16.822 4.504 507 HB3 ASP 62 3HB ASP 62 25.212 -18.460 5.180 508 H SER 63 H SER 63 22.123 -19.254 6.089 509 HA SER 63 HA SER 63 21.918 -21.681 4.384 510 HB2 SER 63 2HB SER 63 21.943 -21.391 7.411 511 HB3 SER 63 3HB SER 63 21.800 -22.912 6.504 512 HG SER 63 HG SER 63 23.953 -22.470 7.144 513 H PHE 64 H PHE 64 20.071 -19.076 5.249 514 HA PHE 64 HA PHE 64 17.627 -20.432 6.004 515 HB2 PHE 64 2HB PHE 64 18.106 -18.084 6.577 516 HB3 PHE 64 3HB PHE 64 18.133 -17.667 4.857 517 HD1 PHE 64 HD1 PHE 64 15.923 -19.069 7.533 518 HD2 PHE 64 HD2 PHE 64 16.156 -17.061 3.738 519 HE1 PHE 64 HE1 PHE 64 13.478 -18.668 7.590 520 HE2 PHE 64 HE2 PHE 64 13.712 -16.652 3.803 521 HZ PHE 64 HZ PHE 64 12.368 -17.458 5.727 522 H ARG 65 H ARG 65 15.897 -21.028 4.698 523 HA ARG 65 HA ARG 65 16.297 -20.856 1.757 524 HB2 ARG 65 2HB ARG 65 15.799 -23.381 3.374 525 HB3 ARG 65 3HB ARG 65 15.652 -23.280 1.607 526 HG2 ARG 65 2HG ARG 65 18.010 -22.585 1.432 527 HG3 ARG 65 3HG ARG 65 18.186 -22.693 3.198 528 HD2 ARG 65 2HD ARG 65 17.651 -25.095 3.125 529 HD3 ARG 65 3HD ARG 65 17.385 -24.996 1.378 530 HE ARG 65 HE ARG 65 19.692 -24.866 1.003 531 HH11 ARG 65 1HH1 ARG 65 19.000 -24.775 4.475 532 HH12 ARG 65 2HH1 ARG 65 20.658 -25.087 4.931 533 HH21 ARG 65 1HH2 ARG 65 21.841 -25.265 1.626 534 HH22 ARG 65 2HH2 ARG 65 22.264 -25.353 3.321 535 H GLY 66 H GLY 66 14.304 -19.991 4.175 536 HA2 GLY 66 2HA GLY 66 12.172 -19.134 4.015 537 HA3 GLY 66 3HA GLY 66 12.096 -19.678 2.338 538 H ASP 67 H ASP 67 12.904 -22.208 4.605 539 HA ASP 67 HA ASP 67 10.412 -23.568 4.112 540 HB2 ASP 67 2HB ASP 67 12.663 -24.112 6.079 541 HB3 ASP 67 3HB ASP 67 11.324 -25.220 5.741 542 H SER 68 H SER 68 11.188 -21.036 6.198 543 HA SER 68 HA SER 68 8.636 -21.327 7.628 544 HB2 SER 68 2HB SER 68 10.323 -22.449 9.086 545 HB3 SER 68 3HB SER 68 11.283 -20.956 9.084 546 HG SER 68 HG SER 68 9.866 -21.147 10.904 547 H ALA 69 H ALA 69 8.131 -19.209 8.768 548 HA ALA 69 HA ALA 69 8.677 -17.028 6.995 549 HB1 ALA 69 1HB ALA 69 6.590 -17.235 8.291 550 HB2 ALA 69 2HB ALA 69 7.507 -17.042 9.800 551 HB3 ALA 69 3HB ALA 69 7.417 -15.697 8.633 552 H PHE 70 H PHE 70 9.941 -15.122 7.318 553 HA PHE 70 HA PHE 70 12.481 -15.707 8.484 554 HB2 PHE 70 2HB PHE 70 12.266 -14.246 6.556 555 HB3 PHE 70 3HB PHE 70 11.264 -13.117 7.482 556 HD1 PHE 70 HD1 PHE 70 14.657 -14.733 7.593 557 HD2 PHE 70 HD2 PHE 70 12.263 -11.280 8.509 558 HE1 PHE 70 HE1 PHE 70 16.673 -13.550 8.407 559 HE2 PHE 70 HE2 PHE 70 14.285 -10.085 9.295 560 HZ PHE 70 HZ PHE 70 16.502 -11.219 9.242 561 H TYR 71 H TYR 71 9.631 -13.889 9.701 562 HA TYR 71 HA TYR 71 11.132 -12.653 11.812 563 HB2 TYR 71 2HB TYR 71 8.979 -12.074 12.765 564 HB3 TYR 71 3HB TYR 71 9.028 -11.720 11.042 565 HD1 TYR 71 HD2 TYR 71 7.693 -14.036 13.622 566 HD2 TYR 71 HD1 TYR 71 7.489 -12.760 9.522 567 HE1 TYR 71 HE2 TYR 71 5.599 -15.332 13.332 568 HE2 TYR 71 HE1 TYR 71 5.379 -14.038 9.224 569 HH TYR 71 HH TYR 71 3.830 -15.401 10.213 570 H THR 72 H THR 72 9.301 -15.742 11.574 571 HA THR 72 HA THR 72 9.570 -16.353 14.377 572 HB THR 72 HB THR 72 9.221 -18.214 11.993 573 HG1 THR 72 1HG THR 72 7.024 -18.023 12.534 574 HG21 THR 72 1HG2 THR 72 9.907 -19.408 14.049 575 HG22 THR 72 2HG2 THR 72 8.645 -18.558 14.969 576 HG23 THR 72 3HG2 THR 72 8.197 -19.724 13.697 577 H TRP 73 H TRP 73 11.521 -16.956 11.454 578 HA TRP 73 HA TRP 73 13.373 -18.752 12.709 579 HB2 TRP 73 2HB TRP 73 13.008 -18.677 10.309 580 HB3 TRP 73 3HB TRP 73 13.516 -16.988 10.242 581 HD1 TRP 73 HD1 TRP 73 14.870 -20.506 10.299 582 HE1 TRP 73 HE1 TRP 73 17.393 -20.493 9.912 583 HE3 TRP 73 HE3 TRP 73 15.713 -15.460 10.629 584 HZ2 TRP 73 HZ2 TRP 73 19.533 -18.552 9.857 585 HZ3 TRP 73 HZ3 TRP 73 18.008 -14.572 10.394 586 HH2 TRP 73 HH2 TRP 73 19.918 -16.102 10.043 587 H LEU 74 H LEU 74 13.152 -15.206 12.479 588 HA LEU 74 HA LEU 74 15.907 -14.817 13.345 589 HB2 LEU 74 2HB LEU 74 14.785 -13.316 11.750 590 HB3 LEU 74 3HB LEU 74 13.574 -12.904 12.978 591 HG LEU 74 HG LEU 74 15.345 -11.919 14.402 592 HD11 LEU 74 1HD1 LEU 74 17.287 -13.260 13.670 593 HD12 LEU 74 2HD1 LEU 74 17.162 -12.573 12.033 594 HD13 LEU 74 3HD1 LEU 74 17.609 -11.537 13.411 595 HD21 LEU 74 3HD2 LEU 74 15.346 -10.901 11.529 596 HD22 LEU 74 1HD2 LEU 74 14.118 -10.538 12.767 597 HD23 LEU 74 2HD2 LEU 74 15.787 -9.954 12.964 598 H TYR 75 H TYR 75 12.634 -14.732 14.834 599 HA TYR 75 HA TYR 75 13.453 -13.576 17.317 600 HB2 TYR 75 2HB TYR 75 11.255 -15.587 16.711 601 HB3 TYR 75 3HB TYR 75 11.419 -14.686 18.214 602 HD1 TYR 75 HD2 TYR 75 12.344 -12.177 16.116 603 HD2 TYR 75 HD1 TYR 75 8.902 -14.639 16.912 604 HE1 TYR 75 HE2 TYR 75 10.866 -10.398 15.235 605 HE2 TYR 75 HE1 TYR 75 7.421 -12.854 16.029 606 HH TYR 75 HH TYR 75 7.308 -10.756 15.110 607 H ARG 76 H ARG 76 13.813 -16.809 15.966 608 HA ARG 76 HA ARG 76 14.350 -18.142 18.478 609 HB2 ARG 76 2HB ARG 76 14.861 -18.841 15.564 610 HB3 ARG 76 3HB ARG 76 15.241 -19.933 16.916 611 HG2 ARG 76 2HG ARG 76 12.926 -19.932 17.650 612 HG3 ARG 76 3HG ARG 76 12.490 -18.753 16.401 613 HD2 ARG 76 2HD ARG 76 13.147 -20.369 14.639 614 HD3 ARG 76 3HD ARG 76 13.602 -21.545 15.881 615 HE ARG 76 HE ARG 76 10.933 -20.796 16.390 616 HH11 ARG 76 1HH1 ARG 76 12.765 -22.427 13.837 617 HH12 ARG 76 2HH1 ARG 76 11.414 -23.413 13.335 618 HH21 ARG 76 1HH2 ARG 76 9.186 -22.101 15.711 619 HH22 ARG 76 2HH2 ARG 76 9.400 -23.231 14.393 620 H ILE 77 H ILE 77 16.292 -16.265 16.188 621 HA ILE 77 HA ILE 77 18.823 -17.318 17.142 622 HB ILE 77 HB ILE 77 18.323 -14.619 15.827 623 HG12 ILE 77 2HG1 ILE 77 17.313 -16.249 14.359 624 HG13 ILE 77 3HG1 ILE 77 18.843 -15.696 13.674 625 HG21 ILE 77 1HG2 ILE 77 20.741 -16.457 16.015 626 HG22 ILE 77 2HG2 ILE 77 20.663 -14.983 15.023 627 HG23 ILE 77 3HG2 ILE 77 20.540 -14.870 16.785 628 HD11 ILE 77 3HD1 ILE 77 19.944 -17.789 14.478 629 HD12 ILE 77 1HD1 ILE 77 18.371 -18.341 15.118 630 HD13 ILE 77 2HD1 ILE 77 18.595 -18.103 13.375 631 H ALA 78 H ALA 78 16.671 -14.634 18.102 632 HA ALA 78 HA ALA 78 18.696 -13.413 19.774 633 HB1 ALA 78 1HB ALA 78 15.686 -12.987 19.590 634 HB2 ALA 78 2HB ALA 78 16.830 -11.921 20.434 635 HB3 ALA 78 3HB ALA 78 16.932 -12.101 18.673 636 H VAL 79 H VAL 79 15.979 -15.693 20.384 637 HA VAL 79 HA VAL 79 16.318 -15.394 23.269 638 HB VAL 79 HB VAL 79 14.134 -15.867 22.310 639 HG11 VAL 79 1HG1 VAL 79 14.871 -17.296 20.408 640 HG12 VAL 79 2HG1 VAL 79 15.268 -18.594 21.560 641 HG13 VAL 79 3HG1 VAL 79 13.583 -18.050 21.375 642 HG21 VAL 79 3HG2 VAL 79 14.721 -16.638 24.621 643 HG22 VAL 79 1HG2 VAL 79 13.467 -17.634 23.842 644 HG23 VAL 79 2HG2 VAL 79 15.135 -18.233 23.949 645 H ASN 80 H ASN 80 17.609 -17.551 20.760 646 HA ASN 80 HA ASN 80 18.647 -19.458 22.705 647 HB2 ASN 80 2HB ASN 80 19.214 -18.975 19.753 648 HB3 ASN 80 3HB ASN 80 19.953 -20.269 20.706 649 HD21 ASN 80 2HD2 ASN 80 18.618 -21.114 18.567 650 HD22 ASN 80 1HD2 ASN 80 17.074 -21.816 19.010 651 H THR 81 H THR 81 19.722 -16.395 21.318 652 HA THR 81 HA THR 81 22.498 -16.801 22.143 653 HB THR 81 HB THR 81 21.020 -14.317 21.180 654 HG1 THR 81 1HG THR 81 21.110 -15.801 19.573 655 HG21 THR 81 1HG2 THR 81 23.995 -14.926 21.467 656 HG22 THR 81 2HG2 THR 81 23.305 -13.491 20.669 657 HG23 THR 81 3HG2 THR 81 23.083 -13.727 22.412 658 H ALA 82 H ALA 82 19.538 -15.466 23.562 659 HA ALA 82 HA ALA 82 20.953 -14.033 25.656 660 HB1 ALA 82 1HB ALA 82 18.687 -13.735 26.579 661 HB2 ALA 82 2HB ALA 82 18.719 -13.375 24.837 662 HB3 ALA 82 3HB ALA 82 18.050 -14.921 25.414 663 H LYS 83 H LYS 83 19.541 -17.293 25.282 664 HA LYS 83 HA LYS 83 19.923 -17.937 28.100 665 HB2 LYS 83 2HB LYS 83 19.303 -19.597 25.631 666 HB3 LYS 83 3HB LYS 83 19.431 -20.265 27.275 667 HG2 LYS 83 2HG LYS 83 17.644 -18.800 28.069 668 HG3 LYS 83 3HG LYS 83 17.528 -18.011 26.486 669 HD2 LYS 83 2HD LYS 83 16.857 -20.126 25.443 670 HD3 LYS 83 3HD LYS 83 17.010 -20.974 27.002 671 HE2 LYS 83 2HE LYS 83 15.135 -18.630 26.450 672 HE3 LYS 83 3HE LYS 83 14.651 -20.332 26.402 673 HZ1 LYS 83 3HZ LYS 83 14.151 -19.344 28.514 674 HZ2 LYS 83 1HZ LYS 83 15.282 -20.521 28.707 675 HZ3 LYS 83 2HZ LYS 83 15.724 -18.941 28.764 676 H ASN 84 H ASN 84 21.834 -18.071 25.134 677 HA ASN 84 HA ASN 84 23.939 -19.708 26.299 678 HB2 ASN 84 2HB ASN 84 23.484 -19.638 23.878 679 HB3 ASN 84 3HB ASN 84 23.865 -17.910 23.849 680 HD21 ASN 84 2HD2 ASN 84 26.011 -17.246 23.755 681 HD22 ASN 84 1HD2 ASN 84 27.358 -18.364 23.698 682 H TYR 85 H TYR 85 23.024 -16.316 26.337 683 HA TYR 85 HA TYR 85 25.681 -15.301 26.918 684 HB2 TYR 85 2HB TYR 85 23.851 -14.041 25.780 685 HB3 TYR 85 3HB TYR 85 22.932 -14.057 27.293 686 HD1 TYR 85 HD1 TYR 85 25.888 -12.715 25.537 687 HD2 TYR 85 HD2 TYR 85 23.531 -12.597 29.127 688 HE1 TYR 85 HE1 TYR 85 27.057 -10.637 26.223 689 HE2 TYR 85 HE2 TYR 85 24.678 -10.505 29.819 690 HH TYR 85 HH TYR 85 27.236 -8.992 27.809 691 H LEU 86 H LEU 86 22.826 -16.307 28.825 692 HA LEU 86 HA LEU 86 23.934 -15.287 31.309 693 HB2 LEU 86 2HB LEU 86 21.657 -17.212 30.715 694 HB3 LEU 86 3HB LEU 86 22.088 -16.641 32.335 695 HG LEU 86 HG LEU 86 21.162 -14.878 30.040 696 HD11 LEU 86 1HD1 LEU 86 19.204 -14.572 31.565 697 HD12 LEU 86 2HD1 LEU 86 19.393 -16.263 31.046 698 HD13 LEU 86 3HD1 LEU 86 19.900 -15.767 32.677 699 HD21 LEU 86 3HD2 LEU 86 21.088 -13.114 31.821 700 HD22 LEU 86 1HD2 LEU 86 21.929 -14.227 32.922 701 HD23 LEU 86 2HD2 LEU 86 22.740 -13.633 31.450 702 H VAL 87 H VAL 87 24.111 -18.431 29.595 703 HA VAL 87 HA VAL 87 25.307 -19.697 31.941 704 HB VAL 87 HB VAL 87 25.791 -21.575 30.438 705 HG11 VAL 87 1HG1 VAL 87 23.591 -21.379 31.553 706 HG12 VAL 87 2HG1 VAL 87 22.964 -20.474 30.156 707 HG13 VAL 87 3HG1 VAL 87 23.450 -22.172 29.965 708 HG21 VAL 87 3HG2 VAL 87 26.242 -20.340 28.359 709 HG22 VAL 87 1HG2 VAL 87 24.957 -21.541 28.113 710 HG23 VAL 87 2HG2 VAL 87 24.540 -19.821 28.290 711 H ALA 88 H ALA 88 26.437 -17.733 29.269 712 HA ALA 88 HA ALA 88 29.183 -18.494 29.334 713 HB1 ALA 88 1HB ALA 88 29.555 -16.299 28.278 714 HB2 ALA 88 2HB ALA 88 28.142 -17.104 27.558 715 HB3 ALA 88 3HB ALA 88 27.920 -15.784 28.736 716 H GLN 89 H GLN 89 27.174 -16.601 31.501 717 HA GLN 89 HA GLN 89 29.530 -15.631 33.009 718 HB2 GLN 89 2HB GLN 89 26.549 -15.193 33.456 719 HB3 GLN 89 3HB GLN 89 27.879 -14.371 34.301 720 HG2 GLN 89 2HG GLN 89 28.640 -13.399 32.152 721 HG3 GLN 89 3HG GLN 89 27.321 -14.223 31.306 722 HE21 GLN 89 2HE2 GLN 89 26.604 -12.101 30.578 723 HE22 GLN 89 1HE2 GLN 89 25.685 -11.078 31.659 724 H GLY 90 H GLY 90 26.986 -18.070 33.074 725 HA2 GLY 90 2HA GLY 90 27.285 -18.768 35.850 726 HA3 GLY 90 3HA GLY 90 26.474 -19.712 34.584 727 H ARG 91 H ARG 91 29.392 -19.178 33.224 728 HA ARG 91 HA ARG 91 30.756 -21.399 34.662 729 HB2 ARG 91 2HB ARG 91 31.474 -22.327 32.569 730 HB3 ARG 91 3HB ARG 91 29.719 -22.087 32.494 731 HG2 ARG 91 2HG ARG 91 30.201 -19.854 31.329 732 HG3 ARG 91 3HG ARG 91 31.890 -20.380 31.207 733 HD2 ARG 91 2HD ARG 91 31.159 -22.416 29.994 734 HD3 ARG 91 3HD ARG 91 29.473 -21.889 30.136 735 HE ARG 91 HE ARG 91 31.348 -20.020 28.819 736 HH11 ARG 91 1HH1 ARG 91 28.835 -22.485 28.454 737 HH12 ARG 91 2HH1 ARG 91 28.452 -22.010 26.814 738 HH21 ARG 91 1HH2 ARG 91 30.820 -19.428 26.686 739 HH22 ARG 91 2HH2 ARG 91 29.564 -20.283 25.822 740 H ARG 92 H ARG 92 30.943 -18.234 34.450 741 HA ARG 92 HA ARG 92 33.915 -18.217 34.282 742 HB2 ARG 92 2HB ARG 92 32.939 -17.486 32.118 743 HB3 ARG 92 3HB ARG 92 32.021 -16.230 32.962 744 HG2 ARG 92 2HG ARG 92 34.124 -15.150 33.683 745 HG3 ARG 92 3HG ARG 92 35.061 -16.441 32.898 746 HD2 ARG 92 2HD ARG 92 34.084 -15.805 30.714 747 HD3 ARG 92 3HD ARG 92 33.116 -14.550 31.512 748 HE ARG 92 HE ARG 92 35.913 -14.207 32.103 749 HH11 ARG 92 1HH1 ARG 92 33.544 -13.755 29.510 750 HH12 ARG 92 2HH1 ARG 92 34.426 -12.430 28.784 751 HH21 ARG 92 1HH2 ARG 92 37.044 -12.498 31.123 752 HH22 ARG 92 2HH2 ARG 92 36.409 -11.730 29.686 753 H LEU 93 H LEU 93 30.941 -17.061 35.731 754 HA LEU 93 HA LEU 93 32.542 -15.428 37.638 755 HB2 LEU 93 2HB LEU 93 29.818 -14.774 36.447 756 HB3 LEU 93 3HB LEU 93 30.623 -13.849 37.727 757 HG LEU 93 HG LEU 93 31.736 -14.246 34.917 758 HD11 LEU 93 1HD1 LEU 93 30.392 -11.843 36.213 759 HD12 LEU 93 2HD1 LEU 93 31.117 -11.887 34.591 760 HD13 LEU 93 3HD1 LEU 93 29.681 -12.875 34.951 761 HD21 LEU 93 3HD2 LEU 93 32.590 -12.434 37.225 762 HD22 LEU 93 1HD2 LEU 93 33.495 -13.844 36.628 763 HD23 LEU 93 2HD2 LEU 93 33.283 -12.425 35.585 764 H GLU 94 H GLU 94 31.085 -18.251 37.439 765 HA GLU 94 HA GLU 94 29.174 -18.031 39.638 766 HB2 GLU 94 2HB GLU 94 28.979 -19.509 37.592 767 HB3 GLU 94 3HB GLU 94 30.284 -20.499 38.256 768 HG2 GLU 94 2HG GLU 94 28.130 -21.501 38.791 769 HG3 GLU 94 3HG GLU 94 28.881 -20.926 40.281 770 H LEU 95 H LEU 95 32.562 -18.611 39.234 771 HA LEU 95 HA LEU 95 34.252 -19.119 40.604 772 HB2 LEU 95 2HB LEU 95 32.463 -17.893 42.720 773 HB3 LEU 95 3HB LEU 95 34.225 -18.066 42.801 774 HG LEU 95 HG LEU 95 32.686 -16.388 40.776 775 HD11 LEU 95 1HD1 LEU 95 33.724 -14.495 41.957 776 HD12 LEU 95 2HD1 LEU 95 32.718 -15.457 43.065 777 HD13 LEU 95 3HD1 LEU 95 34.490 -15.615 43.104 778 HD21 LEU 95 3HD2 LEU 95 34.763 -17.266 39.773 779 HD22 LEU 95 1HD2 LEU 95 34.937 -15.545 40.132 780 HD23 LEU 95 2HD2 LEU 95 35.684 -16.745 41.209 781 H VAL 96 H VAL 96 32.029 -21.266 40.455 782 HA VAL 96 HA VAL 96 32.407 -22.642 43.006 783 HB VAL 96 HB VAL 96 31.199 -24.515 41.812 784 HG11 VAL 96 1HG1 VAL 96 29.887 -21.775 41.953 785 HG12 VAL 96 2HG1 VAL 96 29.029 -23.334 41.881 786 HG13 VAL 96 3HG1 VAL 96 30.051 -22.939 43.281 787 HG21 VAL 96 3HG2 VAL 96 30.826 -22.399 39.654 788 HG22 VAL 96 1HG2 VAL 96 31.792 -23.890 39.487 789 HG23 VAL 96 2HG2 VAL 96 30.035 -23.983 39.724 790 HA PRO 97 HA PRO 97 36.060 -24.849 41.909 791 HB2 PRO 97 2HB PRO 97 35.902 -27.035 43.515 792 HB3 PRO 97 3HB PRO 97 36.079 -25.381 44.188 793 HG2 PRO 97 2HG PRO 97 33.518 -26.966 43.806 794 HG3 PRO 97 3HG PRO 97 34.094 -26.146 45.301 795 HD2 PRO 97 2HD PRO 97 32.335 -24.952 43.605 796 HD3 PRO 97 3HD PRO 97 33.624 -24.005 44.409 797 H ARG 98 H ARG 98 36.825 -26.996 41.083 798 HA ARG 98 HA ARG 98 34.739 -28.535 39.613 799 HB2 ARG 98 2HB ARG 98 37.330 -27.399 38.491 800 HB3 ARG 98 3HB ARG 98 36.288 -28.552 37.645 801 HG2 ARG 98 2HG ARG 98 35.462 -25.754 38.533 802 HG3 ARG 98 3HG ARG 98 35.927 -26.217 36.892 803 HD2 ARG 98 2HD ARG 98 33.555 -27.338 38.436 804 HD3 ARG 98 3HD ARG 98 33.479 -26.117 37.161 805 HE ARG 98 HE ARG 98 34.690 -28.036 35.787 806 HH11 ARG 98 1HH1 ARG 98 32.022 -28.364 38.089 807 HH12 ARG 98 2HH1 ARG 98 31.365 -29.777 37.295 808 HH21 ARG 98 1HH2 ARG 98 33.792 -29.867 34.771 809 HH22 ARG 98 2HH2 ARG 98 32.364 -30.625 35.437 810 H GLY 99 H GLY 99 35.568 -30.629 38.816 811 HA2 GLY 99 2HA GLY 99 36.821 -32.565 39.015 812 HA3 GLY 99 3HA GLY 99 37.981 -31.714 40.052 813 H SER 100 H SER 100 34.968 -31.040 41.312 814 HA SER 100 HA SER 100 35.177 -33.251 43.288 815 HB2 SER 100 2HB SER 100 33.766 -30.563 43.456 816 HB3 SER 100 3HB SER 100 33.878 -31.771 44.757 817 HG SER 100 HG SER 100 35.495 -30.140 44.909 818 H HIS 101 H HIS 101 33.611 -32.692 40.476 819 HA HIS 101 HA HIS 101 30.907 -33.471 41.304 820 HB2 HIS 101 2HB HIS 101 30.424 -33.246 38.898 821 HB3 HIS 101 3HB HIS 101 31.194 -31.801 39.563 822 HD2 HIS 101 HD2 HIS 101 31.625 -34.450 36.899 823 HE1 HIS 101 HE1 HIS 101 35.220 -32.176 36.821 824 HE2 HIS 101 HE2 HIS 101 33.856 -33.958 35.615 825 H HIS 102 H HIS 102 29.823 -35.308 40.218 826 HA HIS 102 HA HIS 102 31.614 -37.536 39.455 827 HB2 HIS 102 2HB HIS 102 31.252 -37.586 41.936 828 HB3 HIS 102 3HB HIS 102 29.518 -37.760 41.642 829 HD2 HIS 102 HD2 HIS 102 28.874 -40.207 42.106 830 HE1 HIS 102 HE1 HIS 102 32.182 -42.210 40.339 831 HE2 HIS 102 HE2 HIS 102 29.950 -42.523 41.525 832 H HIS 103 H HIS 103 29.295 -35.650 38.419 833 HA HIS 103 HA HIS 103 27.491 -35.769 37.079 834 HB2 HIS 103 2HB HIS 103 28.681 -38.428 36.244 835 HB3 HIS 103 3HB HIS 103 27.508 -37.474 35.332 836 HD2 HIS 103 HD2 HIS 103 31.135 -38.042 35.570 837 HE1 HIS 103 HE1 HIS 103 30.834 -34.166 33.841 838 HE2 HIS 103 HE2 HIS 103 32.403 -36.116 34.319 839 H HIS 104 H HIS 104 27.276 -37.040 39.831 840 HA HIS 104 HA HIS 104 24.617 -38.238 39.389 841 HB2 HIS 104 2HB HIS 104 26.188 -40.147 39.400 842 HB3 HIS 104 3HB HIS 104 26.838 -39.604 40.954 843 HD2 HIS 104 HD2 HIS 104 25.856 -40.902 42.946 844 HE1 HIS 104 HE1 HIS 104 21.991 -41.816 41.426 845 HE2 HIS 104 HE2 HIS 104 23.570 -42.092 43.407 846 H HIS 105 H HIS 105 23.298 -38.211 41.307 847 HA HIS 105 HA HIS 105 24.313 -36.818 43.684 848 HB2 HIS 105 2HB HIS 105 23.727 -35.002 42.090 849 HB3 HIS 105 3HB HIS 105 22.091 -35.665 41.959 850 HD2 HIS 105 HD2 HIS 105 20.490 -34.161 43.302 851 HE1 HIS 105 HE1 HIS 105 22.901 -33.345 46.709 852 HE2 HIS 105 HE2 HIS 105 20.621 -32.975 45.635 853 H HIS 106 H HIS 106 22.680 -36.806 45.427 854 HA HIS 106 HA HIS 106 20.371 -38.600 45.066 855 HB2 HIS 106 2HB HIS 106 21.052 -40.061 46.894 856 HB3 HIS 106 3HB HIS 106 22.225 -40.122 45.580 857 HD2 HIS 106 HD2 HIS 106 24.595 -38.709 46.010 858 HE1 HIS 106 HE1 HIS 106 24.260 -38.751 50.248 859 HE2 HIS 106 HE2 HIS 106 25.831 -38.329 48.287 Start of MODEL 3 1 H1 MET 1 H1 MET 1 5.091 0.040 -9.253 2 H2 MET 1 H2 MET 1 3.751 0.996 -9.248 3 H3 MET 1 H3 MET 1 3.717 -0.458 -10.020 4 HA MET 1 HA MET 1 2.538 -0.613 -7.967 5 HB2 MET 1 2HB MET 1 5.210 -2.064 -7.896 6 HB3 MET 1 3HB MET 1 3.795 -2.483 -6.930 7 HG2 MET 1 2HG MET 1 3.992 -2.522 -9.964 8 HG3 MET 1 3HG MET 1 3.941 -3.918 -8.896 9 HE1 MET 1 1HE MET 1 1.827 -4.759 -7.610 10 HE2 MET 1 2HE MET 1 1.683 -3.190 -6.780 11 HE3 MET 1 3HE MET 1 0.264 -3.906 -7.578 12 H SER 2 H SER 2 2.765 -0.774 -5.566 13 HA SER 2 HA SER 2 4.841 0.998 -4.440 14 HB2 SER 2 2HB SER 2 2.817 2.366 -5.103 15 HB3 SER 2 3HB SER 2 1.891 1.447 -3.896 16 HG SER 2 HG SER 2 2.764 3.397 -3.045 17 H GLU 3 H GLU 3 4.152 -1.944 -4.370 18 HA GLU 3 HA GLU 3 3.147 -2.434 -1.689 19 HB2 GLU 3 2HB GLU 3 4.512 -4.262 -3.701 20 HB3 GLU 3 3HB GLU 3 3.672 -4.780 -2.229 21 HG2 GLU 3 2HG GLU 3 2.399 -3.332 -4.587 22 HG3 GLU 3 3HG GLU 3 2.245 -5.051 -4.202 23 H GLN 4 H GLN 4 6.123 -1.385 -2.895 24 HA GLN 4 HA GLN 4 8.236 -1.252 -2.110 25 HB2 GLN 4 2HB GLN 4 6.986 -1.626 0.623 26 HB3 GLN 4 3HB GLN 4 8.499 -0.799 0.238 27 HG2 GLN 4 2HG GLN 4 5.713 0.088 -0.622 28 HG3 GLN 4 3HG GLN 4 6.670 0.804 0.669 29 HE21 GLN 4 2HE2 GLN 4 5.655 2.286 -1.525 30 HE22 GLN 4 1HE2 GLN 4 7.013 2.867 -2.461 31 H LEU 5 H LEU 5 9.757 -2.300 -0.164 32 HA LEU 5 HA LEU 5 9.947 -5.128 -1.011 33 HB2 LEU 5 2HB LEU 5 11.928 -3.396 0.499 34 HB3 LEU 5 3HB LEU 5 12.243 -4.968 -0.256 35 HG LEU 5 HG LEU 5 11.560 -2.360 -1.676 36 HD11 LEU 5 1HD1 LEU 5 14.062 -4.093 -1.661 37 HD12 LEU 5 2HD1 LEU 5 13.836 -2.584 -2.579 38 HD13 LEU 5 3HD1 LEU 5 13.867 -2.552 -0.796 39 HD21 LEU 5 3HD2 LEU 5 12.163 -5.101 -2.863 40 HD22 LEU 5 1HD2 LEU 5 10.580 -4.283 -2.908 41 HD23 LEU 5 2HD2 LEU 5 11.961 -3.584 -3.773 42 H THR 6 H THR 6 10.489 -6.774 0.528 43 HA THR 6 HA THR 6 9.584 -6.302 3.314 44 HB THR 6 HB THR 6 8.480 -8.490 1.496 45 HG1 THR 6 1HG THR 6 7.653 -6.461 0.964 46 HG21 THR 6 1HG2 THR 6 7.920 -7.677 4.374 47 HG22 THR 6 2HG2 THR 6 6.791 -8.656 3.401 48 HG23 THR 6 3HG2 THR 6 8.415 -9.271 3.746 49 H ASP 7 H ASP 7 9.952 -8.488 4.581 50 HA ASP 7 HA ASP 7 12.694 -9.063 4.565 51 HB2 ASP 7 2HB ASP 7 12.098 -10.873 6.114 52 HB3 ASP 7 3HB ASP 7 11.217 -9.382 6.476 53 H GLN 8 H GLN 8 10.236 -10.313 2.461 54 HA GLN 8 HA GLN 8 11.437 -12.832 1.820 55 HB2 GLN 8 2HB GLN 8 9.122 -12.289 1.264 56 HB3 GLN 8 3HB GLN 8 9.651 -10.946 0.236 57 HG2 GLN 8 2HG GLN 8 9.061 -12.895 -1.143 58 HG3 GLN 8 3HG GLN 8 10.778 -12.532 -1.290 59 HE21 GLN 8 2HE2 GLN 8 12.337 -13.934 -0.259 60 HE22 GLN 8 1HE2 GLN 8 11.904 -15.563 0.216 61 H VAL 9 H VAL 9 11.599 -9.615 0.219 62 HA VAL 9 HA VAL 9 13.652 -10.583 -1.632 63 HB VAL 9 HB VAL 9 11.967 -9.169 -2.542 64 HG11 VAL 9 1HG1 VAL 9 12.693 -7.137 -0.407 65 HG12 VAL 9 2HG1 VAL 9 11.564 -6.879 -1.767 66 HG13 VAL 9 3HG1 VAL 9 11.174 -8.072 -0.514 67 HG21 VAL 9 3HG2 VAL 9 14.436 -7.420 -2.167 68 HG22 VAL 9 1HG2 VAL 9 14.306 -8.758 -3.337 69 HG23 VAL 9 2HG2 VAL 9 13.251 -7.334 -3.482 70 H LEU 10 H LEU 10 13.498 -8.761 1.399 71 HA LEU 10 HA LEU 10 16.131 -7.609 1.175 72 HB2 LEU 10 2HB LEU 10 14.037 -7.971 3.286 73 HB3 LEU 10 3HB LEU 10 15.705 -7.761 3.842 74 HG LEU 10 HG LEU 10 15.941 -5.689 2.644 75 HD11 LEU 10 1HD1 LEU 10 14.544 -6.093 0.683 76 HD12 LEU 10 2HD1 LEU 10 13.076 -6.083 1.709 77 HD13 LEU 10 3HD1 LEU 10 14.051 -4.604 1.502 78 HD21 LEU 10 3HD2 LEU 10 14.952 -5.640 4.904 79 HD22 LEU 10 1HD2 LEU 10 14.276 -4.339 3.902 80 HD23 LEU 10 2HD2 LEU 10 13.321 -5.811 4.202 81 H VAL 11 H VAL 11 14.935 -10.825 2.192 82 HA VAL 11 HA VAL 11 17.579 -11.504 3.265 83 HB VAL 11 HB VAL 11 15.069 -13.134 2.792 84 HG11 VAL 11 1HG1 VAL 11 17.772 -13.963 3.934 85 HG12 VAL 11 2HG1 VAL 11 16.278 -14.906 4.105 86 HG13 VAL 11 3HG1 VAL 11 16.967 -14.640 2.495 87 HG21 VAL 11 3HG2 VAL 11 16.572 -12.255 5.305 88 HG22 VAL 11 1HG2 VAL 11 15.090 -11.494 4.693 89 HG23 VAL 11 2HG2 VAL 11 15.055 -13.183 5.255 90 H GLU 12 H GLU 12 15.840 -11.771 0.156 91 HA GLU 12 HA GLU 12 17.770 -13.589 -1.021 92 HB2 GLU 12 2HB GLU 12 15.767 -11.616 -2.167 93 HB3 GLU 12 3HB GLU 12 16.799 -12.645 -3.170 94 HG2 GLU 12 2HG GLU 12 15.874 -14.663 -2.074 95 HG3 GLU 12 3HG GLU 12 14.812 -13.640 -1.088 96 H ARG 13 H ARG 13 17.492 -10.030 -0.726 97 HA ARG 13 HA ARG 13 19.575 -9.488 -2.620 98 HB2 ARG 13 2HB ARG 13 17.811 -7.902 -2.098 99 HB3 ARG 13 3HB ARG 13 18.325 -7.813 -0.403 100 HG2 ARG 13 2HG ARG 13 20.373 -6.751 -0.970 101 HG3 ARG 13 3HG ARG 13 20.171 -7.105 -2.709 102 HD2 ARG 13 2HD ARG 13 18.339 -5.300 -1.075 103 HD3 ARG 13 3HD ARG 13 19.676 -4.713 -2.074 104 HE ARG 13 HE ARG 13 17.069 -5.640 -2.978 105 HH11 ARG 13 1HH1 ARG 13 20.464 -5.181 -3.953 106 HH12 ARG 13 2HH1 ARG 13 20.063 -5.079 -5.646 107 HH21 ARG 13 1HH2 ARG 13 16.620 -5.528 -5.199 108 HH22 ARG 13 2HH2 ARG 13 17.910 -5.275 -6.350 109 H VAL 14 H VAL 14 19.599 -9.979 0.941 110 HA VAL 14 HA VAL 14 22.381 -9.184 1.151 111 HB VAL 14 HB VAL 14 22.267 -10.148 3.405 112 HG11 VAL 14 1HG1 VAL 14 19.870 -8.463 2.563 113 HG12 VAL 14 2HG1 VAL 14 20.388 -8.705 4.237 114 HG13 VAL 14 3HG1 VAL 14 21.471 -7.881 3.080 115 HG21 VAL 14 3HG2 VAL 14 20.828 -12.091 3.013 116 HG22 VAL 14 1HG2 VAL 14 20.120 -11.020 4.246 117 HG23 VAL 14 2HG2 VAL 14 19.474 -11.013 2.588 118 H GLN 15 H GLN 15 20.723 -12.165 0.270 119 HA GLN 15 HA GLN 15 23.108 -13.820 0.591 120 HB2 GLN 15 2HB GLN 15 20.425 -14.239 -0.773 121 HB3 GLN 15 3HB GLN 15 21.700 -15.469 -0.707 122 HG2 GLN 15 2HG GLN 15 21.653 -15.469 1.738 123 HG3 GLN 15 3HG GLN 15 20.469 -14.177 1.765 124 HE21 GLN 15 2HE2 GLN 15 19.850 -16.488 3.111 125 HE22 GLN 15 1HE2 GLN 15 18.602 -17.361 2.248 126 H LYS 16 H LYS 16 21.967 -11.524 -1.715 127 HA LYS 16 HA LYS 16 23.576 -12.650 -3.907 128 HB2 LYS 16 2HB LYS 16 21.611 -10.367 -3.679 129 HB3 LYS 16 3HB LYS 16 22.577 -10.656 -5.146 130 HG2 LYS 16 2HG LYS 16 21.656 -12.870 -5.420 131 HG3 LYS 16 3HG LYS 16 20.862 -12.811 -3.832 132 HD2 LYS 16 2HD LYS 16 19.482 -10.889 -4.642 133 HD3 LYS 16 3HD LYS 16 20.191 -11.104 -6.262 134 HE2 LYS 16 2HE LYS 16 19.356 -13.452 -6.292 135 HE3 LYS 16 3HE LYS 16 18.665 -13.220 -4.678 136 HZ1 LYS 16 3HZ LYS 16 17.246 -11.511 -5.611 137 HZ2 LYS 16 1HZ LYS 16 17.891 -11.742 -7.108 138 HZ3 LYS 16 2HZ LYS 16 17.024 -12.937 -6.393 139 H GLY 17 H GLY 17 24.306 -10.905 -1.202 140 HA2 GLY 17 2HA GLY 17 26.625 -10.388 -0.893 141 HA3 GLY 17 3HA GLY 17 26.726 -9.852 -2.573 142 H ASP 18 H ASP 18 23.830 -8.604 -1.369 143 HA ASP 18 HA ASP 18 25.093 -5.962 -0.918 144 HB2 ASP 18 2HB ASP 18 22.311 -6.980 -1.503 145 HB3 ASP 18 3HB ASP 18 22.563 -5.350 -0.890 146 H GLN 19 H GLN 19 26.026 -6.476 1.164 147 HA GLN 19 HA GLN 19 24.469 -7.387 3.367 148 HB2 GLN 19 2HB GLN 19 26.917 -7.498 3.179 149 HB3 GLN 19 3HB GLN 19 27.037 -5.742 3.286 150 HG2 GLN 19 2HG GLN 19 25.664 -7.380 5.448 151 HG3 GLN 19 3HG GLN 19 27.421 -7.217 5.421 152 HE21 GLN 19 2HE2 GLN 19 26.096 -6.331 7.632 153 HE22 GLN 19 1HE2 GLN 19 26.123 -4.578 7.690 154 H LYS 20 H LYS 20 24.667 -4.306 1.770 155 HA LYS 20 HA LYS 20 23.912 -2.556 3.879 156 HB2 LYS 20 2HB LYS 20 23.224 -1.078 2.037 157 HB3 LYS 20 3HB LYS 20 24.779 -1.851 1.674 158 HG2 LYS 20 2HG LYS 20 23.556 -3.565 0.295 159 HG3 LYS 20 3HG LYS 20 22.050 -2.681 0.591 160 HD2 LYS 20 2HD LYS 20 23.042 -0.665 -0.474 161 HD3 LYS 20 3HD LYS 20 24.535 -1.593 -0.784 162 HE2 LYS 20 2HE LYS 20 23.239 -3.219 -2.132 163 HE3 LYS 20 3HE LYS 20 21.762 -2.289 -1.833 164 HZ1 LYS 20 3HZ LYS 20 24.149 -1.297 -3.240 165 HZ2 LYS 20 1HZ LYS 20 22.740 -1.763 -3.951 166 HZ3 LYS 20 2HZ LYS 20 22.764 -0.442 -2.978 167 H ALA 21 H ALA 21 22.066 -4.962 2.068 168 HA ALA 21 HA ALA 21 19.506 -3.780 2.823 169 HB1 ALA 21 1HB ALA 21 18.574 -5.805 1.756 170 HB2 ALA 21 2HB ALA 21 19.752 -4.984 0.705 171 HB3 ALA 21 3HB ALA 21 20.213 -6.467 1.576 172 H PHE 22 H PHE 22 21.840 -5.947 4.288 173 HA PHE 22 HA PHE 22 19.888 -7.228 6.040 174 HB2 PHE 22 2HB PHE 22 22.053 -8.297 5.464 175 HB3 PHE 22 3HB PHE 22 22.905 -7.002 6.300 176 HD1 PHE 22 HD2 PHE 22 20.138 -9.491 6.878 177 HD2 PHE 22 HD1 PHE 22 23.474 -7.350 8.558 178 HE1 PHE 22 HE2 PHE 22 19.852 -10.714 8.999 179 HE2 PHE 22 HE1 PHE 22 23.169 -8.566 10.696 180 HZ PHE 22 HZ PHE 22 21.361 -10.239 10.925 181 H ASN 23 H ASN 23 22.077 -4.407 6.137 182 HA ASN 23 HA ASN 23 21.746 -3.742 8.888 183 HB2 ASN 23 2HB ASN 23 23.499 -2.736 7.600 184 HB3 ASN 23 3HB ASN 23 22.366 -2.215 6.348 185 HD21 ASN 23 2HD2 ASN 23 21.316 -0.270 6.510 186 HD22 ASN 23 1HD2 ASN 23 21.516 0.832 7.853 187 H LEU 24 H LEU 24 19.897 -2.874 5.949 188 HA LEU 24 HA LEU 24 18.005 -1.257 7.426 189 HB2 LEU 24 2HB LEU 24 17.895 -2.428 4.625 190 HB3 LEU 24 3HB LEU 24 16.790 -1.199 5.294 191 HG LEU 24 HG LEU 24 19.801 -0.819 5.041 192 HD11 LEU 24 1HD1 LEU 24 17.542 0.142 3.237 193 HD12 LEU 24 2HD1 LEU 24 19.256 0.598 3.094 194 HD13 LEU 24 3HD1 LEU 24 18.762 -1.093 2.837 195 HD21 LEU 24 3HD2 LEU 24 19.214 1.573 5.347 196 HD22 LEU 24 1HD2 LEU 24 17.508 1.121 5.571 197 HD23 LEU 24 2HD2 LEU 24 18.735 0.609 6.754 198 H LEU 25 H LEU 25 18.341 -4.668 6.832 199 HA LEU 25 HA LEU 25 15.503 -5.250 7.243 200 HB2 LEU 25 2HB LEU 25 16.878 -6.669 5.790 201 HB3 LEU 25 3HB LEU 25 17.997 -6.988 7.118 202 HG LEU 25 HG LEU 25 16.190 -8.152 8.362 203 HD11 LEU 25 1HD1 LEU 25 14.108 -8.744 7.178 204 HD12 LEU 25 2HD1 LEU 25 14.223 -6.991 7.399 205 HD13 LEU 25 3HD1 LEU 25 14.580 -7.722 5.806 206 HD21 LEU 25 3HD2 LEU 25 16.081 -10.122 6.848 207 HD22 LEU 25 1HD2 LEU 25 16.653 -9.108 5.505 208 HD23 LEU 25 2HD2 LEU 25 17.709 -9.414 6.900 209 H VAL 26 H VAL 26 18.537 -5.377 9.240 210 HA VAL 26 HA VAL 26 17.118 -6.659 11.380 211 HB VAL 26 HB VAL 26 19.022 -6.239 12.772 212 HG11 VAL 26 1HG1 VAL 26 19.148 -8.078 11.153 213 HG12 VAL 26 2HG1 VAL 26 19.895 -6.991 9.960 214 HG13 VAL 26 3HG1 VAL 26 20.749 -7.364 11.469 215 HG21 VAL 26 3HG2 VAL 26 19.551 -3.944 12.175 216 HG22 VAL 26 1HG2 VAL 26 20.978 -4.973 11.991 217 HG23 VAL 26 2HG2 VAL 26 20.071 -4.464 10.545 218 H VAL 27 H VAL 27 17.446 -3.219 10.462 219 HA VAL 27 HA VAL 27 16.804 -2.221 13.073 220 HB VAL 27 HB VAL 27 16.138 -0.141 11.884 221 HG11 VAL 27 1HG1 VAL 27 18.363 0.312 10.911 222 HG12 VAL 27 2HG1 VAL 27 18.478 -0.509 12.487 223 HG13 VAL 27 3HG1 VAL 27 18.744 -1.428 10.985 224 HG21 VAL 27 3HG2 VAL 27 16.488 0.015 9.467 225 HG22 VAL 27 1HG2 VAL 27 16.884 -1.712 9.391 226 HG23 VAL 27 2HG2 VAL 27 15.225 -1.186 9.811 227 H ARG 28 H ARG 28 14.801 -3.608 10.498 228 HA ARG 28 HA ARG 28 12.290 -2.594 11.489 229 HB2 ARG 28 2HB ARG 28 12.770 -5.216 10.020 230 HB3 ARG 28 3HB ARG 28 11.305 -4.221 10.024 231 HG2 ARG 28 2HG ARG 28 12.610 -2.410 8.842 232 HG3 ARG 28 3HG ARG 28 13.995 -3.518 8.785 233 HD2 ARG 28 2HD ARG 28 12.808 -3.631 6.667 234 HD3 ARG 28 3HD ARG 28 12.651 -5.162 7.532 235 HE ARG 28 HE ARG 28 10.517 -3.053 7.440 236 HH11 ARG 28 1HH1 ARG 28 11.469 -6.465 7.421 237 HH12 ARG 28 2HH1 ARG 28 9.820 -7.038 7.332 238 HH21 ARG 28 1HH2 ARG 28 8.390 -3.833 7.302 239 HH22 ARG 28 2HH2 ARG 28 8.090 -5.555 7.263 240 H TYR 29 H TYR 29 14.364 -5.339 12.229 241 HA TYR 29 HA TYR 29 12.345 -6.423 14.112 242 HB2 TYR 29 2HB TYR 29 14.887 -7.554 12.917 243 HB3 TYR 29 3HB TYR 29 13.918 -8.372 14.149 244 HD1 TYR 29 HD2 TYR 29 13.968 -7.204 10.636 245 HD2 TYR 29 HD1 TYR 29 11.771 -9.339 13.647 246 HE1 TYR 29 HE2 TYR 29 12.402 -8.019 8.895 247 HE2 TYR 29 HE1 TYR 29 10.222 -10.195 11.928 248 HH TYR 29 HH TYR 29 9.647 -10.179 9.694 249 H GLN 30 H GLN 30 15.007 -4.323 14.190 250 HA GLN 30 HA GLN 30 16.407 -5.188 16.496 251 HB2 GLN 30 2HB GLN 30 17.140 -3.521 14.812 252 HB3 GLN 30 3HB GLN 30 15.942 -2.374 15.423 253 HG2 GLN 30 2HG GLN 30 17.080 -2.325 17.598 254 HG3 GLN 30 3HG GLN 30 18.215 -3.581 17.038 255 HE21 GLN 30 2HE2 GLN 30 19.205 -2.978 14.745 256 HE22 GLN 30 1HE2 GLN 30 19.808 -1.340 14.604 257 H HIS 31 H HIS 31 13.368 -3.382 16.119 258 HA HIS 31 HA HIS 31 13.191 -2.877 19.013 259 HB2 HIS 31 2HB HIS 31 11.245 -2.471 16.713 260 HB3 HIS 31 3HB HIS 31 10.975 -1.952 18.385 261 HD2 HIS 31 HD2 HIS 31 12.807 -0.055 19.344 262 HE1 HIS 31 HE1 HIS 31 13.799 1.433 15.483 263 HE2 HIS 31 HE2 HIS 31 13.951 1.878 17.989 264 H LYS 32 H LYS 32 12.071 -5.244 16.638 265 HA LYS 32 HA LYS 32 9.984 -6.321 18.342 266 HB2 LYS 32 2HB LYS 32 11.324 -7.489 15.869 267 HB3 LYS 32 3HB LYS 32 9.812 -8.051 16.616 268 HG2 LYS 32 2HG LYS 32 8.770 -5.850 16.184 269 HG3 LYS 32 3HG LYS 32 10.271 -5.285 15.421 270 HD2 LYS 32 2HD LYS 32 10.090 -7.097 13.733 271 HD3 LYS 32 3HD LYS 32 8.570 -7.635 14.490 272 HE2 LYS 32 2HE LYS 32 7.569 -5.419 14.059 273 HE3 LYS 32 3HE LYS 32 9.082 -4.881 13.305 274 HZ1 LYS 32 3HZ LYS 32 8.784 -6.588 11.642 275 HZ2 LYS 32 1HZ LYS 32 7.393 -7.102 12.356 276 HZ3 LYS 32 2HZ LYS 32 7.464 -5.607 11.677 277 H VAL 33 H VAL 33 13.383 -7.296 17.607 278 HA VAL 33 HA VAL 33 13.041 -9.695 19.231 279 HB VAL 33 HB VAL 33 15.285 -10.240 18.713 280 HG11 VAL 33 1HG1 VAL 33 15.221 -10.270 16.265 281 HG12 VAL 33 2HG1 VAL 33 13.614 -10.614 16.948 282 HG13 VAL 33 3HG1 VAL 33 13.963 -9.012 16.264 283 HG21 VAL 33 3HG2 VAL 33 16.398 -8.115 19.010 284 HG22 VAL 33 1HG2 VAL 33 16.778 -8.787 17.415 285 HG23 VAL 33 2HG2 VAL 33 15.610 -7.449 17.562 286 H ALA 34 H ALA 34 14.170 -6.387 19.711 287 HA ALA 34 HA ALA 34 15.620 -6.950 22.135 288 HB1 ALA 34 1HB ALA 34 14.266 -4.401 21.164 289 HB2 ALA 34 2HB ALA 34 15.444 -4.519 22.494 290 HB3 ALA 34 3HB ALA 34 15.946 -4.891 20.831 291 H SER 35 H SER 35 12.214 -6.637 21.301 292 HA SER 35 HA SER 35 11.326 -6.075 24.010 293 HB2 SER 35 2HB SER 35 10.075 -5.415 21.965 294 HB3 SER 35 3HB SER 35 9.826 -7.136 21.587 295 HG SER 35 HG SER 35 8.059 -6.213 22.734 296 H LEU 36 H LEU 36 11.454 -8.977 21.885 297 HA LEU 36 HA LEU 36 10.249 -10.641 23.907 298 HB2 LEU 36 2HB LEU 36 10.534 -12.441 22.367 299 HB3 LEU 36 3HB LEU 36 10.015 -11.006 21.480 300 HG LEU 36 HG LEU 36 12.572 -10.653 21.025 301 HD11 LEU 36 1HD1 LEU 36 13.475 -12.488 22.461 302 HD12 LEU 36 2HD1 LEU 36 12.487 -13.660 21.555 303 HD13 LEU 36 3HD1 LEU 36 13.803 -12.781 20.751 304 HD21 LEU 36 3HD2 LEU 36 10.979 -12.921 19.759 305 HD22 LEU 36 1HD2 LEU 36 10.857 -11.201 19.327 306 HD23 LEU 36 2HD2 LEU 36 12.369 -12.091 19.018 307 H VAL 37 H VAL 37 13.534 -9.641 23.221 308 HA VAL 37 HA VAL 37 14.626 -11.897 24.753 309 HB VAL 37 HB VAL 37 15.640 -10.873 22.629 310 HG11 VAL 37 1HG1 VAL 37 17.152 -8.985 22.990 311 HG12 VAL 37 2HG1 VAL 37 15.506 -8.503 23.476 312 HG13 VAL 37 3HG1 VAL 37 16.709 -8.935 24.713 313 HG21 VAL 37 3HG2 VAL 37 17.389 -11.227 25.093 314 HG22 VAL 37 1HG2 VAL 37 16.769 -12.538 24.053 315 HG23 VAL 37 2HG2 VAL 37 17.914 -11.344 23.397 316 H SER 38 H SER 38 13.572 -8.620 25.401 317 HA SER 38 HA SER 38 15.306 -8.060 27.599 318 HB2 SER 38 2HB SER 38 12.580 -7.067 26.744 319 HB3 SER 38 3HB SER 38 13.390 -6.483 28.223 320 HG SER 38 HG SER 38 14.271 -6.286 25.550 321 H ARG 39 H ARG 39 12.789 -10.399 27.330 322 HA ARG 39 HA ARG 39 12.410 -10.435 30.266 323 HB2 ARG 39 2HB ARG 39 10.666 -12.037 29.899 324 HB3 ARG 39 3HB ARG 39 10.425 -10.655 28.816 325 HG2 ARG 39 2HG ARG 39 11.480 -11.944 26.971 326 HG3 ARG 39 3HG ARG 39 11.667 -13.337 28.062 327 HD2 ARG 39 2HD ARG 39 9.667 -13.660 26.718 328 HD3 ARG 39 3HD ARG 39 9.195 -13.353 28.400 329 HE ARG 39 HE ARG 39 9.254 -10.882 26.969 330 HH11 ARG 39 1HH1 ARG 39 7.374 -13.867 27.167 331 HH12 ARG 39 2HH1 ARG 39 5.885 -13.112 26.652 332 HH21 ARG 39 1HH2 ARG 39 7.301 -9.917 26.269 333 HH22 ARG 39 2HH2 ARG 39 5.849 -10.879 26.138 334 H TYR 40 H TYR 40 14.669 -11.605 28.113 335 HA TYR 40 HA TYR 40 15.183 -14.021 29.788 336 HB2 TYR 40 2HB TYR 40 16.020 -13.352 26.949 337 HB3 TYR 40 3HB TYR 40 16.557 -14.767 27.852 338 HD1 TYR 40 HD1 TYR 40 14.874 -16.504 28.560 339 HD2 TYR 40 HD2 TYR 40 13.893 -13.316 25.848 340 HE1 TYR 40 HE1 TYR 40 12.879 -17.771 27.793 341 HE2 TYR 40 HE2 TYR 40 11.935 -14.592 25.039 342 HH TYR 40 HH TYR 40 11.057 -17.792 26.390 343 H VAL 41 H VAL 41 16.401 -10.872 28.811 344 HA VAL 41 HA VAL 41 18.574 -11.205 30.783 345 HB VAL 41 HB VAL 41 20.055 -9.809 29.233 346 HG11 VAL 41 1HG1 VAL 41 19.406 -12.657 28.392 347 HG12 VAL 41 2HG1 VAL 41 20.912 -11.776 28.056 348 HG13 VAL 41 3HG1 VAL 41 20.471 -12.181 29.731 349 HG21 VAL 41 3HG2 VAL 41 18.171 -10.884 27.108 350 HG22 VAL 41 1HG2 VAL 41 18.287 -9.179 27.604 351 HG23 VAL 41 2HG2 VAL 41 19.679 -9.984 26.839 352 HA PRO 42 HA PRO 42 17.040 -7.332 32.130 353 HB2 PRO 42 2HB PRO 42 19.214 -6.181 33.328 354 HB3 PRO 42 3HB PRO 42 18.423 -7.663 33.971 355 HG2 PRO 42 2HG PRO 42 20.843 -7.497 32.146 356 HG3 PRO 42 3HG PRO 42 20.695 -8.393 33.701 357 HD2 PRO 42 2HD PRO 42 20.317 -9.641 31.330 358 HD3 PRO 42 3HD PRO 42 19.248 -10.008 32.720 359 H SER 43 H SER 43 17.387 -4.922 31.979 360 HA SER 43 HA SER 43 17.632 -4.222 29.236 361 HB2 SER 43 2HB SER 43 17.559 -2.442 31.704 362 HB3 SER 43 3HB SER 43 17.222 -1.939 30.034 363 HG SER 43 HG SER 43 15.317 -2.442 31.209 364 H GLY 44 H GLY 44 20.094 -4.610 31.610 365 HA2 GLY 44 2HA GLY 44 21.894 -2.598 30.447 366 HA3 GLY 44 3HA GLY 44 22.228 -3.702 31.792 367 H ASP 45 H ASP 45 21.120 -5.971 29.932 368 HA ASP 45 HA ASP 45 23.692 -6.359 28.469 369 HB2 ASP 45 2HB ASP 45 21.930 -8.346 29.932 370 HB3 ASP 45 3HB ASP 45 23.288 -8.787 28.892 371 H VAL 46 H VAL 46 20.370 -5.857 28.038 372 HA VAL 46 HA VAL 46 19.853 -7.748 25.969 373 HB VAL 46 HB VAL 46 18.069 -6.772 27.142 374 HG11 VAL 46 1HG1 VAL 46 18.730 -4.072 25.905 375 HG12 VAL 46 2HG1 VAL 46 17.366 -4.473 26.973 376 HG13 VAL 46 3HG1 VAL 46 19.028 -4.512 27.607 377 HG21 VAL 46 3HG2 VAL 46 16.618 -6.276 25.291 378 HG22 VAL 46 1HG2 VAL 46 17.954 -5.593 24.338 379 HG23 VAL 46 2HG2 VAL 46 17.901 -7.340 24.640 380 HA PRO 47 HA PRO 47 20.790 -4.297 22.869 381 HB2 PRO 47 2HB PRO 47 22.766 -2.483 23.278 382 HB3 PRO 47 3HB PRO 47 21.110 -2.261 23.944 383 HG2 PRO 47 2HG PRO 47 23.546 -3.416 25.351 384 HG3 PRO 47 3HG PRO 47 22.479 -2.098 25.923 385 HD2 PRO 47 2HD PRO 47 22.142 -4.671 26.711 386 HD3 PRO 47 3HD PRO 47 20.723 -3.629 26.414 387 H ASP 48 H ASP 48 23.370 -5.785 24.786 388 HA ASP 48 HA ASP 48 25.172 -5.985 22.498 389 HB2 ASP 48 2HB ASP 48 25.950 -5.755 24.867 390 HB3 ASP 48 3HB ASP 48 25.256 -7.344 25.218 391 H VAL 49 H VAL 49 22.695 -7.933 24.117 392 HA VAL 49 HA VAL 49 23.383 -10.391 22.727 393 HB VAL 49 HB VAL 49 21.009 -9.483 24.393 394 HG11 VAL 49 1HG1 VAL 49 21.581 -12.241 23.239 395 HG12 VAL 49 2HG1 VAL 49 20.330 -11.857 24.446 396 HG13 VAL 49 3HG1 VAL 49 20.212 -11.184 22.809 397 HG21 VAL 49 3HG2 VAL 49 23.259 -11.483 24.898 398 HG22 VAL 49 1HG2 VAL 49 23.190 -9.841 25.566 399 HG23 VAL 49 2HG2 VAL 49 21.969 -11.042 26.043 400 H VAL 50 H VAL 50 21.226 -7.606 22.128 401 HA VAL 50 HA VAL 50 19.857 -8.876 19.909 402 HB VAL 50 HB VAL 50 20.223 -5.991 20.790 403 HG11 VAL 50 1HG1 VAL 50 18.534 -7.099 18.505 404 HG12 VAL 50 2HG1 VAL 50 18.434 -5.444 19.153 405 HG13 VAL 50 3HG1 VAL 50 19.912 -5.990 18.342 406 HG21 VAL 50 3HG2 VAL 50 17.822 -7.876 20.758 407 HG22 VAL 50 1HG2 VAL 50 18.789 -7.494 22.193 408 HG23 VAL 50 2HG2 VAL 50 17.847 -6.214 21.392 409 H GLN 51 H GLN 51 22.886 -7.008 20.309 410 HA GLN 51 HA GLN 51 23.299 -6.738 17.459 411 HB2 GLN 51 2HB GLN 51 24.335 -5.228 19.116 412 HB3 GLN 51 3HB GLN 51 25.268 -6.591 19.778 413 HG2 GLN 51 2HG GLN 51 26.409 -6.899 17.649 414 HG3 GLN 51 3HG GLN 51 25.406 -5.660 16.883 415 HE21 GLN 51 2HE2 GLN 51 27.882 -5.071 16.459 416 HE22 GLN 51 1HE2 GLN 51 28.540 -3.899 17.578 417 H GLU 52 H GLU 52 24.415 -9.095 19.984 418 HA GLU 52 HA GLU 52 26.038 -10.568 18.142 419 HB2 GLU 52 2HB GLU 52 26.223 -10.731 20.616 420 HB3 GLU 52 3HB GLU 52 24.626 -11.513 20.676 421 HG2 GLU 52 2HG GLU 52 25.484 -13.336 19.210 422 HG3 GLU 52 3HG GLU 52 27.076 -12.564 19.192 423 H ALA 53 H ALA 53 22.554 -10.568 18.880 424 HA ALA 53 HA ALA 53 21.999 -13.063 17.581 425 HB1 ALA 53 1HB ALA 53 20.220 -10.652 18.126 426 HB2 ALA 53 2HB ALA 53 19.662 -12.277 17.661 427 HB3 ALA 53 3HB ALA 53 20.479 -12.032 19.219 428 H PHE 54 H PHE 54 22.421 -9.720 16.393 429 HA PHE 54 HA PHE 54 21.363 -10.472 13.755 430 HB2 PHE 54 2HB PHE 54 22.637 -7.943 14.838 431 HB3 PHE 54 3HB PHE 54 22.105 -8.134 13.178 432 HD1 PHE 54 HD2 PHE 54 19.540 -9.756 13.733 433 HD2 PHE 54 HD1 PHE 54 21.155 -6.192 15.533 434 HE1 PHE 54 HE2 PHE 54 17.261 -9.036 14.356 435 HE2 PHE 54 HE1 PHE 54 18.852 -5.449 16.093 436 HZ PHE 54 HZ PHE 54 16.914 -6.872 15.504 437 H ILE 55 H ILE 55 24.532 -10.201 15.348 438 HA ILE 55 HA ILE 55 26.021 -10.427 12.861 439 HB ILE 55 HB ILE 55 26.747 -11.021 15.755 440 HG12 ILE 55 2HG1 ILE 55 27.424 -8.617 13.996 441 HG13 ILE 55 3HG1 ILE 55 26.137 -8.634 15.195 442 HG21 ILE 55 1HG2 ILE 55 29.099 -10.966 14.968 443 HG22 ILE 55 2HG2 ILE 55 28.201 -12.260 14.180 444 HG23 ILE 55 3HG2 ILE 55 28.532 -10.757 13.292 445 HD11 ILE 55 3HD1 ILE 55 28.118 -7.601 16.151 446 HD12 ILE 55 1HD1 ILE 55 27.814 -9.144 16.977 447 HD13 ILE 55 2HD1 ILE 55 29.111 -9.015 15.763 448 H LYS 56 H LYS 56 24.635 -12.655 15.271 449 HA LYS 56 HA LYS 56 25.796 -15.041 14.096 450 HB2 LYS 56 2HB LYS 56 25.266 -14.726 16.486 451 HB3 LYS 56 3HB LYS 56 23.539 -14.601 16.094 452 HG2 LYS 56 2HG LYS 56 23.581 -16.916 15.197 453 HG3 LYS 56 3HG LYS 56 25.302 -17.039 15.610 454 HD2 LYS 56 2HD LYS 56 22.994 -16.568 17.547 455 HD3 LYS 56 3HD LYS 56 23.928 -18.074 17.372 456 HE2 LYS 56 2HE LYS 56 25.983 -16.861 18.062 457 HE3 LYS 56 3HE LYS 56 25.040 -15.369 18.228 458 HZ1 LYS 56 3HZ LYS 56 25.332 -16.413 20.328 459 HZ2 LYS 56 1HZ LYS 56 23.737 -16.450 19.917 460 HZ3 LYS 56 2HZ LYS 56 24.650 -17.817 19.806 461 H ALA 57 H ALA 57 22.753 -13.209 13.757 462 HA ALA 57 HA ALA 57 21.352 -15.321 12.382 463 HB1 ALA 57 1HB ALA 57 20.970 -12.302 12.368 464 HB2 ALA 57 2HB ALA 57 19.839 -13.475 11.664 465 HB3 ALA 57 3HB ALA 57 20.131 -13.476 13.415 466 H TYR 58 H TYR 58 23.402 -12.553 11.253 467 HA TYR 58 HA TYR 58 22.809 -12.892 8.504 468 HB2 TYR 58 2HB TYR 58 23.940 -10.933 9.574 469 HB3 TYR 58 3HB TYR 58 25.377 -11.932 9.814 470 HD1 TYR 58 HD1 TYR 58 23.019 -10.925 7.060 471 HD2 TYR 58 HD2 TYR 58 27.060 -11.840 8.216 472 HE1 TYR 58 HE1 TYR 58 23.807 -10.255 4.812 473 HE2 TYR 58 HE2 TYR 58 27.854 -11.216 5.956 474 HH TYR 58 HH TYR 58 25.613 -10.064 3.403 475 H ARG 59 H ARG 59 25.270 -14.414 10.595 476 HA ARG 59 HA ARG 59 26.662 -15.749 8.457 477 HB2 ARG 59 2HB ARG 59 26.502 -16.229 11.460 478 HB3 ARG 59 3HB ARG 59 27.663 -17.026 10.375 479 HG2 ARG 59 2HG ARG 59 28.692 -14.925 9.800 480 HG3 ARG 59 3HG ARG 59 27.427 -13.993 10.630 481 HD2 ARG 59 2HD ARG 59 28.075 -14.900 12.785 482 HD3 ARG 59 3HD ARG 59 29.237 -15.996 12.002 483 HE ARG 59 HE ARG 59 29.874 -13.320 11.271 484 HH11 ARG 59 1HH1 ARG 59 29.881 -15.387 14.147 485 HH12 ARG 59 2HH1 ARG 59 31.202 -14.525 14.900 486 HH21 ARG 59 1HH2 ARG 59 31.595 -12.222 12.283 487 HH22 ARG 59 2HH2 ARG 59 32.159 -12.737 13.854 488 H ALA 60 H ALA 60 23.800 -16.478 10.354 489 HA ALA 60 HA ALA 60 23.694 -19.246 9.298 490 HB1 ALA 60 1HB ALA 60 21.873 -17.744 11.216 491 HB2 ALA 60 2HB ALA 60 21.784 -19.478 10.820 492 HB3 ALA 60 3HB ALA 60 23.201 -18.836 11.682 493 H LEU 61 H LEU 61 22.695 -16.112 8.354 494 HA LEU 61 HA LEU 61 20.130 -16.813 7.244 495 HB2 LEU 61 2HB LEU 61 20.943 -14.500 7.996 496 HB3 LEU 61 3HB LEU 61 21.948 -14.478 6.538 497 HG LEU 61 HG LEU 61 19.842 -14.785 5.180 498 HD11 LEU 61 1HD1 LEU 61 18.582 -14.348 7.915 499 HD12 LEU 61 2HD1 LEU 61 17.698 -14.237 6.373 500 HD13 LEU 61 3HD1 LEU 61 18.384 -15.792 6.887 501 HD21 LEU 61 3HD2 LEU 61 20.869 -12.575 5.599 502 HD22 LEU 61 1HD2 LEU 61 19.087 -12.460 5.525 503 HD23 LEU 61 2HD2 LEU 61 19.920 -12.420 7.098 504 H ASP 62 H ASP 62 23.471 -16.955 6.174 505 HA ASP 62 HA ASP 62 22.952 -17.296 3.375 506 HB2 ASP 62 2HB ASP 62 25.150 -16.722 4.398 507 HB3 ASP 62 3HB ASP 62 25.226 -18.342 5.107 508 H SER 63 H SER 63 22.156 -19.230 6.073 509 HA SER 63 HA SER 63 22.042 -21.705 4.428 510 HB2 SER 63 2HB SER 63 22.028 -21.350 7.448 511 HB3 SER 63 3HB SER 63 21.977 -22.891 6.568 512 HG SER 63 HG SER 63 24.100 -22.313 7.225 513 H PHE 64 H PHE 64 20.103 -19.153 5.307 514 HA PHE 64 HA PHE 64 17.690 -20.565 6.061 515 HB2 PHE 64 2HB PHE 64 18.156 -18.224 6.659 516 HB3 PHE 64 3HB PHE 64 18.165 -17.782 4.951 517 HD1 PHE 64 HD1 PHE 64 15.982 -19.275 7.601 518 HD2 PHE 64 HD2 PHE 64 16.170 -17.119 3.890 519 HE1 PHE 64 HE1 PHE 64 13.542 -18.871 7.716 520 HE2 PHE 64 HE2 PHE 64 13.730 -16.703 4.009 521 HZ PHE 64 HZ PHE 64 12.412 -17.581 5.915 522 H ARG 65 H ARG 65 15.879 -21.036 4.741 523 HA ARG 65 HA ARG 65 16.355 -20.946 1.803 524 HB2 ARG 65 2HB ARG 65 15.508 -23.398 3.391 525 HB3 ARG 65 3HB ARG 65 15.568 -23.276 1.623 526 HG2 ARG 65 2HG ARG 65 18.014 -22.792 1.745 527 HG3 ARG 65 3HG ARG 65 17.944 -22.983 3.509 528 HD2 ARG 65 2HD ARG 65 18.735 -25.046 2.543 529 HD3 ARG 65 3HD ARG 65 17.115 -25.307 3.213 530 HE ARG 65 HE ARG 65 16.903 -24.592 0.452 531 HH11 ARG 65 1HH1 ARG 65 17.931 -27.275 2.516 532 HH12 ARG 65 2HH1 ARG 65 17.562 -28.490 1.315 533 HH21 ARG 65 1HH2 ARG 65 16.437 -26.201 -1.093 534 HH22 ARG 65 2HH2 ARG 65 16.745 -27.886 -0.731 535 H GLY 66 H GLY 66 14.345 -19.917 4.180 536 HA2 GLY 66 2HA GLY 66 12.225 -19.030 4.028 537 HA3 GLY 66 3HA GLY 66 12.166 -19.513 2.324 538 H ASP 67 H ASP 67 12.946 -22.078 4.542 539 HA ASP 67 HA ASP 67 10.534 -23.509 3.929 540 HB2 ASP 67 2HB ASP 67 12.747 -24.541 4.374 541 HB3 ASP 67 3HB ASP 67 12.654 -23.994 6.052 542 H SER 68 H SER 68 11.212 -21.033 6.161 543 HA SER 68 HA SER 68 8.580 -21.356 7.432 544 HB2 SER 68 2HB SER 68 9.516 -20.979 9.676 545 HB3 SER 68 3HB SER 68 10.120 -22.492 8.981 546 HG SER 68 HG SER 68 11.791 -21.243 9.919 547 H ALA 69 H ALA 69 8.118 -19.246 8.750 548 HA ALA 69 HA ALA 69 8.614 -17.025 7.000 549 HB1 ALA 69 1HB ALA 69 7.520 -17.096 9.843 550 HB2 ALA 69 2HB ALA 69 7.400 -15.735 8.700 551 HB3 ALA 69 3HB ALA 69 6.562 -17.264 8.355 552 H PHE 70 H PHE 70 9.915 -15.165 7.308 553 HA PHE 70 HA PHE 70 12.472 -15.765 8.436 554 HB2 PHE 70 2HB PHE 70 12.230 -14.263 6.530 555 HB3 PHE 70 3HB PHE 70 11.246 -13.153 7.495 556 HD1 PHE 70 HD1 PHE 70 14.608 -14.838 7.671 557 HD2 PHE 70 HD2 PHE 70 12.296 -11.289 8.402 558 HE1 PHE 70 HE1 PHE 70 16.643 -13.675 8.454 559 HE2 PHE 70 HE2 PHE 70 14.338 -10.120 9.169 560 HZ PHE 70 HZ PHE 70 16.525 -11.309 9.183 561 H TYR 71 H TYR 71 9.652 -13.933 9.707 562 HA TYR 71 HA TYR 71 11.183 -12.713 11.798 563 HB2 TYR 71 2HB TYR 71 9.043 -12.098 12.759 564 HB3 TYR 71 3HB TYR 71 9.057 -11.793 11.025 565 HD1 TYR 71 HD1 TYR 71 7.769 -14.026 13.692 566 HD2 TYR 71 HD2 TYR 71 7.495 -12.887 9.552 567 HE1 TYR 71 HE1 TYR 71 5.668 -15.328 13.479 568 HE2 TYR 71 HE2 TYR 71 5.387 -14.180 9.336 569 HH TYR 71 HH TYR 71 3.969 -15.976 12.092 570 H THR 72 H THR 72 9.352 -15.808 11.572 571 HA THR 72 HA THR 72 9.612 -16.386 14.385 572 HB THR 72 HB THR 72 9.292 -18.298 12.035 573 HG1 THR 72 1HG THR 72 7.085 -18.123 12.577 574 HG21 THR 72 1HG2 THR 72 8.264 -19.777 13.754 575 HG22 THR 72 2HG2 THR 72 9.958 -19.418 14.141 576 HG23 THR 72 3HG2 THR 72 8.658 -18.576 15.009 577 H TRP 73 H TRP 73 11.570 -17.071 11.477 578 HA TRP 73 HA TRP 73 13.410 -18.840 12.774 579 HB2 TRP 73 2HB TRP 73 13.074 -18.787 10.367 580 HB3 TRP 73 3HB TRP 73 13.560 -17.096 10.295 581 HD1 TRP 73 HD1 TRP 73 14.972 -20.599 10.434 582 HE1 TRP 73 HE1 TRP 73 17.496 -20.550 10.047 583 HE3 TRP 73 HE3 TRP 73 15.730 -15.535 10.627 584 HZ2 TRP 73 HZ2 TRP 73 19.597 -18.582 9.929 585 HZ3 TRP 73 HZ3 TRP 73 18.007 -14.616 10.383 586 HH2 TRP 73 HH2 TRP 73 19.945 -16.127 10.048 587 H LEU 74 H LEU 74 13.232 -15.301 12.452 588 HA LEU 74 HA LEU 74 15.964 -14.900 13.367 589 HB2 LEU 74 2HB LEU 74 14.820 -13.422 11.747 590 HB3 LEU 74 3HB LEU 74 13.626 -12.994 12.979 591 HG LEU 74 HG LEU 74 15.414 -11.997 14.378 592 HD11 LEU 74 1HD1 LEU 74 17.206 -12.686 12.010 593 HD12 LEU 74 2HD1 LEU 74 17.669 -11.635 13.369 594 HD13 LEU 74 3HD1 LEU 74 17.338 -13.354 13.653 595 HD21 LEU 74 3HD2 LEU 74 15.394 -11.015 11.493 596 HD22 LEU 74 1HD2 LEU 74 14.169 -10.640 12.726 597 HD23 LEU 74 2HD2 LEU 74 15.835 -10.050 12.925 598 H TYR 75 H TYR 75 12.690 -14.852 14.833 599 HA TYR 75 HA TYR 75 13.459 -13.606 17.290 600 HB2 TYR 75 2HB TYR 75 11.288 -15.641 16.673 601 HB3 TYR 75 3HB TYR 75 11.433 -14.767 18.193 602 HD1 TYR 75 HD1 TYR 75 12.376 -12.272 16.005 603 HD2 TYR 75 HD2 TYR 75 8.928 -14.647 17.011 604 HE1 TYR 75 HE1 TYR 75 10.899 -10.487 15.148 605 HE2 TYR 75 HE2 TYR 75 7.446 -12.858 16.150 606 HH TYR 75 HH TYR 75 8.735 -9.806 14.783 607 H ARG 76 H ARG 76 13.862 -16.900 16.048 608 HA ARG 76 HA ARG 76 14.413 -18.069 18.654 609 HB2 ARG 76 2HB ARG 76 14.989 -19.031 15.823 610 HB3 ARG 76 3HB ARG 76 15.171 -20.017 17.277 611 HG2 ARG 76 2HG ARG 76 12.541 -18.791 16.374 612 HG3 ARG 76 3HG ARG 76 13.074 -20.441 16.013 613 HD2 ARG 76 2HD ARG 76 11.639 -20.677 17.863 614 HD3 ARG 76 3HD ARG 76 13.266 -20.802 18.536 615 HE ARG 76 HE ARG 76 12.903 -18.838 19.728 616 HH11 ARG 76 1HH1 ARG 76 10.391 -19.172 17.257 617 HH12 ARG 76 2HH1 ARG 76 9.439 -17.847 17.882 618 HH21 ARG 76 1HH2 ARG 76 11.654 -17.091 20.495 619 HH22 ARG 76 2HH2 ARG 76 10.154 -16.672 19.700 620 H ILE 77 H ILE 77 16.321 -16.333 16.251 621 HA ILE 77 HA ILE 77 18.866 -17.345 17.180 622 HB ILE 77 HB ILE 77 18.297 -14.657 15.875 623 HG12 ILE 77 2HG1 ILE 77 17.353 -16.366 14.415 624 HG13 ILE 77 3HG1 ILE 77 18.821 -15.697 13.718 625 HG21 ILE 77 1HG2 ILE 77 20.787 -16.400 16.067 626 HG22 ILE 77 2HG2 ILE 77 20.647 -14.932 15.076 627 HG23 ILE 77 3HG2 ILE 77 20.517 -14.827 16.842 628 HD11 ILE 77 3HD1 ILE 77 18.619 -18.366 15.170 629 HD12 ILE 77 1HD1 ILE 77 18.727 -18.120 13.412 630 HD13 ILE 77 2HD1 ILE 77 20.102 -17.686 14.446 631 H ALA 78 H ALA 78 16.742 -14.617 18.105 632 HA ALA 78 HA ALA 78 18.793 -13.388 19.732 633 HB1 ALA 78 1HB ALA 78 15.792 -12.902 19.553 634 HB2 ALA 78 2HB ALA 78 16.969 -11.838 20.353 635 HB3 ALA 78 3HB ALA 78 17.045 -12.082 18.594 636 H VAL 79 H VAL 79 16.015 -15.571 20.440 637 HA VAL 79 HA VAL 79 16.373 -15.137 23.299 638 HB VAL 79 HB VAL 79 14.170 -15.577 22.356 639 HG11 VAL 79 1HG1 VAL 79 14.842 -17.168 20.567 640 HG12 VAL 79 2HG1 VAL 79 15.191 -18.390 21.814 641 HG13 VAL 79 3HG1 VAL 79 13.527 -17.797 21.593 642 HG21 VAL 79 3HG2 VAL 79 15.078 -17.857 24.167 643 HG22 VAL 79 1HG2 VAL 79 14.740 -16.201 24.717 644 HG23 VAL 79 2HG2 VAL 79 13.437 -17.194 24.017 645 H ASN 80 H ASN 80 17.545 -17.503 20.916 646 HA ASN 80 HA ASN 80 18.490 -19.323 22.979 647 HB2 ASN 80 2HB ASN 80 19.086 -19.066 20.005 648 HB3 ASN 80 3HB ASN 80 19.760 -20.330 21.036 649 HD21 ASN 80 2HD2 ASN 80 18.401 -21.292 18.987 650 HD22 ASN 80 1HD2 ASN 80 16.813 -21.866 19.460 651 H THR 81 H THR 81 19.713 -16.409 21.408 652 HA THR 81 HA THR 81 22.467 -16.859 22.243 653 HB THR 81 HB THR 81 21.007 -14.377 21.260 654 HG1 THR 81 1HG THR 81 21.186 -15.881 19.666 655 HG21 THR 81 1HG2 THR 81 23.316 -13.535 20.806 656 HG22 THR 81 2HG2 THR 81 23.003 -13.713 22.546 657 HG23 THR 81 3HG2 THR 81 23.975 -14.929 21.693 658 H ALA 82 H ALA 82 19.549 -15.409 23.656 659 HA ALA 82 HA ALA 82 20.976 -13.994 25.737 660 HB1 ALA 82 1HB ALA 82 18.720 -13.699 26.680 661 HB2 ALA 82 2HB ALA 82 18.727 -13.356 24.938 662 HB3 ALA 82 3HB ALA 82 18.077 -14.903 25.539 663 H LYS 83 H LYS 83 19.636 -17.274 25.365 664 HA LYS 83 HA LYS 83 19.953 -17.937 28.181 665 HB2 LYS 83 2HB LYS 83 19.539 -19.617 25.681 666 HB3 LYS 83 3HB LYS 83 19.543 -20.262 27.339 667 HG2 LYS 83 2HG LYS 83 17.644 -18.862 27.954 668 HG3 LYS 83 3HG LYS 83 17.666 -18.060 26.378 669 HD2 LYS 83 2HD LYS 83 17.187 -20.233 25.270 670 HD3 LYS 83 3HD LYS 83 17.140 -21.025 26.867 671 HE2 LYS 83 2HE LYS 83 15.290 -19.537 27.543 672 HE3 LYS 83 3HE LYS 83 15.340 -18.743 25.961 673 HZ1 LYS 83 3HZ LYS 83 13.639 -20.424 26.044 674 HZ2 LYS 83 1HZ LYS 83 14.791 -20.856 24.954 675 HZ3 LYS 83 2HZ LYS 83 14.733 -21.589 26.423 676 H ASN 84 H ASN 84 21.950 -18.077 25.255 677 HA ASN 84 HA ASN 84 24.037 -19.627 26.598 678 HB2 ASN 84 2HB ASN 84 23.599 -19.930 24.228 679 HB3 ASN 84 3HB ASN 84 23.948 -18.215 23.909 680 HD21 ASN 84 2HD2 ASN 84 26.082 -17.545 23.691 681 HD22 ASN 84 1HD2 ASN 84 27.444 -18.639 23.795 682 H TYR 85 H TYR 85 23.090 -16.276 26.382 683 HA TYR 85 HA TYR 85 25.754 -15.220 26.887 684 HB2 TYR 85 2HB TYR 85 23.943 -13.959 25.754 685 HB3 TYR 85 3HB TYR 85 23.003 -13.983 27.252 686 HD1 TYR 85 HD2 TYR 85 25.971 -12.599 25.544 687 HD2 TYR 85 HD1 TYR 85 23.604 -12.565 29.131 688 HE1 TYR 85 HE2 TYR 85 27.102 -10.510 26.262 689 HE2 TYR 85 HE1 TYR 85 24.734 -10.476 29.861 690 HH TYR 85 HH TYR 85 26.251 -8.854 29.321 691 H LEU 86 H LEU 86 22.921 -16.211 28.846 692 HA LEU 86 HA LEU 86 24.171 -15.199 31.289 693 HB2 LEU 86 2HB LEU 86 21.671 -16.856 30.779 694 HB3 LEU 86 3HB LEU 86 22.209 -16.316 32.376 695 HG LEU 86 HG LEU 86 21.465 -14.486 30.056 696 HD11 LEU 86 1HD1 LEU 86 20.127 -15.129 32.715 697 HD12 LEU 86 2HD1 LEU 86 19.582 -13.887 31.567 698 HD13 LEU 86 3HD1 LEU 86 19.542 -15.601 31.098 699 HD21 LEU 86 3HD2 LEU 86 22.316 -13.880 32.920 700 HD22 LEU 86 1HD2 LEU 86 23.202 -13.438 31.436 701 HD23 LEU 86 2HD2 LEU 86 21.631 -12.690 31.787 702 H VAL 87 H VAL 87 24.353 -18.194 29.476 703 HA VAL 87 HA VAL 87 25.314 -19.635 31.847 704 HB VAL 87 HB VAL 87 24.005 -20.663 29.901 705 HG11 VAL 87 1HG1 VAL 87 26.771 -20.692 28.611 706 HG12 VAL 87 2HG1 VAL 87 25.279 -21.423 27.980 707 HG13 VAL 87 3HG1 VAL 87 25.424 -19.653 28.099 708 HG21 VAL 87 3HG2 VAL 87 26.644 -21.950 30.701 709 HG22 VAL 87 1HG2 VAL 87 25.130 -22.002 31.640 710 HG23 VAL 87 2HG2 VAL 87 25.219 -22.778 30.040 711 H ALA 88 H ALA 88 26.598 -17.659 29.240 712 HA ALA 88 HA ALA 88 29.288 -18.675 29.425 713 HB1 ALA 88 1HB ALA 88 28.184 -16.061 28.317 714 HB2 ALA 88 2HB ALA 88 29.820 -16.695 28.031 715 HB3 ALA 88 3HB ALA 88 28.409 -17.574 27.399 716 H GLN 89 H GLN 89 27.413 -16.220 31.124 717 HA GLN 89 HA GLN 89 29.834 -15.392 32.657 718 HB2 GLN 89 2HB GLN 89 27.098 -14.169 32.196 719 HB3 GLN 89 3HB GLN 89 28.092 -13.714 33.587 720 HG2 GLN 89 2HG GLN 89 28.515 -12.117 31.868 721 HG3 GLN 89 3HG GLN 89 29.962 -13.113 32.065 722 HE21 GLN 89 2HE2 GLN 89 27.033 -12.636 30.011 723 HE22 GLN 89 1HE2 GLN 89 27.767 -13.264 28.554 724 H GLY 90 H GLY 90 27.157 -17.530 32.763 725 HA2 GLY 90 2HA GLY 90 26.956 -17.537 35.691 726 HA3 GLY 90 3HA GLY 90 26.054 -18.548 34.542 727 H ARG 91 H ARG 91 29.049 -18.926 33.359 728 HA ARG 91 HA ARG 91 29.852 -21.070 35.268 729 HB2 ARG 91 2HB ARG 91 29.818 -21.168 32.231 730 HB3 ARG 91 3HB ARG 91 30.532 -22.387 33.293 731 HG2 ARG 91 2HG ARG 91 27.584 -21.610 33.246 732 HG3 ARG 91 3HG ARG 91 28.283 -23.037 32.474 733 HD2 ARG 91 2HD ARG 91 28.245 -22.440 35.463 734 HD3 ARG 91 3HD ARG 91 27.294 -23.663 34.618 735 HE ARG 91 HE ARG 91 30.063 -23.849 35.467 736 HH11 ARG 91 1HH1 ARG 91 27.709 -25.071 33.119 737 HH12 ARG 91 2HH1 ARG 91 28.628 -26.521 32.792 738 HH21 ARG 91 1HH2 ARG 91 31.215 -25.762 35.035 739 HH22 ARG 91 2HH2 ARG 91 30.601 -26.908 33.868 740 H ARG 92 H ARG 92 32.058 -21.634 35.162 741 HA ARG 92 HA ARG 92 33.936 -19.709 33.900 742 HB2 ARG 92 2HB ARG 92 33.976 -20.570 36.826 743 HB3 ARG 92 3HB ARG 92 35.279 -19.700 35.995 744 HG2 ARG 92 2HG ARG 92 33.720 -17.831 35.501 745 HG3 ARG 92 3HG ARG 92 32.432 -18.684 36.380 746 HD2 ARG 92 2HD ARG 92 35.091 -17.802 37.569 747 HD3 ARG 92 3HD ARG 92 33.546 -16.956 37.773 748 HE ARG 92 HE ARG 92 34.418 -19.413 39.102 749 HH11 ARG 92 1HH1 ARG 92 31.643 -17.407 38.207 750 HH12 ARG 92 2HH1 ARG 92 30.615 -18.071 39.454 751 HH21 ARG 92 1HH2 ARG 92 33.063 -20.249 40.723 752 HH22 ARG 92 2HH2 ARG 92 31.422 -19.672 40.887 753 H LEU 93 H LEU 93 36.095 -20.630 33.660 754 HA LEU 93 HA LEU 93 37.327 -22.273 32.673 755 HB2 LEU 93 2HB LEU 93 36.337 -23.913 35.035 756 HB3 LEU 93 3HB LEU 93 37.746 -24.283 34.035 757 HG LEU 93 HG LEU 93 37.401 -21.812 35.786 758 HD11 LEU 93 1HD1 LEU 93 39.194 -24.262 36.044 759 HD12 LEU 93 2HD1 LEU 93 39.184 -22.856 37.135 760 HD13 LEU 93 3HD1 LEU 93 37.760 -23.916 37.039 761 HD21 LEU 93 3HD2 LEU 93 39.761 -22.758 34.104 762 HD22 LEU 93 1HD2 LEU 93 38.794 -21.290 33.824 763 HD23 LEU 93 2HD2 LEU 93 39.807 -21.423 35.274 764 H GLU 94 H GLU 94 34.740 -21.907 31.637 765 HA GLU 94 HA GLU 94 34.073 -24.582 30.577 766 HB2 GLU 94 2HB GLU 94 32.665 -24.076 32.576 767 HB3 GLU 94 3HB GLU 94 32.125 -22.586 31.801 768 HG2 GLU 94 2HG GLU 94 30.477 -24.425 31.652 769 HG3 GLU 94 3HG GLU 94 30.977 -23.859 30.063 770 H LEU 95 H LEU 95 32.338 -24.189 28.758 771 HA LEU 95 HA LEU 95 32.020 -23.480 26.676 772 HB2 LEU 95 2HB LEU 95 31.075 -21.544 27.982 773 HB3 LEU 95 3HB LEU 95 32.583 -20.675 27.688 774 HG LEU 95 HG LEU 95 32.167 -20.771 25.239 775 HD11 LEU 95 1HD1 LEU 95 29.576 -22.155 26.061 776 HD12 LEU 95 2HD1 LEU 95 29.939 -21.532 24.434 777 HD13 LEU 95 3HD1 LEU 95 30.883 -22.874 25.086 778 HD21 LEU 95 3HD2 LEU 95 29.789 -19.776 26.858 779 HD22 LEU 95 1HD2 LEU 95 31.301 -18.889 26.586 780 HD23 LEU 95 2HD2 LEU 95 30.241 -19.256 25.211 781 H VAL 96 H VAL 96 34.628 -24.336 27.540 782 HA VAL 96 HA VAL 96 36.276 -23.205 25.333 783 HB VAL 96 HB VAL 96 38.253 -23.771 26.775 784 HG11 VAL 96 1HG1 VAL 96 36.325 -21.737 27.966 785 HG12 VAL 96 2HG1 VAL 96 38.088 -21.785 28.199 786 HG13 VAL 96 3HG1 VAL 96 37.407 -21.460 26.586 787 HG21 VAL 96 3HG2 VAL 96 36.183 -24.027 28.995 788 HG22 VAL 96 1HG2 VAL 96 37.141 -25.366 28.309 789 HG23 VAL 96 2HG2 VAL 96 37.946 -24.048 29.183 790 HA PRO 97 HA PRO 97 36.454 -27.342 23.879 791 HB2 PRO 97 2HB PRO 97 39.016 -27.595 22.920 792 HB3 PRO 97 3HB PRO 97 37.758 -26.591 22.126 793 HG2 PRO 97 2HG PRO 97 39.900 -25.687 24.077 794 HG3 PRO 97 3HG PRO 97 39.488 -24.974 22.476 795 HD2 PRO 97 2HD PRO 97 38.492 -23.917 24.750 796 HD3 PRO 97 3HD PRO 97 37.446 -24.088 23.307 797 H ARG 98 H ARG 98 37.348 -29.457 24.285 798 HA ARG 98 HA ARG 98 38.842 -29.669 26.865 799 HB2 ARG 98 2HB ARG 98 36.620 -31.456 25.801 800 HB3 ARG 98 3HB ARG 98 37.518 -31.707 27.297 801 HG2 ARG 98 2HG ARG 98 35.614 -29.405 26.696 802 HG3 ARG 98 3HG ARG 98 35.362 -30.764 27.805 803 HD2 ARG 98 2HD ARG 98 37.604 -29.875 28.901 804 HD3 ARG 98 3HD ARG 98 37.153 -28.354 28.117 805 HE ARG 98 HE ARG 98 36.008 -29.554 30.467 806 HH11 ARG 98 1HH1 ARG 98 35.054 -27.536 27.689 807 HH12 ARG 98 2HH1 ARG 98 33.689 -26.872 28.564 808 HH21 ARG 98 1HH2 ARG 98 34.282 -28.592 31.527 809 HH22 ARG 98 2HH2 ARG 98 33.234 -27.481 30.673 810 H GLY 99 H GLY 99 40.007 -31.754 27.125 811 HA2 GLY 99 2HA GLY 99 41.375 -33.446 26.387 812 HA3 GLY 99 3HA GLY 99 40.578 -33.375 24.803 813 H SER 100 H SER 100 41.696 -30.291 25.747 814 HA SER 100 HA SER 100 44.160 -30.611 24.105 815 HB2 SER 100 2HB SER 100 43.766 -28.288 23.362 816 HB3 SER 100 3HB SER 100 42.425 -29.369 22.921 817 HG SER 100 HG SER 100 41.724 -27.385 23.854 818 H HIS 101 H HIS 101 43.498 -30.622 27.166 819 HA HIS 101 HA HIS 101 45.457 -28.502 27.933 820 HB2 HIS 101 2HB HIS 101 43.259 -29.737 29.619 821 HB3 HIS 101 3HB HIS 101 44.325 -28.412 30.086 822 HD2 HIS 101 HD2 HIS 101 41.123 -29.161 28.196 823 HE1 HIS 101 HE1 HIS 101 41.769 -24.984 27.723 824 HE2 HIS 101 HE2 HIS 101 40.116 -26.892 27.363 825 H HIS 102 H HIS 102 46.791 -29.025 29.844 826 HA HIS 102 HA HIS 102 47.312 -31.943 30.140 827 HB2 HIS 102 2HB HIS 102 49.390 -29.766 29.736 828 HB3 HIS 102 3HB HIS 102 49.725 -31.472 30.047 829 HD2 HIS 102 HD2 HIS 102 48.896 -33.252 28.064 830 HE1 HIS 102 HE1 HIS 102 48.845 -30.332 24.969 831 HE2 HIS 102 HE2 HIS 102 48.795 -32.826 25.475 832 H HIS 103 H HIS 103 46.342 -29.221 31.706 833 HA HIS 103 HA HIS 103 47.170 -30.285 34.310 834 HB2 HIS 103 2HB HIS 103 48.970 -28.675 33.559 835 HB3 HIS 103 3HB HIS 103 47.740 -27.401 33.546 836 HD2 HIS 103 HD2 HIS 103 49.003 -26.059 35.509 837 HE1 HIS 103 HE1 HIS 103 48.382 -28.904 38.609 838 HE2 HIS 103 HE2 HIS 103 49.146 -26.528 38.079 839 H HIS 104 H HIS 104 46.020 -29.000 36.075 840 HA HIS 104 HA HIS 104 44.011 -28.499 37.019 841 HB2 HIS 104 2HB HIS 104 43.681 -26.735 34.572 842 HB3 HIS 104 3HB HIS 104 42.810 -26.586 36.101 843 HD2 HIS 104 HD2 HIS 104 44.691 -26.345 38.347 844 HE1 HIS 104 HE1 HIS 104 47.236 -23.843 36.039 845 HE2 HIS 104 HE2 HIS 104 46.649 -24.609 38.395 846 H HIS 105 H HIS 105 41.457 -27.991 36.127 847 HA HIS 105 HA HIS 105 40.745 -30.237 34.323 848 HB2 HIS 105 2HB HIS 105 40.636 -31.077 36.651 849 HB3 HIS 105 3HB HIS 105 39.560 -29.739 37.081 850 HD2 HIS 105 HD2 HIS 105 37.114 -30.526 37.213 851 HE1 HIS 105 HE1 HIS 105 37.090 -33.424 34.094 852 HE2 HIS 105 HE2 HIS 105 35.683 -32.272 35.883 853 H HIS 106 H HIS 106 38.616 -30.059 33.427 854 HA HIS 106 HA HIS 106 37.328 -27.394 33.610 855 HB2 HIS 106 2HB HIS 106 38.304 -28.663 31.025 856 HB3 HIS 106 3HB HIS 106 37.349 -27.183 31.158 857 HD2 HIS 106 HD2 HIS 106 38.603 -24.954 31.960 858 HE1 HIS 106 HE1 HIS 106 42.561 -26.500 31.851 859 HE2 HIS 106 HE2 HIS 106 41.160 -24.384 32.056 Start of MODEL 4 1 H1 MET 1 H1 MET 1 10.602 4.845 4.788 2 H2 MET 1 H2 MET 1 9.026 4.378 4.652 3 H3 MET 1 H3 MET 1 9.514 5.824 4.037 4 HA MET 1 HA MET 1 9.198 4.247 2.292 5 HB2 MET 1 2HB MET 1 10.921 5.987 2.022 6 HB3 MET 1 3HB MET 1 12.117 4.939 2.800 7 HG2 MET 1 2HG MET 1 12.320 4.903 0.344 8 HG3 MET 1 3HG MET 1 11.957 3.321 1.007 9 HE1 MET 1 1HE MET 1 10.654 6.404 -0.989 10 HE2 MET 1 2HE MET 1 8.954 5.989 -1.309 11 HE3 MET 1 3HE MET 1 9.480 6.378 0.346 12 H SER 2 H SER 2 9.525 2.201 1.408 13 HA SER 2 HA SER 2 11.220 0.298 2.903 14 HB2 SER 2 2HB SER 2 8.892 0.229 3.840 15 HB3 SER 2 3HB SER 2 8.302 -0.249 2.237 16 HG SER 2 HG SER 2 9.640 -2.082 2.366 17 H GLU 3 H GLU 3 10.702 1.724 0.068 18 HA GLU 3 HA GLU 3 11.012 1.258 -2.107 19 HB2 GLU 3 2HB GLU 3 12.628 -1.084 -1.060 20 HB3 GLU 3 3HB GLU 3 12.737 -0.363 -2.681 21 HG2 GLU 3 2HG GLU 3 13.393 1.805 -1.618 22 HG3 GLU 3 3HG GLU 3 13.430 0.988 -0.043 23 H GLN 4 H GLN 4 8.721 -0.261 -0.634 24 HA GLN 4 HA GLN 4 7.170 -1.836 -1.060 25 HB2 GLN 4 2HB GLN 4 7.222 -0.485 -3.257 26 HB3 GLN 4 3HB GLN 4 8.033 -1.904 -3.949 27 HG2 GLN 4 2HG GLN 4 6.114 -3.332 -3.270 28 HG3 GLN 4 3HG GLN 4 5.323 -1.927 -2.549 29 HE21 GLN 4 2HE2 GLN 4 3.730 -3.060 -4.242 30 HE22 GLN 4 1HE2 GLN 4 3.692 -2.270 -5.805 31 H LEU 5 H LEU 5 9.882 -2.607 -0.297 32 HA LEU 5 HA LEU 5 9.952 -5.415 -1.300 33 HB2 LEU 5 2HB LEU 5 12.094 -3.730 0.045 34 HB3 LEU 5 3HB LEU 5 12.300 -5.380 -0.567 35 HG LEU 5 HG LEU 5 11.706 -2.888 -2.221 36 HD11 LEU 5 1HD1 LEU 5 14.180 -4.648 -1.994 37 HD12 LEU 5 2HD1 LEU 5 13.991 -3.246 -3.078 38 HD13 LEU 5 3HD1 LEU 5 13.986 -3.012 -1.315 39 HD21 LEU 5 3HD2 LEU 5 12.050 -4.301 -4.187 40 HD22 LEU 5 1HD2 LEU 5 12.285 -5.733 -3.161 41 HD23 LEU 5 2HD2 LEU 5 10.696 -4.929 -3.237 42 H THR 6 H THR 6 10.566 -7.031 0.311 43 HA THR 6 HA THR 6 9.664 -6.432 3.079 44 HB THR 6 HB THR 6 8.546 -8.686 1.365 45 HG1 THR 6 1HG THR 6 6.663 -7.440 1.367 46 HG21 THR 6 1HG2 THR 6 8.416 -9.308 3.671 47 HG22 THR 6 2HG2 THR 6 7.925 -7.661 4.153 48 HG23 THR 6 3HG2 THR 6 6.811 -8.703 3.235 49 H ASP 7 H ASP 7 9.978 -8.570 4.437 50 HA ASP 7 HA ASP 7 12.709 -9.152 4.483 51 HB2 ASP 7 2HB ASP 7 12.089 -10.881 6.114 52 HB3 ASP 7 3HB ASP 7 11.182 -9.386 6.382 53 H GLN 8 H GLN 8 10.277 -10.515 2.402 54 HA GLN 8 HA GLN 8 11.520 -13.047 1.895 55 HB2 GLN 8 2HB GLN 8 9.206 -12.564 1.263 56 HB3 GLN 8 3HB GLN 8 9.733 -11.243 0.207 57 HG2 GLN 8 2HG GLN 8 9.196 -13.248 -1.104 58 HG3 GLN 8 3HG GLN 8 10.904 -12.837 -1.258 59 HE21 GLN 8 2HE2 GLN 8 12.500 -14.180 -0.195 60 HE22 GLN 8 1HE2 GLN 8 12.098 -15.808 0.309 61 H VAL 9 H VAL 9 11.661 -9.893 0.184 62 HA VAL 9 HA VAL 9 13.751 -10.899 -1.613 63 HB VAL 9 HB VAL 9 12.018 -9.598 -2.604 64 HG11 VAL 9 1HG1 VAL 9 11.172 -8.436 -0.651 65 HG12 VAL 9 2HG1 VAL 9 12.659 -7.449 -0.569 66 HG13 VAL 9 3HG1 VAL 9 11.525 -7.286 -1.944 67 HG21 VAL 9 3HG2 VAL 9 14.432 -7.760 -2.321 68 HG22 VAL 9 1HG2 VAL 9 14.355 -9.170 -3.410 69 HG23 VAL 9 2HG2 VAL 9 13.259 -7.786 -3.650 70 H LEU 10 H LEU 10 13.511 -8.921 1.325 71 HA LEU 10 HA LEU 10 16.113 -7.712 1.051 72 HB2 LEU 10 2HB LEU 10 14.023 -8.044 3.166 73 HB3 LEU 10 3HB LEU 10 15.680 -7.811 3.735 74 HG LEU 10 HG LEU 10 15.922 -5.768 2.461 75 HD11 LEU 10 1HD1 LEU 10 14.498 -6.221 0.533 76 HD12 LEU 10 2HD1 LEU 10 13.050 -6.211 1.576 77 HD13 LEU 10 3HD1 LEU 10 13.997 -4.723 1.329 78 HD21 LEU 10 3HD2 LEU 10 13.338 -5.857 4.080 79 HD22 LEU 10 1HD2 LEU 10 14.974 -5.666 4.746 80 HD23 LEU 10 2HD2 LEU 10 14.279 -4.390 3.719 81 H VAL 11 H VAL 11 14.984 -10.907 2.183 82 HA VAL 11 HA VAL 11 17.626 -11.501 3.294 83 HB VAL 11 HB VAL 11 15.156 -13.200 2.829 84 HG11 VAL 11 1HG1 VAL 11 17.077 -14.679 2.565 85 HG12 VAL 11 2HG1 VAL 11 17.875 -13.947 3.977 86 HG13 VAL 11 3HG1 VAL 11 16.398 -14.917 4.191 87 HG21 VAL 11 3HG2 VAL 11 15.155 -11.516 4.714 88 HG22 VAL 11 1HG2 VAL 11 15.110 -13.202 5.285 89 HG23 VAL 11 2HG2 VAL 11 16.632 -12.272 5.338 90 H GLU 12 H GLU 12 15.924 -11.889 0.188 91 HA GLU 12 HA GLU 12 17.947 -13.637 -0.941 92 HB2 GLU 12 2HB GLU 12 15.832 -11.798 -2.118 93 HB3 GLU 12 3HB GLU 12 16.950 -12.746 -3.116 94 HG2 GLU 12 2HG GLU 12 16.196 -14.821 -2.022 95 HG3 GLU 12 3HG GLU 12 15.036 -13.897 -1.049 96 H ARG 13 H ARG 13 17.528 -10.121 -0.595 97 HA ARG 13 HA ARG 13 19.521 -9.401 -2.524 98 HB2 ARG 13 2HB ARG 13 17.631 -7.991 -1.808 99 HB3 ARG 13 3HB ARG 13 18.322 -7.852 -0.185 100 HG2 ARG 13 2HG ARG 13 20.108 -6.507 -0.954 101 HG3 ARG 13 3HG ARG 13 19.907 -7.049 -2.636 102 HD2 ARG 13 2HD ARG 13 19.072 -4.781 -2.451 103 HD3 ARG 13 3HD ARG 13 17.724 -5.897 -2.764 104 HE ARG 13 HE ARG 13 17.765 -5.669 -0.016 105 HH11 ARG 13 1HH1 ARG 13 17.556 -3.364 -2.695 106 HH12 ARG 13 2HH1 ARG 13 16.629 -2.205 -1.763 107 HH21 ARG 13 1HH2 ARG 13 16.568 -4.095 1.165 108 HH22 ARG 13 2HH2 ARG 13 16.074 -2.615 0.363 109 H VAL 14 H VAL 14 19.633 -9.908 1.027 110 HA VAL 14 HA VAL 14 22.398 -9.081 1.225 111 HB VAL 14 HB VAL 14 22.302 -10.021 3.474 112 HG11 VAL 14 1HG1 VAL 14 20.374 -8.658 4.306 113 HG12 VAL 14 2HG1 VAL 14 21.420 -7.790 3.148 114 HG13 VAL 14 3HG1 VAL 14 19.843 -8.432 2.633 115 HG21 VAL 14 3HG2 VAL 14 19.548 -11.020 2.674 116 HG22 VAL 14 1HG2 VAL 14 20.959 -12.019 3.103 117 HG23 VAL 14 2HG2 VAL 14 20.203 -10.974 4.331 118 H GLN 15 H GLN 15 20.780 -12.100 0.356 119 HA GLN 15 HA GLN 15 23.186 -13.721 0.678 120 HB2 GLN 15 2HB GLN 15 20.510 -14.153 -0.689 121 HB3 GLN 15 3HB GLN 15 21.798 -15.370 -0.656 122 HG2 GLN 15 2HG GLN 15 21.775 -15.419 1.790 123 HG3 GLN 15 3HG GLN 15 20.570 -14.150 1.851 124 HE21 GLN 15 2HE2 GLN 15 19.912 -16.440 3.161 125 HE22 GLN 15 1HE2 GLN 15 18.733 -17.361 2.255 126 H LYS 16 H LYS 16 21.877 -11.557 -1.762 127 HA LYS 16 HA LYS 16 23.581 -12.570 -3.887 128 HB2 LYS 16 2HB LYS 16 21.297 -10.852 -3.638 129 HB3 LYS 16 3HB LYS 16 22.616 -9.891 -4.325 130 HG2 LYS 16 2HG LYS 16 21.446 -10.950 -6.147 131 HG3 LYS 16 3HG LYS 16 23.028 -11.731 -5.968 132 HD2 LYS 16 2HD LYS 16 21.453 -13.475 -6.335 133 HD3 LYS 16 3HD LYS 16 21.864 -13.553 -4.615 134 HE2 LYS 16 2HE LYS 16 19.793 -12.293 -4.070 135 HE3 LYS 16 3HE LYS 16 19.397 -12.198 -5.796 136 HZ1 LYS 16 3HZ LYS 16 19.650 -14.683 -4.240 137 HZ2 LYS 16 1HZ LYS 16 18.241 -13.999 -4.726 138 HZ3 LYS 16 2HZ LYS 16 19.286 -14.593 -5.842 139 H GLY 17 H GLY 17 24.189 -10.792 -1.094 140 HA2 GLY 17 2HA GLY 17 26.511 -10.368 -0.611 141 HA3 GLY 17 3HA GLY 17 26.755 -9.836 -2.280 142 H ASP 18 H ASP 18 23.789 -8.543 -1.335 143 HA ASP 18 HA ASP 18 25.019 -5.917 -0.852 144 HB2 ASP 18 2HB ASP 18 22.208 -6.922 -1.398 145 HB3 ASP 18 3HB ASP 18 22.524 -5.261 -0.938 146 H GLN 19 H GLN 19 25.944 -6.362 1.227 147 HA GLN 19 HA GLN 19 24.389 -7.265 3.445 148 HB2 GLN 19 2HB GLN 19 26.830 -7.406 3.253 149 HB3 GLN 19 3HB GLN 19 26.973 -5.649 3.335 150 HG2 GLN 19 2HG GLN 19 25.594 -7.243 5.526 151 HG3 GLN 19 3HG GLN 19 27.348 -7.092 5.489 152 HE21 GLN 19 2HE2 GLN 19 26.049 -6.158 7.699 153 HE22 GLN 19 1HE2 GLN 19 26.089 -4.406 7.726 154 H LYS 20 H LYS 20 24.628 -4.187 1.829 155 HA LYS 20 HA LYS 20 23.871 -2.429 3.926 156 HB2 LYS 20 2HB LYS 20 23.214 -0.945 2.096 157 HB3 LYS 20 3HB LYS 20 24.719 -1.780 1.672 158 HG2 LYS 20 2HG LYS 20 23.344 -3.456 0.374 159 HG3 LYS 20 3HG LYS 20 21.907 -2.471 0.714 160 HD2 LYS 20 2HD LYS 20 22.994 -0.538 -0.417 161 HD3 LYS 20 3HD LYS 20 24.389 -1.578 -0.797 162 HE2 LYS 20 2HE LYS 20 22.876 -3.130 -2.005 163 HE3 LYS 20 3HE LYS 20 21.515 -2.042 -1.684 164 HZ1 LYS 20 3HZ LYS 20 22.668 -0.337 -2.929 165 HZ2 LYS 20 1HZ LYS 20 23.924 -1.357 -3.236 166 HZ3 LYS 20 2HZ LYS 20 22.440 -1.670 -3.856 167 H ALA 21 H ALA 21 22.025 -4.849 2.130 168 HA ALA 21 HA ALA 21 19.458 -3.684 2.892 169 HB1 ALA 21 1HB ALA 21 19.752 -4.892 0.770 170 HB2 ALA 21 2HB ALA 21 20.164 -6.371 1.662 171 HB3 ALA 21 3HB ALA 21 18.529 -5.680 1.812 172 H PHE 22 H PHE 22 21.809 -5.832 4.359 173 HA PHE 22 HA PHE 22 19.871 -7.138 6.090 174 HB2 PHE 22 2HB PHE 22 22.065 -8.161 5.510 175 HB3 PHE 22 3HB PHE 22 22.881 -6.869 6.377 176 HD1 PHE 22 HD1 PHE 22 20.097 -9.362 6.924 177 HD2 PHE 22 HD2 PHE 22 23.496 -7.315 8.599 178 HE1 PHE 22 HE1 PHE 22 19.848 -10.659 9.013 179 HE2 PHE 22 HE2 PHE 22 23.215 -8.595 10.709 180 HZ PHE 22 HZ PHE 22 21.397 -10.271 10.910 181 H ASN 23 H ASN 23 22.013 -4.274 6.218 182 HA ASN 23 HA ASN 23 21.600 -3.606 8.957 183 HB2 ASN 23 2HB ASN 23 23.363 -2.566 7.729 184 HB3 ASN 23 3HB ASN 23 22.270 -2.097 6.422 185 HD21 ASN 23 2HD2 ASN 23 21.218 -0.163 6.477 186 HD22 ASN 23 1HD2 ASN 23 21.309 0.968 7.808 187 H LEU 24 H LEU 24 19.820 -2.806 5.966 188 HA LEU 24 HA LEU 24 17.844 -1.184 7.329 189 HB2 LEU 24 2HB LEU 24 17.882 -2.477 4.574 190 HB3 LEU 24 3HB LEU 24 16.681 -1.295 5.125 191 HG LEU 24 HG LEU 24 19.683 -0.768 4.970 192 HD11 LEU 24 1HD1 LEU 24 17.424 0.059 3.108 193 HD12 LEU 24 2HD1 LEU 24 19.133 0.562 2.987 194 HD13 LEU 24 3HD1 LEU 24 18.688 -1.145 2.757 195 HD21 LEU 24 3HD2 LEU 24 18.540 0.655 6.629 196 HD22 LEU 24 1HD2 LEU 24 18.988 1.603 5.198 197 HD23 LEU 24 2HD2 LEU 24 17.302 1.090 5.421 198 H LEU 25 H LEU 25 18.286 -4.598 6.859 199 HA LEU 25 HA LEU 25 15.449 -5.219 7.244 200 HB2 LEU 25 2HB LEU 25 16.852 -6.616 5.794 201 HB3 LEU 25 3HB LEU 25 17.946 -6.951 7.139 202 HG LEU 25 HG LEU 25 16.094 -8.111 8.341 203 HD11 LEU 25 1HD1 LEU 25 14.571 -7.667 5.742 204 HD12 LEU 25 2HD1 LEU 25 14.056 -8.713 7.080 205 HD13 LEU 25 3HD1 LEU 25 14.154 -6.953 7.321 206 HD21 LEU 25 3HD2 LEU 25 17.666 -9.366 6.919 207 HD22 LEU 25 1HD2 LEU 25 16.045 -10.078 6.806 208 HD23 LEU 25 2HD2 LEU 25 16.649 -9.051 5.490 209 H VAL 26 H VAL 26 18.491 -5.455 9.234 210 HA VAL 26 HA VAL 26 17.068 -6.691 11.390 211 HB VAL 26 HB VAL 26 19.002 -6.303 12.750 212 HG11 VAL 26 1HG1 VAL 26 20.729 -7.396 11.421 213 HG12 VAL 26 2HG1 VAL 26 19.130 -8.117 11.103 214 HG13 VAL 26 3HG1 VAL 26 19.863 -7.011 9.921 215 HG21 VAL 26 3HG2 VAL 26 20.953 -5.028 11.944 216 HG22 VAL 26 1HG2 VAL 26 20.011 -4.475 10.539 217 HG23 VAL 26 2HG2 VAL 26 19.527 -4.006 12.191 218 H VAL 27 H VAL 27 17.392 -3.290 10.433 219 HA VAL 27 HA VAL 27 16.868 -2.299 13.088 220 HB VAL 27 HB VAL 27 17.983 -0.970 11.348 221 HG11 VAL 27 1HG1 VAL 27 16.677 -1.680 9.399 222 HG12 VAL 27 2HG1 VAL 27 15.241 -0.841 10.040 223 HG13 VAL 27 3HG1 VAL 27 16.681 0.086 9.556 224 HG21 VAL 27 3HG2 VAL 27 15.371 0.285 12.279 225 HG22 VAL 27 1HG2 VAL 27 16.848 0.128 13.260 226 HG23 VAL 27 2HG2 VAL 27 16.858 1.138 11.801 227 H ARG 28 H ARG 28 14.796 -3.510 10.485 228 HA ARG 28 HA ARG 28 12.331 -2.439 11.519 229 HB2 ARG 28 2HB ARG 28 12.722 -5.064 10.010 230 HB3 ARG 28 3HB ARG 28 11.283 -4.031 10.050 231 HG2 ARG 28 2HG ARG 28 12.572 -2.257 8.840 232 HG3 ARG 28 3HG ARG 28 13.979 -3.350 8.816 233 HD2 ARG 28 2HD ARG 28 12.946 -3.550 6.697 234 HD3 ARG 28 3HD ARG 28 12.570 -5.034 7.590 235 HE ARG 28 HE ARG 28 10.325 -4.006 8.080 236 HH11 ARG 28 1HH1 ARG 28 12.178 -2.911 5.260 237 HH12 ARG 28 2HH1 ARG 28 10.745 -2.375 4.410 238 HH21 ARG 28 1HH2 ARG 28 8.498 -3.289 6.918 239 HH22 ARG 28 2HH2 ARG 28 8.709 -2.575 5.333 240 H TYR 29 H TYR 29 14.344 -5.248 12.222 241 HA TYR 29 HA TYR 29 12.307 -6.305 14.097 242 HB2 TYR 29 2HB TYR 29 14.822 -7.475 12.891 243 HB3 TYR 29 3HB TYR 29 13.852 -8.276 14.132 244 HD1 TYR 29 HD2 TYR 29 13.855 -7.049 10.630 245 HD2 TYR 29 HD1 TYR 29 11.730 -9.275 13.624 246 HE1 TYR 29 HE2 TYR 29 12.283 -7.860 8.894 247 HE2 TYR 29 HE1 TYR 29 10.177 -10.131 11.906 248 HH TYR 29 HH TYR 29 9.583 -10.090 9.673 249 H GLN 30 H GLN 30 15.020 -4.254 14.196 250 HA GLN 30 HA GLN 30 16.370 -5.176 16.513 251 HB2 GLN 30 2HB GLN 30 17.194 -3.532 14.854 252 HB3 GLN 30 3HB GLN 30 16.037 -2.339 15.466 253 HG2 GLN 30 2HG GLN 30 17.136 -2.376 17.660 254 HG3 GLN 30 3HG GLN 30 18.214 -3.680 17.119 255 HE21 GLN 30 2HE2 GLN 30 19.404 -3.133 14.943 256 HE22 GLN 30 1HE2 GLN 30 20.095 -1.523 14.860 257 H HIS 31 H HIS 31 13.363 -3.346 16.095 258 HA HIS 31 HA HIS 31 13.167 -2.778 18.973 259 HB2 HIS 31 2HB HIS 31 12.307 -1.218 17.254 260 HB3 HIS 31 3HB HIS 31 11.186 -2.463 16.694 261 HD2 HIS 31 HD2 HIS 31 8.872 -2.581 17.850 262 HE1 HIS 31 HE1 HIS 31 9.639 -0.105 21.225 263 HE2 HIS 31 HE2 HIS 31 7.848 -1.404 19.958 264 H LYS 32 H LYS 32 12.056 -5.217 16.637 265 HA LYS 32 HA LYS 32 9.984 -6.258 18.382 266 HB2 LYS 32 2HB LYS 32 11.314 -7.437 15.907 267 HB3 LYS 32 3HB LYS 32 9.834 -8.039 16.678 268 HG2 LYS 32 2HG LYS 32 8.714 -5.878 16.231 269 HG3 LYS 32 3HG LYS 32 10.188 -5.274 15.441 270 HD2 LYS 32 2HD LYS 32 10.050 -7.114 13.781 271 HD3 LYS 32 3HD LYS 32 8.568 -7.706 14.563 272 HE2 LYS 32 2HE LYS 32 7.471 -5.532 14.109 273 HE3 LYS 32 3HE LYS 32 8.951 -4.945 13.337 274 HZ1 LYS 32 3HZ LYS 32 7.376 -5.759 11.719 275 HZ2 LYS 32 1HZ LYS 32 8.728 -6.694 11.708 276 HZ3 LYS 32 2HZ LYS 32 7.350 -7.243 12.417 277 H VAL 33 H VAL 33 13.372 -7.260 17.597 278 HA VAL 33 HA VAL 33 13.035 -9.636 19.255 279 HB VAL 33 HB VAL 33 15.277 -10.194 18.711 280 HG11 VAL 33 1HG1 VAL 33 13.555 -10.571 16.979 281 HG12 VAL 33 2HG1 VAL 33 13.910 -8.982 16.272 282 HG13 VAL 33 3HG1 VAL 33 15.149 -10.260 16.258 283 HG21 VAL 33 3HG2 VAL 33 16.396 -8.064 18.956 284 HG22 VAL 33 1HG2 VAL 33 16.740 -8.744 17.358 285 HG23 VAL 33 2HG2 VAL 33 15.570 -7.411 17.526 286 H ALA 34 H ALA 34 14.213 -6.327 19.705 287 HA ALA 34 HA ALA 34 15.657 -6.919 22.129 288 HB1 ALA 34 1HB ALA 34 14.376 -4.320 21.198 289 HB2 ALA 34 2HB ALA 34 15.569 -4.498 22.501 290 HB3 ALA 34 3HB ALA 34 16.030 -4.864 20.822 291 H SER 35 H SER 35 12.266 -6.581 21.311 292 HA SER 35 HA SER 35 11.375 -5.962 24.002 293 HB2 SER 35 2HB SER 35 10.121 -5.375 21.927 294 HB3 SER 35 3HB SER 35 9.866 -7.101 21.616 295 HG SER 35 HG SER 35 8.109 -6.121 22.740 296 H LEU 36 H LEU 36 11.630 -8.914 21.968 297 HA LEU 36 HA LEU 36 10.471 -10.536 24.100 298 HB2 LEU 36 2HB LEU 36 10.648 -12.377 22.565 299 HB3 LEU 36 3HB LEU 36 10.006 -10.959 21.733 300 HG LEU 36 HG LEU 36 12.496 -10.566 21.004 301 HD11 LEU 36 1HD1 LEU 36 13.716 -12.685 20.615 302 HD12 LEU 36 2HD1 LEU 36 13.559 -12.379 22.349 303 HD13 LEU 36 3HD1 LEU 36 12.497 -13.568 21.562 304 HD21 LEU 36 3HD2 LEU 36 10.626 -11.117 19.499 305 HD22 LEU 36 1HD2 LEU 36 12.088 -12.004 19.022 306 HD23 LEU 36 2HD2 LEU 36 10.793 -12.841 19.905 307 H VAL 37 H VAL 37 13.718 -9.600 23.125 308 HA VAL 37 HA VAL 37 14.872 -11.840 24.637 309 HB VAL 37 HB VAL 37 15.779 -10.924 22.441 310 HG11 VAL 37 1HG1 VAL 37 17.280 -8.989 24.203 311 HG12 VAL 37 2HG1 VAL 37 17.190 -9.054 22.434 312 HG13 VAL 37 3HG1 VAL 37 15.781 -8.491 23.373 313 HG21 VAL 37 3HG2 VAL 37 17.680 -11.195 24.798 314 HG22 VAL 37 1HG2 VAL 37 16.933 -12.548 23.910 315 HG23 VAL 37 2HG2 VAL 37 18.063 -11.453 23.083 316 H SER 38 H SER 38 13.902 -8.546 25.258 317 HA SER 38 HA SER 38 15.584 -8.104 27.547 318 HB2 SER 38 2HB SER 38 14.348 -6.316 26.343 319 HB3 SER 38 3HB SER 38 12.818 -6.999 26.907 320 HG SER 38 HG SER 38 13.577 -5.299 28.240 321 H ARG 39 H ARG 39 13.106 -10.346 26.930 322 HA ARG 39 HA ARG 39 12.289 -10.644 29.746 323 HB2 ARG 39 2HB ARG 39 11.517 -12.185 27.248 324 HB3 ARG 39 3HB ARG 39 10.814 -12.405 28.856 325 HG2 ARG 39 2HG ARG 39 10.023 -10.048 28.836 326 HG3 ARG 39 3HG ARG 39 10.730 -9.828 27.220 327 HD2 ARG 39 2HD ARG 39 8.360 -10.273 26.990 328 HD3 ARG 39 3HD ARG 39 9.279 -11.646 26.348 329 HE ARG 39 HE ARG 39 8.636 -12.081 29.114 330 HH11 ARG 39 1HH1 ARG 39 7.166 -12.059 25.900 331 HH12 ARG 39 2HH1 ARG 39 5.931 -13.221 26.331 332 HH21 ARG 39 1HH2 ARG 39 7.008 -13.583 29.649 333 HH22 ARG 39 2HH2 ARG 39 5.840 -14.078 28.446 334 H TYR 40 H TYR 40 14.953 -11.579 27.928 335 HA TYR 40 HA TYR 40 15.306 -14.037 29.590 336 HB2 TYR 40 2HB TYR 40 16.264 -13.478 26.771 337 HB3 TYR 40 3HB TYR 40 16.736 -14.878 27.740 338 HD1 TYR 40 HD1 TYR 40 14.974 -16.534 28.478 339 HD2 TYR 40 HD2 TYR 40 14.215 -13.477 25.551 340 HE1 TYR 40 HE1 TYR 40 12.963 -17.770 27.713 341 HE2 TYR 40 HE2 TYR 40 12.219 -14.714 24.764 342 HH TYR 40 HH TYR 40 11.184 -17.809 26.253 343 H VAL 41 H VAL 41 16.527 -10.902 28.774 344 HA VAL 41 HA VAL 41 18.718 -11.333 30.698 345 HB VAL 41 HB VAL 41 20.202 -9.870 29.221 346 HG11 VAL 41 1HG1 VAL 41 20.601 -12.274 29.589 347 HG12 VAL 41 2HG1 VAL 41 19.549 -12.662 28.211 348 HG13 VAL 41 3HG1 VAL 41 21.063 -11.767 27.947 349 HG21 VAL 41 3HG2 VAL 41 18.348 -10.846 27.016 350 HG22 VAL 41 1HG2 VAL 41 18.431 -9.166 27.609 351 HG23 VAL 41 2HG2 VAL 41 19.839 -9.906 26.825 352 HA PRO 42 HA PRO 42 17.225 -7.503 32.235 353 HB2 PRO 42 2HB PRO 42 19.439 -6.371 33.362 354 HB3 PRO 42 3HB PRO 42 18.668 -7.855 34.021 355 HG2 PRO 42 2HG PRO 42 21.022 -7.681 32.117 356 HG3 PRO 42 3HG PRO 42 20.931 -8.594 33.660 357 HD2 PRO 42 2HD PRO 42 20.458 -9.820 31.305 358 HD3 PRO 42 3HD PRO 42 19.415 -10.179 32.716 359 H SER 43 H SER 43 17.488 -5.089 32.057 360 HA SER 43 HA SER 43 17.734 -4.421 29.297 361 HB2 SER 43 2HB SER 43 17.214 -2.137 30.068 362 HB3 SER 43 3HB SER 43 16.138 -3.340 30.811 363 HG SER 43 HG SER 43 16.987 -1.838 32.331 364 H GLY 44 H GLY 44 20.192 -4.697 31.673 365 HA2 GLY 44 2HA GLY 44 21.907 -2.625 30.487 366 HA3 GLY 44 3HA GLY 44 22.299 -3.727 31.825 367 H ASP 45 H ASP 45 21.202 -6.010 29.982 368 HA ASP 45 HA ASP 45 23.686 -6.298 28.358 369 HB2 ASP 45 2HB ASP 45 22.056 -8.375 29.854 370 HB3 ASP 45 3HB ASP 45 23.372 -8.746 28.741 371 H VAL 46 H VAL 46 20.373 -5.760 28.121 372 HA VAL 46 HA VAL 46 19.718 -7.655 26.089 373 HB VAL 46 HB VAL 46 18.119 -6.450 27.599 374 HG11 VAL 46 1HG1 VAL 46 18.862 -4.127 27.300 375 HG12 VAL 46 2HG1 VAL 46 18.412 -4.206 25.568 376 HG13 VAL 46 3HG1 VAL 46 17.167 -4.343 26.824 377 HG21 VAL 46 3HG2 VAL 46 17.336 -7.785 25.788 378 HG22 VAL 46 1HG2 VAL 46 16.365 -6.303 25.848 379 HG23 VAL 46 2HG2 VAL 46 17.627 -6.473 24.604 380 HA PRO 47 HA PRO 47 20.576 -4.230 22.931 381 HB2 PRO 47 2HB PRO 47 22.562 -2.428 23.262 382 HB3 PRO 47 3HB PRO 47 20.944 -2.196 24.008 383 HG2 PRO 47 2HG PRO 47 23.439 -3.353 25.299 384 HG3 PRO 47 3HG PRO 47 22.390 -2.037 25.923 385 HD2 PRO 47 2HD PRO 47 22.103 -4.626 26.704 386 HD3 PRO 47 3HD PRO 47 20.687 -3.550 26.512 387 H ASP 48 H ASP 48 23.216 -5.711 24.781 388 HA ASP 48 HA ASP 48 24.985 -5.848 22.455 389 HB2 ASP 48 2HB ASP 48 25.799 -5.595 24.806 390 HB3 ASP 48 3HB ASP 48 25.145 -7.204 25.174 391 H VAL 49 H VAL 49 22.586 -7.891 24.080 392 HA VAL 49 HA VAL 49 23.376 -10.295 22.637 393 HB VAL 49 HB VAL 49 20.974 -9.571 24.361 394 HG11 VAL 49 1HG1 VAL 49 20.497 -11.994 24.403 395 HG12 VAL 49 2HG1 VAL 49 20.318 -11.331 22.769 396 HG13 VAL 49 3HG1 VAL 49 21.776 -12.262 23.190 397 HG21 VAL 49 3HG2 VAL 49 23.392 -11.368 24.833 398 HG22 VAL 49 1HG2 VAL 49 23.181 -9.737 25.517 399 HG23 VAL 49 2HG2 VAL 49 22.078 -11.053 25.986 400 H VAL 50 H VAL 50 21.216 -7.547 22.073 401 HA VAL 50 HA VAL 50 19.776 -8.803 19.891 402 HB VAL 50 HB VAL 50 20.238 -5.921 20.743 403 HG11 VAL 50 1HG1 VAL 50 18.522 -6.977 18.458 404 HG12 VAL 50 2HG1 VAL 50 18.466 -5.321 19.102 405 HG13 VAL 50 3HG1 VAL 50 19.936 -5.907 18.301 406 HG21 VAL 50 3HG2 VAL 50 18.739 -7.417 22.122 407 HG22 VAL 50 1HG2 VAL 50 17.895 -6.034 21.384 408 HG23 VAL 50 2HG2 VAL 50 17.738 -7.664 20.681 409 H GLN 51 H GLN 51 22.801 -6.898 20.218 410 HA GLN 51 HA GLN 51 23.222 -6.723 17.365 411 HB2 GLN 51 2HB GLN 51 24.222 -5.148 18.954 412 HB3 GLN 51 3HB GLN 51 25.156 -6.468 19.700 413 HG2 GLN 51 2HG GLN 51 26.356 -6.866 17.622 414 HG3 GLN 51 3HG GLN 51 25.374 -5.660 16.774 415 HE21 GLN 51 2HE2 GLN 51 27.868 -5.104 16.408 416 HE22 GLN 51 1HE2 GLN 51 28.480 -3.876 17.494 417 H GLU 52 H GLU 52 24.360 -8.989 19.948 418 HA GLU 52 HA GLU 52 25.992 -10.482 18.123 419 HB2 GLU 52 2HB GLU 52 26.235 -10.498 20.600 420 HB3 GLU 52 3HB GLU 52 24.707 -11.406 20.725 421 HG2 GLU 52 2HG GLU 52 25.650 -13.275 19.509 422 HG3 GLU 52 3HG GLU 52 27.093 -12.340 19.089 423 H ALA 53 H ALA 53 22.534 -10.482 18.850 424 HA ALA 53 HA ALA 53 22.023 -13.063 17.651 425 HB1 ALA 53 1HB ALA 53 20.194 -10.691 18.188 426 HB2 ALA 53 2HB ALA 53 19.670 -12.327 17.725 427 HB3 ALA 53 3HB ALA 53 20.496 -12.064 19.280 428 H PHE 54 H PHE 54 22.392 -9.740 16.396 429 HA PHE 54 HA PHE 54 21.324 -10.546 13.781 430 HB2 PHE 54 2HB PHE 54 22.605 -7.995 14.814 431 HB3 PHE 54 3HB PHE 54 22.059 -8.227 13.155 432 HD1 PHE 54 HD1 PHE 54 19.488 -9.805 13.722 433 HD2 PHE 54 HD2 PHE 54 21.139 -6.248 15.506 434 HE1 PHE 54 HE1 PHE 54 17.222 -9.056 14.340 435 HE2 PHE 54 HE2 PHE 54 18.851 -5.484 16.073 436 HZ PHE 54 HZ PHE 54 16.894 -6.896 15.495 437 H ILE 55 H ILE 55 24.492 -10.200 15.363 438 HA ILE 55 HA ILE 55 25.984 -10.502 12.893 439 HB ILE 55 HB ILE 55 26.712 -10.995 15.809 440 HG12 ILE 55 2HG1 ILE 55 27.374 -8.653 13.963 441 HG13 ILE 55 3HG1 ILE 55 26.099 -8.630 15.165 442 HG21 ILE 55 1HG2 ILE 55 29.063 -10.951 15.025 443 HG22 ILE 55 2HG2 ILE 55 28.175 -12.286 14.279 444 HG23 ILE 55 3HG2 ILE 55 28.500 -10.809 13.345 445 HD11 ILE 55 3HD1 ILE 55 27.789 -9.085 16.957 446 HD12 ILE 55 1HD1 ILE 55 29.074 -8.970 15.730 447 HD13 ILE 55 2HD1 ILE 55 28.069 -7.559 16.088 448 H LYS 56 H LYS 56 24.623 -12.667 15.371 449 HA LYS 56 HA LYS 56 25.753 -15.098 14.255 450 HB2 LYS 56 2HB LYS 56 25.158 -14.756 16.636 451 HB3 LYS 56 3HB LYS 56 23.449 -14.596 16.182 452 HG2 LYS 56 2HG LYS 56 23.510 -16.919 15.267 453 HG3 LYS 56 3HG LYS 56 25.195 -17.070 15.810 454 HD2 LYS 56 2HD LYS 56 22.771 -16.500 17.568 455 HD3 LYS 56 3HD LYS 56 23.596 -18.062 17.434 456 HE2 LYS 56 2HE LYS 56 24.810 -15.472 18.486 457 HE3 LYS 56 3HE LYS 56 24.256 -16.830 19.469 458 HZ1 LYS 56 3HZ LYS 56 25.902 -18.216 18.406 459 HZ2 LYS 56 1HZ LYS 56 26.439 -16.959 17.495 460 HZ3 LYS 56 2HZ LYS 56 26.617 -16.918 19.126 461 H ALA 57 H ALA 57 22.721 -13.243 13.839 462 HA ALA 57 HA ALA 57 21.337 -15.350 12.463 463 HB1 ALA 57 1HB ALA 57 20.967 -12.329 12.404 464 HB2 ALA 57 2HB ALA 57 19.837 -13.510 11.709 465 HB3 ALA 57 3HB ALA 57 20.115 -13.493 13.456 466 H TYR 58 H TYR 58 23.423 -12.613 11.303 467 HA TYR 58 HA TYR 58 22.809 -12.976 8.555 468 HB2 TYR 58 2HB TYR 58 23.945 -11.007 9.597 469 HB3 TYR 58 3HB TYR 58 25.385 -12.006 9.846 470 HD1 TYR 58 HD1 TYR 58 23.076 -10.722 7.185 471 HD2 TYR 58 HD2 TYR 58 26.980 -12.253 8.135 472 HE1 TYR 58 HE1 TYR 58 23.860 -10.096 4.924 473 HE2 TYR 58 HE2 TYR 58 27.772 -11.656 5.860 474 HH TYR 58 HH TYR 58 25.623 -10.111 3.442 475 H ARG 59 H ARG 59 25.245 -14.492 10.674 476 HA ARG 59 HA ARG 59 26.657 -15.861 8.562 477 HB2 ARG 59 2HB ARG 59 26.466 -16.291 11.570 478 HB3 ARG 59 3HB ARG 59 27.615 -17.129 10.507 479 HG2 ARG 59 2HG ARG 59 28.697 -15.052 9.904 480 HG3 ARG 59 3HG ARG 59 27.439 -14.084 10.706 481 HD2 ARG 59 2HD ARG 59 28.047 -14.961 12.878 482 HD3 ARG 59 3HD ARG 59 29.184 -16.098 12.146 483 HE ARG 59 HE ARG 59 29.546 -13.194 12.565 484 HH11 ARG 59 1HH1 ARG 59 30.784 -16.128 11.018 485 HH12 ARG 59 2HH1 ARG 59 32.382 -15.467 10.779 486 HH21 ARG 59 1HH2 ARG 59 31.647 -12.366 12.251 487 HH22 ARG 59 2HH2 ARG 59 32.871 -13.350 11.481 488 H ALA 60 H ALA 60 23.774 -16.530 10.443 489 HA ALA 60 HA ALA 60 23.631 -19.306 9.428 490 HB1 ALA 60 1HB ALA 60 21.825 -17.740 11.306 491 HB2 ALA 60 2HB ALA 60 21.692 -19.473 10.929 492 HB3 ALA 60 3HB ALA 60 23.120 -18.854 11.792 493 H LEU 61 H LEU 61 22.685 -16.162 8.436 494 HA LEU 61 HA LEU 61 20.126 -16.838 7.311 495 HB2 LEU 61 2HB LEU 61 20.951 -14.540 8.054 496 HB3 LEU 61 3HB LEU 61 21.983 -14.530 6.610 497 HG LEU 61 HG LEU 61 19.900 -14.800 5.211 498 HD11 LEU 61 1HD1 LEU 61 18.404 -15.814 6.888 499 HD12 LEU 61 2HD1 LEU 61 18.573 -14.375 7.924 500 HD13 LEU 61 3HD1 LEU 61 17.731 -14.250 6.362 501 HD21 LEU 61 3HD2 LEU 61 19.154 -12.467 5.572 502 HD22 LEU 61 1HD2 LEU 61 19.952 -12.454 7.163 503 HD23 LEU 61 2HD2 LEU 61 20.928 -12.595 5.681 504 H ASP 62 H ASP 62 23.475 -17.048 6.270 505 HA ASP 62 HA ASP 62 22.970 -17.382 3.461 506 HB2 ASP 62 2HB ASP 62 25.174 -16.836 4.509 507 HB3 ASP 62 3HB ASP 62 25.213 -18.467 5.203 508 H SER 63 H SER 63 22.149 -19.303 6.166 509 HA SER 63 HA SER 63 22.017 -21.775 4.522 510 HB2 SER 63 2HB SER 63 21.976 -21.400 7.536 511 HB3 SER 63 3HB SER 63 21.889 -22.950 6.677 512 HG SER 63 HG SER 63 24.019 -22.425 7.333 513 H PHE 64 H PHE 64 20.102 -19.200 5.314 514 HA PHE 64 HA PHE 64 17.663 -20.562 6.079 515 HB2 PHE 64 2HB PHE 64 18.159 -18.211 6.625 516 HB3 PHE 64 3HB PHE 64 18.175 -17.805 4.906 517 HD1 PHE 64 HD1 PHE 64 15.975 -19.245 7.579 518 HD2 PHE 64 HD2 PHE 64 16.194 -17.125 3.851 519 HE1 PHE 64 HE1 PHE 64 13.535 -18.806 7.688 520 HE2 PHE 64 HE2 PHE 64 13.760 -16.687 3.948 521 HZ PHE 64 HZ PHE 64 12.423 -17.522 5.872 522 H ARG 65 H ARG 65 15.842 -20.997 4.759 523 HA ARG 65 HA ARG 65 16.304 -20.941 1.821 524 HB2 ARG 65 2HB ARG 65 15.383 -23.372 3.379 525 HB3 ARG 65 3HB ARG 65 15.587 -23.260 1.618 526 HG2 ARG 65 2HG ARG 65 18.029 -22.831 1.963 527 HG3 ARG 65 3HG ARG 65 17.796 -23.068 3.712 528 HD2 ARG 65 2HD ARG 65 17.253 -25.110 1.531 529 HD3 ARG 65 3HD ARG 65 18.605 -25.128 2.683 530 HE ARG 65 HE ARG 65 15.916 -25.084 3.876 531 HH11 ARG 65 1HH1 ARG 65 18.611 -27.114 2.812 532 HH12 ARG 65 2HH1 ARG 65 18.132 -28.463 3.814 533 HH21 ARG 65 1HH2 ARG 65 15.308 -26.823 5.119 534 HH22 ARG 65 2HH2 ARG 65 16.245 -28.306 5.130 535 H GLY 66 H GLY 66 14.298 -19.965 4.253 536 HA2 GLY 66 2HA GLY 66 12.155 -19.112 4.116 537 HA3 GLY 66 3HA GLY 66 12.053 -19.658 2.436 538 H ASP 67 H ASP 67 12.982 -22.103 4.765 539 HA ASP 67 HA ASP 67 10.632 -23.669 4.265 540 HB2 ASP 67 2HB ASP 67 12.767 -23.881 6.423 541 HB3 ASP 67 3HB ASP 67 11.546 -25.112 6.085 542 H SER 68 H SER 68 11.173 -21.001 6.308 543 HA SER 68 HA SER 68 8.506 -21.278 7.501 544 HB2 SER 68 2HB SER 68 9.352 -20.798 9.777 545 HB3 SER 68 3HB SER 68 9.965 -22.347 9.177 546 HG SER 68 HG SER 68 11.338 -19.860 9.233 547 H ALA 69 H ALA 69 7.987 -19.122 8.693 548 HA ALA 69 HA ALA 69 8.601 -16.957 6.922 549 HB1 ALA 69 1HB ALA 69 7.370 -15.592 8.550 550 HB2 ALA 69 2HB ALA 69 6.511 -17.110 8.222 551 HB3 ALA 69 3HB ALA 69 7.438 -16.924 9.732 552 H PHE 70 H PHE 70 9.879 -15.074 7.274 553 HA PHE 70 HA PHE 70 12.416 -15.713 8.436 554 HB2 PHE 70 2HB PHE 70 12.216 -14.225 6.515 555 HB3 PHE 70 3HB PHE 70 11.239 -13.095 7.462 556 HD1 PHE 70 HD1 PHE 70 14.610 -14.787 7.622 557 HD2 PHE 70 HD2 PHE 70 12.281 -11.258 8.424 558 HE1 PHE 70 HE1 PHE 70 16.644 -13.617 8.413 559 HE2 PHE 70 HE2 PHE 70 14.312 -10.095 9.204 560 HZ PHE 70 HZ PHE 70 16.508 -11.266 9.189 561 H TYR 71 H TYR 71 9.601 -13.861 9.680 562 HA TYR 71 HA TYR 71 11.122 -12.658 11.791 563 HB2 TYR 71 2HB TYR 71 8.993 -12.041 12.746 564 HB3 TYR 71 3HB TYR 71 9.015 -11.713 11.017 565 HD1 TYR 71 HD2 TYR 71 7.689 -13.970 13.655 566 HD2 TYR 71 HD1 TYR 71 7.449 -12.775 9.527 567 HE1 TYR 71 HE2 TYR 71 5.576 -15.250 13.408 568 HE2 TYR 71 HE1 TYR 71 5.340 -14.047 9.276 569 HH TYR 71 HH TYR 71 3.784 -15.366 10.303 570 H THR 72 H THR 72 9.274 -15.740 11.536 571 HA THR 72 HA THR 72 9.527 -16.352 14.344 572 HB THR 72 HB THR 72 9.200 -18.224 11.965 573 HG1 THR 72 1HG THR 72 6.996 -18.027 12.484 574 HG21 THR 72 1HG2 THR 72 9.850 -19.394 14.034 575 HG22 THR 72 2HG2 THR 72 8.564 -18.550 14.929 576 HG23 THR 72 3HG2 THR 72 8.147 -19.716 13.653 577 H TRP 73 H TRP 73 11.507 -16.937 11.432 578 HA TRP 73 HA TRP 73 13.341 -18.747 12.703 579 HB2 TRP 73 2HB TRP 73 12.981 -18.699 10.302 580 HB3 TRP 73 3HB TRP 73 13.493 -17.014 10.224 581 HD1 TRP 73 HD1 TRP 73 14.842 -20.534 10.353 582 HE1 TRP 73 HE1 TRP 73 17.371 -20.536 9.994 583 HE3 TRP 73 HE3 TRP 73 15.687 -15.488 10.597 584 HZ2 TRP 73 HZ2 TRP 73 19.514 -18.595 9.917 585 HZ3 TRP 73 HZ3 TRP 73 17.982 -14.607 10.376 586 HH2 TRP 73 HH2 TRP 73 19.897 -16.141 10.060 587 H LEU 74 H LEU 74 13.145 -15.205 12.417 588 HA LEU 74 HA LEU 74 15.892 -14.823 13.294 589 HB2 LEU 74 2HB LEU 74 14.775 -13.326 11.686 590 HB3 LEU 74 3HB LEU 74 13.570 -12.898 12.909 591 HG LEU 74 HG LEU 74 15.358 -11.925 14.333 592 HD11 LEU 74 1HD1 LEU 74 17.613 -11.556 13.350 593 HD12 LEU 74 2HD1 LEU 74 17.283 -13.280 13.597 594 HD13 LEU 74 3HD1 LEU 74 17.169 -12.580 11.965 595 HD21 LEU 74 3HD2 LEU 74 15.805 -9.967 12.892 596 HD22 LEU 74 1HD2 LEU 74 15.350 -10.915 11.462 597 HD23 LEU 74 2HD2 LEU 74 14.131 -10.535 12.706 598 H TYR 75 H TYR 75 12.631 -14.739 14.774 599 HA TYR 75 HA TYR 75 13.440 -13.555 17.252 600 HB2 TYR 75 2HB TYR 75 11.238 -15.559 16.625 601 HB3 TYR 75 3HB TYR 75 11.400 -14.691 18.147 602 HD1 TYR 75 HD2 TYR 75 12.338 -12.187 15.966 603 HD2 TYR 75 HD1 TYR 75 8.884 -14.558 16.981 604 HE1 TYR 75 HE2 TYR 75 10.846 -10.387 15.143 605 HE2 TYR 75 HE1 TYR 75 7.400 -12.758 16.143 606 HH TYR 75 HH TYR 75 7.282 -10.664 15.215 607 H ARG 76 H ARG 76 13.756 -16.821 15.937 608 HA ARG 76 HA ARG 76 14.305 -18.122 18.460 609 HB2 ARG 76 2HB ARG 76 14.812 -18.863 15.554 610 HB3 ARG 76 3HB ARG 76 15.181 -19.938 16.920 611 HG2 ARG 76 2HG ARG 76 12.878 -19.943 17.648 612 HG3 ARG 76 3HG ARG 76 12.440 -18.738 16.418 613 HD2 ARG 76 2HD ARG 76 13.067 -20.332 14.630 614 HD3 ARG 76 3HD ARG 76 13.525 -21.530 15.853 615 HE ARG 76 HE ARG 76 10.859 -20.770 16.388 616 HH11 ARG 76 1HH1 ARG 76 12.680 -22.398 13.824 617 HH12 ARG 76 2HH1 ARG 76 11.318 -23.369 13.321 618 HH21 ARG 76 1HH2 ARG 76 9.099 -22.048 15.699 619 HH22 ARG 76 2HH2 ARG 76 9.298 -23.165 14.368 620 H ILE 77 H ILE 77 16.249 -16.265 16.170 621 HA ILE 77 HA ILE 77 18.769 -17.347 17.106 622 HB ILE 77 HB ILE 77 18.296 -14.649 15.790 623 HG12 ILE 77 2HG1 ILE 77 17.261 -16.264 14.330 624 HG13 ILE 77 3HG1 ILE 77 18.793 -15.745 13.632 625 HG21 ILE 77 1HG2 ILE 77 20.634 -15.036 14.982 626 HG22 ILE 77 2HG2 ILE 77 20.528 -14.933 16.747 627 HG23 ILE 77 3HG2 ILE 77 20.704 -16.515 15.960 628 HD11 ILE 77 3HD1 ILE 77 19.873 -17.839 14.445 629 HD12 ILE 77 1HD1 ILE 77 18.307 -18.361 15.121 630 HD13 ILE 77 2HD1 ILE 77 18.501 -18.154 13.369 631 H ALA 78 H ALA 78 16.699 -14.577 18.029 632 HA ALA 78 HA ALA 78 18.764 -13.405 19.683 633 HB1 ALA 78 1HB ALA 78 15.771 -12.884 19.548 634 HB2 ALA 78 2HB ALA 78 16.977 -11.850 20.346 635 HB3 ALA 78 3HB ALA 78 17.020 -12.069 18.581 636 H VAL 79 H VAL 79 16.003 -15.622 20.323 637 HA VAL 79 HA VAL 79 16.303 -15.295 23.194 638 HB VAL 79 HB VAL 79 14.140 -15.785 22.226 639 HG11 VAL 79 1HG1 VAL 79 13.587 -17.953 21.282 640 HG12 VAL 79 2HG1 VAL 79 14.886 -17.209 20.324 641 HG13 VAL 79 3HG1 VAL 79 15.267 -18.513 21.474 642 HG21 VAL 79 3HG2 VAL 79 15.128 -18.171 23.845 643 HG22 VAL 79 1HG2 VAL 79 14.745 -16.580 24.539 644 HG23 VAL 79 2HG2 VAL 79 13.466 -17.547 23.761 645 H ASN 80 H ASN 80 17.590 -17.542 20.744 646 HA ASN 80 HA ASN 80 18.585 -19.373 22.783 647 HB2 ASN 80 2HB ASN 80 19.118 -19.079 19.800 648 HB3 ASN 80 3HB ASN 80 19.838 -20.342 20.805 649 HD21 ASN 80 2HD2 ASN 80 18.405 -21.222 18.718 650 HD22 ASN 80 1HD2 ASN 80 16.855 -21.859 19.241 651 H THR 81 H THR 81 19.741 -16.416 21.250 652 HA THR 81 HA THR 81 22.521 -16.851 22.014 653 HB THR 81 HB THR 81 21.027 -14.332 21.179 654 HG1 THR 81 1HG THR 81 21.062 -15.783 19.527 655 HG21 THR 81 1HG2 THR 81 23.152 -13.809 22.375 656 HG22 THR 81 2HG2 THR 81 24.014 -14.954 21.323 657 HG23 THR 81 3HG2 THR 81 23.292 -13.479 20.639 658 H ALA 82 H ALA 82 19.611 -15.451 23.497 659 HA ALA 82 HA ALA 82 21.049 -14.069 25.592 660 HB1 ALA 82 1HB ALA 82 18.143 -14.955 25.371 661 HB2 ALA 82 2HB ALA 82 18.793 -13.799 26.556 662 HB3 ALA 82 3HB ALA 82 18.807 -13.404 24.819 663 H LYS 83 H LYS 83 19.654 -17.325 25.197 664 HA LYS 83 HA LYS 83 19.952 -18.029 28.000 665 HB2 LYS 83 2HB LYS 83 19.546 -19.678 25.479 666 HB3 LYS 83 3HB LYS 83 19.555 -20.350 27.122 667 HG2 LYS 83 2HG LYS 83 17.657 -18.956 27.770 668 HG3 LYS 83 3HG LYS 83 17.680 -18.123 26.208 669 HD2 LYS 83 2HD LYS 83 17.204 -20.265 25.053 670 HD3 LYS 83 3HD LYS 83 17.139 -21.091 26.630 671 HE2 LYS 83 2HE LYS 83 15.297 -19.589 27.331 672 HE3 LYS 83 3HE LYS 83 15.369 -18.767 25.765 673 HZ1 LYS 83 3HZ LYS 83 13.641 -20.423 25.809 674 HZ2 LYS 83 1HZ LYS 83 14.786 -20.857 24.717 675 HZ3 LYS 83 2HZ LYS 83 14.711 -21.611 26.177 676 H ASN 84 H ASN 84 21.988 -18.173 25.093 677 HA ASN 84 HA ASN 84 24.038 -19.793 26.366 678 HB2 ASN 84 2HB ASN 84 23.578 -19.707 23.896 679 HB3 ASN 84 3HB ASN 84 24.157 -18.034 23.885 680 HD21 ASN 84 2HD2 ASN 84 25.794 -18.698 22.354 681 HD22 ASN 84 1HD2 ASN 84 27.227 -19.540 22.912 682 H TYR 85 H TYR 85 23.191 -16.377 26.175 683 HA TYR 85 HA TYR 85 25.823 -15.360 26.755 684 HB2 TYR 85 2HB TYR 85 24.014 -14.090 25.626 685 HB3 TYR 85 3HB TYR 85 23.080 -14.106 27.122 686 HD1 TYR 85 HD2 TYR 85 26.057 -12.761 25.406 687 HD2 TYR 85 HD1 TYR 85 23.663 -12.646 28.971 688 HE1 TYR 85 HE2 TYR 85 27.196 -10.664 26.093 689 HE2 TYR 85 HE1 TYR 85 24.802 -10.557 29.677 690 HH TYR 85 HH TYR 85 26.331 -8.944 29.117 691 H LEU 86 H LEU 86 22.970 -16.231 28.780 692 HA LEU 86 HA LEU 86 24.231 -15.112 31.156 693 HB2 LEU 86 2HB LEU 86 21.753 -16.817 30.734 694 HB3 LEU 86 3HB LEU 86 22.294 -16.235 32.317 695 HG LEU 86 HG LEU 86 21.501 -14.484 29.957 696 HD11 LEU 86 1HD1 LEU 86 19.664 -13.835 31.510 697 HD12 LEU 86 2HD1 LEU 86 19.610 -15.568 31.118 698 HD13 LEU 86 3HD1 LEU 86 20.251 -15.026 32.688 699 HD21 LEU 86 3HD2 LEU 86 22.468 -13.769 32.760 700 HD22 LEU 86 1HD2 LEU 86 23.269 -13.352 31.229 701 HD23 LEU 86 2HD2 LEU 86 21.702 -12.629 31.631 702 H VAL 87 H VAL 87 24.139 -18.369 29.665 703 HA VAL 87 HA VAL 87 25.206 -19.578 32.085 704 HB VAL 87 HB VAL 87 25.705 -21.521 30.665 705 HG11 VAL 87 1HG1 VAL 87 23.371 -22.053 30.090 706 HG12 VAL 87 2HG1 VAL 87 23.478 -21.244 31.670 707 HG13 VAL 87 3HG1 VAL 87 22.934 -20.336 30.240 708 HG21 VAL 87 3HG2 VAL 87 26.287 -20.373 28.563 709 HG22 VAL 87 1HG2 VAL 87 24.984 -21.543 28.309 710 HG23 VAL 87 2HG2 VAL 87 24.602 -19.807 28.410 711 H ALA 88 H ALA 88 26.546 -17.724 29.437 712 HA ALA 88 HA ALA 88 29.275 -18.580 29.853 713 HB1 ALA 88 1HB ALA 88 28.176 -16.007 28.651 714 HB2 ALA 88 2HB ALA 88 29.827 -16.626 28.472 715 HB3 ALA 88 3HB ALA 88 28.465 -17.522 27.754 716 H GLN 89 H GLN 89 27.110 -16.560 31.680 717 HA GLN 89 HA GLN 89 29.417 -15.281 33.055 718 HB2 GLN 89 2HB GLN 89 26.518 -14.798 33.725 719 HB3 GLN 89 3HB GLN 89 27.903 -13.731 33.952 720 HG2 GLN 89 2HG GLN 89 26.564 -14.449 31.321 721 HG3 GLN 89 3HG GLN 89 26.422 -12.919 32.183 722 HE21 GLN 89 2HE2 GLN 89 27.161 -12.897 29.551 723 HE22 GLN 89 1HE2 GLN 89 28.844 -12.427 29.409 724 H GLY 90 H GLY 90 26.830 -17.662 33.497 725 HA2 GLY 90 2HA GLY 90 27.186 -17.737 36.402 726 HA3 GLY 90 3HA GLY 90 26.025 -18.660 35.425 727 H ARG 91 H ARG 91 28.713 -19.305 33.737 728 HA ARG 91 HA ARG 91 29.322 -21.684 35.421 729 HB2 ARG 91 2HB ARG 91 29.561 -21.287 32.423 730 HB3 ARG 91 3HB ARG 91 30.086 -22.723 33.318 731 HG2 ARG 91 2HG ARG 91 27.719 -22.908 34.248 732 HG3 ARG 91 3HG ARG 91 27.246 -21.645 33.097 733 HD2 ARG 91 2HD ARG 91 26.788 -23.864 32.157 734 HD3 ARG 91 3HD ARG 91 28.084 -23.078 31.232 735 HE ARG 91 HE ARG 91 29.178 -24.660 33.364 736 HH11 ARG 91 1HH1 ARG 91 27.617 -25.026 30.214 737 HH12 ARG 91 2HH1 ARG 91 28.437 -26.528 29.856 738 HH21 ARG 91 1HH2 ARG 91 30.259 -26.567 32.865 739 HH22 ARG 91 2HH2 ARG 91 29.915 -27.425 31.373 740 H ARG 92 H ARG 92 30.627 -18.783 35.245 741 HA ARG 92 HA ARG 92 33.361 -19.428 34.506 742 HB2 ARG 92 2HB ARG 92 32.174 -17.066 36.022 743 HB3 ARG 92 3HB ARG 92 33.860 -17.197 35.474 744 HG2 ARG 92 2HG ARG 92 33.061 -17.436 33.126 745 HG3 ARG 92 3HG ARG 92 31.386 -17.230 33.688 746 HD2 ARG 92 2HD ARG 92 31.951 -14.995 34.564 747 HD3 ARG 92 3HD ARG 92 33.635 -15.213 34.043 748 HE ARG 92 HE ARG 92 31.598 -15.503 31.942 749 HH11 ARG 92 1HH1 ARG 92 33.856 -13.330 33.573 750 HH12 ARG 92 2HH1 ARG 92 33.948 -12.222 32.222 751 HH21 ARG 92 1HH2 ARG 92 31.738 -14.054 30.201 752 HH22 ARG 92 2HH2 ARG 92 32.737 -12.624 30.323 753 H LEU 93 H LEU 93 34.938 -20.231 35.705 754 HA LEU 93 HA LEU 93 35.949 -21.363 37.380 755 HB2 LEU 93 2HB LEU 93 34.893 -18.965 38.904 756 HB3 LEU 93 3HB LEU 93 35.962 -20.172 39.624 757 HG LEU 93 HG LEU 93 37.673 -19.722 37.893 758 HD11 LEU 93 1HD1 LEU 93 35.798 -17.453 37.107 759 HD12 LEU 93 2HD1 LEU 93 37.511 -17.563 36.641 760 HD13 LEU 93 3HD1 LEU 93 36.373 -18.779 36.054 761 HD21 LEU 93 3HD2 LEU 93 37.693 -18.635 40.116 762 HD22 LEU 93 1HD2 LEU 93 38.362 -17.564 38.870 763 HD23 LEU 93 2HD2 LEU 93 36.710 -17.299 39.472 764 H GLU 94 H GLU 94 33.235 -22.256 36.748 765 HA GLU 94 HA GLU 94 31.823 -22.847 39.159 766 HB2 GLU 94 2HB GLU 94 30.495 -24.334 37.772 767 HB3 GLU 94 3HB GLU 94 30.803 -22.818 36.906 768 HG2 GLU 94 2HG GLU 94 32.605 -23.907 35.612 769 HG3 GLU 94 3HG GLU 94 32.393 -25.397 36.537 770 H LEU 95 H LEU 95 34.833 -24.011 38.268 771 HA LEU 95 HA LEU 95 34.443 -26.800 39.025 772 HB2 LEU 95 2HB LEU 95 36.951 -25.123 38.600 773 HB3 LEU 95 3HB LEU 95 36.942 -26.848 38.932 774 HG LEU 95 HG LEU 95 37.280 -26.584 36.613 775 HD11 LEU 95 1HD1 LEU 95 35.410 -27.809 35.642 776 HD12 LEU 95 2HD1 LEU 95 35.733 -28.412 37.278 777 HD13 LEU 95 3HD1 LEU 95 34.349 -27.329 36.982 778 HD21 LEU 95 3HD2 LEU 95 35.879 -25.385 35.089 779 HD22 LEU 95 1HD2 LEU 95 34.706 -24.988 36.351 780 HD23 LEU 95 2HD2 LEU 95 36.338 -24.272 36.397 781 H VAL 96 H VAL 96 34.664 -23.885 40.792 782 HA VAL 96 HA VAL 96 35.229 -25.400 43.265 783 HB VAL 96 HB VAL 96 36.655 -23.488 44.034 784 HG11 VAL 96 1HG1 VAL 96 37.709 -24.947 41.578 785 HG12 VAL 96 2HG1 VAL 96 38.680 -24.219 42.871 786 HG13 VAL 96 3HG1 VAL 96 37.641 -25.613 43.231 787 HG21 VAL 96 3HG2 VAL 96 36.685 -22.731 41.082 788 HG22 VAL 96 1HG2 VAL 96 35.919 -21.788 42.381 789 HG23 VAL 96 2HG2 VAL 96 37.681 -22.015 42.366 790 HA PRO 97 HA PRO 97 31.881 -22.874 44.717 791 HB2 PRO 97 2HB PRO 97 32.214 -22.978 47.413 792 HB3 PRO 97 3HB PRO 97 31.835 -24.455 46.463 793 HG2 PRO 97 2HG PRO 97 34.568 -23.487 47.372 794 HG3 PRO 97 3HG PRO 97 33.848 -25.115 47.593 795 HD2 PRO 97 2HD PRO 97 35.532 -24.551 45.521 796 HD3 PRO 97 3HD PRO 97 34.131 -25.644 45.304 797 H ARG 98 H ARG 98 35.221 -22.069 45.338 798 HA ARG 98 HA ARG 98 34.628 -19.221 45.215 799 HB2 ARG 98 2HB ARG 98 34.382 -19.800 47.661 800 HB3 ARG 98 3HB ARG 98 36.034 -20.431 47.646 801 HG2 ARG 98 2HG ARG 98 35.974 -18.176 48.583 802 HG3 ARG 98 3HG ARG 98 36.882 -18.162 47.067 803 HD2 ARG 98 2HD ARG 98 34.900 -17.282 45.875 804 HD3 ARG 98 3HD ARG 98 33.951 -17.365 47.366 805 HE ARG 98 HE ARG 98 35.999 -15.387 46.640 806 HH11 ARG 98 1HH1 ARG 98 34.038 -16.755 49.251 807 HH12 ARG 98 2HH1 ARG 98 34.216 -15.348 50.273 808 HH21 ARG 98 1HH2 ARG 98 36.207 -13.576 47.991 809 HH22 ARG 98 2HH2 ARG 98 35.433 -13.553 49.557 810 H GLY 99 H GLY 99 36.546 -18.022 44.624 811 HA2 GLY 99 2HA GLY 99 38.404 -19.494 43.051 812 HA3 GLY 99 3HA GLY 99 38.536 -17.781 43.490 813 H SER 100 H SER 100 40.595 -19.971 43.348 814 HA SER 100 HA SER 100 41.911 -19.402 45.899 815 HB2 SER 100 2HB SER 100 42.282 -21.775 46.438 816 HB3 SER 100 3HB SER 100 40.551 -21.392 46.440 817 HG SER 100 HG SER 100 41.028 -23.322 45.291 818 H HIS 101 H HIS 101 44.146 -20.407 45.909 819 HA HIS 101 HA HIS 101 45.242 -20.787 43.176 820 HB2 HIS 101 2HB HIS 101 46.342 -18.887 45.276 821 HB3 HIS 101 3HB HIS 101 47.096 -19.258 43.720 822 HD2 HIS 101 HD2 HIS 101 45.809 -18.368 41.468 823 HE1 HIS 101 HE1 HIS 101 43.367 -15.518 43.468 824 HE2 HIS 101 HE2 HIS 101 44.230 -16.294 41.200 825 H HIS 102 H HIS 102 44.680 -22.383 45.796 826 HA HIS 102 HA HIS 102 45.617 -24.020 47.036 827 HB2 HIS 102 2HB HIS 102 46.047 -24.840 44.722 828 HB3 HIS 102 3HB HIS 102 47.685 -24.184 44.835 829 HD2 HIS 102 HD2 HIS 102 49.055 -26.415 44.870 830 HE1 HIS 102 HE1 HIS 102 47.213 -28.273 48.224 831 HE2 HIS 102 HE2 HIS 102 49.121 -28.429 46.545 832 H HIS 103 H HIS 103 47.836 -24.866 48.027 833 HA HIS 103 HA HIS 103 49.618 -22.607 48.701 834 HB2 HIS 103 2HB HIS 103 47.703 -22.495 50.281 835 HB3 HIS 103 3HB HIS 103 48.018 -24.160 50.770 836 HD2 HIS 103 HD2 HIS 103 50.087 -20.831 50.581 837 HE1 HIS 103 HE1 HIS 103 51.188 -22.851 54.162 838 HE2 HIS 103 HE2 HIS 103 51.554 -20.759 52.754 839 H HIS 104 H HIS 104 51.523 -23.330 49.948 840 HA HIS 104 HA HIS 104 52.093 -26.227 49.821 841 HB2 HIS 104 2HB HIS 104 54.158 -25.849 48.568 842 HB3 HIS 104 3HB HIS 104 52.748 -25.347 47.628 843 HD2 HIS 104 HD2 HIS 104 55.965 -24.012 49.161 844 HE1 HIS 104 HE1 HIS 104 54.056 -20.654 47.379 845 HE2 HIS 104 HE2 HIS 104 56.198 -21.495 48.474 846 H HIS 105 H HIS 105 54.219 -26.727 50.863 847 HA HIS 105 HA HIS 105 54.889 -24.740 52.979 848 HB2 HIS 105 2HB HIS 105 54.524 -27.737 53.315 849 HB3 HIS 105 3HB HIS 105 55.034 -26.603 54.575 850 HD2 HIS 105 HD2 HIS 105 53.182 -24.966 55.629 851 HE1 HIS 105 HE1 HIS 105 49.788 -26.769 53.808 852 HE2 HIS 105 HE2 HIS 105 50.564 -25.112 55.578 853 H HIS 106 H HIS 106 56.091 -26.213 50.316 854 HA HIS 106 HA HIS 106 58.853 -26.024 51.325 855 HB2 HIS 106 2HB HIS 106 58.211 -28.400 51.641 856 HB3 HIS 106 3HB HIS 106 57.744 -28.497 49.938 857 HD2 HIS 106 HD2 HIS 106 60.953 -27.677 52.025 858 HE1 HIS 106 HE1 HIS 106 62.190 -29.584 48.431 859 HE2 HIS 106 HE2 HIS 106 62.979 -28.611 50.650 Start of MODEL 5 1 H1 MET 1 H1 MET 1 0.715 3.589 -10.103 2 H2 MET 1 H2 MET 1 2.293 3.094 -10.136 3 H3 MET 1 H3 MET 1 1.899 4.532 -9.458 4 HA MET 1 HA MET 1 0.670 3.479 -7.730 5 HB2 MET 1 2HB MET 1 0.643 1.090 -7.464 6 HB3 MET 1 3HB MET 1 -0.020 1.490 -9.056 7 HG2 MET 1 2HG MET 1 2.834 0.565 -8.504 8 HG3 MET 1 3HG MET 1 1.527 -0.484 -9.028 9 HE1 MET 1 1HE MET 1 0.849 0.566 -12.691 10 HE2 MET 1 2HE MET 1 0.479 -0.575 -11.370 11 HE3 MET 1 3HE MET 1 -0.021 1.124 -11.246 12 H SER 2 H SER 2 1.716 2.393 -5.796 13 HA SER 2 HA SER 2 4.605 3.097 -5.787 14 HB2 SER 2 2HB SER 2 2.611 2.862 -3.504 15 HB3 SER 2 3HB SER 2 4.317 3.333 -3.358 16 HG SER 2 HG SER 2 2.911 5.137 -3.475 17 H GLU 3 H GLU 3 6.021 1.785 -4.401 18 HA GLU 3 HA GLU 3 5.144 -0.986 -3.886 19 HB2 GLU 3 2HB GLU 3 5.918 -0.921 -6.261 20 HB3 GLU 3 3HB GLU 3 7.482 -0.292 -5.709 21 HG2 GLU 3 2HG GLU 3 7.885 -2.362 -4.432 22 HG3 GLU 3 3HG GLU 3 6.277 -2.963 -4.851 23 H GLN 4 H GLN 4 6.519 -2.106 -2.442 24 HA GLN 4 HA GLN 4 8.814 -0.664 -1.298 25 HB2 GLN 4 2HB GLN 4 6.828 0.185 -0.127 26 HB3 GLN 4 3HB GLN 4 6.406 -1.469 0.378 27 HG2 GLN 4 2HG GLN 4 8.463 -1.620 1.702 28 HG3 GLN 4 3HG GLN 4 9.011 -0.056 1.084 29 HE21 GLN 4 2HE2 GLN 4 9.098 -0.025 3.664 30 HE22 GLN 4 1HE2 GLN 4 7.696 0.714 4.412 31 H LEU 5 H LEU 5 9.911 -2.039 0.368 32 HA LEU 5 HA LEU 5 9.967 -4.831 -0.661 33 HB2 LEU 5 2HB LEU 5 12.124 -3.198 0.687 34 HB3 LEU 5 3HB LEU 5 12.316 -4.762 -0.144 35 HG LEU 5 HG LEU 5 11.523 -2.111 -1.428 36 HD11 LEU 5 1HD1 LEU 5 13.744 -2.284 -2.496 37 HD12 LEU 5 2HD1 LEU 5 13.900 -2.280 -0.727 38 HD13 LEU 5 3HD1 LEU 5 14.049 -3.810 -1.629 39 HD21 LEU 5 3HD2 LEU 5 12.102 -4.812 -2.716 40 HD22 LEU 5 1HD2 LEU 5 10.492 -4.056 -2.595 41 HD23 LEU 5 2HD2 LEU 5 11.760 -3.292 -3.568 42 H THR 6 H THR 6 10.492 -6.522 0.789 43 HA THR 6 HA THR 6 9.809 -6.064 3.640 44 HB THR 6 HB THR 6 8.495 -8.123 1.829 45 HG1 THR 6 1HG THR 6 6.673 -6.807 2.083 46 HG21 THR 6 1HG2 THR 6 8.474 -8.964 4.070 47 HG22 THR 6 2HG2 THR 6 8.107 -7.356 4.753 48 HG23 THR 6 3HG2 THR 6 6.882 -8.247 3.816 49 H ASP 7 H ASP 7 10.092 -8.337 4.809 50 HA ASP 7 HA ASP 7 12.810 -8.998 4.687 51 HB2 ASP 7 2HB ASP 7 12.219 -10.833 6.190 52 HB3 ASP 7 3HB ASP 7 11.329 -9.366 6.620 53 H GLN 8 H GLN 8 10.246 -10.123 2.623 54 HA GLN 8 HA GLN 8 11.379 -12.642 1.876 55 HB2 GLN 8 2HB GLN 8 9.055 -12.045 1.375 56 HB3 GLN 8 3HB GLN 8 9.594 -10.669 0.392 57 HG2 GLN 8 2HG GLN 8 8.928 -12.548 -1.037 58 HG3 GLN 8 3HG GLN 8 10.651 -12.228 -1.216 59 HE21 GLN 8 2HE2 GLN 8 12.191 -13.701 -0.271 60 HE22 GLN 8 1HE2 GLN 8 11.727 -15.336 0.164 61 H VAL 9 H VAL 9 11.587 -9.378 0.376 62 HA VAL 9 HA VAL 9 13.565 -10.349 -1.560 63 HB VAL 9 HB VAL 9 11.868 -8.888 -2.391 64 HG11 VAL 9 1HG1 VAL 9 11.537 -6.589 -1.550 65 HG12 VAL 9 2HG1 VAL 9 11.152 -7.816 -0.331 66 HG13 VAL 9 3HG1 VAL 9 12.692 -6.924 -0.231 67 HG21 VAL 9 3HG2 VAL 9 14.188 -8.502 -3.267 68 HG22 VAL 9 1HG2 VAL 9 13.152 -7.060 -3.346 69 HG23 VAL 9 2HG2 VAL 9 14.378 -7.190 -2.077 70 H LEU 10 H LEU 10 13.521 -8.603 1.512 71 HA LEU 10 HA LEU 10 16.173 -7.497 1.226 72 HB2 LEU 10 2HB LEU 10 14.129 -7.811 3.396 73 HB3 LEU 10 3HB LEU 10 15.821 -7.630 3.892 74 HG LEU 10 HG LEU 10 16.057 -5.567 2.683 75 HD11 LEU 10 1HD1 LEU 10 14.578 -5.952 0.767 76 HD12 LEU 10 2HD1 LEU 10 13.154 -5.914 1.840 77 HD13 LEU 10 3HD1 LEU 10 14.139 -4.450 1.604 78 HD21 LEU 10 3HD2 LEU 10 15.138 -5.465 4.975 79 HD22 LEU 10 1HD2 LEU 10 14.454 -4.177 3.968 80 HD23 LEU 10 2HD2 LEU 10 13.486 -5.633 4.324 81 H VAL 11 H VAL 11 14.910 -10.681 2.237 82 HA VAL 11 HA VAL 11 17.543 -11.449 3.270 83 HB VAL 11 HB VAL 11 14.973 -12.997 2.826 84 HG11 VAL 11 1HG1 VAL 11 17.663 -13.936 3.920 85 HG12 VAL 11 2HG1 VAL 11 16.127 -14.824 4.073 86 HG13 VAL 11 3HG1 VAL 11 16.845 -14.550 2.472 87 HG21 VAL 11 3HG2 VAL 11 16.565 -12.219 5.319 88 HG22 VAL 11 1HG2 VAL 11 15.118 -11.359 4.746 89 HG23 VAL 11 2HG2 VAL 11 14.993 -13.047 5.290 90 H GLU 12 H GLU 12 15.756 -11.654 0.189 91 HA GLU 12 HA GLU 12 17.616 -13.510 -1.023 92 HB2 GLU 12 2HB GLU 12 15.668 -11.453 -2.133 93 HB3 GLU 12 3HB GLU 12 16.659 -12.500 -3.160 94 HG2 GLU 12 2HG GLU 12 15.680 -14.496 -2.084 95 HG3 GLU 12 3HG GLU 12 14.659 -13.460 -1.080 96 H ARG 13 H ARG 13 17.472 -9.962 -0.650 97 HA ARG 13 HA ARG 13 19.522 -9.424 -2.585 98 HB2 ARG 13 2HB ARG 13 17.761 -7.854 -1.941 99 HB3 ARG 13 3HB ARG 13 18.398 -7.766 -0.290 100 HG2 ARG 13 2HG ARG 13 20.416 -6.714 -1.039 101 HG3 ARG 13 3HG ARG 13 20.035 -7.027 -2.752 102 HD2 ARG 13 2HD ARG 13 18.362 -5.286 -0.896 103 HD3 ARG 13 3HD ARG 13 19.580 -4.665 -2.029 104 HE ARG 13 HE ARG 13 17.866 -6.256 -3.559 105 HH11 ARG 13 1HH1 ARG 13 17.568 -3.364 -1.535 106 HH12 ARG 13 2HH1 ARG 13 16.223 -2.726 -2.445 107 HH21 ARG 13 1HH2 ARG 13 16.105 -5.387 -4.731 108 HH22 ARG 13 2HH2 ARG 13 15.398 -3.868 -4.245 109 H VAL 14 H VAL 14 19.595 -9.936 0.971 110 HA VAL 14 HA VAL 14 22.400 -9.253 1.167 111 HB VAL 14 HB VAL 14 22.262 -10.220 3.413 112 HG11 VAL 14 1HG1 VAL 14 19.923 -8.455 2.569 113 HG12 VAL 14 2HG1 VAL 14 20.403 -8.737 4.247 114 HG13 VAL 14 3HG1 VAL 14 21.526 -7.927 3.114 115 HG21 VAL 14 3HG2 VAL 14 19.448 -11.024 2.609 116 HG22 VAL 14 1HG2 VAL 14 20.788 -12.120 3.045 117 HG23 VAL 14 2HG2 VAL 14 20.099 -11.021 4.265 118 H GLN 15 H GLN 15 20.621 -12.173 0.278 119 HA GLN 15 HA GLN 15 22.951 -13.912 0.568 120 HB2 GLN 15 2HB GLN 15 20.222 -14.226 -0.730 121 HB3 GLN 15 3HB GLN 15 21.446 -15.506 -0.707 122 HG2 GLN 15 2HG GLN 15 21.491 -15.489 1.746 123 HG3 GLN 15 3HG GLN 15 20.333 -14.165 1.798 124 HE21 GLN 15 2HE2 GLN 15 19.677 -16.440 3.194 125 HE22 GLN 15 1HE2 GLN 15 18.400 -17.303 2.368 126 H LYS 16 H LYS 16 21.852 -11.586 -1.722 127 HA LYS 16 HA LYS 16 23.398 -12.763 -3.939 128 HB2 LYS 16 2HB LYS 16 21.501 -10.427 -3.690 129 HB3 LYS 16 3HB LYS 16 22.442 -10.736 -5.160 130 HG2 LYS 16 2HG LYS 16 21.468 -12.930 -5.431 131 HG3 LYS 16 3HG LYS 16 20.695 -12.860 -3.839 132 HD2 LYS 16 2HD LYS 16 19.352 -10.891 -4.625 133 HD3 LYS 16 3HD LYS 16 20.029 -11.128 -6.253 134 HE2 LYS 16 2HE LYS 16 19.154 -13.451 -6.268 135 HE3 LYS 16 3HE LYS 16 18.488 -13.214 -4.645 136 HZ1 LYS 16 3HZ LYS 16 16.817 -12.891 -6.339 137 HZ2 LYS 16 1HZ LYS 16 17.089 -11.473 -5.554 138 HZ3 LYS 16 2HZ LYS 16 17.703 -11.717 -7.061 139 H GLY 17 H GLY 17 24.200 -11.064 -1.237 140 HA2 GLY 17 2HA GLY 17 26.523 -10.629 -0.914 141 HA3 GLY 17 3HA GLY 17 26.662 -10.107 -2.598 142 H ASP 18 H ASP 18 23.810 -8.757 -1.362 143 HA ASP 18 HA ASP 18 25.185 -6.170 -0.937 144 HB2 ASP 18 2HB ASP 18 22.386 -7.055 -1.657 145 HB3 ASP 18 3HB ASP 18 22.688 -5.431 -1.056 146 H GLN 19 H GLN 19 26.025 -6.659 1.162 147 HA GLN 19 HA GLN 19 24.404 -7.528 3.326 148 HB2 GLN 19 2HB GLN 19 26.850 -7.725 3.163 149 HB3 GLN 19 3HB GLN 19 27.021 -5.969 3.284 150 HG2 GLN 19 2HG GLN 19 25.578 -7.578 5.421 151 HG3 GLN 19 3HG GLN 19 27.338 -7.473 5.413 152 HE21 GLN 19 2HE2 GLN 19 25.963 -6.563 7.603 153 HE22 GLN 19 1HE2 GLN 19 26.072 -4.815 7.684 154 H LYS 20 H LYS 20 24.736 -4.429 1.767 155 HA LYS 20 HA LYS 20 24.036 -2.682 3.900 156 HB2 LYS 20 2HB LYS 20 23.469 -1.131 2.103 157 HB3 LYS 20 3HB LYS 20 24.922 -2.038 1.653 158 HG2 LYS 20 2HG LYS 20 23.420 -3.631 0.363 159 HG3 LYS 20 3HG LYS 20 22.074 -2.515 0.683 160 HD2 LYS 20 2HD LYS 20 23.373 -0.691 -0.446 161 HD3 LYS 20 3HD LYS 20 24.664 -1.865 -0.780 162 HE2 LYS 20 2HE LYS 20 23.320 -1.726 -2.768 163 HE3 LYS 20 3HE LYS 20 22.958 -3.281 -2.001 164 HZ1 LYS 20 3HZ LYS 20 21.338 -0.828 -1.780 165 HZ2 LYS 20 1HZ LYS 20 20.976 -2.128 -2.718 166 HZ3 LYS 20 2HZ LYS 20 20.979 -2.275 -1.081 167 H ALA 21 H ALA 21 22.114 -5.010 2.076 168 HA ALA 21 HA ALA 21 19.587 -3.766 2.856 169 HB1 ALA 21 1HB ALA 21 20.230 -6.453 1.582 170 HB2 ALA 21 2HB ALA 21 18.600 -5.767 1.777 171 HB3 ALA 21 3HB ALA 21 19.786 -4.957 0.728 172 H PHE 22 H PHE 22 21.871 -5.991 4.301 173 HA PHE 22 HA PHE 22 19.909 -7.226 6.065 174 HB2 PHE 22 2HB PHE 22 22.068 -8.326 5.477 175 HB3 PHE 22 3HB PHE 22 22.935 -7.041 6.314 176 HD1 PHE 22 HD1 PHE 22 20.173 -9.542 6.882 177 HD2 PHE 22 HD2 PHE 22 23.463 -7.343 8.586 178 HE1 PHE 22 HE1 PHE 22 19.872 -10.748 9.005 179 HE2 PHE 22 HE2 PHE 22 23.137 -8.545 10.734 180 HZ PHE 22 HZ PHE 22 21.349 -10.242 10.954 181 H ASN 23 H ASN 23 22.151 -4.443 6.152 182 HA ASN 23 HA ASN 23 21.820 -3.770 8.902 183 HB2 ASN 23 2HB ASN 23 23.586 -2.788 7.626 184 HB3 ASN 23 3HB ASN 23 22.472 -2.260 6.360 185 HD21 ASN 23 2HD2 ASN 23 21.488 -0.297 6.476 186 HD22 ASN 23 1HD2 ASN 23 21.673 0.818 7.813 187 H LEU 24 H LEU 24 19.995 -2.875 5.953 188 HA LEU 24 HA LEU 24 18.108 -1.239 7.428 189 HB2 LEU 24 2HB LEU 24 17.997 -2.415 4.624 190 HB3 LEU 24 3HB LEU 24 16.905 -1.177 5.271 191 HG LEU 24 HG LEU 24 19.925 -0.818 5.047 192 HD11 LEU 24 1HD1 LEU 24 19.408 0.599 3.095 193 HD12 LEU 24 2HD1 LEU 24 18.886 -1.080 2.830 194 HD13 LEU 24 3HD1 LEU 24 17.686 0.165 3.233 195 HD21 LEU 24 3HD2 LEU 24 18.872 0.616 6.756 196 HD22 LEU 24 1HD2 LEU 24 19.351 1.576 5.338 197 HD23 LEU 24 2HD2 LEU 24 17.647 1.140 5.575 198 H LEU 25 H LEU 25 18.413 -4.654 6.819 199 HA LEU 25 HA LEU 25 15.568 -5.206 7.223 200 HB2 LEU 25 2HB LEU 25 16.940 -6.658 5.800 201 HB3 LEU 25 3HB LEU 25 18.043 -6.977 7.153 202 HG LEU 25 HG LEU 25 16.240 -8.117 8.383 203 HD11 LEU 25 1HD1 LEU 25 14.133 -8.681 7.214 204 HD12 LEU 25 2HD1 LEU 25 14.285 -6.924 7.438 205 HD13 LEU 25 3HD1 LEU 25 14.615 -7.652 5.846 206 HD21 LEU 25 3HD2 LEU 25 16.652 -9.092 5.525 207 HD22 LEU 25 1HD2 LEU 25 17.732 -9.397 6.901 208 HD23 LEU 25 2HD2 LEU 25 16.089 -10.083 6.889 209 H VAL 26 H VAL 26 18.581 -5.347 9.260 210 HA VAL 26 HA VAL 26 17.109 -6.602 11.392 211 HB VAL 26 HB VAL 26 19.004 -6.204 12.801 212 HG11 VAL 26 1HG1 VAL 26 19.140 -8.052 11.189 213 HG12 VAL 26 2HG1 VAL 26 19.917 -6.971 10.002 214 HG13 VAL 26 3HG1 VAL 26 20.742 -7.356 11.520 215 HG21 VAL 26 3HG2 VAL 26 20.103 -4.441 10.587 216 HG22 VAL 26 1HG2 VAL 26 19.567 -3.927 12.213 217 HG23 VAL 26 2HG2 VAL 26 20.986 -4.972 12.040 218 H VAL 27 H VAL 27 17.492 -3.175 10.458 219 HA VAL 27 HA VAL 27 16.844 -2.168 13.071 220 HB VAL 27 HB VAL 27 16.215 -0.081 11.887 221 HG11 VAL 27 1HG1 VAL 27 18.555 -0.494 12.480 222 HG12 VAL 27 2HG1 VAL 27 18.799 -1.381 10.954 223 HG13 VAL 27 3HG1 VAL 27 18.437 0.356 10.916 224 HG21 VAL 27 3HG2 VAL 27 16.555 0.097 9.472 225 HG22 VAL 27 1HG2 VAL 27 16.938 -1.635 9.380 226 HG23 VAL 27 2HG2 VAL 27 15.282 -1.103 9.813 227 H ARG 28 H ARG 28 14.843 -3.523 10.482 228 HA ARG 28 HA ARG 28 12.344 -2.483 11.491 229 HB2 ARG 28 2HB ARG 28 12.774 -5.060 9.931 230 HB3 ARG 28 3HB ARG 28 11.329 -4.037 9.972 231 HG2 ARG 28 2HG ARG 28 12.673 -2.221 8.833 232 HG3 ARG 28 3HG ARG 28 14.038 -3.350 8.761 233 HD2 ARG 28 2HD ARG 28 12.951 -3.425 6.639 234 HD3 ARG 28 3HD ARG 28 12.636 -4.955 7.476 235 HE ARG 28 HE ARG 28 10.430 -3.555 8.152 236 HH11 ARG 28 1HH1 ARG 28 12.030 -3.939 5.017 237 HH12 ARG 28 2HH1 ARG 28 10.543 -3.761 4.113 238 HH21 ARG 28 1HH2 ARG 28 8.514 -3.320 6.934 239 HH22 ARG 28 2HH2 ARG 28 8.565 -3.424 5.191 240 H TYR 29 H TYR 29 14.384 -5.261 12.184 241 HA TYR 29 HA TYR 29 12.336 -6.362 14.022 242 HB2 TYR 29 2HB TYR 29 14.877 -7.496 12.824 243 HB3 TYR 29 3HB TYR 29 13.912 -8.325 14.050 244 HD1 TYR 29 HD2 TYR 29 13.833 -6.978 10.574 245 HD2 TYR 29 HD1 TYR 29 11.903 -9.439 13.512 246 HE1 TYR 29 HE2 TYR 29 12.273 -7.791 8.837 247 HE2 TYR 29 HE1 TYR 29 10.351 -10.301 11.790 248 HH TYR 29 HH TYR 29 9.715 -10.216 9.574 249 H GLN 30 H GLN 30 15.004 -4.281 14.172 250 HA GLN 30 HA GLN 30 16.346 -5.174 16.499 251 HB2 GLN 30 2HB GLN 30 17.128 -3.511 14.827 252 HB3 GLN 30 3HB GLN 30 15.934 -2.352 15.429 253 HG2 GLN 30 2HG GLN 30 17.054 -2.344 17.627 254 HG3 GLN 30 3HG GLN 30 18.197 -3.579 17.056 255 HE21 GLN 30 2HE2 GLN 30 19.198 -2.940 14.771 256 HE22 GLN 30 1HE2 GLN 30 19.792 -1.297 14.653 257 H HIS 31 H HIS 31 13.314 -3.383 16.047 258 HA HIS 31 HA HIS 31 13.062 -2.861 18.933 259 HB2 HIS 31 2HB HIS 31 12.213 -1.283 17.225 260 HB3 HIS 31 3HB HIS 31 11.103 -2.538 16.635 261 HD2 HIS 31 HD2 HIS 31 8.777 -2.667 17.770 262 HE1 HIS 31 HE1 HIS 31 9.520 -0.250 21.188 263 HE2 HIS 31 HE2 HIS 31 7.738 -1.523 19.887 264 H LYS 32 H LYS 32 12.053 -5.291 16.554 265 HA LYS 32 HA LYS 32 9.952 -6.378 18.234 266 HB2 LYS 32 2HB LYS 32 11.358 -7.546 15.803 267 HB3 LYS 32 3HB LYS 32 9.850 -8.141 16.524 268 HG2 LYS 32 2HG LYS 32 8.765 -5.955 16.057 269 HG3 LYS 32 3HG LYS 32 10.267 -5.382 15.299 270 HD2 LYS 32 2HD LYS 32 10.146 -7.228 13.654 271 HD3 LYS 32 3HD LYS 32 8.632 -7.793 14.402 272 HE2 LYS 32 2HE LYS 32 7.582 -5.609 13.902 273 HE3 LYS 32 3HE LYS 32 9.084 -5.055 13.143 274 HZ1 LYS 32 3HZ LYS 32 7.517 -5.864 11.523 275 HZ2 LYS 32 1HZ LYS 32 8.852 -6.823 11.537 276 HZ3 LYS 32 2HZ LYS 32 7.458 -7.338 12.245 277 H VAL 33 H VAL 33 13.367 -7.329 17.525 278 HA VAL 33 HA VAL 33 13.052 -9.711 19.171 279 HB VAL 33 HB VAL 33 15.317 -10.213 18.676 280 HG11 VAL 33 1HG1 VAL 33 13.646 -10.614 16.907 281 HG12 VAL 33 2HG1 VAL 33 13.998 -9.021 16.202 282 HG13 VAL 33 3HG1 VAL 33 15.255 -10.274 16.228 283 HG21 VAL 33 3HG2 VAL 33 15.574 -7.418 17.500 284 HG22 VAL 33 1HG2 VAL 33 16.379 -8.051 18.956 285 HG23 VAL 33 2HG2 VAL 33 16.774 -8.727 17.364 286 H ALA 34 H ALA 34 14.156 -6.383 19.657 287 HA ALA 34 HA ALA 34 15.540 -6.943 22.126 288 HB1 ALA 34 1HB ALA 34 14.269 -4.371 21.113 289 HB2 ALA 34 2HB ALA 34 15.426 -4.512 22.461 290 HB3 ALA 34 3HB ALA 34 15.939 -4.902 20.811 291 H SER 35 H SER 35 12.170 -6.657 21.208 292 HA SER 35 HA SER 35 11.184 -6.022 23.866 293 HB2 SER 35 2HB SER 35 9.976 -5.492 21.755 294 HB3 SER 35 3HB SER 35 9.781 -7.232 21.451 295 HG SER 35 HG SER 35 7.966 -6.278 22.512 296 H LEU 36 H LEU 36 11.604 -8.990 21.897 297 HA LEU 36 HA LEU 36 10.410 -10.604 24.027 298 HB2 LEU 36 2HB LEU 36 10.650 -12.468 22.527 299 HB3 LEU 36 3HB LEU 36 9.974 -11.076 21.675 300 HG LEU 36 HG LEU 36 12.460 -10.627 20.956 301 HD11 LEU 36 1HD1 LEU 36 13.550 -12.418 22.322 302 HD12 LEU 36 2HD1 LEU 36 12.526 -13.629 21.528 303 HD13 LEU 36 3HD1 LEU 36 13.736 -12.723 20.590 304 HD21 LEU 36 3HD2 LEU 36 12.091 -12.081 18.987 305 HD22 LEU 36 1HD2 LEU 36 10.820 -12.954 19.880 306 HD23 LEU 36 2HD2 LEU 36 10.602 -11.233 19.462 307 H VAL 37 H VAL 37 13.666 -9.638 23.082 308 HA VAL 37 HA VAL 37 14.792 -11.854 24.639 309 HB VAL 37 HB VAL 37 15.717 -10.982 22.437 310 HG11 VAL 37 1HG1 VAL 37 15.742 -8.549 23.307 311 HG12 VAL 37 2HG1 VAL 37 17.224 -9.027 24.176 312 HG13 VAL 37 3HG1 VAL 37 17.169 -9.147 22.409 313 HG21 VAL 37 3HG2 VAL 37 18.006 -11.522 23.101 314 HG22 VAL 37 1HG2 VAL 37 17.605 -11.238 24.809 315 HG23 VAL 37 2HG2 VAL 37 16.855 -12.594 23.933 316 H SER 38 H SER 38 13.866 -8.531 25.180 317 HA SER 38 HA SER 38 15.505 -8.098 27.507 318 HB2 SER 38 2HB SER 38 14.308 -6.291 26.259 319 HB3 SER 38 3HB SER 38 12.764 -6.958 26.821 320 HG SER 38 HG SER 38 13.527 -6.607 28.973 321 H ARG 39 H ARG 39 13.027 -10.313 26.842 322 HA ARG 39 HA ARG 39 12.054 -10.525 29.610 323 HB2 ARG 39 2HB ARG 39 11.393 -12.248 27.209 324 HB3 ARG 39 3HB ARG 39 10.486 -12.124 28.726 325 HG2 ARG 39 2HG ARG 39 9.988 -9.740 28.228 326 HG3 ARG 39 3HG ARG 39 10.918 -9.860 26.720 327 HD2 ARG 39 2HD ARG 39 9.365 -11.728 26.011 328 HD3 ARG 39 3HD ARG 39 8.342 -11.304 27.399 329 HE ARG 39 HE ARG 39 9.050 -9.034 25.695 330 HH11 ARG 39 1HH1 ARG 39 6.751 -11.677 26.149 331 HH12 ARG 39 2HH1 ARG 39 5.497 -10.909 25.199 332 HH21 ARG 39 1HH2 ARG 39 7.403 -8.042 24.491 333 HH22 ARG 39 2HH2 ARG 39 5.861 -8.835 24.281 334 H TYR 40 H TYR 40 14.781 -11.556 27.949 335 HA TYR 40 HA TYR 40 15.032 -13.966 29.700 336 HB2 TYR 40 2HB TYR 40 16.142 -13.485 26.915 337 HB3 TYR 40 3HB TYR 40 16.552 -14.856 27.947 338 HD1 TYR 40 HD2 TYR 40 14.828 -16.563 28.534 339 HD2 TYR 40 HD1 TYR 40 14.093 -13.451 25.659 340 HE1 TYR 40 HE2 TYR 40 12.853 -17.813 27.683 341 HE2 TYR 40 HE1 TYR 40 12.153 -14.706 24.779 342 HH TYR 40 HH TYR 40 10.836 -16.578 24.999 343 H VAL 41 H VAL 41 16.359 -10.871 28.771 344 HA VAL 41 HA VAL 41 18.456 -11.262 30.818 345 HB VAL 41 HB VAL 41 20.051 -9.931 29.365 346 HG11 VAL 41 1HG1 VAL 41 19.303 -12.705 28.364 347 HG12 VAL 41 2HG1 VAL 41 20.866 -11.885 28.148 348 HG13 VAL 41 3HG1 VAL 41 20.328 -12.354 29.772 349 HG21 VAL 41 3HG2 VAL 41 18.225 -10.834 27.110 350 HG22 VAL 41 1HG2 VAL 41 18.385 -9.154 27.688 351 HG23 VAL 41 2HG2 VAL 41 19.775 -9.981 26.957 352 HA PRO 42 HA PRO 42 16.974 -7.380 32.176 353 HB2 PRO 42 2HB PRO 42 19.138 -6.257 33.397 354 HB3 PRO 42 3HB PRO 42 18.336 -7.730 34.027 355 HG2 PRO 42 2HG PRO 42 20.771 -7.588 32.220 356 HG3 PRO 42 3HG PRO 42 20.607 -8.485 33.771 357 HD2 PRO 42 2HD PRO 42 20.224 -9.722 31.394 358 HD3 PRO 42 3HD PRO 42 19.137 -10.076 32.778 359 H SER 43 H SER 43 17.298 -4.975 31.999 360 HA SER 43 HA SER 43 17.611 -4.306 29.259 361 HB2 SER 43 2HB SER 43 17.485 -2.490 31.697 362 HB3 SER 43 3HB SER 43 17.162 -2.018 30.016 363 HG SER 43 HG SER 43 15.244 -2.502 31.152 364 H GLY 44 H GLY 44 20.042 -4.673 31.664 365 HA2 GLY 44 2HA GLY 44 21.843 -2.662 30.498 366 HA3 GLY 44 3HA GLY 44 22.177 -3.764 31.851 367 H ASP 45 H ASP 45 21.030 -6.016 30.001 368 HA ASP 45 HA ASP 45 23.543 -6.417 28.442 369 HB2 ASP 45 2HB ASP 45 21.781 -8.381 29.933 370 HB3 ASP 45 3HB ASP 45 23.091 -8.846 28.832 371 H VAL 46 H VAL 46 20.233 -5.798 28.130 372 HA VAL 46 HA VAL 46 19.586 -7.678 26.080 373 HB VAL 46 HB VAL 46 17.965 -6.466 27.542 374 HG11 VAL 46 1HG1 VAL 46 18.372 -4.182 25.566 375 HG12 VAL 46 2HG1 VAL 46 17.097 -4.316 26.797 376 HG13 VAL 46 3HG1 VAL 46 18.792 -4.149 27.303 377 HG21 VAL 46 3HG2 VAL 46 17.563 -6.402 24.538 378 HG22 VAL 46 1HG2 VAL 46 17.203 -7.734 25.682 379 HG23 VAL 46 2HG2 VAL 46 16.273 -6.226 25.742 380 HA PRO 47 HA PRO 47 20.546 -4.267 22.954 381 HB2 PRO 47 2HB PRO 47 22.556 -2.480 23.320 382 HB3 PRO 47 3HB PRO 47 20.930 -2.226 24.038 383 HG2 PRO 47 2HG PRO 47 23.385 -3.422 25.369 384 HG3 PRO 47 3HG PRO 47 22.341 -2.094 25.972 385 HD2 PRO 47 2HD PRO 47 22.013 -4.682 26.746 386 HD3 PRO 47 3HD PRO 47 20.609 -3.591 26.530 387 H ASP 48 H ASP 48 23.132 -5.788 24.840 388 HA ASP 48 HA ASP 48 24.950 -5.933 22.557 389 HB2 ASP 48 2HB ASP 48 25.710 -5.692 24.919 390 HB3 ASP 48 3HB ASP 48 25.041 -7.299 25.271 391 H VAL 49 H VAL 49 22.517 -7.968 24.140 392 HA VAL 49 HA VAL 49 23.299 -10.372 22.700 393 HB VAL 49 HB VAL 49 20.865 -9.607 24.353 394 HG11 VAL 49 1HG1 VAL 49 20.343 -12.030 24.380 395 HG12 VAL 49 2HG1 VAL 49 20.207 -11.354 22.744 396 HG13 VAL 49 3HG1 VAL 49 21.636 -12.320 23.191 397 HG21 VAL 49 3HG2 VAL 49 23.238 -11.448 24.896 398 HG22 VAL 49 1HG2 VAL 49 23.012 -9.829 25.589 399 HG23 VAL 49 2HG2 VAL 49 21.883 -11.135 26.006 400 H VAL 50 H VAL 50 21.156 -7.608 22.117 401 HA VAL 50 HA VAL 50 19.766 -8.849 19.893 402 HB VAL 50 HB VAL 50 20.186 -5.971 20.790 403 HG11 VAL 50 1HG1 VAL 50 19.916 -5.930 18.341 404 HG12 VAL 50 2HG1 VAL 50 18.516 -7.022 18.462 405 HG13 VAL 50 3HG1 VAL 50 18.428 -5.377 19.128 406 HG21 VAL 50 3HG2 VAL 50 18.690 -7.490 22.139 407 HG22 VAL 50 1HG2 VAL 50 17.830 -6.125 21.405 408 HG23 VAL 50 2HG2 VAL 50 17.715 -7.749 20.676 409 H GLN 51 H GLN 51 22.783 -6.963 20.301 410 HA GLN 51 HA GLN 51 23.234 -6.720 17.453 411 HB2 GLN 51 2HB GLN 51 24.225 -5.186 19.103 412 HB3 GLN 51 3HB GLN 51 25.139 -6.535 19.817 413 HG2 GLN 51 2HG GLN 51 26.368 -6.859 17.743 414 HG3 GLN 51 3HG GLN 51 25.372 -5.656 16.912 415 HE21 GLN 51 2HE2 GLN 51 27.886 -5.083 16.592 416 HE22 GLN 51 1HE2 GLN 51 28.472 -3.859 17.694 417 H GLU 52 H GLU 52 24.331 -9.048 19.998 418 HA GLU 52 HA GLU 52 25.973 -10.519 18.156 419 HB2 GLU 52 2HB GLU 52 26.171 -10.620 20.636 420 HB3 GLU 52 3HB GLU 52 24.616 -11.476 20.713 421 HG2 GLU 52 2HG GLU 52 25.509 -13.317 19.368 422 HG3 GLU 52 3HG GLU 52 27.033 -12.443 19.134 423 H ALA 53 H ALA 53 22.494 -10.515 18.857 424 HA ALA 53 HA ALA 53 21.982 -13.054 17.594 425 HB1 ALA 53 1HB ALA 53 20.152 -10.679 18.128 426 HB2 ALA 53 2HB ALA 53 19.634 -12.317 17.664 427 HB3 ALA 53 3HB ALA 53 20.439 -12.047 19.223 428 H PHE 54 H PHE 54 22.371 -9.712 16.402 429 HA PHE 54 HA PHE 54 21.334 -10.466 13.752 430 HB2 PHE 54 2HB PHE 54 22.602 -7.940 14.857 431 HB3 PHE 54 3HB PHE 54 22.087 -8.124 13.188 432 HD1 PHE 54 HD1 PHE 54 19.510 -9.737 13.706 433 HD2 PHE 54 HD2 PHE 54 21.126 -6.194 15.541 434 HE1 PHE 54 HE1 PHE 54 17.232 -9.002 14.306 435 HE2 PHE 54 HE2 PHE 54 18.830 -5.435 16.083 436 HZ PHE 54 HZ PHE 54 16.883 -6.851 15.481 437 H ILE 55 H ILE 55 24.500 -10.155 15.363 438 HA ILE 55 HA ILE 55 25.997 -10.398 12.886 439 HB ILE 55 HB ILE 55 26.707 -10.982 15.788 440 HG12 ILE 55 2HG1 ILE 55 27.393 -8.581 14.025 441 HG13 ILE 55 3HG1 ILE 55 26.094 -8.596 15.210 442 HG21 ILE 55 1HG2 ILE 55 29.063 -10.931 15.033 443 HG22 ILE 55 2HG2 ILE 55 28.174 -12.215 14.209 444 HG23 ILE 55 3HG2 ILE 55 28.519 -10.694 13.352 445 HD11 ILE 55 3HD1 ILE 55 27.760 -9.101 17.008 446 HD12 ILE 55 1HD1 ILE 55 29.063 -8.964 15.800 447 HD13 ILE 55 2HD1 ILE 55 28.061 -7.556 16.190 448 H LYS 56 H LYS 56 24.623 -12.626 15.307 449 HA LYS 56 HA LYS 56 25.788 -15.003 14.131 450 HB2 LYS 56 2HB LYS 56 25.214 -14.738 16.523 451 HB3 LYS 56 3HB LYS 56 23.498 -14.590 16.100 452 HG2 LYS 56 2HG LYS 56 23.560 -16.898 15.145 453 HG3 LYS 56 3HG LYS 56 25.269 -17.026 15.608 454 HD2 LYS 56 2HD LYS 56 22.937 -16.529 17.503 455 HD3 LYS 56 3HD LYS 56 23.751 -18.092 17.269 456 HE2 LYS 56 2HE LYS 56 25.883 -17.111 18.052 457 HE3 LYS 56 3HE LYS 56 25.082 -15.537 18.269 458 HZ1 LYS 56 3HZ LYS 56 23.641 -16.563 19.872 459 HZ2 LYS 56 1HZ LYS 56 24.405 -18.011 19.706 460 HZ3 LYS 56 2HZ LYS 56 25.221 -16.716 20.316 461 H ALA 57 H ALA 57 22.726 -13.188 13.770 462 HA ALA 57 HA ALA 57 21.354 -15.304 12.387 463 HB1 ALA 57 1HB ALA 57 20.938 -12.289 12.372 464 HB2 ALA 57 2HB ALA 57 19.822 -13.484 11.676 465 HB3 ALA 57 3HB ALA 57 20.115 -13.477 13.422 466 H TYR 58 H TYR 58 23.379 -12.516 11.277 467 HA TYR 58 HA TYR 58 22.794 -12.831 8.522 468 HB2 TYR 58 2HB TYR 58 23.917 -10.882 9.613 469 HB3 TYR 58 3HB TYR 58 25.356 -11.877 9.855 470 HD1 TYR 58 HD2 TYR 58 23.006 -10.921 7.069 471 HD2 TYR 58 HD1 TYR 58 27.057 -11.691 8.294 472 HE1 TYR 58 HE2 TYR 58 23.803 -10.260 4.822 473 HE2 TYR 58 HE1 TYR 58 27.864 -11.069 6.034 474 HH TYR 58 HH TYR 58 27.275 -10.352 3.925 475 H ARG 59 H ARG 59 25.253 -14.362 10.603 476 HA ARG 59 HA ARG 59 26.661 -15.679 8.448 477 HB2 ARG 59 2HB ARG 59 26.528 -16.149 11.453 478 HB3 ARG 59 3HB ARG 59 27.669 -16.956 10.355 479 HG2 ARG 59 2HG ARG 59 28.700 -14.853 9.758 480 HG3 ARG 59 3HG ARG 59 27.458 -13.918 10.616 481 HD2 ARG 59 2HD ARG 59 28.139 -14.848 12.753 482 HD3 ARG 59 3HD ARG 59 29.275 -15.941 11.956 483 HE ARG 59 HE ARG 59 29.602 -13.045 12.445 484 HH11 ARG 59 1HH1 ARG 59 30.822 -15.914 10.771 485 HH12 ARG 59 2HH1 ARG 59 32.406 -15.224 10.502 486 HH21 ARG 59 1HH2 ARG 59 31.672 -12.173 12.080 487 HH22 ARG 59 2HH2 ARG 59 32.882 -13.106 11.235 488 H ALA 60 H ALA 60 23.824 -16.437 10.366 489 HA ALA 60 HA ALA 60 23.736 -19.203 9.330 490 HB1 ALA 60 1HB ALA 60 21.872 -17.694 11.202 491 HB2 ALA 60 2HB ALA 60 21.814 -19.435 10.828 492 HB3 ALA 60 3HB ALA 60 23.209 -18.762 11.698 493 H LEU 61 H LEU 61 22.717 -16.081 8.339 494 HA LEU 61 HA LEU 61 20.153 -16.818 7.239 495 HB2 LEU 61 2HB LEU 61 20.935 -14.506 7.992 496 HB3 LEU 61 3HB LEU 61 21.948 -14.461 6.536 497 HG LEU 61 HG LEU 61 19.848 -14.785 5.165 498 HD11 LEU 61 1HD1 LEU 61 18.574 -14.400 7.906 499 HD12 LEU 61 2HD1 LEU 61 17.694 -14.283 6.362 500 HD13 LEU 61 3HD1 LEU 61 18.396 -15.834 6.863 501 HD21 LEU 61 3HD2 LEU 61 19.870 -12.433 7.110 502 HD22 LEU 61 1HD2 LEU 61 20.832 -12.567 5.616 503 HD23 LEU 61 2HD2 LEU 61 19.049 -12.478 5.535 504 H ASP 62 H ASP 62 23.503 -16.880 6.146 505 HA ASP 62 HA ASP 62 22.940 -17.236 3.351 506 HB2 ASP 62 2HB ASP 62 25.128 -16.530 4.313 507 HB3 ASP 62 3HB ASP 62 25.314 -18.135 5.031 508 H SER 63 H SER 63 22.337 -19.191 6.075 509 HA SER 63 HA SER 63 22.293 -21.679 4.442 510 HB2 SER 63 2HB SER 63 22.494 -21.292 7.454 511 HB3 SER 63 3HB SER 63 22.425 -22.851 6.606 512 HG SER 63 HG SER 63 24.570 -22.180 7.082 513 H PHE 64 H PHE 64 20.273 -19.238 5.481 514 HA PHE 64 HA PHE 64 18.052 -20.798 6.455 515 HB2 PHE 64 2HB PHE 64 18.381 -18.439 7.008 516 HB3 PHE 64 3HB PHE 64 18.238 -17.999 5.302 517 HD1 PHE 64 HD2 PHE 64 16.168 -20.242 7.533 518 HD2 PHE 64 HD1 PHE 64 16.313 -16.768 5.007 519 HE1 PHE 64 HE2 PHE 64 13.729 -19.933 7.821 520 HE2 PHE 64 HE1 PHE 64 13.863 -16.450 5.311 521 HZ PHE 64 HZ PHE 64 12.577 -18.044 6.698 522 H ARG 65 H ARG 65 16.116 -21.346 5.324 523 HA ARG 65 HA ARG 65 16.504 -21.578 2.365 524 HB2 ARG 65 2HB ARG 65 15.261 -23.594 4.272 525 HB3 ARG 65 3HB ARG 65 15.423 -23.779 2.519 526 HG2 ARG 65 2HG ARG 65 17.721 -23.561 4.507 527 HG3 ARG 65 3HG ARG 65 17.163 -25.041 3.727 528 HD2 ARG 65 2HD ARG 65 18.318 -22.619 2.287 529 HD3 ARG 65 3HD ARG 65 19.172 -24.130 2.632 530 HE ARG 65 HE ARG 65 16.887 -24.911 1.255 531 HH11 ARG 65 1HH1 ARG 65 19.600 -22.743 0.609 532 HH12 ARG 65 2HH1 ARG 65 19.553 -23.003 -1.120 533 HH21 ARG 65 1HH2 ARG 65 16.824 -25.215 -1.005 534 HH22 ARG 65 2HH2 ARG 65 17.968 -24.391 -2.030 535 H GLY 66 H GLY 66 14.558 -20.161 4.715 536 HA2 GLY 66 2HA GLY 66 12.534 -19.081 4.523 537 HA3 GLY 66 3HA GLY 66 12.559 -19.411 2.790 538 H ASP 67 H ASP 67 12.859 -22.202 4.860 539 HA ASP 67 HA ASP 67 10.378 -23.317 3.939 540 HB2 ASP 67 2HB ASP 67 12.432 -24.600 4.477 541 HB3 ASP 67 3HB ASP 67 12.236 -24.188 6.188 542 H SER 68 H SER 68 11.056 -21.039 6.329 543 HA SER 68 HA SER 68 8.314 -21.231 7.394 544 HB2 SER 68 2HB SER 68 9.777 -22.462 9.000 545 HB3 SER 68 3HB SER 68 10.788 -21.011 9.158 546 HG SER 68 HG SER 68 9.161 -21.206 10.792 547 H ALA 69 H ALA 69 7.910 -19.080 8.699 548 HA ALA 69 HA ALA 69 8.592 -16.916 6.947 549 HB1 ALA 69 1HB ALA 69 6.493 -17.020 8.251 550 HB2 ALA 69 2HB ALA 69 7.421 -16.853 9.758 551 HB3 ALA 69 3HB ALA 69 7.399 -15.524 8.576 552 H PHE 70 H PHE 70 9.939 -15.098 7.277 553 HA PHE 70 HA PHE 70 12.465 -15.773 8.414 554 HB2 PHE 70 2HB PHE 70 12.251 -14.232 6.541 555 HB3 PHE 70 3HB PHE 70 11.271 -13.134 7.515 556 HD1 PHE 70 HD1 PHE 70 14.631 -14.829 7.684 557 HD2 PHE 70 HD2 PHE 70 12.324 -11.277 8.454 558 HE1 PHE 70 HE1 PHE 70 16.669 -13.670 8.479 559 HE2 PHE 70 HE2 PHE 70 14.371 -10.111 9.217 560 HZ PHE 70 HZ PHE 70 16.555 -11.311 9.233 561 H TYR 71 H TYR 71 9.671 -13.912 9.703 562 HA TYR 71 HA TYR 71 11.196 -12.740 11.827 563 HB2 TYR 71 2HB TYR 71 9.074 -12.096 12.767 564 HB3 TYR 71 3HB TYR 71 9.077 -11.800 11.031 565 HD1 TYR 71 HD2 TYR 71 7.786 -14.025 13.720 566 HD2 TYR 71 HD1 TYR 71 7.483 -12.852 9.592 567 HE1 TYR 71 HE2 TYR 71 5.666 -15.295 13.521 568 HE2 TYR 71 HE1 TYR 71 5.354 -14.114 9.388 569 HH TYR 71 HH TYR 71 3.815 -15.443 10.453 570 H THR 72 H THR 72 9.390 -15.832 11.538 571 HA THR 72 HA THR 72 9.601 -16.428 14.359 572 HB THR 72 HB THR 72 9.298 -18.319 11.982 573 HG1 THR 72 1HG THR 72 7.090 -18.111 12.461 574 HG21 THR 72 1HG2 THR 72 8.639 -18.608 14.950 575 HG22 THR 72 2HG2 THR 72 8.236 -19.794 13.680 576 HG23 THR 72 3HG2 THR 72 9.932 -19.464 14.077 577 H TRP 73 H TRP 73 11.604 -17.028 11.466 578 HA TRP 73 HA TRP 73 13.432 -18.824 12.774 579 HB2 TRP 73 2HB TRP 73 13.102 -18.811 10.364 580 HB3 TRP 73 3HB TRP 73 13.583 -17.118 10.267 581 HD1 TRP 73 HD1 TRP 73 14.988 -20.616 10.466 582 HE1 TRP 73 HE1 TRP 73 17.511 -20.586 10.097 583 HE3 TRP 73 HE3 TRP 73 15.755 -15.559 10.616 584 HZ2 TRP 73 HZ2 TRP 73 19.624 -18.609 9.939 585 HZ3 TRP 73 HZ3 TRP 73 18.036 -14.643 10.365 586 HH2 TRP 73 HH2 TRP 73 19.964 -16.149 10.035 587 H LEU 74 H LEU 74 13.246 -15.289 12.427 588 HA LEU 74 HA LEU 74 15.980 -14.887 13.333 589 HB2 LEU 74 2HB LEU 74 14.839 -13.403 11.709 590 HB3 LEU 74 3HB LEU 74 13.649 -12.974 12.939 591 HG LEU 74 HG LEU 74 15.423 -11.976 14.346 592 HD11 LEU 74 1HD1 LEU 74 17.252 -12.663 12.005 593 HD12 LEU 74 2HD1 LEU 74 17.693 -11.618 13.382 594 HD13 LEU 74 3HD1 LEU 74 17.364 -13.338 13.645 595 HD21 LEU 74 3HD2 LEU 74 15.433 -11.000 11.464 596 HD22 LEU 74 1HD2 LEU 74 14.214 -10.603 12.695 597 HD23 LEU 74 2HD2 LEU 74 15.889 -10.038 12.891 598 H TYR 75 H TYR 75 12.705 -14.808 14.801 599 HA TYR 75 HA TYR 75 13.500 -13.582 17.260 600 HB2 TYR 75 2HB TYR 75 11.305 -15.593 16.638 601 HB3 TYR 75 3HB TYR 75 11.465 -14.734 18.165 602 HD1 TYR 75 HD2 TYR 75 12.406 -12.249 15.919 603 HD2 TYR 75 HD1 TYR 75 8.953 -14.556 17.063 604 HE1 TYR 75 HE2 TYR 75 10.933 -10.452 15.091 605 HE2 TYR 75 HE1 TYR 75 7.472 -12.753 16.207 606 HH TYR 75 HH TYR 75 7.368 -10.682 15.229 607 H ARG 76 H ARG 76 13.835 -16.866 15.999 608 HA ARG 76 HA ARG 76 14.392 -18.098 18.559 609 HB2 ARG 76 2HB ARG 76 14.897 -18.943 15.681 610 HB3 ARG 76 3HB ARG 76 15.199 -19.986 17.080 611 HG2 ARG 76 2HG ARG 76 12.503 -18.725 16.480 612 HG3 ARG 76 3HG ARG 76 12.976 -20.355 15.949 613 HD2 ARG 76 2HD ARG 76 13.340 -21.013 18.311 614 HD3 ARG 76 3HD ARG 76 12.853 -19.390 18.838 615 HE ARG 76 HE ARG 76 10.763 -20.380 17.237 616 HH11 ARG 76 1HH1 ARG 76 12.333 -21.178 20.302 617 HH12 ARG 76 2HH1 ARG 76 10.886 -21.877 20.997 618 HH21 ARG 76 1HH2 ARG 76 8.896 -21.307 18.164 619 HH22 ARG 76 2HH2 ARG 76 8.952 -21.951 19.786 620 H ILE 77 H ILE 77 16.324 -16.308 16.207 621 HA ILE 77 HA ILE 77 18.857 -17.367 17.138 622 HB ILE 77 HB ILE 77 18.335 -14.669 15.839 623 HG12 ILE 77 2HG1 ILE 77 17.371 -16.339 14.364 624 HG13 ILE 77 3HG1 ILE 77 18.867 -15.719 13.685 625 HG21 ILE 77 1HG2 ILE 77 20.792 -16.461 16.035 626 HG22 ILE 77 2HG2 ILE 77 20.692 -14.982 15.055 627 HG23 ILE 77 3HG2 ILE 77 20.548 -14.887 16.820 628 HD11 ILE 77 3HD1 ILE 77 18.707 -18.143 13.380 629 HD12 ILE 77 1HD1 ILE 77 20.076 -17.750 14.439 630 HD13 ILE 77 2HD1 ILE 77 18.558 -18.381 15.133 631 H ALA 78 H ALA 78 16.752 -14.626 18.069 632 HA ALA 78 HA ALA 78 18.793 -13.422 19.719 633 HB1 ALA 78 1HB ALA 78 15.793 -12.959 19.538 634 HB2 ALA 78 2HB ALA 78 16.956 -11.891 20.369 635 HB3 ALA 78 3HB ALA 78 17.050 -12.108 18.610 636 H VAL 79 H VAL 79 16.041 -15.648 20.377 637 HA VAL 79 HA VAL 79 16.348 -15.294 23.248 638 HB VAL 79 HB VAL 79 14.175 -15.773 22.281 639 HG11 VAL 79 1HG1 VAL 79 15.301 -18.510 21.565 640 HG12 VAL 79 2HG1 VAL 79 13.620 -17.965 21.362 641 HG13 VAL 79 3HG1 VAL 79 14.913 -17.217 20.401 642 HG21 VAL 79 3HG2 VAL 79 15.146 -18.134 23.938 643 HG22 VAL 79 1HG2 VAL 79 14.737 -16.537 24.605 644 HG23 VAL 79 2HG2 VAL 79 13.483 -17.526 23.817 645 H ASN 80 H ASN 80 17.613 -17.576 20.815 646 HA ASN 80 HA ASN 80 18.592 -19.410 22.852 647 HB2 ASN 80 2HB ASN 80 19.171 -19.098 19.877 648 HB3 ASN 80 3HB ASN 80 19.865 -20.371 20.889 649 HD21 ASN 80 2HD2 ASN 80 18.498 -21.279 18.800 650 HD22 ASN 80 1HD2 ASN 80 16.933 -21.905 19.282 651 H THR 81 H THR 81 19.760 -16.444 21.341 652 HA THR 81 HA THR 81 22.520 -16.871 22.170 653 HB THR 81 HB THR 81 21.035 -14.376 21.230 654 HG1 THR 81 1HG THR 81 21.170 -15.840 19.605 655 HG21 THR 81 1HG2 THR 81 24.016 -14.940 21.558 656 HG22 THR 81 2HG2 THR 81 23.313 -13.505 20.776 657 HG23 THR 81 3HG2 THR 81 23.076 -13.777 22.514 658 H ALA 82 H ALA 82 19.581 -15.457 23.577 659 HA ALA 82 HA ALA 82 20.963 -14.041 25.689 660 HB1 ALA 82 1HB ALA 82 18.686 -13.839 26.629 661 HB2 ALA 82 2HB ALA 82 18.690 -13.471 24.885 662 HB3 ALA 82 3HB ALA 82 18.091 -15.042 25.470 663 H LYS 83 H LYS 83 19.666 -17.340 25.293 664 HA LYS 83 HA LYS 83 20.043 -18.010 28.097 665 HB2 LYS 83 2HB LYS 83 19.592 -19.697 25.602 666 HB3 LYS 83 3HB LYS 83 19.611 -20.333 27.262 667 HG2 LYS 83 2HG LYS 83 17.720 -18.906 27.887 668 HG3 LYS 83 3HG LYS 83 17.742 -18.126 26.296 669 HD2 LYS 83 2HD LYS 83 17.265 -20.314 25.223 670 HD3 LYS 83 3HD LYS 83 17.166 -21.064 26.837 671 HE2 LYS 83 2HE LYS 83 15.338 -19.508 27.436 672 HE3 LYS 83 3HE LYS 83 15.437 -18.763 25.835 673 HZ1 LYS 83 3HZ LYS 83 14.844 -20.885 24.877 674 HZ2 LYS 83 1HZ LYS 83 14.760 -21.585 26.357 675 HZ3 LYS 83 2HZ LYS 83 13.693 -20.403 25.950 676 H ASN 84 H ASN 84 21.996 -18.137 25.141 677 HA ASN 84 HA ASN 84 24.079 -19.756 26.370 678 HB2 ASN 84 2HB ASN 84 23.554 -19.678 23.906 679 HB3 ASN 84 3HB ASN 84 24.174 -18.021 23.878 680 HD21 ASN 84 2HD2 ASN 84 25.812 -18.661 22.369 681 HD22 ASN 84 1HD2 ASN 84 27.210 -19.583 22.894 682 H TYR 85 H TYR 85 23.232 -16.347 26.202 683 HA TYR 85 HA TYR 85 25.871 -15.314 26.766 684 HB2 TYR 85 2HB TYR 85 24.067 -14.069 25.621 685 HB3 TYR 85 3HB TYR 85 23.092 -14.128 27.093 686 HD1 TYR 85 HD2 TYR 85 26.167 -12.739 25.548 687 HD2 TYR 85 HD1 TYR 85 23.465 -12.585 28.890 688 HE1 TYR 85 HE2 TYR 85 27.207 -10.608 26.280 689 HE2 TYR 85 HE1 TYR 85 24.503 -10.459 29.634 690 HH TYR 85 HH TYR 85 26.063 -8.834 29.175 691 H LEU 86 H LEU 86 23.049 -16.308 28.717 692 HA LEU 86 HA LEU 86 24.164 -15.214 31.170 693 HB2 LEU 86 2HB LEU 86 21.831 -17.067 30.578 694 HB3 LEU 86 3HB LEU 86 22.256 -16.516 32.210 695 HG LEU 86 HG LEU 86 21.516 -14.682 29.894 696 HD11 LEU 86 1HD1 LEU 86 19.474 -14.307 31.264 697 HD12 LEU 86 2HD1 LEU 86 19.614 -16.001 30.747 698 HD13 LEU 86 3HD1 LEU 86 20.022 -15.544 32.416 699 HD21 LEU 86 3HD2 LEU 86 21.399 -12.954 31.696 700 HD22 LEU 86 1HD2 LEU 86 22.097 -14.119 32.836 701 HD23 LEU 86 2HD2 LEU 86 23.047 -13.549 31.440 702 H VAL 87 H VAL 87 24.445 -18.353 29.503 703 HA VAL 87 HA VAL 87 25.612 -19.525 31.940 704 HB VAL 87 HB VAL 87 26.003 -21.510 30.553 705 HG11 VAL 87 1HG1 VAL 87 23.178 -20.371 30.356 706 HG12 VAL 87 2HG1 VAL 87 23.625 -22.090 30.262 707 HG13 VAL 87 3HG1 VAL 87 23.880 -21.192 31.770 708 HG21 VAL 87 3HG2 VAL 87 25.058 -21.626 28.276 709 HG22 VAL 87 1HG2 VAL 87 24.679 -19.889 28.349 710 HG23 VAL 87 2HG2 VAL 87 26.372 -20.438 28.373 711 H ALA 88 H ALA 88 26.694 -17.695 29.182 712 HA ALA 88 HA ALA 88 29.433 -18.634 29.305 713 HB1 ALA 88 1HB ALA 88 28.220 -16.113 28.097 714 HB2 ALA 88 2HB ALA 88 29.862 -16.727 27.791 715 HB3 ALA 88 3HB ALA 88 28.454 -17.664 27.255 716 H GLN 89 H GLN 89 27.539 -16.573 31.287 717 HA GLN 89 HA GLN 89 30.033 -15.529 32.555 718 HB2 GLN 89 2HB GLN 89 28.724 -13.640 33.341 719 HB3 GLN 89 3HB GLN 89 28.592 -13.786 31.576 720 HG2 GLN 89 2HG GLN 89 26.406 -14.994 31.903 721 HG3 GLN 89 3HG GLN 89 26.522 -14.647 33.642 722 HE21 GLN 89 2HE2 GLN 89 26.164 -13.245 30.394 723 HE22 GLN 89 1HE2 GLN 89 25.557 -11.691 30.927 724 H GLY 90 H GLY 90 27.211 -17.534 32.925 725 HA2 GLY 90 2HA GLY 90 27.242 -17.464 35.841 726 HA3 GLY 90 3HA GLY 90 26.297 -18.542 34.791 727 H ARG 91 H ARG 91 28.901 -19.209 33.291 728 HA ARG 91 HA ARG 91 29.802 -21.350 35.093 729 HB2 ARG 91 2HB ARG 91 30.311 -20.741 32.164 730 HB3 ARG 91 3HB ARG 91 31.036 -22.108 33.036 731 HG2 ARG 91 2HG ARG 91 28.813 -22.999 33.574 732 HG3 ARG 91 3HG ARG 91 28.038 -21.613 32.786 733 HD2 ARG 91 2HD ARG 91 28.036 -23.532 31.270 734 HD3 ARG 91 3HD ARG 91 29.063 -22.244 30.631 735 HE ARG 91 HE ARG 91 30.954 -23.570 30.934 736 HH11 ARG 91 1HH1 ARG 91 28.158 -25.119 32.449 737 HH12 ARG 91 2HH1 ARG 91 28.983 -26.644 32.676 738 HH21 ARG 91 1HH2 ARG 91 31.997 -25.568 31.240 739 HH22 ARG 91 2HH2 ARG 91 31.147 -26.895 31.994 740 H ARG 92 H ARG 92 30.544 -18.228 35.009 741 HA ARG 92 HA ARG 92 33.488 -18.502 35.063 742 HB2 ARG 92 2HB ARG 92 32.353 -16.631 33.876 743 HB3 ARG 92 3HB ARG 92 31.668 -16.090 35.417 744 HG2 ARG 92 2HG ARG 92 33.933 -15.659 36.298 745 HG3 ARG 92 3HG ARG 92 34.648 -16.333 34.819 746 HD2 ARG 92 2HD ARG 92 34.645 -13.885 34.726 747 HD3 ARG 92 3HD ARG 92 33.568 -14.553 33.485 748 HE ARG 92 HE ARG 92 32.140 -13.977 35.929 749 HH11 ARG 92 1HH1 ARG 92 33.505 -12.459 33.044 750 HH12 ARG 92 2HH1 ARG 92 32.398 -11.105 33.091 751 HH21 ARG 92 1HH2 ARG 92 30.706 -12.202 35.963 752 HH22 ARG 92 2HH2 ARG 92 30.812 -10.970 34.728 753 H LEU 93 H LEU 93 30.812 -18.717 37.185 754 HA LEU 93 HA LEU 93 32.583 -18.327 39.556 755 HB2 LEU 93 2HB LEU 93 29.639 -17.617 39.254 756 HB3 LEU 93 3HB LEU 93 30.561 -17.519 40.760 757 HG LEU 93 HG LEU 93 31.184 -15.931 38.233 758 HD11 LEU 93 1HD1 LEU 93 29.897 -15.097 40.863 759 HD12 LEU 93 2HD1 LEU 93 30.319 -14.017 39.514 760 HD13 LEU 93 3HD1 LEU 93 29.064 -15.259 39.300 761 HD21 LEU 93 3HD2 LEU 93 32.303 -15.762 41.066 762 HD22 LEU 93 1HD2 LEU 93 33.191 -16.323 39.629 763 HD23 LEU 93 2HD2 LEU 93 32.668 -14.636 39.736 764 H GLU 94 H GLU 94 31.153 -20.623 37.731 765 HA GLU 94 HA GLU 94 30.790 -22.432 40.053 766 HB2 GLU 94 2HB GLU 94 28.924 -22.135 37.664 767 HB3 GLU 94 3HB GLU 94 28.874 -23.480 38.807 768 HG2 GLU 94 2HG GLU 94 28.457 -20.548 39.529 769 HG3 GLU 94 3HG GLU 94 27.173 -21.738 39.294 770 H LEU 95 H LEU 95 31.352 -24.559 39.621 771 HA LEU 95 HA LEU 95 32.727 -26.144 38.839 772 HB2 LEU 95 2HB LEU 95 30.822 -26.228 37.233 773 HB3 LEU 95 3HB LEU 95 31.759 -25.249 36.104 774 HG LEU 95 HG LEU 95 33.437 -27.033 35.889 775 HD11 LEU 95 1HD1 LEU 95 31.680 -28.538 37.880 776 HD12 LEU 95 2HD1 LEU 95 33.013 -29.251 36.945 777 HD13 LEU 95 3HD1 LEU 95 33.358 -28.004 38.156 778 HD21 LEU 95 3HD2 LEU 95 30.584 -28.059 35.660 779 HD22 LEU 95 1HD2 LEU 95 31.432 -27.056 34.459 780 HD23 LEU 95 2HD2 LEU 95 32.003 -28.703 34.806 781 H VAL 96 H VAL 96 33.634 -23.108 38.758 782 HA VAL 96 HA VAL 96 36.334 -23.721 37.708 783 HB VAL 96 HB VAL 96 34.704 -21.239 37.027 784 HG11 VAL 96 1HG1 VAL 96 37.547 -22.004 36.232 785 HG12 VAL 96 2HG1 VAL 96 36.650 -20.582 35.666 786 HG13 VAL 96 3HG1 VAL 96 37.105 -20.712 37.375 787 HG21 VAL 96 3HG2 VAL 96 35.772 -23.485 35.266 788 HG22 VAL 96 1HG2 VAL 96 34.059 -23.166 35.640 789 HG23 VAL 96 2HG2 VAL 96 34.984 -21.999 34.686 790 HA PRO 97 HA PRO 97 37.140 -21.922 41.704 791 HB2 PRO 97 2HB PRO 97 39.847 -21.630 41.576 792 HB3 PRO 97 3HB PRO 97 39.050 -23.240 41.667 793 HG2 PRO 97 2HG PRO 97 40.009 -21.784 39.181 794 HG3 PRO 97 3HG PRO 97 40.361 -23.477 39.676 795 HD2 PRO 97 2HD PRO 97 38.363 -22.908 37.933 796 HD3 PRO 97 3HD PRO 97 38.154 -24.175 39.180 797 H ARG 98 H ARG 98 38.040 -19.945 42.690 798 HA ARG 98 HA ARG 98 38.523 -17.674 40.865 799 HB2 ARG 98 2HB ARG 98 36.770 -16.324 41.910 800 HB3 ARG 98 3HB ARG 98 36.081 -17.746 41.110 801 HG2 ARG 98 2HG ARG 98 35.958 -18.921 43.296 802 HG3 ARG 98 3HG ARG 98 36.611 -17.482 44.106 803 HD2 ARG 98 2HD ARG 98 34.038 -17.575 42.484 804 HD3 ARG 98 3HD ARG 98 34.137 -17.643 44.256 805 HE ARG 98 HE ARG 98 35.506 -15.325 43.228 806 HH11 ARG 98 1HH1 ARG 98 32.290 -16.618 43.925 807 HH12 ARG 98 2HH1 ARG 98 31.578 -15.037 44.158 808 HH21 ARG 98 1HH2 ARG 98 34.555 -13.277 43.556 809 HH22 ARG 98 2HH2 ARG 98 32.855 -13.152 43.944 810 H GLY 99 H GLY 99 39.092 -15.674 42.131 811 HA2 GLY 99 2HA GLY 99 39.864 -15.827 44.881 812 HA3 GLY 99 3HA GLY 99 41.260 -16.153 43.839 813 H SER 100 H SER 100 41.831 -14.070 45.148 814 HA SER 100 HA SER 100 41.398 -11.781 43.334 815 HB2 SER 100 2HB SER 100 39.624 -11.621 45.061 816 HB3 SER 100 3HB SER 100 40.866 -11.657 46.330 817 HG SER 100 HG SER 100 40.223 -9.526 45.741 818 H HIS 101 H HIS 101 42.950 -10.049 43.699 819 HA HIS 101 HA HIS 101 45.277 -10.633 45.400 820 HB2 HIS 101 2HB HIS 101 45.643 -11.875 43.258 821 HB3 HIS 101 3HB HIS 101 45.498 -10.349 42.380 822 HD2 HIS 101 HD2 HIS 101 47.954 -10.063 41.513 823 HE1 HIS 101 HE1 HIS 101 50.019 -10.348 45.220 824 HE2 HIS 101 HE2 HIS 101 50.261 -9.846 42.737 825 H HIS 102 H HIS 102 46.836 -8.755 45.346 826 HA HIS 102 HA HIS 102 45.264 -6.294 45.381 827 HB2 HIS 102 2HB HIS 102 47.208 -5.313 46.452 828 HB3 HIS 102 3HB HIS 102 46.766 -6.833 47.225 829 HD2 HIS 102 HD2 HIS 102 48.776 -8.341 47.763 830 HE1 HIS 102 HE1 HIS 102 51.507 -7.059 44.764 831 HE2 HIS 102 HE2 HIS 102 51.189 -8.591 46.777 832 H HIS 103 H HIS 103 46.730 -7.867 42.901 833 HA HIS 103 HA HIS 103 47.015 -5.361 41.358 834 HB2 HIS 103 2HB HIS 103 49.281 -5.922 42.154 835 HB3 HIS 103 3HB HIS 103 49.119 -7.550 41.484 836 HD2 HIS 103 HD2 HIS 103 50.383 -7.771 39.264 837 HE1 HIS 103 HE1 HIS 103 49.818 -3.868 37.668 838 HE2 HIS 103 HE2 HIS 103 50.854 -6.158 37.253 839 H HIS 104 H HIS 104 46.830 -5.718 39.045 840 HA HIS 104 HA HIS 104 46.007 -8.380 38.127 841 HB2 HIS 104 2HB HIS 104 43.959 -7.392 39.145 842 HB3 HIS 104 3HB HIS 104 44.112 -6.005 38.056 843 HD2 HIS 104 HD2 HIS 104 42.095 -6.307 36.444 844 HE1 HIS 104 HE1 HIS 104 42.722 -10.351 35.278 845 HE2 HIS 104 HE2 HIS 104 41.320 -8.260 34.879 846 H HIS 105 H HIS 105 45.560 -8.367 35.760 847 HA HIS 105 HA HIS 105 47.604 -6.831 34.392 848 HB2 HIS 105 2HB HIS 105 45.488 -8.746 33.351 849 HB3 HIS 105 3HB HIS 105 46.868 -8.128 32.434 850 HD2 HIS 105 HD2 HIS 105 45.880 -10.875 34.819 851 HE1 HIS 105 HE1 HIS 105 50.112 -11.137 34.501 852 HE2 HIS 105 HE2 HIS 105 48.010 -12.303 35.346 853 H HIS 106 H HIS 106 47.091 -5.744 32.260 854 HA HIS 106 HA HIS 106 45.158 -3.644 32.728 855 HB2 HIS 106 2HB HIS 106 45.995 -2.763 30.594 856 HB3 HIS 106 3HB HIS 106 47.314 -3.186 31.685 857 HD2 HIS 106 HD2 HIS 106 45.939 -3.924 28.244 858 HE1 HIS 106 HE1 HIS 106 49.136 -6.677 28.785 859 HE2 HIS 106 HE2 HIS 106 47.495 -5.695 27.098 Start of MODEL 6 1 H1 MET 1 H1 MET 1 -3.085 -6.286 -1.827 2 H2 MET 1 H2 MET 1 -2.979 -4.741 -1.257 3 H3 MET 1 H3 MET 1 -2.180 -5.957 -0.488 4 HA MET 1 HA MET 1 -0.765 -6.312 -2.361 5 HB2 MET 1 2HB MET 1 -2.275 -3.931 -3.515 6 HB3 MET 1 3HB MET 1 -0.805 -4.638 -4.203 7 HG2 MET 1 2HG MET 1 -1.961 -6.811 -4.454 8 HG3 MET 1 3HG MET 1 -3.439 -6.100 -3.800 9 HE1 MET 1 1HE MET 1 -0.805 -4.533 -6.375 10 HE2 MET 1 2HE MET 1 -0.917 -6.268 -6.763 11 HE3 MET 1 3HE MET 1 -1.544 -5.055 -7.901 12 H SER 2 H SER 2 1.160 -4.896 -2.834 13 HA SER 2 HA SER 2 1.433 -2.550 -1.066 14 HB2 SER 2 2HB SER 2 3.479 -3.480 -0.036 15 HB3 SER 2 3HB SER 2 2.047 -4.446 0.370 16 HG SER 2 HG SER 2 3.815 -5.745 -0.282 17 H GLU 3 H GLU 3 3.613 -1.519 -1.395 18 HA GLU 3 HA GLU 3 4.662 -1.960 -4.139 19 HB2 GLU 3 2HB GLU 3 3.784 0.703 -2.958 20 HB3 GLU 3 3HB GLU 3 4.647 0.497 -4.495 21 HG2 GLU 3 2HG GLU 3 2.778 -0.917 -5.333 22 HG3 GLU 3 3HG GLU 3 1.892 -0.606 -3.826 23 H GLN 4 H GLN 4 5.579 -2.444 -1.239 24 HA GLN 4 HA GLN 4 8.214 -1.080 -1.536 25 HB2 GLN 4 2HB GLN 4 6.738 -1.538 1.074 26 HB3 GLN 4 3HB GLN 4 8.318 -0.760 0.866 27 HG2 GLN 4 2HG GLN 4 7.260 1.040 -0.479 28 HG3 GLN 4 3HG GLN 4 5.672 0.302 -0.217 29 HE21 GLN 4 2HE2 GLN 4 5.620 2.764 0.585 30 HE22 GLN 4 1HE2 GLN 4 5.828 2.942 2.313 31 H LEU 5 H LEU 5 9.780 -2.163 0.155 32 HA LEU 5 HA LEU 5 9.841 -4.999 -0.643 33 HB2 LEU 5 2HB LEU 5 11.951 -3.315 0.740 34 HB3 LEU 5 3HB LEU 5 12.180 -4.869 -0.085 35 HG LEU 5 HG LEU 5 11.385 -2.224 -1.366 36 HD11 LEU 5 1HD1 LEU 5 13.767 -2.409 -0.683 37 HD12 LEU 5 2HD1 LEU 5 13.893 -3.945 -1.571 38 HD13 LEU 5 3HD1 LEU 5 13.606 -2.433 -2.456 39 HD21 LEU 5 3HD2 LEU 5 11.906 -4.931 -2.676 40 HD22 LEU 5 1HD2 LEU 5 10.321 -4.119 -2.560 41 HD23 LEU 5 2HD2 LEU 5 11.621 -3.397 -3.524 42 H THR 6 H THR 6 10.387 -6.672 0.818 43 HA THR 6 HA THR 6 9.680 -6.225 3.675 44 HB THR 6 HB THR 6 8.431 -8.337 1.871 45 HG1 THR 6 1HG THR 6 7.619 -6.285 1.422 46 HG21 THR 6 1HG2 THR 6 6.831 -8.507 3.843 47 HG22 THR 6 2HG2 THR 6 8.452 -9.165 4.116 48 HG23 THR 6 3HG2 THR 6 8.024 -7.566 4.779 49 H ASP 7 H ASP 7 10.051 -8.463 4.851 50 HA ASP 7 HA ASP 7 12.787 -9.056 4.710 51 HB2 ASP 7 2HB ASP 7 12.234 -10.913 6.229 52 HB3 ASP 7 3HB ASP 7 11.372 -9.430 6.665 53 H GLN 8 H GLN 8 10.244 -10.235 2.654 54 HA GLN 8 HA GLN 8 11.400 -12.756 1.939 55 HB2 GLN 8 2HB GLN 8 9.071 -12.186 1.451 56 HB3 GLN 8 3HB GLN 8 9.587 -10.816 0.455 57 HG2 GLN 8 2HG GLN 8 8.943 -12.701 -0.966 58 HG3 GLN 8 3HG GLN 8 10.662 -12.359 -1.150 59 HE21 GLN 8 2HE2 GLN 8 12.229 -13.792 -0.141 60 HE22 GLN 8 1HE2 GLN 8 11.780 -15.442 0.247 61 H VAL 9 H VAL 9 11.557 -9.497 0.400 62 HA VAL 9 HA VAL 9 13.560 -10.462 -1.512 63 HB VAL 9 HB VAL 9 11.848 -9.019 -2.363 64 HG11 VAL 9 1HG1 VAL 9 11.492 -6.729 -1.538 65 HG12 VAL 9 2HG1 VAL 9 11.125 -7.940 -0.303 66 HG13 VAL 9 3HG1 VAL 9 12.656 -7.029 -0.220 67 HG21 VAL 9 3HG2 VAL 9 14.337 -7.294 -2.054 68 HG22 VAL 9 1HG2 VAL 9 14.165 -8.614 -3.235 69 HG23 VAL 9 2HG2 VAL 9 13.114 -7.188 -3.332 70 H LEU 10 H LEU 10 13.484 -8.692 1.544 71 HA LEU 10 HA LEU 10 16.114 -7.542 1.258 72 HB2 LEU 10 2HB LEU 10 14.056 -7.885 3.403 73 HB3 LEU 10 3HB LEU 10 15.743 -7.679 3.927 74 HG LEU 10 HG LEU 10 15.969 -5.611 2.717 75 HD11 LEU 10 1HD1 LEU 10 13.085 -5.998 1.833 76 HD12 LEU 10 2HD1 LEU 10 14.063 -4.532 1.594 77 HD13 LEU 10 3HD1 LEU 10 14.532 -6.032 0.783 78 HD21 LEU 10 3HD2 LEU 10 15.027 -5.529 4.989 79 HD22 LEU 10 1HD2 LEU 10 14.320 -4.248 3.981 80 HD23 LEU 10 2HD2 LEU 10 13.387 -5.727 4.326 81 H VAL 11 H VAL 11 14.919 -10.756 2.286 82 HA VAL 11 HA VAL 11 17.575 -11.453 3.318 83 HB VAL 11 HB VAL 11 15.050 -13.074 2.877 84 HG11 VAL 11 1HG1 VAL 11 17.781 -13.901 3.954 85 HG12 VAL 11 2HG1 VAL 11 16.283 -14.837 4.172 86 HG13 VAL 11 3HG1 VAL 11 16.938 -14.581 2.543 87 HG21 VAL 11 3HG2 VAL 11 16.588 -12.220 5.376 88 HG22 VAL 11 1HG2 VAL 11 15.103 -11.435 4.793 89 HG23 VAL 11 2HG2 VAL 11 15.051 -13.120 5.338 90 H GLU 12 H GLU 12 15.769 -11.711 0.250 91 HA GLU 12 HA GLU 12 17.646 -13.568 -0.942 92 HB2 GLU 12 2HB GLU 12 15.694 -11.551 -2.108 93 HB3 GLU 12 3HB GLU 12 16.681 -12.632 -3.095 94 HG2 GLU 12 2HG GLU 12 15.706 -14.599 -1.952 95 HG3 GLU 12 3HG GLU 12 14.686 -13.535 -0.979 96 H ARG 13 H ARG 13 17.442 -9.994 -0.727 97 HA ARG 13 HA ARG 13 19.543 -9.498 -2.609 98 HB2 ARG 13 2HB ARG 13 17.760 -7.913 -2.061 99 HB3 ARG 13 3HB ARG 13 18.340 -7.784 -0.395 100 HG2 ARG 13 2HG ARG 13 20.407 -6.759 -1.120 101 HG3 ARG 13 3HG ARG 13 20.036 -7.074 -2.831 102 HD2 ARG 13 2HD ARG 13 18.377 -5.315 -0.979 103 HD3 ARG 13 3HD ARG 13 19.585 -4.712 -2.129 104 HE ARG 13 HE ARG 13 17.871 -6.285 -3.652 105 HH11 ARG 13 1HH1 ARG 13 17.567 -3.428 -1.598 106 HH12 ARG 13 2HH1 ARG 13 16.197 -2.792 -2.481 107 HH21 ARG 13 1HH2 ARG 13 16.091 -5.431 -4.795 108 HH22 ARG 13 2HH2 ARG 13 15.374 -3.918 -4.296 109 H VAL 14 H VAL 14 19.577 -9.889 0.982 110 HA VAL 14 HA VAL 14 22.364 -9.141 1.162 111 HB VAL 14 HB VAL 14 22.272 -10.131 3.403 112 HG11 VAL 14 1HG1 VAL 14 21.474 -7.874 3.127 113 HG12 VAL 14 2HG1 VAL 14 19.875 -8.438 2.595 114 HG13 VAL 14 3HG1 VAL 14 20.387 -8.718 4.267 115 HG21 VAL 14 3HG2 VAL 14 19.478 -11.005 2.597 116 HG22 VAL 14 1HG2 VAL 14 20.841 -12.079 3.016 117 HG23 VAL 14 2HG2 VAL 14 20.134 -11.009 4.253 118 H GLN 15 H GLN 15 20.667 -12.075 0.220 119 HA GLN 15 HA GLN 15 23.062 -13.739 0.418 120 HB2 GLN 15 2HB GLN 15 20.335 -14.166 -0.847 121 HB3 GLN 15 3HB GLN 15 21.627 -15.383 -0.821 122 HG2 GLN 15 2HG GLN 15 21.644 -15.383 1.634 123 HG3 GLN 15 3HG GLN 15 20.457 -14.098 1.687 124 HE21 GLN 15 2HE2 GLN 15 19.847 -16.382 3.058 125 HE22 GLN 15 1HE2 GLN 15 18.599 -17.277 2.221 126 H LYS 16 H LYS 16 21.823 -11.399 -1.850 127 HA LYS 16 HA LYS 16 23.383 -12.431 -4.095 128 HB2 LYS 16 2HB LYS 16 22.161 -9.673 -3.644 129 HB3 LYS 16 3HB LYS 16 22.807 -10.289 -5.162 130 HG2 LYS 16 2HG LYS 16 20.327 -11.255 -3.725 131 HG3 LYS 16 3HG LYS 16 20.432 -10.413 -5.269 132 HD2 LYS 16 2HD LYS 16 21.584 -12.373 -6.268 133 HD3 LYS 16 3HD LYS 16 21.500 -13.218 -4.700 134 HE2 LYS 16 2HE LYS 16 19.034 -13.047 -4.741 135 HE3 LYS 16 3HE LYS 16 19.115 -12.213 -6.302 136 HZ1 LYS 16 3HZ LYS 16 20.065 -14.950 -5.779 137 HZ2 LYS 16 1HZ LYS 16 18.680 -14.557 -6.567 138 HZ3 LYS 16 2HZ LYS 16 20.134 -14.176 -7.229 139 H GLY 17 H GLY 17 24.178 -10.981 -1.178 140 HA2 GLY 17 2HA GLY 17 26.453 -10.643 -0.571 141 HA3 GLY 17 3HA GLY 17 26.828 -10.146 -2.233 142 H ASP 18 H ASP 18 23.893 -8.708 -1.350 143 HA ASP 18 HA ASP 18 25.218 -6.118 -0.891 144 HB2 ASP 18 2HB ASP 18 22.435 -7.051 -1.603 145 HB3 ASP 18 3HB ASP 18 22.707 -5.405 -1.054 146 H GLN 19 H GLN 19 26.045 -6.544 1.234 147 HA GLN 19 HA GLN 19 24.403 -7.410 3.391 148 HB2 GLN 19 2HB GLN 19 26.856 -7.563 3.255 149 HB3 GLN 19 3HB GLN 19 27.003 -5.812 3.379 150 HG2 GLN 19 2HG GLN 19 25.535 -7.424 5.488 151 HG3 GLN 19 3HG GLN 19 27.295 -7.314 5.511 152 HE21 GLN 19 2HE2 GLN 19 25.938 -6.405 7.690 153 HE22 GLN 19 1HE2 GLN 19 26.024 -4.655 7.762 154 H LYS 20 H LYS 20 24.685 -4.342 1.767 155 HA LYS 20 HA LYS 20 23.917 -2.564 3.845 156 HB2 LYS 20 2HB LYS 20 23.261 -1.093 2.007 157 HB3 LYS 20 3HB LYS 20 24.784 -1.909 1.609 158 HG2 LYS 20 2HG LYS 20 23.477 -3.598 0.279 159 HG3 LYS 20 3HG LYS 20 22.003 -2.655 0.602 160 HD2 LYS 20 2HD LYS 20 23.071 -0.680 -0.495 161 HD3 LYS 20 3HD LYS 20 24.495 -1.686 -0.850 162 HE2 LYS 20 2HE LYS 20 23.030 -3.261 -2.109 163 HE3 LYS 20 3HE LYS 20 21.649 -2.188 -1.811 164 HZ1 LYS 20 3HZ LYS 20 24.085 -1.461 -3.293 165 HZ2 LYS 20 1HZ LYS 20 22.618 -1.789 -3.953 166 HZ3 LYS 20 2HZ LYS 20 22.814 -0.459 -3.004 167 H ALA 21 H ALA 21 22.066 -4.983 2.065 168 HA ALA 21 HA ALA 21 19.512 -3.782 2.824 169 HB1 ALA 21 1HB ALA 21 18.562 -5.788 1.746 170 HB2 ALA 21 2HB ALA 21 19.754 -4.986 0.698 171 HB3 ALA 21 3HB ALA 21 20.201 -6.467 1.566 172 H PHE 22 H PHE 22 21.839 -5.943 4.295 173 HA PHE 22 HA PHE 22 19.884 -7.220 6.040 174 HB2 PHE 22 2HB PHE 22 22.057 -8.285 5.467 175 HB3 PHE 22 3HB PHE 22 22.902 -6.980 6.301 176 HD1 PHE 22 HD1 PHE 22 20.128 -9.458 6.890 177 HD2 PHE 22 HD2 PHE 22 23.482 -7.336 8.556 178 HE1 PHE 22 HE1 PHE 22 19.856 -10.696 9.004 179 HE2 PHE 22 HE2 PHE 22 23.185 -8.566 10.693 180 HZ PHE 22 HZ PHE 22 21.383 -10.242 10.923 181 H ASN 23 H ASN 23 22.095 -4.416 6.136 182 HA ASN 23 HA ASN 23 21.747 -3.743 8.885 183 HB2 ASN 23 2HB ASN 23 23.513 -2.742 7.611 184 HB3 ASN 23 3HB ASN 23 22.397 -2.217 6.348 185 HD21 ASN 23 2HD2 ASN 23 21.351 -0.283 6.488 186 HD22 ASN 23 1HD2 ASN 23 21.538 0.832 7.825 187 H LEU 24 H LEU 24 19.917 -2.881 5.933 188 HA LEU 24 HA LEU 24 18.018 -1.256 7.401 189 HB2 LEU 24 2HB LEU 24 17.903 -2.447 4.604 190 HB3 LEU 24 3HB LEU 24 16.805 -1.217 5.261 191 HG LEU 24 HG LEU 24 19.821 -0.835 5.014 192 HD11 LEU 24 1HD1 LEU 24 17.556 0.099 3.208 193 HD12 LEU 24 2HD1 LEU 24 19.269 0.574 3.069 194 HD13 LEU 24 3HD1 LEU 24 18.793 -1.120 2.810 195 HD21 LEU 24 3HD2 LEU 24 18.780 0.604 6.720 196 HD22 LEU 24 1HD2 LEU 24 19.222 1.563 5.291 197 HD23 LEU 24 2HD2 LEU 24 17.529 1.096 5.556 198 H LEU 25 H LEU 25 18.351 -4.679 6.826 199 HA LEU 25 HA LEU 25 15.503 -5.244 7.234 200 HB2 LEU 25 2HB LEU 25 16.864 -6.678 5.786 201 HB3 LEU 25 3HB LEU 25 17.990 -6.997 7.112 202 HG LEU 25 HG LEU 25 16.197 -8.154 8.373 203 HD11 LEU 25 1HD1 LEU 25 14.091 -8.731 7.217 204 HD12 LEU 25 2HD1 LEU 25 14.226 -6.976 7.447 205 HD13 LEU 25 3HD1 LEU 25 14.554 -7.697 5.849 206 HD21 LEU 25 3HD2 LEU 25 16.607 -9.110 5.508 207 HD22 LEU 25 1HD2 LEU 25 17.696 -9.407 6.880 208 HD23 LEU 25 2HD2 LEU 25 16.068 -10.120 6.873 209 H VAL 26 H VAL 26 18.531 -5.351 9.230 210 HA VAL 26 HA VAL 26 17.094 -6.628 11.377 211 HB VAL 26 HB VAL 26 18.998 -6.215 12.773 212 HG11 VAL 26 1HG1 VAL 26 20.724 -7.357 11.486 213 HG12 VAL 26 2HG1 VAL 26 19.127 -8.058 11.148 214 HG13 VAL 26 3HG1 VAL 26 19.891 -6.970 9.969 215 HG21 VAL 26 3HG2 VAL 26 19.541 -3.924 12.158 216 HG22 VAL 26 1HG2 VAL 26 20.964 -4.966 11.982 217 HG23 VAL 26 2HG2 VAL 26 20.058 -4.462 10.532 218 H VAL 27 H VAL 27 17.436 -3.202 10.433 219 HA VAL 27 HA VAL 27 16.814 -2.188 13.050 220 HB VAL 27 HB VAL 27 16.172 -0.102 11.855 221 HG11 VAL 27 1HG1 VAL 27 18.765 -1.410 10.957 222 HG12 VAL 27 2HG1 VAL 27 18.410 0.327 10.882 223 HG13 VAL 27 3HG1 VAL 27 18.504 -0.490 12.465 224 HG21 VAL 27 3HG2 VAL 27 16.524 0.057 9.437 225 HG22 VAL 27 1HG2 VAL 27 16.880 -1.684 9.358 226 HG23 VAL 27 2HG2 VAL 27 15.244 -1.125 9.789 227 H ARG 28 H ARG 28 14.797 -3.547 10.479 228 HA ARG 28 HA ARG 28 12.303 -2.485 11.491 229 HB2 ARG 28 2HB ARG 28 12.706 -5.075 9.938 230 HB3 ARG 28 3HB ARG 28 11.268 -4.044 9.995 231 HG2 ARG 28 2HG ARG 28 12.631 -2.233 8.845 232 HG3 ARG 28 3HG ARG 28 13.968 -3.400 8.746 233 HD2 ARG 28 2HD ARG 28 12.840 -3.440 6.636 234 HD3 ARG 28 3HD ARG 28 12.510 -4.960 7.475 235 HE ARG 28 HE ARG 28 10.357 -3.452 8.198 236 HH11 ARG 28 1HH1 ARG 28 11.840 -4.064 5.039 237 HH12 ARG 28 2HH1 ARG 28 10.334 -3.869 4.170 238 HH21 ARG 28 1HH2 ARG 28 8.417 -3.219 7.031 239 HH22 ARG 28 2HH2 ARG 28 8.409 -3.408 5.293 240 H TYR 29 H TYR 29 14.343 -5.261 12.179 241 HA TYR 29 HA TYR 29 12.321 -6.359 14.040 242 HB2 TYR 29 2HB TYR 29 14.837 -7.484 12.789 243 HB3 TYR 29 3HB TYR 29 13.920 -8.315 14.054 244 HD1 TYR 29 HD1 TYR 29 13.696 -6.960 10.588 245 HD2 TYR 29 HD2 TYR 29 11.914 -9.469 13.584 246 HE1 TYR 29 HE1 TYR 29 12.081 -7.783 8.906 247 HE2 TYR 29 HE2 TYR 29 10.308 -10.334 11.911 248 HH TYR 29 HH TYR 29 10.294 -9.200 8.501 249 H GLN 30 H GLN 30 14.982 -4.267 14.155 250 HA GLN 30 HA GLN 30 16.366 -5.171 16.467 251 HB2 GLN 30 2HB GLN 30 17.139 -3.505 14.790 252 HB3 GLN 30 3HB GLN 30 15.960 -2.342 15.413 253 HG2 GLN 30 2HG GLN 30 17.113 -2.356 17.595 254 HG3 GLN 30 3HG GLN 30 18.231 -3.606 17.000 255 HE21 GLN 30 2HE2 GLN 30 19.189 -2.955 14.691 256 HE22 GLN 30 1HE2 GLN 30 19.820 -1.322 14.590 257 H HIS 31 H HIS 31 13.341 -3.376 16.052 258 HA HIS 31 HA HIS 31 13.135 -2.835 18.942 259 HB2 HIS 31 2HB HIS 31 12.279 -1.250 17.239 260 HB3 HIS 31 3HB HIS 31 11.154 -2.491 16.663 261 HD2 HIS 31 HD2 HIS 31 11.920 -0.566 19.983 262 HE1 HIS 31 HE1 HIS 31 7.748 -1.403 19.899 263 HE2 HIS 31 HE2 HIS 31 9.618 -0.252 21.194 264 H LYS 32 H LYS 32 12.082 -5.257 16.584 265 HA LYS 32 HA LYS 32 9.980 -6.320 18.285 266 HB2 LYS 32 2HB LYS 32 11.333 -7.487 15.824 267 HB3 LYS 32 3HB LYS 32 9.824 -8.065 16.562 268 HG2 LYS 32 2HG LYS 32 8.764 -5.867 16.133 269 HG3 LYS 32 3HG LYS 32 10.260 -5.297 15.360 270 HD2 LYS 32 2HD LYS 32 10.081 -7.126 13.685 271 HD3 LYS 32 3HD LYS 32 8.569 -7.664 14.452 272 HE2 LYS 32 2HE LYS 32 7.556 -5.458 13.996 273 HE3 LYS 32 3HE LYS 32 9.071 -4.913 13.248 274 HZ1 LYS 32 3HZ LYS 32 7.388 -7.139 12.298 275 HZ2 LYS 32 1HZ LYS 32 7.484 -5.652 11.605 276 HZ3 LYS 32 2HZ LYS 32 8.794 -6.640 11.597 277 H VAL 33 H VAL 33 13.372 -7.315 17.525 278 HA VAL 33 HA VAL 33 13.057 -9.694 19.181 279 HB VAL 33 HB VAL 33 15.316 -10.209 18.670 280 HG11 VAL 33 1HG1 VAL 33 15.252 -10.257 16.225 281 HG12 VAL 33 2HG1 VAL 33 13.648 -10.613 16.905 282 HG13 VAL 33 3HG1 VAL 33 13.979 -9.014 16.209 283 HG21 VAL 33 3HG2 VAL 33 16.773 -8.737 17.342 284 HG22 VAL 33 1HG2 VAL 33 15.585 -7.419 17.492 285 HG23 VAL 33 2HG2 VAL 33 16.398 -8.059 18.939 286 H ALA 34 H ALA 34 14.197 -6.372 19.637 287 HA ALA 34 HA ALA 34 15.607 -6.925 22.086 288 HB1 ALA 34 1HB ALA 34 14.330 -4.355 21.072 289 HB2 ALA 34 2HB ALA 34 15.504 -4.493 22.406 290 HB3 ALA 34 3HB ALA 34 15.996 -4.892 20.750 291 H SER 35 H SER 35 12.228 -6.629 21.218 292 HA SER 35 HA SER 35 11.307 -5.970 23.899 293 HB2 SER 35 2HB SER 35 10.084 -5.392 21.800 294 HB3 SER 35 3HB SER 35 9.802 -7.122 21.518 295 HG SER 35 HG SER 35 8.056 -6.077 22.614 296 H LEU 36 H LEU 36 11.592 -8.939 21.900 297 HA LEU 36 HA LEU 36 10.408 -10.545 24.026 298 HB2 LEU 36 2HB LEU 36 10.627 -12.394 22.521 299 HB3 LEU 36 3HB LEU 36 9.987 -10.994 21.658 300 HG LEU 36 HG LEU 36 12.478 -10.585 20.949 301 HD11 LEU 36 1HD1 LEU 36 13.742 -12.684 20.625 302 HD12 LEU 36 2HD1 LEU 36 13.536 -12.364 22.351 303 HD13 LEU 36 3HD1 LEU 36 12.517 -13.579 21.549 304 HD21 LEU 36 3HD2 LEU 36 10.834 -12.919 19.884 305 HD22 LEU 36 1HD2 LEU 36 10.628 -11.206 19.439 306 HD23 LEU 36 2HD2 LEU 36 12.120 -12.071 19.001 307 H VAL 37 H VAL 37 13.666 -9.590 23.112 308 HA VAL 37 HA VAL 37 14.793 -11.811 24.662 309 HB VAL 37 HB VAL 37 15.720 -10.940 22.460 310 HG11 VAL 37 1HG1 VAL 37 15.728 -8.495 23.308 311 HG12 VAL 37 2HG1 VAL 37 17.186 -8.973 24.218 312 HG13 VAL 37 3HG1 VAL 37 17.179 -9.095 22.451 313 HG21 VAL 37 3HG2 VAL 37 18.003 -11.463 23.125 314 HG22 VAL 37 1HG2 VAL 37 17.613 -11.163 24.829 315 HG23 VAL 37 2HG2 VAL 37 16.862 -12.539 23.977 316 H SER 38 H SER 38 13.840 -8.500 25.216 317 HA SER 38 HA SER 38 15.492 -8.024 27.510 318 HB2 SER 38 2HB SER 38 14.265 -6.260 26.283 319 HB3 SER 38 3HB SER 38 12.724 -6.954 26.819 320 HG SER 38 HG SER 38 13.451 -5.230 28.145 321 H ARG 39 H ARG 39 12.998 -10.269 26.904 322 HA ARG 39 HA ARG 39 12.101 -10.510 29.687 323 HB2 ARG 39 2HB ARG 39 11.571 -12.171 27.201 324 HB3 ARG 39 3HB ARG 39 10.774 -12.402 28.762 325 HG2 ARG 39 2HG ARG 39 9.736 -10.210 28.648 326 HG3 ARG 39 3HG ARG 39 10.650 -9.802 27.178 327 HD2 ARG 39 2HD ARG 39 8.330 -10.467 26.654 328 HD3 ARG 39 3HD ARG 39 9.514 -11.557 25.924 329 HE ARG 39 HE ARG 39 7.738 -12.145 28.242 330 HH11 ARG 39 1HH1 ARG 39 10.092 -13.279 25.856 331 HH12 ARG 39 2HH1 ARG 39 9.775 -14.967 26.172 332 HH21 ARG 39 1HH2 ARG 39 7.335 -14.363 28.624 333 HH22 ARG 39 2HH2 ARG 39 8.226 -15.577 27.733 334 H TYR 40 H TYR 40 14.862 -11.476 27.988 335 HA TYR 40 HA TYR 40 15.200 -13.845 29.771 336 HB2 TYR 40 2HB TYR 40 16.206 -13.460 26.933 337 HB3 TYR 40 3HB TYR 40 16.565 -14.837 27.971 338 HD1 TYR 40 HD1 TYR 40 14.521 -16.175 28.902 339 HD2 TYR 40 HD2 TYR 40 14.329 -13.540 25.505 340 HE1 TYR 40 HE1 TYR 40 12.435 -17.292 28.150 341 HE2 TYR 40 HE2 TYR 40 12.262 -14.664 24.741 342 HH TYR 40 HH TYR 40 10.780 -17.371 26.564 343 H VAL 41 H VAL 41 16.431 -10.756 28.830 344 HA VAL 41 HA VAL 41 18.627 -11.136 30.766 345 HB VAL 41 HB VAL 41 20.122 -9.731 29.255 346 HG11 VAL 41 1HG1 VAL 41 19.457 -12.541 28.310 347 HG12 VAL 41 2HG1 VAL 41 20.974 -11.664 28.035 348 HG13 VAL 41 3HG1 VAL 41 20.506 -12.131 29.685 349 HG21 VAL 41 3HG2 VAL 41 18.270 -10.744 27.072 350 HG22 VAL 41 1HG2 VAL 41 18.357 -9.053 27.627 351 HG23 VAL 41 2HG2 VAL 41 19.770 -9.816 26.864 352 HA PRO 42 HA PRO 42 17.113 -7.272 32.194 353 HB2 PRO 42 2HB PRO 42 19.313 -6.107 33.320 354 HB3 PRO 42 3HB PRO 42 18.546 -7.584 34.003 355 HG2 PRO 42 2HG PRO 42 20.915 -7.425 32.116 356 HG3 PRO 42 3HG PRO 42 20.808 -8.314 33.676 357 HD2 PRO 42 2HD PRO 42 20.365 -9.589 31.335 358 HD3 PRO 42 3HD PRO 42 19.320 -9.929 32.746 359 H SER 43 H SER 43 17.343 -4.880 31.961 360 HA SER 43 HA SER 43 17.600 -4.235 29.206 361 HB2 SER 43 2HB SER 43 17.438 -2.394 31.626 362 HB3 SER 43 3HB SER 43 17.089 -1.952 29.941 363 HG SER 43 HG SER 43 15.197 -2.495 31.119 364 H GLY 44 H GLY 44 20.070 -4.494 31.575 365 HA2 GLY 44 2HA GLY 44 21.794 -2.439 30.361 366 HA3 GLY 44 3HA GLY 44 22.186 -3.523 31.709 367 H ASP 45 H ASP 45 21.099 -5.841 29.921 368 HA ASP 45 HA ASP 45 23.583 -6.154 28.304 369 HB2 ASP 45 2HB ASP 45 21.951 -8.222 29.808 370 HB3 ASP 45 3HB ASP 45 23.325 -8.579 28.751 371 H VAL 46 H VAL 46 20.268 -5.652 28.051 372 HA VAL 46 HA VAL 46 19.620 -7.587 26.053 373 HB VAL 46 HB VAL 46 18.016 -6.346 27.531 374 HG11 VAL 46 1HG1 VAL 46 18.333 -4.142 25.461 375 HG12 VAL 46 2HG1 VAL 46 17.081 -4.252 26.722 376 HG13 VAL 46 3HG1 VAL 46 18.780 -4.033 27.187 377 HG21 VAL 46 3HG2 VAL 46 17.236 -7.717 25.746 378 HG22 VAL 46 1HG2 VAL 46 16.276 -6.221 25.769 379 HG23 VAL 46 2HG2 VAL 46 17.537 -6.431 24.539 380 HA PRO 47 HA PRO 47 20.522 -4.250 22.823 381 HB2 PRO 47 2HB PRO 47 22.495 -2.426 23.139 382 HB3 PRO 47 3HB PRO 47 20.863 -2.175 23.841 383 HG2 PRO 47 2HG PRO 47 23.329 -3.289 25.223 384 HG3 PRO 47 3HG PRO 47 22.274 -1.959 25.784 385 HD2 PRO 47 2HD PRO 47 21.977 -4.518 26.638 386 HD3 PRO 47 3HD PRO 47 20.558 -3.454 26.378 387 H ASP 48 H ASP 48 23.119 -5.676 24.763 388 HA ASP 48 HA ASP 48 24.957 -5.856 22.504 389 HB2 ASP 48 2HB ASP 48 25.693 -5.580 24.875 390 HB3 ASP 48 3HB ASP 48 25.017 -7.171 25.246 391 H VAL 49 H VAL 49 22.526 -7.897 24.103 392 HA VAL 49 HA VAL 49 23.341 -10.313 22.704 393 HB VAL 49 HB VAL 49 20.913 -9.566 24.375 394 HG11 VAL 49 1HG1 VAL 49 20.262 -11.340 22.793 395 HG12 VAL 49 2HG1 VAL 49 21.715 -12.271 23.221 396 HG13 VAL 49 3HG1 VAL 49 20.439 -12.000 24.432 397 HG21 VAL 49 3HG2 VAL 49 21.999 -11.041 26.030 398 HG22 VAL 49 1HG2 VAL 49 23.324 -11.364 24.890 399 HG23 VAL 49 2HG2 VAL 49 23.108 -9.735 25.559 400 H VAL 50 H VAL 50 21.188 -7.574 22.061 401 HA VAL 50 HA VAL 50 19.807 -8.864 19.854 402 HB VAL 50 HB VAL 50 20.194 -5.969 20.705 403 HG11 VAL 50 1HG1 VAL 50 19.931 -5.962 18.267 404 HG12 VAL 50 2HG1 VAL 50 18.547 -7.075 18.388 405 HG13 VAL 50 3HG1 VAL 50 18.430 -5.421 19.031 406 HG21 VAL 50 3HG2 VAL 50 17.746 -7.781 20.627 407 HG22 VAL 50 1HG2 VAL 50 18.714 -7.470 22.082 408 HG23 VAL 50 2HG2 VAL 50 17.835 -6.138 21.312 409 H GLN 51 H GLN 51 22.814 -6.953 20.256 410 HA GLN 51 HA GLN 51 23.261 -6.739 17.409 411 HB2 GLN 51 2HB GLN 51 24.268 -5.184 19.026 412 HB3 GLN 51 3HB GLN 51 25.172 -6.527 19.774 413 HG2 GLN 51 2HG GLN 51 26.408 -6.907 17.723 414 HG3 GLN 51 3HG GLN 51 25.442 -5.702 16.857 415 HE21 GLN 51 2HE2 GLN 51 27.964 -5.164 16.554 416 HE22 GLN 51 1HE2 GLN 51 28.555 -3.934 17.659 417 H GLU 52 H GLU 52 24.347 -9.058 19.971 418 HA GLU 52 HA GLU 52 26.013 -10.528 18.165 419 HB2 GLU 52 2HB GLU 52 26.164 -10.670 20.637 420 HB3 GLU 52 3HB GLU 52 24.579 -11.479 20.680 421 HG2 GLU 52 2HG GLU 52 25.460 -13.319 19.296 422 HG3 GLU 52 3HG GLU 52 27.025 -12.496 19.180 423 H ALA 53 H ALA 53 22.520 -10.550 18.855 424 HA ALA 53 HA ALA 53 22.017 -13.064 17.555 425 HB1 ALA 53 1HB ALA 53 19.660 -12.320 17.625 426 HB2 ALA 53 2HB ALA 53 20.467 -12.070 19.188 427 HB3 ALA 53 3HB ALA 53 20.184 -10.688 18.092 428 H PHE 54 H PHE 54 22.414 -9.721 16.368 429 HA PHE 54 HA PHE 54 21.379 -10.474 13.725 430 HB2 PHE 54 2HB PHE 54 22.645 -7.938 14.815 431 HB3 PHE 54 3HB PHE 54 22.119 -8.128 13.153 432 HD1 PHE 54 HD1 PHE 54 19.545 -9.774 13.744 433 HD2 PHE 54 HD2 PHE 54 21.160 -6.160 15.456 434 HE1 PHE 54 HE1 PHE 54 17.279 -9.047 14.354 435 HE2 PHE 54 HE2 PHE 54 18.864 -5.417 16.015 436 HZ PHE 54 HZ PHE 54 16.926 -6.861 15.467 437 H ILE 55 H ILE 55 24.529 -10.192 15.346 438 HA ILE 55 HA ILE 55 26.038 -10.417 12.878 439 HB ILE 55 HB ILE 55 26.727 -10.999 15.788 440 HG12 ILE 55 2HG1 ILE 55 27.459 -8.613 14.026 441 HG13 ILE 55 3HG1 ILE 55 26.147 -8.611 15.195 442 HG21 ILE 55 1HG2 ILE 55 28.558 -10.748 13.360 443 HG22 ILE 55 2HG2 ILE 55 29.092 -10.976 15.044 444 HG23 ILE 55 3HG2 ILE 55 28.198 -12.257 14.231 445 HD11 ILE 55 3HD1 ILE 55 29.099 -9.036 15.832 446 HD12 ILE 55 1HD1 ILE 55 28.134 -7.588 16.175 447 HD13 ILE 55 2HD1 ILE 55 27.768 -9.114 17.014 448 H LYS 56 H LYS 56 24.653 -12.648 15.282 449 HA LYS 56 HA LYS 56 25.824 -15.024 14.115 450 HB2 LYS 56 2HB LYS 56 25.244 -14.732 16.496 451 HB3 LYS 56 3HB LYS 56 23.527 -14.611 16.066 452 HG2 LYS 56 2HG LYS 56 23.612 -16.915 15.129 453 HG3 LYS 56 3HG LYS 56 25.329 -17.030 15.582 454 HD2 LYS 56 2HD LYS 56 23.003 -16.574 17.500 455 HD3 LYS 56 3HD LYS 56 23.852 -18.116 17.254 456 HE2 LYS 56 2HE LYS 56 25.963 -17.072 18.027 457 HE3 LYS 56 3HE LYS 56 25.127 -15.520 18.227 458 HZ1 LYS 56 3HZ LYS 56 25.308 -16.663 20.300 459 HZ2 LYS 56 1HZ LYS 56 23.724 -16.555 19.861 460 HZ3 LYS 56 2HZ LYS 56 24.527 -17.987 19.709 461 H ALA 57 H ALA 57 22.754 -13.218 13.764 462 HA ALA 57 HA ALA 57 21.391 -15.324 12.369 463 HB1 ALA 57 1HB ALA 57 20.986 -12.303 12.365 464 HB2 ALA 57 2HB ALA 57 19.868 -13.482 11.646 465 HB3 ALA 57 3HB ALA 57 20.152 -13.487 13.397 466 H TYR 58 H TYR 58 23.440 -12.551 11.259 467 HA TYR 58 HA TYR 58 22.836 -12.861 8.512 468 HB2 TYR 58 2HB TYR 58 23.961 -10.914 9.594 469 HB3 TYR 58 3HB TYR 58 25.408 -11.903 9.828 470 HD1 TYR 58 HD2 TYR 58 23.034 -10.896 7.081 471 HD2 TYR 58 HD1 TYR 58 27.088 -11.769 8.232 472 HE1 TYR 58 HE2 TYR 58 23.813 -10.204 4.835 473 HE2 TYR 58 HE1 TYR 58 27.877 -11.114 5.970 474 HH TYR 58 HH TYR 58 27.273 -10.346 3.898 475 H ARG 59 H ARG 59 25.318 -14.393 10.570 476 HA ARG 59 HA ARG 59 26.707 -15.716 8.420 477 HB2 ARG 59 2HB ARG 59 26.548 -16.212 11.414 478 HB3 ARG 59 3HB ARG 59 27.699 -17.009 10.321 479 HG2 ARG 59 2HG ARG 59 28.751 -14.921 9.754 480 HG3 ARG 59 3HG ARG 59 27.496 -13.977 10.590 481 HD2 ARG 59 2HD ARG 59 28.139 -14.895 12.739 482 HD3 ARG 59 3HD ARG 59 29.275 -16.006 11.973 483 HE ARG 59 HE ARG 59 29.613 -13.105 12.441 484 HH11 ARG 59 1HH1 ARG 59 30.869 -16.012 10.859 485 HH12 ARG 59 2HH1 ARG 59 32.465 -15.330 10.634 486 HH21 ARG 59 1HH2 ARG 59 31.703 -12.250 12.117 487 HH22 ARG 59 2HH2 ARG 59 32.926 -13.211 11.322 488 H ALA 60 H ALA 60 23.841 -16.447 10.298 489 HA ALA 60 HA ALA 60 23.736 -19.226 9.271 490 HB1 ALA 60 1HB ALA 60 21.926 -17.698 11.177 491 HB2 ALA 60 2HB ALA 60 21.810 -19.431 10.787 492 HB3 ALA 60 3HB ALA 60 23.241 -18.802 11.640 493 H LEU 61 H LEU 61 22.713 -16.082 8.324 494 HA LEU 61 HA LEU 61 20.153 -16.796 7.225 495 HB2 LEU 61 2HB LEU 61 20.966 -14.488 7.982 496 HB3 LEU 61 3HB LEU 61 21.962 -14.448 6.518 497 HG LEU 61 HG LEU 61 19.837 -14.766 5.177 498 HD11 LEU 61 1HD1 LEU 61 18.605 -14.338 7.926 499 HD12 LEU 61 2HD1 LEU 61 17.708 -14.226 6.390 500 HD13 LEU 61 3HD1 LEU 61 18.400 -15.780 6.894 501 HD21 LEU 61 3HD2 LEU 61 19.932 -12.393 7.081 502 HD22 LEU 61 1HD2 LEU 61 20.859 -12.567 5.568 503 HD23 LEU 61 2HD2 LEU 61 19.082 -12.449 5.516 504 H ASP 62 H ASP 62 23.494 -16.905 6.124 505 HA ASP 62 HA ASP 62 22.967 -17.207 3.326 506 HB2 ASP 62 2HB ASP 62 25.167 -16.662 4.329 507 HB3 ASP 62 3HB ASP 62 25.233 -18.285 5.041 508 H SER 63 H SER 63 22.187 -19.190 5.992 509 HA SER 63 HA SER 63 22.014 -21.617 4.281 510 HB2 SER 63 2HB SER 63 22.050 -21.363 7.310 511 HB3 SER 63 3HB SER 63 21.959 -22.869 6.369 512 HG SER 63 HG SER 63 24.103 -22.357 7.018 513 H PHE 64 H PHE 64 20.115 -19.065 5.211 514 HA PHE 64 HA PHE 64 17.709 -20.461 6.006 515 HB2 PHE 64 2HB PHE 64 18.176 -18.101 6.553 516 HB3 PHE 64 3HB PHE 64 18.162 -17.696 4.838 517 HD1 PHE 64 HD2 PHE 64 16.012 -19.188 7.523 518 HD2 PHE 64 HD1 PHE 64 16.164 -17.024 3.812 519 HE1 PHE 64 HE2 PHE 64 13.565 -18.810 7.642 520 HE2 PHE 64 HE1 PHE 64 13.718 -16.645 3.930 521 HZ PHE 64 HZ PHE 64 12.416 -17.539 5.843 522 H ARG 65 H ARG 65 15.915 -21.010 4.743 523 HA ARG 65 HA ARG 65 16.295 -20.928 1.797 524 HB2 ARG 65 2HB ARG 65 15.703 -23.406 3.457 525 HB3 ARG 65 3HB ARG 65 15.627 -23.328 1.686 526 HG2 ARG 65 2HG ARG 65 18.007 -22.693 1.587 527 HG3 ARG 65 3HG ARG 65 18.111 -22.765 3.359 528 HD2 ARG 65 2HD ARG 65 17.525 -25.138 3.339 529 HD3 ARG 65 3HD ARG 65 17.369 -25.113 1.574 530 HE ARG 65 HE ARG 65 19.847 -25.109 3.157 531 HH11 ARG 65 1HH1 ARG 65 18.388 -24.543 -0.027 532 HH12 ARG 65 2HH1 ARG 65 19.900 -24.754 -0.876 533 HH21 ARG 65 1HH2 ARG 65 21.791 -25.374 2.011 534 HH22 ARG 65 2HH2 ARG 65 21.814 -25.222 0.270 535 H GLY 66 H GLY 66 14.338 -19.935 4.193 536 HA2 GLY 66 2HA GLY 66 12.196 -19.128 4.086 537 HA3 GLY 66 3HA GLY 66 12.096 -19.665 2.405 538 H ASP 67 H ASP 67 12.986 -22.183 4.634 539 HA ASP 67 HA ASP 67 10.563 -23.639 4.134 540 HB2 ASP 67 2HB ASP 67 12.803 -24.650 4.525 541 HB3 ASP 67 3HB ASP 67 12.752 -24.092 6.202 542 H SER 68 H SER 68 11.380 -21.176 6.367 543 HA SER 68 HA SER 68 8.776 -21.459 7.740 544 HB2 SER 68 2HB SER 68 11.439 -21.031 9.158 545 HB3 SER 68 3HB SER 68 9.837 -20.932 9.913 546 HG SER 68 HG SER 68 10.834 -22.983 10.193 547 H ALA 69 H ALA 69 8.217 -19.348 8.849 548 HA ALA 69 HA ALA 69 8.722 -17.158 7.073 549 HB1 ALA 69 1HB ALA 69 6.654 -17.394 8.403 550 HB2 ALA 69 2HB ALA 69 7.588 -17.155 9.897 551 HB3 ALA 69 3HB ALA 69 7.462 -15.839 8.704 552 H PHE 70 H PHE 70 9.955 -15.236 7.402 553 HA PHE 70 HA PHE 70 12.534 -15.782 8.516 554 HB2 PHE 70 2HB PHE 70 12.244 -14.293 6.614 555 HB3 PHE 70 3HB PHE 70 11.245 -13.200 7.585 556 HD1 PHE 70 HD2 PHE 70 14.653 -14.814 7.672 557 HD2 PHE 70 HD1 PHE 70 12.279 -11.328 8.526 558 HE1 PHE 70 HE2 PHE 70 16.677 -13.618 8.440 559 HE2 PHE 70 HE1 PHE 70 14.317 -10.124 9.262 560 HZ PHE 70 HZ PHE 70 16.522 -11.273 9.222 561 H TYR 71 H TYR 71 9.683 -14.004 9.806 562 HA TYR 71 HA TYR 71 11.206 -12.795 11.914 563 HB2 TYR 71 2HB TYR 71 9.077 -12.191 12.874 564 HB3 TYR 71 3HB TYR 71 9.068 -11.895 11.137 565 HD1 TYR 71 HD1 TYR 71 7.773 -14.044 13.850 566 HD2 TYR 71 HD2 TYR 71 7.558 -13.085 9.662 567 HE1 TYR 71 HE1 TYR 71 5.656 -15.331 13.668 568 HE2 TYR 71 HE2 TYR 71 5.443 -14.365 9.475 569 HH TYR 71 HH TYR 71 3.973 -16.036 12.277 570 H THR 72 H THR 72 9.416 -15.900 11.631 571 HA THR 72 HA THR 72 9.680 -16.560 14.425 572 HB THR 72 HB THR 72 9.370 -18.410 12.020 573 HG1 THR 72 1HG THR 72 7.418 -17.087 13.584 574 HG21 THR 72 1HG2 THR 72 9.896 -19.578 14.132 575 HG22 THR 72 2HG2 THR 72 8.582 -18.703 14.956 576 HG23 THR 72 3HG2 THR 72 8.214 -19.864 13.657 577 H TRP 73 H TRP 73 11.677 -16.982 11.531 578 HA TRP 73 HA TRP 73 13.546 -18.815 12.769 579 HB2 TRP 73 2HB TRP 73 13.126 -18.822 10.379 580 HB3 TRP 73 3HB TRP 73 13.596 -17.128 10.247 581 HD1 TRP 73 HD1 TRP 73 15.035 -20.605 10.357 582 HE1 TRP 73 HE1 TRP 73 17.557 -20.535 9.938 583 HE3 TRP 73 HE3 TRP 73 15.759 -15.540 10.621 584 HZ2 TRP 73 HZ2 TRP 73 19.647 -18.550 9.858 585 HZ3 TRP 73 HZ3 TRP 73 18.032 -14.601 10.379 586 HH2 TRP 73 HH2 TRP 73 19.976 -16.084 10.029 587 H LEU 74 H LEU 74 13.229 -15.298 12.551 588 HA LEU 74 HA LEU 74 16.006 -14.870 13.367 589 HB2 LEU 74 2HB LEU 74 14.858 -13.379 11.763 590 HB3 LEU 74 3HB LEU 74 13.669 -12.964 12.998 591 HG LEU 74 HG LEU 74 15.450 -11.963 14.402 592 HD11 LEU 74 1HD1 LEU 74 17.706 -11.603 13.400 593 HD12 LEU 74 2HD1 LEU 74 17.381 -13.322 13.683 594 HD13 LEU 74 3HD1 LEU 74 17.257 -12.650 12.038 595 HD21 LEU 74 3HD2 LEU 74 14.221 -10.601 12.760 596 HD22 LEU 74 1HD2 LEU 74 15.892 -10.021 12.954 597 HD23 LEU 74 2HD2 LEU 74 15.444 -10.975 11.524 598 H TYR 75 H TYR 75 12.744 -14.829 14.855 599 HA TYR 75 HA TYR 75 13.533 -13.607 17.311 600 HB2 TYR 75 2HB TYR 75 11.356 -15.632 16.678 601 HB3 TYR 75 3HB TYR 75 11.513 -14.792 18.220 602 HD1 TYR 75 HD1 TYR 75 12.423 -12.294 15.978 603 HD2 TYR 75 HD2 TYR 75 8.996 -14.616 17.161 604 HE1 TYR 75 HE1 TYR 75 10.930 -10.503 15.165 605 HE2 TYR 75 HE2 TYR 75 7.494 -12.818 16.326 606 HH TYR 75 HH TYR 75 8.774 -9.816 14.856 607 H ARG 76 H ARG 76 13.820 -16.951 16.089 608 HA ARG 76 HA ARG 76 14.445 -18.030 18.700 609 HB2 ARG 76 2HB ARG 76 15.121 -20.052 17.474 610 HB3 ARG 76 3HB ARG 76 13.485 -19.497 17.087 611 HG2 ARG 76 2HG ARG 76 14.276 -18.476 15.020 612 HG3 ARG 76 3HG ARG 76 15.958 -18.945 15.385 613 HD2 ARG 76 2HD ARG 76 13.651 -20.906 15.131 614 HD3 ARG 76 3HD ARG 76 14.711 -20.474 13.778 615 HE ARG 76 HE ARG 76 15.339 -22.220 16.028 616 HH11 ARG 76 1HH1 ARG 76 16.695 -20.152 13.492 617 HH12 ARG 76 2HH1 ARG 76 18.237 -20.978 13.488 618 HH21 ARG 76 1HH2 ARG 76 17.362 -23.276 15.983 619 HH22 ARG 76 2HH2 ARG 76 18.610 -22.743 14.881 620 H ILE 77 H ILE 77 16.357 -16.347 16.239 621 HA ILE 77 HA ILE 77 18.890 -17.390 17.162 622 HB ILE 77 HB ILE 77 18.351 -14.677 15.900 623 HG12 ILE 77 2HG1 ILE 77 17.395 -16.344 14.418 624 HG13 ILE 77 3HG1 ILE 77 18.868 -15.671 13.730 625 HG21 ILE 77 1HG2 ILE 77 20.702 -14.966 15.094 626 HG22 ILE 77 2HG2 ILE 77 20.578 -14.883 16.861 627 HG23 ILE 77 3HG2 ILE 77 20.820 -16.451 16.064 628 HD11 ILE 77 3HD1 ILE 77 18.652 -18.369 15.126 629 HD12 ILE 77 1HD1 ILE 77 18.753 -18.093 13.372 630 HD13 ILE 77 2HD1 ILE 77 20.134 -17.683 14.406 631 H ALA 78 H ALA 78 16.756 -14.696 18.143 632 HA ALA 78 HA ALA 78 18.799 -13.471 19.781 633 HB1 ALA 78 1HB ALA 78 15.791 -13.015 19.627 634 HB2 ALA 78 2HB ALA 78 16.966 -11.943 20.426 635 HB3 ALA 78 3HB ALA 78 17.029 -12.175 18.668 636 H VAL 79 H VAL 79 16.035 -15.686 20.469 637 HA VAL 79 HA VAL 79 16.403 -15.337 23.341 638 HB VAL 79 HB VAL 79 14.204 -15.779 22.397 639 HG11 VAL 79 1HG1 VAL 79 15.271 -18.550 21.738 640 HG12 VAL 79 2HG1 VAL 79 13.603 -17.973 21.519 641 HG13 VAL 79 3HG1 VAL 79 14.913 -17.274 20.543 642 HG21 VAL 79 3HG2 VAL 79 15.152 -18.115 24.116 643 HG22 VAL 79 1HG2 VAL 79 14.776 -16.491 24.734 644 HG23 VAL 79 2HG2 VAL 79 13.497 -17.476 23.990 645 H ASN 80 H ASN 80 17.608 -17.590 20.868 646 HA ASN 80 HA ASN 80 18.601 -19.483 22.846 647 HB2 ASN 80 2HB ASN 80 19.177 -19.075 19.888 648 HB3 ASN 80 3HB ASN 80 19.867 -20.380 20.857 649 HD21 ASN 80 2HD2 ASN 80 18.459 -21.173 18.707 650 HD22 ASN 80 1HD2 ASN 80 16.912 -21.835 19.193 651 H THR 81 H THR 81 19.752 -16.471 21.404 652 HA THR 81 HA THR 81 22.513 -16.926 22.242 653 HB THR 81 HB THR 81 21.064 -14.430 21.276 654 HG1 THR 81 1HG THR 81 21.203 -15.912 19.662 655 HG21 THR 81 1HG2 THR 81 24.029 -15.033 21.664 656 HG22 THR 81 2HG2 THR 81 23.373 -13.604 20.824 657 HG23 THR 81 3HG2 THR 81 23.084 -13.831 22.562 658 H ALA 82 H ALA 82 19.570 -15.458 23.625 659 HA ALA 82 HA ALA 82 20.983 -14.025 25.704 660 HB1 ALA 82 1HB ALA 82 18.736 -13.400 24.873 661 HB2 ALA 82 2HB ALA 82 18.084 -14.944 25.473 662 HB3 ALA 82 3HB ALA 82 18.703 -13.737 26.620 663 H LYS 83 H LYS 83 19.539 -17.281 25.406 664 HA LYS 83 HA LYS 83 19.914 -17.866 28.231 665 HB2 LYS 83 2HB LYS 83 19.239 -19.566 25.801 666 HB3 LYS 83 3HB LYS 83 19.325 -20.202 27.458 667 HG2 LYS 83 2HG LYS 83 17.594 -18.653 28.202 668 HG3 LYS 83 3HG LYS 83 17.529 -17.889 26.601 669 HD2 LYS 83 2HD LYS 83 16.787 -20.000 25.591 670 HD3 LYS 83 3HD LYS 83 16.887 -20.815 27.165 671 HE2 LYS 83 2HE LYS 83 15.111 -18.411 26.565 672 HE3 LYS 83 3HE LYS 83 14.565 -20.090 26.518 673 HZ1 LYS 83 3HZ LYS 83 14.072 -19.087 28.628 674 HZ2 LYS 83 1HZ LYS 83 15.168 -20.289 28.832 675 HZ3 LYS 83 2HZ LYS 83 15.654 -18.719 28.888 676 H ASN 84 H ASN 84 21.824 -18.169 25.268 677 HA ASN 84 HA ASN 84 23.812 -19.890 26.527 678 HB2 ASN 84 2HB ASN 84 23.290 -19.841 24.064 679 HB3 ASN 84 3HB ASN 84 23.987 -18.216 23.990 680 HD21 ASN 84 2HD2 ASN 84 25.571 -18.990 22.476 681 HD22 ASN 84 1HD2 ASN 84 26.943 -19.940 23.025 682 H TYR 85 H TYR 85 23.170 -16.439 26.254 683 HA TYR 85 HA TYR 85 25.857 -15.539 26.771 684 HB2 TYR 85 2HB TYR 85 24.129 -14.218 25.626 685 HB3 TYR 85 3HB TYR 85 23.144 -14.209 27.095 686 HD1 TYR 85 HD1 TYR 85 26.424 -13.083 25.693 687 HD2 TYR 85 HD2 TYR 85 23.416 -12.529 28.714 688 HE1 TYR 85 HE1 TYR 85 27.480 -10.935 26.343 689 HE2 TYR 85 HE2 TYR 85 24.484 -10.403 29.402 690 HH TYR 85 HH TYR 85 27.402 -9.120 27.740 691 H LEU 86 H LEU 86 22.999 -16.241 28.830 692 HA LEU 86 HA LEU 86 24.324 -15.170 31.198 693 HB2 LEU 86 2HB LEU 86 21.761 -16.761 30.807 694 HB3 LEU 86 3HB LEU 86 22.321 -16.133 32.365 695 HG LEU 86 HG LEU 86 21.648 -14.437 29.926 696 HD11 LEU 86 1HD1 LEU 86 20.278 -14.857 32.622 697 HD12 LEU 86 2HD1 LEU 86 19.791 -13.670 31.394 698 HD13 LEU 86 3HD1 LEU 86 19.681 -15.408 31.041 699 HD21 LEU 86 3HD2 LEU 86 22.541 -13.674 32.741 700 HD22 LEU 86 1HD2 LEU 86 23.419 -13.342 31.227 701 HD23 LEU 86 2HD2 LEU 86 21.876 -12.538 31.548 702 H VAL 87 H VAL 87 24.140 -18.404 29.696 703 HA VAL 87 HA VAL 87 25.142 -19.596 32.188 704 HB VAL 87 HB VAL 87 25.250 -21.687 30.935 705 HG11 VAL 87 1HG1 VAL 87 23.143 -21.007 32.008 706 HG12 VAL 87 2HG1 VAL 87 22.640 -20.167 30.521 707 HG13 VAL 87 3HG1 VAL 87 22.839 -21.934 30.520 708 HG21 VAL 87 3HG2 VAL 87 25.877 -20.864 28.722 709 HG22 VAL 87 1HG2 VAL 87 24.373 -21.800 28.622 710 HG23 VAL 87 2HG2 VAL 87 24.321 -20.019 28.568 711 H ALA 88 H ALA 88 26.482 -18.108 29.336 712 HA ALA 88 HA ALA 88 29.082 -19.392 29.618 713 HB1 ALA 88 1HB ALA 88 28.194 -16.935 28.052 714 HB2 ALA 88 2HB ALA 88 29.755 -17.771 27.877 715 HB3 ALA 88 3HB ALA 88 28.249 -18.606 27.434 716 H GLN 89 H GLN 89 27.444 -16.928 31.320 717 HA GLN 89 HA GLN 89 30.056 -15.893 32.354 718 HB2 GLN 89 2HB GLN 89 27.353 -14.506 32.267 719 HB3 GLN 89 3HB GLN 89 28.873 -13.836 32.902 720 HG2 GLN 89 2HG GLN 89 29.892 -14.054 30.642 721 HG3 GLN 89 3HG GLN 89 28.358 -14.678 30.012 722 HE21 GLN 89 2HE2 GLN 89 28.510 -12.820 28.493 723 HE22 GLN 89 1HE2 GLN 89 27.971 -11.248 29.045 724 H GLY 90 H GLY 90 26.998 -17.453 33.113 725 HA2 GLY 90 2HA GLY 90 27.404 -17.048 36.019 726 HA3 GLY 90 3HA GLY 90 25.960 -17.685 35.219 727 H ARG 91 H ARG 91 28.129 -19.398 33.587 728 HA ARG 91 HA ARG 91 28.560 -21.436 35.708 729 HB2 ARG 91 2HB ARG 91 27.503 -22.074 32.928 730 HB3 ARG 91 3HB ARG 91 27.786 -23.196 34.263 731 HG2 ARG 91 2HG ARG 91 26.079 -21.891 35.620 732 HG3 ARG 91 3HG ARG 91 25.714 -20.965 34.151 733 HD2 ARG 91 2HD ARG 91 24.108 -22.759 34.327 734 HD3 ARG 91 3HD ARG 91 25.202 -23.128 32.982 735 HE ARG 91 HE ARG 91 25.941 -24.274 35.595 736 HH11 ARG 91 1HH1 ARG 91 24.259 -24.833 32.525 737 HH12 ARG 91 2HH1 ARG 91 24.347 -26.573 32.685 738 HH21 ARG 91 1HH2 ARG 91 26.039 -26.478 35.765 739 HH22 ARG 91 2HH2 ARG 91 25.352 -27.514 34.529 740 H ARG 92 H ARG 92 30.283 -19.424 34.129 741 HA ARG 92 HA ARG 92 31.908 -20.840 32.283 742 HB2 ARG 92 2HB ARG 92 31.721 -18.366 32.592 743 HB3 ARG 92 3HB ARG 92 32.650 -18.511 34.097 744 HG2 ARG 92 2HG ARG 92 34.590 -19.367 32.876 745 HG3 ARG 92 3HG ARG 92 33.656 -19.428 31.367 746 HD2 ARG 92 2HD ARG 92 34.259 -16.901 32.954 747 HD3 ARG 92 3HD ARG 92 35.149 -17.442 31.518 748 HE ARG 92 HE ARG 92 32.318 -17.274 30.992 749 HH11 ARG 92 1HH1 ARG 92 35.219 -15.282 31.335 750 HH12 ARG 92 2HH1 ARG 92 34.602 -14.013 30.302 751 HH21 ARG 92 1HH2 ARG 92 31.548 -15.621 29.667 752 HH22 ARG 92 2HH2 ARG 92 32.522 -14.199 29.357 753 H LEU 93 H LEU 93 31.708 -21.135 35.721 754 HA LEU 93 HA LEU 93 34.436 -22.316 35.857 755 HB2 LEU 93 2HB LEU 93 32.649 -21.167 38.026 756 HB3 LEU 93 3HB LEU 93 34.253 -21.874 38.289 757 HG LEU 93 HG LEU 93 33.646 -19.402 36.605 758 HD11 LEU 93 1HD1 LEU 93 35.014 -19.747 39.307 759 HD12 LEU 93 2HD1 LEU 93 34.838 -18.219 38.412 760 HD13 LEU 93 3HD1 LEU 93 33.400 -19.053 39.042 761 HD21 LEU 93 3HD2 LEU 93 36.285 -20.737 37.355 762 HD22 LEU 93 1HD2 LEU 93 35.601 -20.595 35.715 763 HD23 LEU 93 2HD2 LEU 93 36.123 -19.141 36.585 764 H GLU 94 H GLU 94 31.483 -23.458 35.206 765 HA GLU 94 HA GLU 94 32.108 -25.995 36.614 766 HB2 GLU 94 2HB GLU 94 29.813 -26.286 37.348 767 HB3 GLU 94 3HB GLU 94 30.473 -24.778 38.015 768 HG2 GLU 94 2HG GLU 94 29.307 -23.468 36.305 769 HG3 GLU 94 3HG GLU 94 28.707 -24.956 35.542 770 H LEU 95 H LEU 95 30.815 -24.315 33.827 771 HA LEU 95 HA LEU 95 29.903 -26.876 32.649 772 HB2 LEU 95 2HB LEU 95 28.378 -24.926 32.677 773 HB3 LEU 95 3HB LEU 95 29.557 -23.986 31.747 774 HG LEU 95 HG LEU 95 29.321 -25.533 29.846 775 HD11 LEU 95 1HD1 LEU 95 27.246 -26.913 31.608 776 HD12 LEU 95 2HD1 LEU 95 27.506 -27.230 29.874 777 HD13 LEU 95 3HD1 LEU 95 28.780 -27.623 31.042 778 HD21 LEU 95 3HD2 LEU 95 26.662 -24.554 30.954 779 HD22 LEU 95 1HD2 LEU 95 27.839 -23.568 30.058 780 HD23 LEU 95 2HD2 LEU 95 27.016 -24.915 29.246 781 H VAL 96 H VAL 96 32.524 -24.600 32.576 782 HA VAL 96 HA VAL 96 33.486 -25.503 29.947 783 HB VAL 96 HB VAL 96 34.712 -23.605 31.978 784 HG11 VAL 96 1HG1 VAL 96 35.424 -24.214 29.074 785 HG12 VAL 96 2HG1 VAL 96 36.129 -22.919 30.070 786 HG13 VAL 96 3HG1 VAL 96 36.412 -24.619 30.496 787 HG21 VAL 96 3HG2 VAL 96 33.187 -23.104 29.386 788 HG22 VAL 96 1HG2 VAL 96 32.586 -22.768 31.030 789 HG23 VAL 96 2HG2 VAL 96 33.974 -21.867 30.390 790 HA PRO 97 HA PRO 97 36.634 -27.776 32.689 791 HB2 PRO 97 2HB PRO 97 36.372 -27.966 35.381 792 HB3 PRO 97 3HB PRO 97 37.074 -26.500 34.614 793 HG2 PRO 97 2HG PRO 97 34.202 -26.936 35.501 794 HG3 PRO 97 3HG PRO 97 35.280 -25.560 35.912 795 HD2 PRO 97 2HD PRO 97 33.486 -25.441 33.874 796 HD3 PRO 97 3HD PRO 97 35.091 -24.654 33.752 797 H ARG 98 H ARG 98 33.263 -27.923 32.755 798 HA ARG 98 HA ARG 98 31.708 -29.547 32.932 799 HB2 ARG 98 2HB ARG 98 34.009 -31.280 31.973 800 HB3 ARG 98 3HB ARG 98 32.290 -31.716 31.912 801 HG2 ARG 98 2HG ARG 98 31.829 -29.751 30.480 802 HG3 ARG 98 3HG ARG 98 33.552 -29.320 30.500 803 HD2 ARG 98 2HD ARG 98 32.394 -31.936 29.455 804 HD3 ARG 98 3HD ARG 98 32.900 -30.564 28.450 805 HE ARG 98 HE ARG 98 35.100 -31.222 30.067 806 HH11 ARG 98 1HH1 ARG 98 33.165 -32.744 27.521 807 HH12 ARG 98 2HH1 ARG 98 34.492 -33.725 26.941 808 HH21 ARG 98 1HH2 ARG 98 36.808 -32.519 29.291 809 HH22 ARG 98 2HH2 ARG 98 36.546 -33.601 27.943 810 H GLY 99 H GLY 99 33.157 -28.967 35.403 811 HA2 GLY 99 2HA GLY 99 32.107 -31.093 37.015 812 HA3 GLY 99 3HA GLY 99 33.872 -31.209 36.915 813 H SER 100 H SER 100 33.149 -30.847 39.368 814 HA SER 100 HA SER 100 32.700 -28.057 40.080 815 HB2 SER 100 2HB SER 100 31.722 -29.957 41.337 816 HB3 SER 100 3HB SER 100 33.356 -30.489 41.781 817 HG SER 100 HG SER 100 32.116 -28.020 42.443 818 H HIS 101 H HIS 101 35.444 -29.921 39.249 819 HA HIS 101 HA HIS 101 37.663 -29.694 39.501 820 HB2 HIS 101 2HB HIS 101 37.022 -27.651 38.227 821 HB3 HIS 101 3HB HIS 101 37.049 -26.737 39.737 822 HD2 HIS 101 HD2 HIS 101 39.250 -25.395 39.902 823 HE1 HIS 101 HE1 HIS 101 41.962 -28.155 38.138 824 HE2 HIS 101 HE2 HIS 101 41.737 -25.866 39.233 825 H HIS 102 H HIS 102 36.164 -30.194 41.961 826 HA HIS 102 HA HIS 102 38.248 -29.408 43.907 827 HB2 HIS 102 2HB HIS 102 36.451 -27.695 44.016 828 HB3 HIS 102 3HB HIS 102 35.272 -28.974 44.333 829 HD2 HIS 102 HD2 HIS 102 34.612 -28.812 46.813 830 HE1 HIS 102 HE1 HIS 102 38.444 -28.227 48.568 831 HE2 HIS 102 HE2 HIS 102 35.961 -28.540 49.046 832 H HIS 103 H HIS 103 38.106 -30.716 45.902 833 HA HIS 103 HA HIS 103 36.654 -33.287 45.583 834 HB2 HIS 103 2HB HIS 103 39.650 -33.018 46.033 835 HB3 HIS 103 3HB HIS 103 38.726 -34.522 46.089 836 HD2 HIS 103 HD2 HIS 103 40.361 -32.097 43.664 837 HE1 HIS 103 HE1 HIS 103 38.522 -35.089 41.261 838 HE2 HIS 103 HE2 HIS 103 40.112 -33.096 41.253 839 H HIS 104 H HIS 104 36.781 -34.621 47.571 840 HA HIS 104 HA HIS 104 37.396 -33.156 50.058 841 HB2 HIS 104 2HB HIS 104 35.186 -33.578 50.980 842 HB3 HIS 104 3HB HIS 104 35.051 -32.590 49.526 843 HD2 HIS 104 HD2 HIS 104 33.984 -35.926 51.011 844 HE1 HIS 104 HE1 HIS 104 32.473 -35.905 47.038 845 HE2 HIS 104 HE2 HIS 104 32.424 -37.118 49.277 846 H HIS 105 H HIS 105 36.960 -34.671 51.987 847 HA HIS 105 HA HIS 105 37.507 -37.510 51.280 848 HB2 HIS 105 2HB HIS 105 39.062 -35.840 53.283 849 HB3 HIS 105 3HB HIS 105 39.281 -37.566 52.972 850 HD2 HIS 105 HD2 HIS 105 40.336 -38.260 50.531 851 HE1 HIS 105 HE1 HIS 105 41.943 -34.417 49.666 852 HE2 HIS 105 HE2 HIS 105 41.959 -36.878 49.004 853 H HIS 106 H HIS 106 37.207 -38.975 53.096 854 HA HIS 106 HA HIS 106 35.730 -39.922 54.538 855 HB2 HIS 106 2HB HIS 106 36.364 -37.409 56.113 856 HB3 HIS 106 3HB HIS 106 35.744 -38.926 56.775 857 HD2 HIS 106 HD2 HIS 106 38.944 -37.161 55.998 858 HE1 HIS 106 HE1 HIS 106 40.074 -41.219 56.582 859 HE2 HIS 106 HE2 HIS 106 40.933 -38.837 56.337 Start of MODEL 7 1 H1 MET 1 H1 MET 1 -0.424 5.398 -4.913 2 H2 MET 1 H2 MET 1 -1.016 5.528 -6.437 3 H3 MET 1 H3 MET 1 0.264 6.458 -5.969 4 HA MET 1 HA MET 1 0.255 3.535 -6.218 5 HB2 MET 1 2HB MET 1 0.175 4.714 -8.388 6 HB3 MET 1 3HB MET 1 1.627 5.628 -7.944 7 HG2 MET 1 2HG MET 1 2.914 3.537 -7.769 8 HG3 MET 1 3HG MET 1 1.459 2.597 -8.109 9 HE1 MET 1 1HE MET 1 3.669 5.298 -11.171 10 HE2 MET 1 2HE MET 1 2.719 5.966 -9.825 11 HE3 MET 1 3HE MET 1 4.196 5.026 -9.498 12 H SER 2 H SER 2 1.834 2.496 -5.120 13 HA SER 2 HA SER 2 4.365 3.830 -4.498 14 HB2 SER 2 2HB SER 2 4.166 3.447 -2.078 15 HB3 SER 2 3HB SER 2 2.944 4.603 -2.650 16 HG SER 2 HG SER 2 1.430 2.919 -2.637 17 H GLU 3 H GLU 3 5.899 2.317 -3.448 18 HA GLU 3 HA GLU 3 5.201 -0.532 -3.530 19 HB2 GLU 3 2HB GLU 3 5.865 0.029 -5.858 20 HB3 GLU 3 3HB GLU 3 7.412 0.657 -5.256 21 HG2 GLU 3 2HG GLU 3 8.007 -1.569 -4.401 22 HG3 GLU 3 3HG GLU 3 6.423 -2.203 -4.890 23 H GLN 4 H GLN 4 6.685 -1.814 -2.309 24 HA GLN 4 HA GLN 4 8.984 -0.488 -1.050 25 HB2 GLN 4 2HB GLN 4 8.205 -1.041 1.233 26 HB3 GLN 4 3HB GLN 4 7.186 0.169 0.449 27 HG2 GLN 4 2HG GLN 4 5.526 -1.599 -0.118 28 HG3 GLN 4 3HG GLN 4 6.558 -2.821 0.633 29 HE21 GLN 4 2HE2 GLN 4 4.192 -2.920 1.684 30 HE22 GLN 4 1HE2 GLN 4 4.071 -2.074 3.210 31 H LEU 5 H LEU 5 10.049 -2.023 0.518 32 HA LEU 5 HA LEU 5 10.157 -4.739 -0.706 33 HB2 LEU 5 2HB LEU 5 12.255 -3.125 0.777 34 HB3 LEU 5 3HB LEU 5 12.500 -4.708 0.015 35 HG LEU 5 HG LEU 5 11.881 -2.072 -1.395 36 HD11 LEU 5 1HD1 LEU 5 14.186 -2.330 -0.525 37 HD12 LEU 5 2HD1 LEU 5 14.338 -3.874 -1.402 38 HD13 LEU 5 3HD1 LEU 5 14.135 -2.348 -2.303 39 HD21 LEU 5 3HD2 LEU 5 10.831 -3.980 -2.602 40 HD22 LEU 5 1HD2 LEU 5 12.211 -3.306 -3.491 41 HD23 LEU 5 2HD2 LEU 5 12.405 -4.825 -2.597 42 H THR 6 H THR 6 10.658 -6.505 0.717 43 HA THR 6 HA THR 6 9.861 -6.114 3.558 44 HB THR 6 HB THR 6 8.614 -8.145 1.654 45 HG1 THR 6 1HG THR 6 7.897 -6.047 1.246 46 HG21 THR 6 1HG2 THR 6 8.520 -9.040 3.876 47 HG22 THR 6 2HG2 THR 6 8.135 -7.443 4.577 48 HG23 THR 6 3HG2 THR 6 6.939 -8.311 3.578 49 H ASP 7 H ASP 7 10.119 -8.373 4.712 50 HA ASP 7 HA ASP 7 12.835 -9.044 4.673 51 HB2 ASP 7 2HB ASP 7 12.180 -10.876 6.159 52 HB3 ASP 7 3HB ASP 7 11.310 -9.393 6.555 53 H GLN 8 H GLN 8 10.334 -10.123 2.512 54 HA GLN 8 HA GLN 8 11.458 -12.650 1.765 55 HB2 GLN 8 2HB GLN 8 9.152 -12.007 1.226 56 HB3 GLN 8 3HB GLN 8 9.734 -10.635 0.269 57 HG2 GLN 8 2HG GLN 8 9.088 -12.499 -1.198 58 HG3 GLN 8 3HG GLN 8 10.814 -12.177 -1.325 59 HE21 GLN 8 2HE2 GLN 8 12.324 -13.681 -0.374 60 HE22 GLN 8 1HE2 GLN 8 11.835 -15.319 0.013 61 H VAL 9 H VAL 9 11.721 -9.372 0.308 62 HA VAL 9 HA VAL 9 13.750 -10.322 -1.581 63 HB VAL 9 HB VAL 9 12.071 -8.841 -2.424 64 HG11 VAL 9 1HG1 VAL 9 11.356 -7.783 -0.338 65 HG12 VAL 9 2HG1 VAL 9 12.893 -6.882 -0.254 66 HG13 VAL 9 3HG1 VAL 9 11.729 -6.566 -1.568 67 HG21 VAL 9 3HG2 VAL 9 14.598 -7.172 -2.044 68 HG22 VAL 9 1HG2 VAL 9 14.410 -8.475 -3.249 69 HG23 VAL 9 2HG2 VAL 9 13.399 -7.016 -3.339 70 H LEU 10 H LEU 10 13.631 -8.609 1.509 71 HA LEU 10 HA LEU 10 16.293 -7.512 1.310 72 HB2 LEU 10 2HB LEU 10 14.192 -7.855 3.411 73 HB3 LEU 10 3HB LEU 10 15.866 -7.702 3.969 74 HG LEU 10 HG LEU 10 16.156 -5.607 2.803 75 HD11 LEU 10 1HD1 LEU 10 13.277 -5.920 1.860 76 HD12 LEU 10 2HD1 LEU 10 14.285 -4.467 1.673 77 HD13 LEU 10 3HD1 LEU 10 14.740 -5.958 0.836 78 HD21 LEU 10 3HD2 LEU 10 13.525 -5.668 4.351 79 HD22 LEU 10 1HD2 LEU 10 15.156 -5.553 5.057 80 HD23 LEU 10 2HD2 LEU 10 14.526 -4.226 4.060 81 H VAL 11 H VAL 11 15.020 -10.715 2.249 82 HA VAL 11 HA VAL 11 17.639 -11.476 3.321 83 HB VAL 11 HB VAL 11 15.104 -13.047 2.796 84 HG11 VAL 11 1HG1 VAL 11 17.785 -13.942 3.932 85 HG12 VAL 11 2HG1 VAL 11 16.269 -14.858 4.095 86 HG13 VAL 11 3HG1 VAL 11 16.967 -14.583 2.487 87 HG21 VAL 11 3HG2 VAL 11 15.052 -13.137 5.258 88 HG22 VAL 11 1HG2 VAL 11 16.598 -12.262 5.349 89 HG23 VAL 11 2HG2 VAL 11 15.148 -11.437 4.743 90 H GLU 12 H GLU 12 15.915 -11.640 0.208 91 HA GLU 12 HA GLU 12 17.790 -13.491 -0.995 92 HB2 GLU 12 2HB GLU 12 15.864 -11.419 -2.108 93 HB3 GLU 12 3HB GLU 12 16.874 -12.449 -3.129 94 HG2 GLU 12 2HG GLU 12 15.867 -14.468 -2.105 95 HG3 GLU 12 3HG GLU 12 14.834 -13.443 -1.098 96 H ARG 13 H ARG 13 17.638 -9.944 -0.593 97 HA ARG 13 HA ARG 13 19.730 -9.422 -2.507 98 HB2 ARG 13 2HB ARG 13 17.963 -7.818 -1.953 99 HB3 ARG 13 3HB ARG 13 18.570 -7.686 -0.287 100 HG2 ARG 13 2HG ARG 13 20.606 -6.691 -1.012 101 HG3 ARG 13 3HG ARG 13 20.307 -7.131 -2.715 102 HD2 ARG 13 2HD ARG 13 18.288 -5.631 -2.666 103 HD3 ARG 13 3HD ARG 13 18.791 -5.082 -1.051 104 HE ARG 13 HE ARG 13 21.006 -4.808 -2.791 105 HH11 ARG 13 1HH1 ARG 13 17.800 -3.400 -2.333 106 HH12 ARG 13 2HH1 ARG 13 18.241 -1.874 -3.071 107 HH21 ARG 13 1HH2 ARG 13 21.536 -2.869 -3.778 108 HH22 ARG 13 2HH2 ARG 13 20.368 -1.561 -3.868 109 H VAL 14 H VAL 14 19.718 -9.916 1.045 110 HA VAL 14 HA VAL 14 22.503 -9.173 1.322 111 HB VAL 14 HB VAL 14 22.327 -10.163 3.553 112 HG11 VAL 14 1HG1 VAL 14 19.975 -8.443 2.672 113 HG12 VAL 14 2HG1 VAL 14 20.437 -8.723 4.357 114 HG13 VAL 14 3HG1 VAL 14 21.562 -7.887 3.250 115 HG21 VAL 14 3HG2 VAL 14 19.554 -11.014 2.657 116 HG22 VAL 14 1HG2 VAL 14 20.894 -12.091 3.120 117 HG23 VAL 14 2HG2 VAL 14 20.154 -11.028 4.338 118 H GLN 15 H GLN 15 20.810 -12.115 0.362 119 HA GLN 15 HA GLN 15 23.165 -13.811 0.692 120 HB2 GLN 15 2HB GLN 15 20.486 -14.167 -0.707 121 HB3 GLN 15 3HB GLN 15 21.747 -15.415 -0.649 122 HG2 GLN 15 2HG GLN 15 21.678 -15.446 1.803 123 HG3 GLN 15 3HG GLN 15 20.514 -14.133 1.826 124 HE21 GLN 15 2HE2 GLN 15 19.803 -16.420 3.159 125 HE22 GLN 15 1HE2 GLN 15 18.578 -17.287 2.261 126 H LYS 16 H LYS 16 22.069 -11.482 -1.608 127 HA LYS 16 HA LYS 16 23.684 -12.602 -3.795 128 HB2 LYS 16 2HB LYS 16 21.765 -10.277 -3.564 129 HB3 LYS 16 3HB LYS 16 22.745 -10.564 -5.015 130 HG2 LYS 16 2HG LYS 16 21.806 -12.774 -5.319 131 HG3 LYS 16 3HG LYS 16 20.987 -12.702 -3.749 132 HD2 LYS 16 2HD LYS 16 19.640 -10.765 -4.585 133 HD3 LYS 16 3HD LYS 16 20.377 -10.994 -6.191 134 HE2 LYS 16 2HE LYS 16 19.522 -13.328 -6.227 135 HE3 LYS 16 3HE LYS 16 18.816 -13.100 -4.623 136 HZ1 LYS 16 3HZ LYS 16 17.181 -12.804 -6.348 137 HZ2 LYS 16 1HZ LYS 16 17.420 -11.371 -5.571 138 HZ3 LYS 16 2HZ LYS 16 18.066 -11.625 -7.060 139 H GLY 17 H GLY 17 24.427 -10.915 -1.058 140 HA2 GLY 17 2HA GLY 17 26.751 -10.451 -0.713 141 HA3 GLY 17 3HA GLY 17 26.883 -9.871 -2.378 142 H ASP 18 H ASP 18 24.004 -8.579 -1.206 143 HA ASP 18 HA ASP 18 25.347 -6.002 -0.631 144 HB2 ASP 18 2HB ASP 18 22.592 -6.901 -1.453 145 HB3 ASP 18 3HB ASP 18 22.795 -5.335 -0.678 146 H GLN 19 H GLN 19 26.167 -6.595 1.464 147 HA GLN 19 HA GLN 19 24.486 -7.532 3.576 148 HB2 GLN 19 2HB GLN 19 26.943 -7.738 3.467 149 HB3 GLN 19 3HB GLN 19 27.126 -5.993 3.652 150 HG2 GLN 19 2HG GLN 19 25.603 -7.660 5.684 151 HG3 GLN 19 3HG GLN 19 27.363 -7.570 5.732 152 HE21 GLN 19 2HE2 GLN 19 25.934 -6.719 7.921 153 HE22 GLN 19 1HE2 GLN 19 26.059 -4.978 8.063 154 H LYS 20 H LYS 20 24.880 -4.403 2.100 155 HA LYS 20 HA LYS 20 24.081 -2.719 4.246 156 HB2 LYS 20 2HB LYS 20 23.552 -1.135 2.433 157 HB3 LYS 20 3HB LYS 20 25.099 -1.950 2.144 158 HG2 LYS 20 2HG LYS 20 23.875 -3.579 0.634 159 HG3 LYS 20 3HG LYS 20 22.424 -2.572 0.823 160 HD2 LYS 20 2HD LYS 20 23.651 -0.632 -0.099 161 HD3 LYS 20 3HD LYS 20 25.112 -1.643 -0.261 162 HE2 LYS 20 2HE LYS 20 23.872 -3.169 -1.778 163 HE3 LYS 20 3HE LYS 20 22.453 -2.118 -1.661 164 HZ1 LYS 20 3HZ LYS 20 25.091 -1.321 -2.700 165 HZ2 LYS 20 1HZ LYS 20 23.778 -1.653 -3.619 166 HZ3 LYS 20 2HZ LYS 20 23.763 -0.351 -2.612 167 H ALA 21 H ALA 21 22.249 -5.001 2.274 168 HA ALA 21 HA ALA 21 19.695 -3.763 2.958 169 HB1 ALA 21 1HB ALA 21 20.387 -6.446 1.701 170 HB2 ALA 21 2HB ALA 21 18.752 -5.766 1.849 171 HB3 ALA 21 3HB ALA 21 19.962 -4.952 0.830 172 H PHE 22 H PHE 22 21.935 -5.984 4.469 173 HA PHE 22 HA PHE 22 19.925 -7.255 6.144 174 HB2 PHE 22 2HB PHE 22 22.106 -8.324 5.600 175 HB3 PHE 22 3HB PHE 22 22.939 -7.054 6.487 176 HD1 PHE 22 HD1 PHE 22 20.111 -9.506 6.985 177 HD2 PHE 22 HD2 PHE 22 23.505 -7.502 8.713 178 HE1 PHE 22 HE1 PHE 22 19.804 -10.787 9.067 179 HE2 PHE 22 HE2 PHE 22 23.189 -8.794 10.809 180 HZ PHE 22 HZ PHE 22 21.342 -10.436 10.990 181 H ASN 23 H ASN 23 22.130 -4.450 6.338 182 HA ASN 23 HA ASN 23 21.668 -3.763 9.072 183 HB2 ASN 23 2HB ASN 23 23.470 -2.742 7.863 184 HB3 ASN 23 3HB ASN 23 22.405 -2.262 6.543 185 HD21 ASN 23 2HD2 ASN 23 21.320 -0.338 6.606 186 HD22 ASN 23 1HD2 ASN 23 21.419 0.794 7.933 187 H LEU 24 H LEU 24 19.950 -2.970 6.044 188 HA LEU 24 HA LEU 24 17.972 -1.316 7.370 189 HB2 LEU 24 2HB LEU 24 18.067 -2.626 4.623 190 HB3 LEU 24 3HB LEU 24 16.857 -1.439 5.136 191 HG LEU 24 HG LEU 24 19.867 -0.913 5.053 192 HD11 LEU 24 1HD1 LEU 24 17.658 -0.091 3.129 193 HD12 LEU 24 2HD1 LEU 24 19.360 0.417 3.039 194 HD13 LEU 24 3HD1 LEU 24 18.926 -1.289 2.805 195 HD21 LEU 24 3HD2 LEU 24 17.470 0.935 5.423 196 HD22 LEU 24 1HD2 LEU 24 18.673 0.520 6.674 197 HD23 LEU 24 2HD2 LEU 24 19.161 1.458 5.248 198 H LEU 25 H LEU 25 18.385 -4.745 6.907 199 HA LEU 25 HA LEU 25 15.536 -5.333 7.264 200 HB2 LEU 25 2HB LEU 25 16.937 -6.754 5.839 201 HB3 LEU 25 3HB LEU 25 18.027 -7.085 7.189 202 HG LEU 25 HG LEU 25 16.206 -8.228 8.400 203 HD11 LEU 25 1HD1 LEU 25 14.591 -7.715 5.860 204 HD12 LEU 25 2HD1 LEU 25 14.109 -8.787 7.190 205 HD13 LEU 25 3HD1 LEU 25 14.246 -7.039 7.471 206 HD21 LEU 25 3HD2 LEU 25 16.643 -9.167 5.535 207 HD22 LEU 25 1HD2 LEU 25 17.695 -9.502 6.934 208 HD23 LEU 25 2HD2 LEU 25 16.052 -10.179 6.869 209 H VAL 26 H VAL 26 18.556 -5.610 9.280 210 HA VAL 26 HA VAL 26 17.098 -6.813 11.430 211 HB VAL 26 HB VAL 26 19.021 -6.430 12.808 212 HG11 VAL 26 1HG1 VAL 26 19.141 -8.257 11.180 213 HG12 VAL 26 2HG1 VAL 26 19.885 -7.168 9.988 214 HG13 VAL 26 3HG1 VAL 26 20.742 -7.548 11.497 215 HG21 VAL 26 3HG2 VAL 26 20.988 -5.178 12.010 216 HG22 VAL 26 1HG2 VAL 26 20.054 -4.625 10.594 217 HG23 VAL 26 2HG2 VAL 26 19.569 -4.140 12.238 218 H VAL 27 H VAL 27 17.444 -3.414 10.468 219 HA VAL 27 HA VAL 27 16.864 -2.422 13.108 220 HB VAL 27 HB VAL 27 18.010 -1.097 11.398 221 HG11 VAL 27 1HG1 VAL 27 15.288 -0.948 10.030 222 HG12 VAL 27 2HG1 VAL 27 16.744 -0.040 9.576 223 HG13 VAL 27 3HG1 VAL 27 16.718 -1.812 9.424 224 HG21 VAL 27 3HG2 VAL 27 15.378 0.148 12.290 225 HG22 VAL 27 1HG2 VAL 27 16.844 -0.002 13.289 226 HG23 VAL 27 2HG2 VAL 27 16.865 1.011 11.835 227 H ARG 28 H ARG 28 14.831 -3.648 10.474 228 HA ARG 28 HA ARG 28 12.350 -2.553 11.462 229 HB2 ARG 28 2HB ARG 28 12.778 -5.164 9.949 230 HB3 ARG 28 3HB ARG 28 11.309 -4.175 10.001 231 HG2 ARG 28 2HG ARG 28 12.542 -2.353 8.804 232 HG3 ARG 28 3HG ARG 28 13.969 -3.417 8.740 233 HD2 ARG 28 2HD ARG 28 12.862 -3.575 6.630 234 HD3 ARG 28 3HD ARG 28 12.627 -5.104 7.490 235 HE ARG 28 HE ARG 28 10.361 -3.861 8.183 236 HH11 ARG 28 1HH1 ARG 28 11.946 -3.989 5.016 237 HH12 ARG 28 2HH1 ARG 28 10.441 -3.841 4.138 238 HH21 ARG 28 1HH2 ARG 28 8.422 -3.689 6.996 239 HH22 ARG 28 2HH2 ARG 28 8.465 -3.673 5.247 240 H TYR 29 H TYR 29 14.353 -5.338 12.232 241 HA TYR 29 HA TYR 29 12.276 -6.370 14.080 242 HB2 TYR 29 2HB TYR 29 14.799 -7.584 12.924 243 HB3 TYR 29 3HB TYR 29 13.781 -8.374 14.132 244 HD1 TYR 29 HD2 TYR 29 13.887 -7.153 10.628 245 HD2 TYR 29 HD1 TYR 29 11.667 -9.328 13.587 246 HE1 TYR 29 HE2 TYR 29 12.327 -7.928 8.867 247 HE2 TYR 29 HE1 TYR 29 10.121 -10.154 11.841 248 HH TYR 29 HH TYR 29 9.569 -10.111 9.599 249 H GLN 30 H GLN 30 15.016 -4.355 14.196 250 HA GLN 30 HA GLN 30 16.354 -5.308 16.503 251 HB2 GLN 30 2HB GLN 30 17.213 -3.664 14.867 252 HB3 GLN 30 3HB GLN 30 16.041 -2.469 15.450 253 HG2 GLN 30 2HG GLN 30 17.097 -2.467 17.652 254 HG3 GLN 30 3HG GLN 30 18.185 -3.787 17.164 255 HE21 GLN 30 2HE2 GLN 30 19.438 -3.278 15.010 256 HE22 GLN 30 1HE2 GLN 30 20.131 -1.672 14.917 257 H HIS 31 H HIS 31 13.385 -3.424 16.097 258 HA HIS 31 HA HIS 31 13.211 -2.855 18.980 259 HB2 HIS 31 2HB HIS 31 11.275 -2.439 16.673 260 HB3 HIS 31 3HB HIS 31 11.024 -1.882 18.330 261 HD2 HIS 31 HD2 HIS 31 12.863 -1.003 15.107 262 HE1 HIS 31 HE1 HIS 31 13.970 1.985 17.923 263 HE2 HIS 31 HE2 HIS 31 14.058 1.296 15.469 264 H LYS 32 H LYS 32 11.982 -5.208 16.628 265 HA LYS 32 HA LYS 32 9.917 -6.231 18.392 266 HB2 LYS 32 2HB LYS 32 11.172 -7.378 15.871 267 HB3 LYS 32 3HB LYS 32 9.714 -8.005 16.672 268 HG2 LYS 32 2HG LYS 32 8.558 -5.867 16.334 269 HG3 LYS 32 3HG LYS 32 10.005 -5.179 15.566 270 HD2 LYS 32 2HD LYS 32 9.879 -6.838 13.764 271 HD3 LYS 32 3HD LYS 32 8.491 -7.624 14.547 272 HE2 LYS 32 2HE LYS 32 7.745 -6.164 12.725 273 HE3 LYS 32 3HE LYS 32 7.155 -5.591 14.295 274 HZ1 LYS 32 3HZ LYS 32 9.518 -4.514 12.902 275 HZ2 LYS 32 1HZ LYS 32 8.030 -3.815 12.905 276 HZ3 LYS 32 2HZ LYS 32 8.876 -3.951 14.306 277 H VAL 33 H VAL 33 13.269 -7.322 17.573 278 HA VAL 33 HA VAL 33 12.893 -9.686 19.231 279 HB VAL 33 HB VAL 33 15.138 -10.278 18.707 280 HG11 VAL 33 1HG1 VAL 33 13.431 -10.627 16.962 281 HG12 VAL 33 2HG1 VAL 33 13.824 -9.045 16.252 282 HG13 VAL 33 3HG1 VAL 33 15.041 -10.339 16.260 283 HG21 VAL 33 3HG2 VAL 33 16.282 -8.158 18.962 284 HG22 VAL 33 1HG2 VAL 33 16.628 -8.842 17.362 285 HG23 VAL 33 2HG2 VAL 33 15.471 -7.497 17.523 286 H ALA 34 H ALA 34 14.118 -6.400 19.692 287 HA ALA 34 HA ALA 34 15.552 -6.975 22.115 288 HB1 ALA 34 1HB ALA 34 14.229 -4.404 21.151 289 HB2 ALA 34 2HB ALA 34 15.405 -4.537 22.477 290 HB3 ALA 34 3HB ALA 34 15.906 -4.918 20.818 291 H SER 35 H SER 35 12.154 -6.651 21.303 292 HA SER 35 HA SER 35 11.251 -6.044 23.988 293 HB2 SER 35 2HB SER 35 9.998 -5.466 21.915 294 HB3 SER 35 3HB SER 35 9.758 -7.203 21.606 295 HG SER 35 HG SER 35 7.998 -6.243 22.715 296 H LEU 36 H LEU 36 11.496 -9.009 21.946 297 HA LEU 36 HA LEU 36 10.341 -10.625 24.067 298 HB2 LEU 36 2HB LEU 36 10.569 -12.473 22.556 299 HB3 LEU 36 3HB LEU 36 9.948 -11.066 21.687 300 HG LEU 36 HG LEU 36 12.450 -10.678 21.011 301 HD11 LEU 36 1HD1 LEU 36 13.480 -12.466 22.435 302 HD12 LEU 36 2HD1 LEU 36 12.455 -13.671 21.626 303 HD13 LEU 36 3HD1 LEU 36 13.699 -12.792 20.711 304 HD21 LEU 36 3HD2 LEU 36 10.801 -13.000 19.937 305 HD22 LEU 36 1HD2 LEU 36 10.611 -11.290 19.484 306 HD23 LEU 36 2HD2 LEU 36 12.106 -12.161 19.065 307 H VAL 37 H VAL 37 13.596 -9.658 23.172 308 HA VAL 37 HA VAL 37 14.745 -11.877 24.703 309 HB VAL 37 HB VAL 37 15.651 -10.989 22.507 310 HG11 VAL 37 1HG1 VAL 37 15.599 -8.546 23.370 311 HG12 VAL 37 2HG1 VAL 37 17.095 -8.987 24.239 312 HG13 VAL 37 3HG1 VAL 37 17.038 -9.098 22.468 313 HG21 VAL 37 3HG2 VAL 37 17.569 -11.158 24.862 314 HG22 VAL 37 1HG2 VAL 37 16.846 -12.554 24.008 315 HG23 VAL 37 2HG2 VAL 37 17.951 -11.453 23.156 316 H SER 38 H SER 38 13.751 -8.583 25.300 317 HA SER 38 HA SER 38 15.419 -8.101 27.579 318 HB2 SER 38 2HB SER 38 14.128 -6.355 26.372 319 HB3 SER 38 3HB SER 38 12.622 -7.090 26.950 320 HG SER 38 HG SER 38 13.338 -5.353 28.267 321 H ARG 39 H ARG 39 12.995 -10.420 26.986 322 HA ARG 39 HA ARG 39 12.122 -10.698 29.776 323 HB2 ARG 39 2HB ARG 39 11.673 -12.511 27.385 324 HB3 ARG 39 3HB ARG 39 10.807 -12.560 28.928 325 HG2 ARG 39 2HG ARG 39 9.928 -10.269 28.495 326 HG3 ARG 39 3HG ARG 39 10.744 -10.265 26.914 327 HD2 ARG 39 2HD ARG 39 8.612 -12.237 27.831 328 HD3 ARG 39 3HD ARG 39 8.375 -10.903 26.686 329 HE ARG 39 HE ARG 39 10.492 -12.475 25.691 330 HH11 ARG 39 1HH1 ARG 39 7.031 -12.813 26.337 331 HH12 ARG 39 2HH1 ARG 39 6.798 -14.027 25.097 332 HH21 ARG 39 1HH2 ARG 39 10.155 -14.063 24.082 333 HH22 ARG 39 2HH2 ARG 39 8.558 -14.725 23.827 334 H TYR 40 H TYR 40 14.908 -11.563 28.053 335 HA TYR 40 HA TYR 40 15.338 -13.961 29.786 336 HB2 TYR 40 2HB TYR 40 16.292 -13.445 26.955 337 HB3 TYR 40 3HB TYR 40 16.751 -14.830 27.943 338 HD1 TYR 40 HD2 TYR 40 14.824 -16.337 28.843 339 HD2 TYR 40 HD1 TYR 40 14.388 -13.584 25.564 340 HE1 TYR 40 HE2 TYR 40 12.802 -17.561 28.078 341 HE2 TYR 40 HE1 TYR 40 12.378 -14.793 24.799 342 HH TYR 40 HH TYR 40 10.947 -16.556 25.186 343 H VAL 41 H VAL 41 16.460 -10.819 28.917 344 HA VAL 41 HA VAL 41 18.685 -11.132 30.826 345 HB VAL 41 HB VAL 41 20.112 -9.666 29.293 346 HG11 VAL 41 1HG1 VAL 41 20.592 -12.042 29.742 347 HG12 VAL 41 2HG1 VAL 41 19.566 -12.508 28.366 348 HG13 VAL 41 3HG1 VAL 41 21.043 -11.562 28.091 349 HG21 VAL 41 3HG2 VAL 41 18.269 -10.760 27.139 350 HG22 VAL 41 1HG2 VAL 41 18.316 -9.065 27.680 351 HG23 VAL 41 2HG2 VAL 41 19.740 -9.792 26.902 352 HA PRO 42 HA PRO 42 17.083 -7.286 32.233 353 HB2 PRO 42 2HB PRO 42 19.267 -6.049 33.316 354 HB3 PRO 42 3HB PRO 42 18.546 -7.534 34.025 355 HG2 PRO 42 2HG PRO 42 20.894 -7.334 32.108 356 HG3 PRO 42 3HG PRO 42 20.829 -8.209 33.675 357 HD2 PRO 42 2HD PRO 42 20.400 -9.511 31.351 358 HD3 PRO 42 3HD PRO 42 19.388 -9.875 32.784 359 H SER 43 H SER 43 17.269 -4.882 31.971 360 HA SER 43 HA SER 43 17.471 -4.293 29.193 361 HB2 SER 43 2HB SER 43 16.894 -1.992 29.910 362 HB3 SER 43 3HB SER 43 15.853 -3.217 30.661 363 HG SER 43 HG SER 43 16.635 -1.667 32.164 364 H GLY 44 H GLY 44 19.950 -4.421 31.555 365 HA2 GLY 44 2HA GLY 44 21.602 -2.326 30.310 366 HA3 GLY 44 3HA GLY 44 22.035 -3.380 31.671 367 H ASP 45 H ASP 45 21.014 -5.754 29.912 368 HA ASP 45 HA ASP 45 23.501 -5.997 28.275 369 HB2 ASP 45 2HB ASP 45 21.949 -8.109 29.803 370 HB3 ASP 45 3HB ASP 45 23.323 -8.425 28.737 371 H VAL 46 H VAL 46 20.165 -5.621 28.061 372 HA VAL 46 HA VAL 46 19.556 -7.594 26.093 373 HB VAL 46 HB VAL 46 17.949 -6.381 27.590 374 HG11 VAL 46 1HG1 VAL 46 18.618 -4.048 27.188 375 HG12 VAL 46 2HG1 VAL 46 18.139 -4.207 25.472 376 HG13 VAL 46 3HG1 VAL 46 16.919 -4.336 26.749 377 HG21 VAL 46 3HG2 VAL 46 17.396 -6.530 24.607 378 HG22 VAL 46 1HG2 VAL 46 17.190 -7.810 25.837 379 HG23 VAL 46 2HG2 VAL 46 16.158 -6.369 25.875 380 HA PRO 47 HA PRO 47 20.297 -4.283 22.805 381 HB2 PRO 47 2HB PRO 47 22.222 -2.393 23.059 382 HB3 PRO 47 3HB PRO 47 20.598 -2.189 23.797 383 HG2 PRO 47 2HG PRO 47 23.126 -3.216 25.127 384 HG3 PRO 47 3HG PRO 47 22.042 -1.904 25.695 385 HD2 PRO 47 2HD PRO 47 21.836 -4.463 26.587 386 HD3 PRO 47 3HD PRO 47 20.384 -3.444 26.348 387 H ASP 48 H ASP 48 22.983 -5.603 24.711 388 HA ASP 48 HA ASP 48 24.762 -5.771 22.403 389 HB2 ASP 48 2HB ASP 48 25.534 -5.422 24.756 390 HB3 ASP 48 3HB ASP 48 24.953 -7.045 25.158 391 H VAL 49 H VAL 49 22.440 -7.840 24.106 392 HA VAL 49 HA VAL 49 23.266 -10.281 22.773 393 HB VAL 49 HB VAL 49 20.817 -9.459 24.379 394 HG11 VAL 49 1HG1 VAL 49 21.599 -12.223 23.377 395 HG12 VAL 49 2HG1 VAL 49 20.280 -11.859 24.517 396 HG13 VAL 49 3HG1 VAL 49 20.182 -11.284 22.841 397 HG21 VAL 49 3HG2 VAL 49 23.003 -9.619 25.596 398 HG22 VAL 49 1HG2 VAL 49 21.863 -10.887 26.107 399 HG23 VAL 49 2HG2 VAL 49 23.191 -11.272 24.990 400 H VAL 50 H VAL 50 21.059 -7.593 22.062 401 HA VAL 50 HA VAL 50 19.706 -8.928 19.871 402 HB VAL 50 HB VAL 50 20.086 -6.030 20.692 403 HG11 VAL 50 1HG1 VAL 50 18.434 -7.156 18.388 404 HG12 VAL 50 2HG1 VAL 50 18.335 -5.488 19.010 405 HG13 VAL 50 3HG1 VAL 50 19.830 -6.066 18.246 406 HG21 VAL 50 3HG2 VAL 50 17.650 -7.862 20.623 407 HG22 VAL 50 1HG2 VAL 50 18.613 -7.517 22.073 408 HG23 VAL 50 2HG2 VAL 50 17.716 -6.205 21.275 409 H GLN 51 H GLN 51 22.695 -6.986 20.238 410 HA GLN 51 HA GLN 51 23.152 -6.812 17.392 411 HB2 GLN 51 2HB GLN 51 24.117 -5.224 19.007 412 HB3 GLN 51 3HB GLN 51 25.069 -6.532 19.746 413 HG2 GLN 51 2HG GLN 51 26.283 -6.886 17.662 414 HG3 GLN 51 3HG GLN 51 25.272 -5.694 16.827 415 HE21 GLN 51 2HE2 GLN 51 27.789 -5.103 16.500 416 HE22 GLN 51 1HE2 GLN 51 28.359 -3.868 17.599 417 H GLU 52 H GLU 52 24.292 -9.043 20.000 418 HA GLU 52 HA GLU 52 25.996 -10.527 18.226 419 HB2 GLU 52 2HB GLU 52 26.224 -10.534 20.682 420 HB3 GLU 52 3HB GLU 52 24.659 -11.366 20.839 421 HG2 GLU 52 2HG GLU 52 25.503 -13.321 19.685 422 HG3 GLU 52 3HG GLU 52 26.994 -12.484 19.239 423 H ALA 53 H ALA 53 22.515 -10.612 18.910 424 HA ALA 53 HA ALA 53 22.124 -13.202 17.702 425 HB1 ALA 53 1HB ALA 53 20.554 -12.261 19.336 426 HB2 ALA 53 2HB ALA 53 20.179 -10.918 18.226 427 HB3 ALA 53 3HB ALA 53 19.742 -12.589 17.790 428 H PHE 54 H PHE 54 22.389 -9.874 16.456 429 HA PHE 54 HA PHE 54 21.339 -10.697 13.839 430 HB2 PHE 54 2HB PHE 54 22.592 -8.132 14.870 431 HB3 PHE 54 3HB PHE 54 22.063 -8.360 13.210 432 HD1 PHE 54 HD1 PHE 54 19.502 -9.983 13.824 433 HD2 PHE 54 HD2 PHE 54 21.117 -6.358 15.501 434 HE1 PHE 54 HE1 PHE 54 17.230 -9.239 14.406 435 HE2 PHE 54 HE2 PHE 54 18.820 -5.593 16.026 436 HZ PHE 54 HZ PHE 54 16.875 -7.038 15.489 437 H ILE 55 H ILE 55 24.514 -10.257 15.404 438 HA ILE 55 HA ILE 55 26.004 -10.525 12.939 439 HB ILE 55 HB ILE 55 26.741 -11.087 15.839 440 HG12 ILE 55 2HG1 ILE 55 27.388 -8.679 14.063 441 HG13 ILE 55 3HG1 ILE 55 26.096 -8.700 15.257 442 HG21 ILE 55 1HG2 ILE 55 28.527 -10.786 13.385 443 HG22 ILE 55 2HG2 ILE 55 29.088 -10.989 15.062 444 HG23 ILE 55 3HG2 ILE 55 28.213 -12.301 14.271 445 HD11 ILE 55 3HD1 ILE 55 28.061 -7.633 16.209 446 HD12 ILE 55 1HD1 ILE 55 27.772 -9.175 17.048 447 HD13 ILE 55 2HD1 ILE 55 29.072 -9.037 15.837 448 H LYS 56 H LYS 56 24.668 -12.774 15.376 449 HA LYS 56 HA LYS 56 25.871 -15.112 14.143 450 HB2 LYS 56 2HB LYS 56 25.322 -14.865 16.578 451 HB3 LYS 56 3HB LYS 56 23.599 -14.867 16.156 452 HG2 LYS 56 2HG LYS 56 23.825 -17.118 15.191 453 HG3 LYS 56 3HG LYS 56 25.585 -17.075 15.478 454 HD2 LYS 56 2HD LYS 56 24.599 -18.375 17.240 455 HD3 LYS 56 3HD LYS 56 25.113 -16.821 17.934 456 HE2 LYS 56 2HE LYS 56 22.804 -15.975 17.788 457 HE3 LYS 56 3HE LYS 56 22.285 -17.481 17.012 458 HZ1 LYS 56 3HZ LYS 56 21.815 -17.463 19.369 459 HZ2 LYS 56 1HZ LYS 56 22.892 -18.657 19.011 460 HZ3 LYS 56 2HZ LYS 56 23.406 -17.267 19.724 461 H ALA 57 H ALA 57 22.745 -13.386 13.918 462 HA ALA 57 HA ALA 57 21.385 -15.484 12.518 463 HB1 ALA 57 1HB ALA 57 20.964 -12.470 12.517 464 HB2 ALA 57 2HB ALA 57 19.839 -13.668 11.830 465 HB3 ALA 57 3HB ALA 57 20.161 -13.664 13.572 466 H TYR 58 H TYR 58 23.446 -12.735 11.395 467 HA TYR 58 HA TYR 58 22.826 -13.082 8.636 468 HB2 TYR 58 2HB TYR 58 23.885 -11.090 9.686 469 HB3 TYR 58 3HB TYR 58 25.352 -12.023 9.955 470 HD1 TYR 58 HD1 TYR 58 23.033 -10.938 7.202 471 HD2 TYR 58 HD2 TYR 58 27.020 -12.111 8.317 472 HE1 TYR 58 HE1 TYR 58 23.848 -10.281 4.957 473 HE2 TYR 58 HE2 TYR 58 27.841 -11.480 6.067 474 HH TYR 58 HH TYR 58 25.661 -10.155 3.547 475 H ARG 59 H ARG 59 25.279 -14.551 10.763 476 HA ARG 59 HA ARG 59 26.692 -15.934 8.666 477 HB2 ARG 59 2HB ARG 59 26.542 -16.371 11.670 478 HB3 ARG 59 3HB ARG 59 27.658 -17.218 10.573 479 HG2 ARG 59 2HG ARG 59 28.724 -15.127 9.954 480 HG3 ARG 59 3HG ARG 59 27.492 -14.187 10.824 481 HD2 ARG 59 2HD ARG 59 29.428 -14.301 12.237 482 HD3 ARG 59 3HD ARG 59 28.173 -15.314 12.949 483 HE ARG 59 HE ARG 59 29.445 -17.226 12.525 484 HH11 ARG 59 1HH1 ARG 59 30.912 -14.440 10.916 485 HH12 ARG 59 2HH1 ARG 59 32.390 -15.292 10.536 486 HH21 ARG 59 1HH2 ARG 59 31.387 -18.308 12.023 487 HH22 ARG 59 2HH2 ARG 59 32.667 -17.460 11.186 488 H ALA 60 H ALA 60 23.675 -16.486 10.298 489 HA ALA 60 HA ALA 60 23.605 -19.318 9.392 490 HB1 ALA 60 1HB ALA 60 21.788 -17.769 11.277 491 HB2 ALA 60 2HB ALA 60 21.688 -19.508 10.903 492 HB3 ALA 60 3HB ALA 60 23.102 -18.859 11.768 493 H LEU 61 H LEU 61 22.655 -16.181 8.423 494 HA LEU 61 HA LEU 61 20.087 -16.842 7.289 495 HB2 LEU 61 2HB LEU 61 20.918 -14.557 8.085 496 HB3 LEU 61 3HB LEU 61 21.939 -14.519 6.633 497 HG LEU 61 HG LEU 61 19.831 -14.781 5.256 498 HD11 LEU 61 1HD1 LEU 61 18.555 -14.358 7.989 499 HD12 LEU 61 2HD1 LEU 61 17.688 -14.234 6.438 500 HD13 LEU 61 3HD1 LEU 61 18.356 -15.794 6.957 501 HD21 LEU 61 3HD2 LEU 61 20.881 -12.598 5.694 502 HD22 LEU 61 1HD2 LEU 61 19.103 -12.449 5.636 503 HD23 LEU 61 2HD2 LEU 61 19.942 -12.440 7.203 504 H ASP 62 H ASP 62 23.433 -17.036 6.275 505 HA ASP 62 HA ASP 62 22.981 -17.280 3.452 506 HB2 ASP 62 2HB ASP 62 25.157 -16.754 4.520 507 HB3 ASP 62 3HB ASP 62 25.199 -18.379 5.222 508 H SER 63 H SER 63 22.074 -19.259 6.060 509 HA SER 63 HA SER 63 21.963 -21.706 4.369 510 HB2 SER 63 2HB SER 63 21.950 -21.404 7.393 511 HB3 SER 63 3HB SER 63 21.888 -22.934 6.482 512 HG SER 63 HG SER 63 24.007 -22.384 7.155 513 H PHE 64 H PHE 64 20.038 -19.149 5.148 514 HA PHE 64 HA PHE 64 17.644 -20.489 6.046 515 HB2 PHE 64 2HB PHE 64 18.117 -18.094 6.386 516 HB3 PHE 64 3HB PHE 64 18.060 -17.832 4.640 517 HD1 PHE 64 HD1 PHE 64 15.955 -19.257 7.418 518 HD2 PHE 64 HD2 PHE 64 16.065 -17.074 3.717 519 HE1 PHE 64 HE1 PHE 64 13.519 -18.843 7.596 520 HE2 PHE 64 HE2 PHE 64 13.625 -16.655 3.897 521 HZ PHE 64 HZ PHE 64 12.347 -17.539 5.832 522 H ARG 65 H ARG 65 15.815 -21.115 4.843 523 HA ARG 65 HA ARG 65 16.209 -21.336 1.902 524 HB2 ARG 65 2HB ARG 65 15.419 -23.548 3.830 525 HB3 ARG 65 3HB ARG 65 15.327 -23.680 2.069 526 HG2 ARG 65 2HG ARG 65 17.867 -23.185 3.674 527 HG3 ARG 65 3HG ARG 65 17.367 -24.737 2.988 528 HD2 ARG 65 2HD ARG 65 17.970 -22.216 1.390 529 HD3 ARG 65 3HD ARG 65 19.051 -23.604 1.582 530 HE ARG 65 HE ARG 65 16.686 -24.683 0.597 531 HH11 ARG 65 1HH1 ARG 65 18.997 -22.238 -0.470 532 HH12 ARG 65 2HH1 ARG 65 18.696 -22.520 -2.170 533 HH21 ARG 65 1HH2 ARG 65 16.311 -25.042 -1.627 534 HH22 ARG 65 2HH2 ARG 65 17.192 -24.118 -2.820 535 H GLY 66 H GLY 66 14.222 -20.166 4.316 536 HA2 GLY 66 2HA GLY 66 12.137 -19.224 4.123 537 HA3 GLY 66 3HA GLY 66 12.087 -19.732 2.430 538 H ASP 67 H ASP 67 12.710 -22.329 4.671 539 HA ASP 67 HA ASP 67 10.186 -23.590 4.073 540 HB2 ASP 67 2HB ASP 67 12.353 -24.223 6.116 541 HB3 ASP 67 3HB ASP 67 10.963 -25.263 5.771 542 H SER 68 H SER 68 11.004 -21.125 6.222 543 HA SER 68 HA SER 68 8.377 -21.301 7.546 544 HB2 SER 68 2HB SER 68 9.369 -20.864 9.762 545 HB3 SER 68 3HB SER 68 9.893 -22.438 9.122 546 HG SER 68 HG SER 68 11.633 -21.243 9.976 547 H ALA 69 H ALA 69 7.945 -19.152 8.717 548 HA ALA 69 HA ALA 69 8.588 -17.007 6.916 549 HB1 ALA 69 1HB ALA 69 6.465 -17.128 8.172 550 HB2 ALA 69 2HB ALA 69 7.364 -16.949 9.700 551 HB3 ALA 69 3HB ALA 69 7.340 -15.620 8.520 552 H PHE 70 H PHE 70 9.863 -15.115 7.283 553 HA PHE 70 HA PHE 70 12.389 -15.753 8.439 554 HB2 PHE 70 2HB PHE 70 12.185 -14.248 6.547 555 HB3 PHE 70 3HB PHE 70 11.206 -13.121 7.497 556 HD1 PHE 70 HD2 PHE 70 14.567 -14.816 7.650 557 HD2 PHE 70 HD1 PHE 70 12.238 -11.301 8.482 558 HE1 PHE 70 HE2 PHE 70 16.597 -13.662 8.459 559 HE2 PHE 70 HE1 PHE 70 14.282 -10.133 9.266 560 HZ PHE 70 HZ PHE 70 16.471 -11.312 9.239 561 H TYR 71 H TYR 71 9.568 -13.925 9.711 562 HA TYR 71 HA TYR 71 11.095 -12.751 11.839 563 HB2 TYR 71 2HB TYR 71 8.978 -12.100 12.780 564 HB3 TYR 71 3HB TYR 71 8.974 -11.811 11.041 565 HD1 TYR 71 HD1 TYR 71 7.631 -13.895 13.776 566 HD2 TYR 71 HD2 TYR 71 7.448 -13.003 9.574 567 HE1 TYR 71 HE1 TYR 71 5.508 -15.170 13.604 568 HE2 TYR 71 HE2 TYR 71 5.325 -14.281 9.392 569 HH TYR 71 HH TYR 71 3.826 -15.886 12.223 570 H THR 72 H THR 72 9.259 -15.816 11.527 571 HA THR 72 HA THR 72 9.481 -16.488 14.326 572 HB THR 72 HB THR 72 9.155 -18.324 11.914 573 HG1 THR 72 1HG THR 72 7.211 -16.983 13.480 574 HG21 THR 72 1HG2 THR 72 8.378 -18.619 14.848 575 HG22 THR 72 2HG2 THR 72 7.939 -19.753 13.545 576 HG23 THR 72 3HG2 THR 72 9.643 -19.524 13.992 577 H TRP 73 H TRP 73 11.469 -16.940 11.433 578 HA TRP 73 HA TRP 73 13.312 -18.809 12.635 579 HB2 TRP 73 2HB TRP 73 12.903 -18.724 10.233 580 HB3 TRP 73 3HB TRP 73 13.415 -17.037 10.176 581 HD1 TRP 73 HD1 TRP 73 14.749 -20.548 10.117 582 HE1 TRP 73 HE1 TRP 73 17.279 -20.546 9.738 583 HE3 TRP 73 HE3 TRP 73 15.630 -15.538 10.622 584 HZ2 TRP 73 HZ2 TRP 73 19.438 -18.635 9.807 585 HZ3 TRP 73 HZ3 TRP 73 17.939 -14.661 10.447 586 HH2 TRP 73 HH2 TRP 73 19.841 -16.196 10.094 587 H LEU 74 H LEU 74 13.056 -15.271 12.486 588 HA LEU 74 HA LEU 74 15.831 -14.903 13.334 589 HB2 LEU 74 2HB LEU 74 14.737 -13.386 11.729 590 HB3 LEU 74 3HB LEU 74 13.528 -12.960 12.944 591 HG LEU 74 HG LEU 74 15.318 -12.010 14.392 592 HD11 LEU 74 1HD1 LEU 74 17.573 -11.644 13.423 593 HD12 LEU 74 2HD1 LEU 74 17.237 -13.374 13.635 594 HD13 LEU 74 3HD1 LEU 74 17.133 -12.648 12.019 595 HD21 LEU 74 3HD2 LEU 74 15.773 -10.044 12.978 596 HD22 LEU 74 1HD2 LEU 74 15.306 -10.969 11.534 597 HD23 LEU 74 2HD2 LEU 74 14.097 -10.608 12.785 598 H TYR 75 H TYR 75 12.558 -14.819 14.775 599 HA TYR 75 HA TYR 75 13.301 -13.583 17.239 600 HB2 TYR 75 2HB TYR 75 11.134 -15.601 16.571 601 HB3 TYR 75 3HB TYR 75 11.273 -14.787 18.125 602 HD1 TYR 75 HD1 TYR 75 12.225 -12.290 15.862 603 HD2 TYR 75 HD2 TYR 75 8.777 -14.538 17.132 604 HE1 TYR 75 HE1 TYR 75 10.749 -10.465 15.093 605 HE2 TYR 75 HE2 TYR 75 7.292 -12.717 16.335 606 HH TYR 75 HH TYR 75 8.593 -9.725 14.853 607 H ARG 76 H ARG 76 13.532 -16.967 16.085 608 HA ARG 76 HA ARG 76 14.119 -17.954 18.736 609 HB2 ARG 76 2HB ARG 76 14.554 -20.072 17.702 610 HB3 ARG 76 3HB ARG 76 13.077 -19.367 17.027 611 HG2 ARG 76 2HG ARG 76 14.294 -18.656 15.021 612 HG3 ARG 76 3HG ARG 76 15.822 -19.269 15.703 613 HD2 ARG 76 2HD ARG 76 14.780 -21.542 15.833 614 HD3 ARG 76 3HD ARG 76 13.352 -20.898 14.990 615 HE ARG 76 HE ARG 76 15.572 -20.226 13.417 616 HH11 ARG 76 1HH1 ARG 76 13.970 -23.166 14.555 617 HH12 ARG 76 2HH1 ARG 76 14.502 -24.126 13.194 618 HH21 ARG 76 1HH2 ARG 76 16.261 -21.502 11.666 619 HH22 ARG 76 2HH2 ARG 76 15.788 -23.184 11.557 620 H ILE 77 H ILE 77 16.086 -16.441 16.223 621 HA ILE 77 HA ILE 77 18.586 -17.542 17.150 622 HB ILE 77 HB ILE 77 18.136 -14.819 15.870 623 HG12 ILE 77 2HG1 ILE 77 17.127 -16.462 14.392 624 HG13 ILE 77 3HG1 ILE 77 18.623 -15.834 13.709 625 HG21 ILE 77 1HG2 ILE 77 20.348 -15.082 16.837 626 HG22 ILE 77 2HG2 ILE 77 20.541 -16.676 16.081 627 HG23 ILE 77 3HG2 ILE 77 20.491 -15.216 15.076 628 HD11 ILE 77 3HD1 ILE 77 19.822 -17.889 14.378 629 HD12 ILE 77 1HD1 ILE 77 18.316 -18.527 15.107 630 HD13 ILE 77 2HD1 ILE 77 18.418 -18.252 13.356 631 H ALA 78 H ALA 78 16.576 -14.724 18.069 632 HA ALA 78 HA ALA 78 18.646 -13.536 19.671 633 HB1 ALA 78 1HB ALA 78 15.645 -13.042 19.551 634 HB2 ALA 78 2HB ALA 78 16.843 -11.980 20.336 635 HB3 ALA 78 3HB ALA 78 16.887 -12.228 18.574 636 H VAL 79 H VAL 79 15.911 -15.752 20.446 637 HA VAL 79 HA VAL 79 16.290 -15.351 23.300 638 HB VAL 79 HB VAL 79 14.128 -15.966 22.442 639 HG11 VAL 79 1HG1 VAL 79 14.851 -17.333 20.513 640 HG12 VAL 79 2HG1 VAL 79 15.384 -18.623 21.632 641 HG13 VAL 79 3HG1 VAL 79 13.664 -18.189 21.519 642 HG21 VAL 79 3HG2 VAL 79 14.828 -16.711 24.734 643 HG22 VAL 79 1HG2 VAL 79 13.596 -17.765 24.002 644 HG23 VAL 79 2HG2 VAL 79 15.293 -18.282 24.052 645 H ASN 80 H ASN 80 17.617 -17.599 20.863 646 HA ASN 80 HA ASN 80 18.851 -19.264 22.924 647 HB2 ASN 80 2HB ASN 80 19.049 -19.116 19.907 648 HB3 ASN 80 3HB ASN 80 20.127 -20.140 20.874 649 HD21 ASN 80 2HD2 ASN 80 16.836 -19.733 19.701 650 HD22 ASN 80 1HD2 ASN 80 16.241 -21.273 20.297 651 H THR 81 H THR 81 19.626 -16.225 21.362 652 HA THR 81 HA THR 81 22.481 -16.441 21.929 653 HB THR 81 HB THR 81 20.777 -13.996 21.290 654 HG1 THR 81 1HG THR 81 20.716 -15.419 19.594 655 HG21 THR 81 1HG2 THR 81 22.938 -13.024 20.577 656 HG22 THR 81 2HG2 THR 81 22.999 -13.449 22.297 657 HG23 THR 81 3HG2 THR 81 23.783 -14.500 21.097 658 H ALA 82 H ALA 82 19.559 -15.287 23.605 659 HA ALA 82 HA ALA 82 21.009 -13.838 25.644 660 HB1 ALA 82 1HB ALA 82 18.682 -13.337 24.990 661 HB2 ALA 82 2HB ALA 82 18.163 -14.942 25.559 662 HB3 ALA 82 3HB ALA 82 18.784 -13.746 26.718 663 H LYS 83 H LYS 83 19.737 -17.164 25.296 664 HA LYS 83 HA LYS 83 20.331 -17.847 28.066 665 HB2 LYS 83 2HB LYS 83 19.582 -19.492 25.620 666 HB3 LYS 83 3HB LYS 83 19.788 -20.165 27.251 667 HG2 LYS 83 2HG LYS 83 18.039 -18.700 28.128 668 HG3 LYS 83 3HG LYS 83 17.842 -17.916 26.552 669 HD2 LYS 83 2HD LYS 83 17.153 -20.051 25.543 670 HD3 LYS 83 3HD LYS 83 17.366 -20.876 27.104 671 HE2 LYS 83 2HE LYS 83 15.456 -18.557 26.609 672 HE3 LYS 83 3HE LYS 83 14.986 -20.266 26.590 673 HZ1 LYS 83 3HZ LYS 83 16.130 -18.850 28.903 674 HZ2 LYS 83 1HZ LYS 83 14.556 -19.289 28.722 675 HZ3 LYS 83 2HZ LYS 83 15.717 -20.440 28.864 676 H ASN 84 H ASN 84 22.092 -17.830 25.015 677 HA ASN 84 HA ASN 84 24.253 -19.476 26.126 678 HB2 ASN 84 2HB ASN 84 23.659 -19.692 23.790 679 HB3 ASN 84 3HB ASN 84 23.972 -17.963 23.511 680 HD21 ASN 84 2HD2 ASN 84 26.071 -17.272 23.122 681 HD22 ASN 84 1HD2 ASN 84 27.449 -18.350 23.121 682 H TYR 85 H TYR 85 23.328 -16.113 26.062 683 HA TYR 85 HA TYR 85 26.018 -15.061 26.372 684 HB2 TYR 85 2HB TYR 85 24.148 -13.795 25.361 685 HB3 TYR 85 3HB TYR 85 23.274 -13.855 26.894 686 HD1 TYR 85 HD1 TYR 85 26.303 -12.543 25.199 687 HD2 TYR 85 HD2 TYR 85 23.706 -12.266 28.611 688 HE1 TYR 85 HE1 TYR 85 27.407 -10.422 25.850 689 HE2 TYR 85 HE2 TYR 85 24.800 -10.137 29.277 690 HH TYR 85 HH TYR 85 27.463 -8.690 27.358 691 H LEU 86 H LEU 86 23.341 -16.017 28.523 692 HA LEU 86 HA LEU 86 24.737 -15.021 30.896 693 HB2 LEU 86 2HB LEU 86 22.213 -16.679 30.533 694 HB3 LEU 86 3HB LEU 86 22.812 -16.085 32.087 695 HG LEU 86 HG LEU 86 21.973 -14.331 29.736 696 HD11 LEU 86 1HD1 LEU 86 20.098 -15.455 30.862 697 HD12 LEU 86 2HD1 LEU 86 20.706 -14.917 32.447 698 HD13 LEU 86 3HD1 LEU 86 20.121 -13.723 31.268 699 HD21 LEU 86 3HD2 LEU 86 22.903 -13.646 32.560 700 HD22 LEU 86 1HD2 LEU 86 23.745 -13.239 31.044 701 HD23 LEU 86 2HD2 LEU 86 22.182 -12.491 31.415 702 H VAL 87 H VAL 87 24.547 -18.113 29.160 703 HA VAL 87 HA VAL 87 25.578 -19.593 31.458 704 HB VAL 87 HB VAL 87 24.103 -20.527 29.626 705 HG11 VAL 87 1HG1 VAL 87 26.721 -20.660 28.065 706 HG12 VAL 87 2HG1 VAL 87 25.126 -21.254 27.556 707 HG13 VAL 87 3HG1 VAL 87 25.410 -19.505 27.734 708 HG21 VAL 87 3HG2 VAL 87 26.754 -21.952 30.112 709 HG22 VAL 87 1HG2 VAL 87 25.346 -21.978 31.199 710 HG23 VAL 87 2HG2 VAL 87 25.232 -22.703 29.576 711 H ALA 88 H ALA 88 26.888 -17.806 28.703 712 HA ALA 88 HA ALA 88 29.503 -19.012 28.872 713 HB1 ALA 88 1HB ALA 88 28.547 -16.421 27.576 714 HB2 ALA 88 2HB ALA 88 30.123 -17.191 27.298 715 HB3 ALA 88 3HB ALA 88 28.631 -18.016 26.785 716 H GLN 89 H GLN 89 27.839 -16.572 30.667 717 HA GLN 89 HA GLN 89 30.421 -15.633 31.837 718 HB2 GLN 89 2HB GLN 89 27.659 -14.359 31.760 719 HB3 GLN 89 3HB GLN 89 29.060 -13.696 32.631 720 HG2 GLN 89 2HG GLN 89 30.322 -13.495 30.545 721 HG3 GLN 89 3HG GLN 89 28.998 -14.254 29.637 722 HE21 GLN 89 2HE2 GLN 89 26.949 -13.136 29.458 723 HE22 GLN 89 1HE2 GLN 89 26.891 -11.393 29.582 724 H GLY 90 H GLY 90 27.787 -17.716 32.352 725 HA2 GLY 90 2HA GLY 90 27.835 -17.463 35.295 726 HA3 GLY 90 3HA GLY 90 26.770 -18.488 34.316 727 H ARG 91 H ARG 91 29.446 -19.264 32.787 728 HA ARG 91 HA ARG 91 30.244 -21.340 34.790 729 HB2 ARG 91 2HB ARG 91 30.302 -21.422 31.752 730 HB3 ARG 91 3HB ARG 91 30.881 -22.693 32.828 731 HG2 ARG 91 2HG ARG 91 28.004 -21.722 32.551 732 HG3 ARG 91 3HG ARG 91 28.662 -23.272 32.011 733 HD2 ARG 91 2HD ARG 91 28.343 -22.311 34.878 734 HD3 ARG 91 3HD ARG 91 27.443 -23.604 34.074 735 HE ARG 91 HE ARG 91 30.205 -24.247 33.933 736 HH11 ARG 91 1HH1 ARG 91 27.611 -23.965 36.324 737 HH12 ARG 91 2HH1 ARG 91 28.347 -25.113 37.421 738 HH21 ARG 91 1HH2 ARG 91 31.153 -25.720 35.419 739 HH22 ARG 91 2HH2 ARG 91 30.341 -26.069 36.926 740 H ARG 92 H ARG 92 31.407 -18.607 33.010 741 HA ARG 92 HA ARG 92 34.188 -19.621 33.140 742 HB2 ARG 92 2HB ARG 92 33.008 -17.147 31.825 743 HB3 ARG 92 3HB ARG 92 34.731 -17.574 31.846 744 HG2 ARG 92 2HG ARG 92 34.189 -19.747 30.743 745 HG3 ARG 92 3HG ARG 92 32.492 -19.246 30.630 746 HD2 ARG 92 2HD ARG 92 33.600 -18.784 28.510 747 HD3 ARG 92 3HD ARG 92 33.192 -17.256 29.296 748 HE ARG 92 HE ARG 92 35.447 -16.773 29.557 749 HH11 ARG 92 1HH1 ARG 92 35.077 -20.138 28.527 750 HH12 ARG 92 2HH1 ARG 92 36.788 -20.347 28.222 751 HH21 ARG 92 1HH2 ARG 92 37.659 -17.081 29.148 752 HH22 ARG 92 2HH2 ARG 92 38.240 -18.625 28.564 753 H LEU 93 H LEU 93 35.585 -19.031 34.573 754 HA LEU 93 HA LEU 93 36.479 -18.136 36.465 755 HB2 LEU 93 2HB LEU 93 35.458 -15.621 35.112 756 HB3 LEU 93 3HB LEU 93 36.460 -15.611 36.563 757 HG LEU 93 HG LEU 93 38.238 -16.858 35.357 758 HD11 LEU 93 1HD1 LEU 93 36.463 -16.353 32.932 759 HD12 LEU 93 2HD1 LEU 93 38.184 -16.786 32.850 760 HD13 LEU 93 3HD1 LEU 93 37.028 -17.937 33.533 761 HD21 LEU 93 3HD2 LEU 93 37.327 -14.248 34.076 762 HD22 LEU 93 1HD2 LEU 93 38.241 -14.397 35.591 763 HD23 LEU 93 2HD2 LEU 93 38.985 -14.900 34.059 764 H GLU 94 H GLU 94 33.824 -19.226 36.807 765 HA GLU 94 HA GLU 94 32.975 -17.603 39.149 766 HB2 GLU 94 2HB GLU 94 31.383 -17.385 37.249 767 HB3 GLU 94 3HB GLU 94 31.171 -19.144 37.249 768 HG2 GLU 94 2HG GLU 94 29.345 -18.058 38.460 769 HG3 GLU 94 3HG GLU 94 30.312 -19.044 39.567 770 H LEU 95 H LEU 95 32.350 -18.726 40.954 771 HA LEU 95 HA LEU 95 33.501 -21.444 41.132 772 HB2 LEU 95 2HB LEU 95 32.941 -19.288 43.195 773 HB3 LEU 95 3HB LEU 95 33.376 -20.950 43.621 774 HG LEU 95 HG LEU 95 35.493 -20.755 42.368 775 HD11 LEU 95 1HD1 LEU 95 34.656 -17.839 42.060 776 HD12 LEU 95 2HD1 LEU 95 36.317 -18.431 41.850 777 HD13 LEU 95 3HD1 LEU 95 35.049 -18.983 40.751 778 HD21 LEU 95 3HD2 LEU 95 35.006 -18.613 44.475 779 HD22 LEU 95 1HD2 LEU 95 35.333 -20.334 44.798 780 HD23 LEU 95 2HD2 LEU 95 36.579 -19.316 44.046 781 H VAL 96 H VAL 96 31.124 -21.567 39.839 782 HA VAL 96 HA VAL 96 28.810 -21.769 41.450 783 HB VAL 96 HB VAL 96 29.475 -23.397 38.968 784 HG11 VAL 96 1HG1 VAL 96 26.825 -22.432 40.132 785 HG12 VAL 96 2HG1 VAL 96 27.026 -23.335 38.618 786 HG13 VAL 96 3HG1 VAL 96 27.414 -24.112 40.163 787 HG21 VAL 96 3HG2 VAL 96 29.859 -21.019 38.502 788 HG22 VAL 96 1HG2 VAL 96 28.361 -21.557 37.725 789 HG23 VAL 96 2HG2 VAL 96 28.286 -20.607 39.227 790 HA PRO 97 HA PRO 97 29.893 -25.403 43.770 791 HB2 PRO 97 2HB PRO 97 27.564 -25.843 45.100 792 HB3 PRO 97 3HB PRO 97 28.554 -24.373 45.385 793 HG2 PRO 97 2HG PRO 97 26.165 -24.660 43.527 794 HG3 PRO 97 3HG PRO 97 26.417 -23.430 44.812 795 HD2 PRO 97 2HD PRO 97 27.041 -22.926 42.210 796 HD3 PRO 97 3HD PRO 97 28.068 -22.315 43.543 797 H ARG 98 H ARG 98 28.208 -25.491 40.945 798 HA ARG 98 HA ARG 98 27.851 -28.430 41.092 799 HB2 ARG 98 2HB ARG 98 25.650 -27.337 41.540 800 HB3 ARG 98 3HB ARG 98 25.776 -26.490 39.992 801 HG2 ARG 98 2HG ARG 98 25.781 -28.667 38.797 802 HG3 ARG 98 3HG ARG 98 25.759 -29.522 40.351 803 HD2 ARG 98 2HD ARG 98 23.504 -29.456 39.420 804 HD3 ARG 98 3HD ARG 98 23.573 -28.477 40.885 805 HE ARG 98 HE ARG 98 23.224 -26.537 39.626 806 HH11 ARG 98 1HH1 ARG 98 23.787 -29.288 37.475 807 HH12 ARG 98 2HH1 ARG 98 23.296 -28.417 36.042 808 HH21 ARG 98 1HH2 ARG 98 22.585 -25.429 37.751 809 HH22 ARG 98 2HH2 ARG 98 22.600 -26.242 36.202 810 H GLY 99 H GLY 99 28.099 -29.494 39.119 811 HA2 GLY 99 2HA GLY 99 28.762 -29.822 36.943 812 HA3 GLY 99 3HA GLY 99 28.619 -28.088 36.632 813 H SER 100 H SER 100 30.744 -29.847 35.733 814 HA SER 100 HA SER 100 33.043 -28.337 36.743 815 HB2 SER 100 2HB SER 100 34.332 -30.359 37.297 816 HB3 SER 100 3HB SER 100 32.918 -30.192 38.351 817 HG SER 100 HG SER 100 31.837 -31.702 37.055 818 H HIS 101 H HIS 101 35.085 -29.129 35.539 819 HA HIS 101 HA HIS 101 34.354 -29.771 32.717 820 HB2 HIS 101 2HB HIS 101 36.695 -28.172 33.797 821 HB3 HIS 101 3HB HIS 101 36.364 -28.517 32.096 822 HD2 HIS 101 HD2 HIS 101 34.072 -27.356 31.039 823 HE1 HIS 101 HE1 HIS 101 33.788 -24.318 34.003 824 HE2 HIS 101 HE2 HIS 101 32.965 -25.080 31.716 825 H HIS 102 H HIS 102 35.917 -31.033 31.495 826 HA HIS 102 HA HIS 102 37.900 -32.562 33.031 827 HB2 HIS 102 2HB HIS 102 35.678 -33.721 33.321 828 HB3 HIS 102 3HB HIS 102 35.622 -33.951 31.570 829 HD2 HIS 102 HD2 HIS 102 38.077 -34.751 34.516 830 HE1 HIS 102 HE1 HIS 102 38.261 -37.999 31.773 831 HE2 HIS 102 HE2 HIS 102 39.112 -37.108 34.006 832 H HIS 103 H HIS 103 39.067 -34.136 31.519 833 HA HIS 103 HA HIS 103 39.680 -32.623 29.063 834 HB2 HIS 103 2HB HIS 103 41.172 -34.868 30.456 835 HB3 HIS 103 3HB HIS 103 41.756 -33.937 29.069 836 HD2 HIS 103 HD2 HIS 103 41.705 -33.914 32.811 837 HE1 HIS 103 HE1 HIS 103 42.928 -29.989 31.721 838 HE2 HIS 103 HE2 HIS 103 42.717 -31.643 33.646 839 H HIS 104 H HIS 104 37.500 -34.960 29.676 840 HA HIS 104 HA HIS 104 37.812 -36.120 26.963 841 HB2 HIS 104 2HB HIS 104 38.781 -37.671 28.678 842 HB3 HIS 104 3HB HIS 104 37.194 -37.744 29.455 843 HD2 HIS 104 HD2 HIS 104 35.894 -39.855 28.777 844 HE1 HIS 104 HE1 HIS 104 37.351 -40.408 24.823 845 HE2 HIS 104 HE2 HIS 104 35.806 -41.338 26.620 846 H HIS 105 H HIS 105 35.761 -37.176 26.224 847 HA HIS 105 HA HIS 105 33.538 -35.390 26.868 848 HB2 HIS 105 2HB HIS 105 32.456 -36.383 24.957 849 HB3 HIS 105 3HB HIS 105 34.112 -35.929 24.548 850 HD2 HIS 105 HD2 HIS 105 35.664 -37.786 23.579 851 HE1 HIS 105 HE1 HIS 105 33.170 -41.168 24.230 852 HE2 HIS 105 HE2 HIS 105 35.322 -40.348 23.151 853 H HIS 106 H HIS 106 31.294 -36.333 27.025 854 HA HIS 106 HA HIS 106 31.140 -38.900 28.478 855 HB2 HIS 106 2HB HIS 106 31.573 -37.195 30.215 856 HB3 HIS 106 3HB HIS 106 30.210 -36.237 29.621 857 HD2 HIS 106 HD2 HIS 106 30.781 -39.878 30.960 858 HE1 HIS 106 HE1 HIS 106 27.004 -38.541 32.387 859 HE2 HIS 106 HE2 HIS 106 28.684 -40.458 32.419 Start of MODEL 8 1 H1 MET 1 H1 MET 1 5.136 6.018 6.667 2 H2 MET 1 H2 MET 1 4.630 7.074 5.517 3 H3 MET 1 H3 MET 1 5.859 7.493 6.529 4 HA MET 1 HA MET 1 6.712 6.953 4.369 5 HB2 MET 1 2HB MET 1 7.382 4.899 6.511 6 HB3 MET 1 3HB MET 1 8.336 5.205 5.048 7 HG2 MET 1 2HG MET 1 7.762 7.203 7.270 8 HG3 MET 1 3HG MET 1 9.288 6.369 6.985 9 HE1 MET 1 1HE MET 1 9.051 9.497 7.379 10 HE2 MET 1 2HE MET 1 10.578 8.622 7.089 11 HE3 MET 1 3HE MET 1 10.182 10.062 6.126 12 H SER 2 H SER 2 7.239 5.201 2.847 13 HA SER 2 HA SER 2 5.275 2.976 2.785 14 HB2 SER 2 2HB SER 2 5.753 4.935 0.502 15 HB3 SER 2 3HB SER 2 4.755 3.471 0.430 16 HG SER 2 HG SER 2 3.524 5.349 0.851 17 H GLU 3 H GLU 3 5.902 1.250 1.315 18 HA GLU 3 HA GLU 3 8.609 1.329 0.192 19 HB2 GLU 3 2HB GLU 3 9.405 -0.577 1.500 20 HB3 GLU 3 3HB GLU 3 9.023 0.792 2.554 21 HG2 GLU 3 2HG GLU 3 6.809 -0.257 3.059 22 HG3 GLU 3 3HG GLU 3 7.259 -1.646 2.054 23 H GLN 4 H GLN 4 9.143 -0.855 -0.812 24 HA GLN 4 HA GLN 4 6.692 -2.235 -1.790 25 HB2 GLN 4 2HB GLN 4 9.032 -1.184 -3.437 26 HB3 GLN 4 3HB GLN 4 7.783 -2.278 -4.048 27 HG2 GLN 4 2HG GLN 4 6.043 -0.579 -3.485 28 HG3 GLN 4 3HG GLN 4 7.309 0.522 -2.934 29 HE21 GLN 4 2HE2 GLN 4 5.928 1.728 -4.729 30 HE22 GLN 4 1HE2 GLN 4 6.630 1.679 -6.335 31 H LEU 5 H LEU 5 9.268 -2.683 0.053 32 HA LEU 5 HA LEU 5 9.836 -5.400 -1.042 33 HB2 LEU 5 2HB LEU 5 11.771 -3.466 0.280 34 HB3 LEU 5 3HB LEU 5 12.154 -5.112 -0.238 35 HG LEU 5 HG LEU 5 11.352 -2.805 -2.063 36 HD11 LEU 5 1HD1 LEU 5 13.697 -2.918 -2.798 37 HD12 LEU 5 2HD1 LEU 5 13.608 -2.584 -1.052 38 HD13 LEU 5 3HD1 LEU 5 14.009 -4.220 -1.623 39 HD21 LEU 5 3HD2 LEU 5 10.689 -5.052 -2.977 40 HD22 LEU 5 1HD2 LEU 5 11.988 -4.280 -3.910 41 HD23 LEU 5 2HD2 LEU 5 12.381 -5.584 -2.777 42 H THR 6 H THR 6 10.463 -6.958 0.565 43 HA THR 6 HA THR 6 9.569 -6.382 3.336 44 HB THR 6 HB THR 6 8.528 -8.690 1.650 45 HG1 THR 6 1HG THR 6 6.594 -7.513 1.667 46 HG21 THR 6 1HG2 THR 6 7.912 -7.674 4.450 47 HG22 THR 6 2HG2 THR 6 6.813 -8.746 3.546 48 HG23 THR 6 3HG2 THR 6 8.445 -9.304 3.958 49 H ASP 7 H ASP 7 10.001 -8.482 4.711 50 HA ASP 7 HA ASP 7 12.750 -9.023 4.691 51 HB2 ASP 7 2HB ASP 7 12.195 -10.782 6.312 52 HB3 ASP 7 3HB ASP 7 11.311 -9.283 6.630 53 H GLN 8 H GLN 8 10.291 -10.407 2.663 54 HA GLN 8 HA GLN 8 11.539 -12.931 2.135 55 HB2 GLN 8 2HB GLN 8 9.197 -12.473 1.578 56 HB3 GLN 8 3HB GLN 8 9.680 -11.161 0.488 57 HG2 GLN 8 2HG GLN 8 9.123 -13.167 -0.800 58 HG3 GLN 8 3HG GLN 8 10.829 -12.773 -0.986 59 HE21 GLN 8 2HE2 GLN 8 12.431 -14.099 0.109 60 HE22 GLN 8 1HE2 GLN 8 12.026 -15.725 0.631 61 H VAL 9 H VAL 9 11.641 -9.771 0.424 62 HA VAL 9 HA VAL 9 13.681 -10.780 -1.420 63 HB VAL 9 HB VAL 9 11.980 -9.453 -2.386 64 HG11 VAL 9 1HG1 VAL 9 12.585 -7.318 -0.310 65 HG12 VAL 9 2HG1 VAL 9 11.451 -7.157 -1.675 66 HG13 VAL 9 3HG1 VAL 9 11.118 -8.335 -0.403 67 HG21 VAL 9 3HG2 VAL 9 13.194 -7.597 -3.376 68 HG22 VAL 9 1HG2 VAL 9 14.358 -7.579 -2.039 69 HG23 VAL 9 2HG2 VAL 9 14.313 -8.960 -3.169 70 H LEU 10 H LEU 10 13.518 -8.844 1.532 71 HA LEU 10 HA LEU 10 16.123 -7.661 1.262 72 HB2 LEU 10 2HB LEU 10 14.057 -8.018 3.397 73 HB3 LEU 10 3HB LEU 10 15.726 -7.785 3.944 74 HG LEU 10 HG LEU 10 15.932 -5.724 2.687 75 HD11 LEU 10 1HD1 LEU 10 14.490 -6.199 0.765 76 HD12 LEU 10 2HD1 LEU 10 13.053 -6.168 1.819 77 HD13 LEU 10 3HD1 LEU 10 14.005 -4.690 1.560 78 HD21 LEU 10 3HD2 LEU 10 14.982 -5.671 4.973 79 HD22 LEU 10 1HD2 LEU 10 14.299 -4.374 3.967 80 HD23 LEU 10 2HD2 LEU 10 13.342 -5.837 4.303 81 H VAL 11 H VAL 11 14.986 -10.874 2.346 82 HA VAL 11 HA VAL 11 17.637 -11.510 3.416 83 HB VAL 11 HB VAL 11 15.124 -13.153 3.008 84 HG11 VAL 11 1HG1 VAL 11 16.349 -14.875 4.370 85 HG12 VAL 11 2HG1 VAL 11 16.990 -14.684 2.724 86 HG13 VAL 11 3HG1 VAL 11 17.852 -13.961 4.101 87 HG21 VAL 11 3HG2 VAL 11 15.123 -13.141 5.464 88 HG22 VAL 11 1HG2 VAL 11 16.662 -12.245 5.488 89 HG23 VAL 11 2HG2 VAL 11 15.188 -11.463 4.878 90 H GLU 12 H GLU 12 15.878 -11.874 0.333 91 HA GLU 12 HA GLU 12 17.811 -13.722 -0.794 92 HB2 GLU 12 2HB GLU 12 15.776 -11.806 -1.984 93 HB3 GLU 12 3HB GLU 12 16.822 -12.850 -2.966 94 HG2 GLU 12 2HG GLU 12 15.927 -14.850 -1.812 95 HG3 GLU 12 3HG GLU 12 14.870 -13.816 -0.838 96 H ARG 13 H ARG 13 17.536 -10.177 -0.530 97 HA ARG 13 HA ARG 13 19.568 -9.611 -2.481 98 HB2 ARG 13 2HB ARG 13 17.759 -8.086 -1.891 99 HB3 ARG 13 3HB ARG 13 18.374 -7.946 -0.231 100 HG2 ARG 13 2HG ARG 13 20.371 -6.843 -0.974 101 HG3 ARG 13 3HG ARG 13 20.019 -7.191 -2.682 102 HD2 ARG 13 2HD ARG 13 18.284 -5.475 -0.866 103 HD3 ARG 13 3HD ARG 13 19.483 -4.842 -2.018 104 HE ARG 13 HE ARG 13 17.771 -6.551 -3.458 105 HH11 ARG 13 1HH1 ARG 13 17.566 -3.492 -1.689 106 HH12 ARG 13 2HH1 ARG 13 16.245 -2.884 -2.665 107 HH21 ARG 13 1HH2 ARG 13 16.050 -5.723 -4.716 108 HH22 ARG 13 2HH2 ARG 13 15.403 -4.137 -4.367 109 H VAL 14 H VAL 14 19.658 -10.042 1.087 110 HA VAL 14 HA VAL 14 22.438 -9.259 1.264 111 HB VAL 14 HB VAL 14 22.328 -10.162 3.531 112 HG11 VAL 14 1HG1 VAL 14 20.394 -8.751 4.322 113 HG12 VAL 14 2HG1 VAL 14 21.493 -7.924 3.177 114 HG13 VAL 14 3HG1 VAL 14 19.912 -8.532 2.637 115 HG21 VAL 14 3HG2 VAL 14 19.544 -11.091 2.757 116 HG22 VAL 14 1HG2 VAL 14 20.923 -12.142 3.185 117 HG23 VAL 14 2HG2 VAL 14 20.210 -11.062 4.404 118 H GLN 15 H GLN 15 20.764 -12.246 0.438 119 HA GLN 15 HA GLN 15 23.133 -13.921 0.754 120 HB2 GLN 15 2HB GLN 15 20.446 -14.292 -0.613 121 HB3 GLN 15 3HB GLN 15 21.704 -15.539 -0.560 122 HG2 GLN 15 2HG GLN 15 21.656 -15.573 1.888 123 HG3 GLN 15 3HG GLN 15 20.493 -14.253 1.922 124 HE21 GLN 15 2HE2 GLN 15 19.826 -16.575 3.243 125 HE22 GLN 15 1HE2 GLN 15 18.584 -17.437 2.359 126 H LYS 16 H LYS 16 21.964 -11.664 -1.599 127 HA LYS 16 HA LYS 16 23.554 -12.819 -3.788 128 HB2 LYS 16 2HB LYS 16 21.584 -10.530 -3.573 129 HB3 LYS 16 3HB LYS 16 22.535 -10.837 -5.044 130 HG2 LYS 16 2HG LYS 16 21.631 -13.064 -5.277 131 HG3 LYS 16 3HG LYS 16 20.851 -12.982 -3.691 132 HD2 LYS 16 2HD LYS 16 19.460 -11.077 -4.511 133 HD3 LYS 16 3HD LYS 16 20.155 -11.307 -6.133 134 HE2 LYS 16 2HE LYS 16 19.342 -13.656 -6.128 135 HE3 LYS 16 3HE LYS 16 18.655 -13.412 -4.515 136 HZ1 LYS 16 3HZ LYS 16 16.997 -13.161 -6.216 137 HZ2 LYS 16 1HZ LYS 16 17.215 -11.731 -5.442 138 HZ3 LYS 16 2HZ LYS 16 17.850 -11.954 -6.943 139 H GLY 17 H GLY 17 24.326 -11.049 -1.118 140 HA2 GLY 17 2HA GLY 17 26.631 -10.509 -0.834 141 HA3 GLY 17 3HA GLY 17 26.725 -10.018 -2.532 142 H ASP 18 H ASP 18 23.838 -8.766 -1.283 143 HA ASP 18 HA ASP 18 25.115 -6.118 -0.896 144 HB2 ASP 18 2HB ASP 18 22.363 -7.115 -1.632 145 HB3 ASP 18 3HB ASP 18 22.589 -5.473 -1.050 146 H GLN 19 H GLN 19 25.948 -6.585 1.216 147 HA GLN 19 HA GLN 19 24.294 -7.478 3.361 148 HB2 GLN 19 2HB GLN 19 26.736 -7.702 3.228 149 HB3 GLN 19 3HB GLN 19 26.933 -5.950 3.337 150 HG2 GLN 19 2HG GLN 19 25.452 -7.521 5.471 151 HG3 GLN 19 3HG GLN 19 27.214 -7.445 5.468 152 HE21 GLN 19 2HE2 GLN 19 25.880 -6.489 7.662 153 HE22 GLN 19 1HE2 GLN 19 26.007 -4.741 7.717 154 H LYS 20 H LYS 20 24.584 -4.423 1.754 155 HA LYS 20 HA LYS 20 23.892 -2.639 3.848 156 HB2 LYS 20 2HB LYS 20 23.216 -1.154 2.023 157 HB3 LYS 20 3HB LYS 20 24.715 -1.995 1.596 158 HG2 LYS 20 2HG LYS 20 23.350 -3.656 0.282 159 HG3 LYS 20 3HG LYS 20 21.899 -2.698 0.648 160 HD2 LYS 20 2HD LYS 20 22.961 -0.731 -0.468 161 HD3 LYS 20 3HD LYS 20 24.364 -1.750 -0.869 162 HE2 LYS 20 2HE LYS 20 22.837 -3.305 -2.092 163 HE3 LYS 20 3HE LYS 20 21.487 -2.212 -1.742 164 HZ1 LYS 20 3HZ LYS 20 22.403 -1.814 -3.927 165 HZ2 LYS 20 1HZ LYS 20 22.646 -0.499 -2.975 166 HZ3 LYS 20 2HZ LYS 20 23.893 -1.522 -3.301 167 H ALA 21 H ALA 21 21.990 -5.037 2.108 168 HA ALA 21 HA ALA 21 19.442 -3.840 2.888 169 HB1 ALA 21 1HB ALA 21 20.129 -6.546 1.680 170 HB2 ALA 21 2HB ALA 21 18.494 -5.869 1.862 171 HB3 ALA 21 3HB ALA 21 19.671 -5.077 0.784 172 H PHE 22 H PHE 22 21.797 -5.978 4.363 173 HA PHE 22 HA PHE 22 19.873 -7.242 6.146 174 HB2 PHE 22 2HB PHE 22 22.054 -8.293 5.531 175 HB3 PHE 22 3HB PHE 22 22.893 -7.006 6.388 176 HD1 PHE 22 HD1 PHE 22 20.110 -9.489 6.934 177 HD2 PHE 22 HD2 PHE 22 23.489 -7.429 8.620 178 HE1 PHE 22 HE1 PHE 22 19.830 -10.757 9.044 179 HE2 PHE 22 HE2 PHE 22 23.206 -8.707 10.732 180 HZ PHE 22 HZ PHE 22 21.368 -10.358 10.944 181 H ASN 23 H ASN 23 22.056 -4.414 6.189 182 HA ASN 23 HA ASN 23 21.711 -3.711 8.924 183 HB2 ASN 23 2HB ASN 23 23.464 -2.708 7.636 184 HB3 ASN 23 3HB ASN 23 22.340 -2.233 6.359 185 HD21 ASN 23 2HD2 ASN 23 21.308 -0.298 6.416 186 HD22 ASN 23 1HD2 ASN 23 21.466 0.849 7.727 187 H LEU 24 H LEU 24 19.856 -2.932 5.974 188 HA LEU 24 HA LEU 24 17.943 -1.263 7.370 189 HB2 LEU 24 2HB LEU 24 17.903 -2.592 4.626 190 HB3 LEU 24 3HB LEU 24 16.733 -1.386 5.182 191 HG LEU 24 HG LEU 24 19.738 -0.904 4.963 192 HD11 LEU 24 1HD1 LEU 24 17.442 -0.055 3.150 193 HD12 LEU 24 2HD1 LEU 24 19.146 0.432 2.980 194 HD13 LEU 24 3HD1 LEU 24 18.682 -1.274 2.773 195 HD21 LEU 24 3HD2 LEU 24 18.676 0.549 6.633 196 HD22 LEU 24 1HD2 LEU 24 19.096 1.473 5.178 197 HD23 LEU 24 2HD2 LEU 24 17.409 0.994 5.458 198 H LEU 25 H LEU 25 18.326 -4.686 6.927 199 HA LEU 25 HA LEU 25 15.496 -5.287 7.401 200 HB2 LEU 25 2HB LEU 25 16.868 -6.698 5.924 201 HB3 LEU 25 3HB LEU 25 17.994 -7.020 7.244 202 HG LEU 25 HG LEU 25 16.178 -8.163 8.508 203 HD11 LEU 25 1HD1 LEU 25 14.587 -7.736 5.946 204 HD12 LEU 25 2HD1 LEU 25 14.112 -8.790 7.293 205 HD13 LEU 25 3HD1 LEU 25 14.213 -7.032 7.543 206 HD21 LEU 25 3HD2 LEU 25 16.662 -9.124 5.652 207 HD22 LEU 25 1HD2 LEU 25 17.722 -9.415 7.052 208 HD23 LEU 25 2HD2 LEU 25 16.106 -10.146 7.003 209 H VAL 26 H VAL 26 18.586 -5.490 9.310 210 HA VAL 26 HA VAL 26 17.185 -6.684 11.518 211 HB VAL 26 HB VAL 26 19.152 -6.352 12.818 212 HG11 VAL 26 1HG1 VAL 26 19.928 -7.054 9.971 213 HG12 VAL 26 2HG1 VAL 26 20.816 -7.478 11.448 214 HG13 VAL 26 3HG1 VAL 26 19.193 -8.154 11.164 215 HG21 VAL 26 3HG2 VAL 26 19.728 -4.070 12.277 216 HG22 VAL 26 1HG2 VAL 26 21.120 -5.121 11.964 217 HG23 VAL 26 2HG2 VAL 26 20.143 -4.523 10.602 218 H VAL 27 H VAL 27 17.557 -3.306 10.508 219 HA VAL 27 HA VAL 27 17.116 -2.248 13.149 220 HB VAL 27 HB VAL 27 18.176 -0.977 11.350 221 HG11 VAL 27 1HG1 VAL 27 16.775 -1.720 9.469 222 HG12 VAL 27 2HG1 VAL 27 15.381 -0.835 10.144 223 HG13 VAL 27 3HG1 VAL 27 16.820 0.054 9.587 224 HG21 VAL 27 3HG2 VAL 27 15.607 0.306 12.372 225 HG22 VAL 27 1HG2 VAL 27 17.124 0.165 13.281 226 HG23 VAL 27 2HG2 VAL 27 17.057 1.156 11.805 227 H ARG 28 H ARG 28 14.968 -3.519 10.646 228 HA ARG 28 HA ARG 28 12.521 -2.434 11.705 229 HB2 ARG 28 2HB ARG 28 12.902 -5.111 10.306 230 HB3 ARG 28 3HB ARG 28 11.440 -4.110 10.353 231 HG2 ARG 28 2HG ARG 28 12.600 -2.390 8.972 232 HG3 ARG 28 3HG ARG 28 14.071 -3.396 8.996 233 HD2 ARG 28 2HD ARG 28 12.961 -3.796 6.909 234 HD3 ARG 28 3HD ARG 28 12.817 -5.240 7.913 235 HE ARG 28 HE ARG 28 10.494 -4.710 8.337 236 HH11 ARG 28 1HH1 ARG 28 12.042 -2.678 5.887 237 HH12 ARG 28 2HH1 ARG 28 10.523 -2.208 5.162 238 HH21 ARG 28 1HH2 ARG 28 8.535 -4.063 7.368 239 HH22 ARG 28 2HH2 ARG 28 8.557 -2.979 5.994 240 H TYR 29 H TYR 29 14.565 -5.215 12.432 241 HA TYR 29 HA TYR 29 12.613 -6.229 14.419 242 HB2 TYR 29 2HB TYR 29 15.149 -7.393 13.225 243 HB3 TYR 29 3HB TYR 29 14.206 -8.164 14.485 244 HD1 TYR 29 HD1 TYR 29 14.015 -6.988 10.959 245 HD2 TYR 29 HD2 TYR 29 12.247 -9.374 14.059 246 HE1 TYR 29 HE1 TYR 29 12.431 -7.928 9.308 247 HE2 TYR 29 HE2 TYR 29 10.655 -10.341 12.422 248 HH TYR 29 HH TYR 29 10.665 -9.375 8.967 249 H GLN 30 H GLN 30 15.264 -4.099 14.387 250 HA GLN 30 HA GLN 30 16.675 -4.998 16.688 251 HB2 GLN 30 2HB GLN 30 17.452 -3.374 14.956 252 HB3 GLN 30 3HB GLN 30 16.353 -2.158 15.624 253 HG2 GLN 30 2HG GLN 30 17.574 -2.199 17.753 254 HG3 GLN 30 3HG GLN 30 18.571 -3.553 17.173 255 HE21 GLN 30 2HE2 GLN 30 19.662 -3.081 14.923 256 HE22 GLN 30 1HE2 GLN 30 20.426 -1.509 14.794 257 H HIS 31 H HIS 31 13.695 -3.114 16.319 258 HA HIS 31 HA HIS 31 13.599 -2.507 19.197 259 HB2 HIS 31 2HB HIS 31 12.781 -0.903 17.510 260 HB3 HIS 31 3HB HIS 31 11.583 -2.085 16.967 261 HD2 HIS 31 HD2 HIS 31 9.279 -2.026 18.160 262 HE1 HIS 31 HE1 HIS 31 10.283 0.338 21.548 263 HE2 HIS 31 HE2 HIS 31 8.383 -0.812 20.298 264 H LYS 32 H LYS 32 12.265 -4.920 16.942 265 HA LYS 32 HA LYS 32 10.242 -5.777 18.886 266 HB2 LYS 32 2HB LYS 32 11.078 -6.913 16.189 267 HB3 LYS 32 3HB LYS 32 9.687 -7.444 17.156 268 HG2 LYS 32 2HG LYS 32 8.749 -5.121 17.032 269 HG3 LYS 32 3HG LYS 32 10.124 -4.639 16.025 270 HD2 LYS 32 2HD LYS 32 8.233 -5.100 14.588 271 HD3 LYS 32 3HD LYS 32 9.473 -6.335 14.336 272 HE2 LYS 32 2HE LYS 32 7.295 -7.395 14.409 273 HE3 LYS 32 3HE LYS 32 8.207 -7.878 15.849 274 HZ1 LYS 32 3HZ LYS 32 6.998 -6.227 17.093 275 HZ2 LYS 32 1HZ LYS 32 6.159 -5.769 15.749 276 HZ3 LYS 32 2HZ LYS 32 5.957 -7.274 16.372 277 H VAL 33 H VAL 33 13.454 -6.864 17.807 278 HA VAL 33 HA VAL 33 13.336 -9.438 19.121 279 HB VAL 33 HB VAL 33 15.665 -7.677 18.217 280 HG11 VAL 33 1HG1 VAL 33 15.479 -10.642 18.760 281 HG12 VAL 33 2HG1 VAL 33 16.903 -9.777 18.117 282 HG13 VAL 33 3HG1 VAL 33 16.358 -9.482 19.804 283 HG21 VAL 33 3HG2 VAL 33 14.551 -10.177 16.896 284 HG22 VAL 33 1HG2 VAL 33 14.030 -8.548 16.412 285 HG23 VAL 33 2HG2 VAL 33 15.761 -9.031 16.271 286 H ALA 34 H ALA 34 14.483 -6.141 19.928 287 HA ALA 34 HA ALA 34 15.684 -6.798 22.410 288 HB1 ALA 34 1HB ALA 34 14.313 -4.226 21.510 289 HB2 ALA 34 2HB ALA 34 15.451 -4.382 22.869 290 HB3 ALA 34 3HB ALA 34 16.016 -4.657 21.213 291 H SER 35 H SER 35 12.284 -6.441 21.465 292 HA SER 35 HA SER 35 11.288 -5.955 24.131 293 HB2 SER 35 2HB SER 35 10.088 -5.367 22.026 294 HB3 SER 35 3HB SER 35 9.879 -7.100 21.693 295 HG SER 35 HG SER 35 8.077 -6.144 22.774 296 H LEU 36 H LEU 36 11.531 -8.906 22.048 297 HA LEU 36 HA LEU 36 10.363 -10.513 24.176 298 HB2 LEU 36 2HB LEU 36 10.541 -12.361 22.660 299 HB3 LEU 36 3HB LEU 36 9.967 -10.939 21.785 300 HG LEU 36 HG LEU 36 12.539 -10.666 21.149 301 HD11 LEU 36 1HD1 LEU 36 13.628 -12.883 20.869 302 HD12 LEU 36 2HD1 LEU 36 13.396 -12.537 22.591 303 HD13 LEU 36 3HD1 LEU 36 12.296 -13.655 21.756 304 HD21 LEU 36 3HD2 LEU 36 10.737 -12.848 20.028 305 HD22 LEU 36 1HD2 LEU 36 10.719 -11.129 19.566 306 HD23 LEU 36 2HD2 LEU 36 12.142 -12.135 19.209 307 H VAL 37 H VAL 37 13.631 -9.641 23.168 308 HA VAL 37 HA VAL 37 14.768 -11.865 24.681 309 HB VAL 37 HB VAL 37 15.614 -10.877 22.479 310 HG11 VAL 37 1HG1 VAL 37 17.078 -9.054 22.505 311 HG12 VAL 37 2HG1 VAL 37 15.698 -8.500 23.500 312 HG13 VAL 37 3HG1 VAL 37 17.206 -9.050 24.275 313 HG21 VAL 37 3HG2 VAL 37 17.586 -11.294 24.762 314 HG22 VAL 37 1HG2 VAL 37 16.779 -12.589 23.841 315 HG23 VAL 37 2HG2 VAL 37 17.910 -11.485 23.027 316 H SER 38 H SER 38 13.734 -8.634 25.403 317 HA SER 38 HA SER 38 15.462 -8.181 27.656 318 HB2 SER 38 2HB SER 38 14.114 -6.417 26.538 319 HB3 SER 38 3HB SER 38 12.630 -7.200 27.116 320 HG SER 38 HG SER 38 13.321 -5.509 28.491 321 H ARG 39 H ARG 39 12.992 -10.475 27.041 322 HA ARG 39 HA ARG 39 12.209 -10.835 29.838 323 HB2 ARG 39 2HB ARG 39 11.692 -12.590 27.416 324 HB3 ARG 39 3HB ARG 39 10.856 -12.658 28.975 325 HG2 ARG 39 2HG ARG 39 9.995 -10.350 28.611 326 HG3 ARG 39 3HG ARG 39 10.785 -10.316 27.019 327 HD2 ARG 39 2HD ARG 39 8.639 -12.271 27.914 328 HD3 ARG 39 3HD ARG 39 8.407 -10.908 26.805 329 HE ARG 39 HE ARG 39 10.479 -12.489 25.732 330 HH11 ARG 39 1HH1 ARG 39 7.032 -12.775 26.442 331 HH12 ARG 39 2HH1 ARG 39 6.748 -13.961 25.186 332 HH21 ARG 39 1HH2 ARG 39 10.081 -14.068 24.111 333 HH22 ARG 39 2HH2 ARG 39 8.464 -14.681 23.875 334 H TYR 40 H TYR 40 14.956 -11.644 28.050 335 HA TYR 40 HA TYR 40 15.431 -14.061 29.728 336 HB2 TYR 40 2HB TYR 40 16.322 -13.519 26.883 337 HB3 TYR 40 3HB TYR 40 16.787 -14.918 27.852 338 HD1 TYR 40 HD1 TYR 40 14.973 -16.512 28.667 339 HD2 TYR 40 HD2 TYR 40 14.273 -13.515 25.666 340 HE1 TYR 40 HE1 TYR 40 12.931 -17.717 27.941 341 HE2 TYR 40 HE2 TYR 40 12.242 -14.724 24.918 342 HH TYR 40 HH TYR 40 11.154 -17.760 26.486 343 H VAL 41 H VAL 41 16.520 -10.892 28.917 344 HA VAL 41 HA VAL 41 18.781 -11.272 30.761 345 HB VAL 41 HB VAL 41 20.205 -9.803 29.230 346 HG11 VAL 41 1HG1 VAL 41 21.148 -11.685 28.044 347 HG12 VAL 41 2HG1 VAL 41 20.655 -12.212 29.661 348 HG13 VAL 41 3HG1 VAL 41 19.651 -12.627 28.255 349 HG21 VAL 41 3HG2 VAL 41 18.342 -10.879 27.088 350 HG22 VAL 41 1HG2 VAL 41 18.376 -9.195 27.643 351 HG23 VAL 41 2HG2 VAL 41 19.807 -9.893 26.849 352 HA PRO 42 HA PRO 42 17.249 -7.461 32.287 353 HB2 PRO 42 2HB PRO 42 19.474 -6.219 33.296 354 HB3 PRO 42 3HB PRO 42 18.782 -7.711 34.018 355 HG2 PRO 42 2HG PRO 42 21.046 -7.500 32.003 356 HG3 PRO 42 3HG PRO 42 21.054 -8.375 33.573 357 HD2 PRO 42 2HD PRO 42 20.522 -9.686 31.277 358 HD3 PRO 42 3HD PRO 42 19.547 -10.033 32.737 359 H SER 43 H SER 43 17.353 -5.075 32.049 360 HA SER 43 HA SER 43 17.469 -4.419 29.285 361 HB2 SER 43 2HB SER 43 16.841 -2.170 30.020 362 HB3 SER 43 3HB SER 43 15.899 -3.405 30.879 363 HG SER 43 HG SER 43 17.259 -3.127 32.661 364 H GLY 44 H GLY 44 20.034 -4.545 31.546 365 HA2 GLY 44 2HA GLY 44 21.602 -2.410 30.261 366 HA3 GLY 44 3HA GLY 44 22.105 -3.465 31.592 367 H ASP 45 H ASP 45 21.045 -5.841 29.845 368 HA ASP 45 HA ASP 45 23.486 -6.045 28.136 369 HB2 ASP 45 2HB ASP 45 21.976 -8.187 29.667 370 HB3 ASP 45 3HB ASP 45 23.348 -8.471 28.584 371 H VAL 46 H VAL 46 20.144 -5.675 28.014 372 HA VAL 46 HA VAL 46 19.473 -7.657 26.081 373 HB VAL 46 HB VAL 46 17.919 -6.475 27.634 374 HG11 VAL 46 1HG1 VAL 46 18.593 -4.140 27.267 375 HG12 VAL 46 2HG1 VAL 46 18.057 -4.244 25.563 376 HG13 VAL 46 3HG1 VAL 46 16.878 -4.389 26.878 377 HG21 VAL 46 3HG2 VAL 46 17.263 -6.541 24.664 378 HG22 VAL 46 1HG2 VAL 46 17.060 -7.847 25.870 379 HG23 VAL 46 2HG2 VAL 46 16.069 -6.377 25.965 380 HA PRO 47 HA PRO 47 20.095 -4.379 22.737 381 HB2 PRO 47 2HB PRO 47 21.984 -2.451 22.925 382 HB3 PRO 47 3HB PRO 47 20.380 -2.261 23.714 383 HG2 PRO 47 2HG PRO 47 22.965 -3.215 24.974 384 HG3 PRO 47 3HG PRO 47 21.855 -1.940 25.573 385 HD2 PRO 47 2HD PRO 47 21.762 -4.503 26.470 386 HD3 PRO 47 3HD PRO 47 20.282 -3.516 26.301 387 H ASP 48 H ASP 48 22.773 -5.669 24.630 388 HA ASP 48 HA ASP 48 24.587 -5.831 22.348 389 HB2 ASP 48 2HB ASP 48 25.333 -5.504 24.711 390 HB3 ASP 48 3HB ASP 48 24.725 -7.126 25.096 391 H VAL 49 H VAL 49 22.186 -7.881 23.954 392 HA VAL 49 HA VAL 49 23.067 -10.298 22.590 393 HB VAL 49 HB VAL 49 20.580 -9.604 24.191 394 HG11 VAL 49 1HG1 VAL 49 20.207 -12.047 24.280 395 HG12 VAL 49 2HG1 VAL 49 20.076 -11.438 22.610 396 HG13 VAL 49 3HG1 VAL 49 21.546 -12.296 23.133 397 HG21 VAL 49 3HG2 VAL 49 22.736 -9.672 25.461 398 HG22 VAL 49 1HG2 VAL 49 21.665 -11.012 25.910 399 HG23 VAL 49 2HG2 VAL 49 23.040 -11.301 24.825 400 H VAL 50 H VAL 50 20.801 -7.632 21.910 401 HA VAL 50 HA VAL 50 19.522 -8.946 19.664 402 HB VAL 50 HB VAL 50 19.919 -6.035 20.448 403 HG11 VAL 50 1HG1 VAL 50 18.288 -7.222 18.156 404 HG12 VAL 50 2HG1 VAL 50 18.189 -5.542 18.725 405 HG13 VAL 50 3HG1 VAL 50 19.691 -6.142 18.000 406 HG21 VAL 50 3HG2 VAL 50 18.401 -7.446 21.863 407 HG22 VAL 50 1HG2 VAL 50 17.533 -6.166 20.977 408 HG23 VAL 50 2HG2 VAL 50 17.467 -7.843 20.398 409 H GLN 51 H GLN 51 22.494 -6.990 20.126 410 HA GLN 51 HA GLN 51 23.068 -6.825 17.307 411 HB2 GLN 51 2HB GLN 51 23.983 -5.251 18.970 412 HB3 GLN 51 3HB GLN 51 24.912 -6.574 19.717 413 HG2 GLN 51 2HG GLN 51 26.173 -6.910 17.657 414 HG3 GLN 51 3HG GLN 51 25.187 -5.700 16.815 415 HE21 GLN 51 2HE2 GLN 51 27.689 -5.101 16.530 416 HE22 GLN 51 1HE2 GLN 51 28.255 -3.893 17.664 417 H GLU 52 H GLU 52 24.088 -9.078 19.952 418 HA GLU 52 HA GLU 52 25.817 -10.561 18.201 419 HB2 GLU 52 2HB GLU 52 25.991 -10.539 20.681 420 HB3 GLU 52 3HB GLU 52 24.465 -11.460 20.777 421 HG2 GLU 52 2HG GLU 52 25.449 -13.352 19.659 422 HG3 GLU 52 3HG GLU 52 26.875 -12.417 19.189 423 H ALA 53 H ALA 53 22.334 -10.626 18.849 424 HA ALA 53 HA ALA 53 21.898 -13.217 17.660 425 HB1 ALA 53 1HB ALA 53 20.028 -10.851 18.071 426 HB2 ALA 53 2HB ALA 53 19.533 -12.503 17.622 427 HB3 ALA 53 3HB ALA 53 20.286 -12.201 19.203 428 H PHE 54 H PHE 54 22.004 -9.842 16.409 429 HA PHE 54 HA PHE 54 21.209 -10.643 13.735 430 HB2 PHE 54 2HB PHE 54 22.594 -8.158 14.803 431 HB3 PHE 54 3HB PHE 54 22.024 -8.356 13.147 432 HD1 PHE 54 HD1 PHE 54 19.395 -9.879 13.938 433 HD2 PHE 54 HD2 PHE 54 21.240 -6.239 15.322 434 HE1 PHE 54 HE1 PHE 54 17.195 -9.015 14.603 435 HE2 PHE 54 HE2 PHE 54 19.006 -5.352 15.919 436 HZ PHE 54 HZ PHE 54 16.984 -6.750 15.577 437 H ILE 55 H ILE 55 24.364 -10.298 15.419 438 HA ILE 55 HA ILE 55 25.895 -10.602 12.985 439 HB ILE 55 HB ILE 55 26.576 -11.086 15.911 440 HG12 ILE 55 2HG1 ILE 55 27.313 -8.771 14.053 441 HG13 ILE 55 3HG1 ILE 55 25.985 -8.726 15.200 442 HG21 ILE 55 1HG2 ILE 55 28.057 -12.403 14.410 443 HG22 ILE 55 2HG2 ILE 55 28.417 -10.925 13.477 444 HG23 ILE 55 3HG2 ILE 55 28.941 -11.079 15.168 445 HD11 ILE 55 3HD1 ILE 55 28.934 -9.087 15.888 446 HD12 ILE 55 1HD1 ILE 55 27.932 -7.654 16.183 447 HD13 ILE 55 2HD1 ILE 55 27.605 -9.161 17.067 448 H LYS 56 H LYS 56 24.556 -12.801 15.441 449 HA LYS 56 HA LYS 56 25.731 -15.204 14.326 450 HB2 LYS 56 2HB LYS 56 25.099 -14.890 16.697 451 HB3 LYS 56 3HB LYS 56 23.394 -14.751 16.226 452 HG2 LYS 56 2HG LYS 56 23.487 -17.067 15.309 453 HG3 LYS 56 3HG LYS 56 25.176 -17.197 15.844 454 HD2 LYS 56 2HD LYS 56 22.775 -16.647 17.639 455 HD3 LYS 56 3HD LYS 56 23.580 -18.217 17.472 456 HE2 LYS 56 2HE LYS 56 24.870 -15.657 18.509 457 HE3 LYS 56 3HE LYS 56 24.290 -16.996 19.512 458 HZ1 LYS 56 3HZ LYS 56 26.415 -17.208 17.489 459 HZ2 LYS 56 1HZ LYS 56 26.645 -17.149 19.119 460 HZ3 LYS 56 2HZ LYS 56 25.877 -18.432 18.443 461 H ALA 57 H ALA 57 22.695 -13.385 13.861 462 HA ALA 57 HA ALA 57 21.344 -15.485 12.449 463 HB1 ALA 57 1HB ALA 57 20.967 -12.461 12.399 464 HB2 ALA 57 2HB ALA 57 19.851 -13.650 11.691 465 HB3 ALA 57 3HB ALA 57 20.114 -13.628 13.443 466 H TYR 58 H TYR 58 23.401 -12.691 11.349 467 HA TYR 58 HA TYR 58 22.826 -13.038 8.599 468 HB2 TYR 58 2HB TYR 58 23.942 -11.075 9.665 469 HB3 TYR 58 3HB TYR 58 25.386 -12.062 9.914 470 HD1 TYR 58 HD2 TYR 58 23.081 -10.828 7.223 471 HD2 TYR 58 HD1 TYR 58 27.022 -12.203 8.249 472 HE1 TYR 58 HE2 TYR 58 23.890 -10.167 4.975 473 HE2 TYR 58 HE1 TYR 58 27.840 -11.582 5.993 474 HH TYR 58 HH TYR 58 27.293 -10.669 3.954 475 H ARG 59 H ARG 59 25.259 -14.569 10.706 476 HA ARG 59 HA ARG 59 26.701 -15.872 8.575 477 HB2 ARG 59 2HB ARG 59 26.513 -16.390 11.567 478 HB3 ARG 59 3HB ARG 59 27.686 -17.161 10.486 479 HG2 ARG 59 2HG ARG 59 28.712 -15.043 9.946 480 HG3 ARG 59 3HG ARG 59 27.428 -14.127 10.767 481 HD2 ARG 59 2HD ARG 59 28.058 -15.053 12.918 482 HD3 ARG 59 3HD ARG 59 29.236 -16.131 12.138 483 HE ARG 59 HE ARG 59 29.901 -13.486 11.404 484 HH11 ARG 59 1HH1 ARG 59 29.764 -15.448 14.339 485 HH12 ARG 59 2HH1 ARG 59 31.030 -14.550 15.146 486 HH21 ARG 59 1HH2 ARG 59 31.555 -12.324 12.487 487 HH22 ARG 59 2HH2 ARG 59 32.037 -12.783 14.099 488 H ALA 60 H ALA 60 23.822 -16.628 10.432 489 HA ALA 60 HA ALA 60 23.735 -19.387 9.363 490 HB1 ALA 60 1HB ALA 60 21.893 -17.895 11.275 491 HB2 ALA 60 2HB ALA 60 21.805 -19.624 10.863 492 HB3 ALA 60 3HB ALA 60 23.209 -18.989 11.747 493 H LEU 61 H LEU 61 22.736 -16.246 8.444 494 HA LEU 61 HA LEU 61 20.176 -16.923 7.314 495 HB2 LEU 61 2HB LEU 61 20.973 -14.637 8.120 496 HB3 LEU 61 3HB LEU 61 22.008 -14.571 6.681 497 HG LEU 61 HG LEU 61 19.930 -14.843 5.274 498 HD11 LEU 61 1HD1 LEU 61 18.605 -14.489 7.993 499 HD12 LEU 61 2HD1 LEU 61 17.763 -14.327 6.432 500 HD13 LEU 61 3HD1 LEU 61 18.435 -15.896 6.917 501 HD21 LEU 61 3HD2 LEU 61 19.171 -12.526 5.665 502 HD22 LEU 61 1HD2 LEU 61 19.967 -12.527 7.257 503 HD23 LEU 61 2HD2 LEU 61 20.946 -12.642 5.770 504 H ASP 62 H ASP 62 23.525 -17.054 6.245 505 HA ASP 62 HA ASP 62 23.028 -17.315 3.435 506 HB2 ASP 62 2HB ASP 62 25.221 -16.819 4.506 507 HB3 ASP 62 3HB ASP 62 25.246 -18.466 5.168 508 H SER 63 H SER 63 22.183 -19.319 6.078 509 HA SER 63 HA SER 63 22.027 -21.732 4.354 510 HB2 SER 63 2HB SER 63 21.906 -21.456 7.379 511 HB3 SER 63 3HB SER 63 21.875 -22.974 6.464 512 HG SER 63 HG SER 63 23.947 -22.445 5.676 513 H PHE 64 H PHE 64 20.130 -19.158 5.093 514 HA PHE 64 HA PHE 64 17.671 -20.521 5.838 515 HB2 PHE 64 2HB PHE 64 18.193 -18.209 6.495 516 HB3 PHE 64 3HB PHE 64 18.213 -17.727 4.797 517 HD1 PHE 64 HD2 PHE 64 16.008 -19.215 7.426 518 HD2 PHE 64 HD1 PHE 64 16.239 -17.011 3.748 519 HE1 PHE 64 HE2 PHE 64 13.572 -18.770 7.545 520 HE2 PHE 64 HE1 PHE 64 13.811 -16.528 3.880 521 HZ PHE 64 HZ PHE 64 12.472 -17.409 5.777 522 H ARG 65 H ARG 65 15.846 -20.865 4.495 523 HA ARG 65 HA ARG 65 16.364 -20.753 1.562 524 HB2 ARG 65 2HB ARG 65 15.409 -23.187 3.116 525 HB3 ARG 65 3HB ARG 65 15.471 -23.050 1.348 526 HG2 ARG 65 2HG ARG 65 17.938 -22.672 1.487 527 HG3 ARG 65 3HG ARG 65 17.851 -22.885 3.250 528 HD2 ARG 65 2HD ARG 65 18.555 -24.970 2.210 529 HD3 ARG 65 3HD ARG 65 16.936 -25.171 2.919 530 HE ARG 65 HE ARG 65 16.692 -24.387 0.183 531 HH11 ARG 65 1HH1 ARG 65 17.666 -27.158 2.148 532 HH12 ARG 65 2HH1 ARG 65 17.231 -28.329 0.921 533 HH21 ARG 65 1HH2 ARG 65 16.124 -25.928 -1.391 534 HH22 ARG 65 2HH2 ARG 65 16.362 -27.632 -1.079 535 H GLY 66 H GLY 66 14.359 -19.710 3.949 536 HA2 GLY 66 2HA GLY 66 12.280 -18.729 3.801 537 HA3 GLY 66 3HA GLY 66 12.242 -19.130 2.079 538 H ASP 67 H ASP 67 12.841 -21.845 4.167 539 HA ASP 67 HA ASP 67 10.339 -23.089 3.444 540 HB2 ASP 67 2HB ASP 67 12.492 -24.286 3.780 541 HB3 ASP 67 3HB ASP 67 12.430 -23.892 5.502 542 H SER 68 H SER 68 11.162 -20.812 5.823 543 HA SER 68 HA SER 68 8.539 -21.112 7.122 544 HB2 SER 68 2HB SER 68 9.542 -20.886 9.366 545 HB3 SER 68 3HB SER 68 10.074 -22.382 8.574 546 HG SER 68 HG SER 68 11.819 -21.265 9.520 547 H ALA 69 H ALA 69 8.158 -19.081 8.553 548 HA ALA 69 HA ALA 69 8.720 -16.771 6.928 549 HB1 ALA 69 1HB ALA 69 7.568 -16.992 9.736 550 HB2 ALA 69 2HB ALA 69 7.518 -15.555 8.686 551 HB3 ALA 69 3HB ALA 69 6.647 -17.031 8.216 552 H PHE 70 H PHE 70 10.070 -14.977 7.352 553 HA PHE 70 HA PHE 70 12.591 -15.703 8.494 554 HB2 PHE 70 2HB PHE 70 12.442 -14.127 6.645 555 HB3 PHE 70 3HB PHE 70 11.434 -13.039 7.614 556 HD1 PHE 70 HD2 PHE 70 14.791 -14.730 7.754 557 HD2 PHE 70 HD1 PHE 70 12.457 -11.239 8.667 558 HE1 PHE 70 HE2 PHE 70 16.819 -13.598 8.632 559 HE2 PHE 70 HE1 PHE 70 14.481 -10.109 9.540 560 HZ PHE 70 HZ PHE 70 16.672 -11.289 9.513 561 H TYR 71 H TYR 71 9.793 -13.882 9.809 562 HA TYR 71 HA TYR 71 11.339 -12.734 11.944 563 HB2 TYR 71 2HB TYR 71 9.218 -12.082 12.890 564 HB3 TYR 71 3HB TYR 71 9.254 -11.750 11.160 565 HD1 TYR 71 HD2 TYR 71 7.902 -14.023 13.773 566 HD2 TYR 71 HD1 TYR 71 7.658 -12.743 9.671 567 HE1 TYR 71 HE2 TYR 71 5.754 -15.240 13.522 568 HE2 TYR 71 HE1 TYR 71 5.516 -13.953 9.412 569 HH TYR 71 HH TYR 71 3.944 -15.272 10.429 570 H THR 72 H THR 72 9.527 -15.803 11.606 571 HA THR 72 HA THR 72 9.788 -16.436 14.435 572 HB THR 72 HB THR 72 9.175 -18.213 12.035 573 HG1 THR 72 1HG THR 72 7.674 -16.512 12.414 574 HG21 THR 72 1HG2 THR 72 8.729 -18.633 15.022 575 HG22 THR 72 2HG2 THR 72 8.125 -19.693 13.733 576 HG23 THR 72 3HG2 THR 72 9.876 -19.533 14.002 577 H TRP 73 H TRP 73 11.642 -16.991 11.459 578 HA TRP 73 HA TRP 73 13.468 -18.914 12.603 579 HB2 TRP 73 2HB TRP 73 13.050 -18.793 10.207 580 HB3 TRP 73 3HB TRP 73 13.568 -17.111 10.167 581 HD1 TRP 73 HD1 TRP 73 14.900 -20.623 10.094 582 HE1 TRP 73 HE1 TRP 73 17.424 -20.617 9.680 583 HE3 TRP 73 HE3 TRP 73 15.785 -15.607 10.623 584 HZ2 TRP 73 HZ2 TRP 73 19.588 -18.701 9.787 585 HZ3 TRP 73 HZ3 TRP 73 18.088 -14.738 10.482 586 HH2 TRP 73 HH2 TRP 73 19.993 -16.272 10.112 587 H LEU 74 H LEU 74 13.269 -15.379 12.534 588 HA LEU 74 HA LEU 74 16.070 -15.060 13.339 589 HB2 LEU 74 2HB LEU 74 14.989 -13.446 11.835 590 HB3 LEU 74 3HB LEU 74 13.763 -13.097 13.059 591 HG LEU 74 HG LEU 74 15.566 -12.276 14.596 592 HD11 LEU 74 1HD1 LEU 74 17.331 -12.622 12.133 593 HD12 LEU 74 2HD1 LEU 74 17.790 -11.773 13.627 594 HD13 LEU 74 3HD1 LEU 74 17.492 -13.520 13.662 595 HD21 LEU 74 3HD2 LEU 74 15.928 -10.171 13.436 596 HD22 LEU 74 1HD2 LEU 74 15.501 -10.920 11.874 597 HD23 LEU 74 2HD2 LEU 74 14.272 -10.759 13.145 598 H TYR 75 H TYR 75 12.812 -14.923 14.863 599 HA TYR 75 HA TYR 75 13.841 -13.843 17.329 600 HB2 TYR 75 2HB TYR 75 11.260 -15.303 16.656 601 HB3 TYR 75 3HB TYR 75 11.599 -14.588 18.230 602 HD1 TYR 75 HD1 TYR 75 13.118 -12.093 17.024 603 HD2 TYR 75 HD2 TYR 75 9.306 -13.936 16.240 604 HE1 TYR 75 HE1 TYR 75 12.247 -9.927 16.286 605 HE2 TYR 75 HE2 TYR 75 8.425 -11.758 15.444 606 HH TYR 75 HH TYR 75 10.436 -8.792 15.405 607 H ARG 76 H ARG 76 13.820 -17.121 16.048 608 HA ARG 76 HA ARG 76 14.329 -18.221 18.701 609 HB2 ARG 76 2HB ARG 76 14.830 -20.299 17.583 610 HB3 ARG 76 3HB ARG 76 13.322 -19.619 16.961 611 HG2 ARG 76 2HG ARG 76 14.474 -18.807 14.955 612 HG3 ARG 76 3HG ARG 76 16.043 -19.370 15.602 613 HD2 ARG 76 2HD ARG 76 15.094 -21.691 15.695 614 HD3 ARG 76 3HD ARG 76 13.640 -21.088 14.872 615 HE ARG 76 HE ARG 76 15.802 -20.298 13.287 616 HH11 ARG 76 1HH1 ARG 76 14.413 -23.340 14.442 617 HH12 ARG 76 2HH1 ARG 76 15.009 -24.259 13.078 618 HH21 ARG 76 1HH2 ARG 76 16.591 -21.535 11.545 619 HH22 ARG 76 2HH2 ARG 76 16.222 -23.243 11.436 620 H ILE 77 H ILE 77 16.264 -16.618 16.222 621 HA ILE 77 HA ILE 77 18.795 -17.607 17.222 622 HB ILE 77 HB ILE 77 18.292 -14.934 15.866 623 HG12 ILE 77 2HG1 ILE 77 17.294 -16.616 14.428 624 HG13 ILE 77 3HG1 ILE 77 18.772 -15.978 13.723 625 HG21 ILE 77 1HG2 ILE 77 20.630 -15.274 15.094 626 HG22 ILE 77 2HG2 ILE 77 20.506 -15.189 16.856 627 HG23 ILE 77 3HG2 ILE 77 20.716 -16.764 16.062 628 HD11 ILE 77 3HD1 ILE 77 20.005 -18.006 14.397 629 HD12 ILE 77 1HD1 ILE 77 18.530 -18.654 15.160 630 HD13 ILE 77 2HD1 ILE 77 18.595 -18.406 13.402 631 H ALA 78 H ALA 78 16.592 -14.921 18.039 632 HA ALA 78 HA ALA 78 18.534 -13.496 19.602 633 HB1 ALA 78 1HB ALA 78 16.618 -12.088 20.223 634 HB2 ALA 78 2HB ALA 78 16.626 -12.429 18.481 635 HB3 ALA 78 3HB ALA 78 15.502 -13.300 19.548 636 H VAL 79 H VAL 79 15.917 -15.840 20.459 637 HA VAL 79 HA VAL 79 16.397 -15.404 23.305 638 HB VAL 79 HB VAL 79 14.170 -15.924 22.487 639 HG11 VAL 79 1HG1 VAL 79 14.822 -17.422 20.597 640 HG12 VAL 79 2HG1 VAL 79 15.271 -18.677 21.778 641 HG13 VAL 79 3HG1 VAL 79 13.583 -18.140 21.653 642 HG21 VAL 79 3HG2 VAL 79 15.275 -18.219 24.160 643 HG22 VAL 79 1HG2 VAL 79 14.882 -16.606 24.789 644 HG23 VAL 79 2HG2 VAL 79 13.596 -17.642 24.111 645 H ASN 80 H ASN 80 17.558 -17.663 20.826 646 HA ASN 80 HA ASN 80 18.721 -19.471 22.789 647 HB2 ASN 80 2HB ASN 80 19.105 -19.126 19.790 648 HB3 ASN 80 3HB ASN 80 19.924 -20.363 20.741 649 HD21 ASN 80 2HD2 ASN 80 18.343 -21.219 18.684 650 HD22 ASN 80 1HD2 ASN 80 16.897 -21.975 19.327 651 H THR 81 H THR 81 19.687 -16.454 21.253 652 HA THR 81 HA THR 81 22.501 -16.774 21.990 653 HB THR 81 HB THR 81 20.922 -14.328 21.100 654 HG1 THR 81 1HG THR 81 21.008 -15.839 19.493 655 HG21 THR 81 1HG2 THR 81 23.172 -13.430 20.528 656 HG22 THR 81 2HG2 THR 81 23.006 -13.696 22.276 657 HG23 THR 81 3HG2 THR 81 23.924 -14.853 21.284 658 H ALA 82 H ALA 82 19.529 -15.485 23.453 659 HA ALA 82 HA ALA 82 20.930 -14.003 25.512 660 HB1 ALA 82 1HB ALA 82 18.689 -13.745 26.467 661 HB2 ALA 82 2HB ALA 82 18.636 -13.461 24.710 662 HB3 ALA 82 3HB ALA 82 18.057 -15.005 25.379 663 H LYS 83 H LYS 83 19.629 -17.316 25.206 664 HA LYS 83 HA LYS 83 20.105 -17.923 28.012 665 HB2 LYS 83 2HB LYS 83 19.526 -19.628 25.564 666 HB3 LYS 83 3HB LYS 83 19.732 -20.296 27.202 667 HG2 LYS 83 2HG LYS 83 17.893 -18.926 28.048 668 HG3 LYS 83 3HG LYS 83 17.690 -18.152 26.461 669 HD2 LYS 83 2HD LYS 83 17.109 -20.317 25.451 670 HD3 LYS 83 3HD LYS 83 17.357 -21.130 27.010 671 HE2 LYS 83 2HE LYS 83 15.319 -18.920 26.505 672 HE3 LYS 83 3HE LYS 83 14.951 -20.649 26.488 673 HZ1 LYS 83 3HZ LYS 83 16.015 -19.174 28.805 674 HZ2 LYS 83 1HZ LYS 83 14.459 -19.678 28.612 675 HZ3 LYS 83 2HZ LYS 83 15.662 -20.781 28.766 676 H ASN 84 H ASN 84 21.962 -18.046 25.004 677 HA ASN 84 HA ASN 84 24.164 -19.536 26.164 678 HB2 ASN 84 2HB ASN 84 23.615 -19.412 23.710 679 HB3 ASN 84 3HB ASN 84 24.088 -17.709 23.730 680 HD21 ASN 84 2HD2 ASN 84 25.762 -18.093 22.200 681 HD22 ASN 84 1HD2 ASN 84 27.240 -18.913 22.664 682 H TYR 85 H TYR 85 23.058 -16.207 26.193 683 HA TYR 85 HA TYR 85 25.645 -15.037 26.788 684 HB2 TYR 85 2HB TYR 85 23.741 -13.877 25.656 685 HB3 TYR 85 3HB TYR 85 22.844 -13.943 27.177 686 HD1 TYR 85 HD1 TYR 85 25.655 -12.400 25.375 687 HD2 TYR 85 HD2 TYR 85 23.459 -12.533 29.063 688 HE1 TYR 85 HE1 TYR 85 26.740 -10.286 26.079 689 HE2 TYR 85 HE2 TYR 85 24.550 -10.423 29.798 690 HH TYR 85 HH TYR 85 26.938 -8.707 27.741 691 H LEU 86 H LEU 86 22.822 -16.216 28.671 692 HA LEU 86 HA LEU 86 23.825 -15.134 31.160 693 HB2 LEU 86 2HB LEU 86 21.759 -17.278 30.532 694 HB3 LEU 86 3HB LEU 86 22.128 -16.695 32.161 695 HG LEU 86 HG LEU 86 21.005 -14.996 29.899 696 HD11 LEU 86 1HD1 LEU 86 19.893 -16.053 32.538 697 HD12 LEU 86 2HD1 LEU 86 19.053 -14.919 31.467 698 HD13 LEU 86 3HD1 LEU 86 19.407 -16.571 30.903 699 HD21 LEU 86 3HD2 LEU 86 21.765 -14.311 32.775 700 HD22 LEU 86 1HD2 LEU 86 22.468 -13.609 31.298 701 HD23 LEU 86 2HD2 LEU 86 20.779 -13.278 31.717 702 H VAL 87 H VAL 87 24.476 -18.129 29.363 703 HA VAL 87 HA VAL 87 25.837 -19.240 31.733 704 HB VAL 87 HB VAL 87 26.459 -21.099 30.253 705 HG11 VAL 87 1HG1 VAL 87 24.189 -21.999 29.994 706 HG12 VAL 87 2HG1 VAL 87 24.355 -21.122 31.532 707 HG13 VAL 87 3HG1 VAL 87 23.506 -20.368 30.159 708 HG21 VAL 87 3HG2 VAL 87 24.833 -19.618 28.155 709 HG22 VAL 87 1HG2 VAL 87 26.593 -19.889 28.104 710 HG23 VAL 87 2HG2 VAL 87 25.478 -21.270 28.003 711 H ALA 88 H ALA 88 26.621 -17.187 29.017 712 HA ALA 88 HA ALA 88 29.455 -17.749 29.045 713 HB1 ALA 88 1HB ALA 88 28.311 -16.699 27.116 714 HB2 ALA 88 2HB ALA 88 27.901 -15.292 28.127 715 HB3 ALA 88 3HB ALA 88 29.599 -15.645 27.742 716 H GLN 89 H GLN 89 27.278 -15.723 30.939 717 HA GLN 89 HA GLN 89 29.580 -14.525 32.405 718 HB2 GLN 89 2HB GLN 89 26.655 -13.872 32.050 719 HB3 GLN 89 3HB GLN 89 27.482 -13.358 33.527 720 HG2 GLN 89 2HG GLN 89 27.529 -11.589 31.833 721 HG3 GLN 89 3HG GLN 89 29.153 -12.138 32.277 722 HE21 GLN 89 2HE2 GLN 89 26.554 -12.650 29.821 723 HE22 GLN 89 1HE2 GLN 89 27.646 -12.912 28.482 724 H GLY 90 H GLY 90 27.023 -16.946 32.667 725 HA2 GLY 90 2HA GLY 90 27.070 -17.096 35.552 726 HA3 GLY 90 3HA GLY 90 26.372 -18.276 34.420 727 H ARG 91 H ARG 91 29.032 -18.450 32.955 728 HA ARG 91 HA ARG 91 30.306 -20.383 34.775 729 HB2 ARG 91 2HB ARG 91 30.665 -19.781 31.818 730 HB3 ARG 91 3HB ARG 91 31.646 -20.955 32.717 731 HG2 ARG 91 2HG ARG 91 29.569 -22.167 33.379 732 HG3 ARG 91 3HG ARG 91 28.616 -21.039 32.399 733 HD2 ARG 91 2HD ARG 91 29.031 -23.068 31.118 734 HD3 ARG 91 3HD ARG 91 29.922 -21.721 30.389 735 HE ARG 91 HE ARG 91 31.634 -23.003 32.247 736 HH11 ARG 91 1HH1 ARG 91 30.062 -23.680 29.154 737 HH12 ARG 91 2HH1 ARG 91 31.293 -24.808 28.635 738 HH21 ARG 91 1HH2 ARG 91 33.231 -24.474 31.549 739 HH22 ARG 91 2HH2 ARG 91 33.079 -25.266 29.997 740 H ARG 92 H ARG 92 30.529 -17.154 34.485 741 HA ARG 92 HA ARG 92 33.434 -17.163 35.124 742 HB2 ARG 92 2HB ARG 92 32.767 -16.073 32.939 743 HB3 ARG 92 3HB ARG 92 31.903 -14.846 33.888 744 HG2 ARG 92 2HG ARG 92 34.000 -14.169 34.972 745 HG3 ARG 92 3HG ARG 92 34.848 -15.547 34.240 746 HD2 ARG 92 2HD ARG 92 35.409 -13.564 33.001 747 HD3 ARG 92 3HD ARG 92 34.392 -14.585 31.985 748 HE ARG 92 HE ARG 92 33.575 -12.054 33.351 749 HH11 ARG 92 1HH1 ARG 92 32.885 -14.577 30.950 750 HH12 ARG 92 2HH1 ARG 92 31.557 -13.677 30.251 751 HH21 ARG 92 1HH2 ARG 92 31.871 -10.913 32.355 752 HH22 ARG 92 2HH2 ARG 92 31.016 -11.635 31.007 753 H LEU 93 H LEU 93 30.680 -17.353 36.592 754 HA LEU 93 HA LEU 93 31.463 -15.629 38.838 755 HB2 LEU 93 2HB LEU 93 29.861 -14.375 37.353 756 HB3 LEU 93 3HB LEU 93 28.668 -15.650 37.625 757 HG LEU 93 HG LEU 93 28.581 -15.072 40.034 758 HD11 LEU 93 1HD1 LEU 93 30.639 -12.958 39.278 759 HD12 LEU 93 2HD1 LEU 93 29.788 -13.049 40.838 760 HD13 LEU 93 3HD1 LEU 93 30.909 -14.340 40.376 761 HD21 LEU 93 3HD2 LEU 93 28.386 -12.633 38.227 762 HD22 LEU 93 1HD2 LEU 93 27.130 -13.872 38.441 763 HD23 LEU 93 2HD2 LEU 93 27.601 -12.841 39.810 764 H GLU 94 H GLU 94 31.177 -18.614 37.909 765 HA GLU 94 HA GLU 94 29.024 -19.749 39.404 766 HB2 GLU 94 2HB GLU 94 30.188 -20.720 37.395 767 HB3 GLU 94 3HB GLU 94 31.592 -21.043 38.419 768 HG2 GLU 94 2HG GLU 94 30.274 -23.062 38.193 769 HG3 GLU 94 3HG GLU 94 30.170 -22.509 39.862 770 H LEU 95 H LEU 95 32.234 -18.713 40.338 771 HA LEU 95 HA LEU 95 31.664 -19.556 43.100 772 HB2 LEU 95 2HB LEU 95 32.858 -21.475 42.060 773 HB3 LEU 95 3HB LEU 95 34.174 -20.390 41.585 774 HG LEU 95 HG LEU 95 34.674 -19.929 43.962 775 HD11 LEU 95 1HD1 LEU 95 32.457 -21.951 44.510 776 HD12 LEU 95 2HD1 LEU 95 33.588 -21.305 45.725 777 HD13 LEU 95 3HD1 LEU 95 32.425 -20.223 44.937 778 HD21 LEU 95 3HD2 LEU 95 34.455 -22.895 43.308 779 HD22 LEU 95 1HD2 LEU 95 35.771 -21.805 42.798 780 HD23 LEU 95 2HD2 LEU 95 35.541 -22.164 44.517 781 H VAL 96 H VAL 96 33.601 -17.731 40.742 782 HA VAL 96 HA VAL 96 33.966 -15.604 42.721 783 HB VAL 96 HB VAL 96 35.905 -17.042 43.110 784 HG11 VAL 96 1HG1 VAL 96 36.018 -18.153 40.891 785 HG12 VAL 96 2HG1 VAL 96 36.590 -16.625 40.176 786 HG13 VAL 96 3HG1 VAL 96 37.579 -17.473 41.384 787 HG21 VAL 96 3HG2 VAL 96 36.657 -14.516 41.584 788 HG22 VAL 96 1HG2 VAL 96 36.266 -14.638 43.320 789 HG23 VAL 96 2HG2 VAL 96 37.716 -15.427 42.679 790 HA PRO 97 HA PRO 97 33.092 -13.486 38.924 791 HB2 PRO 97 2HB PRO 97 33.706 -10.910 39.623 792 HB3 PRO 97 3HB PRO 97 32.269 -11.773 40.265 793 HG2 PRO 97 2HG PRO 97 34.984 -11.461 41.581 794 HG3 PRO 97 3HG PRO 97 33.364 -11.151 42.295 795 HD2 PRO 97 2HD PRO 97 34.649 -13.508 42.702 796 HD3 PRO 97 3HD PRO 97 32.879 -13.468 42.420 797 H ARG 98 H ARG 98 34.237 -13.406 37.128 798 HA ARG 98 HA ARG 98 35.960 -13.370 35.667 799 HB2 ARG 98 2HB ARG 98 36.798 -10.977 37.338 800 HB3 ARG 98 3HB ARG 98 37.330 -11.337 35.685 801 HG2 ARG 98 2HG ARG 98 34.973 -11.229 34.903 802 HG3 ARG 98 3HG ARG 98 34.453 -10.837 36.558 803 HD2 ARG 98 2HD ARG 98 34.621 -8.788 35.266 804 HD3 ARG 98 3HD ARG 98 35.874 -8.802 36.515 805 HE ARG 98 HE ARG 98 36.984 -9.904 34.148 806 HH11 ARG 98 1HH1 ARG 98 35.737 -6.819 35.339 807 HH12 ARG 98 2HH1 ARG 98 36.752 -5.865 34.283 808 HH21 ARG 98 1HH2 ARG 98 38.309 -8.632 32.785 809 HH22 ARG 98 2HH2 ARG 98 38.204 -6.887 32.843 810 H GLY 99 H GLY 99 36.467 -14.893 38.315 811 HA2 GLY 99 2HA GLY 99 39.438 -15.092 37.988 812 HA3 GLY 99 3HA GLY 99 38.589 -15.333 39.523 813 H SER 100 H SER 100 36.578 -16.649 37.220 814 HA SER 100 HA SER 100 37.409 -19.361 37.952 815 HB2 SER 100 2HB SER 100 35.043 -18.631 38.043 816 HB3 SER 100 3HB SER 100 35.065 -18.396 36.283 817 HG SER 100 HG SER 100 34.272 -20.465 36.886 818 H HIS 101 H HIS 101 37.615 -21.083 36.361 819 HA HIS 101 HA HIS 101 38.298 -20.308 33.609 820 HB2 HIS 101 2HB HIS 101 40.507 -21.331 33.714 821 HB3 HIS 101 3HB HIS 101 40.399 -19.986 34.853 822 HD2 HIS 101 HD2 HIS 101 40.966 -23.751 34.672 823 HE1 HIS 101 HE1 HIS 101 41.145 -22.752 38.801 824 HE2 HIS 101 HE2 HIS 101 41.541 -24.591 37.086 825 H HIS 102 H HIS 102 38.643 -22.220 32.231 826 HA HIS 102 HA HIS 102 37.451 -24.717 33.303 827 HB2 HIS 102 2HB HIS 102 36.517 -23.241 30.813 828 HB3 HIS 102 3HB HIS 102 35.966 -24.842 31.327 829 HD2 HIS 102 HD2 HIS 102 35.697 -21.107 32.293 830 HE1 HIS 102 HE1 HIS 102 32.758 -23.181 34.558 831 HE2 HIS 102 HE2 HIS 102 33.677 -20.885 33.939 832 H HIS 103 H HIS 103 40.155 -23.567 32.213 833 HA HIS 103 HA HIS 103 40.638 -25.174 29.842 834 HB2 HIS 103 2HB HIS 103 42.559 -23.700 31.670 835 HB3 HIS 103 3HB HIS 103 42.929 -24.341 30.062 836 HD2 HIS 103 HD2 HIS 103 42.177 -22.908 27.960 837 HE1 HIS 103 HE1 HIS 103 40.390 -19.659 30.049 838 HE2 HIS 103 HE2 HIS 103 41.151 -20.496 27.767 839 H HIS 104 H HIS 104 42.316 -26.831 29.724 840 HA HIS 104 HA HIS 104 42.759 -28.337 32.245 841 HB2 HIS 104 2HB HIS 104 41.734 -29.479 29.623 842 HB3 HIS 104 3HB HIS 104 42.232 -30.433 31.027 843 HD2 HIS 104 HD2 HIS 104 39.301 -28.453 29.640 844 HE1 HIS 104 HE1 HIS 104 38.110 -29.738 33.517 845 HE2 HIS 104 HE2 HIS 104 37.323 -28.660 31.345 846 H HIS 105 H HIS 105 44.316 -26.620 30.089 847 HA HIS 105 HA HIS 105 46.221 -28.479 28.971 848 HB2 HIS 105 2HB HIS 105 45.670 -26.293 27.960 849 HB3 HIS 105 3HB HIS 105 46.359 -25.470 29.367 850 HD2 HIS 105 HD2 HIS 105 47.525 -27.945 26.570 851 HE1 HIS 105 HE1 HIS 105 50.857 -25.522 27.621 852 HE2 HIS 105 HE2 HIS 105 50.027 -27.359 26.063 853 H HIS 106 H HIS 106 48.494 -28.583 29.486 854 HA HIS 106 HA HIS 106 49.328 -27.742 32.182 855 HB2 HIS 106 2HB HIS 106 48.256 -29.946 32.510 856 HB3 HIS 106 3HB HIS 106 49.281 -30.644 31.256 857 HD2 HIS 106 HD2 HIS 106 51.700 -31.418 31.937 858 HE1 HIS 106 HE1 HIS 106 51.692 -30.078 35.971 859 HE2 HIS 106 HE2 HIS 106 52.965 -31.433 34.231 Start of MODEL 9 1 H1 MET 1 H1 MET 1 -0.488 -5.633 -4.728 2 H2 MET 1 H2 MET 1 -1.227 -4.637 -3.641 3 H3 MET 1 H3 MET 1 -0.206 -5.815 -3.113 4 HA MET 1 HA MET 1 1.656 -4.768 -4.157 5 HB2 MET 1 2HB MET 1 0.334 -3.747 -5.996 6 HB3 MET 1 3HB MET 1 -0.352 -2.587 -4.844 7 HG2 MET 1 2HG MET 1 1.900 -1.705 -4.369 8 HG3 MET 1 3HG MET 1 2.615 -2.932 -5.424 9 HE1 MET 1 1HE MET 1 -0.636 -0.694 -5.985 10 HE2 MET 1 2HE MET 1 0.545 0.353 -5.155 11 HE3 MET 1 3HE MET 1 0.092 0.684 -6.843 12 H SER 2 H SER 2 2.969 -3.465 -2.858 13 HA SER 2 HA SER 2 1.637 -2.044 -0.617 14 HB2 SER 2 2HB SER 2 3.273 -3.026 0.949 15 HB3 SER 2 3HB SER 2 2.276 -4.282 0.182 16 HG SER 2 HG SER 2 4.488 -4.834 0.135 17 H GLU 3 H GLU 3 3.708 -1.868 -3.200 18 HA GLU 3 HA GLU 3 5.415 -0.598 -3.851 19 HB2 GLU 3 2HB GLU 3 5.119 1.779 -3.581 20 HB3 GLU 3 3HB GLU 3 3.588 0.967 -3.904 21 HG2 GLU 3 2HG GLU 3 2.935 1.148 -1.558 22 HG3 GLU 3 3HG GLU 3 4.520 1.834 -1.138 23 H GLN 4 H GLN 4 6.033 -2.084 -1.347 24 HA GLN 4 HA GLN 4 8.514 -0.592 -0.787 25 HB2 GLN 4 2HB GLN 4 8.323 -0.856 1.612 26 HB3 GLN 4 3HB GLN 4 6.947 0.071 1.008 27 HG2 GLN 4 2HG GLN 4 5.570 -2.044 1.050 28 HG3 GLN 4 3HG GLN 4 6.959 -2.902 1.715 29 HE21 GLN 4 2HE2 GLN 4 4.950 -3.216 3.293 30 HE22 GLN 4 1HE2 GLN 4 4.948 -2.125 4.668 31 H LEU 5 H LEU 5 10.014 -1.933 0.569 32 HA LEU 5 HA LEU 5 10.061 -4.708 -0.480 33 HB2 LEU 5 2HB LEU 5 12.163 -3.033 0.913 34 HB3 LEU 5 3HB LEU 5 12.417 -4.613 0.144 35 HG LEU 5 HG LEU 5 11.698 -1.987 -1.228 36 HD11 LEU 5 1HD1 LEU 5 13.906 -2.292 -2.293 37 HD12 LEU 5 2HD1 LEU 5 14.058 -2.254 -0.529 38 HD13 LEU 5 3HD1 LEU 5 14.140 -3.809 -1.391 39 HD21 LEU 5 3HD2 LEU 5 12.107 -4.741 -2.475 40 HD22 LEU 5 1HD2 LEU 5 10.559 -3.864 -2.378 41 HD23 LEU 5 2HD2 LEU 5 11.891 -3.215 -3.357 42 H THR 6 H THR 6 10.610 -6.456 0.925 43 HA THR 6 HA THR 6 9.910 -6.081 3.791 44 HB THR 6 HB THR 6 8.616 -8.123 1.943 45 HG1 THR 6 1HG THR 6 6.789 -6.818 2.169 46 HG21 THR 6 1HG2 THR 6 6.990 -8.285 3.898 47 HG22 THR 6 2HG2 THR 6 8.599 -8.960 4.194 48 HG23 THR 6 3HG2 THR 6 8.171 -7.362 4.854 49 H ASP 7 H ASP 7 10.225 -8.332 4.932 50 HA ASP 7 HA ASP 7 12.933 -9.027 4.755 51 HB2 ASP 7 2HB ASP 7 12.337 -10.887 6.243 52 HB3 ASP 7 3HB ASP 7 11.537 -9.383 6.724 53 H GLN 8 H GLN 8 10.323 -10.088 2.718 54 HA GLN 8 HA GLN 8 11.399 -12.606 1.897 55 HB2 GLN 8 2HB GLN 8 9.097 -11.939 1.437 56 HB3 GLN 8 3HB GLN 8 9.652 -10.557 0.474 57 HG2 GLN 8 2HG GLN 8 8.943 -12.402 -0.990 58 HG3 GLN 8 3HG GLN 8 10.669 -12.100 -1.173 59 HE21 GLN 8 2HE2 GLN 8 12.203 -13.616 -0.232 60 HE22 GLN 8 1HE2 GLN 8 11.707 -15.253 0.134 61 H VAL 9 H VAL 9 11.663 -9.316 0.467 62 HA VAL 9 HA VAL 9 13.624 -10.277 -1.490 63 HB VAL 9 HB VAL 9 11.920 -8.786 -2.275 64 HG11 VAL 9 1HG1 VAL 9 12.829 -6.838 -0.135 65 HG12 VAL 9 2HG1 VAL 9 11.633 -6.506 -1.413 66 HG13 VAL 9 3HG1 VAL 9 11.281 -7.725 -0.177 67 HG21 VAL 9 3HG2 VAL 9 13.228 -6.975 -3.239 68 HG22 VAL 9 1HG2 VAL 9 14.468 -7.143 -1.983 69 HG23 VAL 9 2HG2 VAL 9 14.238 -8.436 -3.186 70 H LEU 10 H LEU 10 13.601 -8.566 1.607 71 HA LEU 10 HA LEU 10 16.265 -7.491 1.331 72 HB2 LEU 10 2HB LEU 10 14.215 -7.816 3.489 73 HB3 LEU 10 3HB LEU 10 15.906 -7.646 3.998 74 HG LEU 10 HG LEU 10 16.155 -5.568 2.805 75 HD11 LEU 10 1HD1 LEU 10 13.256 -5.910 1.948 76 HD12 LEU 10 2HD1 LEU 10 14.243 -4.447 1.728 77 HD13 LEU 10 3HD1 LEU 10 14.688 -5.937 0.882 78 HD21 LEU 10 3HD2 LEU 10 14.557 -4.182 4.101 79 HD22 LEU 10 1HD2 LEU 10 13.579 -5.631 4.431 80 HD23 LEU 10 2HD2 LEU 10 15.227 -5.492 5.095 81 H VAL 11 H VAL 11 14.987 -10.680 2.316 82 HA VAL 11 HA VAL 11 17.628 -11.450 3.330 83 HB VAL 11 HB VAL 11 15.063 -13.003 2.888 84 HG11 VAL 11 1HG1 VAL 11 17.767 -13.916 3.958 85 HG12 VAL 11 2HG1 VAL 11 16.240 -14.805 4.181 86 HG13 VAL 11 3HG1 VAL 11 16.903 -14.565 2.550 87 HG21 VAL 11 3HG2 VAL 11 15.172 -11.376 4.811 88 HG22 VAL 11 1HG2 VAL 11 15.081 -13.065 5.352 89 HG23 VAL 11 2HG2 VAL 11 16.637 -12.199 5.385 90 H GLU 12 H GLU 12 15.821 -11.631 0.264 91 HA GLU 12 HA GLU 12 17.654 -13.502 -0.976 92 HB2 GLU 12 2HB GLU 12 15.710 -11.432 -2.055 93 HB3 GLU 12 3HB GLU 12 16.670 -12.493 -3.099 94 HG2 GLU 12 2HG GLU 12 15.700 -14.478 -1.981 95 HG3 GLU 12 3HG GLU 12 14.701 -13.423 -0.970 96 H ARG 13 H ARG 13 17.552 -9.970 -0.563 97 HA ARG 13 HA ARG 13 19.587 -9.424 -2.520 98 HB2 ARG 13 2HB ARG 13 17.851 -7.835 -1.865 99 HB3 ARG 13 3HB ARG 13 18.488 -7.766 -0.211 100 HG2 ARG 13 2HG ARG 13 20.534 -6.729 -0.981 101 HG3 ARG 13 3HG ARG 13 20.115 -7.024 -2.685 102 HD2 ARG 13 2HD ARG 13 18.484 -5.287 -0.791 103 HD3 ARG 13 3HD ARG 13 19.697 -4.664 -1.931 104 HE ARG 13 HE ARG 13 17.937 -6.235 -3.443 105 HH11 ARG 13 1HH1 ARG 13 17.767 -3.305 -1.467 106 HH12 ARG 13 2HH1 ARG 13 16.444 -2.627 -2.393 107 HH21 ARG 13 1HH2 ARG 13 16.206 -5.328 -4.616 108 HH22 ARG 13 2HH2 ARG 13 15.557 -3.774 -4.159 109 H VAL 14 H VAL 14 19.670 -9.922 1.044 110 HA VAL 14 HA VAL 14 22.468 -9.241 1.242 111 HB VAL 14 HB VAL 14 22.326 -10.208 3.484 112 HG11 VAL 14 1HG1 VAL 14 19.979 -8.468 2.622 113 HG12 VAL 14 2HG1 VAL 14 20.447 -8.754 4.310 114 HG13 VAL 14 3HG1 VAL 14 21.575 -7.935 3.193 115 HG21 VAL 14 3HG2 VAL 14 20.169 -11.059 4.319 116 HG22 VAL 14 1HG2 VAL 14 19.527 -11.045 2.661 117 HG23 VAL 14 2HG2 VAL 14 20.878 -12.132 3.092 118 H GLN 15 H GLN 15 20.704 -12.162 0.340 119 HA GLN 15 HA GLN 15 23.031 -13.894 0.646 120 HB2 GLN 15 2HB GLN 15 20.335 -14.198 -0.711 121 HB3 GLN 15 3HB GLN 15 21.569 -15.475 -0.699 122 HG2 GLN 15 2HG GLN 15 21.570 -15.518 1.753 123 HG3 GLN 15 3HG GLN 15 20.431 -14.190 1.828 124 HE21 GLN 15 2HE2 GLN 15 19.765 -16.508 3.143 125 HE22 GLN 15 1HE2 GLN 15 18.475 -17.327 2.290 126 H LYS 16 H LYS 16 21.858 -11.631 -1.769 127 HA LYS 16 HA LYS 16 23.553 -12.652 -3.891 128 HB2 LYS 16 2HB LYS 16 21.434 -10.735 -3.586 129 HB3 LYS 16 3HB LYS 16 22.850 -9.880 -4.213 130 HG2 LYS 16 2HG LYS 16 21.671 -10.709 -6.122 131 HG3 LYS 16 3HG LYS 16 23.118 -11.707 -5.919 132 HD2 LYS 16 2HD LYS 16 21.273 -13.192 -6.412 133 HD3 LYS 16 3HD LYS 16 21.682 -13.418 -4.708 134 HE2 LYS 16 2HE LYS 16 19.279 -13.301 -4.896 135 HE3 LYS 16 3HE LYS 16 19.841 -11.821 -4.104 136 HZ1 LYS 16 3HZ LYS 16 19.672 -10.706 -6.231 137 HZ2 LYS 16 1HZ LYS 16 19.142 -12.085 -6.951 138 HZ3 LYS 16 2HZ LYS 16 18.223 -11.357 -5.801 139 H GLY 17 H GLY 17 24.209 -11.095 -0.972 140 HA2 GLY 17 2HA GLY 17 26.484 -10.798 -0.335 141 HA3 GLY 17 3HA GLY 17 26.887 -10.316 -1.994 142 H ASP 18 H ASP 18 23.973 -8.798 -1.217 143 HA ASP 18 HA ASP 18 25.359 -6.252 -0.725 144 HB2 ASP 18 2HB ASP 18 22.557 -7.121 -1.457 145 HB3 ASP 18 3HB ASP 18 22.869 -5.481 -0.912 146 H GLN 19 H GLN 19 26.154 -6.695 1.406 147 HA GLN 19 HA GLN 19 24.478 -7.521 3.551 148 HB2 GLN 19 2HB GLN 19 26.923 -7.733 3.451 149 HB3 GLN 19 3HB GLN 19 27.110 -5.976 3.560 150 HG2 GLN 19 2HG GLN 19 25.596 -7.558 5.664 151 HG3 GLN 19 3HG GLN 19 27.357 -7.453 5.707 152 HE21 GLN 19 2HE2 GLN 19 25.942 -6.516 7.860 153 HE22 GLN 19 1HE2 GLN 19 26.045 -4.769 7.917 154 H LYS 20 H LYS 20 24.840 -4.462 1.932 155 HA LYS 20 HA LYS 20 24.097 -2.670 3.997 156 HB2 LYS 20 2HB LYS 20 23.492 -1.182 2.151 157 HB3 LYS 20 3HB LYS 20 24.996 -2.042 1.773 158 HG2 LYS 20 2HG LYS 20 23.656 -3.702 0.435 159 HG3 LYS 20 3HG LYS 20 22.210 -2.721 0.728 160 HD2 LYS 20 2HD LYS 20 23.345 -0.780 -0.356 161 HD3 LYS 20 3HD LYS 20 24.749 -1.820 -0.696 162 HE2 LYS 20 2HE LYS 20 23.262 -3.360 -1.973 163 HE3 LYS 20 3HE LYS 20 21.905 -2.253 -1.698 164 HZ1 LYS 20 3HZ LYS 20 22.933 -1.888 -3.826 165 HZ2 LYS 20 1HZ LYS 20 23.125 -0.560 -2.885 166 HZ3 LYS 20 2HZ LYS 20 24.389 -1.590 -3.123 167 H ALA 21 H ALA 21 22.203 -5.040 2.191 168 HA ALA 21 HA ALA 21 19.665 -3.791 2.929 169 HB1 ALA 21 1HB ALA 21 18.690 -5.786 1.851 170 HB2 ALA 21 2HB ALA 21 19.895 -4.986 0.812 171 HB3 ALA 21 3HB ALA 21 20.319 -6.484 1.680 172 H PHE 22 H PHE 22 21.936 -6.021 4.397 173 HA PHE 22 HA PHE 22 19.948 -7.253 6.127 174 HB2 PHE 22 2HB PHE 22 22.110 -8.359 5.537 175 HB3 PHE 22 3HB PHE 22 22.968 -7.098 6.414 176 HD1 PHE 22 HD1 PHE 22 20.135 -9.533 6.905 177 HD2 PHE 22 HD2 PHE 22 23.512 -7.527 8.663 178 HE1 PHE 22 HE1 PHE 22 19.796 -10.802 8.996 179 HE2 PHE 22 HE2 PHE 22 23.165 -8.796 10.764 180 HZ PHE 22 HZ PHE 22 21.305 -10.428 10.939 181 H ASN 23 H ASN 23 22.217 -4.495 6.236 182 HA ASN 23 HA ASN 23 21.888 -3.800 8.976 183 HB2 ASN 23 2HB ASN 23 23.643 -2.825 7.672 184 HB3 ASN 23 3HB ASN 23 22.503 -2.287 6.426 185 HD21 ASN 23 2HD2 ASN 23 21.490 -0.340 6.593 186 HD22 ASN 23 1HD2 ASN 23 21.703 0.760 7.933 187 H LEU 24 H LEU 24 20.036 -2.921 6.031 188 HA LEU 24 HA LEU 24 18.166 -1.274 7.511 189 HB2 LEU 24 2HB LEU 24 18.031 -2.474 4.723 190 HB3 LEU 24 3HB LEU 24 16.939 -1.228 5.377 191 HG LEU 24 HG LEU 24 19.956 -0.881 5.112 192 HD11 LEU 24 1HD1 LEU 24 17.695 0.089 3.322 193 HD12 LEU 24 2HD1 LEU 24 19.419 0.524 3.163 194 HD13 LEU 24 3HD1 LEU 24 18.902 -1.157 2.913 195 HD21 LEU 24 3HD2 LEU 24 17.696 1.095 5.641 196 HD22 LEU 24 1HD2 LEU 24 18.924 0.572 6.818 197 HD23 LEU 24 2HD2 LEU 24 19.403 1.520 5.397 198 H LEU 25 H LEU 25 18.451 -4.697 6.948 199 HA LEU 25 HA LEU 25 15.604 -5.230 7.379 200 HB2 LEU 25 2HB LEU 25 16.956 -6.666 5.914 201 HB3 LEU 25 3HB LEU 25 18.074 -7.004 7.237 202 HG LEU 25 HG LEU 25 16.254 -8.146 8.487 203 HD11 LEU 25 1HD1 LEU 25 14.645 -7.651 5.943 204 HD12 LEU 25 2HD1 LEU 25 14.159 -8.707 7.285 205 HD13 LEU 25 3HD1 LEU 25 14.300 -6.955 7.549 206 HD21 LEU 25 3HD2 LEU 25 16.121 -10.108 6.963 207 HD22 LEU 25 1HD2 LEU 25 16.692 -9.095 5.620 208 HD23 LEU 25 2HD2 LEU 25 17.753 -9.408 7.011 209 H VAL 26 H VAL 26 18.644 -5.367 9.347 210 HA VAL 26 HA VAL 26 17.198 -6.608 11.510 211 HB VAL 26 HB VAL 26 19.136 -6.277 12.864 212 HG11 VAL 26 1HG1 VAL 26 20.823 -7.437 11.510 213 HG12 VAL 26 2HG1 VAL 26 19.205 -8.118 11.253 214 HG13 VAL 26 3HG1 VAL 26 19.923 -7.052 10.029 215 HG21 VAL 26 3HG2 VAL 26 20.225 -4.525 10.636 216 HG22 VAL 26 1HG2 VAL 26 19.735 -4.008 12.277 217 HG23 VAL 26 2HG2 VAL 26 21.130 -5.081 12.062 218 H VAL 27 H VAL 27 17.587 -3.206 10.538 219 HA VAL 27 HA VAL 27 17.037 -2.162 13.160 220 HB VAL 27 HB VAL 27 16.378 -0.084 11.960 221 HG11 VAL 27 1HG1 VAL 27 18.605 0.342 10.971 222 HG12 VAL 27 2HG1 VAL 27 18.722 -0.478 12.549 223 HG13 VAL 27 3HG1 VAL 27 18.963 -1.396 11.043 224 HG21 VAL 27 3HG2 VAL 27 15.425 -1.130 9.918 225 HG22 VAL 27 1HG2 VAL 27 16.691 0.063 9.547 226 HG23 VAL 27 2HG2 VAL 27 17.068 -1.673 9.473 227 H ARG 28 H ARG 28 14.974 -3.535 10.635 228 HA ARG 28 HA ARG 28 12.495 -2.473 11.656 229 HB2 ARG 28 2HB ARG 28 12.906 -5.099 10.173 230 HB3 ARG 28 3HB ARG 28 11.456 -4.081 10.212 231 HG2 ARG 28 2HG ARG 28 12.793 -2.287 9.010 232 HG3 ARG 28 3HG ARG 28 14.147 -3.428 8.937 233 HD2 ARG 28 2HD ARG 28 13.025 -3.560 6.834 234 HD3 ARG 28 3HD ARG 28 12.684 -5.055 7.716 235 HE ARG 28 HE ARG 28 10.526 -3.611 8.394 236 HH11 ARG 28 1HH1 ARG 28 12.058 -4.019 5.233 237 HH12 ARG 28 2HH1 ARG 28 10.559 -3.813 4.353 238 HH21 ARG 28 1HH2 ARG 28 8.596 -3.315 7.214 239 HH22 ARG 28 2HH2 ARG 28 8.616 -3.419 5.468 240 H TYR 29 H TYR 29 14.565 -5.220 12.383 241 HA TYR 29 HA TYR 29 12.590 -6.282 14.316 242 HB2 TYR 29 2HB TYR 29 15.148 -7.421 13.140 243 HB3 TYR 29 3HB TYR 29 14.204 -8.208 14.388 244 HD1 TYR 29 HD1 TYR 29 13.949 -6.921 10.887 245 HD2 TYR 29 HD2 TYR 29 12.299 -9.463 13.925 246 HE1 TYR 29 HE1 TYR 29 12.362 -7.847 9.223 247 HE2 TYR 29 HE2 TYR 29 10.723 -10.430 12.269 248 HH TYR 29 HH TYR 29 10.639 -9.328 8.856 249 H GLN 30 H GLN 30 15.220 -4.118 14.350 250 HA GLN 30 HA GLN 30 16.616 -5.007 16.654 251 HB2 GLN 30 2HB GLN 30 17.365 -3.370 14.941 252 HB3 GLN 30 3HB GLN 30 16.220 -2.186 15.586 253 HG2 GLN 30 2HG GLN 30 17.447 -2.176 17.725 254 HG3 GLN 30 3HG GLN 30 18.527 -3.454 17.131 255 HE21 GLN 30 2HE2 GLN 30 19.431 -2.891 14.784 256 HE22 GLN 30 1HE2 GLN 30 20.086 -1.276 14.624 257 H HIS 31 H HIS 31 13.601 -3.182 16.274 258 HA HIS 31 HA HIS 31 13.452 -2.627 19.157 259 HB2 HIS 31 2HB HIS 31 12.624 -1.010 17.502 260 HB3 HIS 31 3HB HIS 31 11.474 -2.209 16.894 261 HD2 HIS 31 HD2 HIS 31 12.264 -0.361 20.256 262 HE1 HIS 31 HE1 HIS 31 8.072 -1.075 20.120 263 HE2 HIS 31 HE2 HIS 31 9.962 0.001 21.452 264 H LYS 32 H LYS 32 12.210 -5.009 16.823 265 HA LYS 32 HA LYS 32 10.148 -5.974 18.650 266 HB2 LYS 32 2HB LYS 32 11.221 -7.132 16.044 267 HB3 LYS 32 3HB LYS 32 9.751 -7.648 16.896 268 HG2 LYS 32 2HG LYS 32 8.776 -5.394 16.602 269 HG3 LYS 32 3HG LYS 32 10.246 -4.862 15.755 270 HD2 LYS 32 2HD LYS 32 9.895 -6.602 14.029 271 HD3 LYS 32 3HD LYS 32 8.405 -7.121 14.861 272 HE2 LYS 32 2HE LYS 32 7.449 -4.868 14.561 273 HE3 LYS 32 3HE LYS 32 8.927 -4.338 13.742 274 HZ1 LYS 32 3HZ LYS 32 7.229 -4.958 12.175 275 HZ2 LYS 32 1HZ LYS 32 8.497 -5.999 12.051 276 HZ3 LYS 32 2HZ LYS 32 7.112 -6.468 12.806 277 H VAL 33 H VAL 33 13.442 -6.941 17.733 278 HA VAL 33 HA VAL 33 13.350 -9.524 19.026 279 HB VAL 33 HB VAL 33 15.667 -7.727 18.141 280 HG11 VAL 33 1HG1 VAL 33 15.507 -10.693 18.651 281 HG12 VAL 33 2HG1 VAL 33 16.933 -9.807 18.037 282 HG13 VAL 33 3HG1 VAL 33 16.364 -9.546 19.725 283 HG21 VAL 33 3HG2 VAL 33 15.778 -9.083 16.194 284 HG22 VAL 33 1HG2 VAL 33 14.571 -10.231 16.818 285 HG23 VAL 33 2HG2 VAL 33 14.045 -8.605 16.335 286 H ALA 34 H ALA 34 14.395 -6.216 19.882 287 HA ALA 34 HA ALA 34 15.603 -6.862 22.372 288 HB1 ALA 34 1HB ALA 34 14.154 -4.334 21.462 289 HB2 ALA 34 2HB ALA 34 15.269 -4.453 22.844 290 HB3 ALA 34 3HB ALA 34 15.871 -4.703 21.194 291 H SER 35 H SER 35 12.204 -6.569 21.388 292 HA SER 35 HA SER 35 11.189 -6.194 24.061 293 HB2 SER 35 2HB SER 35 10.010 -5.534 21.960 294 HB3 SER 35 3HB SER 35 9.793 -7.258 21.578 295 HG SER 35 HG SER 35 7.989 -6.354 22.666 296 H LEU 36 H LEU 36 11.421 -9.071 21.864 297 HA LEU 36 HA LEU 36 10.233 -10.771 23.882 298 HB2 LEU 36 2HB LEU 36 10.518 -12.549 22.328 299 HB3 LEU 36 3HB LEU 36 10.040 -11.105 21.412 300 HG LEU 36 HG LEU 36 12.670 -10.825 21.103 301 HD11 LEU 36 1HD1 LEU 36 13.335 -12.782 22.536 302 HD12 LEU 36 2HD1 LEU 36 12.336 -13.840 21.518 303 HD13 LEU 36 3HD1 LEU 36 13.768 -13.041 20.840 304 HD21 LEU 36 3HD2 LEU 36 10.984 -12.916 19.679 305 HD22 LEU 36 1HD2 LEU 36 11.046 -11.178 19.296 306 HD23 LEU 36 2HD2 LEU 36 12.488 -12.192 19.058 307 H VAL 37 H VAL 37 13.517 -9.752 23.126 308 HA VAL 37 HA VAL 37 14.634 -11.985 24.652 309 HB VAL 37 HB VAL 37 15.614 -10.858 22.544 310 HG11 VAL 37 1HG1 VAL 37 16.773 -9.065 24.705 311 HG12 VAL 37 2HG1 VAL 37 17.134 -9.009 22.964 312 HG13 VAL 37 3HG1 VAL 37 15.519 -8.544 23.561 313 HG21 VAL 37 3HG2 VAL 37 17.379 -11.372 24.963 314 HG22 VAL 37 1HG2 VAL 37 16.731 -12.620 23.866 315 HG23 VAL 37 2HG2 VAL 37 17.878 -11.407 23.257 316 H SER 38 H SER 38 13.447 -8.798 25.392 317 HA SER 38 HA SER 38 15.151 -8.174 27.600 318 HB2 SER 38 2HB SER 38 12.380 -7.351 26.730 319 HB3 SER 38 3HB SER 38 13.053 -6.815 28.285 320 HG SER 38 HG SER 38 14.067 -6.359 25.691 321 H ARG 39 H ARG 39 12.724 -10.649 27.255 322 HA ARG 39 HA ARG 39 12.375 -10.789 30.184 323 HB2 ARG 39 2HB ARG 39 10.688 -12.397 29.814 324 HB3 ARG 39 3HB ARG 39 10.444 -11.122 28.599 325 HG2 ARG 39 2HG ARG 39 11.670 -12.592 26.951 326 HG3 ARG 39 3HG ARG 39 11.722 -13.863 28.198 327 HD2 ARG 39 2HD ARG 39 9.240 -13.781 28.350 328 HD3 ARG 39 3HD ARG 39 9.221 -12.590 27.035 329 HE ARG 39 HE ARG 39 10.622 -15.115 26.460 330 HH11 ARG 39 1HH1 ARG 39 7.585 -13.310 26.228 331 HH12 ARG 39 2HH1 ARG 39 6.957 -14.314 24.944 332 HH21 ARG 39 1HH2 ARG 39 9.776 -16.410 24.818 333 HH22 ARG 39 2HH2 ARG 39 8.201 -16.062 24.136 334 H TYR 40 H TYR 40 14.703 -11.779 28.022 335 HA TYR 40 HA TYR 40 15.360 -14.177 29.669 336 HB2 TYR 40 2HB TYR 40 16.127 -13.479 26.818 337 HB3 TYR 40 3HB TYR 40 16.710 -14.883 27.715 338 HD1 TYR 40 HD1 TYR 40 14.978 -16.588 28.568 339 HD2 TYR 40 HD2 TYR 40 14.078 -13.582 25.624 340 HE1 TYR 40 HE1 TYR 40 13.026 -17.917 27.804 341 HE2 TYR 40 HE2 TYR 40 12.167 -14.931 24.817 342 HH TYR 40 HH TYR 40 11.277 -18.055 26.328 343 H VAL 41 H VAL 41 16.396 -10.969 28.694 344 HA VAL 41 HA VAL 41 18.625 -11.226 30.615 345 HB VAL 41 HB VAL 41 20.049 -9.806 29.073 346 HG11 VAL 41 1HG1 VAL 41 20.470 -12.207 29.489 347 HG12 VAL 41 2HG1 VAL 41 19.415 -12.625 28.121 348 HG13 VAL 41 3HG1 VAL 41 20.918 -11.719 27.840 349 HG21 VAL 41 3HG2 VAL 41 18.127 -10.827 26.945 350 HG22 VAL 41 1HG2 VAL 41 18.254 -9.137 27.486 351 HG23 VAL 41 2HG2 VAL 41 19.628 -9.911 26.675 352 HA PRO 42 HA PRO 42 16.943 -7.464 32.043 353 HB2 PRO 42 2HB PRO 42 19.069 -6.209 33.216 354 HB3 PRO 42 3HB PRO 42 18.389 -7.747 33.843 355 HG2 PRO 42 2HG PRO 42 20.746 -7.388 31.966 356 HG3 PRO 42 3HG PRO 42 20.697 -8.328 33.499 357 HD2 PRO 42 2HD PRO 42 20.336 -9.541 31.108 358 HD3 PRO 42 3HD PRO 42 19.339 -10.016 32.511 359 H SER 43 H SER 43 17.184 -5.024 31.969 360 HA SER 43 HA SER 43 17.259 -4.240 29.241 361 HB2 SER 43 2HB SER 43 17.247 -2.533 31.754 362 HB3 SER 43 3HB SER 43 16.787 -2.004 30.120 363 HG SER 43 HG SER 43 14.983 -2.628 31.395 364 H GLY 44 H GLY 44 19.864 -4.582 31.476 365 HA2 GLY 44 2HA GLY 44 21.523 -2.486 30.247 366 HA3 GLY 44 3HA GLY 44 21.969 -3.610 31.543 367 H ASP 45 H ASP 45 20.829 -5.883 29.718 368 HA ASP 45 HA ASP 45 23.328 -6.163 28.109 369 HB2 ASP 45 2HB ASP 45 21.728 -8.222 29.654 370 HB3 ASP 45 3HB ASP 45 23.051 -8.601 28.536 371 H VAL 46 H VAL 46 19.990 -5.751 27.839 372 HA VAL 46 HA VAL 46 19.414 -7.617 25.769 373 HB VAL 46 HB VAL 46 17.635 -6.670 26.971 374 HG11 VAL 46 1HG1 VAL 46 18.315 -3.913 25.895 375 HG12 VAL 46 2HG1 VAL 46 16.976 -4.372 26.970 376 HG13 VAL 46 3HG1 VAL 46 18.650 -4.476 27.554 377 HG21 VAL 46 3HG2 VAL 46 16.163 -5.940 25.186 378 HG22 VAL 46 1HG2 VAL 46 17.529 -5.355 24.221 379 HG23 VAL 46 2HG2 VAL 46 17.320 -7.095 24.474 380 HA PRO 47 HA PRO 47 20.361 -4.178 22.642 381 HB2 PRO 47 2HB PRO 47 22.371 -2.401 23.052 382 HB3 PRO 47 3HB PRO 47 20.721 -2.138 23.712 383 HG2 PRO 47 2HG PRO 47 23.125 -3.322 25.145 384 HG3 PRO 47 3HG PRO 47 22.066 -1.993 25.699 385 HD2 PRO 47 2HD PRO 47 21.701 -4.564 26.485 386 HD3 PRO 47 3HD PRO 47 20.298 -3.494 26.192 387 H ASP 48 H ASP 48 22.902 -5.687 24.581 388 HA ASP 48 HA ASP 48 24.729 -5.877 22.309 389 HB2 ASP 48 2HB ASP 48 25.462 -5.562 24.683 390 HB3 ASP 48 3HB ASP 48 24.868 -7.195 25.042 391 H VAL 49 H VAL 49 22.238 -7.846 23.868 392 HA VAL 49 HA VAL 49 23.092 -10.301 22.538 393 HB VAL 49 HB VAL 49 20.640 -9.556 24.178 394 HG11 VAL 49 1HG1 VAL 49 20.190 -11.986 24.255 395 HG12 VAL 49 2HG1 VAL 49 20.054 -11.364 22.596 396 HG13 VAL 49 3HG1 VAL 49 21.505 -12.268 23.090 397 HG21 VAL 49 3HG2 VAL 49 23.066 -11.322 24.736 398 HG22 VAL 49 1HG2 VAL 49 22.824 -9.691 25.391 399 HG23 VAL 49 2HG2 VAL 49 21.724 -11.006 25.863 400 H VAL 50 H VAL 50 20.788 -7.652 21.906 401 HA VAL 50 HA VAL 50 19.506 -8.962 19.654 402 HB VAL 50 HB VAL 50 19.855 -6.058 20.471 403 HG11 VAL 50 1HG1 VAL 50 18.248 -7.225 18.155 404 HG12 VAL 50 2HG1 VAL 50 18.141 -5.553 18.752 405 HG13 VAL 50 3HG1 VAL 50 19.648 -6.130 18.020 406 HG21 VAL 50 3HG2 VAL 50 17.433 -7.900 20.365 407 HG22 VAL 50 1HG2 VAL 50 18.349 -7.530 21.845 408 HG23 VAL 50 2HG2 VAL 50 17.469 -6.241 20.993 409 H GLN 51 H GLN 51 22.476 -6.987 20.116 410 HA GLN 51 HA GLN 51 23.027 -6.803 17.298 411 HB2 GLN 51 2HB GLN 51 23.970 -5.256 18.973 412 HB3 GLN 51 3HB GLN 51 24.900 -6.599 19.685 413 HG2 GLN 51 2HG GLN 51 26.103 -6.912 17.567 414 HG3 GLN 51 3HG GLN 51 25.137 -5.642 16.804 415 HE21 GLN 51 2HE2 GLN 51 27.686 -5.164 16.520 416 HE22 GLN 51 1HE2 GLN 51 28.305 -3.999 17.675 417 H GLU 52 H GLU 52 24.101 -9.092 19.908 418 HA GLU 52 HA GLU 52 25.797 -10.567 18.120 419 HB2 GLU 52 2HB GLU 52 25.965 -10.618 20.604 420 HB3 GLU 52 3HB GLU 52 24.432 -11.521 20.664 421 HG2 GLU 52 2HG GLU 52 25.427 -13.332 19.322 422 HG3 GLU 52 3HG GLU 52 26.935 -12.422 19.168 423 H ALA 53 H ALA 53 22.310 -10.667 18.848 424 HA ALA 53 HA ALA 53 21.840 -13.205 17.599 425 HB1 ALA 53 1HB ALA 53 19.999 -10.816 18.020 426 HB2 ALA 53 2HB ALA 53 19.485 -12.458 17.578 427 HB3 ALA 53 3HB ALA 53 20.255 -12.160 19.156 428 H PHE 54 H PHE 54 22.007 -9.832 16.367 429 HA PHE 54 HA PHE 54 21.184 -10.607 13.695 430 HB2 PHE 54 2HB PHE 54 22.580 -8.140 14.789 431 HB3 PHE 54 3HB PHE 54 22.011 -8.313 13.132 432 HD1 PHE 54 HD2 PHE 54 19.363 -9.836 13.886 433 HD2 PHE 54 HD1 PHE 54 21.214 -6.226 15.352 434 HE1 PHE 54 HE2 PHE 54 17.163 -8.962 14.542 435 HE2 PHE 54 HE1 PHE 54 18.979 -5.335 15.941 436 HZ PHE 54 HZ PHE 54 16.957 -6.712 15.556 437 H ILE 55 H ILE 55 24.349 -10.285 15.357 438 HA ILE 55 HA ILE 55 25.859 -10.579 12.906 439 HB ILE 55 HB ILE 55 26.577 -11.079 15.822 440 HG12 ILE 55 2HG1 ILE 55 27.248 -8.727 13.983 441 HG13 ILE 55 3HG1 ILE 55 25.946 -8.713 15.161 442 HG21 ILE 55 1HG2 ILE 55 28.931 -11.012 15.065 443 HG22 ILE 55 2HG2 ILE 55 28.068 -12.348 14.307 444 HG23 ILE 55 3HG2 ILE 55 28.387 -10.868 13.377 445 HD11 ILE 55 3HD1 ILE 55 28.918 -9.021 15.773 446 HD12 ILE 55 1HD1 ILE 55 27.892 -7.618 16.116 447 HD13 ILE 55 2HD1 ILE 55 27.613 -9.144 16.984 448 H LYS 56 H LYS 56 24.498 -12.788 15.339 449 HA LYS 56 HA LYS 56 25.727 -15.168 14.225 450 HB2 LYS 56 2HB LYS 56 25.098 -14.824 16.608 451 HB3 LYS 56 3HB LYS 56 23.390 -14.754 16.137 452 HG2 LYS 56 2HG LYS 56 23.575 -17.079 15.243 453 HG3 LYS 56 3HG LYS 56 25.260 -17.138 15.817 454 HD2 LYS 56 2HD LYS 56 22.769 -16.701 17.520 455 HD3 LYS 56 3HD LYS 56 23.718 -18.195 17.444 456 HE2 LYS 56 2HE LYS 56 24.711 -15.490 18.451 457 HE3 LYS 56 3HE LYS 56 24.225 -16.848 19.465 458 HZ1 LYS 56 3HZ LYS 56 25.999 -18.142 18.490 459 HZ2 LYS 56 1HZ LYS 56 26.472 -16.877 17.553 460 HZ3 LYS 56 2HZ LYS 56 26.592 -16.780 19.189 461 H ALA 57 H ALA 57 22.641 -13.409 13.828 462 HA ALA 57 HA ALA 57 21.299 -15.517 12.429 463 HB1 ALA 57 1HB ALA 57 20.896 -12.493 12.385 464 HB2 ALA 57 2HB ALA 57 19.783 -13.690 11.684 465 HB3 ALA 57 3HB ALA 57 20.063 -13.667 13.435 466 H TYR 58 H TYR 58 23.375 -12.759 11.327 467 HA TYR 58 HA TYR 58 22.809 -13.116 8.568 468 HB2 TYR 58 2HB TYR 58 23.864 -11.130 9.631 469 HB3 TYR 58 3HB TYR 58 25.326 -12.070 9.918 470 HD1 TYR 58 HD2 TYR 58 23.029 -10.961 7.162 471 HD2 TYR 58 HD1 TYR 58 27.005 -12.167 8.278 472 HE1 TYR 58 HE2 TYR 58 23.857 -10.284 4.924 473 HE2 TYR 58 HE1 TYR 58 27.835 -11.536 6.038 474 HH TYR 58 HH TYR 58 27.296 -10.659 3.981 475 H ARG 59 H ARG 59 25.247 -14.600 10.714 476 HA ARG 59 HA ARG 59 26.675 -15.973 8.622 477 HB2 ARG 59 2HB ARG 59 26.490 -16.462 11.616 478 HB3 ARG 59 3HB ARG 59 27.631 -17.260 10.514 479 HG2 ARG 59 2HG ARG 59 28.675 -15.123 9.963 480 HG3 ARG 59 3HG ARG 59 27.418 -14.237 10.859 481 HD2 ARG 59 2HD ARG 59 29.309 -14.347 12.288 482 HD3 ARG 59 3HD ARG 59 28.104 -15.478 12.931 483 HE ARG 59 HE ARG 59 29.805 -16.916 11.174 484 HH11 ARG 59 1HH1 ARG 59 29.949 -15.278 14.301 485 HH12 ARG 59 2HH1 ARG 59 31.226 -16.307 14.913 486 HH21 ARG 59 1HH2 ARG 59 31.471 -18.247 11.997 487 HH22 ARG 59 2HH2 ARG 59 32.085 -17.976 13.609 488 H ALA 60 H ALA 60 23.670 -16.578 10.280 489 HA ALA 60 HA ALA 60 23.622 -19.385 9.301 490 HB1 ALA 60 1HB ALA 60 21.800 -17.896 11.229 491 HB2 ALA 60 2HB ALA 60 21.712 -19.628 10.828 492 HB3 ALA 60 3HB ALA 60 23.125 -18.987 11.691 493 H LEU 61 H LEU 61 22.645 -16.244 8.372 494 HA LEU 61 HA LEU 61 20.072 -16.892 7.260 495 HB2 LEU 61 2HB LEU 61 20.923 -14.613 8.035 496 HB3 LEU 61 3HB LEU 61 21.945 -14.588 6.585 497 HG LEU 61 HG LEU 61 19.851 -14.829 5.196 498 HD11 LEU 61 1HD1 LEU 61 18.353 -15.850 6.855 499 HD12 LEU 61 2HD1 LEU 61 18.559 -14.444 7.923 500 HD13 LEU 61 3HD1 LEU 61 17.701 -14.273 6.366 501 HD21 LEU 61 3HD2 LEU 61 19.953 -12.496 7.160 502 HD22 LEU 61 1HD2 LEU 61 20.892 -12.640 5.657 503 HD23 LEU 61 2HD2 LEU 61 19.114 -12.501 5.589 504 H ASP 62 H ASP 62 23.414 -17.094 6.210 505 HA ASP 62 HA ASP 62 22.933 -17.385 3.397 506 HB2 ASP 62 2HB ASP 62 25.115 -16.891 4.452 507 HB3 ASP 62 3HB ASP 62 25.127 -18.511 5.176 508 H SER 63 H SER 63 22.009 -19.328 6.041 509 HA SER 63 HA SER 63 21.810 -21.759 4.339 510 HB2 SER 63 2HB SER 63 21.801 -21.478 7.368 511 HB3 SER 63 3HB SER 63 21.697 -22.993 6.448 512 HG SER 63 HG SER 63 23.835 -22.513 7.134 513 H PHE 64 H PHE 64 19.985 -19.134 5.255 514 HA PHE 64 HA PHE 64 17.517 -20.488 5.952 515 HB2 PHE 64 2HB PHE 64 18.007 -18.179 6.626 516 HB3 PHE 64 3HB PHE 64 18.064 -17.686 4.930 517 HD1 PHE 64 HD1 PHE 64 15.808 -19.220 7.500 518 HD2 PHE 64 HD2 PHE 64 16.092 -16.999 3.828 519 HE1 PHE 64 HE1 PHE 64 13.362 -18.825 7.551 520 HE2 PHE 64 HE2 PHE 64 13.645 -16.580 3.894 521 HZ PHE 64 HZ PHE 64 12.279 -17.494 5.748 522 H ARG 65 H ARG 65 15.689 -20.812 4.627 523 HA ARG 65 HA ARG 65 16.087 -20.575 1.716 524 HB2 ARG 65 2HB ARG 65 15.686 -22.968 1.338 525 HB3 ARG 65 3HB ARG 65 17.167 -22.680 2.262 526 HG2 ARG 65 2HG ARG 65 15.889 -23.160 4.381 527 HG3 ARG 65 3HG ARG 65 14.486 -23.600 3.384 528 HD2 ARG 65 2HD ARG 65 17.242 -24.881 3.238 529 HD3 ARG 65 3HD ARG 65 15.842 -25.563 4.089 530 HE ARG 65 HE ARG 65 15.011 -25.077 1.448 531 HH11 ARG 65 1HH1 ARG 65 17.361 -27.117 3.132 532 HH12 ARG 65 2HH1 ARG 65 17.321 -28.371 1.916 533 HH21 ARG 65 1HH2 ARG 65 14.970 -26.726 -0.113 534 HH22 ARG 65 2HH2 ARG 65 15.959 -28.156 0.092 535 H GLY 66 H GLY 66 14.123 -19.772 4.081 536 HA2 GLY 66 2HA GLY 66 11.944 -19.060 3.994 537 HA3 GLY 66 3HA GLY 66 11.839 -19.645 2.325 538 H ASP 67 H ASP 67 12.867 -22.026 4.662 539 HA ASP 67 HA ASP 67 10.533 -23.636 4.233 540 HB2 ASP 67 2HB ASP 67 12.796 -24.519 4.713 541 HB3 ASP 67 3HB ASP 67 12.725 -23.824 6.340 542 H SER 68 H SER 68 11.148 -20.982 6.294 543 HA SER 68 HA SER 68 8.515 -21.250 7.566 544 HB2 SER 68 2HB SER 68 9.427 -20.843 9.821 545 HB3 SER 68 3HB SER 68 9.996 -22.389 9.172 546 HG SER 68 HG SER 68 11.686 -21.152 10.105 547 H ALA 69 H ALA 69 8.051 -19.114 8.810 548 HA ALA 69 HA ALA 69 8.651 -16.933 7.058 549 HB1 ALA 69 1HB ALA 69 7.499 -16.928 9.877 550 HB2 ALA 69 2HB ALA 69 7.440 -15.581 8.713 551 HB3 ALA 69 3HB ALA 69 6.573 -17.092 8.360 552 H PHE 70 H PHE 70 10.009 -15.114 7.356 553 HA PHE 70 HA PHE 70 12.528 -15.776 8.519 554 HB2 PHE 70 2HB PHE 70 12.357 -14.260 6.615 555 HB3 PHE 70 3HB PHE 70 11.369 -13.136 7.558 556 HD1 PHE 70 HD2 PHE 70 14.719 -14.838 7.748 557 HD2 PHE 70 HD1 PHE 70 12.409 -11.298 8.537 558 HE1 PHE 70 HE2 PHE 70 16.754 -13.691 8.587 559 HE2 PHE 70 HE1 PHE 70 14.448 -10.149 9.350 560 HZ PHE 70 HZ PHE 70 16.627 -11.344 9.368 561 H TYR 71 H TYR 71 9.743 -13.901 9.794 562 HA TYR 71 HA TYR 71 11.322 -12.710 11.875 563 HB2 TYR 71 2HB TYR 71 9.218 -12.018 12.836 564 HB3 TYR 71 3HB TYR 71 9.210 -11.746 11.093 565 HD1 TYR 71 HD1 TYR 71 7.923 -13.909 13.823 566 HD2 TYR 71 HD2 TYR 71 7.581 -12.796 9.685 567 HE1 TYR 71 HE1 TYR 71 5.780 -15.146 13.675 568 HE2 TYR 71 HE2 TYR 71 5.433 -14.022 9.522 569 HH TYR 71 HH TYR 71 4.024 -15.757 12.334 570 H THR 72 H THR 72 9.385 -15.741 11.648 571 HA THR 72 HA THR 72 9.681 -16.383 14.444 572 HB THR 72 HB THR 72 9.213 -18.217 12.055 573 HG1 THR 72 1HG THR 72 7.038 -17.961 12.674 574 HG21 THR 72 1HG2 THR 72 8.202 -19.706 13.769 575 HG22 THR 72 2HG2 THR 72 9.918 -19.417 14.101 576 HG23 THR 72 3HG2 THR 72 8.685 -18.555 15.044 577 H TRP 73 H TRP 73 11.546 -17.033 11.469 578 HA TRP 73 HA TRP 73 13.360 -18.903 12.672 579 HB2 TRP 73 2HB TRP 73 12.975 -18.789 10.268 580 HB3 TRP 73 3HB TRP 73 13.520 -17.112 10.224 581 HD1 TRP 73 HD1 TRP 73 14.808 -20.657 10.249 582 HE1 TRP 73 HE1 TRP 73 17.332 -20.689 9.864 583 HE3 TRP 73 HE3 TRP 73 15.739 -15.633 10.593 584 HZ2 TRP 73 HZ2 TRP 73 19.503 -18.793 9.838 585 HZ3 TRP 73 HZ3 TRP 73 18.047 -14.785 10.392 586 HH2 TRP 73 HH2 TRP 73 19.938 -16.354 10.032 587 H LEU 74 H LEU 74 13.295 -15.341 12.416 588 HA LEU 74 HA LEU 74 16.064 -15.057 13.245 589 HB2 LEU 74 2HB LEU 74 14.949 -13.428 11.768 590 HB3 LEU 74 3HB LEU 74 13.763 -13.076 13.033 591 HG LEU 74 HG LEU 74 15.592 -12.258 14.516 592 HD11 LEU 74 1HD1 LEU 74 17.817 -11.798 13.497 593 HD12 LEU 74 2HD1 LEU 74 17.491 -13.535 13.596 594 HD13 LEU 74 3HD1 LEU 74 17.317 -12.687 12.038 595 HD21 LEU 74 3HD2 LEU 74 14.318 -10.716 13.083 596 HD22 LEU 74 1HD2 LEU 74 15.995 -10.172 13.309 597 HD23 LEU 74 2HD2 LEU 74 15.509 -10.937 11.779 598 H TYR 75 H TYR 75 12.856 -14.947 14.830 599 HA TYR 75 HA TYR 75 13.893 -13.894 17.303 600 HB2 TYR 75 2HB TYR 75 11.324 -15.370 16.641 601 HB3 TYR 75 3HB TYR 75 11.676 -14.626 18.200 602 HD1 TYR 75 HD2 TYR 75 13.197 -12.161 16.816 603 HD2 TYR 75 HD1 TYR 75 9.329 -13.997 16.317 604 HE1 TYR 75 HE2 TYR 75 12.296 -10.019 16.066 605 HE2 TYR 75 HE1 TYR 75 8.421 -11.841 15.495 606 HH TYR 75 HH TYR 75 8.865 -9.653 15.020 607 H ARG 76 H ARG 76 13.918 -17.101 15.920 608 HA ARG 76 HA ARG 76 14.387 -18.454 18.456 609 HB2 ARG 76 2HB ARG 76 14.939 -19.183 15.550 610 HB3 ARG 76 3HB ARG 76 15.254 -20.275 16.914 611 HG2 ARG 76 2HG ARG 76 12.917 -20.226 17.581 612 HG3 ARG 76 3HG ARG 76 12.549 -19.040 16.311 613 HD2 ARG 76 2HD ARG 76 13.239 -20.684 14.587 614 HD3 ARG 76 3HD ARG 76 13.607 -21.868 15.859 615 HE ARG 76 HE ARG 76 10.949 -21.065 16.268 616 HH11 ARG 76 1HH1 ARG 76 12.814 -22.681 13.735 617 HH12 ARG 76 2HH1 ARG 76 11.445 -23.601 13.154 618 HH21 ARG 76 1HH2 ARG 76 9.187 -22.293 15.500 619 HH22 ARG 76 2HH2 ARG 76 9.399 -23.375 14.148 620 H ILE 77 H ILE 77 16.340 -16.613 16.162 621 HA ILE 77 HA ILE 77 18.873 -17.601 17.172 622 HB ILE 77 HB ILE 77 18.387 -14.922 15.823 623 HG12 ILE 77 2HG1 ILE 77 17.333 -16.537 14.361 624 HG13 ILE 77 3HG1 ILE 77 18.860 -15.996 13.668 625 HG21 ILE 77 1HG2 ILE 77 20.783 -16.800 15.966 626 HG22 ILE 77 2HG2 ILE 77 20.704 -15.299 15.020 627 HG23 ILE 77 3HG2 ILE 77 20.605 -15.238 16.787 628 HD11 ILE 77 3HD1 ILE 77 19.954 -18.092 14.426 629 HD12 ILE 77 1HD1 ILE 77 18.395 -18.641 15.108 630 HD13 ILE 77 2HD1 ILE 77 18.577 -18.395 13.355 631 H ALA 78 H ALA 78 16.634 -14.949 17.998 632 HA ALA 78 HA ALA 78 18.561 -13.521 19.587 633 HB1 ALA 78 1HB ALA 78 15.534 -13.334 19.463 634 HB2 ALA 78 2HB ALA 78 16.622 -12.139 20.204 635 HB3 ALA 78 3HB ALA 78 16.693 -12.439 18.454 636 H VAL 79 H VAL 79 16.018 -15.950 20.349 637 HA VAL 79 HA VAL 79 16.389 -15.514 23.214 638 HB VAL 79 HB VAL 79 14.195 -16.058 22.316 639 HG11 VAL 79 1HG1 VAL 79 15.368 -18.795 21.666 640 HG12 VAL 79 2HG1 VAL 79 13.667 -18.305 21.493 641 HG13 VAL 79 3HG1 VAL 79 14.910 -17.566 20.457 642 HG21 VAL 79 3HG2 VAL 79 15.275 -18.328 24.036 643 HG22 VAL 79 1HG2 VAL 79 14.826 -16.722 24.645 644 HG23 VAL 79 2HG2 VAL 79 13.592 -17.783 23.927 645 H ASN 80 H ASN 80 17.663 -17.721 20.740 646 HA ASN 80 HA ASN 80 18.808 -19.539 22.703 647 HB2 ASN 80 2HB ASN 80 19.263 -19.128 19.722 648 HB3 ASN 80 3HB ASN 80 20.083 -20.362 20.681 649 HD21 ASN 80 2HD2 ASN 80 18.708 -21.351 18.642 650 HD22 ASN 80 1HD2 ASN 80 17.215 -22.100 19.176 651 H THR 81 H THR 81 19.765 -16.495 21.199 652 HA THR 81 HA THR 81 22.572 -16.779 21.958 653 HB THR 81 HB THR 81 20.953 -14.358 21.060 654 HG1 THR 81 1HG THR 81 21.093 -15.842 19.438 655 HG21 THR 81 1HG2 THR 81 23.190 -13.408 20.512 656 HG22 THR 81 2HG2 THR 81 23.007 -13.674 22.262 657 HG23 THR 81 3HG2 THR 81 23.961 -14.815 21.287 658 H ALA 82 H ALA 82 19.589 -15.524 23.420 659 HA ALA 82 HA ALA 82 20.946 -13.966 25.442 660 HB1 ALA 82 1HB ALA 82 18.110 -15.081 25.330 661 HB2 ALA 82 2HB ALA 82 18.687 -13.788 26.410 662 HB3 ALA 82 3HB ALA 82 18.641 -13.524 24.653 663 H LYS 83 H LYS 83 19.750 -17.336 25.238 664 HA LYS 83 HA LYS 83 20.267 -17.846 28.055 665 HB2 LYS 83 2HB LYS 83 19.736 -19.652 25.660 666 HB3 LYS 83 3HB LYS 83 19.928 -20.242 27.322 667 HG2 LYS 83 2HG LYS 83 18.054 -18.884 28.077 668 HG3 LYS 83 3HG LYS 83 17.854 -18.176 26.464 669 HD2 LYS 83 2HD LYS 83 17.354 -20.386 25.521 670 HD3 LYS 83 3HD LYS 83 17.589 -21.143 27.113 671 HE2 LYS 83 2HE LYS 83 15.518 -18.992 26.502 672 HE3 LYS 83 3HE LYS 83 15.180 -20.728 26.512 673 HZ1 LYS 83 3HZ LYS 83 16.158 -19.183 28.818 674 HZ2 LYS 83 1HZ LYS 83 14.622 -19.729 28.608 675 HZ3 LYS 83 2HZ LYS 83 15.851 -20.798 28.810 676 H ASN 84 H ASN 84 22.082 -18.088 25.015 677 HA ASN 84 HA ASN 84 24.313 -19.509 26.194 678 HB2 ASN 84 2HB ASN 84 23.773 -19.550 23.786 679 HB3 ASN 84 3HB ASN 84 24.084 -17.814 23.676 680 HD21 ASN 84 2HD2 ASN 84 26.175 -17.108 23.344 681 HD22 ASN 84 1HD2 ASN 84 27.574 -18.163 23.356 682 H TYR 85 H TYR 85 23.249 -16.154 26.058 683 HA TYR 85 HA TYR 85 25.847 -14.993 26.606 684 HB2 TYR 85 2HB TYR 85 23.970 -13.842 25.439 685 HB3 TYR 85 3HB TYR 85 23.038 -13.886 26.939 686 HD1 TYR 85 HD2 TYR 85 25.958 -12.410 25.221 687 HD2 TYR 85 HD1 TYR 85 23.514 -12.370 28.758 688 HE1 TYR 85 HE2 TYR 85 26.988 -10.253 25.900 689 HE2 TYR 85 HE1 TYR 85 24.534 -10.212 29.444 690 HH TYR 85 HH TYR 85 25.991 -8.544 28.885 691 H LEU 86 H LEU 86 23.027 -16.044 28.566 692 HA LEU 86 HA LEU 86 24.059 -14.831 30.982 693 HB2 LEU 86 2HB LEU 86 21.942 -16.952 30.454 694 HB3 LEU 86 3HB LEU 86 22.356 -16.362 32.072 695 HG LEU 86 HG LEU 86 21.236 -14.654 29.821 696 HD11 LEU 86 1HD1 LEU 86 19.316 -14.513 31.429 697 HD12 LEU 86 2HD1 LEU 86 19.607 -16.168 30.850 698 HD13 LEU 86 3HD1 LEU 86 20.139 -15.687 32.476 699 HD21 LEU 86 3HD2 LEU 86 22.043 -13.968 32.684 700 HD22 LEU 86 1HD2 LEU 86 22.757 -13.303 31.197 701 HD23 LEU 86 2HD2 LEU 86 21.077 -12.919 31.626 702 H VAL 87 H VAL 87 24.710 -17.918 29.366 703 HA VAL 87 HA VAL 87 25.991 -18.919 31.834 704 HB VAL 87 HB VAL 87 26.536 -20.904 30.515 705 HG11 VAL 87 1HG1 VAL 87 23.629 -20.034 30.256 706 HG12 VAL 87 2HG1 VAL 87 24.226 -21.704 30.241 707 HG13 VAL 87 3HG1 VAL 87 24.374 -20.722 31.717 708 HG21 VAL 87 3HG2 VAL 87 26.796 -19.874 28.299 709 HG22 VAL 87 1HG2 VAL 87 25.605 -21.189 28.256 710 HG23 VAL 87 2HG2 VAL 87 25.056 -19.495 28.261 711 H ALA 88 H ALA 88 26.880 -17.136 28.945 712 HA ALA 88 HA ALA 88 29.681 -17.850 29.060 713 HB1 ALA 88 1HB ALA 88 28.246 -15.468 27.805 714 HB2 ALA 88 2HB ALA 88 29.926 -15.948 27.476 715 HB3 ALA 88 3HB ALA 88 28.585 -17.016 26.997 716 H GLN 89 H GLN 89 27.660 -15.588 30.789 717 HA GLN 89 HA GLN 89 30.094 -14.434 32.078 718 HB2 GLN 89 2HB GLN 89 27.283 -13.373 31.649 719 HB3 GLN 89 3HB GLN 89 28.337 -12.740 32.920 720 HG2 GLN 89 2HG GLN 89 28.575 -11.315 31.011 721 HG3 GLN 89 3HG GLN 89 30.082 -12.216 31.222 722 HE21 GLN 89 2HE2 GLN 89 26.988 -12.184 29.373 723 HE22 GLN 89 1HE2 GLN 89 27.655 -12.921 27.936 724 H GLY 90 H GLY 90 27.511 -16.649 32.461 725 HA2 GLY 90 2HA GLY 90 27.435 -16.411 35.401 726 HA3 GLY 90 3HA GLY 90 26.413 -17.436 34.377 727 H ARG 91 H ARG 91 29.448 -17.952 33.170 728 HA ARG 91 HA ARG 91 29.992 -20.155 35.114 729 HB2 ARG 91 2HB ARG 91 30.406 -20.105 32.106 730 HB3 ARG 91 3HB ARG 91 30.947 -21.400 33.175 731 HG2 ARG 91 2HG ARG 91 28.041 -20.511 32.876 732 HG3 ARG 91 3HG ARG 91 28.773 -21.904 32.057 733 HD2 ARG 91 2HD ARG 91 29.273 -22.939 34.233 734 HD3 ARG 91 3HD ARG 91 28.581 -21.547 35.081 735 HE ARG 91 HE ARG 91 27.116 -23.641 33.598 736 HH11 ARG 91 1HH1 ARG 91 26.978 -20.579 35.379 737 HH12 ARG 91 2HH1 ARG 91 25.254 -20.692 35.643 738 HH21 ARG 91 1HH2 ARG 91 24.883 -23.747 33.956 739 HH22 ARG 91 2HH2 ARG 91 24.076 -22.485 34.856 740 H ARG 92 H ARG 92 31.152 -17.189 34.271 741 HA ARG 92 HA ARG 92 33.966 -17.803 34.034 742 HB2 ARG 92 2HB ARG 92 32.570 -15.249 34.931 743 HB3 ARG 92 3HB ARG 92 34.289 -15.399 34.521 744 HG2 ARG 92 2HG ARG 92 33.664 -16.116 32.217 745 HG3 ARG 92 3HG ARG 92 31.948 -15.906 32.640 746 HD2 ARG 92 2HD ARG 92 32.435 -13.510 33.199 747 HD3 ARG 92 3HD ARG 92 34.097 -13.753 32.634 748 HE ARG 92 HE ARG 92 31.903 -14.401 30.748 749 HH11 ARG 92 1HH1 ARG 92 34.428 -12.122 31.735 750 HH12 ARG 92 2HH1 ARG 92 34.437 -11.298 30.197 751 HH21 ARG 92 1HH2 ARG 92 31.857 -13.229 28.807 752 HH22 ARG 92 2HH2 ARG 92 32.995 -11.923 28.539 753 H LEU 93 H LEU 93 35.410 -18.280 35.563 754 HA LEU 93 HA LEU 93 36.204 -19.019 37.548 755 HB2 LEU 93 2HB LEU 93 34.911 -16.412 38.413 756 HB3 LEU 93 3HB LEU 93 35.904 -17.398 39.488 757 HG LEU 93 HG LEU 93 37.188 -15.566 38.583 758 HD11 LEU 93 1HD1 LEU 93 39.128 -16.820 37.807 759 HD12 LEU 93 2HD1 LEU 93 38.312 -17.695 39.120 760 HD13 LEU 93 3HD1 LEU 93 38.111 -18.225 37.428 761 HD21 LEU 93 3HD2 LEU 93 36.885 -16.808 35.825 762 HD22 LEU 93 1HD2 LEU 93 36.012 -15.351 36.379 763 HD23 LEU 93 2HD2 LEU 93 37.784 -15.346 36.269 764 H GLU 94 H GLU 94 33.438 -19.920 36.769 765 HA GLU 94 HA GLU 94 32.659 -20.912 39.454 766 HB2 GLU 94 2HB GLU 94 31.257 -18.949 38.659 767 HB3 GLU 94 3HB GLU 94 30.694 -19.974 37.334 768 HG2 GLU 94 2HG GLU 94 29.086 -19.938 39.183 769 HG3 GLU 94 3HG GLU 94 29.732 -21.565 38.986 770 H LEU 95 H LEU 95 33.806 -21.706 36.483 771 HA LEU 95 HA LEU 95 32.531 -24.395 36.594 772 HB2 LEU 95 2HB LEU 95 31.636 -23.015 34.735 773 HB3 LEU 95 3HB LEU 95 33.280 -22.779 34.125 774 HG LEU 95 HG LEU 95 33.484 -25.203 33.694 775 HD11 LEU 95 1HD1 LEU 95 31.459 -26.646 33.874 776 HD12 LEU 95 2HD1 LEU 95 31.999 -26.089 35.467 777 HD13 LEU 95 3HD1 LEU 95 30.599 -25.320 34.691 778 HD21 LEU 95 3HD2 LEU 95 30.925 -23.988 32.585 779 HD22 LEU 95 1HD2 LEU 95 32.562 -23.700 31.960 780 HD23 LEU 95 2HD2 LEU 95 31.846 -25.326 31.864 781 H VAL 96 H VAL 96 35.406 -22.472 36.545 782 HA VAL 96 HA VAL 96 37.033 -24.886 36.769 783 HB VAL 96 HB VAL 96 36.951 -24.488 34.342 784 HG11 VAL 96 1HG1 VAL 96 38.232 -21.792 34.913 785 HG12 VAL 96 2HG1 VAL 96 37.908 -22.498 33.321 786 HG13 VAL 96 3HG1 VAL 96 36.551 -22.044 34.373 787 HG21 VAL 96 3HG2 VAL 96 39.655 -23.786 35.552 788 HG22 VAL 96 1HG2 VAL 96 39.011 -25.425 35.282 789 HG23 VAL 96 2HG2 VAL 96 39.364 -24.377 33.899 790 HA PRO 97 HA PRO 97 38.673 -22.062 39.752 791 HB2 PRO 97 2HB PRO 97 40.787 -23.482 40.707 792 HB3 PRO 97 3HB PRO 97 39.090 -24.014 40.950 793 HG2 PRO 97 2HG PRO 97 41.023 -24.901 38.779 794 HG3 PRO 97 3HG PRO 97 40.061 -25.940 39.880 795 HD2 PRO 97 2HD PRO 97 39.202 -25.341 37.374 796 HD3 PRO 97 3HD PRO 97 38.052 -25.437 38.741 797 H ARG 98 H ARG 98 40.059 -22.540 36.758 798 HA ARG 98 HA ARG 98 42.263 -20.616 37.328 799 HB2 ARG 98 2HB ARG 98 42.227 -22.887 35.312 800 HB3 ARG 98 3HB ARG 98 43.504 -21.663 35.468 801 HG2 ARG 98 2HG ARG 98 43.898 -22.383 37.815 802 HG3 ARG 98 3HG ARG 98 42.653 -23.635 37.631 803 HD2 ARG 98 2HD ARG 98 44.865 -24.620 37.313 804 HD3 ARG 98 3HD ARG 98 43.959 -24.661 35.791 805 HE ARG 98 HE ARG 98 45.465 -23.164 34.843 806 HH11 ARG 98 1HH1 ARG 98 46.023 -23.356 38.331 807 HH12 ARG 98 2HH1 ARG 98 47.523 -22.458 38.257 808 HH21 ARG 98 1HH2 ARG 98 47.421 -21.994 34.777 809 HH22 ARG 98 2HH2 ARG 98 48.307 -21.697 36.254 810 H GLY 99 H GLY 99 39.346 -20.309 36.491 811 HA2 GLY 99 2HA GLY 99 39.271 -19.517 33.743 812 HA3 GLY 99 3HA GLY 99 38.100 -19.096 34.993 813 H SER 100 H SER 100 38.502 -17.214 33.194 814 HA SER 100 HA SER 100 39.863 -15.056 34.651 815 HB2 SER 100 2HB SER 100 41.126 -14.373 32.613 816 HB3 SER 100 3HB SER 100 41.665 -15.935 33.259 817 HG SER 100 HG SER 100 41.299 -15.887 30.949 818 H HIS 101 H HIS 101 39.511 -12.933 33.314 819 HA HIS 101 HA HIS 101 36.659 -12.922 32.552 820 HB2 HIS 101 2HB HIS 101 37.551 -11.436 34.354 821 HB3 HIS 101 3HB HIS 101 38.529 -10.606 33.133 822 HD2 HIS 101 HD2 HIS 101 37.396 -8.546 32.033 823 HE1 HIS 101 HE1 HIS 101 33.329 -9.392 32.941 824 HE2 HIS 101 HE2 HIS 101 34.925 -7.696 31.907 825 H HIS 102 H HIS 102 39.584 -13.212 30.972 826 HA HIS 102 HA HIS 102 38.389 -12.373 28.420 827 HB2 HIS 102 2HB HIS 102 39.525 -10.337 29.232 828 HB3 HIS 102 3HB HIS 102 41.017 -11.251 29.468 829 HD2 HIS 102 HD2 HIS 102 42.680 -10.609 27.615 830 HE1 HIS 102 HE1 HIS 102 40.049 -10.435 24.273 831 HE2 HIS 102 HE2 HIS 102 42.473 -10.217 25.029 832 H HIS 103 H HIS 103 39.468 -13.325 26.601 833 HA HIS 103 HA HIS 103 40.249 -15.168 25.560 834 HB2 HIS 103 2HB HIS 103 42.327 -13.879 26.063 835 HB3 HIS 103 3HB HIS 103 42.590 -14.912 27.470 836 HD2 HIS 103 HD2 HIS 103 44.443 -16.616 26.898 837 HE1 HIS 103 HE1 HIS 103 43.386 -17.554 22.888 838 HE2 HIS 103 HE2 HIS 103 45.015 -18.050 24.778 839 H HIS 104 H HIS 104 38.496 -15.582 27.893 840 HA HIS 104 HA HIS 104 39.426 -18.042 29.155 841 HB2 HIS 104 2HB HIS 104 37.353 -17.866 30.426 842 HB3 HIS 104 3HB HIS 104 38.220 -16.325 30.432 843 HD2 HIS 104 HD2 HIS 104 34.842 -17.689 29.912 844 HE1 HIS 104 HE1 HIS 104 34.772 -14.010 27.778 845 HE2 HIS 104 HE2 HIS 104 33.342 -15.902 28.718 846 H HIS 105 H HIS 105 38.400 -17.561 26.124 847 HA HIS 105 HA HIS 105 37.055 -20.201 26.003 848 HB2 HIS 105 2HB HIS 105 35.301 -18.455 25.994 849 HB3 HIS 105 3HB HIS 105 36.097 -17.666 24.626 850 HD2 HIS 105 HD2 HIS 105 34.419 -21.087 25.481 851 HE1 HIS 105 HE1 HIS 105 33.938 -20.417 21.308 852 HE2 HIS 105 HE2 HIS 105 33.374 -21.973 23.248 853 H HIS 106 H HIS 106 37.254 -21.238 23.926 854 HA HIS 106 HA HIS 106 39.298 -20.113 22.104 855 HB2 HIS 106 2HB HIS 106 39.495 -22.858 23.397 856 HB3 HIS 106 3HB HIS 106 40.614 -22.164 22.215 857 HD2 HIS 106 HD2 HIS 106 42.016 -19.892 23.116 858 HE1 HIS 106 HE1 HIS 106 41.691 -20.924 27.230 859 HE2 HIS 106 HE2 HIS 106 42.886 -19.434 25.547 Start of MODEL 10 1 H1 MET 1 H1 MET 1 -1.055 -6.371 -4.844 2 H2 MET 1 H2 MET 1 -0.441 -7.208 -3.573 3 H3 MET 1 H3 MET 1 -0.657 -7.963 -5.020 4 HA MET 1 HA MET 1 1.655 -7.486 -4.658 5 HB2 MET 1 2HB MET 1 0.343 -5.827 -6.846 6 HB3 MET 1 3HB MET 1 2.071 -6.200 -6.761 7 HG2 MET 1 2HG MET 1 1.570 -8.614 -6.838 8 HG3 MET 1 3HG MET 1 -0.162 -8.257 -6.914 9 HE1 MET 1 1HE MET 1 2.902 -7.413 -10.291 10 HE2 MET 1 2HE MET 1 2.874 -6.456 -8.802 11 HE3 MET 1 3HE MET 1 3.281 -8.188 -8.732 12 H SER 2 H SER 2 3.341 -5.792 -4.656 13 HA SER 2 HA SER 2 2.508 -3.130 -3.698 14 HB2 SER 2 2HB SER 2 2.613 -4.528 -1.662 15 HB3 SER 2 3HB SER 2 4.281 -4.994 -2.075 16 HG SER 2 HG SER 2 4.123 -3.222 -0.592 17 H GLU 3 H GLU 3 4.371 -1.649 -3.559 18 HA GLU 3 HA GLU 3 6.515 -2.417 -5.476 19 HB2 GLU 3 2HB GLU 3 6.690 -0.032 -5.997 20 HB3 GLU 3 3HB GLU 3 5.051 -0.632 -6.260 21 HG2 GLU 3 2HG GLU 3 4.362 0.297 -4.058 22 HG3 GLU 3 3HG GLU 3 6.011 0.888 -3.796 23 H GLN 4 H GLN 4 6.003 -2.193 -2.232 24 HA GLN 4 HA GLN 4 8.639 -1.007 -1.583 25 HB2 GLN 4 2HB GLN 4 6.415 -2.030 0.207 26 HB3 GLN 4 3HB GLN 4 7.871 -1.185 0.748 27 HG2 GLN 4 2HG GLN 4 5.730 0.008 -1.068 28 HG3 GLN 4 3HG GLN 4 5.927 0.325 0.664 29 HE21 GLN 4 2HE2 GLN 4 8.082 1.242 1.371 30 HE22 GLN 4 1HE2 GLN 4 8.871 2.367 0.290 31 H LEU 5 H LEU 5 9.666 -2.297 0.395 32 HA LEU 5 HA LEU 5 10.006 -5.093 -0.592 33 HB2 LEU 5 2HB LEU 5 12.094 -3.282 0.664 34 HB3 LEU 5 3HB LEU 5 12.362 -4.893 -0.025 35 HG LEU 5 HG LEU 5 11.449 -2.417 -1.552 36 HD11 LEU 5 1HD1 LEU 5 14.092 -3.947 -1.532 37 HD12 LEU 5 2HD1 LEU 5 13.718 -2.548 -2.558 38 HD13 LEU 5 3HD1 LEU 5 13.819 -2.350 -0.788 39 HD21 LEU 5 3HD2 LEU 5 10.601 -4.526 -2.576 40 HD22 LEU 5 1HD2 LEU 5 11.845 -3.765 -3.580 41 HD23 LEU 5 2HD2 LEU 5 12.267 -5.167 -2.580 42 H THR 6 H THR 6 10.550 -6.697 0.909 43 HA THR 6 HA THR 6 9.886 -6.165 3.755 44 HB THR 6 HB THR 6 8.552 -8.286 2.031 45 HG1 THR 6 1HG THR 6 6.733 -6.962 2.262 46 HG21 THR 6 1HG2 THR 6 6.974 -8.360 4.026 47 HG22 THR 6 2HG2 THR 6 8.578 -9.027 4.324 48 HG23 THR 6 3HG2 THR 6 8.175 -7.394 4.919 49 H ASP 7 H ASP 7 10.214 -8.395 4.980 50 HA ASP 7 HA ASP 7 12.929 -9.050 4.814 51 HB2 ASP 7 2HB ASP 7 12.355 -10.875 6.358 52 HB3 ASP 7 3HB ASP 7 11.551 -9.356 6.798 53 H GLN 8 H GLN 8 10.329 -10.247 2.834 54 HA GLN 8 HA GLN 8 11.469 -12.782 2.137 55 HB2 GLN 8 2HB GLN 8 9.136 -12.220 1.660 56 HB3 GLN 8 3HB GLN 8 9.638 -10.864 0.638 57 HG2 GLN 8 2HG GLN 8 8.980 -12.782 -0.738 58 HG3 GLN 8 3HG GLN 8 10.699 -12.429 -0.950 59 HE21 GLN 8 2HE2 GLN 8 12.283 -13.862 0.047 60 HE22 GLN 8 1HE2 GLN 8 11.832 -15.505 0.467 61 H VAL 9 H VAL 9 11.619 -9.554 0.551 62 HA VAL 9 HA VAL 9 13.594 -10.546 -1.372 63 HB VAL 9 HB VAL 9 11.896 -9.127 -2.243 64 HG11 VAL 9 1HG1 VAL 9 12.661 -7.097 -0.120 65 HG12 VAL 9 2HG1 VAL 9 11.499 -6.832 -1.445 66 HG13 VAL 9 3HG1 VAL 9 11.148 -8.032 -0.198 67 HG21 VAL 9 3HG2 VAL 9 14.351 -7.345 -1.945 68 HG22 VAL 9 1HG2 VAL 9 14.225 -8.702 -3.090 69 HG23 VAL 9 2HG2 VAL 9 13.134 -7.300 -3.232 70 H LEU 10 H LEU 10 13.558 -8.727 1.655 71 HA LEU 10 HA LEU 10 16.199 -7.602 1.325 72 HB2 LEU 10 2HB LEU 10 14.176 -7.901 3.506 73 HB3 LEU 10 3HB LEU 10 15.862 -7.728 4.008 74 HG LEU 10 HG LEU 10 16.114 -5.671 2.772 75 HD11 LEU 10 1HD1 LEU 10 13.198 -6.001 1.967 76 HD12 LEU 10 2HD1 LEU 10 14.194 -4.552 1.695 77 HD13 LEU 10 3HD1 LEU 10 14.612 -6.064 0.875 78 HD21 LEU 10 3HD2 LEU 10 14.551 -4.255 4.072 79 HD22 LEU 10 1HD2 LEU 10 13.566 -5.699 4.445 80 HD23 LEU 10 2HD2 LEU 10 15.224 -5.553 5.071 81 H VAL 11 H VAL 11 14.992 -10.794 2.390 82 HA VAL 11 HA VAL 11 17.648 -11.509 3.403 83 HB VAL 11 HB VAL 11 15.102 -13.105 2.997 84 HG11 VAL 11 1HG1 VAL 11 17.832 -13.970 4.042 85 HG12 VAL 11 2HG1 VAL 11 16.329 -14.882 4.285 86 HG13 VAL 11 3HG1 VAL 11 16.964 -14.640 2.642 87 HG21 VAL 11 3HG2 VAL 11 16.689 -12.280 5.474 88 HG22 VAL 11 1HG2 VAL 11 15.221 -11.459 4.906 89 HG23 VAL 11 2HG2 VAL 11 15.137 -13.155 5.445 90 H GLU 12 H GLU 12 15.836 -11.757 0.344 91 HA GLU 12 HA GLU 12 17.710 -13.599 -0.862 92 HB2 GLU 12 2HB GLU 12 15.701 -11.608 -1.980 93 HB3 GLU 12 3HB GLU 12 16.694 -12.654 -3.000 94 HG2 GLU 12 2HG GLU 12 15.784 -14.654 -1.843 95 HG3 GLU 12 3HG GLU 12 14.765 -13.614 -0.845 96 H ARG 13 H ARG 13 17.499 -10.063 -0.539 97 HA ARG 13 HA ARG 13 19.511 -9.518 -2.513 98 HB2 ARG 13 2HB ARG 13 17.745 -7.940 -1.898 99 HB3 ARG 13 3HB ARG 13 18.389 -7.804 -0.251 100 HG2 ARG 13 2HG ARG 13 20.396 -6.767 -1.039 101 HG3 ARG 13 3HG ARG 13 20.039 -7.203 -2.735 102 HD2 ARG 13 2HD ARG 13 18.002 -5.737 -2.611 103 HD3 ARG 13 3HD ARG 13 18.538 -5.197 -1.007 104 HE ARG 13 HE ARG 13 20.698 -4.866 -2.815 105 HH11 ARG 13 1HH1 ARG 13 17.483 -3.521 -2.230 106 HH12 ARG 13 2HH1 ARG 13 17.868 -1.990 -2.976 107 HH21 ARG 13 1HH2 ARG 13 21.161 -2.911 -3.805 108 HH22 ARG 13 2HH2 ARG 13 19.972 -1.625 -3.846 109 H VAL 14 H VAL 14 19.636 -9.993 1.040 110 HA VAL 14 HA VAL 14 22.424 -9.219 1.212 111 HB VAL 14 HB VAL 14 22.335 -10.192 3.456 112 HG11 VAL 14 1HG1 VAL 14 21.533 -7.939 3.184 113 HG12 VAL 14 2HG1 VAL 14 19.939 -8.509 2.628 114 HG13 VAL 14 3HG1 VAL 14 20.439 -8.785 4.310 115 HG21 VAL 14 3HG2 VAL 14 19.542 -11.074 2.653 116 HG22 VAL 14 1HG2 VAL 14 20.906 -12.149 3.064 117 HG23 VAL 14 2HG2 VAL 14 20.188 -11.096 4.307 118 H GLN 15 H GLN 15 20.725 -12.194 0.353 119 HA GLN 15 HA GLN 15 23.107 -13.860 0.588 120 HB2 GLN 15 2HB GLN 15 20.385 -14.247 -0.706 121 HB3 GLN 15 3HB GLN 15 21.649 -15.491 -0.670 122 HG2 GLN 15 2HG GLN 15 21.665 -15.501 1.778 123 HG3 GLN 15 3HG GLN 15 20.512 -14.185 1.838 124 HE21 GLN 15 2HE2 GLN 15 19.889 -16.497 3.189 125 HE22 GLN 15 1HE2 GLN 15 18.598 -17.342 2.369 126 H LYS 16 H LYS 16 21.906 -11.556 -1.682 127 HA LYS 16 HA LYS 16 23.460 -12.672 -3.917 128 HB2 LYS 16 2HB LYS 16 21.515 -10.367 -3.648 129 HB3 LYS 16 3HB LYS 16 22.442 -10.670 -5.125 130 HG2 LYS 16 2HG LYS 16 21.496 -12.879 -5.383 131 HG3 LYS 16 3HG LYS 16 20.759 -12.818 -3.771 132 HD2 LYS 16 2HD LYS 16 19.373 -10.872 -4.525 133 HD3 LYS 16 3HD LYS 16 20.008 -11.097 -6.169 134 HE2 LYS 16 2HE LYS 16 18.537 -13.206 -4.520 135 HE3 LYS 16 3HE LYS 16 17.784 -12.208 -5.780 136 HZ1 LYS 16 3HZ LYS 16 19.989 -14.115 -6.199 137 HZ2 LYS 16 1HZ LYS 16 18.426 -14.355 -6.625 138 HZ3 LYS 16 2HZ LYS 16 19.300 -13.176 -7.364 139 H GLY 17 H GLY 17 24.277 -10.944 -1.223 140 HA2 GLY 17 2HA GLY 17 26.615 -10.455 -0.999 141 HA3 GLY 17 3HA GLY 17 26.648 -9.877 -2.671 142 H ASP 18 H ASP 18 23.816 -8.624 -1.380 143 HA ASP 18 HA ASP 18 25.145 -6.033 -0.830 144 HB2 ASP 18 2HB ASP 18 22.365 -6.955 -1.546 145 HB3 ASP 18 3HB ASP 18 22.588 -5.392 -0.764 146 H GLN 19 H GLN 19 26.062 -6.635 1.218 147 HA GLN 19 HA GLN 19 24.476 -7.597 3.393 148 HB2 GLN 19 2HB GLN 19 26.916 -7.799 3.178 149 HB3 GLN 19 3HB GLN 19 27.109 -6.054 3.358 150 HG2 GLN 19 2HG GLN 19 25.677 -7.728 5.453 151 HG3 GLN 19 3HG GLN 19 27.436 -7.643 5.418 152 HE21 GLN 19 2HE2 GLN 19 26.135 -6.797 7.683 153 HE22 GLN 19 1HE2 GLN 19 26.255 -5.051 7.812 154 H LYS 20 H LYS 20 24.813 -4.468 1.914 155 HA LYS 20 HA LYS 20 24.108 -2.773 4.088 156 HB2 LYS 20 2HB LYS 20 23.517 -1.188 2.309 157 HB3 LYS 20 3HB LYS 20 25.040 -2.012 1.948 158 HG2 LYS 20 2HG LYS 20 23.741 -3.627 0.487 159 HG3 LYS 20 3HG LYS 20 22.305 -2.612 0.740 160 HD2 LYS 20 2HD LYS 20 23.522 -0.680 -0.235 161 HD3 LYS 20 3HD LYS 20 24.959 -1.716 -0.455 162 HE2 LYS 20 2HE LYS 20 23.619 -3.214 -1.916 163 HE3 LYS 20 3HE LYS 20 22.223 -2.139 -1.722 164 HZ1 LYS 20 3HZ LYS 20 24.814 -1.358 -2.895 165 HZ2 LYS 20 1HZ LYS 20 23.452 -1.690 -3.745 166 HZ3 LYS 20 2HZ LYS 20 23.496 -0.389 -2.742 167 H ALA 21 H ALA 21 22.196 -5.047 2.191 168 HA ALA 21 HA ALA 21 19.663 -3.804 2.951 169 HB1 ALA 21 1HB ALA 21 20.288 -6.486 1.656 170 HB2 ALA 21 2HB ALA 21 18.671 -5.765 1.847 171 HB3 ALA 21 3HB ALA 21 19.887 -4.977 0.808 172 H PHE 22 H PHE 22 21.934 -6.054 4.384 173 HA PHE 22 HA PHE 22 19.956 -7.303 6.128 174 HB2 PHE 22 2HB PHE 22 22.092 -8.419 5.529 175 HB3 PHE 22 3HB PHE 22 22.974 -7.154 6.388 176 HD1 PHE 22 HD2 PHE 22 20.175 -9.615 6.910 177 HD2 PHE 22 HD1 PHE 22 23.497 -7.506 8.651 178 HE1 PHE 22 HE2 PHE 22 19.849 -10.856 9.027 179 HE2 PHE 22 HE1 PHE 22 23.151 -8.735 10.781 180 HZ PHE 22 HZ PHE 22 21.330 -10.402 10.969 181 H ASN 23 H ASN 23 22.220 -4.543 6.236 182 HA ASN 23 HA ASN 23 21.911 -3.886 8.990 183 HB2 ASN 23 2HB ASN 23 23.675 -2.902 7.701 184 HB3 ASN 23 3HB ASN 23 22.547 -2.339 6.461 185 HD21 ASN 23 2HD2 ASN 23 21.522 -0.391 6.663 186 HD22 ASN 23 1HD2 ASN 23 21.758 0.696 8.017 187 H LEU 24 H LEU 24 20.059 -2.980 6.069 188 HA LEU 24 HA LEU 24 18.213 -1.306 7.544 189 HB2 LEU 24 2HB LEU 24 18.072 -2.480 4.740 190 HB3 LEU 24 3HB LEU 24 16.992 -1.237 5.406 191 HG LEU 24 HG LEU 24 20.009 -0.904 5.154 192 HD11 LEU 24 1HD1 LEU 24 17.767 0.115 3.371 193 HD12 LEU 24 2HD1 LEU 24 19.495 0.525 3.227 194 HD13 LEU 24 3HD1 LEU 24 18.960 -1.146 2.955 195 HD21 LEU 24 3HD2 LEU 24 19.460 1.500 5.474 196 HD22 LEU 24 1HD2 LEU 24 17.750 1.072 5.709 197 HD23 LEU 24 2HD2 LEU 24 18.977 0.534 6.880 198 H LEU 25 H LEU 25 18.469 -4.725 6.951 199 HA LEU 25 HA LEU 25 15.618 -5.246 7.381 200 HB2 LEU 25 2HB LEU 25 16.959 -6.700 5.929 201 HB3 LEU 25 3HB LEU 25 18.087 -7.027 7.250 202 HG LEU 25 HG LEU 25 16.270 -8.154 8.519 203 HD11 LEU 25 1HD1 LEU 25 14.311 -6.996 7.541 204 HD12 LEU 25 2HD1 LEU 25 14.676 -7.725 5.957 205 HD13 LEU 25 3HD1 LEU 25 14.190 -8.756 7.323 206 HD21 LEU 25 3HD2 LEU 25 16.732 -9.137 5.672 207 HD22 LEU 25 1HD2 LEU 25 17.799 -9.422 7.062 208 HD23 LEU 25 2HD2 LEU 25 16.169 -10.135 7.040 209 H VAL 26 H VAL 26 18.654 -5.414 9.359 210 HA VAL 26 HA VAL 26 17.189 -6.629 11.525 211 HB VAL 26 HB VAL 26 19.127 -6.330 12.878 212 HG11 VAL 26 1HG1 VAL 26 20.799 -7.506 11.542 213 HG12 VAL 26 2HG1 VAL 26 19.168 -8.148 11.235 214 HG13 VAL 26 3HG1 VAL 26 19.945 -7.078 10.048 215 HG21 VAL 26 3HG2 VAL 26 19.754 -4.054 12.314 216 HG22 VAL 26 1HG2 VAL 26 21.134 -5.154 12.113 217 HG23 VAL 26 2HG2 VAL 26 20.247 -4.574 10.677 218 H VAL 27 H VAL 27 17.610 -3.235 10.552 219 HA VAL 27 HA VAL 27 17.051 -2.186 13.173 220 HB VAL 27 HB VAL 27 16.416 -0.099 11.966 221 HG11 VAL 27 1HG1 VAL 27 18.751 -0.522 12.575 222 HG12 VAL 27 2HG1 VAL 27 18.992 -1.439 11.065 223 HG13 VAL 27 3HG1 VAL 27 18.660 0.302 10.997 224 HG21 VAL 27 3HG2 VAL 27 16.739 0.049 9.558 225 HG22 VAL 27 1HG2 VAL 27 17.129 -1.685 9.481 226 HG23 VAL 27 2HG2 VAL 27 15.479 -1.158 9.903 227 H ARG 28 H ARG 28 14.998 -3.546 10.634 228 HA ARG 28 HA ARG 28 12.519 -2.463 11.644 229 HB2 ARG 28 2HB ARG 28 12.911 -5.099 10.179 230 HB3 ARG 28 3HB ARG 28 11.473 -4.061 10.203 231 HG2 ARG 28 2HG ARG 28 12.837 -2.293 8.993 232 HG3 ARG 28 3HG ARG 28 14.173 -3.453 8.922 233 HD2 ARG 28 2HD ARG 28 13.042 -3.575 6.822 234 HD3 ARG 28 3HD ARG 28 12.687 -5.063 7.712 235 HE ARG 28 HE ARG 28 10.548 -3.566 8.381 236 HH11 ARG 28 1HH1 ARG 28 12.070 -4.082 5.228 237 HH12 ARG 28 2HH1 ARG 28 10.573 -3.871 4.346 238 HH21 ARG 28 1HH2 ARG 28 8.618 -3.301 7.198 239 HH22 ARG 28 2HH2 ARG 28 8.635 -3.439 5.456 240 H TYR 29 H TYR 29 14.571 -5.221 12.386 241 HA TYR 29 HA TYR 29 12.582 -6.258 14.318 242 HB2 TYR 29 2HB TYR 29 15.143 -7.423 13.179 243 HB3 TYR 29 3HB TYR 29 14.181 -8.190 14.420 244 HD1 TYR 29 HD1 TYR 29 13.941 -6.909 10.912 245 HD2 TYR 29 HD2 TYR 29 12.308 -9.484 13.938 246 HE1 TYR 29 HE1 TYR 29 12.373 -7.851 9.240 247 HE2 TYR 29 HE2 TYR 29 10.744 -10.447 12.282 248 HH TYR 29 HH TYR 29 10.654 -9.345 8.867 249 H GLN 30 H GLN 30 15.219 -4.109 14.352 250 HA GLN 30 HA GLN 30 16.615 -4.987 16.661 251 HB2 GLN 30 2HB GLN 30 17.371 -3.366 14.939 252 HB3 GLN 30 3HB GLN 30 16.238 -2.166 15.577 253 HG2 GLN 30 2HG GLN 30 17.451 -2.159 17.716 254 HG3 GLN 30 3HG GLN 30 18.519 -3.460 17.130 255 HE21 GLN 30 2HE2 GLN 30 19.474 -2.932 14.825 256 HE22 GLN 30 1HE2 GLN 30 20.136 -1.322 14.637 257 H HIS 31 H HIS 31 13.611 -3.139 16.268 258 HA HIS 31 HA HIS 31 13.463 -2.567 19.155 259 HB2 HIS 31 2HB HIS 31 12.659 -0.944 17.488 260 HB3 HIS 31 3HB HIS 31 11.487 -2.128 16.888 261 HD2 HIS 31 HD2 HIS 31 9.177 -2.206 18.064 262 HE1 HIS 31 HE1 HIS 31 10.033 0.215 21.453 263 HE2 HIS 31 HE2 HIS 31 8.196 -1.016 20.184 264 H LYS 32 H LYS 32 12.194 -4.954 16.839 265 HA LYS 32 HA LYS 32 10.114 -5.867 18.681 266 HB2 LYS 32 2HB LYS 32 11.185 -7.054 16.093 267 HB3 LYS 32 3HB LYS 32 9.703 -7.549 16.941 268 HG2 LYS 32 2HG LYS 32 8.753 -5.288 16.623 269 HG3 LYS 32 3HG LYS 32 10.225 -4.781 15.769 270 HD2 LYS 32 2HD LYS 32 9.846 -6.552 14.066 271 HD3 LYS 32 3HD LYS 32 8.355 -7.031 14.907 272 HE2 LYS 32 2HE LYS 32 7.442 -4.754 14.580 273 HE3 LYS 32 3HE LYS 32 8.924 -4.283 13.723 274 HZ1 LYS 32 3HZ LYS 32 7.188 -4.895 12.201 275 HZ2 LYS 32 1HZ LYS 32 8.434 -5.954 12.080 276 HZ3 LYS 32 2HZ LYS 32 7.056 -6.391 12.870 277 H VAL 33 H VAL 33 13.378 -6.924 17.717 278 HA VAL 33 HA VAL 33 13.271 -9.470 19.056 279 HB VAL 33 HB VAL 33 15.604 -7.693 18.171 280 HG11 VAL 33 1HG1 VAL 33 15.432 -10.650 18.727 281 HG12 VAL 33 2HG1 VAL 33 16.868 -9.775 18.123 282 HG13 VAL 33 3HG1 VAL 33 16.272 -9.481 19.797 283 HG21 VAL 33 3HG2 VAL 33 15.752 -9.082 16.249 284 HG22 VAL 33 1HG2 VAL 33 14.526 -10.211 16.858 285 HG23 VAL 33 2HG2 VAL 33 14.021 -8.578 16.352 286 H ALA 34 H ALA 34 14.366 -6.165 19.874 287 HA ALA 34 HA ALA 34 15.550 -6.821 22.369 288 HB1 ALA 34 1HB ALA 34 14.216 -4.246 21.431 289 HB2 ALA 34 2HB ALA 34 15.334 -4.397 22.809 290 HB3 ALA 34 3HB ALA 34 15.911 -4.695 21.154 291 H SER 35 H SER 35 12.174 -6.493 21.381 292 HA SER 35 HA SER 35 11.140 -5.951 24.020 293 HB2 SER 35 2HB SER 35 9.978 -5.386 21.882 294 HB3 SER 35 3HB SER 35 9.761 -7.126 21.579 295 HG SER 35 HG SER 35 7.950 -6.138 22.609 296 H LEU 36 H LEU 36 11.459 -8.929 21.994 297 HA LEU 36 HA LEU 36 10.268 -10.512 24.134 298 HB2 LEU 36 2HB LEU 36 10.400 -12.362 22.652 299 HB3 LEU 36 3HB LEU 36 9.881 -10.954 21.726 300 HG LEU 36 HG LEU 36 12.458 -10.745 21.135 301 HD11 LEU 36 1HD1 LEU 36 12.161 -13.717 21.792 302 HD12 LEU 36 2HD1 LEU 36 13.518 -12.984 20.913 303 HD13 LEU 36 3HD1 LEU 36 13.265 -12.599 22.620 304 HD21 LEU 36 3HD2 LEU 36 10.645 -12.917 20.016 305 HD22 LEU 36 1HD2 LEU 36 10.659 -11.203 19.529 306 HD23 LEU 36 2HD2 LEU 36 12.074 -12.234 19.206 307 H VAL 37 H VAL 37 13.551 -9.675 23.089 308 HA VAL 37 HA VAL 37 14.664 -11.862 24.661 309 HB VAL 37 HB VAL 37 15.559 -10.929 22.460 310 HG11 VAL 37 1HG1 VAL 37 17.027 -9.094 22.489 311 HG12 VAL 37 2HG1 VAL 37 15.606 -8.522 23.406 312 HG13 VAL 37 3HG1 VAL 37 17.087 -9.044 24.258 313 HG21 VAL 37 3HG2 VAL 37 16.715 -12.603 23.865 314 HG22 VAL 37 1HG2 VAL 37 17.846 -11.490 23.065 315 HG23 VAL 37 2HG2 VAL 37 17.477 -11.283 24.794 316 H SER 38 H SER 38 13.644 -8.616 25.313 317 HA SER 38 HA SER 38 15.326 -8.139 27.605 318 HB2 SER 38 2HB SER 38 14.029 -6.369 26.441 319 HB3 SER 38 3HB SER 38 12.522 -7.135 26.972 320 HG SER 38 HG SER 38 13.203 -5.430 28.349 321 H ARG 39 H ARG 39 12.849 -10.407 26.952 322 HA ARG 39 HA ARG 39 11.990 -10.724 29.735 323 HB2 ARG 39 2HB ARG 39 11.434 -12.458 27.308 324 HB3 ARG 39 3HB ARG 39 10.563 -12.475 28.849 325 HG2 ARG 39 2HG ARG 39 9.811 -10.142 28.457 326 HG3 ARG 39 3HG ARG 39 10.691 -10.112 26.915 327 HD2 ARG 39 2HD ARG 39 9.330 -12.056 26.138 328 HD3 ARG 39 3HD ARG 39 8.378 -11.942 27.634 329 HE ARG 39 HE ARG 39 8.415 -9.383 26.396 330 HH11 ARG 39 1HH1 ARG 39 7.110 -12.617 25.825 331 HH12 ARG 39 2HH1 ARG 39 5.746 -12.024 24.903 332 HH21 ARG 39 1HH2 ARG 39 6.651 -8.648 25.181 333 HH22 ARG 39 2HH2 ARG 39 5.499 -9.785 24.519 334 H TYR 40 H TYR 40 14.769 -11.573 28.046 335 HA TYR 40 HA TYR 40 15.169 -13.987 29.751 336 HB2 TYR 40 2HB TYR 40 16.140 -13.469 26.923 337 HB3 TYR 40 3HB TYR 40 16.619 -14.843 27.931 338 HD1 TYR 40 HD1 TYR 40 14.958 -16.570 28.581 339 HD2 TYR 40 HD2 TYR 40 14.013 -13.435 25.792 340 HE1 TYR 40 HE1 TYR 40 12.971 -17.848 27.823 341 HE2 TYR 40 HE2 TYR 40 12.045 -14.722 25.008 342 HH TYR 40 HH TYR 40 11.172 -17.902 26.412 343 H VAL 41 H VAL 41 16.338 -10.853 28.847 344 HA VAL 41 HA VAL 41 18.537 -11.184 30.791 345 HB VAL 41 HB VAL 41 19.996 -9.745 29.261 346 HG11 VAL 41 1HG1 VAL 41 20.456 -12.127 29.716 347 HG12 VAL 41 2HG1 VAL 41 19.399 -12.588 28.362 348 HG13 VAL 41 3HG1 VAL 41 20.898 -11.673 28.061 349 HG21 VAL 41 3HG2 VAL 41 18.171 -10.842 27.095 350 HG22 VAL 41 1HG2 VAL 41 18.201 -9.143 27.636 351 HG23 VAL 41 2HG2 VAL 41 19.633 -9.861 26.877 352 HA PRO 42 HA PRO 42 17.018 -7.325 32.220 353 HB2 PRO 42 2HB PRO 42 19.227 -6.104 33.257 354 HB3 PRO 42 3HB PRO 42 18.501 -7.575 33.989 355 HG2 PRO 42 2HG PRO 42 20.816 -7.428 32.036 356 HG3 PRO 42 3HG PRO 42 20.766 -8.286 33.614 357 HD2 PRO 42 2HD PRO 42 20.286 -9.608 31.315 358 HD3 PRO 42 3HD PRO 42 19.271 -9.931 32.756 359 H SER 43 H SER 43 17.208 -4.927 31.953 360 HA SER 43 HA SER 43 17.385 -4.330 29.179 361 HB2 SER 43 2HB SER 43 16.838 -2.036 29.905 362 HB3 SER 43 3HB SER 43 15.806 -3.250 30.690 363 HG SER 43 HG SER 43 16.645 -1.692 32.164 364 H GLY 44 H GLY 44 19.901 -4.478 31.509 365 HA2 GLY 44 2HA GLY 44 21.550 -2.400 30.237 366 HA3 GLY 44 3HA GLY 44 21.992 -3.458 31.589 367 H ASP 45 H ASP 45 20.920 -5.823 29.840 368 HA ASP 45 HA ASP 45 23.382 -6.093 28.168 369 HB2 ASP 45 2HB ASP 45 21.807 -8.178 29.713 370 HB3 ASP 45 3HB ASP 45 23.168 -8.516 28.636 371 H VAL 46 H VAL 46 20.051 -5.655 27.993 372 HA VAL 46 HA VAL 46 19.388 -7.651 26.072 373 HB VAL 46 HB VAL 46 17.805 -6.426 27.585 374 HG11 VAL 46 1HG1 VAL 46 17.984 -4.246 25.465 375 HG12 VAL 46 2HG1 VAL 46 16.789 -4.359 26.779 376 HG13 VAL 46 3HG1 VAL 46 18.498 -4.099 27.172 377 HG21 VAL 46 3HG2 VAL 46 15.988 -6.366 25.894 378 HG22 VAL 46 1HG2 VAL 46 17.201 -6.550 24.614 379 HG23 VAL 46 2HG2 VAL 46 16.988 -7.835 25.846 380 HA PRO 47 HA PRO 47 20.069 -4.393 22.718 381 HB2 PRO 47 2HB PRO 47 21.963 -2.473 22.919 382 HB3 PRO 47 3HB PRO 47 20.352 -2.281 23.694 383 HG2 PRO 47 2HG PRO 47 22.923 -3.252 24.975 384 HG3 PRO 47 3HG PRO 47 21.826 -1.958 25.563 385 HD2 PRO 47 2HD PRO 47 21.704 -4.531 26.459 386 HD3 PRO 47 3HD PRO 47 20.225 -3.532 26.284 387 H ASP 48 H ASP 48 22.732 -5.703 24.625 388 HA ASP 48 HA ASP 48 24.548 -5.860 22.346 389 HB2 ASP 48 2HB ASP 48 25.285 -5.515 24.720 390 HB3 ASP 48 3HB ASP 48 24.708 -7.151 25.092 391 H VAL 49 H VAL 49 22.165 -7.916 23.960 392 HA VAL 49 HA VAL 49 23.041 -10.340 22.605 393 HB VAL 49 HB VAL 49 20.555 -9.629 24.210 394 HG11 VAL 49 1HG1 VAL 49 21.497 -12.324 23.140 395 HG12 VAL 49 2HG1 VAL 49 20.161 -12.070 24.285 396 HG13 VAL 49 3HG1 VAL 49 20.030 -11.452 22.627 397 HG21 VAL 49 3HG2 VAL 49 23.013 -11.327 24.831 398 HG22 VAL 49 1HG2 VAL 49 22.695 -9.706 25.478 399 HG23 VAL 49 2HG2 VAL 49 21.628 -11.055 25.917 400 H VAL 50 H VAL 50 20.741 -7.693 21.936 401 HA VAL 50 HA VAL 50 19.494 -8.993 19.668 402 HB VAL 50 HB VAL 50 19.879 -6.088 20.471 403 HG11 VAL 50 1HG1 VAL 50 18.247 -7.266 18.172 404 HG12 VAL 50 2HG1 VAL 50 18.166 -5.584 18.737 405 HG13 VAL 50 3HG1 VAL 50 19.666 -6.192 18.021 406 HG21 VAL 50 3HG2 VAL 50 17.429 -7.893 20.373 407 HG22 VAL 50 1HG2 VAL 50 18.353 -7.534 21.850 408 HG23 VAL 50 2HG2 VAL 50 17.496 -6.226 20.992 409 H GLN 51 H GLN 51 22.472 -7.049 20.169 410 HA GLN 51 HA GLN 51 23.035 -6.844 17.347 411 HB2 GLN 51 2HB GLN 51 23.931 -5.284 19.057 412 HB3 GLN 51 3HB GLN 51 24.901 -6.606 19.742 413 HG2 GLN 51 2HG GLN 51 26.107 -6.864 17.626 414 HG3 GLN 51 3HG GLN 51 25.098 -5.627 16.865 415 HE21 GLN 51 2HE2 GLN 51 27.587 -4.998 16.551 416 HE22 GLN 51 1HE2 GLN 51 28.180 -3.835 17.719 417 H GLU 52 H GLU 52 24.115 -9.101 19.971 418 HA GLU 52 HA GLU 52 25.879 -10.542 18.220 419 HB2 GLU 52 2HB GLU 52 26.059 -10.543 20.684 420 HB3 GLU 52 3HB GLU 52 24.527 -11.442 20.803 421 HG2 GLU 52 2HG GLU 52 25.476 -13.355 19.685 422 HG3 GLU 52 3HG GLU 52 26.916 -12.444 19.213 423 H ALA 53 H ALA 53 22.395 -10.689 18.855 424 HA ALA 53 HA ALA 53 22.025 -13.263 17.606 425 HB1 ALA 53 1HB ALA 53 20.395 -12.334 19.175 426 HB2 ALA 53 2HB ALA 53 20.081 -10.969 18.074 427 HB3 ALA 53 3HB ALA 53 19.647 -12.623 17.584 428 H PHE 54 H PHE 54 21.987 -9.845 16.431 429 HA PHE 54 HA PHE 54 21.224 -10.608 13.750 430 HB2 PHE 54 2HB PHE 54 22.600 -8.131 14.849 431 HB3 PHE 54 3HB PHE 54 22.025 -8.306 13.195 432 HD1 PHE 54 HD1 PHE 54 19.406 -9.870 14.002 433 HD2 PHE 54 HD2 PHE 54 21.221 -6.202 15.348 434 HE1 PHE 54 HE1 PHE 54 17.190 -9.000 14.637 435 HE2 PHE 54 HE2 PHE 54 18.982 -5.324 15.936 436 HZ PHE 54 HZ PHE 54 16.970 -6.729 15.598 437 H ILE 55 H ILE 55 24.388 -10.235 15.413 438 HA ILE 55 HA ILE 55 25.913 -10.444 12.972 439 HB ILE 55 HB ILE 55 26.603 -10.992 15.882 440 HG12 ILE 55 2HG1 ILE 55 27.331 -8.635 14.078 441 HG13 ILE 55 3HG1 ILE 55 25.991 -8.621 15.219 442 HG21 ILE 55 1HG2 ILE 55 28.452 -10.779 13.468 443 HG22 ILE 55 2HG2 ILE 55 28.974 -10.925 15.164 444 HG23 ILE 55 3HG2 ILE 55 28.114 -12.257 14.394 445 HD11 ILE 55 3HD1 ILE 55 27.585 -9.064 17.087 446 HD12 ILE 55 1HD1 ILE 55 28.935 -8.962 15.926 447 HD13 ILE 55 2HD1 ILE 55 27.924 -7.542 16.225 448 H LYS 56 H LYS 56 24.699 -12.778 15.400 449 HA LYS 56 HA LYS 56 25.951 -15.051 14.110 450 HB2 LYS 56 2HB LYS 56 25.475 -14.856 16.545 451 HB3 LYS 56 3HB LYS 56 23.734 -14.894 16.195 452 HG2 LYS 56 2HG LYS 56 23.914 -17.131 15.275 453 HG3 LYS 56 3HG LYS 56 25.694 -17.055 15.327 454 HD2 LYS 56 2HD LYS 56 24.955 -18.388 17.194 455 HD3 LYS 56 3HD LYS 56 25.573 -16.842 17.816 456 HE2 LYS 56 2HE LYS 56 23.287 -15.971 18.008 457 HE3 LYS 56 3HE LYS 56 22.638 -17.476 17.337 458 HZ1 LYS 56 3HZ LYS 56 23.505 -18.648 19.222 459 HZ2 LYS 56 1HZ LYS 56 24.189 -17.281 19.830 460 HZ3 LYS 56 2HZ LYS 56 22.555 -17.403 19.737 461 H ALA 57 H ALA 57 22.829 -13.377 13.848 462 HA ALA 57 HA ALA 57 21.491 -15.520 12.478 463 HB1 ALA 57 1HB ALA 57 20.999 -12.517 12.498 464 HB2 ALA 57 2HB ALA 57 19.902 -13.726 11.802 465 HB3 ALA 57 3HB ALA 57 20.225 -13.735 13.549 466 H TYR 58 H TYR 58 23.481 -12.699 11.369 467 HA TYR 58 HA TYR 58 22.854 -13.003 8.618 468 HB2 TYR 58 2HB TYR 58 23.955 -11.045 9.684 469 HB3 TYR 58 3HB TYR 58 25.410 -12.016 9.936 470 HD1 TYR 58 HD1 TYR 58 23.041 -11.067 7.158 471 HD2 TYR 58 HD2 TYR 58 27.097 -11.871 8.340 472 HE1 TYR 58 HE1 TYR 58 23.822 -10.404 4.903 473 HE2 TYR 58 HE2 TYR 58 27.892 -11.249 6.076 474 HH TYR 58 HH TYR 58 25.626 -10.198 3.493 475 H ARG 59 H ARG 59 25.338 -14.513 10.674 476 HA ARG 59 HA ARG 59 26.738 -15.839 8.529 477 HB2 ARG 59 2HB ARG 59 26.572 -16.337 11.528 478 HB3 ARG 59 3HB ARG 59 27.751 -17.107 10.444 479 HG2 ARG 59 2HG ARG 59 28.784 -14.997 9.920 480 HG3 ARG 59 3HG ARG 59 27.477 -14.078 10.700 481 HD2 ARG 59 2HD ARG 59 28.066 -14.947 12.878 482 HD3 ARG 59 3HD ARG 59 29.266 -16.037 12.160 483 HE ARG 59 HE ARG 59 29.944 -13.412 11.368 484 HH11 ARG 59 1HH1 ARG 59 29.711 -15.263 14.366 485 HH12 ARG 59 2HH1 ARG 59 30.946 -14.321 15.179 486 HH21 ARG 59 1HH2 ARG 59 31.558 -12.212 12.449 487 HH22 ARG 59 2HH2 ARG 59 31.983 -12.607 14.101 488 H ALA 60 H ALA 60 23.869 -16.548 10.398 489 HA ALA 60 HA ALA 60 23.774 -19.326 9.385 490 HB1 ALA 60 1HB ALA 60 21.955 -17.795 11.290 491 HB2 ALA 60 2HB ALA 60 21.856 -19.532 10.906 492 HB3 ALA 60 3HB ALA 60 23.275 -18.887 11.761 493 H LEU 61 H LEU 61 22.779 -16.199 8.411 494 HA LEU 61 HA LEU 61 20.199 -16.886 7.337 495 HB2 LEU 61 2HB LEU 61 21.021 -14.582 8.076 496 HB3 LEU 61 3HB LEU 61 22.037 -14.562 6.623 497 HG LEU 61 HG LEU 61 19.944 -14.837 5.248 498 HD11 LEU 61 1HD1 LEU 61 18.647 -14.446 7.977 499 HD12 LEU 61 2HD1 LEU 61 17.787 -14.301 6.420 500 HD13 LEU 61 3HD1 LEU 61 18.458 -15.865 6.924 501 HD21 LEU 61 3HD2 LEU 61 19.187 -12.517 5.617 502 HD22 LEU 61 1HD2 LEU 61 20.019 -12.490 7.192 503 HD23 LEU 61 2HD2 LEU 61 20.966 -12.639 5.686 504 H ASP 62 H ASP 62 23.524 -17.042 6.233 505 HA ASP 62 HA ASP 62 23.002 -17.375 3.433 506 HB2 ASP 62 2HB ASP 62 25.207 -16.855 4.464 507 HB3 ASP 62 3HB ASP 62 25.235 -18.472 5.185 508 H SER 63 H SER 63 22.192 -19.325 6.128 509 HA SER 63 HA SER 63 21.970 -21.760 4.437 510 HB2 SER 63 2HB SER 63 22.050 -21.456 7.461 511 HB3 SER 63 3HB SER 63 21.886 -22.980 6.564 512 HG SER 63 HG SER 63 24.062 -21.159 6.405 513 H PHE 64 H PHE 64 20.124 -19.164 5.264 514 HA PHE 64 HA PHE 64 17.694 -20.512 6.091 515 HB2 PHE 64 2HB PHE 64 18.165 -18.150 6.596 516 HB3 PHE 64 3HB PHE 64 18.176 -17.771 4.870 517 HD1 PHE 64 HD1 PHE 64 15.966 -19.246 7.521 518 HD2 PHE 64 HD2 PHE 64 16.206 -17.054 3.835 519 HE1 PHE 64 HE1 PHE 64 13.523 -18.853 7.601 520 HE2 PHE 64 HE2 PHE 64 13.770 -16.636 3.919 521 HZ PHE 64 HZ PHE 64 12.416 -17.540 5.798 522 H ARG 65 H ARG 65 15.875 -21.023 4.798 523 HA ARG 65 HA ARG 65 16.366 -21.096 1.861 524 HB2 ARG 65 2HB ARG 65 15.606 -23.441 3.636 525 HB3 ARG 65 3HB ARG 65 15.578 -23.462 1.859 526 HG2 ARG 65 2HG ARG 65 17.982 -22.969 1.779 527 HG3 ARG 65 3HG ARG 65 18.043 -22.884 3.552 528 HD2 ARG 65 2HD ARG 65 17.333 -25.229 3.710 529 HD3 ARG 65 3HD ARG 65 17.252 -25.335 1.941 530 HE ARG 65 HE ARG 65 19.840 -24.435 2.559 531 HH11 ARG 65 1HH1 ARG 65 17.872 -27.305 3.215 532 HH12 ARG 65 2HH1 ARG 65 19.257 -28.368 3.303 533 HH21 ARG 65 1HH2 ARG 65 21.624 -25.851 2.697 534 HH22 ARG 65 2HH2 ARG 65 21.366 -27.550 3.013 535 H GLY 66 H GLY 66 14.310 -20.031 4.217 536 HA2 GLY 66 2HA GLY 66 12.236 -19.064 3.959 537 HA3 GLY 66 3HA GLY 66 12.236 -19.565 2.264 538 H ASP 67 H ASP 67 12.767 -22.197 4.479 539 HA ASP 67 HA ASP 67 10.205 -23.363 3.834 540 HB2 ASP 67 2HB ASP 67 12.384 -24.171 5.790 541 HB3 ASP 67 3HB ASP 67 10.957 -25.148 5.423 542 H SER 68 H SER 68 11.078 -20.980 6.029 543 HA SER 68 HA SER 68 8.495 -21.202 7.413 544 HB2 SER 68 2HB SER 68 9.549 -20.863 9.627 545 HB3 SER 68 3HB SER 68 10.032 -22.408 8.904 546 HG SER 68 HG SER 68 11.810 -21.249 9.760 547 H ALA 69 H ALA 69 8.146 -19.086 8.723 548 HA ALA 69 HA ALA 69 8.757 -16.874 6.990 549 HB1 ALA 69 1HB ALA 69 6.672 -17.041 8.289 550 HB2 ALA 69 2HB ALA 69 7.600 -16.906 9.802 551 HB3 ALA 69 3HB ALA 69 7.557 -15.544 8.660 552 H PHE 70 H PHE 70 10.107 -15.048 7.375 553 HA PHE 70 HA PHE 70 12.633 -15.747 8.519 554 HB2 PHE 70 2HB PHE 70 12.475 -14.202 6.655 555 HB3 PHE 70 3HB PHE 70 11.474 -13.101 7.613 556 HD1 PHE 70 HD2 PHE 70 14.828 -14.798 7.793 557 HD2 PHE 70 HD1 PHE 70 12.496 -11.286 8.634 558 HE1 PHE 70 HE2 PHE 70 16.848 -13.664 8.676 559 HE2 PHE 70 HE1 PHE 70 14.522 -10.139 9.483 560 HZ PHE 70 HZ PHE 70 16.707 -11.329 9.502 561 H TYR 71 H TYR 71 9.824 -13.923 9.812 562 HA TYR 71 HA TYR 71 11.365 -12.783 11.954 563 HB2 TYR 71 2HB TYR 71 9.237 -12.106 12.883 564 HB3 TYR 71 3HB TYR 71 9.284 -11.794 11.147 565 HD1 TYR 71 HD1 TYR 71 7.883 -13.985 13.789 566 HD2 TYR 71 HD2 TYR 71 7.716 -12.807 9.661 567 HE1 TYR 71 HE1 TYR 71 5.730 -15.198 13.540 568 HE2 TYR 71 HE2 TYR 71 5.560 -14.017 9.394 569 HH TYR 71 HH TYR 71 4.024 -15.775 12.112 570 H THR 72 H THR 72 9.466 -15.816 11.610 571 HA THR 72 HA THR 72 9.712 -16.517 14.404 572 HB THR 72 HB THR 72 9.263 -18.307 11.976 573 HG1 THR 72 1HG THR 72 7.073 -17.977 12.487 574 HG21 THR 72 1HG2 THR 72 8.578 -18.642 14.930 575 HG22 THR 72 2HG2 THR 72 8.090 -19.749 13.626 576 HG23 THR 72 3HG2 THR 72 9.809 -19.561 14.035 577 H TRP 73 H TRP 73 11.657 -16.971 11.474 578 HA TRP 73 HA TRP 73 13.454 -18.906 12.663 579 HB2 TRP 73 2HB TRP 73 13.078 -18.849 10.276 580 HB3 TRP 73 3HB TRP 73 13.596 -17.168 10.182 581 HD1 TRP 73 HD1 TRP 73 14.943 -20.684 10.264 582 HE1 TRP 73 HE1 TRP 73 17.465 -20.684 9.899 583 HE3 TRP 73 HE3 TRP 73 15.801 -15.647 10.611 584 HZ2 TRP 73 HZ2 TRP 73 19.616 -18.753 9.876 585 HZ3 TRP 73 HZ3 TRP 73 18.101 -14.769 10.438 586 HH2 TRP 73 HH2 TRP 73 20.012 -16.302 10.099 587 H LEU 74 H LEU 74 13.284 -15.370 12.544 588 HA LEU 74 HA LEU 74 16.074 -15.072 13.375 589 HB2 LEU 74 2HB LEU 74 15.025 -13.455 11.842 590 HB3 LEU 74 3HB LEU 74 13.795 -13.087 13.053 591 HG LEU 74 HG LEU 74 15.576 -12.266 14.603 592 HD11 LEU 74 1HD1 LEU 74 17.378 -12.700 12.182 593 HD12 LEU 74 2HD1 LEU 74 17.833 -11.816 13.661 594 HD13 LEU 74 3HD1 LEU 74 17.497 -13.557 13.738 595 HD21 LEU 74 3HD2 LEU 74 16.028 -10.190 13.390 596 HD22 LEU 74 1HD2 LEU 74 15.567 -10.965 11.856 597 HD23 LEU 74 2HD2 LEU 74 14.352 -10.724 13.134 598 H TYR 75 H TYR 75 12.805 -14.936 14.855 599 HA TYR 75 HA TYR 75 13.789 -13.861 17.343 600 HB2 TYR 75 2HB TYR 75 11.230 -15.327 16.619 601 HB3 TYR 75 3HB TYR 75 11.536 -14.601 18.194 602 HD1 TYR 75 HD1 TYR 75 13.065 -12.092 17.026 603 HD2 TYR 75 HD2 TYR 75 9.280 -13.969 16.146 604 HE1 TYR 75 HE1 TYR 75 12.205 -9.951 16.229 605 HE2 TYR 75 HE2 TYR 75 8.412 -11.802 15.319 606 HH TYR 75 HH TYR 75 10.419 -8.839 15.277 607 H ARG 76 H ARG 76 13.782 -17.121 16.026 608 HA ARG 76 HA ARG 76 14.263 -18.301 18.647 609 HB2 ARG 76 2HB ARG 76 14.934 -20.305 17.403 610 HB3 ARG 76 3HB ARG 76 13.328 -19.711 16.959 611 HG2 ARG 76 2HG ARG 76 14.200 -18.682 14.942 612 HG3 ARG 76 3HG ARG 76 15.863 -19.158 15.357 613 HD2 ARG 76 2HD ARG 76 13.563 -21.111 15.002 614 HD3 ARG 76 3HD ARG 76 14.683 -20.674 13.696 615 HE ARG 76 HE ARG 76 15.212 -22.435 15.968 616 HH11 ARG 76 1HH1 ARG 76 16.659 -20.391 13.471 617 HH12 ARG 76 2HH1 ARG 76 18.204 -21.212 13.531 618 HH21 ARG 76 1HH2 ARG 76 17.244 -23.476 16.030 619 HH22 ARG 76 2HH2 ARG 76 18.527 -22.957 14.961 620 H ILE 77 H ILE 77 16.245 -16.649 16.215 621 HA ILE 77 HA ILE 77 18.767 -17.616 17.258 622 HB ILE 77 HB ILE 77 18.271 -14.929 15.928 623 HG12 ILE 77 2HG1 ILE 77 17.331 -16.597 14.429 624 HG13 ILE 77 3HG1 ILE 77 18.825 -15.927 13.788 625 HG21 ILE 77 1HG2 ILE 77 20.455 -15.173 16.975 626 HG22 ILE 77 2HG2 ILE 77 20.710 -16.733 16.171 627 HG23 ILE 77 3HG2 ILE 77 20.637 -15.237 15.214 628 HD11 ILE 77 3HD1 ILE 77 20.061 -17.958 14.464 629 HD12 ILE 77 1HD1 ILE 77 18.564 -18.639 15.156 630 HD13 ILE 77 2HD1 ILE 77 18.692 -18.352 13.409 631 H ALA 78 H ALA 78 16.579 -14.862 17.997 632 HA ALA 78 HA ALA 78 18.489 -13.483 19.612 633 HB1 ALA 78 1HB ALA 78 15.460 -13.262 19.496 634 HB2 ALA 78 2HB ALA 78 16.570 -12.070 20.206 635 HB3 ALA 78 3HB ALA 78 16.619 -12.397 18.460 636 H VAL 79 H VAL 79 15.824 -15.784 20.438 637 HA VAL 79 HA VAL 79 16.221 -15.303 23.276 638 HB VAL 79 HB VAL 79 14.024 -15.862 22.399 639 HG11 VAL 79 1HG1 VAL 79 14.746 -17.417 20.576 640 HG12 VAL 79 2HG1 VAL 79 15.169 -18.623 21.810 641 HG13 VAL 79 3HG1 VAL 79 13.477 -18.105 21.619 642 HG21 VAL 79 3HG2 VAL 79 15.099 -18.118 24.145 643 HG22 VAL 79 1HG2 VAL 79 14.687 -16.494 24.739 644 HG23 VAL 79 2HG2 VAL 79 13.420 -17.545 24.051 645 H ASN 80 H ASN 80 17.469 -17.619 20.885 646 HA ASN 80 HA ASN 80 18.574 -19.345 22.962 647 HB2 ASN 80 2HB ASN 80 18.995 -19.175 19.956 648 HB3 ASN 80 3HB ASN 80 19.765 -20.380 20.992 649 HD21 ASN 80 2HD2 ASN 80 18.198 -21.286 18.932 650 HD22 ASN 80 1HD2 ASN 80 16.723 -21.967 19.576 651 H THR 81 H THR 81 19.541 -16.360 21.413 652 HA THR 81 HA THR 81 22.369 -16.713 22.094 653 HB THR 81 HB THR 81 20.836 -14.237 21.190 654 HG1 THR 81 1HG THR 81 20.800 -15.751 19.599 655 HG21 THR 81 1HG2 THR 81 23.819 -14.870 21.264 656 HG22 THR 81 2HG2 THR 81 23.078 -13.430 20.530 657 HG23 THR 81 3HG2 THR 81 22.989 -13.676 22.287 658 H ALA 82 H ALA 82 19.424 -15.406 23.596 659 HA ALA 82 HA ALA 82 20.857 -13.885 25.610 660 HB1 ALA 82 1HB ALA 82 18.636 -13.724 26.656 661 HB2 ALA 82 2HB ALA 82 18.529 -13.388 24.915 662 HB3 ALA 82 3HB ALA 82 18.004 -14.962 25.549 663 H LYS 83 H LYS 83 19.540 -17.204 25.357 664 HA LYS 83 HA LYS 83 20.209 -17.887 28.098 665 HB2 LYS 83 2HB LYS 83 19.655 -19.583 25.630 666 HB3 LYS 83 3HB LYS 83 19.778 -20.209 27.291 667 HG2 LYS 83 2HG LYS 83 17.860 -18.859 27.989 668 HG3 LYS 83 3HG LYS 83 17.773 -18.098 26.391 669 HD2 LYS 83 2HD LYS 83 17.357 -20.336 25.366 670 HD3 LYS 83 3HD LYS 83 17.372 -21.059 26.991 671 HE2 LYS 83 2HE LYS 83 15.490 -19.589 27.647 672 HE3 LYS 83 3HE LYS 83 15.474 -18.875 26.029 673 HZ1 LYS 83 3HZ LYS 83 14.968 -21.058 25.150 674 HZ2 LYS 83 1HZ LYS 83 14.978 -21.714 26.654 675 HZ3 LYS 83 2HZ LYS 83 13.832 -20.608 26.251 676 H ASN 84 H ASN 84 21.855 -17.851 24.990 677 HA ASN 84 HA ASN 84 24.147 -19.434 25.766 678 HB2 ASN 84 2HB ASN 84 23.496 -19.234 23.447 679 HB3 ASN 84 3HB ASN 84 23.510 -17.464 23.545 680 HD21 ASN 84 2HD2 ASN 84 25.679 -20.256 24.068 681 HD22 ASN 84 1HD2 ASN 84 27.103 -19.506 23.354 682 H TYR 85 H TYR 85 23.193 -16.035 26.020 683 HA TYR 85 HA TYR 85 25.886 -15.045 26.323 684 HB2 TYR 85 2HB TYR 85 24.005 -13.763 25.351 685 HB3 TYR 85 3HB TYR 85 23.147 -13.838 26.896 686 HD1 TYR 85 HD1 TYR 85 26.130 -12.476 25.153 687 HD2 TYR 85 HD2 TYR 85 23.600 -12.255 28.618 688 HE1 TYR 85 HE1 TYR 85 27.220 -10.345 25.794 689 HE2 TYR 85 HE2 TYR 85 24.688 -10.114 29.279 690 HH TYR 85 HH TYR 85 27.307 -8.641 27.327 691 H LEU 86 H LEU 86 23.244 -16.019 28.504 692 HA LEU 86 HA LEU 86 24.592 -14.975 30.871 693 HB2 LEU 86 2HB LEU 86 22.179 -16.785 30.496 694 HB3 LEU 86 3HB LEU 86 22.740 -16.174 32.055 695 HG LEU 86 HG LEU 86 21.818 -14.428 29.732 696 HD11 LEU 86 1HD1 LEU 86 20.550 -15.126 32.415 697 HD12 LEU 86 2HD1 LEU 86 19.905 -13.962 31.231 698 HD13 LEU 86 3HD1 LEU 86 19.993 -15.689 30.822 699 HD21 LEU 86 3HD2 LEU 86 22.679 -13.742 32.576 700 HD22 LEU 86 1HD2 LEU 86 23.495 -13.247 31.074 701 HD23 LEU 86 2HD2 LEU 86 21.885 -12.616 31.456 702 H VAL 87 H VAL 87 24.645 -18.070 29.125 703 HA VAL 87 HA VAL 87 25.941 -19.350 31.449 704 HB VAL 87 HB VAL 87 26.086 -21.334 30.050 705 HG11 VAL 87 1HG1 VAL 87 23.344 -20.012 30.007 706 HG12 VAL 87 2HG1 VAL 87 23.665 -21.751 29.843 707 HG13 VAL 87 3HG1 VAL 87 24.058 -20.917 31.363 708 HG21 VAL 87 3HG2 VAL 87 24.991 -21.370 27.824 709 HG22 VAL 87 1HG2 VAL 87 24.808 -19.604 27.896 710 HG23 VAL 87 2HG2 VAL 87 26.428 -20.328 27.849 711 H ALA 88 H ALA 88 26.852 -17.600 28.557 712 HA ALA 88 HA ALA 88 29.532 -18.688 28.425 713 HB1 ALA 88 1HB ALA 88 28.339 -16.105 27.334 714 HB2 ALA 88 2HB ALA 88 29.920 -16.786 26.881 715 HB3 ALA 88 3HB ALA 88 28.428 -17.660 26.471 716 H GLN 89 H GLN 89 27.947 -16.497 30.533 717 HA GLN 89 HA GLN 89 30.582 -15.502 31.538 718 HB2 GLN 89 2HB GLN 89 27.807 -14.262 31.690 719 HB3 GLN 89 3HB GLN 89 29.264 -13.603 32.459 720 HG2 GLN 89 2HG GLN 89 30.336 -13.309 30.279 721 HG3 GLN 89 3HG GLN 89 28.970 -14.097 29.468 722 HE21 GLN 89 2HE2 GLN 89 26.875 -13.045 29.458 723 HE22 GLN 89 1HE2 GLN 89 26.777 -11.307 29.629 724 H GLY 90 H GLY 90 27.706 -17.370 32.240 725 HA2 GLY 90 2HA GLY 90 28.054 -17.239 35.139 726 HA3 GLY 90 3HA GLY 90 26.918 -18.252 34.222 727 H ARG 91 H ARG 91 29.255 -19.214 32.475 728 HA ARG 91 HA ARG 91 30.034 -21.443 34.195 729 HB2 ARG 91 2HB ARG 91 30.541 -20.758 31.281 730 HB3 ARG 91 3HB ARG 91 31.185 -22.215 32.073 731 HG2 ARG 91 2HG ARG 91 28.950 -22.989 32.627 732 HG3 ARG 91 3HG ARG 91 28.228 -21.488 32.043 733 HD2 ARG 91 2HD ARG 91 27.955 -23.230 30.368 734 HD3 ARG 91 3HD ARG 91 29.039 -21.969 29.755 735 HE ARG 91 HE ARG 91 30.746 -23.849 30.869 736 HH11 ARG 91 1HH1 ARG 91 28.201 -23.920 28.415 737 HH12 ARG 91 2HH1 ARG 91 28.922 -25.247 27.535 738 HH21 ARG 91 1HH2 ARG 91 31.674 -25.574 29.686 739 HH22 ARG 91 2HH2 ARG 91 30.874 -26.179 28.255 740 H ARG 92 H ARG 92 31.168 -18.367 34.029 741 HA ARG 92 HA ARG 92 34.034 -19.101 34.226 742 HB2 ARG 92 2HB ARG 92 32.653 -16.393 34.081 743 HB3 ARG 92 3HB ARG 92 34.403 -16.658 34.127 744 HG2 ARG 92 2HG ARG 92 34.227 -17.997 32.018 745 HG3 ARG 92 3HG ARG 92 32.486 -17.633 31.961 746 HD2 ARG 92 2HD ARG 92 33.040 -15.193 31.947 747 HD3 ARG 92 3HD ARG 92 34.760 -15.620 31.881 748 HE ARG 92 HE ARG 92 32.882 -16.621 29.792 749 HH11 ARG 92 1HH1 ARG 92 35.655 -14.598 30.658 750 HH12 ARG 92 2HH1 ARG 92 36.124 -14.336 28.993 751 HH21 ARG 92 1HH2 ARG 92 33.529 -16.277 27.650 752 HH22 ARG 92 2HH2 ARG 92 34.920 -15.276 27.296 753 H LEU 93 H LEU 93 31.419 -18.936 36.276 754 HA LEU 93 HA LEU 93 33.178 -18.404 38.584 755 HB2 LEU 93 2HB LEU 93 31.446 -16.938 39.605 756 HB3 LEU 93 3HB LEU 93 32.253 -16.272 38.182 757 HG LEU 93 HG LEU 93 30.295 -16.843 36.775 758 HD11 LEU 93 1HD1 LEU 93 29.014 -17.627 39.428 759 HD12 LEU 93 2HD1 LEU 93 28.130 -17.344 37.914 760 HD13 LEU 93 3HD1 LEU 93 29.272 -18.691 38.019 761 HD21 LEU 93 3HD2 LEU 93 29.685 -15.190 39.258 762 HD22 LEU 93 1HD2 LEU 93 30.549 -14.621 37.813 763 HD23 LEU 93 2HD2 LEU 93 28.836 -15.082 37.697 764 H GLU 94 H GLU 94 31.548 -20.667 37.168 765 HA GLU 94 HA GLU 94 30.350 -21.717 39.680 766 HB2 GLU 94 2HB GLU 94 28.717 -21.004 37.885 767 HB3 GLU 94 3HB GLU 94 29.374 -22.286 36.860 768 HG2 GLU 94 2HG GLU 94 27.310 -22.986 37.975 769 HG3 GLU 94 3HG GLU 94 28.654 -23.975 38.542 770 H LEU 95 H LEU 95 33.054 -21.896 38.133 771 HA LEU 95 HA LEU 95 34.658 -23.383 37.732 772 HB2 LEU 95 2HB LEU 95 34.120 -23.757 40.145 773 HB3 LEU 95 3HB LEU 95 33.173 -25.172 39.679 774 HG LEU 95 HG LEU 95 35.209 -26.262 38.796 775 HD11 LEU 95 1HD1 LEU 95 36.622 -23.713 39.702 776 HD12 LEU 95 2HD1 LEU 95 37.427 -25.213 39.190 777 HD13 LEU 95 3HD1 LEU 95 36.470 -24.288 38.023 778 HD21 LEU 95 3HD2 LEU 95 35.601 -25.071 41.566 779 HD22 LEU 95 1HD2 LEU 95 34.622 -26.508 41.172 780 HD23 LEU 95 2HD2 LEU 95 36.381 -26.539 40.931 781 H VAL 96 H VAL 96 32.117 -23.566 36.060 782 HA VAL 96 HA VAL 96 32.091 -26.341 35.173 783 HB VAL 96 HB VAL 96 30.930 -23.814 33.931 784 HG11 VAL 96 1HG1 VAL 96 29.491 -25.336 32.652 785 HG12 VAL 96 2HG1 VAL 96 31.193 -25.676 32.285 786 HG13 VAL 96 3HG1 VAL 96 30.282 -26.743 33.387 787 HG21 VAL 96 3HG2 VAL 96 29.643 -25.984 35.637 788 HG22 VAL 96 1HG2 VAL 96 29.981 -24.319 36.160 789 HG23 VAL 96 2HG2 VAL 96 28.797 -24.615 34.877 790 HA PRO 97 HA PRO 97 35.680 -25.864 32.608 791 HB2 PRO 97 2HB PRO 97 35.449 -28.060 30.995 792 HB3 PRO 97 3HB PRO 97 35.846 -28.174 32.742 793 HG2 PRO 97 2HG PRO 97 33.116 -28.437 31.436 794 HG3 PRO 97 3HG PRO 97 33.897 -29.567 32.600 795 HD2 PRO 97 2HD PRO 97 32.131 -27.699 33.446 796 HD3 PRO 97 3HD PRO 97 33.604 -28.041 34.399 797 H ARG 98 H ARG 98 36.310 -25.497 30.383 798 HA ARG 98 HA ARG 98 36.148 -24.339 28.473 799 HB2 ARG 98 2HB ARG 98 35.173 -26.649 27.964 800 HB3 ARG 98 3HB ARG 98 33.592 -25.851 27.911 801 HG2 ARG 98 2HG ARG 98 34.451 -24.329 26.117 802 HG3 ARG 98 3HG ARG 98 36.034 -25.122 26.228 803 HD2 ARG 98 2HD ARG 98 34.986 -27.283 25.611 804 HD3 ARG 98 3HD ARG 98 33.410 -26.486 25.481 805 HE ARG 98 HE ARG 98 35.631 -26.379 23.577 806 HH11 ARG 98 1HH1 ARG 98 32.662 -24.786 24.665 807 HH12 ARG 98 2HH1 ARG 98 32.398 -23.985 23.132 808 HH21 ARG 98 1HH2 ARG 98 35.255 -25.317 21.596 809 HH22 ARG 98 2HH2 ARG 98 33.858 -24.285 21.406 810 H GLY 99 H GLY 99 34.677 -23.198 30.878 811 HA2 GLY 99 2HA GLY 99 32.477 -21.664 29.779 812 HA3 GLY 99 3HA GLY 99 33.290 -21.419 31.339 813 H SER 100 H SER 100 35.900 -21.429 29.541 814 HA SER 100 HA SER 100 35.709 -18.850 28.166 815 HB2 SER 100 2HB SER 100 37.507 -17.836 29.527 816 HB3 SER 100 3HB SER 100 36.071 -18.163 30.508 817 HG SER 100 HG SER 100 37.984 -18.873 31.537 818 H HIS 101 H HIS 101 37.986 -18.284 27.285 819 HA HIS 101 HA HIS 101 39.667 -20.680 26.856 820 HB2 HIS 101 2HB HIS 101 37.930 -20.566 25.045 821 HB3 HIS 101 3HB HIS 101 38.580 -18.988 24.581 822 HD2 HIS 101 HD2 HIS 101 39.425 -19.790 22.190 823 HE1 HIS 101 HE1 HIS 101 42.278 -22.662 23.495 824 HE2 HIS 101 HE2 HIS 101 41.385 -21.378 21.482 825 H HIS 102 H HIS 102 41.780 -20.140 25.961 826 HA HIS 102 HA HIS 102 42.570 -17.303 26.334 827 HB2 HIS 102 2HB HIS 102 43.931 -19.683 27.647 828 HB3 HIS 102 3HB HIS 102 44.467 -18.001 27.729 829 HD2 HIS 102 HD2 HIS 102 42.803 -16.258 29.111 830 HE1 HIS 102 HE1 HIS 102 40.811 -19.301 31.313 831 HE2 HIS 102 HE2 HIS 102 41.243 -16.796 31.142 832 H HIS 103 H HIS 103 42.257 -19.295 24.024 833 HA HIS 103 HA HIS 103 43.325 -19.932 22.152 834 HB2 HIS 103 2HB HIS 103 43.541 -17.456 22.040 835 HB3 HIS 103 3HB HIS 103 45.178 -17.599 22.696 836 HD2 HIS 103 HD2 HIS 103 46.893 -17.361 20.785 837 HE1 HIS 103 HE1 HIS 103 44.856 -19.437 17.681 838 HE2 HIS 103 HE2 HIS 103 46.988 -18.185 18.300 839 H HIS 104 H HIS 104 44.262 -21.042 24.776 840 HA HIS 104 HA HIS 104 47.090 -21.604 24.442 841 HB2 HIS 104 2HB HIS 104 46.737 -23.074 26.381 842 HB3 HIS 104 3HB HIS 104 46.059 -21.466 26.651 843 HD2 HIS 104 HD2 HIS 104 45.012 -25.136 26.154 844 HE1 HIS 104 HE1 HIS 104 41.490 -22.996 27.202 845 HE2 HIS 104 HE2 HIS 104 42.482 -25.310 26.804 846 H HIS 105 H HIS 105 47.871 -23.908 24.419 847 HA HIS 105 HA HIS 105 46.195 -25.794 22.896 848 HB2 HIS 105 2HB HIS 105 47.876 -26.065 21.148 849 HB3 HIS 105 3HB HIS 105 47.261 -24.408 21.171 850 HD2 HIS 105 HD2 HIS 105 48.947 -22.447 21.934 851 HE1 HIS 105 HE1 HIS 105 52.482 -24.806 22.038 852 HE2 HIS 105 HE2 HIS 105 51.562 -22.436 22.107 853 H HIS 106 H HIS 106 47.380 -27.912 22.608 854 HA HIS 106 HA HIS 106 49.418 -28.428 24.701 855 HB2 HIS 106 2HB HIS 106 46.792 -29.929 24.369 856 HB3 HIS 106 3HB HIS 106 48.128 -30.425 25.413 857 HD2 HIS 106 HD2 HIS 106 48.789 -28.537 27.432 858 HE1 HIS 106 HE1 HIS 106 44.807 -27.074 27.711 859 HE2 HIS 106 HE2 HIS 106 47.080 -27.156 28.859 Start of MODEL 11 1 H1 MET 1 H1 MET 1 4.218 -7.921 -2.358 2 H2 MET 1 H2 MET 1 3.190 -8.650 -3.410 3 H3 MET 1 H3 MET 1 2.681 -8.287 -1.886 4 HA MET 1 HA MET 1 1.765 -6.755 -3.460 5 HB2 MET 1 2HB MET 1 2.339 -6.064 -1.115 6 HB3 MET 1 3HB MET 1 3.881 -5.434 -1.714 7 HG2 MET 1 2HG MET 1 2.655 -3.885 -3.205 8 HG3 MET 1 3HG MET 1 1.118 -4.567 -2.656 9 HE1 MET 1 1HE MET 1 1.038 -0.954 -1.189 10 HE2 MET 1 2HE MET 1 1.708 -1.491 -2.749 11 HE3 MET 1 3HE MET 1 0.178 -2.177 -2.145 12 H SER 2 H SER 2 2.114 -5.068 -5.044 13 HA SER 2 HA SER 2 4.399 -5.656 -6.764 14 HB2 SER 2 2HB SER 2 3.204 -4.190 -8.359 15 HB3 SER 2 3HB SER 2 2.172 -5.486 -7.719 16 HG SER 2 HG SER 2 1.139 -3.427 -7.683 17 H GLU 3 H GLU 3 4.236 -3.774 -4.104 18 HA GLU 3 HA GLU 3 6.273 -1.908 -5.135 19 HB2 GLU 3 2HB GLU 3 3.957 -0.851 -5.335 20 HB3 GLU 3 3HB GLU 3 3.858 -0.928 -3.566 21 HG2 GLU 3 2HG GLU 3 5.884 0.485 -3.395 22 HG3 GLU 3 3HG GLU 3 6.030 0.496 -5.162 23 H GLN 4 H GLN 4 7.405 -0.820 -3.322 24 HA GLN 4 HA GLN 4 8.691 -0.953 -1.481 25 HB2 GLN 4 2HB GLN 4 6.270 -2.132 -0.101 26 HB3 GLN 4 3HB GLN 4 7.640 -1.296 0.647 27 HG2 GLN 4 2HG GLN 4 7.034 0.783 -0.612 28 HG3 GLN 4 3HG GLN 4 5.617 -0.055 -1.264 29 HE21 GLN 4 2HE2 GLN 4 4.790 2.057 -0.106 30 HE22 GLN 4 1HE2 GLN 4 4.228 1.809 1.536 31 H LEU 5 H LEU 5 9.330 -2.520 0.479 32 HA LEU 5 HA LEU 5 9.764 -5.213 -0.727 33 HB2 LEU 5 2HB LEU 5 11.809 -3.494 0.708 34 HB3 LEU 5 3HB LEU 5 12.087 -5.095 0.004 35 HG LEU 5 HG LEU 5 11.317 -2.597 -1.562 36 HD11 LEU 5 1HD1 LEU 5 13.954 -4.117 -1.331 37 HD12 LEU 5 2HD1 LEU 5 13.655 -2.706 -2.374 38 HD13 LEU 5 3HD1 LEU 5 13.611 -2.527 -0.602 39 HD21 LEU 5 3HD2 LEU 5 10.589 -4.742 -2.651 40 HD22 LEU 5 1HD2 LEU 5 11.870 -3.908 -3.553 41 HD23 LEU 5 2HD2 LEU 5 12.268 -5.320 -2.556 42 H THR 6 H THR 6 10.277 -6.886 0.777 43 HA THR 6 HA THR 6 9.524 -6.413 3.610 44 HB THR 6 HB THR 6 8.274 -8.553 1.836 45 HG1 THR 6 1HG THR 6 7.531 -6.477 1.315 46 HG21 THR 6 1HG2 THR 6 7.794 -7.664 4.705 47 HG22 THR 6 2HG2 THR 6 6.635 -8.647 3.782 48 HG23 THR 6 3HG2 THR 6 8.251 -9.288 4.129 49 H ASP 7 H ASP 7 9.868 -8.665 4.816 50 HA ASP 7 HA ASP 7 12.599 -9.281 4.651 51 HB2 ASP 7 2HB ASP 7 12.102 -11.096 6.186 52 HB3 ASP 7 3HB ASP 7 11.210 -9.638 6.629 53 H GLN 8 H GLN 8 10.005 -10.454 2.649 54 HA GLN 8 HA GLN 8 11.091 -12.973 1.889 55 HB2 GLN 8 2HB GLN 8 8.794 -12.314 1.345 56 HB3 GLN 8 3HB GLN 8 9.383 -10.940 0.393 57 HG2 GLN 8 2HG GLN 8 8.704 -12.746 -1.089 58 HG3 GLN 8 3HG GLN 8 10.449 -12.491 -1.209 59 HE21 GLN 8 2HE2 GLN 8 11.901 -14.040 -0.150 60 HE22 GLN 8 1HE2 GLN 8 11.324 -15.652 0.234 61 H VAL 9 H VAL 9 11.392 -9.716 0.396 62 HA VAL 9 HA VAL 9 13.419 -10.704 -1.483 63 HB VAL 9 HB VAL 9 11.770 -9.254 -2.390 64 HG11 VAL 9 1HG1 VAL 9 12.462 -7.260 -0.202 65 HG12 VAL 9 2HG1 VAL 9 11.337 -6.983 -1.550 66 HG13 VAL 9 3HG1 VAL 9 10.952 -8.205 -0.337 67 HG21 VAL 9 3HG2 VAL 9 14.227 -7.508 -1.938 68 HG22 VAL 9 1HG2 VAL 9 14.124 -8.816 -3.141 69 HG23 VAL 9 2HG2 VAL 9 13.065 -7.394 -3.271 70 H LEU 10 H LEU 10 13.293 -8.930 1.568 71 HA LEU 10 HA LEU 10 15.954 -7.830 1.359 72 HB2 LEU 10 2HB LEU 10 13.839 -8.125 3.447 73 HB3 LEU 10 3HB LEU 10 15.510 -7.966 4.019 74 HG LEU 10 HG LEU 10 15.819 -5.899 2.824 75 HD11 LEU 10 1HD1 LEU 10 12.946 -6.219 1.871 76 HD12 LEU 10 2HD1 LEU 10 13.960 -4.774 1.651 77 HD13 LEU 10 3HD1 LEU 10 14.409 -6.286 0.850 78 HD21 LEU 10 3HD2 LEU 10 13.187 -5.935 4.359 79 HD22 LEU 10 1HD2 LEU 10 14.814 -5.807 5.075 80 HD23 LEU 10 2HD2 LEU 10 14.187 -4.495 4.053 81 H VAL 11 H VAL 11 14.676 -11.014 2.368 82 HA VAL 11 HA VAL 11 17.306 -11.742 3.452 83 HB VAL 11 HB VAL 11 14.763 -13.322 3.005 84 HG11 VAL 11 1HG1 VAL 11 17.461 -14.214 4.119 85 HG12 VAL 11 2HG1 VAL 11 15.937 -15.123 4.285 86 HG13 VAL 11 3HG1 VAL 11 16.642 -14.860 2.682 87 HG21 VAL 11 3HG2 VAL 11 14.854 -11.670 4.900 88 HG22 VAL 11 1HG2 VAL 11 14.781 -13.351 5.474 89 HG23 VAL 11 2HG2 VAL 11 16.328 -12.469 5.488 90 H GLU 12 H GLU 12 15.520 -12.056 0.361 91 HA GLU 12 HA GLU 12 17.398 -13.924 -0.773 92 HB2 GLU 12 2HB GLU 12 15.514 -11.876 -2.006 93 HB3 GLU 12 3HB GLU 12 16.511 -12.987 -2.962 94 HG2 GLU 12 2HG GLU 12 15.479 -14.923 -1.833 95 HG3 GLU 12 3HG GLU 12 14.449 -13.845 -0.893 96 H ARG 13 H ARG 13 17.241 -10.342 -0.605 97 HA ARG 13 HA ARG 13 19.388 -9.925 -2.465 98 HB2 ARG 13 2HB ARG 13 17.595 -8.304 -2.019 99 HB3 ARG 13 3HB ARG 13 18.182 -8.085 -0.358 100 HG2 ARG 13 2HG ARG 13 20.234 -7.126 -1.137 101 HG3 ARG 13 3HG ARG 13 19.916 -7.637 -2.816 102 HD2 ARG 13 2HD ARG 13 17.893 -6.138 -2.805 103 HD3 ARG 13 3HD ARG 13 18.416 -5.521 -1.227 104 HE ARG 13 HE ARG 13 20.611 -5.326 -3.006 105 HH11 ARG 13 1HH1 ARG 13 17.409 -3.884 -2.560 106 HH12 ARG 13 2HH1 ARG 13 17.842 -2.402 -3.382 107 HH21 ARG 13 1HH2 ARG 13 21.119 -3.443 -4.113 108 HH22 ARG 13 2HH2 ARG 13 19.952 -2.144 -4.254 109 H VAL 14 H VAL 14 19.336 -10.212 1.124 110 HA VAL 14 HA VAL 14 22.121 -9.457 1.339 111 HB VAL 14 HB VAL 14 21.991 -10.377 3.604 112 HG11 VAL 14 1HG1 VAL 14 21.222 -8.121 3.250 113 HG12 VAL 14 2HG1 VAL 14 19.628 -8.683 2.709 114 HG13 VAL 14 3HG1 VAL 14 20.106 -8.923 4.400 115 HG21 VAL 14 3HG2 VAL 14 19.842 -11.212 4.455 116 HG22 VAL 14 1HG2 VAL 14 19.211 -11.274 2.789 117 HG23 VAL 14 2HG2 VAL 14 20.576 -12.319 3.276 118 H GLN 15 H GLN 15 20.452 -12.420 0.447 119 HA GLN 15 HA GLN 15 22.849 -14.058 0.763 120 HB2 GLN 15 2HB GLN 15 20.182 -14.539 -0.607 121 HB3 GLN 15 3HB GLN 15 21.478 -15.744 -0.491 122 HG2 GLN 15 2HG GLN 15 21.370 -15.679 1.967 123 HG3 GLN 15 3HG GLN 15 20.147 -14.417 1.915 124 HE21 GLN 15 2HE2 GLN 15 19.399 -16.582 3.335 125 HE22 GLN 15 1HE2 GLN 15 18.250 -17.549 2.440 126 H LYS 16 H LYS 16 21.668 -11.780 -1.593 127 HA LYS 16 HA LYS 16 23.320 -12.822 -3.766 128 HB2 LYS 16 2HB LYS 16 22.040 -10.082 -3.412 129 HB3 LYS 16 3HB LYS 16 22.738 -10.726 -4.895 130 HG2 LYS 16 2HG LYS 16 20.226 -11.645 -3.482 131 HG3 LYS 16 3HG LYS 16 20.364 -10.890 -5.070 132 HD2 LYS 16 2HD LYS 16 21.556 -12.896 -5.924 133 HD3 LYS 16 3HD LYS 16 21.402 -13.660 -4.319 134 HE2 LYS 16 2HE LYS 16 18.938 -13.470 -4.466 135 HE3 LYS 16 3HE LYS 16 19.090 -12.737 -6.071 136 HZ1 LYS 16 3HZ LYS 16 20.141 -14.770 -6.821 137 HZ2 LYS 16 1HZ LYS 16 19.983 -15.446 -5.333 138 HZ3 LYS 16 2HZ LYS 16 18.643 -15.082 -6.217 139 H GLY 17 H GLY 17 23.968 -11.253 -0.847 140 HA2 GLY 17 2HA GLY 17 26.237 -10.916 -0.181 141 HA3 GLY 17 3HA GLY 17 26.656 -10.440 -1.834 142 H ASP 18 H ASP 18 23.704 -8.973 -1.101 143 HA ASP 18 HA ASP 18 25.012 -6.383 -0.631 144 HB2 ASP 18 2HB ASP 18 22.242 -7.357 -1.305 145 HB3 ASP 18 3HB ASP 18 22.459 -5.722 -0.703 146 H GLN 19 H GLN 19 25.870 -6.795 1.487 147 HA GLN 19 HA GLN 19 24.266 -7.595 3.693 148 HB2 GLN 19 2HB GLN 19 26.782 -7.599 3.424 149 HB3 GLN 19 3HB GLN 19 26.773 -5.859 3.692 150 HG2 GLN 19 2HG GLN 19 25.615 -7.863 5.681 151 HG3 GLN 19 3HG GLN 19 27.316 -7.393 5.676 152 HE21 GLN 19 2HE2 GLN 19 27.474 -4.759 5.395 153 HE22 GLN 19 1HE2 GLN 19 26.560 -3.914 6.632 154 H LYS 20 H LYS 20 24.534 -4.568 1.978 155 HA LYS 20 HA LYS 20 23.685 -2.756 4.001 156 HB2 LYS 20 2HB LYS 20 23.064 -1.342 2.068 157 HB3 LYS 20 3HB LYS 20 24.661 -2.077 1.858 158 HG2 LYS 20 2HG LYS 20 23.584 -3.889 0.463 159 HG3 LYS 20 3HG LYS 20 22.050 -2.993 0.568 160 HD2 LYS 20 2HD LYS 20 23.132 -1.038 -0.489 161 HD3 LYS 20 3HD LYS 20 24.669 -1.938 -0.569 162 HE2 LYS 20 2HE LYS 20 23.553 -3.663 -1.970 163 HE3 LYS 20 3HE LYS 20 22.059 -2.716 -1.929 164 HZ1 LYS 20 3HZ LYS 20 24.637 -1.791 -3.024 165 HZ2 LYS 20 1HZ LYS 20 23.365 -2.305 -3.922 166 HZ3 LYS 20 2HZ LYS 20 23.236 -0.935 -3.023 167 H ALA 21 H ALA 21 21.922 -5.214 2.177 168 HA ALA 21 HA ALA 21 19.337 -4.017 2.821 169 HB1 ALA 21 1HB ALA 21 18.434 -6.074 1.785 170 HB2 ALA 21 2HB ALA 21 19.624 -5.267 0.735 171 HB3 ALA 21 3HB ALA 21 20.089 -6.722 1.647 172 H PHE 22 H PHE 22 21.641 -6.124 4.397 173 HA PHE 22 HA PHE 22 19.673 -7.390 6.132 174 HB2 PHE 22 2HB PHE 22 21.848 -8.448 5.569 175 HB3 PHE 22 3HB PHE 22 22.691 -7.140 6.386 176 HD1 PHE 22 HD1 PHE 22 19.946 -9.640 7.014 177 HD2 PHE 22 HD2 PHE 22 23.284 -7.458 8.632 178 HE1 PHE 22 HE1 PHE 22 19.712 -10.868 9.136 179 HE2 PHE 22 HE2 PHE 22 23.037 -8.681 10.777 180 HZ PHE 22 HZ PHE 22 21.256 -10.392 11.033 181 H ASN 23 H ASN 23 21.813 -4.529 6.200 182 HA ASN 23 HA ASN 23 21.404 -3.811 8.927 183 HB2 ASN 23 2HB ASN 23 23.159 -2.784 7.659 184 HB3 ASN 23 3HB ASN 23 22.041 -2.328 6.365 185 HD21 ASN 23 2HD2 ASN 23 20.979 -0.414 6.417 186 HD22 ASN 23 1HD2 ASN 23 21.089 0.737 7.731 187 H LEU 24 H LEU 24 19.615 -3.078 5.922 188 HA LEU 24 HA LEU 24 17.630 -1.443 7.260 189 HB2 LEU 24 2HB LEU 24 17.668 -2.821 4.546 190 HB3 LEU 24 3HB LEU 24 16.461 -1.629 5.050 191 HG LEU 24 HG LEU 24 19.460 -1.090 4.860 192 HD11 LEU 24 1HD1 LEU 24 17.171 -0.329 3.007 193 HD12 LEU 24 2HD1 LEU 24 18.867 0.196 2.846 194 HD13 LEU 24 3HD1 LEU 24 18.454 -1.522 2.668 195 HD21 LEU 24 3HD2 LEU 24 18.760 1.287 5.040 196 HD22 LEU 24 1HD2 LEU 24 17.080 0.767 5.288 197 HD23 LEU 24 2HD2 LEU 24 18.327 0.370 6.496 198 H LEU 25 H LEU 25 18.098 -4.871 6.857 199 HA LEU 25 HA LEU 25 15.272 -5.515 7.289 200 HB2 LEU 25 2HB LEU 25 16.646 -6.929 5.849 201 HB3 LEU 25 3HB LEU 25 17.799 -7.206 7.162 202 HG LEU 25 HG LEU 25 16.054 -8.387 8.465 203 HD11 LEU 25 1HD1 LEU 25 13.933 -9.016 7.378 204 HD12 LEU 25 2HD1 LEU 25 14.040 -7.256 7.602 205 HD13 LEU 25 3HD1 LEU 25 14.324 -7.974 5.994 206 HD21 LEU 25 3HD2 LEU 25 17.519 -9.643 6.956 207 HD22 LEU 25 1HD2 LEU 25 15.894 -10.361 6.973 208 HD23 LEU 25 2HD2 LEU 25 16.407 -9.359 5.596 209 H VAL 26 H VAL 26 18.328 -5.668 9.262 210 HA VAL 26 HA VAL 26 16.930 -6.887 11.443 211 HB VAL 26 HB VAL 26 18.844 -6.411 12.805 212 HG11 VAL 26 1HG1 VAL 26 19.001 -8.282 11.213 213 HG12 VAL 26 2HG1 VAL 26 19.722 -7.201 9.999 214 HG13 VAL 26 3HG1 VAL 26 20.587 -7.529 11.505 215 HG21 VAL 26 3HG2 VAL 26 19.338 -4.129 12.178 216 HG22 VAL 26 1HG2 VAL 26 20.780 -5.139 11.967 217 HG23 VAL 26 2HG2 VAL 26 19.833 -4.646 10.541 218 H VAL 27 H VAL 27 17.182 -3.497 10.412 219 HA VAL 27 HA VAL 27 16.635 -2.469 13.047 220 HB VAL 27 HB VAL 27 17.733 -1.166 11.285 221 HG11 VAL 27 1HG1 VAL 27 14.976 -1.080 9.990 222 HG12 VAL 27 2HG1 VAL 27 16.390 -0.128 9.492 223 HG13 VAL 27 3HG1 VAL 27 16.420 -1.903 9.347 224 HG21 VAL 27 3HG2 VAL 27 16.604 -0.052 13.185 225 HG22 VAL 27 1HG2 VAL 27 16.577 0.945 11.713 226 HG23 VAL 27 2HG2 VAL 27 15.113 0.074 12.220 227 H ARG 28 H ARG 28 14.580 -3.763 10.465 228 HA ARG 28 HA ARG 28 12.092 -2.705 11.479 229 HB2 ARG 28 2HB ARG 28 12.547 -5.334 10.011 230 HB3 ARG 28 3HB ARG 28 11.060 -4.370 10.074 231 HG2 ARG 28 2HG ARG 28 12.248 -2.545 8.824 232 HG3 ARG 28 3HG ARG 28 13.686 -3.595 8.750 233 HD2 ARG 28 2HD ARG 28 12.543 -3.804 6.659 234 HD3 ARG 28 3HD ARG 28 12.330 -5.318 7.551 235 HE ARG 28 HE ARG 28 10.072 -4.072 8.255 236 HH11 ARG 28 1HH1 ARG 28 11.611 -4.221 5.070 237 HH12 ARG 28 2HH1 ARG 28 10.097 -4.103 4.207 238 HH21 ARG 28 1HH2 ARG 28 8.120 -3.925 7.099 239 HH22 ARG 28 2HH2 ARG 28 8.131 -3.933 5.348 240 H TYR 29 H TYR 29 14.165 -5.450 12.247 241 HA TYR 29 HA TYR 29 12.149 -6.497 14.147 242 HB2 TYR 29 2HB TYR 29 14.657 -7.670 12.930 243 HB3 TYR 29 3HB TYR 29 13.718 -8.456 14.206 244 HD1 TYR 29 HD1 TYR 29 13.564 -7.221 10.693 245 HD2 TYR 29 HD2 TYR 29 11.687 -9.598 13.738 246 HE1 TYR 29 HE1 TYR 29 11.982 -8.095 9.009 247 HE2 TYR 29 HE2 TYR 29 10.111 -10.517 12.059 248 HH TYR 29 HH TYR 29 10.194 -9.493 8.620 249 H GLN 30 H GLN 30 14.834 -4.418 14.199 250 HA GLN 30 HA GLN 30 16.205 -5.305 16.518 251 HB2 GLN 30 2HB GLN 30 17.028 -3.678 14.835 252 HB3 GLN 30 3HB GLN 30 15.855 -2.489 15.416 253 HG2 GLN 30 2HG GLN 30 16.954 -2.465 17.619 254 HG3 GLN 30 3HG GLN 30 18.054 -3.760 17.099 255 HE21 GLN 30 2HE2 GLN 30 19.225 -3.232 14.915 256 HE22 GLN 30 1HE2 GLN 30 19.890 -1.612 14.797 257 H HIS 31 H HIS 31 13.206 -3.474 16.099 258 HA HIS 31 HA HIS 31 13.037 -2.872 18.971 259 HB2 HIS 31 2HB HIS 31 12.158 -1.329 17.235 260 HB3 HIS 31 3HB HIS 31 11.005 -2.571 16.731 261 HD2 HIS 31 HD2 HIS 31 8.731 -2.664 18.002 262 HE1 HIS 31 HE1 HIS 31 9.646 -0.058 21.234 263 HE2 HIS 31 HE2 HIS 31 7.800 -1.400 20.096 264 H LYS 32 H LYS 32 11.921 -5.336 16.672 265 HA LYS 32 HA LYS 32 9.866 -6.369 18.440 266 HB2 LYS 32 2HB LYS 32 11.183 -7.598 15.988 267 HB3 LYS 32 3HB LYS 32 9.688 -8.157 16.773 268 HG2 LYS 32 2HG LYS 32 8.623 -5.972 16.293 269 HG3 LYS 32 3HG LYS 32 10.099 -5.434 15.463 270 HD2 LYS 32 2HD LYS 32 9.889 -7.333 13.869 271 HD3 LYS 32 3HD LYS 32 8.389 -7.840 14.680 272 HE2 LYS 32 2HE LYS 32 7.368 -5.650 14.159 273 HE3 LYS 32 3HE LYS 32 8.858 -5.139 13.350 274 HZ1 LYS 32 3HZ LYS 32 7.245 -5.945 11.787 275 HZ2 LYS 32 1HZ LYS 32 8.547 -6.950 11.791 276 HZ3 LYS 32 2HZ LYS 32 7.153 -7.400 12.540 277 H VAL 33 H VAL 33 13.251 -7.387 17.657 278 HA VAL 33 HA VAL 33 12.929 -9.722 19.377 279 HB VAL 33 HB VAL 33 15.167 -10.285 18.834 280 HG11 VAL 33 1HG1 VAL 33 15.036 -10.408 16.385 281 HG12 VAL 33 2HG1 VAL 33 13.448 -10.710 17.121 282 HG13 VAL 33 3HG1 VAL 33 13.798 -9.135 16.370 283 HG21 VAL 33 3HG2 VAL 33 16.616 -8.862 17.434 284 HG22 VAL 33 1HG2 VAL 33 15.441 -7.528 17.582 285 HG23 VAL 33 2HG2 VAL 33 16.290 -8.148 19.020 286 H ALA 34 H ALA 34 14.118 -6.407 19.735 287 HA ALA 34 HA ALA 34 15.582 -6.938 22.155 288 HB1 ALA 34 1HB ALA 34 14.313 -4.355 21.160 289 HB2 ALA 34 2HB ALA 34 15.517 -4.505 22.461 290 HB3 ALA 34 3HB ALA 34 15.964 -4.926 20.796 291 H SER 35 H SER 35 12.187 -6.620 21.362 292 HA SER 35 HA SER 35 11.312 -5.909 24.037 293 HB2 SER 35 2HB SER 35 10.047 -5.390 21.961 294 HB3 SER 35 3HB SER 35 9.795 -7.135 21.700 295 HG SER 35 HG SER 35 8.043 -6.101 22.799 296 H LEU 36 H LEU 36 11.544 -8.937 22.108 297 HA LEU 36 HA LEU 36 10.385 -10.475 24.299 298 HB2 LEU 36 2HB LEU 36 10.595 -12.381 22.857 299 HB3 LEU 36 3HB LEU 36 9.935 -11.014 21.959 300 HG LEU 36 HG LEU 36 12.409 -10.619 21.189 301 HD11 LEU 36 1HD1 LEU 36 12.490 -13.595 21.878 302 HD12 LEU 36 2HD1 LEU 36 13.697 -12.702 20.922 303 HD13 LEU 36 3HD1 LEU 36 13.503 -12.351 22.646 304 HD21 LEU 36 3HD2 LEU 36 10.768 -13.003 20.258 305 HD22 LEU 36 1HD2 LEU 36 10.524 -11.317 19.752 306 HD23 LEU 36 2HD2 LEU 36 12.021 -12.172 19.303 307 H VAL 37 H VAL 37 13.626 -9.560 23.313 308 HA VAL 37 HA VAL 37 14.799 -11.723 24.908 309 HB VAL 37 HB VAL 37 15.696 -10.886 22.686 310 HG11 VAL 37 1HG1 VAL 37 15.569 -8.419 23.526 311 HG12 VAL 37 2HG1 VAL 37 17.085 -8.807 24.373 312 HG13 VAL 37 3HG1 VAL 37 17.011 -8.931 22.603 313 HG21 VAL 37 3HG2 VAL 37 17.606 -10.974 25.049 314 HG22 VAL 37 1HG2 VAL 37 16.926 -12.388 24.209 315 HG23 VAL 37 2HG2 VAL 37 18.009 -11.275 23.345 316 H SER 38 H SER 38 13.812 -8.397 25.383 317 HA SER 38 HA SER 38 15.396 -7.762 27.669 318 HB2 SER 38 2HB SER 38 12.610 -7.028 26.728 319 HB3 SER 38 3HB SER 38 13.290 -6.396 28.249 320 HG SER 38 HG SER 38 14.223 -6.016 25.614 321 H ARG 39 H ARG 39 13.038 -10.203 27.105 322 HA ARG 39 HA ARG 39 12.186 -10.438 29.904 323 HB2 ARG 39 2HB ARG 39 11.544 -12.225 27.538 324 HB3 ARG 39 3HB ARG 39 10.694 -12.143 29.090 325 HG2 ARG 39 2HG ARG 39 10.018 -9.804 28.606 326 HG3 ARG 39 3HG ARG 39 10.891 -9.873 27.062 327 HD2 ARG 39 2HD ARG 39 9.449 -11.801 26.382 328 HD3 ARG 39 3HD ARG 39 8.502 -11.559 27.870 329 HE ARG 39 HE ARG 39 8.706 -9.095 26.419 330 HH11 ARG 39 1HH1 ARG 39 7.091 -12.237 26.286 331 HH12 ARG 39 2HH1 ARG 39 5.721 -11.618 25.385 332 HH21 ARG 39 1HH2 ARG 39 6.913 -8.327 25.244 333 HH22 ARG 39 2HH2 ARG 39 5.621 -9.415 24.804 334 H TYR 40 H TYR 40 14.924 -11.362 28.198 335 HA TYR 40 HA TYR 40 15.310 -13.758 29.945 336 HB2 TYR 40 2HB TYR 40 16.290 -13.276 27.118 337 HB3 TYR 40 3HB TYR 40 16.768 -14.632 28.139 338 HD1 TYR 40 HD1 TYR 40 15.131 -16.395 28.755 339 HD2 TYR 40 HD2 TYR 40 14.153 -13.242 25.999 340 HE1 TYR 40 HE1 TYR 40 13.143 -17.676 27.996 341 HE2 TYR 40 HE2 TYR 40 12.194 -14.525 25.207 342 HH TYR 40 HH TYR 40 11.330 -17.724 26.592 343 H VAL 41 H VAL 41 16.521 -10.637 28.934 344 HA VAL 41 HA VAL 41 18.713 -10.958 30.890 345 HB VAL 41 HB VAL 41 20.194 -9.594 29.324 346 HG11 VAL 41 1HG1 VAL 41 20.984 -11.553 28.093 347 HG12 VAL 41 2HG1 VAL 41 20.586 -11.977 29.773 348 HG13 VAL 41 3HG1 VAL 41 19.471 -12.416 28.462 349 HG21 VAL 41 3HG2 VAL 41 18.280 -10.621 27.196 350 HG22 VAL 41 1HG2 VAL 41 18.399 -8.924 27.725 351 HG23 VAL 41 2HG2 VAL 41 19.780 -9.715 26.936 352 HA PRO 42 HA PRO 42 17.287 -7.024 32.227 353 HB2 PRO 42 2HB PRO 42 19.518 -5.912 33.338 354 HB3 PRO 42 3HB PRO 42 18.712 -7.345 34.045 355 HG2 PRO 42 2HG PRO 42 21.082 -7.301 32.140 356 HG3 PRO 42 3HG PRO 42 20.961 -8.151 33.719 357 HD2 PRO 42 2HD PRO 42 20.482 -9.446 31.400 358 HD3 PRO 42 3HD PRO 42 19.438 -9.748 32.823 359 H SER 43 H SER 43 17.613 -4.647 31.939 360 HA SER 43 HA SER 43 17.902 -4.089 29.156 361 HB2 SER 43 2HB SER 43 17.461 -1.758 29.853 362 HB3 SER 43 3HB SER 43 16.332 -2.910 30.594 363 HG SER 43 HG SER 43 17.171 -1.409 32.105 364 H GLY 44 H GLY 44 20.329 -4.337 31.575 365 HA2 GLY 44 2HA GLY 44 22.119 -2.351 30.352 366 HA3 GLY 44 3HA GLY 44 22.468 -3.432 31.717 367 H ASP 45 H ASP 45 21.329 -5.728 29.937 368 HA ASP 45 HA ASP 45 23.817 -6.138 28.341 369 HB2 ASP 45 2HB ASP 45 22.100 -8.090 29.910 370 HB3 ASP 45 3HB ASP 45 23.374 -8.571 28.784 371 H VAL 46 H VAL 46 20.498 -5.560 28.095 372 HA VAL 46 HA VAL 46 19.806 -7.504 26.129 373 HB VAL 46 HB VAL 46 18.246 -6.196 27.604 374 HG11 VAL 46 1HG1 VAL 46 17.314 -4.127 26.726 375 HG12 VAL 46 2HG1 VAL 46 19.017 -3.904 27.172 376 HG13 VAL 46 3HG1 VAL 46 18.550 -4.070 25.453 377 HG21 VAL 46 3HG2 VAL 46 17.742 -6.412 24.620 378 HG22 VAL 46 1HG2 VAL 46 17.443 -7.627 25.907 379 HG23 VAL 46 2HG2 VAL 46 16.484 -6.138 25.841 380 HA PRO 47 HA PRO 47 20.667 -4.215 22.847 381 HB2 PRO 47 2HB PRO 47 22.664 -2.402 23.091 382 HB3 PRO 47 3HB PRO 47 21.051 -2.140 23.850 383 HG2 PRO 47 2HG PRO 47 23.560 -3.263 25.136 384 HG3 PRO 47 3HG PRO 47 22.529 -1.920 25.734 385 HD2 PRO 47 2HD PRO 47 22.244 -4.476 26.606 386 HD3 PRO 47 3HD PRO 47 20.825 -3.402 26.395 387 H ASP 48 H ASP 48 23.312 -5.630 24.729 388 HA ASP 48 HA ASP 48 25.067 -5.893 22.407 389 HB2 ASP 48 2HB ASP 48 25.894 -5.569 24.744 390 HB3 ASP 48 3HB ASP 48 25.217 -7.149 25.174 391 H VAL 49 H VAL 49 22.644 -7.815 24.120 392 HA VAL 49 HA VAL 49 23.359 -10.309 22.794 393 HB VAL 49 HB VAL 49 20.998 -9.401 24.482 394 HG11 VAL 49 1HG1 VAL 49 21.636 -12.184 23.414 395 HG12 VAL 49 2HG1 VAL 49 20.399 -11.795 24.631 396 HG13 VAL 49 3HG1 VAL 49 20.224 -11.190 22.971 397 HG21 VAL 49 3HG2 VAL 49 23.204 -9.651 25.625 398 HG22 VAL 49 1HG2 VAL 49 22.036 -10.876 26.161 399 HG23 VAL 49 2HG2 VAL 49 23.317 -11.311 25.004 400 H VAL 50 H VAL 50 21.213 -7.550 22.130 401 HA VAL 50 HA VAL 50 19.812 -8.879 19.966 402 HB VAL 50 HB VAL 50 20.199 -5.971 20.765 403 HG11 VAL 50 1HG1 VAL 50 18.395 -5.460 19.131 404 HG12 VAL 50 2HG1 VAL 50 19.880 -6.023 18.334 405 HG13 VAL 50 3HG1 VAL 50 18.500 -7.126 18.516 406 HG21 VAL 50 3HG2 VAL 50 17.848 -6.147 21.424 407 HG22 VAL 50 1HG2 VAL 50 17.758 -7.795 20.768 408 HG23 VAL 50 2HG2 VAL 50 18.759 -7.465 22.198 409 H GLN 51 H GLN 51 22.841 -7.000 20.295 410 HA GLN 51 HA GLN 51 23.241 -6.807 17.431 411 HB2 GLN 51 2HB GLN 51 24.263 -5.259 19.056 412 HB3 GLN 51 3HB GLN 51 25.208 -6.600 19.741 413 HG2 GLN 51 2HG GLN 51 26.344 -6.940 17.601 414 HG3 GLN 51 3HG GLN 51 25.343 -5.701 16.830 415 HE21 GLN 51 2HE2 GLN 51 27.807 -5.105 16.391 416 HE22 GLN 51 1HE2 GLN 51 28.471 -3.934 17.509 417 H GLU 52 H GLU 52 24.365 -9.084 20.021 418 HA GLU 52 HA GLU 52 26.001 -10.600 18.223 419 HB2 GLU 52 2HB GLU 52 26.194 -10.657 20.687 420 HB3 GLU 52 3HB GLU 52 24.613 -11.475 20.791 421 HG2 GLU 52 2HG GLU 52 25.481 -13.359 19.463 422 HG3 GLU 52 3HG GLU 52 27.041 -12.542 19.286 423 H ALA 53 H ALA 53 22.517 -10.581 18.929 424 HA ALA 53 HA ALA 53 21.989 -13.136 17.722 425 HB1 ALA 53 1HB ALA 53 19.642 -12.377 17.803 426 HB2 ALA 53 2HB ALA 53 20.475 -12.087 19.346 427 HB3 ALA 53 3HB ALA 53 20.183 -10.737 18.219 428 H PHE 54 H PHE 54 22.345 -9.814 16.463 429 HA PHE 54 HA PHE 54 21.301 -10.628 13.842 430 HB2 PHE 54 2HB PHE 54 22.538 -8.065 14.893 431 HB3 PHE 54 3HB PHE 54 22.008 -8.278 13.233 432 HD1 PHE 54 HD2 PHE 54 19.461 -9.945 13.865 433 HD2 PHE 54 HD1 PHE 54 21.033 -6.281 15.503 434 HE1 PHE 54 HE2 PHE 54 17.179 -9.235 14.491 435 HE2 PHE 54 HE1 PHE 54 18.740 -5.556 16.061 436 HZ PHE 54 HZ PHE 54 16.809 -7.038 15.558 437 H ILE 55 H ILE 55 24.460 -10.272 15.418 438 HA ILE 55 HA ILE 55 25.948 -10.529 12.942 439 HB ILE 55 HB ILE 55 26.669 -11.069 15.850 440 HG12 ILE 55 2HG1 ILE 55 27.377 -8.724 14.018 441 HG13 ILE 55 3HG1 ILE 55 26.092 -8.690 15.216 442 HG21 ILE 55 1HG2 ILE 55 28.471 -10.888 13.395 443 HG22 ILE 55 2HG2 ILE 55 29.031 -11.051 15.076 444 HG23 ILE 55 3HG2 ILE 55 28.127 -12.366 14.319 445 HD11 ILE 55 3HD1 ILE 55 29.061 -9.073 15.777 446 HD12 ILE 55 1HD1 ILE 55 28.069 -7.653 16.142 447 HD13 ILE 55 2HD1 ILE 55 27.772 -9.180 17.006 448 H LYS 56 H LYS 56 24.628 -12.744 15.406 449 HA LYS 56 HA LYS 56 25.792 -15.126 14.269 450 HB2 LYS 56 2HB LYS 56 25.202 -14.815 16.647 451 HB3 LYS 56 3HB LYS 56 23.489 -14.679 16.211 452 HG2 LYS 56 2HG LYS 56 23.569 -17.007 15.305 453 HG3 LYS 56 3HG LYS 56 25.266 -17.128 15.830 454 HD2 LYS 56 2HD LYS 56 22.869 -16.564 17.626 455 HD3 LYS 56 3HD LYS 56 23.696 -18.131 17.486 456 HE2 LYS 56 2HE LYS 56 25.784 -17.122 18.319 457 HE3 LYS 56 3HE LYS 56 24.999 -15.532 18.408 458 HZ1 LYS 56 3HZ LYS 56 23.461 -16.447 19.991 459 HZ2 LYS 56 1HZ LYS 56 24.226 -17.905 19.955 460 HZ3 LYS 56 2HZ LYS 56 25.007 -16.580 20.531 461 H ALA 57 H ALA 57 22.734 -13.336 13.870 462 HA ALA 57 HA ALA 57 21.358 -15.442 12.487 463 HB1 ALA 57 1HB ALA 57 20.132 -13.602 13.503 464 HB2 ALA 57 2HB ALA 57 20.962 -12.423 12.452 465 HB3 ALA 57 3HB ALA 57 19.842 -13.612 11.755 466 H TYR 58 H TYR 58 23.312 -12.600 11.331 467 HA TYR 58 HA TYR 58 22.716 -12.963 8.597 468 HB2 TYR 58 2HB TYR 58 23.824 -10.984 9.657 469 HB3 TYR 58 3HB TYR 58 25.285 -11.949 9.875 470 HD1 TYR 58 HD1 TYR 58 22.872 -11.007 7.141 471 HD2 TYR 58 HD2 TYR 58 26.948 -11.791 8.271 472 HE1 TYR 58 HE1 TYR 58 23.610 -10.360 4.875 473 HE2 TYR 58 HE2 TYR 58 27.702 -11.174 5.988 474 HH TYR 58 HH TYR 58 25.407 -10.117 3.442 475 H ARG 59 H ARG 59 25.214 -14.461 10.645 476 HA ARG 59 HA ARG 59 26.620 -15.755 8.476 477 HB2 ARG 59 2HB ARG 59 26.521 -16.226 11.479 478 HB3 ARG 59 3HB ARG 59 27.678 -17.007 10.374 479 HG2 ARG 59 2HG ARG 59 28.657 -14.890 9.773 480 HG3 ARG 59 3HG ARG 59 27.397 -13.977 10.636 481 HD2 ARG 59 2HD ARG 59 28.110 -14.891 12.770 482 HD3 ARG 59 3HD ARG 59 29.269 -15.962 11.960 483 HE ARG 59 HE ARG 59 29.883 -13.307 11.203 484 HH11 ARG 59 1HH1 ARG 59 29.880 -15.289 14.130 485 HH12 ARG 59 2HH1 ARG 59 31.171 -14.384 14.889 486 HH21 ARG 59 1HH2 ARG 59 31.556 -12.144 12.211 487 HH22 ARG 59 2HH2 ARG 59 32.127 -12.606 13.796 488 H ALA 60 H ALA 60 23.809 -16.550 10.429 489 HA ALA 60 HA ALA 60 23.759 -19.323 9.416 490 HB1 ALA 60 1HB ALA 60 21.898 -17.808 11.291 491 HB2 ALA 60 2HB ALA 60 21.831 -19.549 10.924 492 HB3 ALA 60 3HB ALA 60 23.233 -18.873 11.781 493 H LEU 61 H LEU 61 22.652 -16.215 8.447 494 HA LEU 61 HA LEU 61 20.114 -17.016 7.349 495 HB2 LEU 61 2HB LEU 61 20.825 -14.698 8.164 496 HB3 LEU 61 3HB LEU 61 21.819 -14.577 6.697 497 HG LEU 61 HG LEU 61 19.727 -14.938 5.339 498 HD11 LEU 61 1HD1 LEU 61 18.479 -14.672 8.100 499 HD12 LEU 61 2HD1 LEU 61 17.568 -14.520 6.570 500 HD13 LEU 61 3HD1 LEU 61 18.319 -16.072 7.010 501 HD21 LEU 61 3HD2 LEU 61 20.640 -12.702 5.813 502 HD22 LEU 61 1HD2 LEU 61 18.859 -12.669 5.773 503 HD23 LEU 61 2HD2 LEU 61 19.718 -12.630 7.336 504 H ASP 62 H ASP 62 23.450 -16.931 6.231 505 HA ASP 62 HA ASP 62 22.890 -17.124 3.420 506 HB2 ASP 62 2HB ASP 62 25.057 -16.428 4.411 507 HB3 ASP 62 3HB ASP 62 25.287 -18.067 5.038 508 H SER 63 H SER 63 22.413 -19.285 6.040 509 HA SER 63 HA SER 63 22.363 -21.644 4.229 510 HB2 SER 63 2HB SER 63 22.630 -21.485 7.252 511 HB3 SER 63 3HB SER 63 22.605 -22.975 6.278 512 HG SER 63 HG SER 63 24.737 -22.269 6.747 513 H PHE 64 H PHE 64 20.297 -19.340 5.522 514 HA PHE 64 HA PHE 64 18.166 -21.102 6.376 515 HB2 PHE 64 2HB PHE 64 18.334 -18.761 7.130 516 HB3 PHE 64 3HB PHE 64 18.137 -18.202 5.472 517 HD1 PHE 64 HD1 PHE 64 16.260 -20.851 7.403 518 HD2 PHE 64 HD2 PHE 64 16.117 -17.056 5.384 519 HE1 PHE 64 HE1 PHE 64 13.800 -20.775 7.714 520 HE2 PHE 64 HE2 PHE 64 13.642 -16.982 5.725 521 HZ PHE 64 HZ PHE 64 12.503 -18.841 6.893 522 H ARG 65 H ARG 65 16.625 -22.104 5.167 523 HA ARG 65 HA ARG 65 16.698 -21.597 2.228 524 HB2 ARG 65 2HB ARG 65 17.807 -23.803 3.466 525 HB3 ARG 65 3HB ARG 65 16.165 -24.365 3.140 526 HG2 ARG 65 2HG ARG 65 17.144 -24.938 1.147 527 HG3 ARG 65 3HG ARG 65 16.665 -23.286 0.727 528 HD2 ARG 65 2HD ARG 65 19.395 -24.245 1.691 529 HD3 ARG 65 3HD ARG 65 18.999 -23.687 0.055 530 HE ARG 65 HE ARG 65 18.368 -21.552 1.747 531 HH11 ARG 65 1HH1 ARG 65 21.259 -23.415 0.933 532 HH12 ARG 65 2HH1 ARG 65 22.347 -22.092 1.298 533 HH21 ARG 65 1HH2 ARG 65 19.789 -19.870 2.205 534 HH22 ARG 65 2HH2 ARG 65 21.518 -20.083 2.008 535 H GLY 66 H GLY 66 14.752 -21.451 4.923 536 HA2 GLY 66 2HA GLY 66 12.330 -22.595 3.813 537 HA3 GLY 66 3HA GLY 66 12.462 -21.510 5.215 538 H ASP 67 H ASP 67 13.809 -19.369 4.028 539 HA ASP 67 HA ASP 67 13.392 -17.386 3.099 540 HB2 ASP 67 2HB ASP 67 12.719 -19.112 0.704 541 HB3 ASP 67 3HB ASP 67 13.161 -17.400 0.657 542 H SER 68 H SER 68 10.894 -18.772 4.308 543 HA SER 68 HA SER 68 9.000 -16.747 3.259 544 HB2 SER 68 2HB SER 68 8.384 -19.714 3.569 545 HB3 SER 68 3HB SER 68 7.193 -18.447 3.208 546 HG SER 68 HG SER 68 7.951 -19.514 1.329 547 H ALA 69 H ALA 69 10.575 -17.997 5.899 548 HA ALA 69 HA ALA 69 8.497 -16.945 7.709 549 HB1 ALA 69 1HB ALA 69 9.809 -19.678 8.019 550 HB2 ALA 69 2HB ALA 69 8.732 -18.904 9.208 551 HB3 ALA 69 3HB ALA 69 8.105 -19.375 7.611 552 H PHE 70 H PHE 70 10.503 -15.378 7.104 553 HA PHE 70 HA PHE 70 12.974 -15.894 8.452 554 HB2 PHE 70 2HB PHE 70 12.822 -14.342 6.582 555 HB3 PHE 70 3HB PHE 70 11.667 -13.339 7.461 556 HD1 PHE 70 HD1 PHE 70 15.151 -14.725 7.809 557 HD2 PHE 70 HD2 PHE 70 12.448 -11.480 8.636 558 HE1 PHE 70 HE1 PHE 70 17.000 -13.441 8.841 559 HE2 PHE 70 HE2 PHE 70 14.301 -10.202 9.666 560 HZ PHE 70 HZ PHE 70 16.585 -11.188 9.771 561 H TYR 71 H TYR 71 9.921 -14.350 9.549 562 HA TYR 71 HA TYR 71 11.200 -13.017 11.758 563 HB2 TYR 71 2HB TYR 71 8.934 -12.597 12.553 564 HB3 TYR 71 3HB TYR 71 9.130 -12.189 10.852 565 HD1 TYR 71 HD1 TYR 71 7.623 -14.577 13.227 566 HD2 TYR 71 HD2 TYR 71 7.899 -13.345 9.121 567 HE1 TYR 71 HE1 TYR 71 5.627 -15.955 12.685 568 HE2 TYR 71 HE2 TYR 71 5.915 -14.733 8.561 569 HH TYR 71 HH TYR 71 4.188 -16.652 11.045 570 H THR 72 H THR 72 9.417 -16.172 11.518 571 HA THR 72 HA THR 72 9.641 -16.699 14.342 572 HB THR 72 HB THR 72 9.374 -18.652 12.019 573 HG1 THR 72 1HG THR 72 7.166 -18.437 12.453 574 HG21 THR 72 1HG2 THR 72 8.658 -18.856 14.976 575 HG22 THR 72 2HG2 THR 72 8.250 -20.066 13.741 576 HG23 THR 72 3HG2 THR 72 9.951 -19.755 14.146 577 H TRP 73 H TRP 73 11.687 -17.221 11.507 578 HA TRP 73 HA TRP 73 13.563 -19.003 12.776 579 HB2 TRP 73 2HB TRP 73 13.193 -18.969 10.375 580 HB3 TRP 73 3HB TRP 73 13.641 -17.263 10.290 581 HD1 TRP 73 HD1 TRP 73 15.122 -20.715 10.337 582 HE1 TRP 73 HE1 TRP 73 17.653 -20.607 9.993 583 HE3 TRP 73 HE3 TRP 73 15.773 -15.646 10.735 584 HZ2 TRP 73 HZ2 TRP 73 19.713 -18.590 9.995 585 HZ3 TRP 73 HZ3 TRP 73 18.032 -14.678 10.587 586 HH2 TRP 73 HH2 TRP 73 20.005 -16.135 10.249 587 H LEU 74 H LEU 74 13.205 -15.478 12.573 588 HA LEU 74 HA LEU 74 15.940 -15.004 13.483 589 HB2 LEU 74 2HB LEU 74 14.858 -13.493 11.869 590 HB3 LEU 74 3HB LEU 74 13.559 -13.169 13.031 591 HG LEU 74 HG LEU 74 15.233 -12.176 14.597 592 HD11 LEU 74 1HD1 LEU 74 17.166 -12.591 12.276 593 HD12 LEU 74 2HD1 LEU 74 17.492 -11.622 13.729 594 HD13 LEU 74 3HD1 LEU 74 17.257 -13.370 13.879 595 HD21 LEU 74 3HD2 LEU 74 15.584 -10.120 13.325 596 HD22 LEU 74 1HD2 LEU 74 15.295 -10.988 11.800 597 HD23 LEU 74 2HD2 LEU 74 13.974 -10.794 12.978 598 H TYR 75 H TYR 75 12.604 -14.956 14.847 599 HA TYR 75 HA TYR 75 13.282 -13.692 17.300 600 HB2 TYR 75 2HB TYR 75 11.191 -15.824 16.713 601 HB3 TYR 75 3HB TYR 75 11.258 -14.846 18.177 602 HD1 TYR 75 HD1 TYR 75 12.115 -12.262 16.382 603 HD2 TYR 75 HD2 TYR 75 8.879 -15.098 16.385 604 HE1 TYR 75 HE1 TYR 75 10.643 -10.575 15.344 605 HE2 TYR 75 HE2 TYR 75 7.398 -13.408 15.317 606 HH TYR 75 HH TYR 75 8.560 -10.114 14.522 607 H ARG 76 H ARG 76 13.704 -17.063 16.211 608 HA ARG 76 HA ARG 76 14.309 -17.969 18.904 609 HB2 ARG 76 2HB ARG 76 14.864 -20.087 17.903 610 HB3 ARG 76 3HB ARG 76 13.333 -19.484 17.247 611 HG2 ARG 76 2HG ARG 76 14.469 -18.753 15.197 612 HG3 ARG 76 3HG ARG 76 16.044 -19.245 15.869 613 HD2 ARG 76 2HD ARG 76 15.158 -21.578 16.082 614 HD3 ARG 76 3HD ARG 76 13.687 -21.054 15.235 615 HE ARG 76 HE ARG 76 15.865 -20.279 13.635 616 HH11 ARG 76 1HH1 ARG 76 14.446 -23.286 14.846 617 HH12 ARG 76 2HH1 ARG 76 15.013 -24.237 13.492 618 HH21 ARG 76 1HH2 ARG 76 16.613 -21.557 11.895 619 HH22 ARG 76 2HH2 ARG 76 16.226 -23.259 11.824 620 H ILE 77 H ILE 77 16.217 -16.427 16.357 621 HA ILE 77 HA ILE 77 18.752 -17.419 17.319 622 HB ILE 77 HB ILE 77 18.197 -14.766 15.942 623 HG12 ILE 77 2HG1 ILE 77 17.277 -16.530 14.538 624 HG13 ILE 77 3HG1 ILE 77 18.724 -15.817 13.821 625 HG21 ILE 77 1HG2 ILE 77 20.416 -14.891 16.920 626 HG22 ILE 77 2HG2 ILE 77 20.686 -16.498 16.212 627 HG23 ILE 77 3HG2 ILE 77 20.562 -15.064 15.166 628 HD11 ILE 77 3HD1 ILE 77 18.685 -18.264 13.538 629 HD12 ILE 77 1HD1 ILE 77 20.069 -17.763 14.525 630 HD13 ILE 77 2HD1 ILE 77 18.627 -18.479 15.300 631 H ALA 78 H ALA 78 16.620 -14.677 18.180 632 HA ALA 78 HA ALA 78 18.667 -13.360 19.732 633 HB1 ALA 78 1HB ALA 78 15.652 -12.955 19.615 634 HB2 ALA 78 2HB ALA 78 16.826 -11.828 20.340 635 HB3 ALA 78 3HB ALA 78 16.855 -12.142 18.591 636 H VAL 79 H VAL 79 15.903 -15.524 20.570 637 HA VAL 79 HA VAL 79 16.357 -15.082 23.412 638 HB VAL 79 HB VAL 79 14.145 -15.593 22.588 639 HG11 VAL 79 1HG1 VAL 79 15.234 -18.339 21.857 640 HG12 VAL 79 2HG1 VAL 79 13.544 -17.813 21.762 641 HG13 VAL 79 3HG1 VAL 79 14.765 -17.073 20.694 642 HG21 VAL 79 3HG2 VAL 79 15.221 -17.910 24.253 643 HG22 VAL 79 1HG2 VAL 79 14.834 -16.302 24.891 644 HG23 VAL 79 2HG2 VAL 79 13.546 -17.323 24.200 645 H ASN 80 H ASN 80 17.503 -17.447 20.998 646 HA ASN 80 HA ASN 80 18.607 -19.185 23.053 647 HB2 ASN 80 2HB ASN 80 19.039 -18.981 20.045 648 HB3 ASN 80 3HB ASN 80 19.796 -20.211 21.066 649 HD21 ASN 80 2HD2 ASN 80 18.259 -21.100 19.016 650 HD22 ASN 80 1HD2 ASN 80 16.755 -21.762 19.630 651 H THR 81 H THR 81 19.633 -16.225 21.478 652 HA THR 81 HA THR 81 22.442 -16.639 22.131 653 HB THR 81 HB THR 81 20.906 -14.152 21.271 654 HG1 THR 81 1HG THR 81 21.019 -15.662 19.660 655 HG21 THR 81 1HG2 THR 81 22.978 -13.520 22.474 656 HG22 THR 81 2HG2 THR 81 23.906 -14.676 21.501 657 HG23 THR 81 3HG2 THR 81 23.153 -13.255 20.730 658 H ALA 82 H ALA 82 19.589 -15.245 23.710 659 HA ALA 82 HA ALA 82 21.077 -13.885 25.780 660 HB1 ALA 82 1HB ALA 82 18.191 -14.868 25.654 661 HB2 ALA 82 2HB ALA 82 18.834 -13.723 26.844 662 HB3 ALA 82 3HB ALA 82 18.778 -13.272 25.122 663 H LYS 83 H LYS 83 19.863 -17.175 25.275 664 HA LYS 83 HA LYS 83 20.230 -17.942 28.063 665 HB2 LYS 83 2HB LYS 83 19.651 -19.499 25.521 666 HB3 LYS 83 3HB LYS 83 19.759 -20.232 27.135 667 HG2 LYS 83 2HG LYS 83 17.937 -18.819 27.959 668 HG3 LYS 83 3HG LYS 83 17.868 -17.951 26.416 669 HD2 LYS 83 2HD LYS 83 17.254 -20.054 25.251 670 HD3 LYS 83 3HD LYS 83 17.322 -20.923 26.803 671 HE2 LYS 83 2HE LYS 83 15.555 -19.457 27.710 672 HE3 LYS 83 3HE LYS 83 15.485 -18.576 26.179 673 HZ1 LYS 83 3HZ LYS 83 14.816 -20.614 25.103 674 HZ2 LYS 83 1HZ LYS 83 14.880 -21.438 26.522 675 HZ3 LYS 83 2HZ LYS 83 13.773 -20.241 26.318 676 H ASN 84 H ASN 84 22.233 -18.023 25.093 677 HA ASN 84 HA ASN 84 24.201 -19.645 26.533 678 HB2 ASN 84 2HB ASN 84 25.401 -19.847 24.606 679 HB3 ASN 84 3HB ASN 84 23.740 -19.767 24.005 680 HD21 ASN 84 2HD2 ASN 84 26.587 -17.643 24.716 681 HD22 ASN 84 1HD2 ASN 84 26.348 -16.604 23.323 682 H TYR 85 H TYR 85 23.374 -16.305 26.274 683 HA TYR 85 HA TYR 85 26.049 -15.270 26.729 684 HB2 TYR 85 2HB TYR 85 24.262 -14.018 25.581 685 HB3 TYR 85 3HB TYR 85 23.286 -14.034 27.053 686 HD1 TYR 85 HD2 TYR 85 26.393 -12.741 25.489 687 HD2 TYR 85 HD1 TYR 85 23.665 -12.440 28.804 688 HE1 TYR 85 HE2 TYR 85 27.458 -10.611 26.163 689 HE2 TYR 85 HE1 TYR 85 24.726 -10.314 29.494 690 HH TYR 85 HH TYR 85 26.322 -8.735 29.005 691 H LEU 86 H LEU 86 23.226 -16.125 28.759 692 HA LEU 86 HA LEU 86 24.537 -15.076 31.158 693 HB2 LEU 86 2HB LEU 86 21.981 -16.662 30.734 694 HB3 LEU 86 3HB LEU 86 22.541 -16.045 32.302 695 HG LEU 86 HG LEU 86 21.861 -14.330 29.879 696 HD11 LEU 86 1HD1 LEU 86 19.983 -13.594 31.334 697 HD12 LEU 86 2HD1 LEU 86 19.894 -15.334 30.963 698 HD13 LEU 86 3HD1 LEU 86 20.474 -14.789 32.553 699 HD21 LEU 86 3HD2 LEU 86 22.084 -12.447 31.509 700 HD22 LEU 86 1HD2 LEU 86 22.713 -13.593 32.711 701 HD23 LEU 86 2HD2 LEU 86 23.631 -13.268 31.224 702 H VAL 87 H VAL 87 24.350 -18.246 29.547 703 HA VAL 87 HA VAL 87 25.270 -19.589 31.973 704 HB VAL 87 HB VAL 87 23.839 -20.638 30.179 705 HG11 VAL 87 1HG1 VAL 87 25.220 -19.777 28.255 706 HG12 VAL 87 2HG1 VAL 87 26.496 -20.927 28.709 707 HG13 VAL 87 3HG1 VAL 87 24.907 -21.530 28.197 708 HG21 VAL 87 3HG2 VAL 87 25.016 -21.945 31.919 709 HG22 VAL 87 1HG2 VAL 87 24.927 -22.831 30.380 710 HG23 VAL 87 2HG2 VAL 87 26.449 -22.056 30.869 711 H ALA 88 H ALA 88 26.707 -17.969 29.194 712 HA ALA 88 HA ALA 88 29.287 -19.222 29.477 713 HB1 ALA 88 1HB ALA 88 30.011 -17.406 27.930 714 HB2 ALA 88 2HB ALA 88 28.532 -18.215 27.357 715 HB3 ALA 88 3HB ALA 88 28.436 -16.615 28.137 716 H GLN 89 H GLN 89 27.609 -16.746 31.205 717 HA GLN 89 HA GLN 89 30.157 -15.861 32.485 718 HB2 GLN 89 2HB GLN 89 27.436 -14.518 32.325 719 HB3 GLN 89 3HB GLN 89 28.855 -13.881 33.188 720 HG2 GLN 89 2HG GLN 89 30.133 -13.831 31.070 721 HG3 GLN 89 3HG GLN 89 28.735 -14.481 30.199 722 HE21 GLN 89 2HE2 GLN 89 26.828 -13.187 29.947 723 HE22 GLN 89 1HE2 GLN 89 26.911 -11.443 30.102 724 H GLY 90 H GLY 90 27.212 -17.656 32.945 725 HA2 GLY 90 2HA GLY 90 27.242 -17.483 35.858 726 HA3 GLY 90 3HA GLY 90 26.232 -18.536 34.845 727 H ARG 91 H ARG 91 28.947 -19.286 33.443 728 HA ARG 91 HA ARG 91 29.785 -21.310 35.467 729 HB2 ARG 91 2HB ARG 91 29.962 -21.364 32.431 730 HB3 ARG 91 3HB ARG 91 30.549 -22.634 33.505 731 HG2 ARG 91 2HG ARG 91 27.649 -21.718 33.260 732 HG3 ARG 91 3HG ARG 91 28.335 -23.186 32.554 733 HD2 ARG 91 2HD ARG 91 28.158 -22.558 35.533 734 HD3 ARG 91 3HD ARG 91 27.114 -23.669 34.625 735 HE ARG 91 HE ARG 91 29.851 -24.413 34.258 736 HH11 ARG 91 1HH1 ARG 91 27.288 -24.451 36.693 737 HH12 ARG 91 2HH1 ARG 91 27.930 -25.848 37.521 738 HH21 ARG 91 1HH2 ARG 91 30.672 -26.239 35.354 739 HH22 ARG 91 2HH2 ARG 91 29.841 -26.859 36.762 740 H ARG 92 H ARG 92 30.722 -18.361 34.458 741 HA ARG 92 HA ARG 92 33.546 -18.872 33.916 742 HB2 ARG 92 2HB ARG 92 32.287 -17.017 32.889 743 HB3 ARG 92 3HB ARG 92 31.999 -16.312 34.492 744 HG2 ARG 92 2HG ARG 92 34.395 -15.928 34.793 745 HG3 ARG 92 3HG ARG 92 34.756 -16.790 33.283 746 HD2 ARG 92 2HD ARG 92 34.817 -14.354 32.949 747 HD3 ARG 92 3HD ARG 92 33.523 -15.106 31.995 748 HE ARG 92 HE ARG 92 32.658 -14.142 34.615 749 HH11 ARG 92 1HH1 ARG 92 33.208 -13.235 31.242 750 HH12 ARG 92 2HH1 ARG 92 32.064 -11.907 31.294 751 HH21 ARG 92 1HH2 ARG 92 31.165 -12.413 34.642 752 HH22 ARG 92 2HH2 ARG 92 30.916 -11.451 33.206 753 H LEU 93 H LEU 93 31.561 -18.387 36.749 754 HA LEU 93 HA LEU 93 33.866 -17.701 38.444 755 HB2 LEU 93 2HB LEU 93 31.664 -16.623 38.747 756 HB3 LEU 93 3HB LEU 93 30.926 -18.199 39.068 757 HG LEU 93 HG LEU 93 32.297 -18.445 41.107 758 HD11 LEU 93 1HD1 LEU 93 33.355 -15.677 40.368 759 HD12 LEU 93 2HD1 LEU 93 33.623 -16.501 41.921 760 HD13 LEU 93 3HD1 LEU 93 34.306 -17.183 40.436 761 HD21 LEU 93 3HD2 LEU 93 30.884 -15.761 40.898 762 HD22 LEU 93 1HD2 LEU 93 30.112 -17.331 41.239 763 HD23 LEU 93 2HD2 LEU 93 31.255 -16.630 42.406 764 H GLU 94 H GLU 94 32.314 -20.519 37.230 765 HA GLU 94 HA GLU 94 32.895 -22.217 39.532 766 HB2 GLU 94 2HB GLU 94 31.968 -22.863 36.709 767 HB3 GLU 94 3HB GLU 94 32.037 -24.013 38.056 768 HG2 GLU 94 2HG GLU 94 30.341 -21.480 37.975 769 HG3 GLU 94 3HG GLU 94 29.751 -23.119 37.710 770 H LEU 95 H LEU 95 34.906 -20.783 37.360 771 HA LEU 95 HA LEU 95 36.536 -23.111 36.654 772 HB2 LEU 95 2HB LEU 95 37.016 -20.127 36.294 773 HB3 LEU 95 3HB LEU 95 37.951 -21.428 35.547 774 HG LEU 95 HG LEU 95 34.997 -20.859 35.065 775 HD11 LEU 95 1HD1 LEU 95 37.449 -20.498 33.290 776 HD12 LEU 95 2HD1 LEU 95 35.763 -20.184 32.820 777 HD13 LEU 95 3HD1 LEU 95 36.536 -19.191 34.076 778 HD21 LEU 95 3HD2 LEU 95 35.478 -23.261 34.832 779 HD22 LEU 95 1HD2 LEU 95 35.235 -22.527 33.235 780 HD23 LEU 95 2HD2 LEU 95 36.880 -22.897 33.799 781 H VAL 96 H VAL 96 36.178 -21.230 39.448 782 HA VAL 96 HA VAL 96 38.831 -22.096 40.419 783 HB VAL 96 HB VAL 96 39.044 -19.907 41.608 784 HG11 VAL 96 1HG1 VAL 96 38.943 -19.700 38.572 785 HG12 VAL 96 2HG1 VAL 96 39.873 -18.658 39.668 786 HG13 VAL 96 3HG1 VAL 96 40.290 -20.378 39.520 787 HG21 VAL 96 3HG2 VAL 96 36.830 -18.993 39.715 788 HG22 VAL 96 1HG2 VAL 96 36.673 -19.183 41.476 789 HG23 VAL 96 2HG2 VAL 96 37.779 -17.968 40.810 790 HA PRO 97 HA PRO 97 36.375 -23.222 43.944 791 HB2 PRO 97 2HB PRO 97 38.276 -23.572 45.840 792 HB3 PRO 97 3HB PRO 97 38.243 -24.604 44.371 793 HG2 PRO 97 2HG PRO 97 39.911 -22.111 44.847 794 HG3 PRO 97 3HG PRO 97 40.477 -23.720 44.292 795 HD2 PRO 97 2HD PRO 97 39.900 -21.686 42.553 796 HD3 PRO 97 3HD PRO 97 39.561 -23.395 42.142 797 H ARG 98 H ARG 98 37.979 -20.237 43.630 798 HA ARG 98 HA ARG 98 37.398 -19.241 46.324 799 HB2 ARG 98 2HB ARG 98 38.430 -17.822 43.837 800 HB3 ARG 98 3HB ARG 98 38.398 -17.156 45.475 801 HG2 ARG 98 2HG ARG 98 40.014 -19.565 44.530 802 HG3 ARG 98 3HG ARG 98 40.646 -17.958 44.904 803 HD2 ARG 98 2HD ARG 98 39.305 -19.842 46.886 804 HD3 ARG 98 3HD ARG 98 41.046 -19.542 46.750 805 HE ARG 98 HE ARG 98 39.873 -17.026 47.109 806 HH11 ARG 98 1HH1 ARG 98 40.096 -20.060 48.908 807 HH12 ARG 98 2HH1 ARG 98 39.994 -19.277 50.468 808 HH21 ARG 98 1HH2 ARG 98 39.728 -16.034 49.154 809 HH22 ARG 98 2HH2 ARG 98 39.773 -17.008 50.606 810 H GLY 99 H GLY 99 36.233 -17.148 46.573 811 HA2 GLY 99 2HA GLY 99 34.476 -15.704 46.179 812 HA3 GLY 99 3HA GLY 99 34.227 -16.447 44.587 813 H SER 100 H SER 100 34.315 -18.974 46.796 814 HA SER 100 HA SER 100 31.466 -18.759 47.571 815 HB2 SER 100 2HB SER 100 32.649 -21.064 45.976 816 HB3 SER 100 3HB SER 100 31.026 -21.034 46.709 817 HG SER 100 HG SER 100 30.991 -20.421 44.512 818 H HIS 101 H HIS 101 30.893 -20.048 49.340 819 HA HIS 101 HA HIS 101 32.805 -21.898 50.543 820 HB2 HIS 101 2HB HIS 101 33.617 -19.673 51.316 821 HB3 HIS 101 3HB HIS 101 32.008 -19.325 51.965 822 HD2 HIS 101 HD2 HIS 101 32.068 -19.568 54.526 823 HE1 HIS 101 HE1 HIS 101 34.567 -22.990 54.899 824 HE2 HIS 101 HE2 HIS 101 33.186 -21.275 56.175 825 H HIS 102 H HIS 102 31.827 -23.013 52.419 826 HA HIS 102 HA HIS 102 28.959 -22.559 52.878 827 HB2 HIS 102 2HB HIS 102 28.274 -24.771 52.265 828 HB3 HIS 102 3HB HIS 102 29.069 -24.041 50.867 829 HD2 HIS 102 HD2 HIS 102 31.494 -25.051 50.150 830 HE1 HIS 102 HE1 HIS 102 31.341 -28.488 52.653 831 HE2 HIS 102 HE2 HIS 102 32.568 -27.373 50.719 832 H HIS 103 H HIS 103 28.122 -24.097 54.557 833 HA HIS 103 HA HIS 103 30.194 -25.172 56.355 834 HB2 HIS 103 2HB HIS 103 29.767 -22.773 56.969 835 HB3 HIS 103 3HB HIS 103 28.076 -23.189 57.272 836 HD2 HIS 103 HD2 HIS 103 31.344 -25.050 58.407 837 HE1 HIS 103 HE1 HIS 103 29.091 -24.138 61.896 838 HE2 HIS 103 HE2 HIS 103 31.193 -25.272 61.004 839 H HIS 104 H HIS 104 28.201 -26.322 54.563 840 HA HIS 104 HA HIS 104 26.555 -27.859 54.443 841 HB2 HIS 104 2HB HIS 104 27.328 -28.469 57.309 842 HB3 HIS 104 3HB HIS 104 26.414 -29.520 56.221 843 HD2 HIS 104 HD2 HIS 104 27.797 -30.391 53.945 844 HE1 HIS 104 HE1 HIS 104 31.640 -29.955 55.712 845 HE2 HIS 104 HE2 HIS 104 30.346 -30.980 53.773 846 H HIS 105 H HIS 105 24.510 -28.804 55.688 847 HA HIS 105 HA HIS 105 23.054 -26.543 56.936 848 HB2 HIS 105 2HB HIS 105 21.171 -26.853 55.466 849 HB3 HIS 105 3HB HIS 105 22.610 -26.533 54.503 850 HD2 HIS 105 HD2 HIS 105 19.766 -28.282 53.811 851 HE1 HIS 105 HE1 HIS 105 22.590 -31.352 52.975 852 HE2 HIS 105 HE2 HIS 105 20.180 -30.589 52.638 853 H HIS 106 H HIS 106 24.233 -29.304 57.714 854 HA HIS 106 HA HIS 106 21.812 -30.247 59.144 855 HB2 HIS 106 2HB HIS 106 22.422 -32.559 58.696 856 HB3 HIS 106 3HB HIS 106 22.145 -31.692 57.183 857 HD2 HIS 106 HD2 HIS 106 24.867 -33.467 59.198 858 HE1 HIS 106 HE1 HIS 106 26.671 -32.362 55.510 859 HE2 HIS 106 HE2 HIS 106 26.972 -33.704 57.656 Start of MODEL 12 1 H1 MET 1 H1 MET 1 -1.983 -8.943 -3.380 2 H2 MET 1 H2 MET 1 -2.175 -7.646 -2.376 3 H3 MET 1 H3 MET 1 -1.084 -8.816 -2.007 4 HA MET 1 HA MET 1 0.254 -8.275 -3.899 5 HB2 MET 1 2HB MET 1 -1.817 -6.087 -4.324 6 HB3 MET 1 3HB MET 1 -0.269 -6.237 -5.186 7 HG2 MET 1 2HG MET 1 -0.956 -8.456 -6.024 8 HG3 MET 1 3HG MET 1 -2.520 -8.281 -5.211 9 HE1 MET 1 1HE MET 1 -3.760 -8.856 -7.444 10 HE2 MET 1 2HE MET 1 -3.467 -8.026 -8.985 11 HE3 MET 1 3HE MET 1 -2.189 -9.031 -8.267 12 H SER 2 H SER 2 1.780 -6.406 -3.921 13 HA SER 2 HA SER 2 1.661 -4.697 -1.501 14 HB2 SER 2 2HB SER 2 3.988 -6.515 -2.224 15 HB3 SER 2 3HB SER 2 3.964 -5.329 -0.899 16 HG SER 2 HG SER 2 2.249 -6.513 0.029 17 H GLU 3 H GLU 3 3.354 -2.998 -1.553 18 HA GLU 3 HA GLU 3 4.298 -2.376 -4.294 19 HB2 GLU 3 2HB GLU 3 3.579 -0.084 -4.081 20 HB3 GLU 3 3HB GLU 3 2.190 -1.152 -3.868 21 HG2 GLU 3 2HG GLU 3 3.764 0.132 -1.585 22 HG3 GLU 3 3HG GLU 3 2.273 0.780 -2.264 23 H GLN 4 H GLN 4 5.322 -3.168 -1.343 24 HA GLN 4 HA GLN 4 7.791 -1.586 -1.622 25 HB2 GLN 4 2HB GLN 4 6.432 -0.276 -0.120 26 HB3 GLN 4 3HB GLN 4 6.097 -1.688 0.903 27 HG2 GLN 4 2HG GLN 4 8.474 -1.804 1.536 28 HG3 GLN 4 3HG GLN 4 8.855 -0.488 0.413 29 HE21 GLN 4 2HE2 GLN 4 9.744 0.066 2.794 30 HE22 GLN 4 1HE2 GLN 4 8.689 1.144 3.691 31 H LEU 5 H LEU 5 9.551 -2.468 -0.357 32 HA LEU 5 HA LEU 5 9.707 -5.306 -0.741 33 HB2 LEU 5 2HB LEU 5 11.647 -3.478 0.713 34 HB3 LEU 5 3HB LEU 5 12.008 -5.019 -0.079 35 HG LEU 5 HG LEU 5 11.142 -2.422 -1.423 36 HD11 LEU 5 1HD1 LEU 5 13.492 -2.507 -0.630 37 HD12 LEU 5 2HD1 LEU 5 13.732 -4.026 -1.522 38 HD13 LEU 5 3HD1 LEU 5 13.405 -2.517 -2.409 39 HD21 LEU 5 3HD2 LEU 5 11.830 -5.117 -2.685 40 HD22 LEU 5 1HD2 LEU 5 10.215 -4.362 -2.651 41 HD23 LEU 5 2HD2 LEU 5 11.536 -3.603 -3.559 42 H THR 6 H THR 6 10.428 -6.847 0.811 43 HA THR 6 HA THR 6 9.469 -6.451 3.591 44 HB THR 6 HB THR 6 7.544 -7.300 2.364 45 HG1 THR 6 1HG THR 6 7.251 -9.206 3.489 46 HG21 THR 6 1HG2 THR 6 9.506 -9.378 1.352 47 HG22 THR 6 2HG2 THR 6 7.730 -9.548 1.217 48 HG23 THR 6 3HG2 THR 6 8.564 -8.218 0.391 49 H ASP 7 H ASP 7 9.865 -8.693 4.737 50 HA ASP 7 HA ASP 7 12.671 -9.100 4.817 51 HB2 ASP 7 2HB ASP 7 12.138 -10.945 6.339 52 HB3 ASP 7 3HB ASP 7 11.171 -9.508 6.704 53 H GLN 8 H GLN 8 10.280 -10.361 2.636 54 HA GLN 8 HA GLN 8 11.596 -12.863 2.070 55 HB2 GLN 8 2HB GLN 8 9.235 -12.464 1.502 56 HB3 GLN 8 3HB GLN 8 9.709 -11.177 0.378 57 HG2 GLN 8 2HG GLN 8 9.230 -13.255 -0.836 58 HG3 GLN 8 3HG GLN 8 10.918 -12.790 -1.017 59 HE21 GLN 8 2HE2 GLN 8 12.568 -13.992 0.104 60 HE22 GLN 8 1HE2 GLN 8 12.253 -15.617 0.686 61 H VAL 9 H VAL 9 11.589 -9.674 0.391 62 HA VAL 9 HA VAL 9 13.628 -10.589 -1.495 63 HB VAL 9 HB VAL 9 11.904 -9.202 -2.363 64 HG11 VAL 9 1HG1 VAL 9 12.604 -7.174 -0.219 65 HG12 VAL 9 2HG1 VAL 9 11.440 -6.936 -1.548 66 HG13 VAL 9 3HG1 VAL 9 11.113 -8.151 -0.306 67 HG21 VAL 9 3HG2 VAL 9 14.320 -7.376 -1.992 68 HG22 VAL 9 1HG2 VAL 9 14.220 -8.687 -3.200 69 HG23 VAL 9 2HG2 VAL 9 13.113 -7.300 -3.285 70 H LEU 10 H LEU 10 13.526 -8.769 1.539 71 HA LEU 10 HA LEU 10 16.143 -7.593 1.254 72 HB2 LEU 10 2HB LEU 10 14.129 -8.033 3.429 73 HB3 LEU 10 3HB LEU 10 15.797 -7.706 3.910 74 HG LEU 10 HG LEU 10 15.867 -5.618 2.810 75 HD11 LEU 10 1HD1 LEU 10 13.098 -6.168 1.679 76 HD12 LEU 10 2HD1 LEU 10 14.016 -4.651 1.540 77 HD13 LEU 10 3HD1 LEU 10 14.624 -6.110 0.745 78 HD21 LEU 10 3HD2 LEU 10 14.695 -5.702 4.998 79 HD22 LEU 10 1HD2 LEU 10 14.033 -4.417 3.960 80 HD23 LEU 10 2HD2 LEU 10 13.152 -5.956 4.154 81 H VAL 11 H VAL 11 14.983 -10.799 2.337 82 HA VAL 11 HA VAL 11 17.633 -11.473 3.376 83 HB VAL 11 HB VAL 11 15.120 -13.104 2.926 84 HG11 VAL 11 1HG1 VAL 11 16.341 -14.861 4.243 85 HG12 VAL 11 2HG1 VAL 11 16.998 -14.620 2.610 86 HG13 VAL 11 3HG1 VAL 11 17.843 -13.930 4.018 87 HG21 VAL 11 3HG2 VAL 11 16.647 -12.248 5.431 88 HG22 VAL 11 1HG2 VAL 11 15.175 -11.458 4.832 89 HG23 VAL 11 2HG2 VAL 11 15.116 -13.149 5.383 90 H GLU 12 H GLU 12 15.889 -11.743 0.283 91 HA GLU 12 HA GLU 12 17.791 -13.590 -0.893 92 HB2 GLU 12 2HB GLU 12 15.768 -11.621 -2.020 93 HB3 GLU 12 3HB GLU 12 16.798 -12.648 -3.040 94 HG2 GLU 12 2HG GLU 12 15.886 -14.662 -1.934 95 HG3 GLU 12 3HG GLU 12 14.842 -13.643 -0.929 96 H ARG 13 H ARG 13 17.541 -10.040 -0.588 97 HA ARG 13 HA ARG 13 19.585 -9.459 -2.519 98 HB2 ARG 13 2HB ARG 13 17.775 -7.934 -1.871 99 HB3 ARG 13 3HB ARG 13 18.415 -7.823 -0.232 100 HG2 ARG 13 2HG ARG 13 20.412 -6.725 -0.990 101 HG3 ARG 13 3HG ARG 13 20.024 -7.045 -2.699 102 HD2 ARG 13 2HD ARG 13 18.335 -5.337 -0.826 103 HD3 ARG 13 3HD ARG 13 19.515 -4.692 -1.988 104 HE ARG 13 HE ARG 13 17.821 -6.323 -3.484 105 HH11 ARG 13 1HH1 ARG 13 17.456 -3.464 -1.440 106 HH12 ARG 13 2HH1 ARG 13 16.052 -2.883 -2.301 107 HH21 ARG 13 1HH2 ARG 13 16.002 -5.539 -4.602 108 HH22 ARG 13 2HH2 ARG 13 15.243 -4.046 -4.098 109 H VAL 14 H VAL 14 19.661 -9.958 1.038 110 HA VAL 14 HA VAL 14 22.447 -9.198 1.240 111 HB VAL 14 HB VAL 14 22.325 -10.126 3.493 112 HG11 VAL 14 1HG1 VAL 14 19.914 -8.477 2.615 113 HG12 VAL 14 2HG1 VAL 14 20.411 -8.708 4.299 114 HG13 VAL 14 3HG1 VAL 14 21.500 -7.877 3.149 115 HG21 VAL 14 3HG2 VAL 14 19.547 -11.049 2.692 116 HG22 VAL 14 1HG2 VAL 14 20.929 -12.095 3.123 117 HG23 VAL 14 2HG2 VAL 14 20.204 -11.028 4.345 118 H GLN 15 H GLN 15 20.759 -12.164 0.364 119 HA GLN 15 HA GLN 15 23.121 -13.847 0.659 120 HB2 GLN 15 2HB GLN 15 20.427 -14.220 -0.692 121 HB3 GLN 15 3HB GLN 15 21.685 -15.468 -0.649 122 HG2 GLN 15 2HG GLN 15 21.668 -15.490 1.799 123 HG3 GLN 15 3HG GLN 15 20.506 -14.182 1.851 124 HE21 GLN 15 2HE2 GLN 15 19.858 -16.523 3.163 125 HE22 GLN 15 1HE2 GLN 15 18.602 -17.374 2.285 126 H LYS 16 H LYS 16 21.964 -11.557 -1.648 127 HA LYS 16 HA LYS 16 23.543 -12.691 -3.858 128 HB2 LYS 16 2HB LYS 16 21.597 -10.390 -3.605 129 HB3 LYS 16 3HB LYS 16 22.539 -10.685 -5.081 130 HG2 LYS 16 2HG LYS 16 21.620 -12.906 -5.341 131 HG3 LYS 16 3HG LYS 16 20.852 -12.843 -3.750 132 HD2 LYS 16 2HD LYS 16 19.452 -10.920 -4.552 133 HD3 LYS 16 3HD LYS 16 20.147 -11.143 -6.173 134 HE2 LYS 16 2HE LYS 16 19.320 -13.492 -6.182 135 HE3 LYS 16 3HE LYS 16 18.643 -13.259 -4.565 136 HZ1 LYS 16 3HZ LYS 16 17.215 -11.550 -5.494 137 HZ2 LYS 16 1HZ LYS 16 17.838 -11.793 -6.994 138 HZ3 LYS 16 2HZ LYS 16 16.976 -12.987 -6.259 139 H GLY 17 H GLY 17 24.346 -10.987 -1.165 140 HA2 GLY 17 2HA GLY 17 26.651 -10.456 -0.872 141 HA3 GLY 17 3HA GLY 17 26.755 -9.948 -2.565 142 H ASP 18 H ASP 18 23.875 -8.684 -1.318 143 HA ASP 18 HA ASP 18 25.166 -6.051 -0.900 144 HB2 ASP 18 2HB ASP 18 22.404 -7.017 -1.655 145 HB3 ASP 18 3HB ASP 18 22.647 -5.390 -1.036 146 H GLN 19 H GLN 19 25.990 -6.532 1.199 147 HA GLN 19 HA GLN 19 24.337 -7.441 3.344 148 HB2 GLN 19 2HB GLN 19 26.783 -7.651 3.226 149 HB3 GLN 19 3HB GLN 19 26.978 -5.906 3.343 150 HG2 GLN 19 2HG GLN 19 25.472 -7.468 5.468 151 HG3 GLN 19 3HG GLN 19 27.236 -7.395 5.480 152 HE21 GLN 19 2HE2 GLN 19 25.908 -6.428 7.668 153 HE22 GLN 19 1HE2 GLN 19 26.025 -4.678 7.707 154 H LYS 20 H LYS 20 24.643 -4.360 1.774 155 HA LYS 20 HA LYS 20 23.924 -2.602 3.887 156 HB2 LYS 20 2HB LYS 20 23.288 -1.086 2.083 157 HB3 LYS 20 3HB LYS 20 24.771 -1.943 1.643 158 HG2 LYS 20 2HG LYS 20 23.384 -3.576 0.322 159 HG3 LYS 20 3HG LYS 20 21.950 -2.590 0.676 160 HD2 LYS 20 2HD LYS 20 23.063 -0.636 -0.419 161 HD3 LYS 20 3HD LYS 20 24.443 -1.691 -0.823 162 HE2 LYS 20 2HE LYS 20 22.890 -3.191 -2.072 163 HE3 LYS 20 3HE LYS 20 21.553 -2.096 -1.704 164 HZ1 LYS 20 3HZ LYS 20 23.958 -1.395 -3.249 165 HZ2 LYS 20 1HZ LYS 20 22.470 -1.688 -3.877 166 HZ3 LYS 20 2HZ LYS 20 22.705 -0.377 -2.916 167 H ALA 21 H ALA 21 22.044 -4.995 2.109 168 HA ALA 21 HA ALA 21 19.492 -3.797 2.854 169 HB1 ALA 21 1HB ALA 21 20.196 -6.495 1.628 170 HB2 ALA 21 2HB ALA 21 18.558 -5.818 1.797 171 HB3 ALA 21 3HB ALA 21 19.755 -5.021 0.745 172 H PHE 22 H PHE 22 21.826 -5.927 4.351 173 HA PHE 22 HA PHE 22 19.889 -7.209 6.111 174 HB2 PHE 22 2HB PHE 22 22.075 -8.247 5.510 175 HB3 PHE 22 3HB PHE 22 22.904 -6.952 6.374 176 HD1 PHE 22 HD1 PHE 22 20.118 -9.442 6.908 177 HD2 PHE 22 HD2 PHE 22 23.518 -7.411 8.591 178 HE1 PHE 22 HE1 PHE 22 19.856 -10.737 8.992 179 HE2 PHE 22 HE2 PHE 22 23.242 -8.711 10.696 180 HZ PHE 22 HZ PHE 22 21.409 -10.371 10.889 181 H ASN 23 H ASN 23 22.063 -4.380 6.174 182 HA ASN 23 HA ASN 23 21.696 -3.656 8.911 183 HB2 ASN 23 2HB ASN 23 23.450 -2.654 7.636 184 HB3 ASN 23 3HB ASN 23 22.333 -2.188 6.345 185 HD21 ASN 23 2HD2 ASN 23 21.295 -0.256 6.404 186 HD22 ASN 23 1HD2 ASN 23 21.434 0.896 7.714 187 H LEU 24 H LEU 24 19.860 -2.907 5.942 188 HA LEU 24 HA LEU 24 17.923 -1.240 7.319 189 HB2 LEU 24 2HB LEU 24 17.907 -2.584 4.587 190 HB3 LEU 24 3HB LEU 24 16.728 -1.375 5.126 191 HG LEU 24 HG LEU 24 19.733 -0.882 4.935 192 HD11 LEU 24 1HD1 LEU 24 17.464 -0.050 3.078 193 HD12 LEU 24 2HD1 LEU 24 19.169 0.432 2.931 194 HD13 LEU 24 3HD1 LEU 24 18.705 -1.273 2.726 195 HD21 LEU 24 3HD2 LEU 24 17.373 0.993 5.385 196 HD22 LEU 24 1HD2 LEU 24 18.629 0.581 6.578 197 HD23 LEU 24 2HD2 LEU 24 19.059 1.502 5.125 198 H LEU 25 H LEU 25 18.321 -4.675 6.879 199 HA LEU 25 HA LEU 25 15.490 -5.267 7.347 200 HB2 LEU 25 2HB LEU 25 16.842 -6.684 5.866 201 HB3 LEU 25 3HB LEU 25 17.988 -7.003 7.168 202 HG LEU 25 HG LEU 25 16.186 -8.156 8.448 203 HD11 LEU 25 1HD1 LEU 25 14.558 -7.770 5.906 204 HD12 LEU 25 2HD1 LEU 25 14.098 -8.765 7.304 205 HD13 LEU 25 3HD1 LEU 25 14.212 -7.001 7.475 206 HD21 LEU 25 3HD2 LEU 25 17.714 -9.399 6.973 207 HD22 LEU 25 1HD2 LEU 25 16.094 -10.133 6.938 208 HD23 LEU 25 2HD2 LEU 25 16.635 -9.126 5.584 209 H VAL 26 H VAL 26 18.575 -5.457 9.257 210 HA VAL 26 HA VAL 26 17.181 -6.664 11.468 211 HB VAL 26 HB VAL 26 19.154 -6.330 12.767 212 HG11 VAL 26 1HG1 VAL 26 20.812 -7.472 11.388 213 HG12 VAL 26 2HG1 VAL 26 19.182 -8.140 11.112 214 HG13 VAL 26 3HG1 VAL 26 19.928 -7.055 9.915 215 HG21 VAL 26 3HG2 VAL 26 19.732 -4.047 12.214 216 HG22 VAL 26 1HG2 VAL 26 21.120 -5.109 11.917 217 HG23 VAL 26 2HG2 VAL 26 20.150 -4.524 10.544 218 H VAL 27 H VAL 27 17.546 -3.290 10.451 219 HA VAL 27 HA VAL 27 17.080 -2.245 13.096 220 HB VAL 27 HB VAL 27 18.151 -0.946 11.308 221 HG11 VAL 27 1HG1 VAL 27 16.800 0.087 9.538 222 HG12 VAL 27 2HG1 VAL 27 16.783 -1.682 9.398 223 HG13 VAL 27 3HG1 VAL 27 15.370 -0.826 10.075 224 HG21 VAL 27 3HG2 VAL 27 17.038 1.167 11.756 225 HG22 VAL 27 1HG2 VAL 27 15.561 0.326 12.273 226 HG23 VAL 27 2HG2 VAL 27 17.055 0.178 13.232 227 H ARG 28 H ARG 28 14.936 -3.499 10.560 228 HA ARG 28 HA ARG 28 12.498 -2.427 11.646 229 HB2 ARG 28 2HB ARG 28 12.879 -5.077 10.193 230 HB3 ARG 28 3HB ARG 28 11.405 -4.102 10.298 231 HG2 ARG 28 2HG ARG 28 12.573 -2.292 8.993 232 HG3 ARG 28 3HG ARG 28 13.984 -3.368 8.856 233 HD2 ARG 28 2HD ARG 28 12.715 -3.566 6.831 234 HD3 ARG 28 3HD ARG 28 12.528 -5.072 7.740 235 HE ARG 28 HE ARG 28 10.357 -3.684 8.578 236 HH11 ARG 28 1HH1 ARG 28 11.634 -4.227 5.323 237 HH12 ARG 28 2HH1 ARG 28 10.059 -4.118 4.567 238 HH21 ARG 28 1HH2 ARG 28 8.326 -3.576 7.565 239 HH22 ARG 28 2HH2 ARG 28 8.196 -3.748 5.831 240 H TYR 29 H TYR 29 14.561 -5.189 12.369 241 HA TYR 29 HA TYR 29 12.609 -6.225 14.351 242 HB2 TYR 29 2HB TYR 29 15.134 -7.386 13.136 243 HB3 TYR 29 3HB TYR 29 14.202 -8.160 14.404 244 HD1 TYR 29 HD1 TYR 29 13.919 -6.917 10.896 245 HD2 TYR 29 HD2 TYR 29 12.280 -9.410 13.985 246 HE1 TYR 29 HE1 TYR 29 12.309 -7.845 9.265 247 HE2 TYR 29 HE2 TYR 29 10.669 -10.370 12.368 248 HH TYR 29 HH TYR 29 10.564 -9.330 8.931 249 H GLN 30 H GLN 30 15.271 -4.091 14.333 250 HA GLN 30 HA GLN 30 16.673 -4.993 16.630 251 HB2 GLN 30 2HB GLN 30 17.446 -3.372 14.914 252 HB3 GLN 30 3HB GLN 30 16.335 -2.158 15.571 253 HG2 GLN 30 2HG GLN 30 17.543 -2.192 17.705 254 HG3 GLN 30 3HG GLN 30 18.564 -3.529 17.144 255 HE21 GLN 30 2HE2 GLN 30 19.639 -3.052 14.890 256 HE22 GLN 30 1HE2 GLN 30 20.390 -1.472 14.749 257 H HIS 31 H HIS 31 13.666 -3.155 16.255 258 HA HIS 31 HA HIS 31 13.534 -2.574 19.135 259 HB2 HIS 31 2HB HIS 31 12.706 -0.971 17.456 260 HB3 HIS 31 3HB HIS 31 11.519 -2.161 16.900 261 HD2 HIS 31 HD2 HIS 31 9.212 -2.140 18.101 262 HE1 HIS 31 HE1 HIS 31 10.204 0.228 21.489 263 HE2 HIS 31 HE2 HIS 31 8.311 -0.932 20.238 264 H LYS 32 H LYS 32 12.242 -4.979 16.836 265 HA LYS 32 HA LYS 32 10.216 -5.903 18.732 266 HB2 LYS 32 2HB LYS 32 11.165 -7.059 16.086 267 HB3 LYS 32 3HB LYS 32 9.753 -7.595 17.015 268 HG2 LYS 32 2HG LYS 32 8.805 -5.288 16.844 269 HG3 LYS 32 3HG LYS 32 10.162 -4.831 15.794 270 HD2 LYS 32 2HD LYS 32 8.129 -7.028 15.226 271 HD3 LYS 32 3HD LYS 32 8.143 -5.422 14.483 272 HE2 LYS 32 2HE LYS 32 10.372 -5.876 13.514 273 HE3 LYS 32 3HE LYS 32 10.363 -7.493 14.237 274 HZ1 LYS 32 3HZ LYS 32 8.416 -7.994 12.931 275 HZ2 LYS 32 1HZ LYS 32 8.430 -6.497 12.254 276 HZ3 LYS 32 2HZ LYS 32 9.660 -7.548 11.955 277 H VAL 33 H VAL 33 13.480 -6.900 17.738 278 HA VAL 33 HA VAL 33 13.386 -9.485 19.033 279 HB VAL 33 HB VAL 33 15.703 -7.698 18.136 280 HG11 VAL 33 1HG1 VAL 33 15.536 -10.670 18.653 281 HG12 VAL 33 2HG1 VAL 33 16.960 -9.779 18.036 282 HG13 VAL 33 3HG1 VAL 33 16.388 -9.514 19.722 283 HG21 VAL 33 3HG2 VAL 33 14.615 -10.201 16.806 284 HG22 VAL 33 1HG2 VAL 33 14.081 -8.572 16.331 285 HG23 VAL 33 2HG2 VAL 33 15.818 -9.046 16.190 286 H ALA 34 H ALA 34 14.469 -6.177 19.863 287 HA ALA 34 HA ALA 34 15.668 -6.857 22.355 288 HB1 ALA 34 1HB ALA 34 14.327 -4.267 21.451 289 HB2 ALA 34 2HB ALA 34 15.463 -4.435 22.814 290 HB3 ALA 34 3HB ALA 34 16.021 -4.705 21.150 291 H SER 35 H SER 35 12.299 -6.527 21.370 292 HA SER 35 HA SER 35 11.270 -6.018 24.026 293 HB2 SER 35 2HB SER 35 10.107 -5.418 21.905 294 HB3 SER 35 3HB SER 35 9.881 -7.148 21.565 295 HG SER 35 HG SER 35 8.076 -6.196 22.617 296 H LEU 36 H LEU 36 11.586 -8.962 21.950 297 HA LEU 36 HA LEU 36 10.355 -10.580 24.025 298 HB2 LEU 36 2HB LEU 36 10.539 -12.403 22.508 299 HB3 LEU 36 3HB LEU 36 10.080 -10.976 21.579 300 HG LEU 36 HG LEU 36 12.707 -10.788 21.167 301 HD11 LEU 36 1HD1 LEU 36 12.291 -13.776 21.678 302 HD12 LEU 36 2HD1 LEU 36 13.728 -13.041 20.941 303 HD13 LEU 36 3HD1 LEU 36 13.345 -12.728 22.643 304 HD21 LEU 36 3HD2 LEU 36 10.929 -12.875 19.848 305 HD22 LEU 36 1HD2 LEU 36 10.997 -11.140 19.442 306 HD23 LEU 36 2HD2 LEU 36 12.413 -12.178 19.161 307 H VAL 37 H VAL 37 13.659 -9.739 23.058 308 HA VAL 37 HA VAL 37 14.761 -11.923 24.636 309 HB VAL 37 HB VAL 37 15.677 -10.973 22.452 310 HG11 VAL 37 1HG1 VAL 37 17.178 -9.082 24.261 311 HG12 VAL 37 2HG1 VAL 37 17.127 -9.134 22.491 312 HG13 VAL 37 3HG1 VAL 37 15.701 -8.567 23.403 313 HG21 VAL 37 3HG2 VAL 37 17.578 -11.295 24.802 314 HG22 VAL 37 1HG2 VAL 37 16.812 -12.637 23.904 315 HG23 VAL 37 2HG2 VAL 37 17.956 -11.542 23.089 316 H SER 38 H SER 38 13.717 -8.681 25.295 317 HA SER 38 HA SER 38 15.376 -8.196 27.592 318 HB2 SER 38 2HB SER 38 14.037 -6.447 26.430 319 HB3 SER 38 3HB SER 38 12.549 -7.238 26.980 320 HG SER 38 HG SER 38 13.215 -5.517 28.346 321 H ARG 39 H ARG 39 12.932 -10.514 26.947 322 HA ARG 39 HA ARG 39 12.118 -10.872 29.739 323 HB2 ARG 39 2HB ARG 39 11.650 -12.635 27.317 324 HB3 ARG 39 3HB ARG 39 10.807 -12.722 28.879 325 HG2 ARG 39 2HG ARG 39 9.910 -10.429 28.512 326 HG3 ARG 39 3HG ARG 39 10.702 -10.385 26.920 327 HD2 ARG 39 2HD ARG 39 8.589 -12.383 27.801 328 HD3 ARG 39 3HD ARG 39 8.341 -11.018 26.698 329 HE ARG 39 HE ARG 39 10.453 -12.562 25.643 330 HH11 ARG 39 1HH1 ARG 39 7.003 -12.904 26.312 331 HH12 ARG 39 2HH1 ARG 39 6.748 -14.068 25.029 332 HH21 ARG 39 1HH2 ARG 39 10.092 -14.090 23.974 333 HH22 ARG 39 2HH2 ARG 39 8.491 -14.734 23.714 334 H TYR 40 H TYR 40 14.902 -11.642 27.993 335 HA TYR 40 HA TYR 40 15.409 -14.040 29.699 336 HB2 TYR 40 2HB TYR 40 16.305 -13.498 26.853 337 HB3 TYR 40 3HB TYR 40 16.821 -14.863 27.842 338 HD1 TYR 40 HD1 TYR 40 15.165 -16.610 28.539 339 HD2 TYR 40 HD2 TYR 40 14.174 -13.510 25.724 340 HE1 TYR 40 HE1 TYR 40 13.177 -17.905 27.817 341 HE2 TYR 40 HE2 TYR 40 12.214 -14.823 24.965 342 HH TYR 40 HH TYR 40 11.364 -17.980 26.433 343 H VAL 41 H VAL 41 16.458 -10.859 28.838 344 HA VAL 41 HA VAL 41 18.722 -11.170 30.700 345 HB VAL 41 HB VAL 41 20.094 -9.658 29.146 346 HG11 VAL 41 1HG1 VAL 41 19.580 -12.501 28.215 347 HG12 VAL 41 2HG1 VAL 41 21.039 -11.525 27.914 348 HG13 VAL 41 3HG1 VAL 41 20.634 -12.024 29.568 349 HG21 VAL 41 3HG2 VAL 41 19.671 -9.775 26.769 350 HG22 VAL 41 1HG2 VAL 41 18.243 -10.799 27.024 351 HG23 VAL 41 2HG2 VAL 41 18.235 -9.104 27.575 352 HA PRO 42 HA PRO 42 17.154 -7.366 32.219 353 HB2 PRO 42 2HB PRO 42 19.360 -6.124 33.239 354 HB3 PRO 42 3HB PRO 42 18.686 -7.631 33.945 355 HG2 PRO 42 2HG PRO 42 20.956 -7.386 31.944 356 HG3 PRO 42 3HG PRO 42 20.958 -8.276 33.505 357 HD2 PRO 42 2HD PRO 42 20.446 -9.565 31.187 358 HD3 PRO 42 3HD PRO 42 19.486 -9.941 32.651 359 H SER 43 H SER 43 17.275 -4.964 31.964 360 HA SER 43 HA SER 43 17.364 -4.357 29.186 361 HB2 SER 43 2HB SER 43 16.765 -2.083 29.941 362 HB3 SER 43 3HB SER 43 15.789 -3.337 30.737 363 HG SER 43 HG SER 43 16.603 -1.783 32.224 364 H GLY 44 H GLY 44 19.934 -4.430 31.468 365 HA2 GLY 44 2HA GLY 44 21.480 -2.292 30.164 366 HA3 GLY 44 3HA GLY 44 21.988 -3.325 31.512 367 H ASP 45 H ASP 45 20.973 -5.735 29.789 368 HA ASP 45 HA ASP 45 23.407 -5.910 28.073 369 HB2 ASP 45 2HB ASP 45 21.968 -8.059 29.664 370 HB3 ASP 45 3HB ASP 45 23.314 -8.340 28.545 371 H VAL 46 H VAL 46 20.069 -5.595 27.947 372 HA VAL 46 HA VAL 46 19.440 -7.618 26.048 373 HB VAL 46 HB VAL 46 17.855 -6.417 27.564 374 HG11 VAL 46 1HG1 VAL 46 16.772 -4.386 26.750 375 HG12 VAL 46 2HG1 VAL 46 18.476 -4.077 27.139 376 HG13 VAL 46 3HG1 VAL 46 17.961 -4.242 25.438 377 HG21 VAL 46 3HG2 VAL 46 16.012 -6.396 25.889 378 HG22 VAL 46 1HG2 VAL 46 17.215 -6.574 24.598 379 HG23 VAL 46 2HG2 VAL 46 17.030 -7.853 25.841 380 HA PRO 47 HA PRO 47 20.064 -4.386 22.647 381 HB2 PRO 47 2HB PRO 47 21.914 -2.435 22.824 382 HB3 PRO 47 3HB PRO 47 20.302 -2.254 23.594 383 HG2 PRO 47 2HG PRO 47 22.884 -3.155 24.902 384 HG3 PRO 47 3HG PRO 47 21.757 -1.879 25.461 385 HD2 PRO 47 2HD PRO 47 21.684 -4.432 26.398 386 HD3 PRO 47 3HD PRO 47 20.191 -3.468 26.200 387 H ASP 48 H ASP 48 22.743 -5.620 24.592 388 HA ASP 48 HA ASP 48 24.578 -5.781 22.330 389 HB2 ASP 48 2HB ASP 48 25.300 -5.402 24.692 390 HB3 ASP 48 3HB ASP 48 24.700 -7.017 25.108 391 H VAL 49 H VAL 49 22.182 -7.839 23.920 392 HA VAL 49 HA VAL 49 23.127 -10.263 22.600 393 HB VAL 49 HB VAL 49 20.640 -9.607 24.217 394 HG11 VAL 49 1HG1 VAL 49 20.304 -12.049 24.330 395 HG12 VAL 49 2HG1 VAL 49 20.148 -11.470 22.663 396 HG13 VAL 49 3HG1 VAL 49 21.646 -12.288 23.178 397 HG21 VAL 49 3HG2 VAL 49 22.797 -9.608 25.460 398 HG22 VAL 49 1HG2 VAL 49 21.785 -10.993 25.919 399 HG23 VAL 49 2HG2 VAL 49 23.161 -11.227 24.815 400 H VAL 50 H VAL 50 20.797 -7.667 21.911 401 HA VAL 50 HA VAL 50 19.552 -8.999 19.654 402 HB VAL 50 HB VAL 50 19.922 -6.085 20.442 403 HG11 VAL 50 1HG1 VAL 50 18.297 -7.283 18.156 404 HG12 VAL 50 2HG1 VAL 50 18.196 -5.598 18.712 405 HG13 VAL 50 3HG1 VAL 50 19.702 -6.201 17.991 406 HG21 VAL 50 3HG2 VAL 50 17.472 -7.896 20.368 407 HG22 VAL 50 1HG2 VAL 50 18.412 -7.524 21.838 408 HG23 VAL 50 2HG2 VAL 50 17.545 -6.231 20.984 409 H GLN 51 H GLN 51 22.536 -7.068 20.151 410 HA GLN 51 HA GLN 51 23.109 -6.871 17.326 411 HB2 GLN 51 2HB GLN 51 24.007 -5.313 19.021 412 HB3 GLN 51 3HB GLN 51 24.948 -6.641 19.739 413 HG2 GLN 51 2HG GLN 51 26.186 -6.938 17.651 414 HG3 GLN 51 3HG GLN 51 25.205 -5.699 16.852 415 HE21 GLN 51 2HE2 GLN 51 27.715 -5.130 16.581 416 HE22 GLN 51 1HE2 GLN 51 28.293 -3.939 17.729 417 H GLU 52 H GLU 52 24.148 -9.151 19.962 418 HA GLU 52 HA GLU 52 25.848 -10.640 18.199 419 HB2 GLU 52 2HB GLU 52 25.993 -10.698 20.676 420 HB3 GLU 52 3HB GLU 52 24.432 -11.560 20.735 421 HG2 GLU 52 2HG GLU 52 25.373 -13.415 19.449 422 HG3 GLU 52 3HG GLU 52 26.898 -12.549 19.243 423 H ALA 53 H ALA 53 22.353 -10.655 18.824 424 HA ALA 53 HA ALA 53 21.873 -13.211 17.594 425 HB1 ALA 53 1HB ALA 53 20.048 -10.806 17.997 426 HB2 ALA 53 2HB ALA 53 19.520 -12.447 17.568 427 HB3 ALA 53 3HB ALA 53 20.288 -12.148 19.143 428 H PHE 54 H PHE 54 22.045 -9.823 16.369 429 HA PHE 54 HA PHE 54 21.250 -10.604 13.692 430 HB2 PHE 54 2HB PHE 54 22.636 -8.127 14.776 431 HB3 PHE 54 3HB PHE 54 22.068 -8.309 13.123 432 HD1 PHE 54 HD1 PHE 54 19.443 -9.859 13.890 433 HD2 PHE 54 HD2 PHE 54 21.250 -6.204 15.308 434 HE1 PHE 54 HE1 PHE 54 17.231 -9.009 14.530 435 HE2 PHE 54 HE2 PHE 54 19.012 -5.347 15.894 436 HZ PHE 54 HZ PHE 54 16.997 -6.746 15.512 437 H ILE 55 H ILE 55 24.399 -10.301 15.382 438 HA ILE 55 HA ILE 55 25.955 -10.585 12.960 439 HB ILE 55 HB ILE 55 26.583 -11.116 15.888 440 HG12 ILE 55 2HG1 ILE 55 27.355 -8.782 14.075 441 HG13 ILE 55 3HG1 ILE 55 26.010 -8.744 15.196 442 HG21 ILE 55 1HG2 ILE 55 28.471 -10.948 13.496 443 HG22 ILE 55 2HG2 ILE 55 28.963 -11.097 15.197 444 HG23 ILE 55 3HG2 ILE 55 28.086 -12.419 14.420 445 HD11 ILE 55 3HD1 ILE 55 27.936 -7.698 16.236 446 HD12 ILE 55 1HD1 ILE 55 27.574 -9.216 17.087 447 HD13 ILE 55 2HD1 ILE 55 28.941 -9.132 15.946 448 H LYS 56 H LYS 56 24.577 -12.812 15.380 449 HA LYS 56 HA LYS 56 25.762 -15.194 14.235 450 HB2 LYS 56 2HB LYS 56 25.146 -14.899 16.613 451 HB3 LYS 56 3HB LYS 56 23.436 -14.778 16.158 452 HG2 LYS 56 2HG LYS 56 23.534 -17.076 15.216 453 HG3 LYS 56 3HG LYS 56 25.233 -17.199 15.727 454 HD2 LYS 56 2HD LYS 56 22.861 -16.689 17.571 455 HD3 LYS 56 3HD LYS 56 23.654 -18.259 17.348 456 HE2 LYS 56 2HE LYS 56 25.785 -17.306 18.171 457 HE3 LYS 56 3HE LYS 56 25.001 -15.727 18.382 458 HZ1 LYS 56 3HZ LYS 56 24.247 -18.199 19.792 459 HZ2 LYS 56 1HZ LYS 56 25.068 -16.925 20.434 460 HZ3 LYS 56 2HZ LYS 56 23.508 -16.742 19.951 461 H ALA 57 H ALA 57 22.729 -13.366 13.792 462 HA ALA 57 HA ALA 57 21.367 -15.469 12.398 463 HB1 ALA 57 1HB ALA 57 20.976 -12.448 12.371 464 HB2 ALA 57 2HB ALA 57 19.858 -13.634 11.657 465 HB3 ALA 57 3HB ALA 57 20.132 -13.627 13.410 466 H TYR 58 H TYR 58 23.406 -12.672 11.293 467 HA TYR 58 HA TYR 58 22.834 -13.000 8.543 468 HB2 TYR 58 2HB TYR 58 23.950 -11.048 9.630 469 HB3 TYR 58 3HB TYR 58 25.390 -12.044 9.876 470 HD1 TYR 58 HD2 TYR 58 23.083 -10.839 7.172 471 HD2 TYR 58 HD1 TYR 58 27.043 -12.132 8.213 472 HE1 TYR 58 HE2 TYR 58 23.886 -10.161 4.923 473 HE2 TYR 58 HE1 TYR 58 27.862 -11.483 5.961 474 HH TYR 58 HH TYR 58 27.303 -10.574 3.914 475 H ARG 59 H ARG 59 25.272 -14.539 10.643 476 HA ARG 59 HA ARG 59 26.708 -15.843 8.503 477 HB2 ARG 59 2HB ARG 59 26.507 -16.349 11.496 478 HB3 ARG 59 3HB ARG 59 27.684 -17.136 10.418 479 HG2 ARG 59 2HG ARG 59 28.728 -15.031 9.880 480 HG3 ARG 59 3HG ARG 59 27.444 -14.103 10.687 481 HD2 ARG 59 2HD ARG 59 28.056 -15.035 12.849 482 HD3 ARG 59 3HD ARG 59 29.237 -16.111 12.086 483 HE ARG 59 HE ARG 59 29.895 -13.448 11.360 484 HH11 ARG 59 1HH1 ARG 59 29.777 -15.438 14.272 485 HH12 ARG 59 2HH1 ARG 59 31.044 -14.541 15.082 486 HH21 ARG 59 1HH2 ARG 59 31.549 -12.303 12.426 487 HH22 ARG 59 2HH2 ARG 59 32.039 -12.774 14.040 488 H ALA 60 H ALA 60 23.830 -16.608 10.366 489 HA ALA 60 HA ALA 60 23.730 -19.356 9.264 490 HB1 ALA 60 1HB ALA 60 21.919 -17.882 11.218 491 HB2 ALA 60 2HB ALA 60 21.816 -19.607 10.790 492 HB3 ALA 60 3HB ALA 60 23.239 -18.988 11.652 493 H LEU 61 H LEU 61 22.734 -16.203 8.371 494 HA LEU 61 HA LEU 61 20.158 -16.868 7.259 495 HB2 LEU 61 2HB LEU 61 20.970 -14.590 8.053 496 HB3 LEU 61 3HB LEU 61 22.005 -14.535 6.615 497 HG LEU 61 HG LEU 61 19.912 -14.787 5.212 498 HD11 LEU 61 1HD1 LEU 61 18.608 -14.455 7.941 499 HD12 LEU 61 2HD1 LEU 61 17.757 -14.246 6.393 500 HD13 LEU 61 3HD1 LEU 61 18.413 -15.837 6.831 501 HD21 LEU 61 3HD2 LEU 61 19.984 -12.469 7.194 502 HD22 LEU 61 1HD2 LEU 61 20.941 -12.597 5.702 503 HD23 LEU 61 2HD2 LEU 61 19.164 -12.466 5.614 504 H ASP 62 H ASP 62 23.500 -17.035 6.182 505 HA ASP 62 HA ASP 62 23.006 -17.297 3.382 506 HB2 ASP 62 2HB ASP 62 25.202 -16.842 4.448 507 HB3 ASP 62 3HB ASP 62 25.197 -18.481 5.125 508 H SER 63 H SER 63 22.136 -19.286 6.024 509 HA SER 63 HA SER 63 21.888 -21.690 4.290 510 HB2 SER 63 2HB SER 63 21.921 -21.449 7.322 511 HB3 SER 63 3HB SER 63 21.761 -22.949 6.386 512 HG SER 63 HG SER 63 23.925 -22.546 7.018 513 H PHE 64 H PHE 64 20.060 -19.085 5.210 514 HA PHE 64 HA PHE 64 17.614 -20.427 5.960 515 HB2 PHE 64 2HB PHE 64 18.121 -18.098 6.552 516 HB3 PHE 64 3HB PHE 64 18.143 -17.660 4.843 517 HD1 PHE 64 HD1 PHE 64 15.944 -19.048 7.533 518 HD2 PHE 64 HD2 PHE 64 16.142 -17.039 3.736 519 HE1 PHE 64 HE1 PHE 64 13.504 -18.619 7.633 520 HE2 PHE 64 HE2 PHE 64 13.706 -16.588 3.849 521 HZ PHE 64 HZ PHE 64 12.388 -17.371 5.793 522 H ARG 65 H ARG 65 15.797 -20.874 4.661 523 HA ARG 65 HA ARG 65 16.255 -20.850 1.721 524 HB2 ARG 65 2HB ARG 65 15.507 -23.262 3.415 525 HB3 ARG 65 3HB ARG 65 15.461 -23.213 1.640 526 HG2 ARG 65 2HG ARG 65 17.879 -22.724 1.562 527 HG3 ARG 65 3HG ARG 65 17.950 -22.740 3.340 528 HD2 ARG 65 2HD ARG 65 17.257 -25.074 3.389 529 HD3 ARG 65 3HD ARG 65 17.099 -25.093 1.620 530 HE ARG 65 HE ARG 65 19.729 -24.235 2.302 531 HH11 ARG 65 1HH1 ARG 65 17.715 -27.135 2.398 532 HH12 ARG 65 2HH1 ARG 65 19.073 -28.232 2.270 533 HH21 ARG 65 1HH2 ARG 65 21.484 -25.680 2.134 534 HH22 ARG 65 2HH2 ARG 65 21.204 -27.407 2.131 535 H GLY 66 H GLY 66 14.270 -19.756 4.073 536 HA2 GLY 66 2HA GLY 66 12.167 -18.865 3.935 537 HA3 GLY 66 3HA GLY 66 12.099 -19.338 2.228 538 H ASP 67 H ASP 67 12.807 -21.947 4.414 539 HA ASP 67 HA ASP 67 10.331 -23.272 3.793 540 HB2 ASP 67 2HB ASP 67 12.519 -24.399 4.153 541 HB3 ASP 67 3HB ASP 67 12.467 -23.931 5.858 542 H SER 68 H SER 68 11.146 -20.888 6.070 543 HA SER 68 HA SER 68 8.530 -21.154 7.396 544 HB2 SER 68 2HB SER 68 10.144 -22.428 8.821 545 HB3 SER 68 3HB SER 68 11.136 -20.961 8.958 546 HG SER 68 HG SER 68 9.652 -21.227 10.703 547 H ALA 69 H ALA 69 8.101 -19.096 8.697 548 HA ALA 69 HA ALA 69 8.693 -16.836 7.046 549 HB1 ALA 69 1HB ALA 69 7.575 -16.964 9.875 550 HB2 ALA 69 2HB ALA 69 7.519 -15.555 8.789 551 HB3 ALA 69 3HB ALA 69 6.627 -17.034 8.372 552 H PHE 70 H PHE 70 10.034 -15.014 7.422 553 HA PHE 70 HA PHE 70 12.572 -15.730 8.544 554 HB2 PHE 70 2HB PHE 70 12.419 -14.208 6.668 555 HB3 PHE 70 3HB PHE 70 11.424 -13.086 7.601 556 HD1 PHE 70 HD1 PHE 70 14.797 -14.757 7.737 557 HD2 PHE 70 HD2 PHE 70 12.441 -11.281 8.674 558 HE1 PHE 70 HE1 PHE 70 16.824 -13.598 8.568 559 HE2 PHE 70 HE2 PHE 70 14.471 -10.124 9.486 560 HZ PHE 70 HZ PHE 70 16.676 -11.292 9.433 561 H TYR 71 H TYR 71 9.783 -13.892 9.857 562 HA TYR 71 HA TYR 71 11.353 -12.732 11.972 563 HB2 TYR 71 2HB TYR 71 9.236 -12.060 12.928 564 HB3 TYR 71 3HB TYR 71 9.252 -11.749 11.199 565 HD1 TYR 71 HD2 TYR 71 7.932 -14.002 13.843 566 HD2 TYR 71 HD1 TYR 71 7.645 -12.743 9.744 567 HE1 TYR 71 HE2 TYR 71 5.776 -15.217 13.628 568 HE2 TYR 71 HE1 TYR 71 5.489 -13.948 9.515 569 HH TYR 71 HH TYR 71 3.922 -15.253 10.556 570 H THR 72 H THR 72 9.470 -15.783 11.672 571 HA THR 72 HA THR 72 9.761 -16.436 14.478 572 HB THR 72 HB THR 72 9.279 -18.263 12.085 573 HG1 THR 72 1HG THR 72 7.110 -18.003 12.687 574 HG21 THR 72 1HG2 THR 72 9.961 -19.479 14.134 575 HG22 THR 72 2HG2 THR 72 8.731 -18.594 15.069 576 HG23 THR 72 3HG2 THR 72 8.236 -19.735 13.800 577 H TRP 73 H TRP 73 11.632 -17.015 11.497 578 HA TRP 73 HA TRP 73 13.453 -18.906 12.688 579 HB2 TRP 73 2HB TRP 73 13.064 -18.805 10.298 580 HB3 TRP 73 3HB TRP 73 13.591 -17.120 10.238 581 HD1 TRP 73 HD1 TRP 73 14.920 -20.647 10.262 582 HE1 TRP 73 HE1 TRP 73 17.440 -20.645 9.853 583 HE3 TRP 73 HE3 TRP 73 15.792 -15.614 10.622 584 HZ2 TRP 73 HZ2 TRP 73 19.593 -18.723 9.829 585 HZ3 TRP 73 HZ3 TRP 73 18.096 -14.737 10.416 586 HH2 TRP 73 HH2 TRP 73 19.996 -16.276 10.044 587 H LEU 74 H LEU 74 13.352 -15.351 12.456 588 HA LEU 74 HA LEU 74 16.114 -15.042 13.301 589 HB2 LEU 74 2HB LEU 74 15.000 -13.444 11.800 590 HB3 LEU 74 3HB LEU 74 13.798 -13.085 13.053 591 HG LEU 74 HG LEU 74 15.631 -12.245 14.541 592 HD11 LEU 74 1HD1 LEU 74 17.339 -12.624 12.046 593 HD12 LEU 74 2HD1 LEU 74 17.837 -11.757 13.518 594 HD13 LEU 74 3HD1 LEU 74 17.532 -13.503 13.585 595 HD21 LEU 74 3HD2 LEU 74 15.490 -10.933 11.799 596 HD22 LEU 74 1HD2 LEU 74 14.316 -10.726 13.121 597 HD23 LEU 74 2HD2 LEU 74 15.984 -10.153 13.321 598 H TYR 75 H TYR 75 12.879 -14.904 14.859 599 HA TYR 75 HA TYR 75 13.908 -13.846 17.331 600 HB2 TYR 75 2HB TYR 75 11.350 -15.336 16.663 601 HB3 TYR 75 3HB TYR 75 11.691 -14.602 18.230 602 HD1 TYR 75 HD2 TYR 75 13.188 -12.105 16.925 603 HD2 TYR 75 HD1 TYR 75 9.362 -13.988 16.312 604 HE1 TYR 75 HE2 TYR 75 12.267 -9.960 16.186 605 HE2 TYR 75 HE1 TYR 75 8.432 -11.824 15.525 606 HH TYR 75 HH TYR 75 8.844 -9.628 15.127 607 H ARG 76 H ARG 76 13.943 -17.069 15.974 608 HA ARG 76 HA ARG 76 14.420 -18.382 18.534 609 HB2 ARG 76 2HB ARG 76 14.945 -19.178 15.639 610 HB3 ARG 76 3HB ARG 76 15.250 -20.246 17.021 611 HG2 ARG 76 2HG ARG 76 12.545 -19.005 16.442 612 HG3 ARG 76 3HG ARG 76 13.042 -20.620 15.889 613 HD2 ARG 76 2HD ARG 76 13.446 -21.276 18.256 614 HD3 ARG 76 3HD ARG 76 12.867 -19.688 18.790 615 HE ARG 76 HE ARG 76 10.854 -20.766 17.152 616 HH11 ARG 76 1HH1 ARG 76 12.433 -21.518 20.221 617 HH12 ARG 76 2HH1 ARG 76 11.023 -22.313 20.889 618 HH21 ARG 76 1HH2 ARG 76 9.026 -21.827 18.045 619 HH22 ARG 76 2HH2 ARG 76 9.105 -22.472 19.665 620 H ILE 77 H ILE 77 16.376 -16.612 16.180 621 HA ILE 77 HA ILE 77 18.916 -17.565 17.202 622 HB ILE 77 HB ILE 77 18.381 -14.905 15.846 623 HG12 ILE 77 2HG1 ILE 77 17.393 -16.578 14.395 624 HG13 ILE 77 3HG1 ILE 77 18.880 -15.947 13.695 625 HG21 ILE 77 1HG2 ILE 77 20.819 -16.714 16.047 626 HG22 ILE 77 2HG2 ILE 77 20.728 -15.241 15.054 627 HG23 ILE 77 3HG2 ILE 77 20.595 -15.131 16.818 628 HD11 ILE 77 3HD1 ILE 77 18.605 -18.622 15.126 629 HD12 ILE 77 1HD1 ILE 77 18.709 -18.361 13.368 630 HD13 ILE 77 2HD1 ILE 77 20.102 -17.975 14.396 631 H ALA 78 H ALA 78 16.663 -14.929 18.013 632 HA ALA 78 HA ALA 78 18.578 -13.477 19.599 633 HB1 ALA 78 1HB ALA 78 15.544 -13.307 19.505 634 HB2 ALA 78 2HB ALA 78 16.649 -12.092 20.187 635 HB3 ALA 78 3HB ALA 78 16.671 -12.438 18.444 636 H VAL 79 H VAL 79 15.971 -15.845 20.391 637 HA VAL 79 HA VAL 79 16.335 -15.384 23.243 638 HB VAL 79 HB VAL 79 14.151 -15.932 22.347 639 HG11 VAL 79 1HG1 VAL 79 13.603 -18.149 21.509 640 HG12 VAL 79 2HG1 VAL 79 14.897 -17.452 20.504 641 HG13 VAL 79 3HG1 VAL 79 15.277 -18.694 21.724 642 HG21 VAL 79 3HG2 VAL 79 15.204 -18.220 24.058 643 HG22 VAL 79 1HG2 VAL 79 14.792 -16.607 24.681 644 HG23 VAL 79 2HG2 VAL 79 13.528 -17.634 23.962 645 H ASN 80 H ASN 80 17.577 -17.730 20.853 646 HA ASN 80 HA ASN 80 18.667 -19.473 22.905 647 HB2 ASN 80 2HB ASN 80 19.212 -19.172 19.928 648 HB3 ASN 80 3HB ASN 80 19.957 -20.407 20.945 649 HD21 ASN 80 2HD2 ASN 80 18.605 -21.375 18.869 650 HD22 ASN 80 1HD2 ASN 80 17.063 -22.050 19.369 651 H THR 81 H THR 81 19.701 -16.481 21.338 652 HA THR 81 HA THR 81 22.488 -16.839 22.087 653 HB THR 81 HB THR 81 20.944 -14.388 21.148 654 HG1 THR 81 1HG THR 81 21.081 -15.883 19.554 655 HG21 THR 81 1HG2 THR 81 22.995 -13.716 22.366 656 HG22 THR 81 2HG2 THR 81 23.939 -14.895 21.425 657 HG23 THR 81 3HG2 THR 81 23.200 -13.487 20.620 658 H ALA 82 H ALA 82 19.578 -15.439 23.567 659 HA ALA 82 HA ALA 82 21.012 -14.001 25.622 660 HB1 ALA 82 1HB ALA 82 18.728 -13.425 24.862 661 HB2 ALA 82 2HB ALA 82 18.133 -14.987 25.464 662 HB3 ALA 82 3HB ALA 82 18.759 -13.770 26.604 663 H LYS 83 H LYS 83 19.826 -17.318 25.203 664 HA LYS 83 HA LYS 83 20.122 -18.011 28.014 665 HB2 LYS 83 2HB LYS 83 19.714 -19.622 25.472 666 HB3 LYS 83 3HB LYS 83 19.802 -20.347 27.096 667 HG2 LYS 83 2HG LYS 83 17.901 -19.025 27.855 668 HG3 LYS 83 3HG LYS 83 17.836 -18.158 26.308 669 HD2 LYS 83 2HD LYS 83 17.363 -20.294 25.134 670 HD3 LYS 83 3HD LYS 83 17.407 -21.154 26.692 671 HE2 LYS 83 2HE LYS 83 15.545 -19.747 27.518 672 HE3 LYS 83 3HE LYS 83 15.512 -18.876 25.979 673 HZ1 LYS 83 3HZ LYS 83 15.004 -21.758 26.319 674 HZ2 LYS 83 1HZ LYS 83 13.856 -20.608 26.075 675 HZ3 LYS 83 2HZ LYS 83 14.951 -20.942 24.894 676 H ASN 84 H ASN 84 22.235 -18.128 25.116 677 HA ASN 84 HA ASN 84 24.220 -19.604 26.680 678 HB2 ASN 84 2HB ASN 84 25.473 -19.854 24.793 679 HB3 ASN 84 3HB ASN 84 23.825 -19.837 24.145 680 HD21 ASN 84 2HD2 ASN 84 26.578 -17.574 24.839 681 HD22 ASN 84 1HD2 ASN 84 26.342 -16.619 23.392 682 H TYR 85 H TYR 85 23.283 -16.314 26.289 683 HA TYR 85 HA TYR 85 25.907 -15.171 26.725 684 HB2 TYR 85 2HB TYR 85 24.054 -14.027 25.552 685 HB3 TYR 85 3HB TYR 85 23.127 -13.997 27.051 686 HD1 TYR 85 HD1 TYR 85 26.247 -12.784 25.421 687 HD2 TYR 85 HD2 TYR 85 23.462 -12.277 28.653 688 HE1 TYR 85 HE1 TYR 85 27.325 -10.623 26.002 689 HE2 TYR 85 HE2 TYR 85 24.538 -10.118 29.252 690 HH TYR 85 HH TYR 85 27.319 -8.818 27.407 691 H LEU 86 H LEU 86 23.097 -16.008 28.806 692 HA LEU 86 HA LEU 86 24.426 -14.870 31.151 693 HB2 LEU 86 2HB LEU 86 21.875 -16.480 30.797 694 HB3 LEU 86 3HB LEU 86 22.453 -15.866 32.353 695 HG LEU 86 HG LEU 86 21.680 -14.183 29.930 696 HD11 LEU 86 1HD1 LEU 86 20.460 -14.545 32.700 697 HD12 LEU 86 2HD1 LEU 86 19.899 -13.399 31.469 698 HD13 LEU 86 3HD1 LEU 86 19.787 -15.150 31.166 699 HD21 LEU 86 3HD2 LEU 86 21.987 -12.253 31.490 700 HD22 LEU 86 1HD2 LEU 86 22.712 -13.354 32.681 701 HD23 LEU 86 2HD2 LEU 86 23.514 -13.060 31.115 702 H VAL 87 H VAL 87 24.282 -18.083 29.633 703 HA VAL 87 HA VAL 87 25.202 -19.340 32.103 704 HB VAL 87 HB VAL 87 23.801 -20.418 30.238 705 HG11 VAL 87 1HG1 VAL 87 25.018 -21.507 28.442 706 HG12 VAL 87 2HG1 VAL 87 25.359 -19.762 28.377 707 HG13 VAL 87 3HG1 VAL 87 26.568 -20.887 29.045 708 HG21 VAL 87 3HG2 VAL 87 26.279 -21.864 31.262 709 HG22 VAL 87 1HG2 VAL 87 24.757 -21.645 32.161 710 HG23 VAL 87 2HG2 VAL 87 24.778 -22.628 30.682 711 H ALA 88 H ALA 88 26.652 -17.775 29.300 712 HA ALA 88 HA ALA 88 29.252 -18.970 29.716 713 HB1 ALA 88 1HB ALA 88 28.380 -16.509 28.137 714 HB2 ALA 88 2HB ALA 88 29.963 -17.305 28.008 715 HB3 ALA 88 3HB ALA 88 28.496 -18.167 27.498 716 H GLN 89 H GLN 89 27.467 -16.516 31.292 717 HA GLN 89 HA GLN 89 29.962 -15.446 32.530 718 HB2 GLN 89 2HB GLN 89 27.252 -14.122 32.106 719 HB3 GLN 89 3HB GLN 89 28.607 -13.412 33.005 720 HG2 GLN 89 2HG GLN 89 30.012 -13.457 30.993 721 HG3 GLN 89 3HG GLN 89 28.721 -14.258 30.077 722 HE21 GLN 89 2HE2 GLN 89 26.698 -13.090 29.699 723 HE22 GLN 89 1HE2 GLN 89 26.723 -11.339 29.654 724 H GLY 90 H GLY 90 27.366 -17.520 33.001 725 HA2 GLY 90 2HA GLY 90 27.237 -16.990 35.929 726 HA3 GLY 90 3HA GLY 90 26.033 -17.868 34.965 727 H ARG 91 H ARG 91 28.775 -19.022 33.654 728 HA ARG 91 HA ARG 91 29.264 -21.059 35.771 729 HB2 ARG 91 2HB ARG 91 28.920 -21.555 32.784 730 HB3 ARG 91 3HB ARG 91 29.379 -22.771 33.972 731 HG2 ARG 91 2HG ARG 91 26.739 -21.250 33.945 732 HG3 ARG 91 3HG ARG 91 26.985 -22.900 33.359 733 HD2 ARG 91 2HD ARG 91 27.384 -21.963 36.226 734 HD3 ARG 91 3HD ARG 91 26.003 -22.886 35.603 735 HE ARG 91 HE ARG 91 28.365 -24.318 34.970 736 HH11 ARG 91 1HH1 ARG 91 26.478 -23.386 37.819 737 HH12 ARG 91 2HH1 ARG 91 26.998 -24.768 38.754 738 HH21 ARG 91 1HH2 ARG 91 29.008 -26.110 36.215 739 HH22 ARG 91 2HH2 ARG 91 28.408 -26.307 37.847 740 H ARG 92 H ARG 92 30.673 -18.583 34.173 741 HA ARG 92 HA ARG 92 33.333 -19.896 34.215 742 HB2 ARG 92 2HB ARG 92 32.325 -18.167 31.925 743 HB3 ARG 92 3HB ARG 92 33.936 -18.891 32.072 744 HG2 ARG 92 2HG ARG 92 32.939 -21.158 31.979 745 HG3 ARG 92 3HG ARG 92 31.320 -20.428 31.806 746 HD2 ARG 92 2HD ARG 92 32.054 -19.281 29.754 747 HD3 ARG 92 3HD ARG 92 33.656 -20.026 29.899 748 HE ARG 92 HE ARG 92 31.915 -22.172 29.941 749 HH11 ARG 92 1HH1 ARG 92 32.483 -19.484 27.716 750 HH12 ARG 92 2HH1 ARG 92 31.977 -20.388 26.308 751 HH21 ARG 92 1HH2 ARG 92 31.265 -23.332 28.079 752 HH22 ARG 92 2HH2 ARG 92 31.297 -22.562 26.511 753 H LEU 93 H LEU 93 31.523 -17.562 35.569 754 HA LEU 93 HA LEU 93 33.832 -15.764 35.901 755 HB2 LEU 93 2HB LEU 93 32.515 -15.011 33.897 756 HB3 LEU 93 3HB LEU 93 31.114 -14.776 34.944 757 HG LEU 93 HG LEU 93 32.318 -13.019 36.185 758 HD11 LEU 93 1HD1 LEU 93 34.593 -13.604 34.232 759 HD12 LEU 93 2HD1 LEU 93 34.516 -12.209 35.331 760 HD13 LEU 93 3HD1 LEU 93 34.636 -13.855 35.992 761 HD21 LEU 93 3HD2 LEU 93 32.502 -12.689 33.168 762 HD22 LEU 93 1HD2 LEU 93 31.044 -12.440 34.159 763 HD23 LEU 93 2HD2 LEU 93 32.456 -11.376 34.365 764 H GLU 94 H GLU 94 31.410 -17.545 37.319 765 HA GLU 94 HA GLU 94 30.482 -15.705 39.302 766 HB2 GLU 94 2HB GLU 94 29.500 -17.619 40.348 767 HB3 GLU 94 3HB GLU 94 29.277 -17.773 38.605 768 HG2 GLU 94 2HG GLU 94 31.400 -19.185 40.282 769 HG3 GLU 94 3HG GLU 94 29.906 -19.915 39.697 770 H LEU 95 H LEU 95 30.914 -15.811 41.562 771 HA LEU 95 HA LEU 95 33.816 -16.014 42.082 772 HB2 LEU 95 2HB LEU 95 31.488 -14.866 43.670 773 HB3 LEU 95 3HB LEU 95 33.144 -14.938 44.266 774 HG LEU 95 HG LEU 95 32.695 -12.731 43.468 775 HD11 LEU 95 1HD1 LEU 95 34.469 -14.134 41.432 776 HD12 LEU 95 2HD1 LEU 95 34.525 -12.423 41.899 777 HD13 LEU 95 3HD1 LEU 95 34.965 -13.676 43.077 778 HD21 LEU 95 3HD2 LEU 95 32.173 -13.846 40.690 779 HD22 LEU 95 1HD2 LEU 95 30.899 -13.310 41.816 780 HD23 LEU 95 2HD2 LEU 95 32.105 -12.154 41.213 781 H VAL 96 H VAL 96 30.951 -17.873 42.603 782 HA VAL 96 HA VAL 96 32.484 -19.763 44.282 783 HB VAL 96 HB VAL 96 29.692 -18.767 44.989 784 HG11 VAL 96 1HG1 VAL 96 31.574 -20.684 46.430 785 HG12 VAL 96 2HG1 VAL 96 29.993 -20.135 47.022 786 HG13 VAL 96 3HG1 VAL 96 30.083 -21.145 45.569 787 HG21 VAL 96 3HG2 VAL 96 32.366 -18.300 46.377 788 HG22 VAL 96 1HG2 VAL 96 31.353 -17.064 45.591 789 HG23 VAL 96 2HG2 VAL 96 30.776 -17.887 47.055 790 HA PRO 97 HA PRO 97 30.435 -22.353 41.262 791 HB2 PRO 97 2HB PRO 97 31.200 -24.812 42.164 792 HB3 PRO 97 3HB PRO 97 32.362 -23.663 41.415 793 HG2 PRO 97 2HG PRO 97 31.815 -24.095 44.369 794 HG3 PRO 97 3HG PRO 97 33.404 -24.090 43.534 795 HD2 PRO 97 2HD PRO 97 32.441 -21.878 44.793 796 HD3 PRO 97 3HD PRO 97 33.335 -21.739 43.246 797 H ARG 98 H ARG 98 28.681 -23.935 41.168 798 HA ARG 98 HA ARG 98 27.281 -24.541 43.679 799 HB2 ARG 98 2HB ARG 98 25.204 -23.473 43.004 800 HB3 ARG 98 3HB ARG 98 26.499 -22.270 43.100 801 HG2 ARG 98 2HG ARG 98 26.809 -22.478 40.608 802 HG3 ARG 98 3HG ARG 98 25.396 -23.554 40.567 803 HD2 ARG 98 2HD ARG 98 24.028 -21.747 41.613 804 HD3 ARG 98 3HD ARG 98 25.433 -20.667 41.542 805 HE ARG 98 HE ARG 98 23.644 -21.373 39.380 806 HH11 ARG 98 1HH1 ARG 98 26.982 -20.412 40.095 807 HH12 ARG 98 2HH1 ARG 98 27.259 -19.809 38.475 808 HH21 ARG 98 1HH2 ARG 98 24.050 -20.542 37.301 809 HH22 ARG 98 2HH2 ARG 98 25.624 -19.861 36.929 810 H GLY 99 H GLY 99 25.674 -26.122 43.488 811 HA2 GLY 99 2HA GLY 99 24.516 -27.318 41.327 812 HA3 GLY 99 3HA GLY 99 26.129 -28.054 41.354 813 H SER 100 H SER 100 23.898 -29.657 41.735 814 HA SER 100 HA SER 100 24.425 -30.680 44.432 815 HB2 SER 100 2HB SER 100 22.055 -30.762 45.055 816 HB3 SER 100 3HB SER 100 22.574 -29.088 44.802 817 HG SER 100 HG SER 100 20.593 -29.526 43.775 818 H HIS 101 H HIS 101 23.286 -32.805 44.763 819 HA HIS 101 HA HIS 101 22.847 -34.245 42.196 820 HB2 HIS 101 2HB HIS 101 24.194 -36.098 43.027 821 HB3 HIS 101 3HB HIS 101 25.158 -34.622 42.970 822 HD2 HIS 101 HD2 HIS 101 23.955 -37.311 45.341 823 HE1 HIS 101 HE1 HIS 101 25.880 -34.423 47.803 824 HE2 HIS 101 HE2 HIS 101 24.889 -36.768 47.729 825 H HIS 102 H HIS 102 21.252 -33.191 44.736 826 HA HIS 102 HA HIS 102 19.781 -35.742 45.188 827 HB2 HIS 102 2HB HIS 102 21.085 -34.905 47.142 828 HB3 HIS 102 3HB HIS 102 20.104 -33.433 47.124 829 HD2 HIS 102 HD2 HIS 102 18.224 -33.530 48.878 830 HE1 HIS 102 HE1 HIS 102 17.381 -37.698 48.860 831 HE2 HIS 102 HE2 HIS 102 16.767 -35.452 49.901 832 H HIS 103 H HIS 103 19.601 -33.110 43.371 833 HA HIS 103 HA HIS 103 16.646 -32.930 43.626 834 HB2 HIS 103 2HB HIS 103 17.753 -30.983 44.727 835 HB3 HIS 103 3HB HIS 103 18.535 -30.592 43.190 836 HD2 HIS 103 HD2 HIS 103 14.806 -31.344 44.173 837 HE1 HIS 103 HE1 HIS 103 14.855 -27.798 41.828 838 HE2 HIS 103 HE2 HIS 103 13.372 -29.448 43.079 839 H HIS 104 H HIS 104 19.110 -33.959 41.775 840 HA HIS 104 HA HIS 104 17.651 -33.447 39.240 841 HB2 HIS 104 2HB HIS 104 20.646 -33.114 39.647 842 HB3 HIS 104 3HB HIS 104 19.801 -33.030 38.098 843 HD2 HIS 104 HD2 HIS 104 20.777 -30.915 41.066 844 HE1 HIS 104 HE1 HIS 104 18.163 -28.475 38.765 845 HE2 HIS 104 HE2 HIS 104 19.802 -28.510 40.713 846 H HIS 105 H HIS 105 18.350 -34.959 37.520 847 HA HIS 105 HA HIS 105 18.504 -37.078 36.772 848 HB2 HIS 105 2HB HIS 105 20.815 -37.264 38.723 849 HB3 HIS 105 3HB HIS 105 20.549 -38.284 37.304 850 HD2 HIS 105 HD2 HIS 105 20.618 -36.944 34.837 851 HE1 HIS 105 HE1 HIS 105 23.071 -33.776 36.262 852 HE2 HIS 105 HE2 HIS 105 22.158 -34.929 34.181 853 H HIS 106 H HIS 106 16.814 -36.599 39.239 854 HA HIS 106 HA HIS 106 16.319 -39.453 39.816 855 HB2 HIS 106 2HB HIS 106 17.850 -38.675 41.591 856 HB3 HIS 106 3HB HIS 106 16.761 -37.329 41.951 857 HD2 HIS 106 HD2 HIS 106 16.621 -41.244 41.888 858 HE1 HIS 106 HE1 HIS 106 14.069 -39.908 45.016 859 HE2 HIS 106 HE2 HIS 106 15.042 -41.955 43.851 Start of MODEL 13 1 H1 MET 1 H1 MET 1 2.452 4.282 5.817 2 H2 MET 1 H2 MET 1 3.596 3.836 4.726 3 H3 MET 1 H3 MET 1 3.135 2.791 5.916 4 HA MET 1 HA MET 1 0.932 2.643 5.024 5 HB2 MET 1 2HB MET 1 0.890 4.906 4.051 6 HB3 MET 1 3HB MET 1 2.024 4.387 2.785 7 HG2 MET 1 2HG MET 1 0.387 2.683 2.032 8 HG3 MET 1 3HG MET 1 -0.712 3.166 3.325 9 HE1 MET 1 1HE MET 1 0.368 5.768 -0.362 10 HE2 MET 1 2HE MET 1 1.519 5.498 0.961 11 HE3 MET 1 3HE MET 1 0.990 4.132 -0.054 12 H SER 2 H SER 2 3.614 2.897 2.594 13 HA SER 2 HA SER 2 3.661 -0.061 2.420 14 HB2 SER 2 2HB SER 2 3.306 1.796 0.037 15 HB3 SER 2 3HB SER 2 3.569 0.043 -0.032 16 HG SER 2 HG SER 2 1.602 -0.197 1.143 17 H GLU 3 H GLU 3 5.590 -0.866 1.394 18 HA GLU 3 HA GLU 3 7.813 1.100 1.154 19 HB2 GLU 3 2HB GLU 3 7.841 -1.490 2.749 20 HB3 GLU 3 3HB GLU 3 9.260 -0.474 2.430 21 HG2 GLU 3 2HG GLU 3 8.192 1.419 3.597 22 HG3 GLU 3 3HG GLU 3 6.762 0.425 3.921 23 H GLN 4 H GLN 4 6.032 -1.267 -0.298 24 HA GLN 4 HA GLN 4 6.233 -2.632 -2.050 25 HB2 GLN 4 2HB GLN 4 8.491 -0.755 -2.816 26 HB3 GLN 4 3HB GLN 4 7.630 -1.829 -3.914 27 HG2 GLN 4 2HG GLN 4 6.348 0.434 -2.323 28 HG3 GLN 4 3HG GLN 4 6.816 0.523 -4.020 29 HE21 GLN 4 2HE2 GLN 4 4.227 1.098 -3.388 30 HE22 GLN 4 1HE2 GLN 4 3.171 -0.197 -3.922 31 H LEU 5 H LEU 5 8.453 -2.946 0.281 32 HA LEU 5 HA LEU 5 9.519 -5.411 -0.966 33 HB2 LEU 5 2HB LEU 5 11.196 -3.354 0.516 34 HB3 LEU 5 3HB LEU 5 11.756 -4.953 0.021 35 HG LEU 5 HG LEU 5 10.906 -2.729 -1.879 36 HD11 LEU 5 1HD1 LEU 5 13.316 -2.638 -2.402 37 HD12 LEU 5 2HD1 LEU 5 13.046 -2.309 -0.676 38 HD13 LEU 5 3HD1 LEU 5 13.629 -3.915 -1.209 39 HD21 LEU 5 3HD2 LEU 5 12.300 -5.371 -2.475 40 HD22 LEU 5 1HD2 LEU 5 10.575 -5.081 -2.790 41 HD23 LEU 5 2HD2 LEU 5 11.804 -4.134 -3.651 42 H THR 6 H THR 6 10.192 -6.976 0.599 43 HA THR 6 HA THR 6 9.255 -6.558 3.386 44 HB THR 6 HB THR 6 8.405 -8.886 1.622 45 HG1 THR 6 1HG THR 6 6.373 -7.886 1.697 46 HG21 THR 6 1HG2 THR 6 8.398 -9.593 3.910 47 HG22 THR 6 2HG2 THR 6 7.726 -8.038 4.462 48 HG23 THR 6 3HG2 THR 6 6.724 -9.181 3.525 49 H ASP 7 H ASP 7 9.854 -8.654 4.689 50 HA ASP 7 HA ASP 7 12.631 -9.013 4.640 51 HB2 ASP 7 2HB ASP 7 12.193 -10.869 6.209 52 HB3 ASP 7 3HB ASP 7 11.233 -9.437 6.582 53 H GLN 8 H GLN 8 10.227 -10.490 2.608 54 HA GLN 8 HA GLN 8 11.605 -12.912 1.978 55 HB2 GLN 8 2HB GLN 8 9.249 -12.546 1.437 56 HB3 GLN 8 3HB GLN 8 9.673 -11.182 0.387 57 HG2 GLN 8 2HG GLN 8 9.201 -13.178 -0.954 58 HG3 GLN 8 3HG GLN 8 10.890 -12.711 -1.127 59 HE21 GLN 8 2HE2 GLN 8 12.537 -13.963 -0.015 60 HE22 GLN 8 1HE2 GLN 8 12.225 -15.628 0.446 61 H VAL 9 H VAL 9 11.575 -9.687 0.362 62 HA VAL 9 HA VAL 9 13.633 -10.571 -1.527 63 HB VAL 9 HB VAL 9 11.924 -9.235 -2.458 64 HG11 VAL 9 1HG1 VAL 9 12.431 -7.176 -0.279 65 HG12 VAL 9 2HG1 VAL 9 11.274 -7.027 -1.628 66 HG13 VAL 9 3HG1 VAL 9 11.015 -8.258 -0.391 67 HG21 VAL 9 3HG2 VAL 9 14.189 -7.256 -1.977 68 HG22 VAL 9 1HG2 VAL 9 14.268 -8.599 -3.153 69 HG23 VAL 9 2HG2 VAL 9 13.070 -7.304 -3.345 70 H LEU 10 H LEU 10 13.443 -8.775 1.505 71 HA LEU 10 HA LEU 10 16.039 -7.542 1.286 72 HB2 LEU 10 2HB LEU 10 13.962 -8.018 3.383 73 HB3 LEU 10 3HB LEU 10 15.624 -7.746 3.949 74 HG LEU 10 HG LEU 10 15.769 -5.634 2.829 75 HD11 LEU 10 1HD1 LEU 10 14.450 -6.080 0.803 76 HD12 LEU 10 2HD1 LEU 10 12.953 -6.153 1.778 77 HD13 LEU 10 3HD1 LEU 10 13.856 -4.632 1.624 78 HD21 LEU 10 3HD2 LEU 10 13.107 -5.918 4.285 79 HD22 LEU 10 1HD2 LEU 10 14.696 -5.699 5.053 80 HD23 LEU 10 2HD2 LEU 10 14.009 -4.400 4.056 81 H VAL 11 H VAL 11 14.924 -10.793 2.292 82 HA VAL 11 HA VAL 11 17.585 -11.437 3.338 83 HB VAL 11 HB VAL 11 15.086 -13.099 2.870 84 HG11 VAL 11 1HG1 VAL 11 16.334 -14.867 4.149 85 HG12 VAL 11 2HG1 VAL 11 16.992 -14.586 2.525 86 HG13 VAL 11 3HG1 VAL 11 17.823 -13.913 3.942 87 HG21 VAL 11 3HG2 VAL 11 16.605 -12.274 5.387 88 HG22 VAL 11 1HG2 VAL 11 15.127 -11.485 4.807 89 HG23 VAL 11 2HG2 VAL 11 15.073 -13.183 5.324 90 H GLU 12 H GLU 12 15.828 -11.712 0.246 91 HA GLU 12 HA GLU 12 17.749 -13.549 -0.897 92 HB2 GLU 12 2HB GLU 12 15.741 -11.611 -2.105 93 HB3 GLU 12 3HB GLU 12 16.791 -12.649 -3.077 94 HG2 GLU 12 2HG GLU 12 15.893 -14.658 -1.959 95 HG3 GLU 12 3HG GLU 12 14.820 -13.656 -0.981 96 H ARG 13 H ARG 13 17.473 -9.965 -0.734 97 HA ARG 13 HA ARG 13 19.591 -9.517 -2.615 98 HB2 ARG 13 2HB ARG 13 17.835 -7.877 -2.183 99 HB3 ARG 13 3HB ARG 13 18.366 -7.696 -0.497 100 HG2 ARG 13 2HG ARG 13 20.486 -6.784 -1.185 101 HG3 ARG 13 3HG ARG 13 20.185 -7.215 -2.887 102 HD2 ARG 13 2HD ARG 13 18.284 -5.621 -2.934 103 HD3 ARG 13 3HD ARG 13 18.662 -5.135 -1.268 104 HE ARG 13 HE ARG 13 21.045 -4.877 -2.738 105 HH11 ARG 13 1HH1 ARG 13 17.817 -3.420 -2.785 106 HH12 ARG 13 2HH1 ARG 13 18.395 -1.920 -3.476 107 HH21 ARG 13 1HH2 ARG 13 21.743 -2.974 -3.637 108 HH22 ARG 13 2HH2 ARG 13 20.628 -1.660 -3.963 109 H VAL 14 H VAL 14 19.595 -9.878 0.966 110 HA VAL 14 HA VAL 14 22.370 -9.086 1.175 111 HB VAL 14 HB VAL 14 22.288 -10.081 3.403 112 HG11 VAL 14 1HG1 VAL 14 20.379 -8.700 4.274 113 HG12 VAL 14 2HG1 VAL 14 21.439 -7.835 3.122 114 HG13 VAL 14 3HG1 VAL 14 19.846 -8.440 2.603 115 HG21 VAL 14 3HG2 VAL 14 20.888 -12.047 2.974 116 HG22 VAL 14 1HG2 VAL 14 20.197 -11.029 4.260 117 HG23 VAL 14 2HG2 VAL 14 19.493 -10.979 2.626 118 H GLN 15 H GLN 15 20.727 -12.041 0.205 119 HA GLN 15 HA GLN 15 23.159 -13.649 0.408 120 HB2 GLN 15 2HB GLN 15 20.453 -14.134 -0.888 121 HB3 GLN 15 3HB GLN 15 21.769 -15.320 -0.834 122 HG2 GLN 15 2HG GLN 15 21.731 -15.327 1.625 123 HG3 GLN 15 3HG GLN 15 20.533 -14.050 1.651 124 HE21 GLN 15 2HE2 GLN 15 19.909 -16.320 3.028 125 HE22 GLN 15 1HE2 GLN 15 18.690 -17.233 2.166 126 H LYS 16 H LYS 16 21.879 -11.332 -1.859 127 HA LYS 16 HA LYS 16 23.436 -12.346 -4.120 128 HB2 LYS 16 2HB LYS 16 22.163 -9.615 -3.670 129 HB3 LYS 16 3HB LYS 16 22.817 -10.220 -5.189 130 HG2 LYS 16 2HG LYS 16 20.375 -11.238 -3.718 131 HG3 LYS 16 3HG LYS 16 20.431 -10.395 -5.271 132 HD2 LYS 16 2HD LYS 16 21.620 -12.317 -6.277 133 HD3 LYS 16 3HD LYS 16 21.564 -13.174 -4.717 134 HE2 LYS 16 2HE LYS 16 19.085 -13.047 -4.743 135 HE3 LYS 16 3HE LYS 16 19.146 -12.226 -6.306 136 HZ1 LYS 16 3HZ LYS 16 18.756 -14.578 -6.541 137 HZ2 LYS 16 1HZ LYS 16 20.198 -14.174 -7.222 138 HZ3 LYS 16 2HZ LYS 16 20.152 -14.943 -5.764 139 H GLY 17 H GLY 17 24.223 -10.845 -1.220 140 HA2 GLY 17 2HA GLY 17 26.511 -10.473 -0.661 141 HA3 GLY 17 3HA GLY 17 26.836 -9.943 -2.321 142 H ASP 18 H ASP 18 23.889 -8.564 -1.379 143 HA ASP 18 HA ASP 18 25.216 -5.974 -0.844 144 HB2 ASP 18 2HB ASP 18 22.524 -6.898 -1.796 145 HB3 ASP 18 3HB ASP 18 22.618 -5.357 -0.941 146 H GLN 19 H GLN 19 25.993 -6.504 1.269 147 HA GLN 19 HA GLN 19 24.311 -7.383 3.385 148 HB2 GLN 19 2HB GLN 19 26.767 -7.544 3.290 149 HB3 GLN 19 3HB GLN 19 26.914 -5.793 3.432 150 HG2 GLN 19 2HG GLN 19 25.405 -7.419 5.509 151 HG3 GLN 19 3HG GLN 19 27.168 -7.316 5.558 152 HE21 GLN 19 2HE2 GLN 19 25.748 -6.405 7.720 153 HE22 GLN 19 1HE2 GLN 19 25.845 -4.655 7.796 154 H LYS 20 H LYS 20 24.577 -4.329 1.779 155 HA LYS 20 HA LYS 20 23.833 -2.535 3.849 156 HB2 LYS 20 2HB LYS 20 23.288 -1.046 2.035 157 HB3 LYS 20 3HB LYS 20 24.679 -2.009 1.522 158 HG2 LYS 20 2HG LYS 20 22.904 -3.605 0.442 159 HG3 LYS 20 3HG LYS 20 21.768 -2.277 0.692 160 HD2 LYS 20 2HD LYS 20 22.577 -2.057 -1.529 161 HD3 LYS 20 3HD LYS 20 23.411 -0.791 -0.594 162 HE2 LYS 20 2HE LYS 20 25.388 -2.261 -0.377 163 HE3 LYS 20 3HE LYS 20 24.536 -3.553 -1.240 164 HZ1 LYS 20 3HZ LYS 20 25.218 -0.920 -2.369 165 HZ2 LYS 20 1HZ LYS 20 26.009 -2.327 -2.680 166 HZ3 LYS 20 2HZ LYS 20 24.455 -2.134 -3.167 167 H ALA 21 H ALA 21 21.965 -4.950 2.060 168 HA ALA 21 HA ALA 21 19.407 -3.775 2.819 169 HB1 ALA 21 1HB ALA 21 18.477 -5.801 1.765 170 HB2 ALA 21 2HB ALA 21 19.657 -4.994 0.709 171 HB3 ALA 21 3HB ALA 21 20.113 -6.469 1.590 172 H PHE 22 H PHE 22 21.759 -5.906 4.306 173 HA PHE 22 HA PHE 22 19.833 -7.203 6.064 174 HB2 PHE 22 2HB PHE 22 22.026 -8.213 5.474 175 HB3 PHE 22 3HB PHE 22 22.844 -6.905 6.325 176 HD1 PHE 22 HD2 PHE 22 20.114 -9.445 6.897 177 HD2 PHE 22 HD1 PHE 22 23.444 -7.280 8.554 178 HE1 PHE 22 HE2 PHE 22 19.892 -10.718 9.000 179 HE2 PHE 22 HE1 PHE 22 23.203 -8.547 10.678 180 HZ PHE 22 HZ PHE 22 21.431 -10.264 10.901 181 H ASN 23 H ASN 23 21.977 -4.344 6.156 182 HA ASN 23 HA ASN 23 21.574 -3.637 8.887 183 HB2 ASN 23 2HB ASN 23 23.323 -2.594 7.640 184 HB3 ASN 23 3HB ASN 23 22.225 -2.160 6.327 185 HD21 ASN 23 2HD2 ASN 23 21.121 -0.252 6.360 186 HD22 ASN 23 1HD2 ASN 23 21.236 0.915 7.661 187 H LEU 24 H LEU 24 19.754 -2.921 5.902 188 HA LEU 24 HA LEU 24 17.784 -1.285 7.268 189 HB2 LEU 24 2HB LEU 24 17.798 -2.608 4.526 190 HB3 LEU 24 3HB LEU 24 16.605 -1.419 5.076 191 HG LEU 24 HG LEU 24 19.605 -0.886 4.888 192 HD11 LEU 24 1HD1 LEU 24 18.574 -1.285 2.682 193 HD12 LEU 24 2HD1 LEU 24 17.316 -0.081 3.046 194 HD13 LEU 24 3HD1 LEU 24 19.016 0.428 2.889 195 HD21 LEU 24 3HD2 LEU 24 18.898 1.481 5.099 196 HD22 LEU 24 1HD2 LEU 24 17.217 0.954 5.343 197 HD23 LEU 24 2HD2 LEU 24 18.471 0.545 6.539 198 H LEU 25 H LEU 25 18.243 -4.714 6.818 199 HA LEU 25 HA LEU 25 15.420 -5.353 7.255 200 HB2 LEU 25 2HB LEU 25 16.805 -6.748 5.799 201 HB3 LEU 25 3HB LEU 25 17.946 -7.038 7.118 202 HG LEU 25 HG LEU 25 16.195 -8.229 8.393 203 HD11 LEU 25 1HD1 LEU 25 14.188 -7.094 7.507 204 HD12 LEU 25 2HD1 LEU 25 14.495 -7.795 5.900 205 HD13 LEU 25 3HD1 LEU 25 14.081 -8.851 7.270 206 HD21 LEU 25 3HD2 LEU 25 17.697 -9.456 6.876 207 HD22 LEU 25 1HD2 LEU 25 16.079 -10.200 6.880 208 HD23 LEU 25 2HD2 LEU 25 16.580 -9.174 5.519 209 H VAL 26 H VAL 26 18.489 -5.518 9.207 210 HA VAL 26 HA VAL 26 17.099 -6.759 11.390 211 HB VAL 26 HB VAL 26 19.039 -6.331 12.731 212 HG11 VAL 26 1HG1 VAL 26 20.756 -7.427 11.402 213 HG12 VAL 26 2HG1 VAL 26 19.160 -8.156 11.087 214 HG13 VAL 26 3HG1 VAL 26 19.889 -7.048 9.902 215 HG21 VAL 26 3HG2 VAL 26 20.968 -5.040 11.880 216 HG22 VAL 26 1HG2 VAL 26 19.981 -4.508 10.493 217 HG23 VAL 26 2HG2 VAL 26 19.539 -4.038 12.160 218 H VAL 27 H VAL 27 17.396 -3.362 10.402 219 HA VAL 27 HA VAL 27 16.853 -2.351 13.041 220 HB VAL 27 HB VAL 27 17.940 -1.022 11.292 221 HG11 VAL 27 1HG1 VAL 27 16.615 -0.012 9.482 222 HG12 VAL 27 2HG1 VAL 27 16.648 -1.781 9.344 223 HG13 VAL 27 3HG1 VAL 27 15.192 -0.963 9.971 224 HG21 VAL 27 3HG2 VAL 27 16.778 0.075 13.185 225 HG22 VAL 27 1HG2 VAL 27 16.756 1.072 11.711 226 HG23 VAL 27 2HG2 VAL 27 15.298 0.190 12.198 227 H ARG 28 H ARG 28 14.787 -3.625 10.460 228 HA ARG 28 HA ARG 28 12.311 -2.572 11.488 229 HB2 ARG 28 2HB ARG 28 12.733 -5.228 10.049 230 HB3 ARG 28 3HB ARG 28 11.273 -4.231 10.077 231 HG2 ARG 28 2HG ARG 28 12.495 -2.463 8.793 232 HG3 ARG 28 3HG ARG 28 13.935 -3.512 8.781 233 HD2 ARG 28 2HD ARG 28 12.788 -3.760 6.667 234 HD3 ARG 28 3HD ARG 28 12.653 -5.261 7.592 235 HE ARG 28 HE ARG 28 10.347 -4.945 7.770 236 HH11 ARG 28 1HH1 ARG 28 11.885 -2.012 6.551 237 HH12 ARG 28 2HH1 ARG 28 10.370 -1.246 6.124 238 HH21 ARG 28 1HH2 ARG 28 8.370 -3.922 7.199 239 HH22 ARG 28 2HH2 ARG 28 8.403 -2.316 6.507 240 H TYR 29 H TYR 29 14.357 -5.331 12.236 241 HA TYR 29 HA TYR 29 12.340 -6.383 14.133 242 HB2 TYR 29 2HB TYR 29 14.837 -7.565 12.894 243 HB3 TYR 29 3HB TYR 29 13.894 -8.358 14.163 244 HD1 TYR 29 HD1 TYR 29 13.837 -7.206 10.640 245 HD2 TYR 29 HD2 TYR 29 11.752 -9.334 13.731 246 HE1 TYR 29 HE1 TYR 29 12.213 -8.026 8.958 247 HE2 TYR 29 HE2 TYR 29 10.142 -10.203 12.061 248 HH TYR 29 HH TYR 29 10.345 -9.335 8.583 249 H GLN 30 H GLN 30 15.038 -4.330 14.188 250 HA GLN 30 HA GLN 30 16.425 -5.216 16.500 251 HB2 GLN 30 2HB GLN 30 17.228 -3.582 14.829 252 HB3 GLN 30 3HB GLN 30 16.055 -2.392 15.429 253 HG2 GLN 30 2HG GLN 30 17.168 -2.386 17.611 254 HG3 GLN 30 3HG GLN 30 18.257 -3.691 17.086 255 HE21 GLN 30 2HE2 GLN 30 19.410 -3.162 14.888 256 HE22 GLN 30 1HE2 GLN 30 20.101 -1.549 14.783 257 H HIS 31 H HIS 31 13.418 -3.388 16.087 258 HA HIS 31 HA HIS 31 13.217 -2.830 18.969 259 HB2 HIS 31 2HB HIS 31 12.366 -1.260 17.253 260 HB3 HIS 31 3HB HIS 31 11.230 -2.497 16.700 261 HD2 HIS 31 HD2 HIS 31 8.914 -2.564 17.884 262 HE1 HIS 31 HE1 HIS 31 9.773 -0.094 21.240 263 HE2 HIS 31 HE2 HIS 31 7.942 -1.369 20.004 264 H LYS 32 H LYS 32 12.155 -5.273 16.639 265 HA LYS 32 HA LYS 32 10.040 -6.301 18.352 266 HB2 LYS 32 2HB LYS 32 11.354 -7.493 15.879 267 HB3 LYS 32 3HB LYS 32 9.857 -8.055 16.633 268 HG2 LYS 32 2HG LYS 32 8.792 -5.870 16.211 269 HG3 LYS 32 3HG LYS 32 10.282 -5.288 15.431 270 HD2 LYS 32 2HD LYS 32 10.099 -7.095 13.744 271 HD3 LYS 32 3HD LYS 32 8.609 -7.670 14.530 272 HE2 LYS 32 2HE LYS 32 7.557 -5.465 14.114 273 HE3 LYS 32 3HE LYS 32 9.044 -4.902 13.329 274 HZ1 LYS 32 3HZ LYS 32 8.752 -6.629 11.685 275 HZ2 LYS 32 1HZ LYS 32 7.363 -7.142 12.403 276 HZ3 LYS 32 2HZ LYS 32 7.439 -5.647 11.725 277 H VAL 33 H VAL 33 13.434 -7.296 17.622 278 HA VAL 33 HA VAL 33 13.074 -9.679 19.280 279 HB VAL 33 HB VAL 33 15.325 -10.245 18.744 280 HG11 VAL 33 1HG1 VAL 33 15.216 -10.321 16.299 281 HG12 VAL 33 2HG1 VAL 33 13.618 -10.639 17.019 282 HG13 VAL 33 3HG1 VAL 33 13.970 -9.053 16.295 283 HG21 VAL 33 3HG2 VAL 33 15.618 -7.479 17.517 284 HG22 VAL 33 1HG2 VAL 33 16.421 -8.082 18.981 285 HG23 VAL 33 2HG2 VAL 33 16.796 -8.808 17.406 286 H ALA 34 H ALA 34 14.214 -6.372 19.711 287 HA ALA 34 HA ALA 34 15.634 -6.919 22.169 288 HB1 ALA 34 1HB ALA 34 14.386 -4.357 21.105 289 HB2 ALA 34 2HB ALA 34 15.539 -4.479 22.460 290 HB3 ALA 34 3HB ALA 34 16.053 -4.904 20.813 291 H SER 35 H SER 35 12.264 -6.616 21.272 292 HA SER 35 HA SER 35 11.337 -5.938 23.949 293 HB2 SER 35 2HB SER 35 10.158 -5.337 21.823 294 HB3 SER 35 3HB SER 35 9.809 -7.060 21.567 295 HG SER 35 HG SER 35 8.673 -7.048 23.533 296 H LEU 36 H LEU 36 11.655 -8.877 21.927 297 HA LEU 36 HA LEU 36 10.383 -10.505 23.980 298 HB2 LEU 36 2HB LEU 36 10.616 -12.332 22.475 299 HB3 LEU 36 3HB LEU 36 10.089 -10.921 21.569 300 HG LEU 36 HG LEU 36 12.632 -10.605 21.033 301 HD11 LEU 36 1HD1 LEU 36 13.850 -12.746 20.804 302 HD12 LEU 36 2HD1 LEU 36 13.549 -12.403 22.512 303 HD13 LEU 36 3HD1 LEU 36 12.544 -13.593 21.660 304 HD21 LEU 36 3HD2 LEU 36 11.009 -12.915 19.889 305 HD22 LEU 36 1HD2 LEU 36 10.862 -11.203 19.410 306 HD23 LEU 36 2HD2 LEU 36 12.365 -12.092 19.075 307 H VAL 37 H VAL 37 13.691 -9.566 23.213 308 HA VAL 37 HA VAL 37 14.714 -11.777 24.848 309 HB VAL 37 HB VAL 37 15.759 -10.879 22.678 310 HG11 VAL 37 1HG1 VAL 37 17.057 -8.980 24.656 311 HG12 VAL 37 2HG1 VAL 37 17.369 -9.112 22.911 312 HG13 VAL 37 3HG1 VAL 37 15.805 -8.480 23.485 313 HG21 VAL 37 3HG2 VAL 37 17.995 -11.487 23.465 314 HG22 VAL 37 1HG2 VAL 37 17.486 -11.265 25.152 315 HG23 VAL 37 2HG2 VAL 37 16.773 -12.571 24.172 316 H SER 38 H SER 38 13.767 -8.445 25.337 317 HA SER 38 HA SER 38 15.499 -7.898 27.557 318 HB2 SER 38 2HB SER 38 14.389 -6.165 26.221 319 HB3 SER 38 3HB SER 38 12.808 -6.689 26.833 320 HG SER 38 HG SER 38 13.690 -4.928 28.009 321 H ARG 39 H ARG 39 12.799 -10.029 27.270 322 HA ARG 39 HA ARG 39 12.284 -9.935 30.180 323 HB2 ARG 39 2HB ARG 39 10.530 -11.558 29.766 324 HB3 ARG 39 3HB ARG 39 10.350 -10.145 28.713 325 HG2 ARG 39 2HG ARG 39 11.335 -11.334 26.849 326 HG3 ARG 39 3HG ARG 39 11.600 -12.787 27.862 327 HD2 ARG 39 2HD ARG 39 8.904 -11.507 27.276 328 HD3 ARG 39 3HD ARG 39 9.556 -12.927 26.421 329 HE ARG 39 HE ARG 39 9.635 -13.489 29.187 330 HH11 ARG 39 1HH1 ARG 39 7.227 -12.913 26.669 331 HH12 ARG 39 2HH1 ARG 39 6.008 -13.903 27.441 332 HH21 ARG 39 1HH2 ARG 39 8.038 -14.781 30.170 333 HH22 ARG 39 2HH2 ARG 39 6.468 -14.959 29.420 334 H TYR 40 H TYR 40 14.595 -11.322 28.201 335 HA TYR 40 HA TYR 40 14.906 -13.653 30.036 336 HB2 TYR 40 2HB TYR 40 15.970 -13.178 27.236 337 HB3 TYR 40 3HB TYR 40 16.383 -14.557 28.251 338 HD1 TYR 40 HD1 TYR 40 14.624 -16.223 28.899 339 HD2 TYR 40 HD2 TYR 40 13.893 -13.118 26.019 340 HE1 TYR 40 HE1 TYR 40 12.621 -17.454 28.074 341 HE2 TYR 40 HE2 TYR 40 11.931 -14.356 25.163 342 HH TYR 40 HH TYR 40 10.899 -17.490 26.576 343 H VAL 41 H VAL 41 16.358 -10.638 28.928 344 HA VAL 41 HA VAL 41 18.449 -11.000 30.993 345 HB VAL 41 HB VAL 41 20.127 -9.941 29.521 346 HG11 VAL 41 1HG1 VAL 41 20.093 -12.377 29.741 347 HG12 VAL 41 2HG1 VAL 41 18.953 -12.498 28.378 348 HG13 VAL 41 3HG1 VAL 41 20.600 -11.889 28.111 349 HG21 VAL 41 3HG2 VAL 41 18.600 -8.779 27.974 350 HG22 VAL 41 1HG2 VAL 41 19.818 -9.762 27.140 351 HG23 VAL 41 2HG2 VAL 41 18.143 -10.357 27.270 352 HA PRO 42 HA PRO 42 17.116 -7.055 32.230 353 HB2 PRO 42 2HB PRO 42 19.319 -5.896 33.345 354 HB3 PRO 42 3HB PRO 42 18.553 -7.364 34.033 355 HG2 PRO 42 2HG PRO 42 20.926 -7.219 32.147 356 HG3 PRO 42 3HG PRO 42 20.810 -8.103 33.711 357 HD2 PRO 42 2HD PRO 42 20.379 -9.338 31.337 358 HD3 PRO 42 3HD PRO 42 19.375 -9.744 32.768 359 H SER 43 H SER 43 17.548 -4.623 32.063 360 HA SER 43 HA SER 43 17.694 -3.919 29.327 361 HB2 SER 43 2HB SER 43 17.905 -2.169 31.807 362 HB3 SER 43 3HB SER 43 17.506 -1.610 30.166 363 HG SER 43 HG SER 43 15.640 -1.987 31.448 364 H GLY 44 H GLY 44 20.246 -4.505 31.550 365 HA2 GLY 44 2HA GLY 44 22.151 -2.655 30.288 366 HA3 GLY 44 3HA GLY 44 22.455 -3.798 31.612 367 H ASP 45 H ASP 45 21.014 -5.917 29.766 368 HA ASP 45 HA ASP 45 23.449 -6.496 28.138 369 HB2 ASP 45 2HB ASP 45 23.141 -8.011 30.071 370 HB3 ASP 45 3HB ASP 45 21.536 -8.445 29.474 371 H VAL 46 H VAL 46 20.125 -5.722 27.975 372 HA VAL 46 HA VAL 46 19.387 -7.471 25.886 373 HB VAL 46 HB VAL 46 17.731 -6.351 27.186 374 HG11 VAL 46 1HG1 VAL 46 18.493 -3.730 25.862 375 HG12 VAL 46 2HG1 VAL 46 17.176 -4.024 27.024 376 HG13 VAL 46 3HG1 VAL 46 18.870 -4.169 27.552 377 HG21 VAL 46 3HG2 VAL 46 17.590 -5.332 24.311 378 HG22 VAL 46 1HG2 VAL 46 17.131 -6.966 24.840 379 HG23 VAL 46 2HG2 VAL 46 16.222 -5.549 25.411 380 HA PRO 47 HA PRO 47 20.660 -4.134 22.774 381 HB2 PRO 47 2HB PRO 47 22.719 -2.440 23.224 382 HB3 PRO 47 3HB PRO 47 21.072 -2.107 23.865 383 HG2 PRO 47 2HG PRO 47 23.406 -3.377 25.325 384 HG3 PRO 47 3HG PRO 47 22.378 -2.010 25.863 385 HD2 PRO 47 2HD PRO 47 21.931 -4.588 26.628 386 HD3 PRO 47 3HD PRO 47 20.576 -3.449 26.359 387 H ASP 48 H ASP 48 23.095 -5.775 24.777 388 HA ASP 48 HA ASP 48 25.006 -5.943 22.563 389 HB2 ASP 48 2HB ASP 48 25.685 -5.697 24.965 390 HB3 ASP 48 3HB ASP 48 24.993 -7.294 25.290 391 H VAL 49 H VAL 49 22.555 -8.016 24.120 392 HA VAL 49 HA VAL 49 23.419 -10.386 22.666 393 HB VAL 49 HB VAL 49 21.005 -9.732 24.398 394 HG11 VAL 49 1HG1 VAL 49 21.799 -12.374 23.107 395 HG12 VAL 49 2HG1 VAL 49 20.553 -12.165 24.365 396 HG13 VAL 49 3HG1 VAL 49 20.323 -11.435 22.762 397 HG21 VAL 49 3HG2 VAL 49 23.474 -11.471 24.774 398 HG22 VAL 49 1HG2 VAL 49 23.162 -9.898 25.548 399 HG23 VAL 49 2HG2 VAL 49 22.136 -11.297 25.938 400 H VAL 50 H VAL 50 21.208 -7.675 22.081 401 HA VAL 50 HA VAL 50 19.864 -8.978 19.857 402 HB VAL 50 HB VAL 50 20.164 -6.090 20.754 403 HG11 VAL 50 1HG1 VAL 50 18.559 -7.194 18.409 404 HG12 VAL 50 2HG1 VAL 50 18.405 -5.553 19.068 405 HG13 VAL 50 3HG1 VAL 50 19.923 -6.060 18.303 406 HG21 VAL 50 3HG2 VAL 50 17.779 -7.984 20.635 407 HG22 VAL 50 1HG2 VAL 50 18.723 -7.652 22.092 408 HG23 VAL 50 2HG2 VAL 50 17.800 -6.337 21.324 409 H GLN 51 H GLN 51 22.843 -7.018 20.280 410 HA GLN 51 HA GLN 51 23.284 -6.772 17.432 411 HB2 GLN 51 2HB GLN 51 24.272 -5.230 19.061 412 HB3 GLN 51 3HB GLN 51 25.195 -6.569 19.793 413 HG2 GLN 51 2HG GLN 51 26.437 -6.913 17.744 414 HG3 GLN 51 3HG GLN 51 25.446 -5.726 16.878 415 HE21 GLN 51 2HE2 GLN 51 27.913 -5.104 16.538 416 HE22 GLN 51 1HE2 GLN 51 28.499 -3.871 17.635 417 H GLU 52 H GLU 52 24.401 -9.106 19.975 418 HA GLU 52 HA GLU 52 26.057 -10.558 18.144 419 HB2 GLU 52 2HB GLU 52 26.240 -10.694 20.613 420 HB3 GLU 52 3HB GLU 52 24.663 -11.514 20.687 421 HG2 GLU 52 2HG GLU 52 25.539 -13.361 19.304 422 HG3 GLU 52 3HG GLU 52 27.095 -12.530 19.146 423 H ALA 53 H ALA 53 22.572 -10.588 18.837 424 HA ALA 53 HA ALA 53 22.063 -13.111 17.549 425 HB1 ALA 53 1HB ALA 53 20.236 -10.740 18.092 426 HB2 ALA 53 2HB ALA 53 19.718 -12.383 17.645 427 HB3 ALA 53 3HB ALA 53 20.536 -12.105 19.192 428 H PHE 54 H PHE 54 22.452 -9.764 16.372 429 HA PHE 54 HA PHE 54 21.414 -10.521 13.728 430 HB2 PHE 54 2HB PHE 54 22.673 -7.975 14.809 431 HB3 PHE 54 3HB PHE 54 22.129 -8.174 13.152 432 HD1 PHE 54 HD1 PHE 54 19.579 -9.823 13.740 433 HD2 PHE 54 HD2 PHE 54 21.189 -6.235 15.503 434 HE1 PHE 54 HE1 PHE 54 17.309 -9.111 14.375 435 HE2 PHE 54 HE2 PHE 54 18.891 -5.495 16.071 436 HZ PHE 54 HZ PHE 54 16.952 -6.944 15.509 437 H ILE 55 H ILE 55 24.576 -10.215 15.333 438 HA ILE 55 HA ILE 55 26.072 -10.440 12.857 439 HB ILE 55 HB ILE 55 26.793 -11.034 15.755 440 HG12 ILE 55 2HG1 ILE 55 27.456 -8.623 14.000 441 HG13 ILE 55 3HG1 ILE 55 26.181 -8.650 15.205 442 HG21 ILE 55 1HG2 ILE 55 28.592 -10.738 13.306 443 HG22 ILE 55 2HG2 ILE 55 29.146 -10.976 14.982 444 HG23 ILE 55 3HG2 ILE 55 28.258 -12.263 14.160 445 HD11 ILE 55 3HD1 ILE 55 27.883 -9.160 16.975 446 HD12 ILE 55 1HD1 ILE 55 29.159 -9.003 15.745 447 HD13 ILE 55 2HD1 ILE 55 28.148 -7.606 16.164 448 H LYS 56 H LYS 56 24.722 -12.682 15.276 449 HA LYS 56 HA LYS 56 25.882 -15.060 14.092 450 HB2 LYS 56 2HB LYS 56 25.327 -14.790 16.486 451 HB3 LYS 56 3HB LYS 56 23.606 -14.645 16.072 452 HG2 LYS 56 2HG LYS 56 23.661 -16.943 15.113 453 HG3 LYS 56 3HG LYS 56 25.375 -17.077 15.575 454 HD2 LYS 56 2HD LYS 56 23.049 -16.590 17.485 455 HD3 LYS 56 3HD LYS 56 23.885 -18.145 17.257 456 HE2 LYS 56 2HE LYS 56 26.010 -17.110 18.001 457 HE3 LYS 56 3HE LYS 56 25.178 -15.563 18.228 458 HZ1 LYS 56 3HZ LYS 56 23.778 -16.631 19.856 459 HZ2 LYS 56 1HZ LYS 56 24.589 -18.052 19.680 460 HZ3 LYS 56 2HZ LYS 56 25.368 -16.734 20.282 461 H ALA 57 H ALA 57 22.819 -13.249 13.754 462 HA ALA 57 HA ALA 57 21.439 -15.351 12.367 463 HB1 ALA 57 1HB ALA 57 21.044 -12.330 12.367 464 HB2 ALA 57 2HB ALA 57 19.923 -13.512 11.649 465 HB3 ALA 57 3HB ALA 57 20.207 -13.518 13.397 466 H TYR 58 H TYR 58 23.478 -12.571 11.236 467 HA TYR 58 HA TYR 58 22.855 -12.893 8.489 468 HB2 TYR 58 2HB TYR 58 23.987 -10.936 9.570 469 HB3 TYR 58 3HB TYR 58 25.430 -11.934 9.782 470 HD1 TYR 58 HD2 TYR 58 23.057 -10.797 7.095 471 HD2 TYR 58 HD1 TYR 58 27.075 -11.926 8.135 472 HE1 TYR 58 HE2 TYR 58 23.821 -10.111 4.838 473 HE2 TYR 58 HE1 TYR 58 27.850 -11.273 5.868 474 HH TYR 58 HH TYR 58 27.251 -10.415 3.824 475 H ARG 59 H ARG 59 25.340 -14.413 10.550 476 HA ARG 59 HA ARG 59 26.720 -15.752 8.397 477 HB2 ARG 59 2HB ARG 59 26.575 -16.223 11.398 478 HB3 ARG 59 3HB ARG 59 27.732 -17.024 10.312 479 HG2 ARG 59 2HG ARG 59 28.768 -14.926 9.725 480 HG3 ARG 59 3HG ARG 59 27.506 -13.990 10.567 481 HD2 ARG 59 2HD ARG 59 28.167 -14.903 12.713 482 HD3 ARG 59 3HD ARG 59 29.323 -15.999 11.929 483 HE ARG 59 HE ARG 59 29.989 -13.356 11.168 484 HH11 ARG 59 1HH1 ARG 59 29.900 -15.330 14.097 485 HH12 ARG 59 2HH1 ARG 59 31.190 -14.448 14.880 486 HH21 ARG 59 1HH2 ARG 59 31.679 -12.216 12.213 487 HH22 ARG 59 2HH2 ARG 59 32.190 -12.686 13.818 488 H ALA 60 H ALA 60 23.865 -16.476 10.315 489 HA ALA 60 HA ALA 60 23.757 -19.245 9.281 490 HB1 ALA 60 1HB ALA 60 21.929 -17.706 11.166 491 HB2 ALA 60 2HB ALA 60 21.825 -19.442 10.790 492 HB3 ALA 60 3HB ALA 60 23.244 -18.798 11.652 493 H LEU 61 H LEU 61 22.756 -16.112 8.315 494 HA LEU 61 HA LEU 61 20.190 -16.821 7.219 495 HB2 LEU 61 2HB LEU 61 20.989 -14.521 7.991 496 HB3 LEU 61 3HB LEU 61 21.996 -14.469 6.532 497 HG LEU 61 HG LEU 61 19.872 -14.781 5.182 498 HD11 LEU 61 1HD1 LEU 61 18.624 -14.361 7.925 499 HD12 LEU 61 2HD1 LEU 61 17.742 -14.247 6.380 500 HD13 LEU 61 3HD1 LEU 61 18.431 -15.802 6.903 501 HD21 LEU 61 3HD2 LEU 61 19.982 -12.422 7.111 502 HD22 LEU 61 1HD2 LEU 61 20.902 -12.580 5.595 503 HD23 LEU 61 2HD2 LEU 61 19.124 -12.451 5.550 504 H ASP 62 H ASP 62 23.525 -16.930 6.122 505 HA ASP 62 HA ASP 62 22.980 -17.255 3.323 506 HB2 ASP 62 2HB ASP 62 25.181 -16.643 4.318 507 HB3 ASP 62 3HB ASP 62 25.296 -18.275 5.005 508 H SER 63 H SER 63 22.260 -19.225 6.017 509 HA SER 63 HA SER 63 22.159 -21.685 4.349 510 HB2 SER 63 2HB SER 63 22.143 -21.358 7.371 511 HB3 SER 63 3HB SER 63 22.121 -22.891 6.474 512 HG SER 63 HG SER 63 24.230 -22.293 7.135 513 H PHE 64 H PHE 64 20.209 -19.156 5.145 514 HA PHE 64 HA PHE 64 17.822 -20.513 6.023 515 HB2 PHE 64 2HB PHE 64 18.316 -18.121 6.399 516 HB3 PHE 64 3HB PHE 64 18.228 -17.830 4.661 517 HD1 PHE 64 HD2 PHE 64 16.151 -19.273 7.451 518 HD2 PHE 64 HD1 PHE 64 16.229 -17.077 3.751 519 HE1 PHE 64 HE2 PHE 64 13.720 -18.858 7.650 520 HE2 PHE 64 HE1 PHE 64 13.792 -16.661 3.954 521 HZ PHE 64 HZ PHE 64 12.532 -17.552 5.896 522 H ARG 65 H ARG 65 15.896 -20.907 4.750 523 HA ARG 65 HA ARG 65 16.420 -21.276 1.839 524 HB2 ARG 65 2HB ARG 65 15.151 -23.316 3.698 525 HB3 ARG 65 3HB ARG 65 15.430 -23.508 1.960 526 HG2 ARG 65 2HG ARG 65 17.865 -23.412 2.317 527 HG3 ARG 65 3HG ARG 65 17.618 -23.155 4.058 528 HD2 ARG 65 2HD ARG 65 16.734 -25.609 2.492 529 HD3 ARG 65 3HD ARG 65 18.132 -25.507 3.580 530 HE ARG 65 HE ARG 65 15.596 -24.743 4.821 531 HH11 ARG 65 1HH1 ARG 65 17.767 -27.449 4.113 532 HH12 ARG 65 2HH1 ARG 65 17.117 -28.436 5.405 533 HH21 ARG 65 1HH2 ARG 65 14.791 -26.026 6.452 534 HH22 ARG 65 2HH2 ARG 65 15.440 -27.626 6.746 535 H GLY 66 H GLY 66 14.372 -19.990 4.209 536 HA2 GLY 66 2HA GLY 66 12.311 -18.973 3.989 537 HA3 GLY 66 3HA GLY 66 12.305 -19.398 2.272 538 H ASP 67 H ASP 67 12.865 -22.123 4.339 539 HA ASP 67 HA ASP 67 10.326 -23.295 3.639 540 HB2 ASP 67 2HB ASP 67 11.106 -25.206 4.935 541 HB3 ASP 67 3HB ASP 67 12.382 -24.617 3.865 542 H SER 68 H SER 68 11.140 -21.020 5.944 543 HA SER 68 HA SER 68 8.566 -21.345 7.320 544 HB2 SER 68 2HB SER 68 10.209 -22.609 8.704 545 HB3 SER 68 3HB SER 68 11.207 -21.144 8.824 546 HG SER 68 HG SER 68 9.784 -21.415 10.608 547 H ALA 69 H ALA 69 8.155 -19.290 8.660 548 HA ALA 69 HA ALA 69 8.693 -17.024 6.990 549 HB1 ALA 69 1HB ALA 69 6.647 -17.271 8.341 550 HB2 ALA 69 2HB ALA 69 7.614 -17.146 9.833 551 HB3 ALA 69 3HB ALA 69 7.511 -15.761 8.716 552 H PHE 70 H PHE 70 9.992 -15.168 7.364 553 HA PHE 70 HA PHE 70 12.557 -15.808 8.467 554 HB2 PHE 70 2HB PHE 70 12.327 -14.290 6.586 555 HB3 PHE 70 3HB PHE 70 11.310 -13.202 7.540 556 HD1 PHE 70 HD1 PHE 70 14.721 -14.802 7.679 557 HD2 PHE 70 HD2 PHE 70 12.304 -11.346 8.545 558 HE1 PHE 70 HE1 PHE 70 16.728 -13.590 8.481 559 HE2 PHE 70 HE2 PHE 70 14.325 -10.130 9.323 560 HZ PHE 70 HZ PHE 70 16.535 -11.256 9.287 561 H TYR 71 H TYR 71 9.724 -14.033 9.772 562 HA TYR 71 HA TYR 71 11.249 -12.806 11.875 563 HB2 TYR 71 2HB TYR 71 9.120 -12.225 12.851 564 HB3 TYR 71 3HB TYR 71 9.145 -11.874 11.124 565 HD1 TYR 71 HD1 TYR 71 7.812 -14.186 13.710 566 HD2 TYR 71 HD2 TYR 71 7.603 -12.896 9.615 567 HE1 TYR 71 HE1 TYR 71 5.700 -15.460 13.427 568 HE2 TYR 71 HE2 TYR 71 5.484 -14.166 9.324 569 HH TYR 71 HH TYR 71 4.024 -16.068 11.990 570 H THR 72 H THR 72 9.441 -15.909 11.638 571 HA THR 72 HA THR 72 9.726 -16.529 14.440 572 HB THR 72 HB THR 72 9.361 -18.393 12.060 573 HG1 THR 72 1HG THR 72 7.168 -18.145 12.547 574 HG21 THR 72 1HG2 THR 72 8.256 -19.849 13.756 575 HG22 THR 72 2HG2 THR 72 9.967 -19.593 14.129 576 HG23 THR 72 3HG2 THR 72 8.718 -18.694 15.026 577 H TRP 73 H TRP 73 11.692 -17.012 11.532 578 HA TRP 73 HA TRP 73 13.571 -18.843 12.737 579 HB2 TRP 73 2HB TRP 73 13.139 -18.792 10.344 580 HB3 TRP 73 3HB TRP 73 13.609 -17.097 10.260 581 HD1 TRP 73 HD1 TRP 73 15.034 -20.576 10.261 582 HE1 TRP 73 HE1 TRP 73 17.552 -20.511 9.808 583 HE3 TRP 73 HE3 TRP 73 15.791 -15.526 10.648 584 HZ2 TRP 73 HZ2 TRP 73 19.656 -18.540 9.801 585 HZ3 TRP 73 HZ3 TRP 73 18.071 -14.596 10.420 586 HH2 TRP 73 HH2 TRP 73 20.004 -16.084 10.057 587 H LEU 74 H LEU 74 13.265 -15.314 12.550 588 HA LEU 74 HA LEU 74 16.033 -14.874 13.389 589 HB2 LEU 74 2HB LEU 74 14.909 -13.393 11.779 590 HB3 LEU 74 3HB LEU 74 13.670 -13.011 12.984 591 HG LEU 74 HG LEU 74 15.395 -11.987 14.444 592 HD11 LEU 74 1HD1 LEU 74 17.653 -11.544 13.500 593 HD12 LEU 74 2HD1 LEU 74 17.372 -13.279 13.736 594 HD13 LEU 74 3HD1 LEU 74 17.258 -12.567 12.103 595 HD21 LEU 74 3HD2 LEU 74 15.414 -10.959 11.581 596 HD22 LEU 74 1HD2 LEU 74 14.149 -10.642 12.790 597 HD23 LEU 74 2HD2 LEU 74 15.794 -10.010 13.038 598 H TYR 75 H TYR 75 12.754 -14.832 14.840 599 HA TYR 75 HA TYR 75 13.490 -13.578 17.293 600 HB2 TYR 75 2HB TYR 75 11.352 -15.649 16.664 601 HB3 TYR 75 3HB TYR 75 11.481 -14.792 18.194 602 HD1 TYR 75 HD1 TYR 75 12.384 -12.237 16.075 603 HD2 TYR 75 HD2 TYR 75 8.975 -14.705 16.978 604 HE1 TYR 75 HE1 TYR 75 10.879 -10.460 15.248 605 HE2 TYR 75 HE2 TYR 75 7.465 -12.937 16.129 606 HH TYR 75 HH TYR 75 8.705 -9.828 14.844 607 H ARG 76 H ARG 76 13.824 -16.965 16.166 608 HA ARG 76 HA ARG 76 14.453 -17.891 18.837 609 HB2 ARG 76 2HB ARG 76 14.952 -20.011 17.809 610 HB3 ARG 76 3HB ARG 76 13.426 -19.372 17.185 611 HG2 ARG 76 2HG ARG 76 14.543 -18.634 15.127 612 HG3 ARG 76 3HG ARG 76 16.121 -19.164 15.772 613 HD2 ARG 76 2HD ARG 76 15.199 -21.488 15.955 614 HD3 ARG 76 3HD ARG 76 13.723 -20.923 15.146 615 HE ARG 76 HE ARG 76 15.902 -20.173 13.519 616 HH11 ARG 76 1HH1 ARG 76 14.409 -23.145 14.704 617 HH12 ARG 76 2HH1 ARG 76 14.943 -24.099 13.336 618 HH21 ARG 76 1HH2 ARG 76 16.602 -21.439 11.766 619 HH22 ARG 76 2HH2 ARG 76 16.179 -23.134 11.676 620 H ILE 77 H ILE 77 16.358 -16.378 16.273 621 HA ILE 77 HA ILE 77 18.896 -17.401 17.181 622 HB ILE 77 HB ILE 77 18.347 -14.700 15.891 623 HG12 ILE 77 2HG1 ILE 77 17.389 -16.395 14.427 624 HG13 ILE 77 3HG1 ILE 77 18.857 -15.715 13.735 625 HG21 ILE 77 1HG2 ILE 77 20.817 -16.470 16.068 626 HG22 ILE 77 2HG2 ILE 77 20.695 -15.004 15.074 627 HG23 ILE 77 3HG2 ILE 77 20.582 -14.883 16.836 628 HD11 ILE 77 3HD1 ILE 77 18.739 -18.147 13.402 629 HD12 ILE 77 1HD1 ILE 77 20.139 -17.715 14.404 630 HD13 ILE 77 2HD1 ILE 77 18.677 -18.401 15.158 631 H ALA 78 H ALA 78 16.808 -14.664 18.144 632 HA ALA 78 HA ALA 78 18.886 -13.439 19.736 633 HB1 ALA 78 1HB ALA 78 17.131 -12.139 18.602 634 HB2 ALA 78 2HB ALA 78 15.887 -12.928 19.598 635 HB3 ALA 78 3HB ALA 78 17.085 -11.865 20.359 636 H VAL 79 H VAL 79 16.072 -15.568 20.525 637 HA VAL 79 HA VAL 79 16.555 -15.125 23.369 638 HB VAL 79 HB VAL 79 14.288 -15.428 22.503 639 HG11 VAL 79 1HG1 VAL 79 13.481 -17.625 21.834 640 HG12 VAL 79 2HG1 VAL 79 14.763 -17.070 20.727 641 HG13 VAL 79 3HG1 VAL 79 15.120 -18.303 21.965 642 HG21 VAL 79 3HG2 VAL 79 15.133 -17.700 24.347 643 HG22 VAL 79 1HG2 VAL 79 14.872 -16.021 24.860 644 HG23 VAL 79 2HG2 VAL 79 13.514 -16.976 24.221 645 H ASN 80 H ASN 80 17.534 -17.507 20.936 646 HA ASN 80 HA ASN 80 18.478 -19.414 22.926 647 HB2 ASN 80 2HB ASN 80 19.039 -19.079 19.953 648 HB3 ASN 80 3HB ASN 80 19.682 -20.399 20.944 649 HD21 ASN 80 2HD2 ASN 80 18.282 -21.274 18.889 650 HD22 ASN 80 1HD2 ASN 80 16.687 -21.810 19.365 651 H THR 81 H THR 81 19.759 -16.488 21.410 652 HA THR 81 HA THR 81 22.497 -17.043 22.254 653 HB THR 81 HB THR 81 21.147 -14.490 21.288 654 HG1 THR 81 1HG THR 81 21.251 -15.999 19.686 655 HG21 THR 81 1HG2 THR 81 24.092 -15.187 21.696 656 HG22 THR 81 2HG2 THR 81 23.481 -13.733 20.865 657 HG23 THR 81 3HG2 THR 81 23.178 -13.962 22.596 658 H ALA 82 H ALA 82 19.614 -15.481 23.639 659 HA ALA 82 HA ALA 82 21.062 -14.092 25.713 660 HB1 ALA 82 1HB ALA 82 18.816 -13.739 26.652 661 HB2 ALA 82 2HB ALA 82 18.825 -13.424 24.900 662 HB3 ALA 82 3HB ALA 82 18.138 -14.939 25.521 663 H LYS 83 H LYS 83 19.569 -17.330 25.419 664 HA LYS 83 HA LYS 83 19.984 -17.938 28.243 665 HB2 LYS 83 2HB LYS 83 19.240 -19.603 25.811 666 HB3 LYS 83 3HB LYS 83 19.386 -20.266 27.454 667 HG2 LYS 83 2HG LYS 83 17.681 -18.712 28.280 668 HG3 LYS 83 3HG LYS 83 17.541 -17.962 26.678 669 HD2 LYS 83 2HD LYS 83 16.768 -20.059 25.704 670 HD3 LYS 83 3HD LYS 83 16.961 -20.894 27.260 671 HE2 LYS 83 2HE LYS 83 15.113 -18.520 26.780 672 HE3 LYS 83 3HE LYS 83 14.599 -20.214 26.764 673 HZ1 LYS 83 3HZ LYS 83 15.334 -20.402 29.042 674 HZ2 LYS 83 1HZ LYS 83 15.806 -18.828 29.063 675 HZ3 LYS 83 2HZ LYS 83 14.214 -19.212 28.904 676 H ASN 84 H ASN 84 21.821 -18.274 25.229 677 HA ASN 84 HA ASN 84 23.843 -20.001 26.404 678 HB2 ASN 84 2HB ASN 84 23.366 -19.941 23.990 679 HB3 ASN 84 3HB ASN 84 23.858 -18.240 23.924 680 HD21 ASN 84 2HD2 ASN 84 26.068 -17.699 23.934 681 HD22 ASN 84 1HD2 ASN 84 27.329 -18.907 23.839 682 H TYR 85 H TYR 85 23.211 -16.526 26.224 683 HA TYR 85 HA TYR 85 25.893 -15.692 26.892 684 HB2 TYR 85 2HB TYR 85 24.227 -14.308 25.683 685 HB3 TYR 85 3HB TYR 85 23.212 -14.286 27.129 686 HD1 TYR 85 HD1 TYR 85 26.273 -13.003 25.548 687 HD2 TYR 85 HD2 TYR 85 23.785 -12.907 29.046 688 HE1 TYR 85 HE1 TYR 85 27.519 -11.023 26.366 689 HE2 TYR 85 HE2 TYR 85 25.014 -10.914 29.879 690 HH TYR 85 HH TYR 85 27.775 -9.504 28.075 691 H LEU 86 H LEU 86 22.936 -16.468 28.754 692 HA LEU 86 HA LEU 86 24.072 -15.410 31.211 693 HB2 LEU 86 2HB LEU 86 21.603 -17.071 30.615 694 HB3 LEU 86 3HB LEU 86 22.034 -16.504 32.232 695 HG LEU 86 HG LEU 86 21.531 -14.674 29.850 696 HD11 LEU 86 1HD1 LEU 86 19.493 -15.809 30.646 697 HD12 LEU 86 2HD1 LEU 86 19.878 -15.352 32.321 698 HD13 LEU 86 3HD1 LEU 86 19.479 -14.095 31.127 699 HD21 LEU 86 3HD2 LEU 86 22.044 -14.102 32.801 700 HD22 LEU 86 1HD2 LEU 86 23.099 -13.651 31.437 701 HD23 LEU 86 2HD2 LEU 86 21.507 -12.903 31.608 702 H VAL 87 H VAL 87 24.310 -18.511 29.570 703 HA VAL 87 HA VAL 87 25.234 -19.753 32.091 704 HB VAL 87 HB VAL 87 25.533 -21.781 30.764 705 HG11 VAL 87 1HG1 VAL 87 23.147 -22.198 30.334 706 HG12 VAL 87 2HG1 VAL 87 23.369 -21.282 31.843 707 HG13 VAL 87 3HG1 VAL 87 22.821 -20.453 30.370 708 HG21 VAL 87 3HG2 VAL 87 24.713 -21.890 28.442 709 HG22 VAL 87 1HG2 VAL 87 24.444 -20.133 28.451 710 HG23 VAL 87 2HG2 VAL 87 26.095 -20.786 28.579 711 H ALA 88 H ALA 88 26.542 -18.030 29.371 712 HA ALA 88 HA ALA 88 29.213 -19.163 29.626 713 HB1 ALA 88 1HB ALA 88 28.208 -16.631 28.253 714 HB2 ALA 88 2HB ALA 88 29.821 -17.349 28.045 715 HB3 ALA 88 3HB ALA 88 28.381 -18.231 27.491 716 H GLN 89 H GLN 89 27.402 -16.604 31.176 717 HA GLN 89 HA GLN 89 29.878 -15.711 32.584 718 HB2 GLN 89 2HB GLN 89 27.252 -14.347 31.925 719 HB3 GLN 89 3HB GLN 89 28.239 -13.820 33.294 720 HG2 GLN 89 2HG GLN 89 28.805 -12.459 31.410 721 HG3 GLN 89 3HG GLN 89 30.186 -13.504 31.781 722 HE21 GLN 89 2HE2 GLN 89 27.316 -13.202 29.612 723 HE22 GLN 89 1HE2 GLN 89 28.060 -14.017 28.257 724 H GLY 90 H GLY 90 26.890 -17.477 32.914 725 HA2 GLY 90 2HA GLY 90 26.694 -17.140 35.802 726 HA3 GLY 90 3HA GLY 90 25.771 -18.254 34.774 727 H ARG 91 H ARG 91 28.406 -19.258 33.588 728 HA ARG 91 HA ARG 91 29.060 -21.168 35.741 729 HB2 ARG 91 2HB ARG 91 29.697 -21.137 32.768 730 HB3 ARG 91 3HB ARG 91 30.212 -22.404 33.898 731 HG2 ARG 91 2HG ARG 91 27.869 -22.899 34.465 732 HG3 ARG 91 3HG ARG 91 27.311 -21.610 33.384 733 HD2 ARG 91 2HD ARG 91 28.356 -22.762 31.461 734 HD3 ARG 91 3HD ARG 91 28.903 -24.064 32.534 735 HE ARG 91 HE ARG 91 26.185 -23.947 32.978 736 HH11 ARG 91 1HH1 ARG 91 28.208 -24.311 30.100 737 HH12 ARG 91 2HH1 ARG 91 27.014 -25.251 29.235 738 HH21 ARG 91 1HH2 ARG 91 24.645 -25.169 31.827 739 HH22 ARG 91 2HH2 ARG 91 25.004 -25.744 30.214 740 H ARG 92 H ARG 92 29.985 -18.220 35.390 741 HA ARG 92 HA ARG 92 32.915 -18.729 35.560 742 HB2 ARG 92 2HB ARG 92 31.910 -17.447 33.576 743 HB3 ARG 92 3HB ARG 92 31.603 -16.126 34.720 744 HG2 ARG 92 2HG ARG 92 34.022 -16.016 35.239 745 HG3 ARG 92 3HG ARG 92 34.313 -17.414 34.178 746 HD2 ARG 92 2HD ARG 92 33.217 -14.693 33.345 747 HD3 ARG 92 3HD ARG 92 34.845 -15.304 33.016 748 HE ARG 92 HE ARG 92 32.327 -16.063 31.683 749 HH11 ARG 92 1HH1 ARG 92 35.750 -16.809 32.153 750 HH12 ARG 92 2HH1 ARG 92 35.849 -17.789 30.709 751 HH21 ARG 92 1HH2 ARG 92 32.465 -17.357 29.855 752 HH22 ARG 92 2HH2 ARG 92 33.987 -18.087 29.390 753 H LEU 93 H LEU 93 30.418 -18.386 37.518 754 HA LEU 93 HA LEU 93 31.964 -16.943 39.564 755 HB2 LEU 93 2HB LEU 93 29.963 -15.564 40.177 756 HB3 LEU 93 3HB LEU 93 30.723 -15.156 38.640 757 HG LEU 93 HG LEU 93 28.966 -16.396 37.410 758 HD11 LEU 93 1HD1 LEU 93 28.184 -18.018 39.067 759 HD12 LEU 93 2HD1 LEU 93 27.689 -16.694 40.162 760 HD13 LEU 93 3HD1 LEU 93 26.852 -16.945 38.618 761 HD21 LEU 93 3HD2 LEU 93 27.944 -14.298 39.368 762 HD22 LEU 93 1HD2 LEU 93 28.793 -13.968 37.838 763 HD23 LEU 93 2HD2 LEU 93 27.194 -14.738 37.819 764 H GLU 94 H GLU 94 30.850 -19.763 38.885 765 HA GLU 94 HA GLU 94 28.762 -20.317 40.743 766 HB2 GLU 94 2HB GLU 94 29.397 -21.638 38.704 767 HB3 GLU 94 3HB GLU 94 30.848 -22.188 39.557 768 HG2 GLU 94 2HG GLU 94 29.114 -23.884 39.696 769 HG3 GLU 94 3HG GLU 94 29.396 -23.218 41.308 770 H LEU 95 H LEU 95 32.269 -20.158 41.092 771 HA LEU 95 HA LEU 95 31.961 -20.676 44.014 772 HB2 LEU 95 2HB LEU 95 33.993 -21.954 42.138 773 HB3 LEU 95 3HB LEU 95 34.129 -21.976 43.898 774 HG LEU 95 HG LEU 95 31.793 -23.171 42.343 775 HD11 LEU 95 1HD1 LEU 95 34.201 -24.480 43.666 776 HD12 LEU 95 2HD1 LEU 95 32.829 -25.336 42.927 777 HD13 LEU 95 3HD1 LEU 95 33.911 -24.353 41.913 778 HD21 LEU 95 3HD2 LEU 95 32.635 -23.397 45.271 779 HD22 LEU 95 1HD2 LEU 95 31.206 -22.521 44.670 780 HD23 LEU 95 2HD2 LEU 95 31.298 -24.284 44.507 781 H VAL 96 H VAL 96 33.880 -19.403 41.287 782 HA VAL 96 HA VAL 96 34.767 -17.169 42.995 783 HB VAL 96 HB VAL 96 37.055 -17.353 41.997 784 HG11 VAL 96 1HG1 VAL 96 36.250 -19.769 43.663 785 HG12 VAL 96 2HG1 VAL 96 37.873 -19.071 43.526 786 HG13 VAL 96 3HG1 VAL 96 36.575 -18.141 44.305 787 HG21 VAL 96 3HG2 VAL 96 36.150 -20.154 41.203 788 HG22 VAL 96 1HG2 VAL 96 36.531 -18.824 40.082 789 HG23 VAL 96 2HG2 VAL 96 37.804 -19.518 41.097 790 HA PRO 97 HA PRO 97 33.514 -14.970 39.450 791 HB2 PRO 97 2HB PRO 97 34.932 -12.643 39.598 792 HB3 PRO 97 3HB PRO 97 33.715 -13.119 40.826 793 HG2 PRO 97 2HG PRO 97 36.721 -13.553 40.939 794 HG3 PRO 97 3HG PRO 97 35.674 -12.779 42.178 795 HD2 PRO 97 2HD PRO 97 36.353 -15.398 42.350 796 HD3 PRO 97 3HD PRO 97 34.699 -14.856 42.772 797 H ARG 98 H ARG 98 36.180 -16.728 39.265 798 HA ARG 98 HA ARG 98 36.955 -15.669 36.592 799 HB2 ARG 98 2HB ARG 98 39.288 -16.288 37.072 800 HB3 ARG 98 3HB ARG 98 38.698 -15.062 38.211 801 HG2 ARG 98 2HG ARG 98 38.320 -16.782 39.924 802 HG3 ARG 98 3HG ARG 98 38.801 -18.057 38.783 803 HD2 ARG 98 2HD ARG 98 41.061 -17.067 38.624 804 HD3 ARG 98 3HD ARG 98 40.575 -15.770 39.727 805 HE ARG 98 HE ARG 98 40.810 -17.202 41.525 806 HH11 ARG 98 1HH1 ARG 98 40.786 -19.108 38.544 807 HH12 ARG 98 2HH1 ARG 98 41.240 -20.590 39.349 808 HH21 ARG 98 1HH2 ARG 98 41.400 -19.156 42.549 809 HH22 ARG 98 2HH2 ARG 98 41.591 -20.615 41.610 810 H GLY 99 H GLY 99 35.551 -18.209 38.232 811 HA2 GLY 99 2HA GLY 99 35.118 -20.400 37.673 812 HA3 GLY 99 3HA GLY 99 35.614 -19.986 36.027 813 H SER 100 H SER 100 36.497 -22.166 35.939 814 HA SER 100 HA SER 100 38.161 -23.689 36.006 815 HB2 SER 100 2HB SER 100 39.902 -21.212 36.207 816 HB3 SER 100 3HB SER 100 40.427 -22.823 35.670 817 HG SER 100 HG SER 100 39.877 -21.435 33.928 818 H HIS 101 H HIS 101 36.972 -23.241 38.583 819 HA HIS 101 HA HIS 101 39.186 -24.291 40.237 820 HB2 HIS 101 2HB HIS 101 39.035 -21.827 40.637 821 HB3 HIS 101 3HB HIS 101 37.345 -22.042 41.117 822 HD2 HIS 101 HD2 HIS 101 40.629 -23.936 42.165 823 HE1 HIS 101 HE1 HIS 101 38.598 -22.777 45.716 824 HE2 HIS 101 HE2 HIS 101 40.630 -23.995 44.778 825 H HIS 102 H HIS 102 38.306 -25.250 42.311 826 HA HIS 102 HA HIS 102 35.526 -26.260 42.001 827 HB2 HIS 102 2HB HIS 102 38.001 -27.951 42.490 828 HB3 HIS 102 3HB HIS 102 36.331 -28.536 42.486 829 HD2 HIS 102 HD2 HIS 102 35.074 -28.702 40.087 830 HE1 HIS 102 HE1 HIS 102 38.540 -28.151 37.683 831 HE2 HIS 102 HE2 HIS 102 36.093 -28.847 37.674 832 H HIS 103 H HIS 103 34.651 -27.191 43.974 833 HA HIS 103 HA HIS 103 35.300 -25.541 46.239 834 HB2 HIS 103 2HB HIS 103 33.012 -26.244 45.550 835 HB3 HIS 103 3HB HIS 103 33.411 -27.908 45.982 836 HD2 HIS 103 HD2 HIS 103 33.507 -24.433 47.811 837 HE1 HIS 103 HE1 HIS 103 32.049 -27.327 50.569 838 HE2 HIS 103 HE2 HIS 103 32.604 -24.867 50.236 839 H HIS 104 H HIS 104 36.730 -28.370 45.120 840 HA HIS 104 HA HIS 104 37.855 -28.923 47.808 841 HB2 HIS 104 2HB HIS 104 36.094 -30.600 47.196 842 HB3 HIS 104 3HB HIS 104 37.051 -31.039 45.779 843 HD2 HIS 104 HD2 HIS 104 38.069 -30.566 49.544 844 HE1 HIS 104 HE1 HIS 104 39.429 -34.398 48.298 845 HE2 HIS 104 HE2 HIS 104 39.354 -32.744 50.231 846 H HIS 105 H HIS 105 38.607 -27.437 45.225 847 HA HIS 105 HA HIS 105 40.370 -27.086 43.874 848 HB2 HIS 105 2HB HIS 105 41.934 -28.685 45.915 849 HB3 HIS 105 3HB HIS 105 42.589 -27.550 44.735 850 HD2 HIS 105 HD2 HIS 105 41.045 -27.718 48.178 851 HE1 HIS 105 HE1 HIS 105 41.458 -23.570 47.330 852 HE2 HIS 105 HE2 HIS 105 40.931 -25.280 49.139 853 H HIS 106 H HIS 106 42.357 -28.232 42.719 854 HA HIS 106 HA HIS 106 41.760 -31.031 42.013 855 HB2 HIS 106 2HB HIS 106 40.296 -29.661 40.552 856 HB3 HIS 106 3HB HIS 106 41.708 -28.765 39.983 857 HD2 HIS 106 HD2 HIS 106 40.444 -32.465 40.050 858 HE1 HIS 106 HE1 HIS 106 42.757 -31.955 36.518 859 HE2 HIS 106 HE2 HIS 106 41.310 -33.580 37.844 Start of MODEL 14 1 H1 MET 1 H1 MET 1 2.718 -5.064 -8.401 2 H2 MET 1 H2 MET 1 1.545 -5.426 -7.299 3 H3 MET 1 H3 MET 1 3.047 -4.989 -6.790 4 HA MET 1 HA MET 1 2.810 -2.801 -7.674 5 HB2 MET 1 2HB MET 1 0.022 -3.767 -8.403 6 HB3 MET 1 3HB MET 1 0.573 -2.077 -8.469 7 HG2 MET 1 2HG MET 1 2.317 -2.702 -10.106 8 HG3 MET 1 3HG MET 1 1.795 -4.387 -10.024 9 HE1 MET 1 1HE MET 1 -0.427 -1.086 -10.125 10 HE2 MET 1 2HE MET 1 0.960 -0.753 -11.194 11 HE3 MET 1 3HE MET 1 -0.668 -0.927 -11.881 12 H SER 2 H SER 2 1.673 -1.055 -6.492 13 HA SER 2 HA SER 2 1.116 -0.138 -4.507 14 HB2 SER 2 2HB SER 2 -0.953 -2.360 -4.487 15 HB3 SER 2 3HB SER 2 -1.023 -0.846 -3.553 16 HG SER 2 HG SER 2 -2.195 -0.745 -5.524 17 H GLU 3 H GLU 3 3.238 -2.176 -4.391 18 HA GLU 3 HA GLU 3 3.193 -2.629 -1.481 19 HB2 GLU 3 2HB GLU 3 2.172 -4.637 -2.533 20 HB3 GLU 3 3HB GLU 3 3.643 -4.871 -3.491 21 HG2 GLU 3 2HG GLU 3 4.954 -5.207 -1.455 22 HG3 GLU 3 3HG GLU 3 3.553 -4.797 -0.446 23 H GLN 4 H GLN 4 5.344 -3.100 -0.638 24 HA GLN 4 HA GLN 4 7.546 -2.262 -2.472 25 HB2 GLN 4 2HB GLN 4 7.132 -1.501 0.442 26 HB3 GLN 4 3HB GLN 4 8.529 -1.068 -0.562 27 HG2 GLN 4 2HG GLN 4 7.019 0.133 -2.136 28 HG3 GLN 4 3HG GLN 4 5.644 -0.236 -1.083 29 HE21 GLN 4 2HE2 GLN 4 5.826 2.331 -1.480 30 HE22 GLN 4 1HE2 GLN 4 6.606 3.179 -0.161 31 H LEU 5 H LEU 5 9.736 -2.699 -1.102 32 HA LEU 5 HA LEU 5 9.999 -5.524 -1.139 33 HB2 LEU 5 2HB LEU 5 11.865 -3.511 0.162 34 HB3 LEU 5 3HB LEU 5 12.272 -5.134 -0.421 35 HG LEU 5 HG LEU 5 11.449 -2.731 -2.099 36 HD11 LEU 5 1HD1 LEU 5 13.772 -2.740 -1.219 37 HD12 LEU 5 2HD1 LEU 5 14.030 -4.345 -1.933 38 HD13 LEU 5 3HD1 LEU 5 13.740 -2.944 -2.988 39 HD21 LEU 5 3HD2 LEU 5 11.879 -4.151 -4.067 40 HD22 LEU 5 1HD2 LEU 5 12.171 -5.550 -3.014 41 HD23 LEU 5 2HD2 LEU 5 10.547 -4.824 -3.112 42 H THR 6 H THR 6 10.475 -7.004 0.500 43 HA THR 6 HA THR 6 9.706 -6.298 3.278 44 HB THR 6 HB THR 6 8.484 -8.567 1.652 45 HG1 THR 6 1HG THR 6 7.692 -6.512 1.083 46 HG21 THR 6 1HG2 THR 6 8.497 -9.240 3.944 47 HG22 THR 6 2HG2 THR 6 8.072 -7.602 4.505 48 HG23 THR 6 3HG2 THR 6 6.881 -8.604 3.635 49 H ASP 7 H ASP 7 10.060 -8.441 4.662 50 HA ASP 7 HA ASP 7 12.805 -9.008 4.621 51 HB2 ASP 7 2HB ASP 7 12.249 -10.742 6.278 52 HB3 ASP 7 3HB ASP 7 11.376 -9.235 6.585 53 H GLN 8 H GLN 8 10.324 -10.403 2.633 54 HA GLN 8 HA GLN 8 11.570 -12.943 2.145 55 HB2 GLN 8 2HB GLN 8 9.233 -12.508 1.584 56 HB3 GLN 8 3HB GLN 8 9.710 -11.207 0.474 57 HG2 GLN 8 2HG GLN 8 9.161 -13.236 -0.784 58 HG3 GLN 8 3HG GLN 8 10.873 -12.842 -0.965 59 HE21 GLN 8 2HE2 GLN 8 12.468 -14.138 0.143 60 HE22 GLN 8 1HE2 GLN 8 12.074 -15.757 0.698 61 H VAL 9 H VAL 9 11.669 -9.803 0.371 62 HA VAL 9 HA VAL 9 13.702 -10.873 -1.449 63 HB VAL 9 HB VAL 9 12.008 -9.569 -2.461 64 HG11 VAL 9 1HG1 VAL 9 12.634 -7.380 -0.449 65 HG12 VAL 9 2HG1 VAL 9 11.512 -7.240 -1.823 66 HG13 VAL 9 3HG1 VAL 9 11.156 -8.370 -0.506 67 HG21 VAL 9 3HG2 VAL 9 13.231 -7.755 -3.513 68 HG22 VAL 9 1HG2 VAL 9 14.397 -7.701 -2.182 69 HG23 VAL 9 2HG2 VAL 9 14.337 -9.121 -3.262 70 H LEU 10 H LEU 10 13.558 -8.871 1.447 71 HA LEU 10 HA LEU 10 16.174 -7.707 1.136 72 HB2 LEU 10 2HB LEU 10 14.126 -8.020 3.295 73 HB3 LEU 10 3HB LEU 10 15.801 -7.783 3.818 74 HG LEU 10 HG LEU 10 15.992 -5.745 2.519 75 HD11 LEU 10 1HD1 LEU 10 14.472 -6.241 0.657 76 HD12 LEU 10 2HD1 LEU 10 13.078 -6.185 1.764 77 HD13 LEU 10 3HD1 LEU 10 14.033 -4.713 1.439 78 HD21 LEU 10 3HD2 LEU 10 14.400 -4.372 3.829 79 HD22 LEU 10 1HD2 LEU 10 13.470 -5.834 4.228 80 HD23 LEU 10 2HD2 LEU 10 15.132 -5.647 4.833 81 H VAL 11 H VAL 11 15.008 -10.877 2.312 82 HA VAL 11 HA VAL 11 17.648 -11.512 3.395 83 HB VAL 11 HB VAL 11 15.115 -13.130 3.013 84 HG11 VAL 11 1HG1 VAL 11 17.825 -13.973 4.129 85 HG12 VAL 11 2HG1 VAL 11 16.305 -14.867 4.384 86 HG13 VAL 11 3HG1 VAL 11 16.969 -14.690 2.746 87 HG21 VAL 11 3HG2 VAL 11 15.204 -11.417 4.853 88 HG22 VAL 11 1HG2 VAL 11 15.127 -13.081 5.473 89 HG23 VAL 11 2HG2 VAL 11 16.671 -12.196 5.476 90 H GLU 12 H GLU 12 15.921 -11.905 0.302 91 HA GLU 12 HA GLU 12 17.735 -13.910 -0.730 92 HB2 GLU 12 2HB GLU 12 15.796 -11.948 -1.990 93 HB3 GLU 12 3HB GLU 12 16.796 -13.054 -2.948 94 HG2 GLU 12 2HG GLU 12 15.863 -14.988 -1.748 95 HG3 GLU 12 3HG GLU 12 14.842 -13.915 -0.776 96 H ARG 13 H ARG 13 17.755 -10.319 -0.675 97 HA ARG 13 HA ARG 13 19.945 -10.321 -2.617 98 HB2 ARG 13 2HB ARG 13 19.786 -7.978 -2.654 99 HB3 ARG 13 3HB ARG 13 18.140 -8.625 -2.638 100 HG2 ARG 13 2HG ARG 13 18.058 -8.202 -0.158 101 HG3 ARG 13 3HG ARG 13 19.666 -7.444 -0.289 102 HD2 ARG 13 2HD ARG 13 17.148 -6.590 -1.784 103 HD3 ARG 13 3HD ARG 13 17.822 -5.766 -0.367 104 HE ARG 13 HE ARG 13 19.863 -5.954 -2.341 105 HH11 ARG 13 1HH1 ARG 13 16.795 -4.278 -1.801 106 HH12 ARG 13 2HH1 ARG 13 17.220 -2.942 -2.846 107 HH21 ARG 13 1HH2 ARG 13 20.382 -4.240 -3.666 108 HH22 ARG 13 2HH2 ARG 13 19.271 -2.901 -3.887 109 H VAL 14 H VAL 14 19.705 -10.185 0.937 110 HA VAL 14 HA VAL 14 22.462 -9.332 1.235 111 HB VAL 14 HB VAL 14 22.273 -10.158 3.533 112 HG11 VAL 14 1HG1 VAL 14 19.920 -8.534 2.508 113 HG12 VAL 14 2HG1 VAL 14 20.312 -8.749 4.230 114 HG13 VAL 14 3HG1 VAL 14 21.471 -7.939 3.147 115 HG21 VAL 14 3HG2 VAL 14 19.530 -11.127 2.677 116 HG22 VAL 14 1HG2 VAL 14 20.902 -12.152 3.192 117 HG23 VAL 14 2HG2 VAL 14 20.133 -11.049 4.352 118 H GLN 15 H GLN 15 20.840 -12.352 0.458 119 HA GLN 15 HA GLN 15 23.190 -14.016 0.938 120 HB2 GLN 15 2HB GLN 15 20.580 -14.422 -0.565 121 HB3 GLN 15 3HB GLN 15 21.826 -15.670 -0.413 122 HG2 GLN 15 2HG GLN 15 21.638 -15.648 2.020 123 HG3 GLN 15 3HG GLN 15 20.490 -14.318 1.972 124 HE21 GLN 15 2HE2 GLN 15 19.739 -16.608 3.289 125 HE22 GLN 15 1HE2 GLN 15 18.515 -17.462 2.373 126 H LYS 16 H LYS 16 21.942 -12.011 -1.698 127 HA LYS 16 HA LYS 16 23.819 -13.182 -3.625 128 HB2 LYS 16 2HB LYS 16 21.668 -11.068 -3.805 129 HB3 LYS 16 3HB LYS 16 22.771 -11.464 -5.148 130 HG2 LYS 16 2HG LYS 16 22.127 -13.829 -5.029 131 HG3 LYS 16 3HG LYS 16 21.017 -13.498 -3.692 132 HD2 LYS 16 2HD LYS 16 20.799 -12.257 -6.459 133 HD3 LYS 16 3HD LYS 16 19.914 -13.698 -5.904 134 HE2 LYS 16 2HE LYS 16 18.881 -12.372 -4.091 135 HE3 LYS 16 3HE LYS 16 19.755 -10.929 -4.637 136 HZ1 LYS 16 3HZ LYS 16 17.778 -12.433 -6.218 137 HZ2 LYS 16 1HZ LYS 16 17.519 -10.975 -5.493 138 HZ3 LYS 16 2HZ LYS 16 18.590 -11.103 -6.731 139 H GLY 17 H GLY 17 24.015 -10.764 -1.205 140 HA2 GLY 17 2HA GLY 17 26.459 -10.287 -0.932 141 HA3 GLY 17 3HA GLY 17 26.436 -9.693 -2.595 142 H ASP 18 H ASP 18 23.494 -8.612 -1.364 143 HA ASP 18 HA ASP 18 24.674 -5.957 -0.919 144 HB2 ASP 18 2HB ASP 18 21.818 -6.980 -1.106 145 HB3 ASP 18 3HB ASP 18 22.240 -5.313 -0.752 146 H GLN 19 H GLN 19 25.805 -6.446 1.094 147 HA GLN 19 HA GLN 19 24.404 -7.348 3.418 148 HB2 GLN 19 2HB GLN 19 26.838 -7.459 3.067 149 HB3 GLN 19 3HB GLN 19 26.955 -5.697 3.141 150 HG2 GLN 19 2HG GLN 19 25.740 -7.315 5.407 151 HG3 GLN 19 3HG GLN 19 27.490 -7.120 5.268 152 HE21 GLN 19 2HE2 GLN 19 26.219 -6.212 7.530 153 HE22 GLN 19 1HE2 GLN 19 26.254 -4.459 7.558 154 H LYS 20 H LYS 20 24.565 -4.292 1.756 155 HA LYS 20 HA LYS 20 23.849 -2.500 3.840 156 HB2 LYS 20 2HB LYS 20 23.091 -1.072 1.981 157 HB3 LYS 20 3HB LYS 20 24.653 -1.821 1.612 158 HG2 LYS 20 2HG LYS 20 23.445 -3.606 0.310 159 HG3 LYS 20 3HG LYS 20 21.925 -2.734 0.589 160 HD2 LYS 20 2HD LYS 20 22.856 -0.753 -0.573 161 HD3 LYS 20 3HD LYS 20 24.382 -1.639 -0.836 162 HE2 LYS 20 2HE LYS 20 23.141 -3.366 -2.116 163 HE3 LYS 20 3HE LYS 20 21.637 -2.466 -1.862 164 HZ1 LYS 20 3HZ LYS 20 22.615 -1.984 -3.997 165 HZ2 LYS 20 1HZ LYS 20 22.610 -0.627 -3.068 166 HZ3 LYS 20 2HZ LYS 20 24.007 -1.457 -3.299 167 H ALA 21 H ALA 21 21.989 -4.962 2.136 168 HA ALA 21 HA ALA 21 19.429 -3.765 2.892 169 HB1 ALA 21 1HB ALA 21 19.658 -5.002 0.782 170 HB2 ALA 21 2HB ALA 21 20.118 -6.465 1.679 171 HB3 ALA 21 3HB ALA 21 18.486 -5.796 1.861 172 H PHE 22 H PHE 22 21.792 -5.924 4.341 173 HA PHE 22 HA PHE 22 19.863 -7.197 6.107 174 HB2 PHE 22 2HB PHE 22 22.011 -8.271 5.487 175 HB3 PHE 22 3HB PHE 22 22.883 -6.991 6.334 176 HD1 PHE 22 HD1 PHE 22 20.106 -9.467 6.884 177 HD2 PHE 22 HD2 PHE 22 23.471 -7.397 8.589 178 HE1 PHE 22 HE1 PHE 22 19.813 -10.727 8.991 179 HE2 PHE 22 HE2 PHE 22 23.183 -8.678 10.698 180 HZ PHE 22 HZ PHE 22 21.349 -10.336 10.901 181 H ASN 23 H ASN 23 22.032 -4.366 6.157 182 HA ASN 23 HA ASN 23 21.717 -3.688 8.910 183 HB2 ASN 23 2HB ASN 23 23.466 -2.685 7.596 184 HB3 ASN 23 3HB ASN 23 22.319 -2.177 6.350 185 HD21 ASN 23 2HD2 ASN 23 21.280 -0.239 6.487 186 HD22 ASN 23 1HD2 ASN 23 21.477 0.881 7.818 187 H LEU 24 H LEU 24 19.863 -2.859 5.974 188 HA LEU 24 HA LEU 24 17.967 -1.194 7.393 189 HB2 LEU 24 2HB LEU 24 17.892 -2.517 4.648 190 HB3 LEU 24 3HB LEU 24 16.731 -1.309 5.220 191 HG LEU 24 HG LEU 24 19.733 -0.837 4.980 192 HD11 LEU 24 1HD1 LEU 24 19.149 0.497 2.990 193 HD12 LEU 24 2HD1 LEU 24 18.650 -1.198 2.784 194 HD13 LEU 24 3HD1 LEU 24 17.439 0.046 3.176 195 HD21 LEU 24 3HD2 LEU 24 18.663 0.615 6.656 196 HD22 LEU 24 1HD2 LEU 24 19.086 1.551 5.213 197 HD23 LEU 24 2HD2 LEU 24 17.399 1.057 5.483 198 H LEU 25 H LEU 25 18.332 -4.618 6.939 199 HA LEU 25 HA LEU 25 15.502 -5.209 7.409 200 HB2 LEU 25 2HB LEU 25 16.889 -6.611 5.928 201 HB3 LEU 25 3HB LEU 25 17.995 -6.959 7.262 202 HG LEU 25 HG LEU 25 16.122 -8.086 8.484 203 HD11 LEU 25 1HD1 LEU 25 14.087 -8.678 7.223 204 HD12 LEU 25 2HD1 LEU 25 14.208 -6.921 7.429 205 HD13 LEU 25 3HD1 LEU 25 14.625 -7.674 5.861 206 HD21 LEU 25 3HD2 LEU 25 16.689 -9.066 5.650 207 HD22 LEU 25 1HD2 LEU 25 17.704 -9.352 7.085 208 HD23 LEU 25 2HD2 LEU 25 16.081 -10.064 6.988 209 H VAL 26 H VAL 26 18.594 -5.436 9.324 210 HA VAL 26 HA VAL 26 17.192 -6.641 11.521 211 HB VAL 26 HB VAL 26 19.164 -6.314 12.829 212 HG11 VAL 26 1HG1 VAL 26 19.920 -7.036 9.973 213 HG12 VAL 26 2HG1 VAL 26 20.827 -7.442 11.440 214 HG13 VAL 26 3HG1 VAL 26 19.202 -8.125 11.181 215 HG21 VAL 26 3HG2 VAL 26 20.164 -4.498 10.609 216 HG22 VAL 26 1HG2 VAL 26 19.742 -4.024 12.278 217 HG23 VAL 26 2HG2 VAL 26 21.130 -5.082 11.988 218 H VAL 27 H VAL 27 17.575 -3.262 10.532 219 HA VAL 27 HA VAL 27 17.127 -2.226 13.179 220 HB VAL 27 HB VAL 27 18.184 -0.927 11.393 221 HG11 VAL 27 1HG1 VAL 27 15.394 -0.795 10.172 222 HG12 VAL 27 2HG1 VAL 27 16.818 0.127 9.643 223 HG13 VAL 27 3HG1 VAL 27 16.802 -1.644 9.492 224 HG21 VAL 27 3HG2 VAL 27 17.124 0.199 13.335 225 HG22 VAL 27 1HG2 VAL 27 17.073 1.193 11.866 226 HG23 VAL 27 2HG2 VAL 27 15.612 0.343 12.402 227 H ARG 28 H ARG 28 14.969 -3.449 10.657 228 HA ARG 28 HA ARG 28 12.532 -2.370 11.735 229 HB2 ARG 28 2HB ARG 28 12.919 -5.025 10.289 230 HB3 ARG 28 3HB ARG 28 11.439 -4.060 10.392 231 HG2 ARG 28 2HG ARG 28 12.582 -2.257 9.066 232 HG3 ARG 28 3HG ARG 28 14.015 -3.316 8.946 233 HD2 ARG 28 2HD ARG 28 12.725 -3.562 6.910 234 HD3 ARG 28 3HD ARG 28 12.631 -5.055 7.850 235 HE ARG 28 HE ARG 28 10.354 -4.705 8.203 236 HH11 ARG 28 1HH1 ARG 28 11.797 -1.801 6.802 237 HH12 ARG 28 2HH1 ARG 28 10.250 -1.049 6.469 238 HH21 ARG 28 1HH2 ARG 28 8.359 -3.716 7.746 239 HH22 ARG 28 2HH2 ARG 28 8.309 -2.129 7.015 240 H TYR 29 H TYR 29 14.573 -5.153 12.452 241 HA TYR 29 HA TYR 29 12.618 -6.175 14.426 242 HB2 TYR 29 2HB TYR 29 15.151 -7.340 13.222 243 HB3 TYR 29 3HB TYR 29 14.210 -8.119 14.474 244 HD1 TYR 29 HD1 TYR 29 13.980 -6.891 10.961 245 HD2 TYR 29 HD2 TYR 29 12.272 -9.342 14.043 246 HE1 TYR 29 HE1 TYR 29 12.391 -7.826 9.310 247 HE2 TYR 29 HE2 TYR 29 10.683 -10.311 12.405 248 HH TYR 29 HH TYR 29 10.661 -9.305 8.957 249 H GLN 30 H GLN 30 15.273 -4.043 14.411 250 HA GLN 30 HA GLN 30 16.712 -4.987 16.669 251 HB2 GLN 30 2HB GLN 30 17.487 -3.352 14.980 252 HB3 GLN 30 3HB GLN 30 16.374 -2.141 15.630 253 HG2 GLN 30 2HG GLN 30 17.561 -2.157 17.766 254 HG3 GLN 30 3HG GLN 30 18.581 -3.509 17.219 255 HE21 GLN 30 2HE2 GLN 30 19.671 -3.045 14.970 256 HE22 GLN 30 1HE2 GLN 30 20.430 -1.470 14.827 257 H HIS 31 H HIS 31 13.742 -3.071 16.380 258 HA HIS 31 HA HIS 31 13.676 -2.529 19.270 259 HB2 HIS 31 2HB HIS 31 11.686 -2.039 17.030 260 HB3 HIS 31 3HB HIS 31 11.501 -1.485 18.694 261 HD2 HIS 31 HD2 HIS 31 13.463 0.323 19.573 262 HE1 HIS 31 HE1 HIS 31 14.443 1.691 15.663 263 HE2 HIS 31 HE2 HIS 31 14.672 2.167 18.157 264 H LYS 32 H LYS 32 12.286 -4.841 16.951 265 HA LYS 32 HA LYS 32 10.243 -5.740 18.832 266 HB2 LYS 32 2HB LYS 32 11.157 -6.875 16.162 267 HB3 LYS 32 3HB LYS 32 9.718 -7.365 17.070 268 HG2 LYS 32 2HG LYS 32 8.850 -5.021 16.915 269 HG3 LYS 32 3HG LYS 32 10.281 -4.573 15.964 270 HD2 LYS 32 2HD LYS 32 8.459 -4.959 14.438 271 HD3 LYS 32 3HD LYS 32 9.633 -6.275 14.248 272 HE2 LYS 32 2HE LYS 32 8.234 -7.711 15.721 273 HE3 LYS 32 3HE LYS 32 7.078 -6.386 15.909 274 HZ1 LYS 32 3HZ LYS 32 7.755 -7.690 13.356 275 HZ2 LYS 32 1HZ LYS 32 6.379 -7.931 14.222 276 HZ3 LYS 32 2HZ LYS 32 6.685 -6.460 13.546 277 H VAL 33 H VAL 33 13.456 -6.876 17.765 278 HA VAL 33 HA VAL 33 13.330 -9.437 19.075 279 HB VAL 33 HB VAL 33 15.670 -7.666 18.214 280 HG11 VAL 33 1HG1 VAL 33 15.472 -10.633 18.748 281 HG12 VAL 33 2HG1 VAL 33 16.903 -9.772 18.119 282 HG13 VAL 33 3HG1 VAL 33 16.335 -9.473 19.801 283 HG21 VAL 33 3HG2 VAL 33 14.060 -8.528 16.385 284 HG22 VAL 33 1HG2 VAL 33 15.791 -9.019 16.264 285 HG23 VAL 33 2HG2 VAL 33 14.571 -10.161 16.868 286 H ALA 34 H ALA 34 14.460 -6.154 19.924 287 HA ALA 34 HA ALA 34 15.627 -6.825 22.420 288 HB1 ALA 34 1HB ALA 34 14.300 -4.244 21.496 289 HB2 ALA 34 2HB ALA 34 15.404 -4.403 22.879 290 HB3 ALA 34 3HB ALA 34 16.003 -4.688 21.226 291 H SER 35 H SER 35 12.258 -6.492 21.430 292 HA SER 35 HA SER 35 11.218 -5.975 24.076 293 HB2 SER 35 2HB SER 35 10.052 -5.404 21.937 294 HB3 SER 35 3HB SER 35 9.838 -7.140 21.630 295 HG SER 35 HG SER 35 8.030 -6.170 22.676 296 H LEU 36 H LEU 36 11.486 -8.953 22.020 297 HA LEU 36 HA LEU 36 10.317 -10.523 24.175 298 HB2 LEU 36 2HB LEU 36 10.477 -12.381 22.687 299 HB3 LEU 36 3HB LEU 36 9.943 -10.969 21.760 300 HG LEU 36 HG LEU 36 12.530 -10.745 21.193 301 HD11 LEU 36 1HD1 LEU 36 13.328 -12.622 22.657 302 HD12 LEU 36 2HD1 LEU 36 12.221 -13.726 21.812 303 HD13 LEU 36 3HD1 LEU 36 13.582 -12.986 20.945 304 HD21 LEU 36 3HD2 LEU 36 10.716 -12.903 20.039 305 HD22 LEU 36 1HD2 LEU 36 10.726 -11.183 19.581 306 HD23 LEU 36 2HD2 LEU 36 12.143 -12.207 19.241 307 H VAL 37 H VAL 37 13.587 -9.684 23.123 308 HA VAL 37 HA VAL 37 14.711 -11.877 24.691 309 HB VAL 37 HB VAL 37 15.599 -10.930 22.489 310 HG11 VAL 37 1HG1 VAL 37 17.073 -9.103 22.519 311 HG12 VAL 37 2HG1 VAL 37 15.660 -8.528 23.438 312 HG13 VAL 37 3HG1 VAL 37 17.140 -9.060 24.288 313 HG21 VAL 37 3HG2 VAL 37 17.527 -11.286 24.817 314 HG22 VAL 37 1HG2 VAL 37 16.750 -12.610 23.908 315 HG23 VAL 37 2HG2 VAL 37 17.888 -11.523 23.091 316 H SER 38 H SER 38 13.686 -8.624 25.358 317 HA SER 38 HA SER 38 15.370 -8.177 27.645 318 HB2 SER 38 2HB SER 38 14.057 -6.397 26.495 319 HB3 SER 38 3HB SER 38 12.563 -7.152 27.068 320 HG SER 38 HG SER 38 13.340 -6.812 29.209 321 H ARG 39 H ARG 39 12.945 -10.487 27.002 322 HA ARG 39 HA ARG 39 12.099 -10.797 29.798 323 HB2 ARG 39 2HB ARG 39 11.460 -12.451 27.331 324 HB3 ARG 39 3HB ARG 39 10.683 -12.580 28.916 325 HG2 ARG 39 2HG ARG 39 9.868 -10.243 28.715 326 HG3 ARG 39 3HG ARG 39 10.654 -10.105 27.132 327 HD2 ARG 39 2HD ARG 39 9.277 -11.971 26.273 328 HD3 ARG 39 3HD ARG 39 8.476 -12.119 27.837 329 HE ARG 39 HE ARG 39 8.058 -10.027 25.810 330 HH11 ARG 39 1HH1 ARG 39 7.495 -11.037 29.154 331 HH12 ARG 39 2HH1 ARG 39 6.160 -9.930 29.380 332 HH21 ARG 39 1HH2 ARG 39 6.318 -8.606 26.134 333 HH22 ARG 39 2HH2 ARG 39 5.481 -8.578 27.666 334 H TYR 40 H TYR 40 14.833 -11.637 28.051 335 HA TYR 40 HA TYR 40 15.254 -14.060 29.739 336 HB2 TYR 40 2HB TYR 40 16.223 -13.504 26.924 337 HB3 TYR 40 3HB TYR 40 16.714 -14.885 27.915 338 HD1 TYR 40 HD2 TYR 40 15.065 -16.632 28.560 339 HD2 TYR 40 HD1 TYR 40 14.108 -13.493 25.783 340 HE1 TYR 40 HE2 TYR 40 13.083 -17.919 27.790 341 HE2 TYR 40 HE1 TYR 40 12.145 -14.783 24.991 342 HH TYR 40 HH TYR 40 10.897 -16.695 25.240 343 H VAL 41 H VAL 41 16.402 -10.906 28.854 344 HA VAL 41 HA VAL 41 18.596 -11.211 30.801 345 HB VAL 41 HB VAL 41 20.053 -9.777 29.276 346 HG11 VAL 41 1HG1 VAL 41 20.503 -12.161 29.719 347 HG12 VAL 41 2HG1 VAL 41 19.476 -12.607 28.333 348 HG13 VAL 41 3HG1 VAL 41 20.973 -11.679 28.081 349 HG21 VAL 41 3HG2 VAL 41 18.227 -10.856 27.101 350 HG22 VAL 41 1HG2 VAL 41 18.264 -9.160 27.643 351 HG23 VAL 41 2HG2 VAL 41 19.698 -9.886 26.882 352 HA PRO 42 HA PRO 42 17.009 -7.381 32.218 353 HB2 PRO 42 2HB PRO 42 19.181 -6.144 33.302 354 HB3 PRO 42 3HB PRO 42 18.467 -7.635 34.001 355 HG2 PRO 42 2HG PRO 42 20.812 -7.437 32.080 356 HG3 PRO 42 3HG PRO 42 20.758 -8.308 33.652 357 HD2 PRO 42 2HD PRO 42 20.314 -9.622 31.333 358 HD3 PRO 42 3HD PRO 42 19.295 -9.971 32.760 359 H SER 43 H SER 43 17.187 -4.979 31.982 360 HA SER 43 HA SER 43 17.367 -4.369 29.215 361 HB2 SER 43 2HB SER 43 16.793 -2.076 29.951 362 HB3 SER 43 3HB SER 43 15.768 -3.305 30.723 363 HG SER 43 HG SER 43 16.577 -1.759 32.215 364 H GLY 44 H GLY 44 19.885 -4.492 31.550 365 HA2 GLY 44 2HA GLY 44 21.498 -2.388 30.275 366 HA3 GLY 44 3HA GLY 44 21.965 -3.431 31.628 367 H ASP 45 H ASP 45 20.909 -5.807 29.883 368 HA ASP 45 HA ASP 45 23.377 -6.071 28.229 369 HB2 ASP 45 2HB ASP 45 21.827 -8.140 29.826 370 HB3 ASP 45 3HB ASP 45 23.139 -8.511 28.696 371 H VAL 46 H VAL 46 20.044 -5.660 28.029 372 HA VAL 46 HA VAL 46 19.403 -7.658 26.102 373 HB VAL 46 HB VAL 46 17.821 -6.443 27.609 374 HG11 VAL 46 1HG1 VAL 46 18.009 -4.243 25.506 375 HG12 VAL 46 2HG1 VAL 46 16.801 -4.369 26.798 376 HG13 VAL 46 3HG1 VAL 46 18.509 -4.120 27.218 377 HG21 VAL 46 3HG2 VAL 46 16.998 -7.846 25.874 378 HG22 VAL 46 1HG2 VAL 46 16.005 -6.376 25.914 379 HG23 VAL 46 2HG2 VAL 46 17.223 -6.569 24.635 380 HA PRO 47 HA PRO 47 20.090 -4.395 22.748 381 HB2 PRO 47 2HB PRO 47 21.984 -2.478 22.956 382 HB3 PRO 47 3HB PRO 47 20.370 -2.279 23.727 383 HG2 PRO 47 2HG PRO 47 22.937 -3.247 25.017 384 HG3 PRO 47 3HG PRO 47 21.825 -1.957 25.599 385 HD2 PRO 47 2HD PRO 47 21.715 -4.527 26.494 386 HD3 PRO 47 3HD PRO 47 20.237 -3.528 26.310 387 H ASP 48 H ASP 48 22.754 -5.695 24.656 388 HA ASP 48 HA ASP 48 24.565 -5.843 22.371 389 HB2 ASP 48 2HB ASP 48 25.299 -5.504 24.738 390 HB3 ASP 48 3HB ASP 48 24.731 -7.142 25.114 391 H VAL 49 H VAL 49 22.198 -7.906 24.003 392 HA VAL 49 HA VAL 49 23.062 -10.334 22.659 393 HB VAL 49 HB VAL 49 20.582 -9.594 24.264 394 HG11 VAL 49 1HG1 VAL 49 20.137 -12.012 24.348 395 HG12 VAL 49 2HG1 VAL 49 20.041 -11.425 22.673 396 HG13 VAL 49 3HG1 VAL 49 21.480 -12.316 23.219 397 HG21 VAL 49 3HG2 VAL 49 22.735 -9.701 25.518 398 HG22 VAL 49 1HG2 VAL 49 21.642 -11.026 25.964 399 HG23 VAL 49 2HG2 VAL 49 23.016 -11.333 24.879 400 H VAL 50 H VAL 50 20.783 -7.684 21.971 401 HA VAL 50 HA VAL 50 19.524 -8.984 19.703 402 HB VAL 50 HB VAL 50 19.912 -6.081 20.505 403 HG11 VAL 50 1HG1 VAL 50 18.290 -7.249 18.203 404 HG12 VAL 50 2HG1 VAL 50 18.197 -5.568 18.777 405 HG13 VAL 50 3HG1 VAL 50 19.700 -6.172 18.060 406 HG21 VAL 50 3HG2 VAL 50 17.451 -7.872 20.424 407 HG22 VAL 50 1HG2 VAL 50 18.386 -7.514 21.898 408 HG23 VAL 50 2HG2 VAL 50 17.533 -6.208 21.043 409 H GLN 51 H GLN 51 22.511 -7.051 20.201 410 HA GLN 51 HA GLN 51 23.067 -6.846 17.375 411 HB2 GLN 51 2HB GLN 51 23.982 -5.293 19.060 412 HB3 GLN 51 3HB GLN 51 24.928 -6.626 19.771 413 HG2 GLN 51 2HG GLN 51 26.154 -6.915 17.682 414 HG3 GLN 51 3HG GLN 51 25.170 -5.681 16.885 415 HE21 GLN 51 2HE2 GLN 51 27.698 -5.109 16.610 416 HE22 GLN 51 1HE2 GLN 51 28.276 -3.927 17.765 417 H GLU 52 H GLU 52 24.105 -9.136 19.985 418 HA GLU 52 HA GLU 52 25.825 -10.609 18.226 419 HB2 GLU 52 2HB GLU 52 25.965 -10.682 20.699 420 HB3 GLU 52 3HB GLU 52 24.401 -11.526 20.760 421 HG2 GLU 52 2HG GLU 52 25.318 -13.390 19.454 422 HG3 GLU 52 3HG GLU 52 26.858 -12.545 19.276 423 H ALA 53 H ALA 53 22.323 -10.649 18.843 424 HA ALA 53 HA ALA 53 21.864 -13.195 17.587 425 HB1 ALA 53 1HB ALA 53 20.014 -10.804 17.994 426 HB2 ALA 53 2HB ALA 53 19.508 -12.449 17.552 427 HB3 ALA 53 3HB ALA 53 20.250 -12.151 19.134 428 H PHE 54 H PHE 54 22.033 -9.803 16.390 429 HA PHE 54 HA PHE 54 21.249 -10.570 13.701 430 HB2 PHE 54 2HB PHE 54 22.635 -8.099 14.791 431 HB3 PHE 54 3HB PHE 54 22.046 -8.274 13.144 432 HD1 PHE 54 HD1 PHE 54 19.429 -9.832 13.933 433 HD2 PHE 54 HD2 PHE 54 21.252 -6.191 15.360 434 HE1 PHE 54 HE1 PHE 54 17.223 -8.984 14.608 435 HE2 PHE 54 HE2 PHE 54 19.021 -5.329 15.967 436 HZ PHE 54 HZ PHE 54 17.004 -6.725 15.602 437 H ILE 55 H ILE 55 24.385 -10.287 15.404 438 HA ILE 55 HA ILE 55 25.935 -10.549 12.970 439 HB ILE 55 HB ILE 55 26.597 -11.073 15.897 440 HG12 ILE 55 2HG1 ILE 55 27.332 -8.724 14.086 441 HG13 ILE 55 3HG1 ILE 55 26.001 -8.698 15.228 442 HG21 ILE 55 1HG2 ILE 55 28.448 -10.866 13.482 443 HG22 ILE 55 2HG2 ILE 55 28.966 -11.023 15.180 444 HG23 ILE 55 3HG2 ILE 55 28.097 -12.351 14.398 445 HD11 ILE 55 3HD1 ILE 55 27.605 -9.159 17.091 446 HD12 ILE 55 1HD1 ILE 55 28.950 -9.069 15.924 447 HD13 ILE 55 2HD1 ILE 55 27.950 -7.639 16.230 448 H LYS 56 H LYS 56 24.560 -12.787 15.383 449 HA LYS 56 HA LYS 56 25.767 -15.155 14.230 450 HB2 LYS 56 2HB LYS 56 25.155 -14.868 16.609 451 HB3 LYS 56 3HB LYS 56 23.445 -14.750 16.162 452 HG2 LYS 56 2HG LYS 56 23.531 -17.046 15.216 453 HG3 LYS 56 3HG LYS 56 25.232 -17.179 15.714 454 HD2 LYS 56 2HD LYS 56 22.869 -16.665 17.575 455 HD3 LYS 56 3HD LYS 56 23.685 -18.226 17.355 456 HE2 LYS 56 2HE LYS 56 25.799 -17.260 18.167 457 HE3 LYS 56 3HE LYS 56 25.022 -15.672 18.336 458 HZ1 LYS 56 3HZ LYS 56 23.536 -16.633 19.937 459 HZ2 LYS 56 1HZ LYS 56 24.279 -18.100 19.816 460 HZ3 LYS 56 2HZ LYS 56 25.102 -16.806 20.418 461 H ALA 57 H ALA 57 22.724 -13.339 13.799 462 HA ALA 57 HA ALA 57 21.362 -15.447 12.405 463 HB1 ALA 57 1HB ALA 57 20.973 -12.424 12.365 464 HB2 ALA 57 2HB ALA 57 19.853 -13.610 11.660 465 HB3 ALA 57 3HB ALA 57 20.127 -13.594 13.410 466 H TYR 58 H TYR 58 23.403 -12.654 11.297 467 HA TYR 58 HA TYR 58 22.843 -12.988 8.545 468 HB2 TYR 58 2HB TYR 58 23.956 -11.035 9.635 469 HB3 TYR 58 3HB TYR 58 25.403 -12.023 9.868 470 HD1 TYR 58 HD1 TYR 58 23.059 -10.861 7.165 471 HD2 TYR 58 HD2 TYR 58 27.053 -12.072 8.213 472 HE1 TYR 58 HE1 TYR 58 23.852 -10.176 4.920 473 HE2 TYR 58 HE2 TYR 58 27.847 -11.423 5.961 474 HH TYR 58 HH TYR 58 25.645 -10.041 3.493 475 H ARG 59 H ARG 59 25.283 -14.512 10.653 476 HA ARG 59 HA ARG 59 26.714 -15.836 8.523 477 HB2 ARG 59 2HB ARG 59 26.505 -16.310 11.520 478 HB3 ARG 59 3HB ARG 59 27.682 -17.115 10.459 479 HG2 ARG 59 2HG ARG 59 28.729 -15.016 9.896 480 HG3 ARG 59 3HG ARG 59 27.451 -14.079 10.704 481 HD2 ARG 59 2HD ARG 59 28.061 -14.985 12.866 482 HD3 ARG 59 3HD ARG 59 29.231 -16.085 12.124 483 HE ARG 59 HE ARG 59 29.513 -13.175 12.587 484 HH11 ARG 59 1HH1 ARG 59 30.851 -16.064 11.038 485 HH12 ARG 59 2HH1 ARG 59 32.436 -15.355 10.832 486 HH21 ARG 59 1HH2 ARG 59 31.588 -12.284 12.306 487 HH22 ARG 59 2HH2 ARG 59 32.846 -13.223 11.542 488 H ALA 60 H ALA 60 23.824 -16.580 10.373 489 HA ALA 60 HA ALA 60 23.736 -19.342 9.303 490 HB1 ALA 60 1HB ALA 60 21.926 -17.844 11.237 491 HB2 ALA 60 2HB ALA 60 21.800 -19.569 10.812 492 HB3 ALA 60 3HB ALA 60 23.229 -18.967 11.684 493 H LEU 61 H LEU 61 22.746 -16.195 8.397 494 HA LEU 61 HA LEU 61 20.183 -16.871 7.267 495 HB2 LEU 61 2HB LEU 61 20.982 -14.588 8.077 496 HB3 LEU 61 3HB LEU 61 22.011 -14.523 6.635 497 HG LEU 61 HG LEU 61 19.928 -14.772 5.237 498 HD11 LEU 61 1HD1 LEU 61 17.759 -14.279 6.424 499 HD12 LEU 61 2HD1 LEU 61 18.443 -15.862 6.855 500 HD13 LEU 61 3HD1 LEU 61 18.614 -14.485 7.969 501 HD21 LEU 61 3HD2 LEU 61 20.915 -12.570 5.752 502 HD22 LEU 61 1HD2 LEU 61 19.135 -12.461 5.695 503 HD23 LEU 61 2HD2 LEU 61 19.970 -12.491 7.263 504 H ASP 62 H ASP 62 23.528 -17.015 6.215 505 HA ASP 62 HA ASP 62 23.059 -17.264 3.402 506 HB2 ASP 62 2HB ASP 62 25.256 -16.821 4.508 507 HB3 ASP 62 3HB ASP 62 25.243 -18.472 5.143 508 H SER 63 H SER 63 22.167 -19.275 6.023 509 HA SER 63 HA SER 63 21.960 -21.659 4.264 510 HB2 SER 63 2HB SER 63 21.975 -21.429 7.296 511 HB3 SER 63 3HB SER 63 21.822 -22.933 6.367 512 HG SER 63 HG SER 63 23.985 -22.510 6.996 513 H PHE 64 H PHE 64 20.101 -19.082 5.363 514 HA PHE 64 HA PHE 64 17.656 -20.478 6.021 515 HB2 PHE 64 2HB PHE 64 18.128 -18.204 6.771 516 HB3 PHE 64 3HB PHE 64 18.209 -17.643 5.099 517 HD1 PHE 64 HD2 PHE 64 15.919 -19.137 7.650 518 HD2 PHE 64 HD1 PHE 64 16.245 -17.014 3.920 519 HE1 PHE 64 HE2 PHE 64 13.482 -18.730 7.670 520 HE2 PHE 64 HE1 PHE 64 13.804 -16.585 3.959 521 HZ PHE 64 HZ PHE 64 12.421 -17.431 5.824 522 H ARG 65 H ARG 65 16.019 -21.150 4.696 523 HA ARG 65 HA ARG 65 16.461 -20.802 1.769 524 HB2 ARG 65 2HB ARG 65 16.860 -23.150 3.195 525 HB3 ARG 65 3HB ARG 65 15.203 -23.329 2.602 526 HG2 ARG 65 2HG ARG 65 16.339 -24.199 0.807 527 HG3 ARG 65 3HG ARG 65 16.300 -22.501 0.306 528 HD2 ARG 65 2HD ARG 65 18.580 -23.956 1.720 529 HD3 ARG 65 3HD ARG 65 18.544 -23.462 0.019 530 HE ARG 65 HE ARG 65 18.152 -21.139 1.578 531 HH11 ARG 65 1HH1 ARG 65 20.689 -23.535 0.968 532 HH12 ARG 65 2HH1 ARG 65 21.984 -22.415 1.320 533 HH21 ARG 65 1HH2 ARG 65 19.841 -19.729 2.042 534 HH22 ARG 65 2HH2 ARG 65 21.508 -20.261 1.930 535 H GLY 66 H GLY 66 14.397 -19.930 4.161 536 HA2 GLY 66 2HA GLY 66 12.331 -18.936 3.944 537 HA3 GLY 66 3HA GLY 66 12.284 -19.415 2.243 538 H ASP 67 H ASP 67 12.887 -22.004 4.531 539 HA ASP 67 HA ASP 67 10.398 -23.291 3.846 540 HB2 ASP 67 2HB ASP 67 12.478 -23.916 5.970 541 HB3 ASP 67 3HB ASP 67 11.149 -24.988 5.513 542 H SER 68 H SER 68 11.106 -20.812 6.024 543 HA SER 68 HA SER 68 8.467 -21.056 7.291 544 HB2 SER 68 2HB SER 68 10.025 -22.305 8.787 545 HB3 SER 68 3HB SER 68 11.024 -20.839 8.930 546 HG SER 68 HG SER 68 9.493 -21.081 10.636 547 H ALA 69 H ALA 69 8.065 -18.954 8.602 548 HA ALA 69 HA ALA 69 8.727 -16.722 6.924 549 HB1 ALA 69 1HB ALA 69 7.534 -16.779 9.724 550 HB2 ALA 69 2HB ALA 69 7.515 -15.408 8.594 551 HB3 ALA 69 3HB ALA 69 6.622 -16.892 8.197 552 H PHE 70 H PHE 70 10.055 -14.898 7.350 553 HA PHE 70 HA PHE 70 12.581 -15.639 8.488 554 HB2 PHE 70 2HB PHE 70 12.447 -14.085 6.627 555 HB3 PHE 70 3HB PHE 70 11.450 -12.976 7.585 556 HD1 PHE 70 HD2 PHE 70 14.796 -14.693 7.748 557 HD2 PHE 70 HD1 PHE 70 12.480 -11.183 8.645 558 HE1 PHE 70 HE2 PHE 70 16.829 -13.577 8.632 559 HE2 PHE 70 HE1 PHE 70 14.513 -10.067 9.519 560 HZ PHE 70 HZ PHE 70 16.695 -11.264 9.503 561 H TYR 71 H TYR 71 9.798 -13.785 9.795 562 HA TYR 71 HA TYR 71 11.354 -12.621 11.908 563 HB2 TYR 71 2HB TYR 71 9.240 -11.968 12.865 564 HB3 TYR 71 3HB TYR 71 9.255 -11.644 11.131 565 HD1 TYR 71 HD2 TYR 71 7.934 -13.898 13.771 566 HD2 TYR 71 HD1 TYR 71 7.646 -12.645 9.667 567 HE1 TYR 71 HE2 TYR 71 5.805 -15.149 13.542 568 HE2 TYR 71 HE1 TYR 71 5.509 -13.882 9.434 569 HH TYR 71 HH TYR 71 3.952 -15.204 10.472 570 H THR 72 H THR 72 9.485 -15.669 11.623 571 HA THR 72 HA THR 72 9.751 -16.284 14.447 572 HB THR 72 HB THR 72 9.184 -18.090 12.055 573 HG1 THR 72 1HG THR 72 7.631 -16.451 12.440 574 HG21 THR 72 1HG2 THR 72 8.208 -19.606 13.780 575 HG22 THR 72 2HG2 THR 72 9.957 -19.390 14.002 576 HG23 THR 72 3HG2 THR 72 8.820 -18.520 15.052 577 H TRP 73 H TRP 73 11.622 -16.957 11.479 578 HA TRP 73 HA TRP 73 13.402 -18.844 12.712 579 HB2 TRP 73 2HB TRP 73 13.060 -18.755 10.314 580 HB3 TRP 73 3HB TRP 73 13.593 -17.077 10.248 581 HD1 TRP 73 HD1 TRP 73 14.904 -20.619 10.348 582 HE1 TRP 73 HE1 TRP 73 17.423 -20.643 9.962 583 HE3 TRP 73 HE3 TRP 73 15.812 -15.588 10.640 584 HZ2 TRP 73 HZ2 TRP 73 19.588 -18.734 9.883 585 HZ3 TRP 73 HZ3 TRP 73 18.114 -14.731 10.429 586 HH2 TRP 73 HH2 TRP 73 20.011 -16.288 10.063 587 H LEU 74 H LEU 74 13.349 -15.296 12.442 588 HA LEU 74 HA LEU 74 16.101 -14.987 13.318 589 HB2 LEU 74 2HB LEU 74 14.989 -13.370 11.821 590 HB3 LEU 74 3HB LEU 74 13.779 -13.037 13.063 591 HG LEU 74 HG LEU 74 15.581 -12.202 14.582 592 HD11 LEU 74 1HD1 LEU 74 17.501 -13.440 13.659 593 HD12 LEU 74 2HD1 LEU 74 17.329 -12.564 12.114 594 HD13 LEU 74 3HD1 LEU 74 17.804 -11.692 13.587 595 HD21 LEU 74 3HD2 LEU 74 15.931 -10.098 13.409 596 HD22 LEU 74 1HD2 LEU 74 15.503 -10.863 11.855 597 HD23 LEU 74 2HD2 LEU 74 14.279 -10.685 13.146 598 H TYR 75 H TYR 75 12.859 -14.853 14.876 599 HA TYR 75 HA TYR 75 13.899 -13.805 17.351 600 HB2 TYR 75 2HB TYR 75 11.341 -15.289 16.683 601 HB3 TYR 75 3HB TYR 75 11.685 -14.555 18.254 602 HD1 TYR 75 HD2 TYR 75 13.147 -12.037 17.057 603 HD2 TYR 75 HD1 TYR 75 9.379 -13.959 16.236 604 HE1 TYR 75 HE2 TYR 75 12.225 -9.889 16.306 605 HE2 TYR 75 HE1 TYR 75 8.455 -11.797 15.452 606 HH TYR 75 HH TYR 75 8.867 -9.596 15.060 607 H ARG 76 H ARG 76 13.918 -17.018 15.979 608 HA ARG 76 HA ARG 76 14.401 -18.341 18.532 609 HB2 ARG 76 2HB ARG 76 14.939 -19.131 15.643 610 HB3 ARG 76 3HB ARG 76 15.210 -20.203 17.022 611 HG2 ARG 76 2HG ARG 76 12.529 -18.919 16.387 612 HG3 ARG 76 3HG ARG 76 13.009 -20.548 15.854 613 HD2 ARG 76 2HD ARG 76 13.328 -21.215 18.227 614 HD3 ARG 76 3HD ARG 76 12.818 -19.599 18.744 615 HE ARG 76 HE ARG 76 10.603 -20.115 18.253 616 HH11 ARG 76 1HH1 ARG 76 12.725 -22.683 17.073 617 HH12 ARG 76 2HH1 ARG 76 11.401 -23.784 16.754 618 HH21 ARG 76 1HH2 ARG 76 8.901 -21.565 17.813 619 HH22 ARG 76 2HH2 ARG 76 9.250 -23.149 17.162 620 H ILE 77 H ILE 77 16.350 -16.541 16.205 621 HA ILE 77 HA ILE 77 18.893 -17.522 17.216 622 HB ILE 77 HB ILE 77 18.369 -14.858 15.858 623 HG12 ILE 77 2HG1 ILE 77 17.390 -16.537 14.398 624 HG13 ILE 77 3HG1 ILE 77 18.887 -15.908 13.714 625 HG21 ILE 77 1HG2 ILE 77 20.819 -16.653 16.060 626 HG22 ILE 77 2HG2 ILE 77 20.709 -15.169 15.083 627 HG23 ILE 77 3HG2 ILE 77 20.576 -15.077 16.846 628 HD11 ILE 77 3HD1 ILE 77 18.716 -18.318 13.397 629 HD12 ILE 77 1HD1 ILE 77 20.100 -17.937 14.434 630 HD13 ILE 77 2HD1 ILE 77 18.597 -18.576 15.154 631 H ALA 78 H ALA 78 16.638 -14.893 18.044 632 HA ALA 78 HA ALA 78 18.560 -13.450 19.634 633 HB1 ALA 78 1HB ALA 78 15.528 -13.264 19.500 634 HB2 ALA 78 2HB ALA 78 16.620 -12.057 20.215 635 HB3 ALA 78 3HB ALA 78 16.681 -12.388 18.468 636 H VAL 79 H VAL 79 15.945 -15.807 20.399 637 HA VAL 79 HA VAL 79 16.286 -15.357 23.259 638 HB VAL 79 HB VAL 79 14.110 -15.891 22.335 639 HG11 VAL 79 1HG1 VAL 79 14.854 -17.434 20.509 640 HG12 VAL 79 2HG1 VAL 79 15.243 -18.659 21.743 641 HG13 VAL 79 3HG1 VAL 79 13.560 -18.118 21.519 642 HG21 VAL 79 3HG2 VAL 79 15.141 -18.173 24.075 643 HG22 VAL 79 1HG2 VAL 79 14.736 -16.550 24.678 644 HG23 VAL 79 2HG2 VAL 79 13.469 -17.584 23.964 645 H ASN 80 H ASN 80 17.558 -17.662 20.850 646 HA ASN 80 HA ASN 80 18.644 -19.412 22.901 647 HB2 ASN 80 2HB ASN 80 19.163 -19.122 19.918 648 HB3 ASN 80 3HB ASN 80 19.936 -20.347 20.926 649 HD21 ASN 80 2HD2 ASN 80 18.573 -21.351 18.893 650 HD22 ASN 80 1HD2 ASN 80 17.043 -22.038 19.415 651 H THR 81 H THR 81 19.663 -16.411 21.364 652 HA THR 81 HA THR 81 22.460 -16.761 22.142 653 HB THR 81 HB THR 81 20.922 -14.328 21.140 654 HG1 THR 81 1HG THR 81 21.097 -15.829 19.566 655 HG21 THR 81 1HG2 THR 81 23.185 -13.431 20.651 656 HG22 THR 81 2HG2 THR 81 22.946 -13.637 22.396 657 HG23 THR 81 3HG2 THR 81 23.915 -14.821 21.491 658 H ALA 82 H ALA 82 19.498 -15.407 23.580 659 HA ALA 82 HA ALA 82 20.891 -13.927 25.637 660 HB1 ALA 82 1HB ALA 82 18.574 -13.440 24.889 661 HB2 ALA 82 2HB ALA 82 18.045 -15.015 25.524 662 HB3 ALA 82 3HB ALA 82 18.654 -13.761 26.632 663 H LYS 83 H LYS 83 19.671 -17.249 25.276 664 HA LYS 83 HA LYS 83 20.189 -17.977 28.046 665 HB2 LYS 83 2HB LYS 83 19.685 -19.596 25.516 666 HB3 LYS 83 3HB LYS 83 19.800 -20.290 27.147 667 HG2 LYS 83 2HG LYS 83 17.895 -18.974 27.902 668 HG3 LYS 83 3HG LYS 83 17.803 -18.131 26.341 669 HD2 LYS 83 2HD LYS 83 17.374 -20.300 25.209 670 HD3 LYS 83 3HD LYS 83 17.394 -21.117 26.792 671 HE2 LYS 83 2HE LYS 83 15.520 -19.692 27.546 672 HE3 LYS 83 3HE LYS 83 15.506 -18.867 25.980 673 HZ1 LYS 83 3HZ LYS 83 14.980 -21.731 26.409 674 HZ2 LYS 83 1HZ LYS 83 13.850 -20.584 26.081 675 HZ3 LYS 83 2HZ LYS 83 14.974 -20.971 24.950 676 H ASN 84 H ASN 84 22.048 -17.834 25.050 677 HA ASN 84 HA ASN 84 24.231 -19.430 26.174 678 HB2 ASN 84 2HB ASN 84 23.668 -19.597 23.813 679 HB3 ASN 84 3HB ASN 84 23.960 -17.860 23.589 680 HD21 ASN 84 2HD2 ASN 84 26.074 -17.102 23.339 681 HD22 ASN 84 1HD2 ASN 84 27.461 -18.170 23.284 682 H TYR 85 H TYR 85 23.206 -16.095 26.144 683 HA TYR 85 HA TYR 85 25.850 -14.954 26.524 684 HB2 TYR 85 2HB TYR 85 23.912 -13.748 25.532 685 HB3 TYR 85 3HB TYR 85 23.055 -13.871 27.068 686 HD1 TYR 85 HD2 TYR 85 25.997 -12.391 25.351 687 HD2 TYR 85 HD1 TYR 85 23.492 -12.319 28.844 688 HE1 TYR 85 HE2 TYR 85 27.028 -10.240 26.039 689 HE2 TYR 85 HE1 TYR 85 24.515 -10.170 29.543 690 HH TYR 85 HH TYR 85 25.994 -8.504 28.994 691 H LEU 86 H LEU 86 23.162 -16.061 28.608 692 HA LEU 86 HA LEU 86 24.515 -15.142 31.031 693 HB2 LEU 86 2HB LEU 86 22.020 -16.817 30.569 694 HB3 LEU 86 3HB LEU 86 22.593 -16.269 32.153 695 HG LEU 86 HG LEU 86 21.757 -14.455 29.853 696 HD11 LEU 86 1HD1 LEU 86 20.475 -15.104 32.541 697 HD12 LEU 86 2HD1 LEU 86 19.883 -13.907 31.372 698 HD13 LEU 86 3HD1 LEU 86 19.886 -15.632 30.940 699 HD21 LEU 86 3HD2 LEU 86 22.675 -13.831 32.696 700 HD22 LEU 86 1HD2 LEU 86 23.503 -13.374 31.190 701 HD23 LEU 86 2HD2 LEU 86 21.934 -12.656 31.588 702 H VAL 87 H VAL 87 24.498 -18.116 29.120 703 HA VAL 87 HA VAL 87 25.496 -19.685 31.387 704 HB VAL 87 HB VAL 87 24.075 -20.534 29.420 705 HG11 VAL 87 1HG1 VAL 87 26.813 -20.733 28.099 706 HG12 VAL 87 2HG1 VAL 87 25.261 -21.293 27.449 707 HG13 VAL 87 3HG1 VAL 87 25.570 -19.548 27.646 708 HG21 VAL 87 3HG2 VAL 87 26.629 -22.024 30.133 709 HG22 VAL 87 1HG2 VAL 87 25.123 -22.017 31.093 710 HG23 VAL 87 2HG2 VAL 87 25.150 -22.738 29.465 711 H ALA 88 H ALA 88 26.795 -17.702 28.789 712 HA ALA 88 HA ALA 88 29.440 -18.837 28.881 713 HB1 ALA 88 1HB ALA 88 28.425 -16.147 27.865 714 HB2 ALA 88 2HB ALA 88 30.031 -16.832 27.539 715 HB3 ALA 88 3HB ALA 88 28.579 -17.637 26.901 716 H GLN 89 H GLN 89 27.662 -16.612 30.858 717 HA GLN 89 HA GLN 89 30.161 -15.735 32.225 718 HB2 GLN 89 2HB GLN 89 27.338 -14.600 32.240 719 HB3 GLN 89 3HB GLN 89 28.702 -13.963 33.182 720 HG2 GLN 89 2HG GLN 89 29.955 -13.485 31.130 721 HG3 GLN 89 3HG GLN 89 28.674 -14.207 30.146 722 HE21 GLN 89 2HE2 GLN 89 26.641 -13.142 29.913 723 HE22 GLN 89 1HE2 GLN 89 26.474 -11.439 30.277 724 H GLY 90 H GLY 90 27.425 -17.844 32.494 725 HA2 GLY 90 2HA GLY 90 27.471 -17.921 35.422 726 HA3 GLY 90 3HA GLY 90 26.502 -18.926 34.322 727 H ARG 91 H ARG 91 28.938 -19.644 32.699 728 HA ARG 91 HA ARG 91 29.958 -21.770 34.464 729 HB2 ARG 91 2HB ARG 91 30.280 -21.303 31.478 730 HB3 ARG 91 3HB ARG 91 30.896 -22.703 32.368 731 HG2 ARG 91 2HG ARG 91 27.967 -21.925 32.071 732 HG3 ARG 91 3HG ARG 91 28.802 -23.264 31.261 733 HD2 ARG 91 2HD ARG 91 29.309 -24.233 33.526 734 HD3 ARG 91 3HD ARG 91 28.295 -22.957 34.240 735 HE ARG 91 HE ARG 91 26.817 -24.287 32.201 736 HH11 ARG 91 1HH1 ARG 91 28.100 -24.845 35.447 737 HH12 ARG 91 2HH1 ARG 91 26.860 -26.001 35.868 738 HH21 ARG 91 1HH2 ARG 91 25.197 -25.790 32.780 739 HH22 ARG 91 2HH2 ARG 91 25.214 -26.528 34.363 740 H ARG 92 H ARG 92 30.731 -18.746 34.393 741 HA ARG 92 HA ARG 92 33.659 -19.023 34.089 742 HB2 ARG 92 2HB ARG 92 32.444 -17.095 33.108 743 HB3 ARG 92 3HB ARG 92 31.888 -16.627 34.722 744 HG2 ARG 92 2HG ARG 92 34.196 -16.195 35.431 745 HG3 ARG 92 3HG ARG 92 34.813 -16.839 33.891 746 HD2 ARG 92 2HD ARG 92 34.784 -14.380 33.872 747 HD3 ARG 92 3HD ARG 92 33.679 -15.048 32.660 748 HE ARG 92 HE ARG 92 32.411 -14.460 35.231 749 HH11 ARG 92 1HH1 ARG 92 33.333 -13.133 32.086 750 HH12 ARG 92 2HH1 ARG 92 32.124 -11.870 32.133 751 HH21 ARG 92 1HH2 ARG 92 30.836 -12.813 35.258 752 HH22 ARG 92 2HH2 ARG 92 30.721 -11.689 33.924 753 H LEU 93 H LEU 93 31.210 -19.275 36.476 754 HA LEU 93 HA LEU 93 33.248 -19.146 38.646 755 HB2 LEU 93 2HB LEU 93 30.338 -18.245 38.723 756 HB3 LEU 93 3HB LEU 93 31.419 -18.308 40.121 757 HG LEU 93 HG LEU 93 31.871 -16.580 37.655 758 HD11 LEU 93 1HD1 LEU 93 30.927 -15.878 40.466 759 HD12 LEU 93 2HD1 LEU 93 31.262 -14.718 39.160 760 HD13 LEU 93 3HD1 LEU 93 29.922 -15.871 38.997 761 HD21 LEU 93 3HD2 LEU 93 33.292 -16.668 40.355 762 HD22 LEU 93 1HD2 LEU 93 33.988 -17.178 38.797 763 HD23 LEU 93 2HD2 LEU 93 33.580 -15.474 39.073 764 H GLU 94 H GLU 94 31.227 -21.108 36.866 765 HA GLU 94 HA GLU 94 31.166 -23.161 39.008 766 HB2 GLU 94 2HB GLU 94 28.928 -22.354 37.109 767 HB3 GLU 94 3HB GLU 94 28.964 -23.899 37.958 768 HG2 GLU 94 2HG GLU 94 29.022 -21.182 39.335 769 HG3 GLU 94 3HG GLU 94 27.571 -22.162 39.090 770 H LEU 95 H LEU 95 31.033 -25.349 38.053 771 HA LEU 95 HA LEU 95 32.011 -26.925 36.806 772 HB2 LEU 95 2HB LEU 95 30.100 -26.167 35.351 773 HB3 LEU 95 3HB LEU 95 31.265 -25.226 34.406 774 HG LEU 95 HG LEU 95 32.462 -27.317 33.799 775 HD11 LEU 95 1HD1 LEU 95 30.245 -28.672 35.403 776 HD12 LEU 95 2HD1 LEU 95 31.398 -29.503 34.332 777 HD13 LEU 95 3HD1 LEU 95 31.981 -28.691 35.793 778 HD21 LEU 95 3HD2 LEU 95 29.452 -27.441 33.367 779 HD22 LEU 95 1HD2 LEU 95 30.602 -26.474 32.406 780 HD23 LEU 95 2HD2 LEU 95 30.694 -28.247 32.373 781 H VAL 96 H VAL 96 33.664 -24.700 37.777 782 HA VAL 96 HA VAL 96 35.997 -25.081 35.968 783 HB VAL 96 HB VAL 96 36.782 -22.845 36.830 784 HG11 VAL 96 1HG1 VAL 96 35.403 -21.546 35.270 785 HG12 VAL 96 2HG1 VAL 96 35.801 -23.134 34.577 786 HG13 VAL 96 3HG1 VAL 96 34.184 -22.841 35.247 787 HG21 VAL 96 3HG2 VAL 96 33.885 -22.542 37.722 788 HG22 VAL 96 1HG2 VAL 96 35.296 -22.670 38.804 789 HG23 VAL 96 2HG2 VAL 96 35.125 -21.276 37.724 790 HA PRO 97 HA PRO 97 37.913 -26.941 39.385 791 HB2 PRO 97 2HB PRO 97 40.568 -26.347 39.062 792 HB3 PRO 97 3HB PRO 97 39.663 -27.397 37.927 793 HG2 PRO 97 2HG PRO 97 40.227 -24.428 37.647 794 HG3 PRO 97 3HG PRO 97 40.513 -25.725 36.443 795 HD2 PRO 97 2HD PRO 97 38.261 -24.220 36.356 796 HD3 PRO 97 3HD PRO 97 38.184 -25.976 36.031 797 H ARG 98 H ARG 98 37.921 -23.489 39.152 798 HA ARG 98 HA ARG 98 39.137 -23.185 41.824 799 HB2 ARG 98 2HB ARG 98 39.057 -20.809 41.404 800 HB3 ARG 98 3HB ARG 98 39.813 -21.640 40.034 801 HG2 ARG 98 2HG ARG 98 37.709 -21.481 38.754 802 HG3 ARG 98 3HG ARG 98 36.912 -20.705 40.144 803 HD2 ARG 98 2HD ARG 98 38.568 -18.864 40.049 804 HD3 ARG 98 3HD ARG 98 39.320 -19.619 38.632 805 HE ARG 98 HE ARG 98 36.585 -19.312 38.026 806 HH11 ARG 98 1HH1 ARG 98 39.361 -17.244 38.735 807 HH12 ARG 98 2HH1 ARG 98 38.744 -15.900 37.801 808 HH21 ARG 98 1HH2 ARG 98 35.804 -17.547 36.825 809 HH22 ARG 98 2HH2 ARG 98 36.747 -16.077 36.715 810 H GLY 99 H GLY 99 36.122 -24.013 40.689 811 HA2 GLY 99 2HA GLY 99 34.464 -22.311 42.336 812 HA3 GLY 99 3HA GLY 99 33.986 -23.808 41.508 813 H SER 100 H SER 100 36.532 -24.976 43.053 814 HA SER 100 HA SER 100 34.960 -25.975 45.302 815 HB2 SER 100 2HB SER 100 36.425 -27.411 43.884 816 HB3 SER 100 3HB SER 100 37.838 -26.521 44.488 817 HG SER 100 HG SER 100 37.415 -28.447 45.670 818 H HIS 101 H HIS 101 36.916 -23.264 44.762 819 HA HIS 101 HA HIS 101 37.881 -23.141 47.559 820 HB2 HIS 101 2HB HIS 101 38.499 -21.368 45.170 821 HB3 HIS 101 3HB HIS 101 39.274 -21.290 46.756 822 HD2 HIS 101 HD2 HIS 101 41.127 -23.136 47.342 823 HE1 HIS 101 HE1 HIS 101 41.202 -25.070 43.554 824 HE2 HIS 101 HE2 HIS 101 42.360 -24.865 45.813 825 H HIS 102 H HIS 102 35.076 -22.494 46.106 826 HA HIS 102 HA HIS 102 33.353 -21.087 46.373 827 HB2 HIS 102 2HB HIS 102 34.617 -20.528 49.066 828 HB3 HIS 102 3HB HIS 102 32.931 -20.243 48.620 829 HD2 HIS 102 HD2 HIS 102 35.208 -22.884 49.997 830 HE1 HIS 102 HE1 HIS 102 31.636 -24.955 48.973 831 HE2 HIS 102 HE2 HIS 102 33.864 -25.121 50.204 832 H HIS 103 H HIS 103 35.980 -19.946 45.310 833 HA HIS 103 HA HIS 103 36.827 -17.988 44.566 834 HB2 HIS 103 2HB HIS 103 33.971 -17.016 44.858 835 HB3 HIS 103 3HB HIS 103 35.226 -16.296 43.846 836 HD2 HIS 103 HD2 HIS 103 32.498 -18.836 43.729 837 HE1 HIS 103 HE1 HIS 103 34.901 -19.693 40.329 838 HE2 HIS 103 HE2 HIS 103 32.682 -20.162 41.476 839 H HIS 104 H HIS 104 36.626 -15.391 44.952 840 HA HIS 104 HA HIS 104 37.439 -13.735 46.239 841 HB2 HIS 104 2HB HIS 104 35.108 -14.002 47.103 842 HB3 HIS 104 3HB HIS 104 35.759 -14.943 48.450 843 HD2 HIS 104 HD2 HIS 104 36.449 -11.426 46.847 844 HE1 HIS 104 HE1 HIS 104 36.694 -11.004 51.072 845 HE2 HIS 104 HE2 HIS 104 36.834 -9.777 48.844 846 H HIS 105 H HIS 105 38.323 -13.341 48.731 847 HA HIS 105 HA HIS 105 40.217 -13.497 49.945 848 HB2 HIS 105 2HB HIS 105 39.748 -16.487 49.743 849 HB3 HIS 105 3HB HIS 105 40.733 -15.659 50.945 850 HD2 HIS 105 HD2 HIS 105 37.168 -16.667 50.197 851 HE1 HIS 105 HE1 HIS 105 36.952 -14.255 53.694 852 HE2 HIS 105 HE2 HIS 105 35.658 -15.833 52.171 853 H HIS 106 H HIS 106 42.433 -14.826 50.130 854 HA HIS 106 HA HIS 106 44.517 -14.838 49.232 855 HB2 HIS 106 2HB HIS 106 43.611 -17.086 48.735 856 HB3 HIS 106 3HB HIS 106 43.117 -16.527 47.137 857 HD2 HIS 106 HD2 HIS 106 44.759 -17.519 45.416 858 HE1 HIS 106 HE1 HIS 106 48.434 -16.970 47.483 859 HE2 HIS 106 HE2 HIS 106 47.365 -17.786 45.322 Start of MODEL 15 1 H1 MET 1 H1 MET 1 5.659 -3.570 1.750 2 H2 MET 1 H2 MET 1 5.853 -4.853 2.761 3 H3 MET 1 H3 MET 1 4.416 -4.044 2.719 4 HA MET 1 HA MET 1 5.588 -5.601 0.529 5 HB2 MET 1 2HB MET 1 3.796 -7.206 0.899 6 HB3 MET 1 3HB MET 1 4.774 -7.026 2.366 7 HG2 MET 1 2HG MET 1 3.072 -5.447 3.279 8 HG3 MET 1 3HG MET 1 2.085 -5.700 1.836 9 HE1 MET 1 1HE MET 1 0.944 -9.411 2.181 10 HE2 MET 1 2HE MET 1 0.857 -7.912 1.227 11 HE3 MET 1 3HE MET 1 2.379 -8.833 1.301 12 H SER 2 H SER 2 4.139 -5.969 -1.265 13 HA SER 2 HA SER 2 2.905 -5.257 -2.987 14 HB2 SER 2 2HB SER 2 1.008 -4.293 -0.833 15 HB3 SER 2 3HB SER 2 0.597 -4.637 -2.524 16 HG SER 2 HG SER 2 0.160 -6.409 -1.167 17 H GLU 3 H GLU 3 4.569 -3.009 -1.331 18 HA GLU 3 HA GLU 3 4.155 -1.022 -3.425 19 HB2 GLU 3 2HB GLU 3 2.340 -0.508 -1.779 20 HB3 GLU 3 3HB GLU 3 3.559 -0.322 -0.511 21 HG2 GLU 3 2HG GLU 3 4.580 1.555 -1.726 22 HG3 GLU 3 3HG GLU 3 3.464 1.315 -3.084 23 H GLN 4 H GLN 4 5.772 -2.261 -0.550 24 HA GLN 4 HA GLN 4 8.298 -1.053 -1.453 25 HB2 GLN 4 2HB GLN 4 7.377 0.570 0.108 26 HB3 GLN 4 3HB GLN 4 7.146 -0.687 1.344 27 HG2 GLN 4 2HG GLN 4 9.572 -0.994 1.502 28 HG3 GLN 4 3HG GLN 4 9.833 0.141 0.157 29 HE21 GLN 4 2HE2 GLN 4 8.499 -0.125 3.490 30 HE22 GLN 4 1HE2 GLN 4 8.806 1.542 3.925 31 H LEU 5 H LEU 5 10.143 -2.050 -0.368 32 HA LEU 5 HA LEU 5 9.999 -4.873 -0.539 33 HB2 LEU 5 2HB LEU 5 12.164 -3.210 0.781 34 HB3 LEU 5 3HB LEU 5 12.335 -4.797 0.011 35 HG LEU 5 HG LEU 5 11.671 -2.161 -1.367 36 HD11 LEU 5 1HD1 LEU 5 14.039 -2.433 -0.644 37 HD12 LEU 5 2HD1 LEU 5 14.107 -3.991 -1.503 38 HD13 LEU 5 3HD1 LEU 5 13.884 -2.478 -2.415 39 HD21 LEU 5 3HD2 LEU 5 10.540 -4.047 -2.508 40 HD22 LEU 5 1HD2 LEU 5 11.888 -3.411 -3.474 41 HD23 LEU 5 2HD2 LEU 5 12.090 -4.929 -2.574 42 H THR 6 H THR 6 10.441 -6.477 0.990 43 HA THR 6 HA THR 6 9.775 -5.881 3.814 44 HB THR 6 HB THR 6 8.368 -7.970 2.097 45 HG1 THR 6 1HG THR 6 7.781 -5.823 1.597 46 HG21 THR 6 1HG2 THR 6 8.021 -7.045 4.972 47 HG22 THR 6 2HG2 THR 6 6.761 -7.930 4.071 48 HG23 THR 6 3HG2 THR 6 8.325 -8.699 4.378 49 H ASP 7 H ASP 7 9.994 -8.155 5.052 50 HA ASP 7 HA ASP 7 12.701 -8.850 4.927 51 HB2 ASP 7 2HB ASP 7 12.111 -10.618 6.500 52 HB3 ASP 7 3HB ASP 7 11.270 -9.111 6.893 53 H GLN 8 H GLN 8 10.118 -10.000 2.910 54 HA GLN 8 HA GLN 8 11.190 -12.576 2.280 55 HB2 GLN 8 2HB GLN 8 8.879 -11.954 1.787 56 HB3 GLN 8 3HB GLN 8 9.422 -10.637 0.735 57 HG2 GLN 8 2HG GLN 8 8.710 -12.562 -0.604 58 HG3 GLN 8 3HG GLN 8 10.442 -12.272 -0.820 59 HE21 GLN 8 2HE2 GLN 8 11.974 -13.727 0.211 60 HE22 GLN 8 1HE2 GLN 8 11.475 -15.346 0.668 61 H VAL 9 H VAL 9 11.416 -9.395 0.614 62 HA VAL 9 HA VAL 9 13.361 -10.470 -1.290 63 HB VAL 9 HB VAL 9 11.701 -8.997 -2.160 64 HG11 VAL 9 1HG1 VAL 9 12.601 -6.975 -0.076 65 HG12 VAL 9 2HG1 VAL 9 11.433 -6.671 -1.393 66 HG13 VAL 9 3HG1 VAL 9 11.039 -7.837 -0.120 67 HG21 VAL 9 3HG2 VAL 9 13.022 -7.225 -3.174 68 HG22 VAL 9 1HG2 VAL 9 14.255 -7.354 -1.908 69 HG23 VAL 9 2HG2 VAL 9 14.022 -8.692 -3.062 70 H LEU 10 H LEU 10 13.385 -8.640 1.732 71 HA LEU 10 HA LEU 10 16.047 -7.587 1.396 72 HB2 LEU 10 2HB LEU 10 14.007 -7.812 3.576 73 HB3 LEU 10 3HB LEU 10 15.700 -7.686 4.084 74 HG LEU 10 HG LEU 10 16.019 -5.656 2.824 75 HD11 LEU 10 1HD1 LEU 10 14.516 -6.026 0.928 76 HD12 LEU 10 2HD1 LEU 10 13.101 -5.905 2.006 77 HD13 LEU 10 3HD1 LEU 10 14.149 -4.491 1.728 78 HD21 LEU 10 3HD2 LEU 10 13.465 -5.591 4.496 79 HD22 LEU 10 1HD2 LEU 10 15.125 -5.479 5.117 80 HD23 LEU 10 2HD2 LEU 10 14.487 -4.178 4.097 81 H VAL 11 H VAL 11 14.777 -10.745 2.479 82 HA VAL 11 HA VAL 11 17.433 -11.503 3.467 83 HB VAL 11 HB VAL 11 14.856 -13.060 3.093 84 HG11 VAL 11 1HG1 VAL 11 16.701 -14.624 2.723 85 HG12 VAL 11 2HG1 VAL 11 17.578 -13.980 4.128 86 HG13 VAL 11 3HG1 VAL 11 16.046 -14.868 4.350 87 HG21 VAL 11 3HG2 VAL 11 14.911 -13.085 5.549 88 HG22 VAL 11 1HG2 VAL 11 16.481 -12.247 5.552 89 HG23 VAL 11 2HG2 VAL 11 15.021 -11.404 4.986 90 H GLU 12 H GLU 12 15.575 -11.726 0.434 91 HA GLU 12 HA GLU 12 17.391 -13.639 -0.777 92 HB2 GLU 12 2HB GLU 12 15.409 -11.621 -1.894 93 HB3 GLU 12 3HB GLU 12 16.348 -12.725 -2.910 94 HG2 GLU 12 2HG GLU 12 15.390 -14.670 -1.700 95 HG3 GLU 12 3HG GLU 12 14.437 -13.572 -0.694 96 H ARG 13 H ARG 13 17.261 -10.092 -0.495 97 HA ARG 13 HA ARG 13 19.269 -9.621 -2.505 98 HB2 ARG 13 2HB ARG 13 17.547 -7.992 -1.891 99 HB3 ARG 13 3HB ARG 13 18.237 -7.836 -0.256 100 HG2 ARG 13 2HG ARG 13 20.258 -6.878 -1.122 101 HG3 ARG 13 3HG ARG 13 19.844 -7.354 -2.791 102 HD2 ARG 13 2HD ARG 13 17.872 -5.821 -2.679 103 HD3 ARG 13 3HD ARG 13 18.449 -5.256 -1.094 104 HE ARG 13 HE ARG 13 20.584 -5.049 -2.957 105 HH11 ARG 13 1HH1 ARG 13 17.445 -3.549 -2.307 106 HH12 ARG 13 2HH1 ARG 13 17.884 -2.041 -3.073 107 HH21 ARG 13 1HH2 ARG 13 21.103 -3.116 -3.978 108 HH22 ARG 13 2HH2 ARG 13 19.962 -1.788 -4.016 109 H VAL 14 H VAL 14 19.414 -10.020 1.063 110 HA VAL 14 HA VAL 14 22.219 -9.323 1.182 111 HB VAL 14 HB VAL 14 22.140 -10.258 3.441 112 HG11 VAL 14 1HG1 VAL 14 19.781 -8.515 2.628 113 HG12 VAL 14 2HG1 VAL 14 20.289 -8.790 4.310 114 HG13 VAL 14 3HG1 VAL 14 21.393 -7.988 3.156 115 HG21 VAL 14 3HG2 VAL 14 20.002 -11.087 4.347 116 HG22 VAL 14 1HG2 VAL 14 19.320 -11.102 2.703 117 HG23 VAL 14 2HG2 VAL 14 20.685 -12.178 3.121 118 H GLN 15 H GLN 15 20.435 -12.262 0.383 119 HA GLN 15 HA GLN 15 22.763 -13.986 0.670 120 HB2 GLN 15 2HB GLN 15 20.039 -14.324 -0.627 121 HB3 GLN 15 3HB GLN 15 21.280 -15.598 -0.605 122 HG2 GLN 15 2HG GLN 15 21.328 -15.570 1.848 123 HG3 GLN 15 3HG GLN 15 20.164 -14.256 1.901 124 HE21 GLN 15 2HE2 GLN 15 19.577 -16.561 3.292 125 HE22 GLN 15 1HE2 GLN 15 18.277 -17.420 2.499 126 H LYS 16 H LYS 16 21.580 -11.743 -1.733 127 HA LYS 16 HA LYS 16 23.237 -12.838 -3.870 128 HB2 LYS 16 2HB LYS 16 21.094 -10.915 -3.589 129 HB3 LYS 16 3HB LYS 16 22.484 -10.114 -4.346 130 HG2 LYS 16 2HG LYS 16 21.213 -11.054 -6.123 131 HG3 LYS 16 3HG LYS 16 22.673 -12.045 -5.925 132 HD2 LYS 16 2HD LYS 16 20.852 -13.579 -6.233 133 HD3 LYS 16 3HD LYS 16 21.307 -13.658 -4.528 134 HE2 LYS 16 2HE LYS 16 18.908 -13.597 -4.630 135 HE3 LYS 16 3HE LYS 16 19.463 -12.036 -4.009 136 HZ1 LYS 16 3HZ LYS 16 18.674 -12.573 -6.789 137 HZ2 LYS 16 1HZ LYS 16 17.770 -11.772 -5.683 138 HZ3 LYS 16 2HZ LYS 16 19.184 -11.121 -6.205 139 H GLY 17 H GLY 17 23.922 -11.144 -1.047 140 HA2 GLY 17 2HA GLY 17 26.244 -10.835 -0.514 141 HA3 GLY 17 3HA GLY 17 26.556 -10.345 -2.185 142 H ASP 18 H ASP 18 23.675 -8.835 -1.327 143 HA ASP 18 HA ASP 18 25.055 -6.279 -0.851 144 HB2 ASP 18 2HB ASP 18 22.228 -7.172 -1.421 145 HB3 ASP 18 3HB ASP 18 22.528 -5.555 -0.813 146 H GLN 19 H GLN 19 25.974 -6.764 1.238 147 HA GLN 19 HA GLN 19 24.410 -7.587 3.469 148 HB2 GLN 19 2HB GLN 19 26.858 -7.755 3.246 149 HB3 GLN 19 3HB GLN 19 27.018 -5.999 3.343 150 HG2 GLN 19 2HG GLN 19 25.630 -7.593 5.527 151 HG3 GLN 19 3HG GLN 19 27.389 -7.468 5.482 152 HE21 GLN 19 2HE2 GLN 19 26.047 -6.549 7.691 153 HE22 GLN 19 1HE2 GLN 19 26.137 -4.798 7.748 154 H LYS 20 H LYS 20 24.712 -4.536 1.837 155 HA LYS 20 HA LYS 20 23.992 -2.738 3.926 156 HB2 LYS 20 2HB LYS 20 23.387 -1.254 2.051 157 HB3 LYS 20 3HB LYS 20 24.934 -2.064 1.759 158 HG2 LYS 20 2HG LYS 20 23.683 -3.793 0.377 159 HG3 LYS 20 3HG LYS 20 22.229 -2.789 0.545 160 HD2 LYS 20 2HD LYS 20 23.423 -0.898 -0.517 161 HD3 LYS 20 3HD LYS 20 24.891 -1.905 -0.655 162 HE2 LYS 20 2HE LYS 20 23.656 -3.521 -2.056 163 HE3 LYS 20 3HE LYS 20 22.209 -2.513 -1.956 164 HZ1 LYS 20 3HZ LYS 20 23.425 -0.761 -3.054 165 HZ2 LYS 20 1HZ LYS 20 24.790 -1.685 -3.106 166 HZ3 LYS 20 2HZ LYS 20 23.472 -2.129 -3.972 167 H ALA 21 H ALA 21 22.083 -5.088 2.107 168 HA ALA 21 HA ALA 21 19.563 -3.810 2.841 169 HB1 ALA 21 1HB ALA 21 20.183 -6.533 1.621 170 HB2 ALA 21 2HB ALA 21 18.564 -5.822 1.788 171 HB3 ALA 21 3HB ALA 21 19.768 -5.052 0.729 172 H PHE 22 H PHE 22 21.823 -6.033 4.312 173 HA PHE 22 HA PHE 22 19.855 -7.235 6.103 174 HB2 PHE 22 2HB PHE 22 21.987 -8.374 5.490 175 HB3 PHE 22 3HB PHE 22 22.884 -7.104 6.306 176 HD1 PHE 22 HD2 PHE 22 20.101 -9.564 6.909 177 HD2 PHE 22 HD1 PHE 22 23.425 -7.405 8.582 178 HE1 PHE 22 HE2 PHE 22 19.811 -10.780 9.035 179 HE2 PHE 22 HE1 PHE 22 23.126 -8.620 10.723 180 HZ PHE 22 HZ PHE 22 21.316 -10.303 10.958 181 H ASN 23 H ASN 23 22.140 -4.487 6.123 182 HA ASN 23 HA ASN 23 21.882 -3.794 8.871 183 HB2 ASN 23 2HB ASN 23 23.626 -2.835 7.539 184 HB3 ASN 23 3HB ASN 23 22.471 -2.259 6.324 185 HD21 ASN 23 2HD2 ASN 23 21.459 -0.312 6.532 186 HD22 ASN 23 1HD2 ASN 23 21.736 0.787 7.863 187 H LEU 24 H LEU 24 20.005 -2.881 5.969 188 HA LEU 24 HA LEU 24 18.171 -1.213 7.457 189 HB2 LEU 24 2HB LEU 24 17.977 -2.432 4.675 190 HB3 LEU 24 3HB LEU 24 16.920 -1.166 5.336 191 HG LEU 24 HG LEU 24 19.938 -0.864 5.026 192 HD11 LEU 24 1HD1 LEU 24 17.668 0.131 3.260 193 HD12 LEU 24 2HD1 LEU 24 19.392 0.536 3.072 194 HD13 LEU 24 3HD1 LEU 24 18.846 -1.140 2.842 195 HD21 LEU 24 3HD2 LEU 24 19.413 1.547 5.296 196 HD22 LEU 24 1HD2 LEU 24 17.706 1.133 5.580 197 HD23 LEU 24 2HD2 LEU 24 18.960 0.612 6.735 198 H LEU 25 H LEU 25 18.421 -4.633 6.903 199 HA LEU 25 HA LEU 25 15.582 -5.152 7.386 200 HB2 LEU 25 2HB LEU 25 16.877 -6.620 5.931 201 HB3 LEU 25 3HB LEU 25 18.044 -6.926 7.223 202 HG LEU 25 HG LEU 25 16.276 -8.045 8.553 203 HD11 LEU 25 1HD1 LEU 25 14.281 -6.887 7.675 204 HD12 LEU 25 2HD1 LEU 25 14.559 -7.624 6.073 205 HD13 LEU 25 3HD1 LEU 25 14.142 -8.646 7.465 206 HD21 LEU 25 3HD2 LEU 25 16.587 -9.066 5.696 207 HD22 LEU 25 1HD2 LEU 25 17.714 -9.352 7.046 208 HD23 LEU 25 2HD2 LEU 25 16.079 -10.039 7.093 209 H VAL 26 H VAL 26 18.647 -5.306 9.337 210 HA VAL 26 HA VAL 26 17.211 -6.523 11.516 211 HB VAL 26 HB VAL 26 19.152 -6.196 12.857 212 HG11 VAL 26 1HG1 VAL 26 19.965 -6.941 10.021 213 HG12 VAL 26 2HG1 VAL 26 20.839 -7.344 11.506 214 HG13 VAL 26 3HG1 VAL 26 19.220 -8.017 11.225 215 HG21 VAL 26 3HG2 VAL 26 20.240 -4.420 10.645 216 HG22 VAL 26 1HG2 VAL 26 19.739 -3.911 12.282 217 HG23 VAL 26 2HG2 VAL 26 21.134 -4.986 12.077 218 H VAL 27 H VAL 27 17.590 -3.123 10.531 219 HA VAL 27 HA VAL 27 17.039 -2.070 13.149 220 HB VAL 27 HB VAL 27 16.380 -0.003 11.960 221 HG11 VAL 27 1HG1 VAL 27 18.585 0.422 10.928 222 HG12 VAL 27 2HG1 VAL 27 18.750 -0.431 12.483 223 HG13 VAL 27 3HG1 VAL 27 18.932 -1.315 10.949 224 HG21 VAL 27 3HG2 VAL 27 15.379 -1.052 9.929 225 HG22 VAL 27 1HG2 VAL 27 16.631 0.141 9.529 226 HG23 VAL 27 2HG2 VAL 27 17.013 -1.591 9.449 227 H ARG 28 H ARG 28 14.976 -3.482 10.636 228 HA ARG 28 HA ARG 28 12.493 -2.441 11.667 229 HB2 ARG 28 2HB ARG 28 12.930 -5.058 10.181 230 HB3 ARG 28 3HB ARG 28 11.464 -4.066 10.228 231 HG2 ARG 28 2HG ARG 28 12.756 -2.248 9.022 232 HG3 ARG 28 3HG ARG 28 14.136 -3.367 8.941 233 HD2 ARG 28 2HD ARG 28 13.016 -3.501 6.839 234 HD3 ARG 28 3HD ARG 28 12.710 -5.006 7.716 235 HE ARG 28 HE ARG 28 10.517 -3.643 8.407 236 HH11 ARG 28 1HH1 ARG 28 12.072 -3.847 5.233 237 HH12 ARG 28 2HH1 ARG 28 10.571 -3.628 4.358 238 HH21 ARG 28 1HH2 ARG 28 8.576 -3.387 7.228 239 HH22 ARG 28 2HH2 ARG 28 8.614 -3.367 5.480 240 H TYR 29 H TYR 29 14.593 -5.153 12.412 241 HA TYR 29 HA TYR 29 12.625 -6.239 14.346 242 HB2 TYR 29 2HB TYR 29 15.196 -7.353 13.178 243 HB3 TYR 29 3HB TYR 29 14.247 -8.147 14.423 244 HD1 TYR 29 HD2 TYR 29 14.024 -6.877 10.910 245 HD2 TYR 29 HD1 TYR 29 12.355 -9.412 13.944 246 HE1 TYR 29 HE2 TYR 29 12.457 -7.808 9.241 247 HE2 TYR 29 HE1 TYR 29 10.782 -10.373 12.290 248 HH TYR 29 HH TYR 29 10.061 -10.343 10.092 249 H GLN 30 H GLN 30 15.235 -4.055 14.365 250 HA GLN 30 HA GLN 30 16.654 -4.906 16.672 251 HB2 GLN 30 2HB GLN 30 17.362 -3.267 14.941 252 HB3 GLN 30 3HB GLN 30 16.219 -2.092 15.585 253 HG2 GLN 30 2HG GLN 30 17.453 -2.071 17.725 254 HG3 GLN 30 3HG GLN 30 18.539 -3.343 17.119 255 HE21 GLN 30 2HE2 GLN 30 19.422 -2.758 14.761 256 HE22 GLN 30 1HE2 GLN 30 20.053 -1.136 14.601 257 H HIS 31 H HIS 31 13.618 -3.107 16.285 258 HA HIS 31 HA HIS 31 13.446 -2.544 19.166 259 HB2 HIS 31 2HB HIS 31 12.621 -0.940 17.487 260 HB3 HIS 31 3HB HIS 31 11.479 -2.152 16.885 261 HD2 HIS 31 HD2 HIS 31 12.218 -0.215 20.204 262 HE1 HIS 31 HE1 HIS 31 8.054 -1.074 20.102 263 HE2 HIS 31 HE2 HIS 31 9.907 0.088 21.402 264 H LYS 32 H LYS 32 12.210 -4.950 16.840 265 HA LYS 32 HA LYS 32 10.152 -5.902 18.677 266 HB2 LYS 32 2HB LYS 32 11.233 -7.057 16.079 267 HB3 LYS 32 3HB LYS 32 9.762 -7.584 16.929 268 HG2 LYS 32 2HG LYS 32 8.770 -5.345 16.643 269 HG3 LYS 32 3HG LYS 32 10.229 -4.801 15.781 270 HD2 LYS 32 2HD LYS 32 9.853 -6.538 14.052 271 HD3 LYS 32 3HD LYS 32 8.393 -7.072 14.913 272 HE2 LYS 32 2HE LYS 32 7.408 -4.818 14.643 273 HE3 LYS 32 3HE LYS 32 8.864 -4.275 13.793 274 HZ1 LYS 32 3HZ LYS 32 7.120 -4.897 12.275 275 HZ2 LYS 32 1HZ LYS 32 8.408 -5.910 12.099 276 HZ3 LYS 32 2HZ LYS 32 7.056 -6.416 12.888 277 H VAL 33 H VAL 33 13.420 -6.929 17.698 278 HA VAL 33 HA VAL 33 13.356 -9.478 19.030 279 HB VAL 33 HB VAL 33 15.653 -7.643 18.178 280 HG11 VAL 33 1HG1 VAL 33 15.548 -10.610 18.712 281 HG12 VAL 33 2HG1 VAL 33 16.962 -9.693 18.116 282 HG13 VAL 33 3HG1 VAL 33 16.358 -9.428 19.789 283 HG21 VAL 33 3HG2 VAL 33 14.093 -8.561 16.344 284 HG22 VAL 33 1HG2 VAL 33 15.835 -9.006 16.244 285 HG23 VAL 33 2HG2 VAL 33 14.642 -10.179 16.839 286 H ALA 34 H ALA 34 14.398 -6.156 19.867 287 HA ALA 34 HA ALA 34 15.559 -6.801 22.381 288 HB1 ALA 34 1HB ALA 34 14.225 -4.230 21.432 289 HB2 ALA 34 2HB ALA 34 15.326 -4.380 22.818 290 HB3 ALA 34 3HB ALA 34 15.931 -4.672 21.171 291 H SER 35 H SER 35 12.192 -6.540 21.354 292 HA SER 35 HA SER 35 11.129 -6.010 23.987 293 HB2 SER 35 2HB SER 35 9.972 -5.473 21.852 294 HB3 SER 35 3HB SER 35 9.795 -7.218 21.541 295 HG SER 35 HG SER 35 7.952 -6.283 22.577 296 H LEU 36 H LEU 36 11.530 -8.978 21.968 297 HA LEU 36 HA LEU 36 10.356 -10.585 24.106 298 HB2 LEU 36 2HB LEU 36 10.559 -12.442 22.618 299 HB3 LEU 36 3HB LEU 36 9.942 -11.047 21.726 300 HG LEU 36 HG LEU 36 12.491 -10.709 21.065 301 HD11 LEU 36 1HD1 LEU 36 13.640 -12.898 20.781 302 HD12 LEU 36 2HD1 LEU 36 13.427 -12.537 22.496 303 HD13 LEU 36 3HD1 LEU 36 12.345 -13.701 21.691 304 HD21 LEU 36 3HD2 LEU 36 10.739 -12.947 19.968 305 HD22 LEU 36 1HD2 LEU 36 10.666 -11.225 19.508 306 HD23 LEU 36 2HD2 LEU 36 12.110 -12.192 19.126 307 H VAL 37 H VAL 37 13.614 -9.652 23.088 308 HA VAL 37 HA VAL 37 14.764 -11.844 24.637 309 HB VAL 37 HB VAL 37 15.639 -10.890 22.428 310 HG11 VAL 37 1HG1 VAL 37 17.117 -9.077 22.459 311 HG12 VAL 37 2HG1 VAL 37 15.698 -8.498 23.382 312 HG13 VAL 37 3HG1 VAL 37 17.181 -9.027 24.229 313 HG21 VAL 37 3HG2 VAL 37 17.580 -11.256 24.744 314 HG22 VAL 37 1HG2 VAL 37 16.790 -12.575 23.843 315 HG23 VAL 37 2HG2 VAL 37 17.927 -11.482 23.019 316 H SER 38 H SER 38 13.740 -8.583 25.284 317 HA SER 38 HA SER 38 15.420 -8.145 27.581 318 HB2 SER 38 2HB SER 38 14.150 -6.349 26.404 319 HB3 SER 38 3HB SER 38 12.634 -7.070 26.970 320 HG SER 38 HG SER 38 13.408 -6.753 29.113 321 H ARG 39 H ARG 39 12.986 -10.416 26.915 322 HA ARG 39 HA ARG 39 12.071 -10.697 29.691 323 HB2 ARG 39 2HB ARG 39 11.499 -12.414 27.259 324 HB3 ARG 39 3HB ARG 39 10.621 -12.420 28.799 325 HG2 ARG 39 2HG ARG 39 9.902 -10.079 28.407 326 HG3 ARG 39 3HG ARG 39 10.802 -10.056 26.876 327 HD2 ARG 39 2HD ARG 39 9.407 -11.984 26.082 328 HD3 ARG 39 3HD ARG 39 8.441 -11.844 27.560 329 HE ARG 39 HE ARG 39 8.640 -9.308 26.187 330 HH11 ARG 39 1HH1 ARG 39 6.971 -12.422 26.088 331 HH12 ARG 39 2HH1 ARG 39 5.586 -11.787 25.235 332 HH21 ARG 39 1HH2 ARG 39 6.819 -8.504 25.074 333 HH22 ARG 39 2HH2 ARG 39 5.488 -9.568 24.684 334 H TYR 40 H TYR 40 14.833 -11.591 27.992 335 HA TYR 40 HA TYR 40 15.202 -14.007 29.699 336 HB2 TYR 40 2HB TYR 40 16.202 -13.504 26.882 337 HB3 TYR 40 3HB TYR 40 16.651 -14.881 27.891 338 HD1 TYR 40 HD2 TYR 40 14.795 -16.452 28.714 339 HD2 TYR 40 HD1 TYR 40 14.238 -13.578 25.562 340 HE1 TYR 40 HE2 TYR 40 12.784 -17.692 27.937 341 HE2 TYR 40 HE1 TYR 40 12.242 -14.815 24.772 342 HH TYR 40 HH TYR 40 10.863 -16.627 25.116 343 H VAL 41 H VAL 41 16.397 -10.871 28.819 344 HA VAL 41 HA VAL 41 18.589 -11.241 30.760 345 HB VAL 41 HB VAL 41 20.076 -9.816 29.254 346 HG11 VAL 41 1HG1 VAL 41 20.944 -11.745 28.028 347 HG12 VAL 41 2HG1 VAL 41 20.470 -12.217 29.674 348 HG13 VAL 41 3HG1 VAL 41 19.424 -12.627 28.296 349 HG21 VAL 41 3HG2 VAL 41 18.308 -9.147 27.621 350 HG22 VAL 41 1HG2 VAL 41 19.733 -9.889 26.863 351 HG23 VAL 41 2HG2 VAL 41 18.242 -10.836 27.058 352 HA PRO 42 HA PRO 42 17.082 -7.391 32.207 353 HB2 PRO 42 2HB PRO 42 19.271 -6.221 33.331 354 HB3 PRO 42 3HB PRO 42 18.531 -7.714 33.997 355 HG2 PRO 42 2HG PRO 42 20.881 -7.517 32.082 356 HG3 PRO 42 3HG PRO 42 20.805 -8.407 33.645 357 HD2 PRO 42 2HD PRO 42 20.351 -9.681 31.310 358 HD3 PRO 42 3HD PRO 42 19.318 -10.025 32.732 359 H SER 43 H SER 43 17.334 -4.981 32.005 360 HA SER 43 HA SER 43 17.525 -4.337 29.243 361 HB2 SER 43 2HB SER 43 17.037 -2.039 30.023 362 HB3 SER 43 3HB SER 43 15.965 -3.254 30.759 363 HG SER 43 HG SER 43 16.818 -1.768 32.297 364 H GLY 44 H GLY 44 20.042 -4.574 31.571 365 HA2 GLY 44 2HA GLY 44 21.728 -2.516 30.314 366 HA3 GLY 44 3HA GLY 44 22.149 -3.585 31.665 367 H ASP 45 H ASP 45 21.033 -5.911 29.883 368 HA ASP 45 HA ASP 45 23.496 -6.212 28.220 369 HB2 ASP 45 2HB ASP 45 21.898 -8.265 29.778 370 HB3 ASP 45 3HB ASP 45 23.213 -8.642 28.655 371 H VAL 46 H VAL 46 20.174 -5.724 28.045 372 HA VAL 46 HA VAL 46 19.501 -7.667 26.066 373 HB VAL 46 HB VAL 46 17.923 -6.476 27.604 374 HG11 VAL 46 1HG1 VAL 46 18.135 -4.218 25.566 375 HG12 VAL 46 2HG1 VAL 46 16.939 -4.365 26.867 376 HG13 VAL 46 3HG1 VAL 46 18.655 -4.146 27.274 377 HG21 VAL 46 3HG2 VAL 46 17.091 -7.808 25.799 378 HG22 VAL 46 1HG2 VAL 46 16.117 -6.329 25.903 379 HG23 VAL 46 2HG2 VAL 46 17.336 -6.480 24.623 380 HA PRO 47 HA PRO 47 20.218 -4.340 22.791 381 HB2 PRO 47 2HB PRO 47 22.136 -2.455 23.029 382 HB3 PRO 47 3HB PRO 47 20.527 -2.252 23.799 383 HG2 PRO 47 2HG PRO 47 23.086 -3.275 25.069 384 HG3 PRO 47 3HG PRO 47 21.996 -1.990 25.685 385 HD2 PRO 47 2HD PRO 47 21.849 -4.582 26.525 386 HD3 PRO 47 3HD PRO 47 20.390 -3.554 26.373 387 H ASP 48 H ASP 48 22.893 -5.706 24.665 388 HA ASP 48 HA ASP 48 24.686 -5.844 22.373 389 HB2 ASP 48 2HB ASP 48 25.430 -5.564 24.743 390 HB3 ASP 48 3HB ASP 48 24.830 -7.190 25.097 391 H VAL 49 H VAL 49 22.265 -7.890 23.953 392 HA VAL 49 HA VAL 49 23.113 -10.305 22.555 393 HB VAL 49 HB VAL 49 20.680 -9.599 24.234 394 HG11 VAL 49 1HG1 VAL 49 20.263 -12.038 24.285 395 HG12 VAL 49 2HG1 VAL 49 20.083 -11.395 22.642 396 HG13 VAL 49 3HG1 VAL 49 21.561 -12.283 23.091 397 HG21 VAL 49 3HG2 VAL 49 21.790 -11.050 25.893 398 HG22 VAL 49 1HG2 VAL 49 23.124 -11.351 24.759 399 HG23 VAL 49 2HG2 VAL 49 22.875 -9.726 25.428 400 H VAL 50 H VAL 50 20.832 -7.633 21.952 401 HA VAL 50 HA VAL 50 19.543 -8.919 19.685 402 HB VAL 50 HB VAL 50 19.930 -6.012 20.493 403 HG11 VAL 50 1HG1 VAL 50 18.299 -7.179 18.189 404 HG12 VAL 50 2HG1 VAL 50 18.212 -5.502 18.768 405 HG13 VAL 50 3HG1 VAL 50 19.713 -6.109 18.042 406 HG21 VAL 50 3HG2 VAL 50 17.479 -7.824 20.408 407 HG22 VAL 50 1HG2 VAL 50 18.406 -7.438 21.879 408 HG23 VAL 50 2HG2 VAL 50 17.537 -6.151 21.009 409 H GLN 51 H GLN 51 22.532 -7.000 20.182 410 HA GLN 51 HA GLN 51 23.077 -6.767 17.357 411 HB2 GLN 51 2HB GLN 51 23.999 -5.223 19.049 412 HB3 GLN 51 3HB GLN 51 24.941 -6.561 19.758 413 HG2 GLN 51 2HG GLN 51 26.176 -6.841 17.658 414 HG3 GLN 51 3HG GLN 51 25.186 -5.595 16.878 415 HE21 GLN 51 2HE2 GLN 51 27.726 -5.052 16.614 416 HE22 GLN 51 1HE2 GLN 51 28.284 -3.851 17.759 417 H GLU 52 H GLU 52 24.143 -9.081 19.946 418 HA GLU 52 HA GLU 52 25.858 -10.518 18.146 419 HB2 GLU 52 2HB GLU 52 26.028 -10.619 20.622 420 HB3 GLU 52 3HB GLU 52 24.476 -11.491 20.684 421 HG2 GLU 52 2HG GLU 52 25.425 -13.314 19.332 422 HG3 GLU 52 3HG GLU 52 26.943 -12.426 19.165 423 H ALA 53 H ALA 53 22.367 -10.605 18.815 424 HA ALA 53 HA ALA 53 21.924 -13.151 17.546 425 HB1 ALA 53 1HB ALA 53 19.556 -12.429 17.526 426 HB2 ALA 53 2HB ALA 53 20.311 -12.147 19.112 427 HB3 ALA 53 3HB ALA 53 20.056 -10.788 17.998 428 H PHE 54 H PHE 54 22.055 -9.750 16.376 429 HA PHE 54 HA PHE 54 21.242 -10.488 13.684 430 HB2 PHE 54 2HB PHE 54 22.615 -8.020 14.816 431 HB3 PHE 54 3HB PHE 54 22.046 -8.178 13.158 432 HD1 PHE 54 HD2 PHE 54 19.418 -9.745 13.948 433 HD2 PHE 54 HD1 PHE 54 21.254 -6.101 15.345 434 HE1 PHE 54 HE2 PHE 54 17.218 -8.889 14.620 435 HE2 PHE 54 HE1 PHE 54 19.017 -5.224 15.950 436 HZ PHE 54 HZ PHE 54 17.001 -6.621 15.601 437 H ILE 55 H ILE 55 24.394 -10.179 15.353 438 HA ILE 55 HA ILE 55 25.918 -10.394 12.892 439 HB ILE 55 HB ILE 55 26.632 -10.935 15.801 440 HG12 ILE 55 2HG1 ILE 55 27.296 -8.552 14.012 441 HG13 ILE 55 3HG1 ILE 55 25.966 -8.568 15.157 442 HG21 ILE 55 1HG2 ILE 55 28.436 -10.660 13.358 443 HG22 ILE 55 2HG2 ILE 55 28.994 -10.803 15.043 444 HG23 ILE 55 3HG2 ILE 55 28.146 -12.153 14.283 445 HD11 ILE 55 3HD1 ILE 55 28.927 -8.880 15.841 446 HD12 ILE 55 1HD1 ILE 55 27.900 -7.469 16.157 447 HD13 ILE 55 2HD1 ILE 55 27.601 -8.998 17.017 448 H LYS 56 H LYS 56 24.606 -12.677 15.296 449 HA LYS 56 HA LYS 56 25.858 -15.012 14.101 450 HB2 LYS 56 2HB LYS 56 25.285 -14.770 16.493 451 HB3 LYS 56 3HB LYS 56 23.566 -14.665 16.074 452 HG2 LYS 56 2HG LYS 56 23.676 -16.956 15.106 453 HG3 LYS 56 3HG LYS 56 25.385 -17.060 15.590 454 HD2 LYS 56 2HD LYS 56 23.012 -16.622 17.456 455 HD3 LYS 56 3HD LYS 56 23.885 -18.155 17.243 456 HE2 LYS 56 2HE LYS 56 25.961 -17.093 18.058 457 HE3 LYS 56 3HE LYS 56 25.108 -15.549 18.243 458 HZ1 LYS 56 3HZ LYS 56 25.241 -16.713 20.316 459 HZ2 LYS 56 1HZ LYS 56 23.668 -16.605 19.834 460 HZ3 LYS 56 2HZ LYS 56 24.479 -18.031 19.695 461 H ALA 57 H ALA 57 22.743 -13.288 13.793 462 HA ALA 57 HA ALA 57 21.403 -15.384 12.378 463 HB1 ALA 57 1HB ALA 57 19.882 -13.556 11.643 464 HB2 ALA 57 2HB ALA 57 20.152 -13.557 13.399 465 HB3 ALA 57 3HB ALA 57 20.984 -12.365 12.362 466 H TYR 58 H TYR 58 23.380 -12.549 11.265 467 HA TYR 58 HA TYR 58 22.810 -12.933 8.521 468 HB2 TYR 58 2HB TYR 58 23.854 -10.919 9.580 469 HB3 TYR 58 3HB TYR 58 25.332 -11.846 9.835 470 HD1 TYR 58 HD2 TYR 58 22.961 -10.900 7.066 471 HD2 TYR 58 HD1 TYR 58 27.008 -11.771 8.235 472 HE1 TYR 58 HE2 TYR 58 23.743 -10.260 4.808 473 HE2 TYR 58 HE1 TYR 58 27.800 -11.181 5.965 474 HH TYR 58 HH TYR 58 27.198 -10.450 3.864 475 H ARG 59 H ARG 59 25.280 -14.386 10.642 476 HA ARG 59 HA ARG 59 26.740 -15.699 8.523 477 HB2 ARG 59 2HB ARG 59 26.589 -16.174 11.524 478 HB3 ARG 59 3HB ARG 59 27.741 -16.967 10.420 479 HG2 ARG 59 2HG ARG 59 28.744 -14.828 9.848 480 HG3 ARG 59 3HG ARG 59 27.471 -13.948 10.717 481 HD2 ARG 59 2HD ARG 59 29.389 -14.018 12.147 482 HD3 ARG 59 3HD ARG 59 28.166 -15.111 12.821 483 HE ARG 59 HE ARG 59 29.891 -16.592 11.091 484 HH11 ARG 59 1HH1 ARG 59 29.932 -14.967 14.226 485 HH12 ARG 59 2HH1 ARG 59 31.162 -16.019 14.890 486 HH21 ARG 59 1HH2 ARG 59 31.496 -17.953 11.977 487 HH22 ARG 59 2HH2 ARG 59 32.050 -17.701 13.614 488 H ALA 60 H ALA 60 23.772 -16.422 10.231 489 HA ALA 60 HA ALA 60 23.819 -19.229 9.256 490 HB1 ALA 60 1HB ALA 60 21.960 -17.791 11.185 491 HB2 ALA 60 2HB ALA 60 21.916 -19.523 10.785 492 HB3 ALA 60 3HB ALA 60 23.322 -18.835 11.635 493 H LEU 61 H LEU 61 22.699 -16.126 8.360 494 HA LEU 61 HA LEU 61 20.159 -16.882 7.224 495 HB2 LEU 61 2HB LEU 61 20.886 -14.588 8.081 496 HB3 LEU 61 3HB LEU 61 21.900 -14.454 6.635 497 HG LEU 61 HG LEU 61 19.802 -14.786 5.249 498 HD11 LEU 61 1HD1 LEU 61 18.368 -15.894 6.903 499 HD12 LEU 61 2HD1 LEU 61 18.542 -14.504 8.007 500 HD13 LEU 61 3HD1 LEU 61 17.644 -14.321 6.483 501 HD21 LEU 61 3HD2 LEU 61 19.833 -12.488 7.246 502 HD22 LEU 61 1HD2 LEU 61 20.772 -12.576 5.734 503 HD23 LEU 61 2HD2 LEU 61 18.990 -12.496 5.678 504 H ASP 62 H ASP 62 23.512 -16.837 6.148 505 HA ASP 62 HA ASP 62 22.990 -16.980 3.328 506 HB2 ASP 62 2HB ASP 62 25.148 -16.324 4.374 507 HB3 ASP 62 3HB ASP 62 25.343 -17.967 4.987 508 H SER 63 H SER 63 22.449 -19.178 5.903 509 HA SER 63 HA SER 63 22.371 -21.499 4.042 510 HB2 SER 63 2HB SER 63 22.671 -21.407 7.067 511 HB3 SER 63 3HB SER 63 22.589 -22.875 6.074 512 HG SER 63 HG SER 63 24.747 -22.235 6.529 513 H PHE 64 H PHE 64 20.341 -19.188 5.332 514 HA PHE 64 HA PHE 64 18.235 -20.886 6.318 515 HB2 PHE 64 2HB PHE 64 18.446 -18.559 7.023 516 HB3 PHE 64 3HB PHE 64 18.251 -18.012 5.357 517 HD1 PHE 64 HD1 PHE 64 16.353 -20.512 7.464 518 HD2 PHE 64 HD2 PHE 64 16.233 -16.910 5.115 519 HE1 PHE 64 HE1 PHE 64 13.899 -20.379 7.789 520 HE2 PHE 64 HE2 PHE 64 13.776 -16.784 5.442 521 HZ PHE 64 HZ PHE 64 12.611 -18.519 6.782 522 H ARG 65 H ARG 65 16.997 -22.151 5.189 523 HA ARG 65 HA ARG 65 16.009 -21.410 2.511 524 HB2 ARG 65 2HB ARG 65 17.419 -24.050 3.129 525 HB3 ARG 65 3HB ARG 65 16.561 -23.661 1.632 526 HG2 ARG 65 2HG ARG 65 18.138 -21.808 1.191 527 HG3 ARG 65 3HG ARG 65 19.026 -22.209 2.683 528 HD2 ARG 65 2HD ARG 65 19.468 -24.475 1.812 529 HD3 ARG 65 3HD ARG 65 18.618 -24.063 0.306 530 HE ARG 65 HE ARG 65 20.601 -22.102 0.676 531 HH11 ARG 65 1HH1 ARG 65 20.443 -25.594 0.173 532 HH12 ARG 65 2HH1 ARG 65 21.995 -25.671 -0.631 533 HH21 ARG 65 1HH2 ARG 65 22.622 -22.225 -0.381 534 HH22 ARG 65 2HH2 ARG 65 23.221 -23.767 -0.944 535 H GLY 66 H GLY 66 14.953 -21.592 5.287 536 HA2 GLY 66 2HA GLY 66 13.561 -24.051 5.698 537 HA3 GLY 66 3HA GLY 66 13.295 -22.515 6.544 538 H ASP 67 H ASP 67 12.882 -21.631 3.404 539 HA ASP 67 HA ASP 67 11.043 -20.986 2.268 540 HB2 ASP 67 2HB ASP 67 11.305 -23.374 1.604 541 HB3 ASP 67 3HB ASP 67 10.111 -23.822 2.833 542 H SER 68 H SER 68 11.035 -20.438 5.112 543 HA SER 68 HA SER 68 8.099 -20.163 5.589 544 HB2 SER 68 2HB SER 68 10.274 -20.817 7.621 545 HB3 SER 68 3HB SER 68 8.568 -20.492 7.996 546 HG SER 68 HG SER 68 9.577 -22.607 6.393 547 H ALA 69 H ALA 69 7.827 -18.456 7.487 548 HA ALA 69 HA ALA 69 8.772 -16.000 6.402 549 HB1 ALA 69 1HB ALA 69 7.501 -16.590 9.103 550 HB2 ALA 69 2HB ALA 69 7.634 -14.992 8.323 551 HB3 ALA 69 3HB ALA 69 6.624 -16.255 7.589 552 H PHE 70 H PHE 70 10.164 -14.434 7.246 553 HA PHE 70 HA PHE 70 12.609 -15.547 8.320 554 HB2 PHE 70 2HB PHE 70 12.687 -13.855 6.606 555 HB3 PHE 70 3HB PHE 70 11.662 -12.775 7.557 556 HD1 PHE 70 HD2 PHE 70 14.936 -14.605 7.917 557 HD2 PHE 70 HD1 PHE 70 12.665 -11.035 8.690 558 HE1 PHE 70 HE2 PHE 70 16.934 -13.539 8.926 559 HE2 PHE 70 HE1 PHE 70 14.660 -9.975 9.695 560 HZ PHE 70 HZ PHE 70 16.816 -11.219 9.783 561 H TYR 71 H TYR 71 9.878 -13.715 9.719 562 HA TYR 71 HA TYR 71 11.408 -12.680 11.903 563 HB2 TYR 71 2HB TYR 71 9.302 -12.042 12.865 564 HB3 TYR 71 3HB TYR 71 9.297 -11.699 11.138 565 HD1 TYR 71 HD2 TYR 71 7.995 -13.959 13.778 566 HD2 TYR 71 HD1 TYR 71 7.695 -12.724 9.671 567 HE1 TYR 71 HE2 TYR 71 5.855 -15.208 13.564 568 HE2 TYR 71 HE1 TYR 71 5.556 -13.953 9.451 569 HH TYR 71 HH TYR 71 3.995 -15.261 10.504 570 H THR 72 H THR 72 9.530 -15.727 11.530 571 HA THR 72 HA THR 72 9.765 -16.388 14.337 572 HB THR 72 HB THR 72 9.302 -18.188 11.922 573 HG1 THR 72 1HG THR 72 7.711 -16.570 12.254 574 HG21 THR 72 1HG2 THR 72 10.045 -19.461 13.909 575 HG22 THR 72 2HG2 THR 72 8.834 -18.628 14.908 576 HG23 THR 72 3HG2 THR 72 8.316 -19.726 13.609 577 H TRP 73 H TRP 73 11.719 -17.009 11.409 578 HA TRP 73 HA TRP 73 13.494 -18.889 12.671 579 HB2 TRP 73 2HB TRP 73 13.179 -18.794 10.269 580 HB3 TRP 73 3HB TRP 73 13.699 -17.110 10.223 581 HD1 TRP 73 HD1 TRP 73 15.045 -20.636 10.319 582 HE1 TRP 73 HE1 TRP 73 17.575 -20.633 9.962 583 HE3 TRP 73 HE3 TRP 73 15.896 -15.597 10.659 584 HZ2 TRP 73 HZ2 TRP 73 19.713 -18.700 9.914 585 HZ3 TRP 73 HZ3 TRP 73 18.199 -14.720 10.485 586 HH2 TRP 73 HH2 TRP 73 20.102 -16.250 10.107 587 H LEU 74 H LEU 74 13.446 -15.330 12.381 588 HA LEU 74 HA LEU 74 16.172 -15.013 13.309 589 HB2 LEU 74 2HB LEU 74 15.047 -13.388 11.831 590 HB3 LEU 74 3HB LEU 74 13.835 -13.082 13.074 591 HG LEU 74 HG LEU 74 15.628 -12.256 14.613 592 HD11 LEU 74 1HD1 LEU 74 17.393 -12.570 12.138 593 HD12 LEU 74 2HD1 LEU 74 17.862 -11.728 13.634 594 HD13 LEU 74 3HD1 LEU 74 17.562 -13.473 13.663 595 HD21 LEU 74 3HD2 LEU 74 14.334 -10.714 13.216 596 HD22 LEU 74 1HD2 LEU 74 15.996 -10.132 13.445 597 HD23 LEU 74 2HD2 LEU 74 15.524 -10.886 11.904 598 H TYR 75 H TYR 75 12.920 -14.962 14.829 599 HA TYR 75 HA TYR 75 13.902 -13.906 17.324 600 HB2 TYR 75 2HB TYR 75 11.355 -15.393 16.603 601 HB3 TYR 75 3HB TYR 75 11.665 -14.655 18.175 602 HD1 TYR 75 HD1 TYR 75 13.177 -12.155 16.973 603 HD2 TYR 75 HD2 TYR 75 9.395 -14.040 16.130 604 HE1 TYR 75 HE1 TYR 75 12.301 -10.006 16.209 605 HE2 TYR 75 HE2 TYR 75 8.505 -11.867 15.319 606 HH TYR 75 HH TYR 75 10.497 -8.895 15.274 607 H ARG 76 H ARG 76 13.976 -17.126 15.957 608 HA ARG 76 HA ARG 76 14.460 -18.391 18.541 609 HB2 ARG 76 2HB ARG 76 15.064 -19.288 15.694 610 HB3 ARG 76 3HB ARG 76 15.210 -20.303 17.137 611 HG2 ARG 76 2HG ARG 76 12.623 -19.021 16.187 612 HG3 ARG 76 3HG ARG 76 13.128 -20.678 15.840 613 HD2 ARG 76 2HD ARG 76 11.656 -20.888 17.660 614 HD3 ARG 76 3HD ARG 76 13.262 -21.036 18.374 615 HE ARG 76 HE ARG 76 12.888 -19.078 19.564 616 HH11 ARG 76 1HH1 ARG 76 10.483 -19.330 16.988 617 HH12 ARG 76 2HH1 ARG 76 9.543 -17.974 17.568 618 HH21 ARG 76 1HH2 ARG 76 11.667 -17.287 20.277 619 HH22 ARG 76 2HH2 ARG 76 10.217 -16.821 19.422 620 H ILE 77 H ILE 77 16.380 -16.578 16.212 621 HA ILE 77 HA ILE 77 18.930 -17.532 17.229 622 HB ILE 77 HB ILE 77 18.377 -14.880 15.855 623 HG12 ILE 77 2HG1 ILE 77 17.430 -16.595 14.412 624 HG13 ILE 77 3HG1 ILE 77 18.903 -15.925 13.719 625 HG21 ILE 77 1HG2 ILE 77 20.730 -15.161 15.101 626 HG22 ILE 77 2HG2 ILE 77 20.581 -15.062 16.863 627 HG23 ILE 77 3HG2 ILE 77 20.848 -16.636 16.095 628 HD11 ILE 77 3HD1 ILE 77 18.707 -18.594 15.168 629 HD12 ILE 77 1HD1 ILE 77 18.800 -18.350 13.411 630 HD13 ILE 77 2HD1 ILE 77 20.183 -17.908 14.423 631 H ALA 78 H ALA 78 16.648 -14.921 18.052 632 HA ALA 78 HA ALA 78 18.543 -13.466 19.645 633 HB1 ALA 78 1HB ALA 78 16.647 -12.427 18.509 634 HB2 ALA 78 2HB ALA 78 15.511 -13.331 19.533 635 HB3 ALA 78 3HB ALA 78 16.579 -12.112 20.258 636 H VAL 79 H VAL 79 15.963 -15.870 20.405 637 HA VAL 79 HA VAL 79 16.358 -15.478 23.270 638 HB VAL 79 HB VAL 79 14.155 -16.010 22.361 639 HG11 VAL 79 1HG1 VAL 79 15.317 -18.751 21.706 640 HG12 VAL 79 2HG1 VAL 79 13.625 -18.242 21.528 641 HG13 VAL 79 3HG1 VAL 79 14.887 -17.514 20.506 642 HG21 VAL 79 3HG2 VAL 79 15.225 -18.294 24.071 643 HG22 VAL 79 1HG2 VAL 79 14.809 -16.682 24.688 644 HG23 VAL 79 2HG2 VAL 79 13.548 -17.723 23.977 645 H ASN 80 H ASN 80 17.619 -17.705 20.798 646 HA ASN 80 HA ASN 80 18.723 -19.532 22.776 647 HB2 ASN 80 2HB ASN 80 19.241 -19.124 19.807 648 HB3 ASN 80 3HB ASN 80 20.032 -20.364 20.782 649 HD21 ASN 80 2HD2 ASN 80 18.732 -21.355 18.716 650 HD22 ASN 80 1HD2 ASN 80 17.202 -22.074 19.179 651 H THR 81 H THR 81 19.711 -16.469 21.359 652 HA THR 81 HA THR 81 22.511 -16.830 22.147 653 HB THR 81 HB THR 81 20.985 -14.404 21.113 654 HG1 THR 81 1HG THR 81 21.152 -15.924 19.555 655 HG21 THR 81 1HG2 THR 81 23.254 -13.526 20.614 656 HG22 THR 81 2HG2 THR 81 22.996 -13.709 22.361 657 HG23 THR 81 3HG2 THR 81 23.970 -14.909 21.484 658 H ALA 82 H ALA 82 19.539 -15.467 23.536 659 HA ALA 82 HA ALA 82 20.930 -13.965 25.585 660 HB1 ALA 82 1HB ALA 82 18.048 -14.947 25.416 661 HB2 ALA 82 2HB ALA 82 18.670 -13.704 26.526 662 HB3 ALA 82 3HB ALA 82 18.657 -13.406 24.772 663 H LYS 83 H LYS 83 19.618 -17.272 25.303 664 HA LYS 83 HA LYS 83 20.069 -17.862 28.126 665 HB2 LYS 83 2HB LYS 83 19.480 -19.575 25.686 666 HB3 LYS 83 3HB LYS 83 19.638 -20.219 27.336 667 HG2 LYS 83 2HG LYS 83 17.808 -18.801 28.121 668 HG3 LYS 83 3HG LYS 83 17.644 -18.062 26.516 669 HD2 LYS 83 2HD LYS 83 17.062 -20.231 25.536 670 HD3 LYS 83 3HD LYS 83 17.266 -21.032 27.107 671 HE2 LYS 83 2HE LYS 83 15.266 -18.806 26.535 672 HE3 LYS 83 3HE LYS 83 14.883 -20.535 26.522 673 HZ1 LYS 83 3HZ LYS 83 15.555 -20.642 28.824 674 HZ2 LYS 83 1HZ LYS 83 15.882 -19.031 28.850 675 HZ3 LYS 83 2HZ LYS 83 14.341 -19.550 28.627 676 H ASN 84 H ASN 84 21.916 -18.073 25.099 677 HA ASN 84 HA ASN 84 24.073 -19.627 26.268 678 HB2 ASN 84 2HB ASN 84 23.561 -19.615 23.849 679 HB3 ASN 84 3HB ASN 84 23.929 -17.887 23.777 680 HD21 ASN 84 2HD2 ASN 84 26.091 -17.199 23.717 681 HD22 ASN 84 1HD2 ASN 84 27.437 -18.315 23.636 682 H TYR 85 H TYR 85 23.136 -16.235 26.182 683 HA TYR 85 HA TYR 85 25.776 -15.179 26.729 684 HB2 TYR 85 2HB TYR 85 23.931 -13.943 25.604 685 HB3 TYR 85 3HB TYR 85 23.007 -13.983 27.112 686 HD1 TYR 85 HD2 TYR 85 25.959 -12.591 25.383 687 HD2 TYR 85 HD1 TYR 85 23.535 -12.473 28.928 688 HE1 TYR 85 HE2 TYR 85 27.056 -10.463 26.049 689 HE2 TYR 85 HE1 TYR 85 24.625 -10.347 29.609 690 HH TYR 85 HH TYR 85 26.146 -8.722 29.040 691 H LEU 86 H LEU 86 22.952 -16.171 28.711 692 HA LEU 86 HA LEU 86 24.130 -15.070 31.135 693 HB2 LEU 86 2HB LEU 86 21.775 -16.929 30.635 694 HB3 LEU 86 3HB LEU 86 22.267 -16.359 32.236 695 HG LEU 86 HG LEU 86 21.354 -14.588 29.940 696 HD11 LEU 86 1HD1 LEU 86 19.557 -15.862 31.046 697 HD12 LEU 86 2HD1 LEU 86 20.152 -15.344 32.641 698 HD13 LEU 86 3HD1 LEU 86 19.475 -14.145 31.517 699 HD21 LEU 86 3HD2 LEU 86 22.267 -13.911 32.771 700 HD22 LEU 86 1HD2 LEU 86 23.036 -13.386 31.250 701 HD23 LEU 86 2HD2 LEU 86 21.427 -12.783 31.683 702 H VAL 87 H VAL 87 24.485 -18.147 29.439 703 HA VAL 87 HA VAL 87 25.640 -19.326 31.889 704 HB VAL 87 HB VAL 87 25.996 -21.330 30.529 705 HG11 VAL 87 1HG1 VAL 87 23.850 -20.971 31.707 706 HG12 VAL 87 2HG1 VAL 87 23.188 -20.162 30.269 707 HG13 VAL 87 3HG1 VAL 87 23.621 -21.887 30.202 708 HG21 VAL 87 3HG2 VAL 87 25.076 -21.466 28.246 709 HG22 VAL 87 1HG2 VAL 87 24.710 -19.726 28.287 710 HG23 VAL 87 2HG2 VAL 87 26.400 -20.284 28.337 711 H ALA 88 H ALA 88 26.696 -17.540 29.087 712 HA ALA 88 HA ALA 88 29.434 -18.520 29.179 713 HB1 ALA 88 1HB ALA 88 28.210 -16.044 27.893 714 HB2 ALA 88 2HB ALA 88 29.844 -16.673 27.588 715 HB3 ALA 88 3HB ALA 88 28.423 -17.630 27.112 716 H GLN 89 H GLN 89 27.591 -15.917 30.707 717 HA GLN 89 HA GLN 89 30.072 -14.935 32.027 718 HB2 GLN 89 2HB GLN 89 27.307 -13.782 31.583 719 HB3 GLN 89 3HB GLN 89 28.357 -13.178 32.874 720 HG2 GLN 89 2HG GLN 89 28.664 -11.785 30.946 721 HG3 GLN 89 3HG GLN 89 30.144 -12.712 31.231 722 HE21 GLN 89 2HE2 GLN 89 27.135 -12.637 29.237 723 HE22 GLN 89 1HE2 GLN 89 27.849 -13.417 27.845 724 H GLY 90 H GLY 90 27.329 -16.984 32.523 725 HA2 GLY 90 2HA GLY 90 27.296 -16.662 35.433 726 HA3 GLY 90 3HA GLY 90 26.332 -17.789 34.455 727 H ARG 91 H ARG 91 29.106 -18.510 33.115 728 HA ARG 91 HA ARG 91 30.027 -20.316 35.296 729 HB2 ARG 91 2HB ARG 91 29.933 -20.919 32.319 730 HB3 ARG 91 3HB ARG 91 30.514 -21.998 33.601 731 HG2 ARG 91 2HG ARG 91 28.234 -21.874 34.664 732 HG3 ARG 91 3HG ARG 91 27.674 -20.940 33.263 733 HD2 ARG 91 2HD ARG 91 27.091 -23.264 32.919 734 HD3 ARG 91 3HD ARG 91 28.371 -22.826 31.772 735 HE ARG 91 HE ARG 91 29.215 -24.036 34.337 736 HH11 ARG 91 1HH1 ARG 91 28.566 -24.568 30.893 737 HH12 ARG 91 2HH1 ARG 91 29.507 -26.040 30.844 738 HH21 ARG 91 1HH2 ARG 91 30.390 -25.897 34.246 739 HH22 ARG 91 2HH2 ARG 91 30.555 -26.805 32.752 740 H ARG 92 H ARG 92 30.912 -17.561 34.045 741 HA ARG 92 HA ARG 92 33.491 -18.028 32.898 742 HB2 ARG 92 2HB ARG 92 32.060 -15.999 32.586 743 HB3 ARG 92 3HB ARG 92 32.347 -15.557 34.271 744 HG2 ARG 92 2HG ARG 92 33.763 -14.283 32.711 745 HG3 ARG 92 3HG ARG 92 34.745 -15.255 33.815 746 HD2 ARG 92 2HD ARG 92 35.040 -16.968 32.062 747 HD3 ARG 92 3HD ARG 92 33.997 -16.039 30.965 748 HE ARG 92 HE ARG 92 36.088 -14.338 31.825 749 HH11 ARG 92 1HH1 ARG 92 35.642 -17.257 29.886 750 HH12 ARG 92 2HH1 ARG 92 37.027 -16.935 28.866 751 HH21 ARG 92 1HH2 ARG 92 37.893 -13.940 30.480 752 HH22 ARG 92 2HH2 ARG 92 38.301 -15.062 29.207 753 H LEU 93 H LEU 93 32.388 -18.398 36.082 754 HA LEU 93 HA LEU 93 35.156 -18.137 37.145 755 HB2 LEU 93 2HB LEU 93 33.492 -16.502 38.024 756 HB3 LEU 93 3HB LEU 93 32.505 -17.841 38.607 757 HG LEU 93 HG LEU 93 34.281 -18.513 40.175 758 HD11 LEU 93 1HD1 LEU 93 35.819 -16.149 39.006 759 HD12 LEU 93 2HD1 LEU 93 36.282 -17.059 40.462 760 HD13 LEU 93 3HD1 LEU 93 36.283 -17.866 38.886 761 HD21 LEU 93 3HD2 LEU 93 33.724 -15.523 40.257 762 HD22 LEU 93 1HD2 LEU 93 32.643 -16.804 40.861 763 HD23 LEU 93 2HD2 LEU 93 34.222 -16.543 41.629 764 H GLU 94 H GLU 94 32.940 -20.372 36.067 765 HA GLU 94 HA GLU 94 33.527 -22.361 38.194 766 HB2 GLU 94 2HB GLU 94 31.174 -21.922 37.383 767 HB3 GLU 94 3HB GLU 94 31.668 -22.578 35.807 768 HG2 GLU 94 2HG GLU 94 32.357 -24.693 36.982 769 HG3 GLU 94 3HG GLU 94 31.741 -24.011 38.494 770 H LEU 95 H LEU 95 33.967 -21.668 34.768 771 HA LEU 95 HA LEU 95 35.301 -22.386 33.144 772 HB2 LEU 95 2HB LEU 95 37.004 -23.063 35.543 773 HB3 LEU 95 3HB LEU 95 37.552 -23.334 33.886 774 HG LEU 95 HG LEU 95 37.223 -20.947 33.348 775 HD11 LEU 95 1HD1 LEU 95 36.599 -20.688 36.319 776 HD12 LEU 95 2HD1 LEU 95 37.020 -19.329 35.251 777 HD13 LEU 95 3HD1 LEU 95 35.535 -20.241 34.954 778 HD21 LEU 95 3HD2 LEU 95 38.955 -21.504 35.793 779 HD22 LEU 95 1HD2 LEU 95 39.399 -21.837 34.104 780 HD23 LEU 95 2HD2 LEU 95 39.163 -20.161 34.646 781 H VAL 96 H VAL 96 34.289 -24.974 35.320 782 HA VAL 96 HA VAL 96 34.491 -26.859 33.050 783 HB VAL 96 HB VAL 96 35.449 -28.578 34.592 784 HG11 VAL 96 1HG1 VAL 96 37.236 -26.139 34.238 785 HG12 VAL 96 2HG1 VAL 96 37.765 -27.820 34.448 786 HG13 VAL 96 3HG1 VAL 96 36.888 -27.349 32.980 787 HG21 VAL 96 3HG2 VAL 96 34.864 -27.513 36.751 788 HG22 VAL 96 1HG2 VAL 96 36.595 -27.881 36.642 789 HG23 VAL 96 2HG2 VAL 96 36.031 -26.212 36.418 790 HA PRO 97 HA PRO 97 30.643 -28.303 34.786 791 HB2 PRO 97 2HB PRO 97 30.646 -30.951 34.092 792 HB3 PRO 97 3HB PRO 97 30.426 -29.631 32.894 793 HG2 PRO 97 2HG PRO 97 32.988 -31.095 33.606 794 HG3 PRO 97 3HG PRO 97 32.310 -30.791 31.971 795 HD2 PRO 97 2HD PRO 97 34.226 -29.191 33.014 796 HD3 PRO 97 3HD PRO 97 32.874 -28.486 32.074 797 H ARG 98 H ARG 98 29.870 -29.424 36.639 798 HA ARG 98 HA ARG 98 31.880 -30.824 38.317 799 HB2 ARG 98 2HB ARG 98 30.255 -28.423 39.246 800 HB3 ARG 98 3HB ARG 98 31.352 -29.404 40.239 801 HG2 ARG 98 2HG ARG 98 33.250 -28.742 38.751 802 HG3 ARG 98 3HG ARG 98 32.128 -27.713 37.828 803 HD2 ARG 98 2HD ARG 98 31.617 -26.463 39.931 804 HD3 ARG 98 3HD ARG 98 32.866 -27.419 40.756 805 HE ARG 98 HE ARG 98 33.755 -26.057 38.312 806 HH11 ARG 98 1HH1 ARG 98 33.423 -25.828 41.826 807 HH12 ARG 98 2HH1 ARG 98 34.634 -24.577 41.972 808 HH21 ARG 98 1HH2 ARG 98 35.288 -24.403 38.526 809 HH22 ARG 98 2HH2 ARG 98 35.701 -23.784 40.107 810 H GLY 99 H GLY 99 30.891 -31.871 40.214 811 HA2 GLY 99 2HA GLY 99 28.115 -32.122 40.651 812 HA3 GLY 99 3HA GLY 99 28.598 -33.397 39.523 813 H SER 100 H SER 100 27.658 -34.384 41.764 814 HA SER 100 HA SER 100 30.028 -35.505 43.103 815 HB2 SER 100 2HB SER 100 29.412 -33.528 44.471 816 HB3 SER 100 3HB SER 100 27.765 -34.173 44.644 817 HG SER 100 HG SER 100 29.126 -34.733 46.405 818 H HIS 101 H HIS 101 29.490 -37.409 44.382 819 HA HIS 101 HA HIS 101 26.866 -38.645 43.794 820 HB2 HIS 101 2HB HIS 101 29.560 -39.934 43.234 821 HB3 HIS 101 3HB HIS 101 27.984 -40.726 43.093 822 HD2 HIS 101 HD2 HIS 101 26.324 -39.817 41.083 823 HE1 HIS 101 HE1 HIS 101 29.414 -37.965 38.820 824 HE2 HIS 101 HE2 HIS 101 26.994 -38.763 38.781 825 H HIS 102 H HIS 102 28.544 -37.515 46.166 826 HA HIS 102 HA HIS 102 28.060 -39.812 47.981 827 HB2 HIS 102 2HB HIS 102 30.440 -39.857 47.306 828 HB3 HIS 102 3HB HIS 102 30.623 -38.185 47.846 829 HD2 HIS 102 HD2 HIS 102 29.579 -41.631 49.383 830 HE1 HIS 102 HE1 HIS 102 31.627 -39.430 52.391 831 HE2 HIS 102 HE2 HIS 102 30.506 -41.650 51.833 832 H HIS 103 H HIS 103 28.212 -39.087 50.309 833 HA HIS 103 HA HIS 103 26.521 -36.775 50.662 834 HB2 HIS 103 2HB HIS 103 26.342 -38.898 51.936 835 HB3 HIS 103 3HB HIS 103 27.897 -38.559 52.700 836 HD2 HIS 103 HD2 HIS 103 24.682 -36.349 52.219 837 HE1 HIS 103 HE1 HIS 103 25.764 -36.206 56.328 838 HE2 HIS 103 HE2 HIS 103 24.116 -35.364 54.576 839 H HIS 104 H HIS 104 29.753 -36.928 50.093 840 HA HIS 104 HA HIS 104 31.562 -35.685 50.486 841 HB2 HIS 104 2HB HIS 104 31.292 -33.300 50.255 842 HB3 HIS 104 3HB HIS 104 30.262 -34.186 49.136 843 HD2 HIS 104 HD2 HIS 104 27.666 -33.782 49.247 844 HE1 HIS 104 HE1 HIS 104 27.586 -31.101 52.548 845 HE2 HIS 104 HE2 HIS 104 26.207 -32.143 50.682 846 H HIS 105 H HIS 105 30.276 -36.814 52.942 847 HA HIS 105 HA HIS 105 31.976 -35.335 54.846 848 HB2 HIS 105 2HB HIS 105 29.728 -34.316 55.045 849 HB3 HIS 105 3HB HIS 105 29.029 -35.916 55.328 850 HD2 HIS 105 HD2 HIS 105 28.421 -36.095 57.819 851 HE1 HIS 105 HE1 HIS 105 31.856 -34.288 59.563 852 HE2 HIS 105 HE2 HIS 105 29.642 -35.452 60.048 853 H HIS 106 H HIS 106 32.383 -36.587 56.788 854 HA HIS 106 HA HIS 106 33.306 -38.478 57.656 855 HB2 HIS 106 2HB HIS 106 30.968 -38.470 58.465 856 HB3 HIS 106 3HB HIS 106 30.507 -39.519 57.122 857 HD2 HIS 106 HD2 HIS 106 30.129 -41.885 58.083 858 HE1 HIS 106 HE1 HIS 106 33.446 -42.155 60.732 859 HE2 HIS 106 HE2 HIS 106 31.433 -43.395 59.778 Start of MODEL 16 1 H1 MET 1 H1 MET 1 2.743 5.113 1.358 2 H2 MET 1 H2 MET 1 2.608 6.104 0.056 3 H3 MET 1 H3 MET 1 4.100 5.658 0.612 4 HA MET 1 HA MET 1 2.088 3.878 -0.565 5 HB2 MET 1 2HB MET 1 3.596 3.654 -2.459 6 HB3 MET 1 3HB MET 1 3.144 5.352 -2.229 7 HG2 MET 1 2HG MET 1 5.300 5.760 -1.070 8 HG3 MET 1 3HG MET 1 5.748 4.068 -1.307 9 HE1 MET 1 1HE MET 1 8.212 5.937 -3.681 10 HE2 MET 1 2HE MET 1 7.613 6.482 -2.095 11 HE3 MET 1 3HE MET 1 8.045 4.775 -2.346 12 H SER 2 H SER 2 3.121 1.719 -1.192 13 HA SER 2 HA SER 2 4.227 0.544 1.194 14 HB2 SER 2 2HB SER 2 3.863 -0.593 -1.601 15 HB3 SER 2 3HB SER 2 4.197 -1.533 -0.132 16 HG SER 2 HG SER 2 1.959 -1.438 -0.623 17 H GLU 3 H GLU 3 6.188 -0.811 1.216 18 HA GLU 3 HA GLU 3 8.461 0.720 0.199 19 HB2 GLU 3 2HB GLU 3 8.267 -1.763 1.942 20 HB3 GLU 3 3HB GLU 3 9.767 -0.880 1.592 21 HG2 GLU 3 2HG GLU 3 8.851 1.155 2.619 22 HG3 GLU 3 3HG GLU 3 7.314 0.334 2.935 23 H GLN 4 H GLN 4 6.551 -1.693 -1.077 24 HA GLN 4 HA GLN 4 6.698 -3.162 -2.765 25 HB2 GLN 4 2HB GLN 4 9.000 -1.385 -3.645 26 HB3 GLN 4 3HB GLN 4 8.146 -2.555 -4.666 27 HG2 GLN 4 2HG GLN 4 6.018 -1.325 -4.266 28 HG3 GLN 4 3HG GLN 4 6.890 -0.136 -3.288 29 HE21 GLN 4 2HE2 GLN 4 5.655 1.106 -5.161 30 HE22 GLN 4 1HE2 GLN 4 6.645 1.475 -6.561 31 H LEU 5 H LEU 5 8.804 -3.439 -0.365 32 HA LEU 5 HA LEU 5 9.919 -5.950 -1.486 33 HB2 LEU 5 2HB LEU 5 11.506 -3.840 0.034 34 HB3 LEU 5 3HB LEU 5 12.096 -5.452 -0.377 35 HG LEU 5 HG LEU 5 11.341 -3.290 -2.391 36 HD11 LEU 5 1HD1 LEU 5 14.044 -4.397 -1.508 37 HD12 LEU 5 2HD1 LEU 5 13.775 -3.166 -2.763 38 HD13 LEU 5 3HD1 LEU 5 13.389 -2.803 -1.062 39 HD21 LEU 5 3HD2 LEU 5 11.087 -5.656 -3.258 40 HD22 LEU 5 1HD2 LEU 5 12.376 -4.735 -4.057 41 HD23 LEU 5 2HD2 LEU 5 12.785 -5.938 -2.817 42 H THR 6 H THR 6 10.492 -7.482 0.149 43 HA THR 6 HA THR 6 9.369 -6.990 2.850 44 HB THR 6 HB THR 6 8.615 -9.360 1.091 45 HG1 THR 6 1HG THR 6 6.605 -8.333 0.993 46 HG21 THR 6 1HG2 THR 6 7.763 -8.409 3.849 47 HG22 THR 6 2HG2 THR 6 6.802 -9.561 2.887 48 HG23 THR 6 3HG2 THR 6 8.442 -9.991 3.391 49 H ASP 7 H ASP 7 9.854 -9.074 4.247 50 HA ASP 7 HA ASP 7 12.628 -9.437 4.401 51 HB2 ASP 7 2HB ASP 7 12.098 -11.224 5.989 52 HB3 ASP 7 3HB ASP 7 11.050 -9.818 6.238 53 H GLN 8 H GLN 8 10.383 -10.943 2.220 54 HA GLN 8 HA GLN 8 11.807 -13.373 1.718 55 HB2 GLN 8 2HB GLN 8 9.507 -13.072 0.984 56 HB3 GLN 8 3HB GLN 8 9.956 -11.660 0.016 57 HG2 GLN 8 2HG GLN 8 9.650 -13.595 -1.429 58 HG3 GLN 8 3HG GLN 8 11.342 -13.099 -1.455 59 HE21 GLN 8 2HE2 GLN 8 12.932 -14.409 -0.287 60 HE22 GLN 8 1HE2 GLN 8 12.580 -16.093 0.055 61 H VAL 9 H VAL 9 11.875 -10.164 0.088 62 HA VAL 9 HA VAL 9 14.081 -11.049 -1.630 63 HB VAL 9 HB VAL 9 12.412 -9.800 -2.716 64 HG11 VAL 9 1HG1 VAL 9 12.691 -7.666 -0.569 65 HG12 VAL 9 2HG1 VAL 9 11.649 -7.586 -2.015 66 HG13 VAL 9 3HG1 VAL 9 11.318 -8.786 -0.765 67 HG21 VAL 9 3HG2 VAL 9 14.592 -7.751 -2.143 68 HG22 VAL 9 1HG2 VAL 9 14.777 -9.116 -3.275 69 HG23 VAL 9 2HG2 VAL 9 13.566 -7.853 -3.581 70 H LEU 10 H LEU 10 13.623 -9.146 1.322 71 HA LEU 10 HA LEU 10 16.205 -7.868 1.241 72 HB2 LEU 10 2HB LEU 10 14.010 -8.335 3.220 73 HB3 LEU 10 3HB LEU 10 15.630 -8.024 3.874 74 HG LEU 10 HG LEU 10 15.804 -5.931 2.702 75 HD11 LEU 10 1HD1 LEU 10 13.062 -6.535 1.531 76 HD12 LEU 10 2HD1 LEU 10 13.926 -4.987 1.402 77 HD13 LEU 10 3HD1 LEU 10 14.603 -6.435 0.636 78 HD21 LEU 10 3HD2 LEU 10 13.092 -6.241 4.063 79 HD22 LEU 10 1HD2 LEU 10 14.640 -5.932 4.883 80 HD23 LEU 10 2HD2 LEU 10 13.943 -4.704 3.803 81 H VAL 11 H VAL 11 15.088 -11.113 2.235 82 HA VAL 11 HA VAL 11 17.691 -11.667 3.463 83 HB VAL 11 HB VAL 11 15.222 -13.362 2.979 84 HG11 VAL 11 1HG1 VAL 11 17.906 -14.091 4.231 85 HG12 VAL 11 2HG1 VAL 11 16.408 -15.026 4.450 86 HG13 VAL 11 3HG1 VAL 11 17.122 -14.871 2.834 87 HG21 VAL 11 3HG2 VAL 11 15.177 -11.610 4.796 88 HG22 VAL 11 1HG2 VAL 11 15.089 -13.268 5.428 89 HG23 VAL 11 2HG2 VAL 11 16.619 -12.364 5.509 90 H GLU 12 H GLU 12 16.115 -12.099 0.296 91 HA GLU 12 HA GLU 12 18.142 -13.952 -0.664 92 HB2 GLU 12 2HB GLU 12 16.131 -12.123 -2.032 93 HB3 GLU 12 3HB GLU 12 17.273 -13.146 -2.924 94 HG2 GLU 12 2HG GLU 12 16.375 -15.153 -1.808 95 HG3 GLU 12 3HG GLU 12 15.210 -14.163 -0.926 96 H ARG 13 H ARG 13 17.775 -10.408 -0.539 97 HA ARG 13 HA ARG 13 19.915 -9.892 -2.391 98 HB2 ARG 13 2HB ARG 13 18.067 -8.348 -1.977 99 HB3 ARG 13 3HB ARG 13 18.597 -8.110 -0.302 100 HG2 ARG 13 2HG ARG 13 20.620 -7.054 -0.992 101 HG3 ARG 13 3HG ARG 13 20.407 -7.583 -2.682 102 HD2 ARG 13 2HD ARG 13 18.320 -6.188 -2.777 103 HD3 ARG 13 3HD ARG 13 18.745 -5.525 -1.182 104 HE ARG 13 HE ARG 13 21.005 -5.263 -2.866 105 HH11 ARG 13 1HH1 ARG 13 17.732 -3.950 -2.589 106 HH12 ARG 13 2HH1 ARG 13 18.134 -2.471 -3.427 107 HH21 ARG 13 1HH2 ARG 13 21.488 -3.373 -3.974 108 HH22 ARG 13 2HH2 ARG 13 20.272 -2.125 -4.194 109 H VAL 14 H VAL 14 19.800 -10.235 1.177 110 HA VAL 14 HA VAL 14 22.564 -9.393 1.489 111 HB VAL 14 HB VAL 14 22.337 -10.221 3.771 112 HG11 VAL 14 1HG1 VAL 14 19.960 -8.650 2.700 113 HG12 VAL 14 2HG1 VAL 14 20.354 -8.817 4.420 114 HG13 VAL 14 3HG1 VAL 14 21.497 -8.011 3.312 115 HG21 VAL 14 3HG2 VAL 14 20.200 -11.136 4.557 116 HG22 VAL 14 1HG2 VAL 14 19.618 -11.236 2.880 117 HG23 VAL 14 2HG2 VAL 14 20.997 -12.238 3.404 118 H GLN 15 H GLN 15 20.961 -12.442 0.681 119 HA GLN 15 HA GLN 15 23.331 -14.061 1.169 120 HB2 GLN 15 2HB GLN 15 20.757 -14.512 -0.390 121 HB3 GLN 15 3HB GLN 15 22.028 -15.731 -0.221 122 HG2 GLN 15 2HG GLN 15 21.803 -15.708 2.218 123 HG3 GLN 15 3HG GLN 15 20.588 -14.445 2.137 124 HE21 GLN 15 2HE2 GLN 15 19.735 -16.637 3.455 125 HE22 GLN 15 1HE2 GLN 15 18.683 -17.617 2.462 126 H LYS 16 H LYS 16 22.298 -11.844 -1.270 127 HA LYS 16 HA LYS 16 24.081 -12.964 -3.328 128 HB2 LYS 16 2HB LYS 16 22.061 -10.711 -3.278 129 HB3 LYS 16 3HB LYS 16 23.128 -11.018 -4.663 130 HG2 LYS 16 2HG LYS 16 22.268 -13.272 -4.928 131 HG3 LYS 16 3HG LYS 16 21.349 -13.155 -3.421 132 HD2 LYS 16 2HD LYS 16 20.018 -11.284 -4.409 133 HD3 LYS 16 3HD LYS 16 20.866 -11.544 -5.955 134 HE2 LYS 16 2HE LYS 16 20.070 -13.894 -5.977 135 HE3 LYS 16 3HE LYS 16 19.243 -13.628 -4.435 136 HZ1 LYS 16 3HZ LYS 16 17.891 -11.963 -5.544 137 HZ2 LYS 16 1HZ LYS 16 18.658 -12.252 -6.972 138 HZ3 LYS 16 2HZ LYS 16 17.744 -13.426 -6.285 139 H GLY 17 H GLY 17 24.582 -11.121 -0.614 140 HA2 GLY 17 2HA GLY 17 26.860 -10.553 -0.158 141 HA3 GLY 17 3HA GLY 17 27.076 -10.071 -1.845 142 H ASP 18 H ASP 18 24.090 -8.802 -0.944 143 HA ASP 18 HA ASP 18 25.312 -6.152 -0.457 144 HB2 ASP 18 2HB ASP 18 22.626 -7.204 -1.319 145 HB3 ASP 18 3HB ASP 18 22.731 -5.592 -0.618 146 H GLN 19 H GLN 19 26.087 -6.592 1.682 147 HA GLN 19 HA GLN 19 24.413 -7.488 3.802 148 HB2 GLN 19 2HB GLN 19 26.916 -7.482 3.644 149 HB3 GLN 19 3HB GLN 19 26.910 -5.743 3.930 150 HG2 GLN 19 2HG GLN 19 25.678 -7.777 5.837 151 HG3 GLN 19 3HG GLN 19 27.374 -7.288 5.911 152 HE21 GLN 19 2HE2 GLN 19 27.522 -4.650 5.677 153 HE22 GLN 19 1HE2 GLN 19 26.559 -3.838 6.893 154 H LYS 20 H LYS 20 24.674 -4.429 2.152 155 HA LYS 20 HA LYS 20 23.750 -2.667 4.183 156 HB2 LYS 20 2HB LYS 20 23.179 -1.212 2.273 157 HB3 LYS 20 3HB LYS 20 24.769 -1.968 2.067 158 HG2 LYS 20 2HG LYS 20 23.677 -3.725 0.618 159 HG3 LYS 20 3HG LYS 20 22.163 -2.786 0.715 160 HD2 LYS 20 2HD LYS 20 23.342 -0.831 -0.271 161 HD3 LYS 20 3HD LYS 20 24.839 -1.790 -0.346 162 HE2 LYS 20 2HE LYS 20 23.695 -3.432 -1.814 163 HE3 LYS 20 3HE LYS 20 22.233 -2.433 -1.774 164 HZ1 LYS 20 3HZ LYS 20 23.486 -0.662 -2.792 165 HZ2 LYS 20 1HZ LYS 20 24.859 -1.569 -2.799 166 HZ3 LYS 20 2HZ LYS 20 23.579 -2.008 -3.730 167 H ALA 21 H ALA 21 22.046 -5.108 2.274 168 HA ALA 21 HA ALA 21 19.437 -3.949 2.880 169 HB1 ALA 21 1HB ALA 21 20.237 -6.646 1.711 170 HB2 ALA 21 2HB ALA 21 18.578 -6.006 1.797 171 HB3 ALA 21 3HB ALA 21 19.797 -5.190 0.793 172 H PHE 22 H PHE 22 21.734 -6.030 4.494 173 HA PHE 22 HA PHE 22 19.748 -7.325 6.188 174 HB2 PHE 22 2HB PHE 22 21.985 -8.325 5.665 175 HB3 PHE 22 3HB PHE 22 22.751 -7.005 6.540 176 HD1 PHE 22 HD1 PHE 22 19.987 -9.513 7.060 177 HD2 PHE 22 HD2 PHE 22 23.367 -7.453 8.749 178 HE1 PHE 22 HE1 PHE 22 19.725 -10.801 9.152 179 HE2 PHE 22 HE2 PHE 22 23.091 -8.742 10.854 180 HZ PHE 22 HZ PHE 22 21.281 -10.418 11.055 181 H ASN 23 H ASN 23 21.875 -4.465 6.312 182 HA ASN 23 HA ASN 23 21.416 -3.765 9.039 183 HB2 ASN 23 2HB ASN 23 23.195 -2.729 7.797 184 HB3 ASN 23 3HB ASN 23 22.088 -2.257 6.499 185 HD21 ASN 23 2HD2 ASN 23 20.932 -0.368 6.612 186 HD22 ASN 23 1HD2 ASN 23 21.082 0.773 7.933 187 H LEU 24 H LEU 24 19.653 -3.013 6.015 188 HA LEU 24 HA LEU 24 17.668 -1.391 7.355 189 HB2 LEU 24 2HB LEU 24 17.741 -2.717 4.615 190 HB3 LEU 24 3HB LEU 24 16.529 -1.534 5.130 191 HG LEU 24 HG LEU 24 19.531 -0.983 5.012 192 HD11 LEU 24 1HD1 LEU 24 18.979 0.327 2.994 193 HD12 LEU 24 2HD1 LEU 24 18.574 -1.388 2.779 194 HD13 LEU 24 3HD1 LEU 24 17.285 -0.210 3.108 195 HD21 LEU 24 3HD2 LEU 24 18.349 0.442 6.634 196 HD22 LEU 24 1HD2 LEU 24 18.814 1.379 5.196 197 HD23 LEU 24 2HD2 LEU 24 17.128 0.853 5.406 198 H LEU 25 H LEU 25 18.121 -4.812 6.900 199 HA LEU 25 HA LEU 25 15.286 -5.456 7.281 200 HB2 LEU 25 2HB LEU 25 16.701 -6.832 5.834 201 HB3 LEU 25 3HB LEU 25 17.812 -7.145 7.170 202 HG LEU 25 HG LEU 25 15.997 -8.319 8.401 203 HD11 LEU 25 1HD1 LEU 25 13.963 -8.981 7.178 204 HD12 LEU 25 2HD1 LEU 25 14.035 -7.215 7.372 205 HD13 LEU 25 3HD1 LEU 25 14.436 -7.955 5.804 206 HD21 LEU 25 3HD2 LEU 25 17.589 -9.562 7.001 207 HD22 LEU 25 1HD2 LEU 25 15.977 -10.308 6.911 208 HD23 LEU 25 2HD2 LEU 25 16.560 -9.299 5.571 209 H VAL 26 H VAL 26 18.320 -5.639 9.287 210 HA VAL 26 HA VAL 26 16.896 -6.889 11.437 211 HB VAL 26 HB VAL 26 18.814 -6.489 12.807 212 HG11 VAL 26 1HG1 VAL 26 18.948 -8.298 11.159 213 HG12 VAL 26 2HG1 VAL 26 19.702 -7.185 9.989 214 HG13 VAL 26 3HG1 VAL 26 20.543 -7.587 11.499 215 HG21 VAL 26 3HG2 VAL 26 19.834 -4.662 10.597 216 HG22 VAL 26 1HG2 VAL 26 19.357 -4.188 12.253 217 HG23 VAL 26 2HG2 VAL 26 20.775 -5.214 12.002 218 H VAL 27 H VAL 27 17.200 -3.492 10.461 219 HA VAL 27 HA VAL 27 16.682 -2.472 13.106 220 HB VAL 27 HB VAL 27 17.765 -1.167 11.336 221 HG11 VAL 27 1HG1 VAL 27 16.414 -1.893 9.410 222 HG12 VAL 27 2HG1 VAL 27 14.989 -1.045 10.081 223 HG13 VAL 27 3HG1 VAL 27 16.407 -0.123 9.559 224 HG21 VAL 27 3HG2 VAL 27 16.673 -0.053 13.252 225 HG22 VAL 27 1HG2 VAL 27 16.623 0.944 11.780 226 HG23 VAL 27 2HG2 VAL 27 15.168 0.081 12.314 227 H ARG 28 H ARG 28 14.601 -3.737 10.530 228 HA ARG 28 HA ARG 28 12.127 -2.668 11.557 229 HB2 ARG 28 2HB ARG 28 12.516 -5.318 10.112 230 HB3 ARG 28 3HB ARG 28 11.088 -4.272 10.108 231 HG2 ARG 28 2HG ARG 28 12.400 -2.544 8.853 232 HG3 ARG 28 3HG ARG 28 13.803 -3.642 8.871 233 HD2 ARG 28 2HD ARG 28 12.760 -3.903 6.743 234 HD3 ARG 28 3HD ARG 28 12.429 -5.360 7.689 235 HE ARG 28 HE ARG 28 10.149 -4.771 7.818 236 HH11 ARG 28 1HH1 ARG 28 12.037 -2.224 6.244 237 HH12 ARG 28 2HH1 ARG 28 10.621 -1.411 5.614 238 HH21 ARG 28 1HH2 ARG 28 8.322 -3.668 6.998 239 HH22 ARG 28 2HH2 ARG 28 8.541 -2.219 6.041 240 H TYR 29 H TYR 29 14.143 -5.481 12.252 241 HA TYR 29 HA TYR 29 12.129 -6.521 14.152 242 HB2 TYR 29 2HB TYR 29 14.672 -7.678 12.978 243 HB3 TYR 29 3HB TYR 29 13.702 -8.478 14.220 244 HD1 TYR 29 HD2 TYR 29 13.672 -7.254 10.708 245 HD2 TYR 29 HD1 TYR 29 11.663 -9.589 13.697 246 HE1 TYR 29 HE2 TYR 29 12.154 -8.149 8.963 247 HE2 TYR 29 HE1 TYR 29 10.161 -10.527 11.967 248 HH TYR 29 HH TYR 29 9.580 -10.531 9.734 249 H GLN 30 H GLN 30 14.799 -4.425 14.236 250 HA GLN 30 HA GLN 30 16.168 -5.329 16.548 251 HB2 GLN 30 2HB GLN 30 16.988 -3.686 14.882 252 HB3 GLN 30 3HB GLN 30 15.823 -2.497 15.486 253 HG2 GLN 30 2HG GLN 30 16.925 -2.503 17.674 254 HG3 GLN 30 3HG GLN 30 18.001 -3.817 17.151 255 HE21 GLN 30 2HE2 GLN 30 19.186 -3.295 14.972 256 HE22 GLN 30 1HE2 GLN 30 19.884 -1.688 14.861 257 H HIS 31 H HIS 31 13.161 -3.481 16.142 258 HA HIS 31 HA HIS 31 12.994 -2.893 19.016 259 HB2 HIS 31 2HB HIS 31 12.102 -1.342 17.308 260 HB3 HIS 31 3HB HIS 31 10.994 -2.597 16.741 261 HD2 HIS 31 HD2 HIS 31 11.721 -0.582 20.004 262 HE1 HIS 31 HE1 HIS 31 7.584 -1.558 20.001 263 HE2 HIS 31 HE2 HIS 31 9.422 -0.309 21.236 264 H LYS 32 H LYS 32 11.892 -5.367 16.724 265 HA LYS 32 HA LYS 32 9.821 -6.394 18.479 266 HB2 LYS 32 2HB LYS 32 11.133 -7.601 16.015 267 HB3 LYS 32 3HB LYS 32 9.637 -8.168 16.791 268 HG2 LYS 32 2HG LYS 32 8.598 -5.943 16.394 269 HG3 LYS 32 3HG LYS 32 10.055 -5.446 15.503 270 HD2 LYS 32 2HD LYS 32 9.748 -7.383 13.963 271 HD3 LYS 32 3HD LYS 32 8.249 -7.807 14.811 272 HE2 LYS 32 2HE LYS 32 8.806 -5.142 13.455 273 HE3 LYS 32 3HE LYS 32 7.887 -6.475 12.723 274 HZ1 LYS 32 3HZ LYS 32 6.302 -6.281 14.513 275 HZ2 LYS 32 1HZ LYS 32 7.151 -5.047 15.194 276 HZ3 LYS 32 2HZ LYS 32 6.441 -4.849 13.726 277 H VAL 33 H VAL 33 13.195 -7.418 17.672 278 HA VAL 33 HA VAL 33 12.893 -9.758 19.376 279 HB VAL 33 HB VAL 33 15.142 -10.300 18.849 280 HG11 VAL 33 1HG1 VAL 33 13.436 -10.738 17.138 281 HG12 VAL 33 2HG1 VAL 33 13.763 -9.163 16.388 282 HG13 VAL 33 3HG1 VAL 33 15.023 -10.421 16.406 283 HG21 VAL 33 3HG2 VAL 33 16.245 -8.156 19.049 284 HG22 VAL 33 1HG2 VAL 33 16.587 -8.863 17.460 285 HG23 VAL 33 2HG2 VAL 33 15.405 -7.542 17.603 286 H ALA 34 H ALA 34 14.023 -6.428 19.783 287 HA ALA 34 HA ALA 34 15.477 -6.943 22.210 288 HB1 ALA 34 1HB ALA 34 14.127 -4.402 21.221 289 HB2 ALA 34 2HB ALA 34 15.319 -4.517 22.534 290 HB3 ALA 34 3HB ALA 34 15.798 -4.911 20.866 291 H SER 35 H SER 35 12.074 -6.704 21.406 292 HA SER 35 HA SER 35 11.171 -6.068 24.090 293 HB2 SER 35 2HB SER 35 9.868 -5.558 22.046 294 HB3 SER 35 3HB SER 35 9.712 -7.296 21.710 295 HG SER 35 HG SER 35 7.903 -6.428 22.845 296 H LEU 36 H LEU 36 11.538 -9.048 22.124 297 HA LEU 36 HA LEU 36 10.449 -10.658 24.305 298 HB2 LEU 36 2HB LEU 36 10.632 -12.525 22.814 299 HB3 LEU 36 3HB LEU 36 9.935 -11.141 21.974 300 HG LEU 36 HG LEU 36 12.387 -10.714 21.136 301 HD11 LEU 36 1HD1 LEU 36 12.484 -13.693 21.806 302 HD12 LEU 36 2HD1 LEU 36 13.651 -12.826 20.792 303 HD13 LEU 36 3HD1 LEU 36 13.541 -12.448 22.515 304 HD21 LEU 36 3HD2 LEU 36 10.734 -13.090 20.184 305 HD22 LEU 36 1HD2 LEU 36 10.466 -11.389 19.736 306 HD23 LEU 36 2HD2 LEU 36 11.957 -12.213 19.228 307 H VAL 37 H VAL 37 13.654 -9.663 23.252 308 HA VAL 37 HA VAL 37 14.880 -11.841 24.784 309 HB VAL 37 HB VAL 37 15.718 -10.947 22.551 310 HG11 VAL 37 1HG1 VAL 37 17.107 -9.064 22.485 311 HG12 VAL 37 2HG1 VAL 37 15.693 -8.509 23.430 312 HG13 VAL 37 3HG1 VAL 37 17.220 -8.950 24.248 313 HG21 VAL 37 3HG2 VAL 37 18.031 -11.415 23.143 314 HG22 VAL 37 1HG2 VAL 37 17.685 -11.137 24.865 315 HG23 VAL 37 2HG2 VAL 37 16.954 -12.523 24.014 316 H SER 38 H SER 38 13.898 -8.523 25.349 317 HA SER 38 HA SER 38 15.588 -8.028 27.613 318 HB2 SER 38 2HB SER 38 14.284 -6.293 26.398 319 HB3 SER 38 3HB SER 38 12.783 -7.014 27.012 320 HG SER 38 HG SER 38 13.532 -5.260 28.289 321 H ARG 39 H ARG 39 13.170 -10.338 27.043 322 HA ARG 39 HA ARG 39 12.294 -10.558 29.837 323 HB2 ARG 39 2HB ARG 39 11.626 -12.334 27.472 324 HB3 ARG 39 3HB ARG 39 10.755 -12.214 29.015 325 HG2 ARG 39 2HG ARG 39 10.183 -9.839 28.491 326 HG3 ARG 39 3HG ARG 39 11.070 -9.977 26.961 327 HD2 ARG 39 2HD ARG 39 9.528 -11.888 26.346 328 HD3 ARG 39 3HD ARG 39 8.545 -11.450 27.759 329 HE ARG 39 HE ARG 39 9.143 -9.196 26.007 330 HH11 ARG 39 1HH1 ARG 39 6.936 -11.899 26.533 331 HH12 ARG 39 2HH1 ARG 39 5.627 -11.161 25.634 332 HH21 ARG 39 1HH2 ARG 39 7.439 -8.265 24.820 333 HH22 ARG 39 2HH2 ARG 39 5.916 -9.106 24.664 334 H TYR 40 H TYR 40 15.015 -11.527 28.118 335 HA TYR 40 HA TYR 40 15.371 -13.909 29.878 336 HB2 TYR 40 2HB TYR 40 16.383 -13.442 27.054 337 HB3 TYR 40 3HB TYR 40 16.831 -14.809 28.078 338 HD1 TYR 40 HD2 TYR 40 14.965 -16.364 28.915 339 HD2 TYR 40 HD1 TYR 40 14.437 -13.550 25.706 340 HE1 TYR 40 HE2 TYR 40 12.965 -17.620 28.144 341 HE2 TYR 40 HE1 TYR 40 12.459 -14.805 24.918 342 HH TYR 40 HH TYR 40 11.072 -16.596 25.278 343 H VAL 41 H VAL 41 16.568 -10.800 28.922 344 HA VAL 41 HA VAL 41 18.758 -11.105 30.884 345 HB VAL 41 HB VAL 41 20.229 -9.697 29.359 346 HG11 VAL 41 1HG1 VAL 41 21.115 -11.625 28.158 347 HG12 VAL 41 2HG1 VAL 41 20.640 -12.089 29.804 348 HG13 VAL 41 3HG1 VAL 41 19.607 -12.524 28.424 349 HG21 VAL 41 3HG2 VAL 41 18.379 -10.743 27.187 350 HG22 VAL 41 1HG2 VAL 41 18.458 -9.049 27.732 351 HG23 VAL 41 2HG2 VAL 41 19.872 -9.807 26.971 352 HA PRO 42 HA PRO 42 17.169 -7.261 32.260 353 HB2 PRO 42 2HB PRO 42 19.343 -6.042 33.383 354 HB3 PRO 42 3HB PRO 42 18.595 -7.523 34.074 355 HG2 PRO 42 2HG PRO 42 20.981 -7.337 32.210 356 HG3 PRO 42 3HG PRO 42 20.879 -8.223 33.771 357 HD2 PRO 42 2HD PRO 42 20.485 -9.508 31.424 358 HD3 PRO 42 3HD PRO 42 19.440 -9.869 32.831 359 H SER 43 H SER 43 17.384 -4.852 32.028 360 HA SER 43 HA SER 43 17.606 -4.231 29.261 361 HB2 SER 43 2HB SER 43 16.057 -3.171 30.909 362 HB3 SER 43 3HB SER 43 17.448 -2.352 31.646 363 HG SER 43 HG SER 43 16.337 -1.072 30.063 364 H GLY 44 H GLY 44 20.060 -4.406 31.668 365 HA2 GLY 44 2HA GLY 44 21.787 -2.364 30.459 366 HA3 GLY 44 3HA GLY 44 22.178 -3.468 31.789 367 H ASP 45 H ASP 45 21.107 -5.775 29.976 368 HA ASP 45 HA ASP 45 23.584 -6.036 28.329 369 HB2 ASP 45 2HB ASP 45 22.003 -8.150 29.826 370 HB3 ASP 45 3HB ASP 45 23.366 -8.471 28.752 371 H VAL 46 H VAL 46 20.244 -5.599 28.114 372 HA VAL 46 HA VAL 46 19.635 -7.532 26.108 373 HB VAL 46 HB VAL 46 18.007 -6.340 27.592 374 HG11 VAL 46 1HG1 VAL 46 18.279 -4.091 25.557 375 HG12 VAL 46 2HG1 VAL 46 17.037 -4.241 26.812 376 HG13 VAL 46 3HG1 VAL 46 18.736 -4.006 27.282 377 HG21 VAL 46 3HG2 VAL 46 17.524 -6.376 24.596 378 HG22 VAL 46 1HG2 VAL 46 17.247 -7.687 25.782 379 HG23 VAL 46 2HG2 VAL 46 16.260 -6.212 25.835 380 HA PRO 47 HA PRO 47 20.390 -4.145 22.891 381 HB2 PRO 47 2HB PRO 47 22.322 -2.275 23.176 382 HB3 PRO 47 3HB PRO 47 20.708 -2.075 23.935 383 HG2 PRO 47 2HG PRO 47 23.243 -3.145 25.218 384 HG3 PRO 47 3HG PRO 47 22.167 -1.847 25.831 385 HD2 PRO 47 2HD PRO 47 21.961 -4.432 26.657 386 HD3 PRO 47 3HD PRO 47 20.508 -3.403 26.462 387 H ASP 48 H ASP 48 23.096 -5.492 24.747 388 HA ASP 48 HA ASP 48 24.840 -5.658 22.414 389 HB2 ASP 48 2HB ASP 48 25.639 -5.305 24.765 390 HB3 ASP 48 3HB ASP 48 25.074 -6.939 25.159 391 H VAL 49 H VAL 49 22.506 -7.684 24.122 392 HA VAL 49 HA VAL 49 23.311 -10.143 22.785 393 HB VAL 49 HB VAL 49 20.913 -9.329 24.474 394 HG11 VAL 49 1HG1 VAL 49 21.652 -12.083 23.403 395 HG12 VAL 49 2HG1 VAL 49 20.377 -11.732 24.593 396 HG13 VAL 49 3HG1 VAL 49 20.222 -11.132 22.931 397 HG21 VAL 49 3HG2 VAL 49 23.294 -11.169 24.985 398 HG22 VAL 49 1HG2 VAL 49 23.122 -9.522 25.629 399 HG23 VAL 49 2HG2 VAL 49 21.998 -10.796 26.143 400 H VAL 50 H VAL 50 21.077 -7.450 22.141 401 HA VAL 50 HA VAL 50 19.694 -8.797 19.981 402 HB VAL 50 HB VAL 50 20.059 -5.887 20.779 403 HG11 VAL 50 1HG1 VAL 50 18.401 -7.041 18.491 404 HG12 VAL 50 2HG1 VAL 50 18.269 -5.381 19.108 405 HG13 VAL 50 3HG1 VAL 50 19.769 -5.920 18.327 406 HG21 VAL 50 3HG2 VAL 50 17.702 -6.064 21.387 407 HG22 VAL 50 1HG2 VAL 50 17.630 -7.720 20.729 408 HG23 VAL 50 2HG2 VAL 50 18.595 -7.381 22.176 409 H GLN 51 H GLN 51 22.679 -6.835 20.285 410 HA GLN 51 HA GLN 51 23.095 -6.701 17.423 411 HB2 GLN 51 2HB GLN 51 24.065 -5.085 19.012 412 HB3 GLN 51 3HB GLN 51 25.048 -6.374 19.742 413 HG2 GLN 51 2HG GLN 51 26.221 -6.738 17.638 414 HG3 GLN 51 3HG GLN 51 25.179 -5.571 16.808 415 HE21 GLN 51 2HE2 GLN 51 27.649 -4.934 16.389 416 HE22 GLN 51 1HE2 GLN 51 28.235 -3.672 17.451 417 H GLU 52 H GLU 52 24.299 -8.893 20.050 418 HA GLU 52 HA GLU 52 25.961 -10.394 18.257 419 HB2 GLU 52 2HB GLU 52 26.230 -10.370 20.713 420 HB3 GLU 52 3HB GLU 52 24.684 -11.228 20.895 421 HG2 GLU 52 2HG GLU 52 25.552 -13.171 19.740 422 HG3 GLU 52 3HG GLU 52 27.016 -12.306 19.268 423 H ALA 53 H ALA 53 22.491 -10.463 19.007 424 HA ALA 53 HA ALA 53 22.042 -13.076 17.861 425 HB1 ALA 53 1HB ALA 53 20.167 -10.729 18.337 426 HB2 ALA 53 2HB ALA 53 19.673 -12.386 17.915 427 HB3 ALA 53 3HB ALA 53 20.482 -12.071 19.464 428 H PHE 54 H PHE 54 22.314 -9.775 16.534 429 HA PHE 54 HA PHE 54 21.260 -10.659 13.937 430 HB2 PHE 54 2HB PHE 54 22.467 -8.055 14.923 431 HB3 PHE 54 3HB PHE 54 21.943 -8.313 13.270 432 HD1 PHE 54 HD2 PHE 54 19.415 -9.990 13.896 433 HD2 PHE 54 HD1 PHE 54 20.948 -6.308 15.529 434 HE1 PHE 54 HE2 PHE 54 17.120 -9.284 14.475 435 HE2 PHE 54 HE1 PHE 54 18.635 -5.599 16.070 436 HZ PHE 54 HZ PHE 54 16.727 -7.084 15.548 437 H ILE 55 H ILE 55 24.430 -10.192 15.495 438 HA ILE 55 HA ILE 55 25.908 -10.465 13.014 439 HB ILE 55 HB ILE 55 26.675 -10.910 15.928 440 HG12 ILE 55 2HG1 ILE 55 27.269 -8.574 14.047 441 HG13 ILE 55 3HG1 ILE 55 25.994 -8.568 15.259 442 HG21 ILE 55 1HG2 ILE 55 28.453 -10.680 13.458 443 HG22 ILE 55 2HG2 ILE 55 29.015 -10.824 15.140 444 HG23 ILE 55 3HG2 ILE 55 28.161 -12.171 14.385 445 HD11 ILE 55 3HD1 ILE 55 27.714 -8.953 17.043 446 HD12 ILE 55 1HD1 ILE 55 28.984 -8.830 15.799 447 HD13 ILE 55 2HD1 ILE 55 27.945 -7.437 16.145 448 H LYS 56 H LYS 56 24.631 -12.672 15.509 449 HA LYS 56 HA LYS 56 25.862 -15.026 14.327 450 HB2 LYS 56 2HB LYS 56 25.401 -14.705 16.750 451 HB3 LYS 56 3HB LYS 56 23.662 -14.744 16.413 452 HG2 LYS 56 2HG LYS 56 23.764 -17.029 15.709 453 HG3 LYS 56 3HG LYS 56 25.537 -16.982 15.579 454 HD2 LYS 56 2HD LYS 56 24.932 -18.169 17.630 455 HD3 LYS 56 3HD LYS 56 25.734 -16.638 18.008 456 HE2 LYS 56 2HE LYS 56 23.884 -16.876 19.516 457 HE3 LYS 56 3HE LYS 56 23.496 -15.582 18.371 458 HZ1 LYS 56 3HZ LYS 56 21.647 -17.061 18.686 459 HZ2 LYS 56 1HZ LYS 56 22.187 -17.189 17.136 460 HZ3 LYS 56 2HZ LYS 56 22.541 -18.366 18.229 461 H ALA 57 H ALA 57 22.729 -13.343 14.074 462 HA ALA 57 HA ALA 57 21.390 -15.497 12.741 463 HB1 ALA 57 1HB ALA 57 20.939 -12.484 12.647 464 HB2 ALA 57 2HB ALA 57 19.831 -13.704 11.983 465 HB3 ALA 57 3HB ALA 57 20.135 -13.656 13.728 466 H TYR 58 H TYR 58 23.370 -12.714 11.529 467 HA TYR 58 HA TYR 58 22.802 -13.177 8.783 468 HB2 TYR 58 2HB TYR 58 23.822 -11.139 9.778 469 HB3 TYR 58 3HB TYR 58 25.302 -12.047 10.089 470 HD1 TYR 58 HD2 TYR 58 23.053 -10.768 7.402 471 HD2 TYR 58 HD1 TYR 58 26.903 -12.430 8.355 472 HE1 TYR 58 HE2 TYR 58 23.879 -10.127 5.156 473 HE2 TYR 58 HE1 TYR 58 27.732 -11.823 6.096 474 HH TYR 58 HH TYR 58 27.225 -10.842 4.082 475 H ARG 59 H ARG 59 25.251 -14.571 10.975 476 HA ARG 59 HA ARG 59 26.705 -15.967 8.908 477 HB2 ARG 59 2HB ARG 59 26.540 -16.325 11.920 478 HB3 ARG 59 3HB ARG 59 27.666 -17.203 10.861 479 HG2 ARG 59 2HG ARG 59 28.734 -15.120 10.181 480 HG3 ARG 59 3HG ARG 59 27.487 -14.163 11.000 481 HD2 ARG 59 2HD ARG 59 29.414 -14.217 12.431 482 HD3 ARG 59 3HD ARG 59 28.150 -15.213 13.168 483 HE ARG 59 HE ARG 59 29.830 -16.858 11.535 484 HH11 ARG 59 1HH1 ARG 59 29.869 -15.084 14.592 485 HH12 ARG 59 2HH1 ARG 59 31.054 -16.138 15.323 486 HH21 ARG 59 1HH2 ARG 59 31.370 -18.223 12.517 487 HH22 ARG 59 2HH2 ARG 59 31.900 -17.918 14.151 488 H ALA 60 H ALA 60 23.684 -16.553 10.530 489 HA ALA 60 HA ALA 60 23.684 -19.389 9.623 490 HB1 ALA 60 1HB ALA 60 21.776 -19.620 11.157 491 HB2 ALA 60 2HB ALA 60 23.196 -18.952 12.001 492 HB3 ALA 60 3HB ALA 60 21.858 -17.883 11.534 493 H LEU 61 H LEU 61 22.655 -16.264 8.705 494 HA LEU 61 HA LEU 61 20.089 -16.927 7.578 495 HB2 LEU 61 2HB LEU 61 20.902 -14.641 8.338 496 HB3 LEU 61 3HB LEU 61 21.963 -14.612 6.920 497 HG LEU 61 HG LEU 61 19.926 -14.850 5.466 498 HD11 LEU 61 1HD1 LEU 61 18.541 -14.541 8.156 499 HD12 LEU 61 2HD1 LEU 61 17.729 -14.317 6.586 500 HD13 LEU 61 3HD1 LEU 61 18.370 -15.911 7.029 501 HD21 LEU 61 3HD2 LEU 61 19.156 -12.541 5.847 502 HD22 LEU 61 1HD2 LEU 61 19.921 -12.548 7.460 503 HD23 LEU 61 2HD2 LEU 61 20.924 -12.657 5.991 504 H ASP 62 H ASP 62 23.427 -17.154 6.539 505 HA ASP 62 HA ASP 62 23.014 -17.360 3.732 506 HB2 ASP 62 2HB ASP 62 25.199 -17.047 4.860 507 HB3 ASP 62 3HB ASP 62 25.085 -18.679 5.531 508 H SER 63 H SER 63 21.975 -19.403 6.301 509 HA SER 63 HA SER 63 21.606 -21.663 4.403 510 HB2 SER 63 2HB SER 63 23.049 -22.057 6.443 511 HB3 SER 63 3HB SER 63 21.575 -21.838 7.421 512 HG SER 63 HG SER 63 20.639 -23.537 6.209 513 H PHE 64 H PHE 64 19.862 -19.073 5.528 514 HA PHE 64 HA PHE 64 17.443 -20.433 6.346 515 HB2 PHE 64 2HB PHE 64 17.812 -18.127 6.971 516 HB3 PHE 64 3HB PHE 64 17.891 -17.640 5.271 517 HD1 PHE 64 HD2 PHE 64 15.604 -19.153 7.839 518 HD2 PHE 64 HD1 PHE 64 15.918 -17.114 4.068 519 HE1 PHE 64 HE2 PHE 64 13.160 -18.777 7.842 520 HE2 PHE 64 HE1 PHE 64 13.468 -16.725 4.080 521 HZ PHE 64 HZ PHE 64 12.086 -17.547 5.973 522 H ARG 65 H ARG 65 15.975 -21.410 5.163 523 HA ARG 65 HA ARG 65 15.791 -20.948 2.237 524 HB2 ARG 65 2HB ARG 65 16.286 -23.606 3.644 525 HB3 ARG 65 3HB ARG 65 15.802 -23.458 1.941 526 HG2 ARG 65 2HG ARG 65 17.813 -22.258 1.377 527 HG3 ARG 65 3HG ARG 65 18.302 -22.143 3.085 528 HD2 ARG 65 2HD ARG 65 18.562 -24.542 3.249 529 HD3 ARG 65 3HD ARG 65 17.985 -24.756 1.577 530 HE ARG 65 HE ARG 65 20.159 -22.971 1.488 531 HH11 ARG 65 1HH1 ARG 65 19.573 -26.337 2.388 532 HH12 ARG 65 2HH1 ARG 65 21.187 -26.860 1.973 533 HH21 ARG 65 1HH2 ARG 65 22.257 -23.674 0.933 534 HH22 ARG 65 2HH2 ARG 65 22.709 -25.347 1.153 535 H GLY 66 H GLY 66 14.190 -20.618 4.951 536 HA2 GLY 66 2HA GLY 66 11.899 -22.340 4.623 537 HA3 GLY 66 3HA GLY 66 12.035 -20.924 5.685 538 H ASP 67 H ASP 67 12.767 -19.050 3.598 539 HA ASP 67 HA ASP 67 11.720 -17.465 2.382 540 HB2 ASP 67 2HB ASP 67 10.983 -19.968 0.844 541 HB3 ASP 67 3HB ASP 67 10.769 -18.323 0.220 542 H SER 68 H SER 68 10.022 -18.607 4.632 543 HA SER 68 HA SER 68 7.597 -17.163 3.854 544 HB2 SER 68 2HB SER 68 6.085 -19.076 4.356 545 HB3 SER 68 3HB SER 68 7.109 -19.395 2.940 546 HG SER 68 HG SER 68 8.456 -20.635 4.247 547 H ALA 69 H ALA 69 9.816 -18.263 6.218 548 HA ALA 69 HA ALA 69 8.117 -17.070 8.315 549 HB1 ALA 69 1HB ALA 69 9.426 -19.814 8.526 550 HB2 ALA 69 2HB ALA 69 8.574 -18.967 9.841 551 HB3 ALA 69 3HB ALA 69 7.684 -19.502 8.395 552 H PHE 70 H PHE 70 10.071 -15.576 7.284 553 HA PHE 70 HA PHE 70 12.652 -16.064 8.461 554 HB2 PHE 70 2HB PHE 70 12.420 -14.604 6.517 555 HB3 PHE 70 3HB PHE 70 11.332 -13.537 7.418 556 HD1 PHE 70 HD2 PHE 70 14.768 -15.045 7.792 557 HD2 PHE 70 HD1 PHE 70 12.248 -11.598 8.328 558 HE1 PHE 70 HE2 PHE 70 16.694 -13.773 8.683 559 HE2 PHE 70 HE1 PHE 70 14.182 -10.321 9.195 560 HZ PHE 70 HZ PHE 70 16.414 -11.408 9.378 561 H TYR 71 H TYR 71 9.713 -14.342 9.594 562 HA TYR 71 HA TYR 71 11.105 -12.984 11.701 563 HB2 TYR 71 2HB TYR 71 8.864 -12.478 12.561 564 HB3 TYR 71 3HB TYR 71 9.000 -12.139 10.843 565 HD1 TYR 71 HD2 TYR 71 7.544 -14.404 13.373 566 HD2 TYR 71 HD1 TYR 71 7.688 -13.354 9.205 567 HE1 TYR 71 HE2 TYR 71 5.526 -15.790 12.958 568 HE2 TYR 71 HE1 TYR 71 5.679 -14.751 8.779 569 HH TYR 71 HH TYR 71 4.084 -16.103 9.689 570 H THR 72 H THR 72 9.313 -16.106 11.552 571 HA THR 72 HA THR 72 9.539 -16.574 14.399 572 HB THR 72 HB THR 72 9.124 -18.524 12.096 573 HG1 THR 72 1HG THR 72 7.497 -16.932 12.321 574 HG21 THR 72 1HG2 THR 72 8.640 -18.800 15.098 575 HG22 THR 72 2HG2 THR 72 8.136 -19.975 13.864 576 HG23 THR 72 3HG2 THR 72 9.861 -19.682 14.149 577 H TRP 73 H TRP 73 11.527 -17.279 11.528 578 HA TRP 73 HA TRP 73 13.366 -19.036 12.871 579 HB2 TRP 73 2HB TRP 73 13.078 -19.018 10.450 580 HB3 TRP 73 3HB TRP 73 13.539 -17.317 10.370 581 HD1 TRP 73 HD1 TRP 73 15.009 -20.789 10.582 582 HE1 TRP 73 HE1 TRP 73 17.540 -20.695 10.272 583 HE3 TRP 73 HE3 TRP 73 15.652 -15.714 10.758 584 HZ2 TRP 73 HZ2 TRP 73 19.608 -18.672 10.197 585 HZ3 TRP 73 HZ3 TRP 73 17.912 -14.742 10.569 586 HH2 TRP 73 HH2 TRP 73 19.893 -16.207 10.304 587 H LEU 74 H LEU 74 13.087 -15.503 12.556 588 HA LEU 74 HA LEU 74 15.819 -15.045 13.467 589 HB2 LEU 74 2HB LEU 74 14.702 -13.588 11.815 590 HB3 LEU 74 3HB LEU 74 13.465 -13.169 13.009 591 HG LEU 74 HG LEU 74 15.216 -12.152 14.457 592 HD11 LEU 74 1HD1 LEU 74 17.465 -11.739 13.481 593 HD12 LEU 74 2HD1 LEU 74 17.177 -13.467 13.755 594 HD13 LEU 74 3HD1 LEU 74 17.055 -12.793 12.108 595 HD21 LEU 74 3HD2 LEU 74 13.975 -10.803 12.800 596 HD22 LEU 74 1HD2 LEU 74 15.636 -10.199 13.028 597 HD23 LEU 74 2HD2 LEU 74 15.216 -11.151 11.582 598 H TYR 75 H TYR 75 12.515 -14.949 14.899 599 HA TYR 75 HA TYR 75 13.293 -13.705 17.345 600 HB2 TYR 75 2HB TYR 75 11.125 -15.769 16.804 601 HB3 TYR 75 3HB TYR 75 11.243 -14.767 18.248 602 HD1 TYR 75 HD1 TYR 75 12.154 -12.269 16.290 603 HD2 TYR 75 HD2 TYR 75 8.812 -14.972 16.580 604 HE1 TYR 75 HE1 TYR 75 10.695 -10.573 15.254 605 HE2 TYR 75 HE2 TYR 75 7.355 -13.275 15.503 606 HH TYR 75 HH TYR 75 8.583 -10.066 14.513 607 H ARG 76 H ARG 76 13.634 -17.020 16.144 608 HA ARG 76 HA ARG 76 14.205 -18.199 18.724 609 HB2 ARG 76 2HB ARG 76 14.728 -19.075 15.854 610 HB3 ARG 76 3HB ARG 76 15.058 -20.094 17.264 611 HG2 ARG 76 2HG ARG 76 12.333 -18.900 16.645 612 HG3 ARG 76 3HG ARG 76 12.850 -20.531 16.145 613 HD2 ARG 76 2HD ARG 76 13.226 -21.124 18.521 614 HD3 ARG 76 3HD ARG 76 12.678 -19.511 19.016 615 HE ARG 76 HE ARG 76 10.660 -20.668 17.399 616 HH11 ARG 76 1HH1 ARG 76 12.172 -21.156 20.559 617 HH12 ARG 76 2HH1 ARG 76 10.743 -21.876 21.264 618 HH21 ARG 76 1HH2 ARG 76 8.809 -21.611 18.347 619 HH22 ARG 76 2HH2 ARG 76 8.852 -22.131 20.015 620 H ILE 77 H ILE 77 16.128 -16.436 16.338 621 HA ILE 77 HA ILE 77 18.663 -17.462 17.308 622 HB ILE 77 HB ILE 77 18.167 -14.785 15.955 623 HG12 ILE 77 2HG1 ILE 77 17.184 -16.489 14.525 624 HG13 ILE 77 3HG1 ILE 77 18.681 -15.875 13.820 625 HG21 ILE 77 1HG2 ILE 77 20.525 -15.145 15.188 626 HG22 ILE 77 2HG2 ILE 77 20.380 -15.011 16.947 627 HG23 ILE 77 3HG2 ILE 77 20.596 -16.607 16.192 628 HD11 ILE 77 3HD1 ILE 77 19.893 -17.897 14.587 629 HD12 ILE 77 1HD1 ILE 77 18.380 -18.512 15.310 630 HD13 ILE 77 2HD1 ILE 77 18.509 -18.304 13.553 631 H ALA 78 H ALA 78 16.567 -14.681 18.151 632 HA ALA 78 HA ALA 78 18.587 -13.428 19.768 633 HB1 ALA 78 1HB ALA 78 16.729 -11.942 20.447 634 HB2 ALA 78 2HB ALA 78 16.783 -12.172 18.684 635 HB3 ALA 78 3HB ALA 78 15.572 -13.037 19.666 636 H VAL 79 H VAL 79 15.906 -15.704 20.524 637 HA VAL 79 HA VAL 79 16.326 -15.378 23.385 638 HB VAL 79 HB VAL 79 14.150 -15.982 22.537 639 HG11 VAL 79 1HG1 VAL 79 14.846 -17.311 20.567 640 HG12 VAL 79 2HG1 VAL 79 15.403 -18.610 21.653 641 HG13 VAL 79 3HG1 VAL 79 13.675 -18.181 21.590 642 HG21 VAL 79 3HG2 VAL 79 15.348 -18.319 24.079 643 HG22 VAL 79 1HG2 VAL 79 14.892 -16.760 24.800 644 HG23 VAL 79 2HG2 VAL 79 13.651 -17.803 24.061 645 H ASN 80 H ASN 80 17.649 -17.461 20.852 646 HA ASN 80 HA ASN 80 18.923 -19.253 22.775 647 HB2 ASN 80 2HB ASN 80 19.236 -18.842 19.780 648 HB3 ASN 80 3HB ASN 80 20.130 -20.052 20.704 649 HD21 ASN 80 2HD2 ASN 80 18.724 -21.109 18.730 650 HD22 ASN 80 1HD2 ASN 80 17.256 -21.869 19.308 651 H THR 81 H THR 81 19.659 -16.118 21.365 652 HA THR 81 HA THR 81 22.530 -16.337 21.882 653 HB THR 81 HB THR 81 20.804 -13.894 21.315 654 HG1 THR 81 1HG THR 81 20.737 -15.298 19.603 655 HG21 THR 81 1HG2 THR 81 23.031 -13.364 22.316 656 HG22 THR 81 2HG2 THR 81 23.811 -14.377 21.087 657 HG23 THR 81 3HG2 THR 81 22.958 -12.892 20.608 658 H ALA 82 H ALA 82 19.621 -15.176 23.590 659 HA ALA 82 HA ALA 82 21.088 -13.761 25.635 660 HB1 ALA 82 1HB ALA 82 18.251 -14.880 25.557 661 HB2 ALA 82 2HB ALA 82 18.876 -13.727 26.761 662 HB3 ALA 82 3HB ALA 82 18.755 -13.252 25.051 663 H LYS 83 H LYS 83 19.778 -17.090 25.312 664 HA LYS 83 HA LYS 83 20.469 -17.781 28.044 665 HB2 LYS 83 2HB LYS 83 19.701 -19.420 25.598 666 HB3 LYS 83 3HB LYS 83 19.965 -20.110 27.216 667 HG2 LYS 83 2HG LYS 83 18.206 -18.710 28.158 668 HG3 LYS 83 3HG LYS 83 17.962 -17.891 26.597 669 HD2 LYS 83 2HD LYS 83 17.284 -20.006 25.560 670 HD3 LYS 83 3HD LYS 83 17.525 -20.868 27.099 671 HE2 LYS 83 2HE LYS 83 15.581 -18.556 26.677 672 HE3 LYS 83 3HE LYS 83 15.134 -20.265 26.635 673 HZ1 LYS 83 3HZ LYS 83 16.303 -18.875 28.955 674 HZ2 LYS 83 1HZ LYS 83 14.731 -19.315 28.790 675 HZ3 LYS 83 2HZ LYS 83 15.894 -20.467 28.904 676 H ASN 84 H ASN 84 22.118 -17.833 24.909 677 HA ASN 84 HA ASN 84 24.318 -19.488 25.863 678 HB2 ASN 84 2HB ASN 84 23.650 -19.439 23.503 679 HB3 ASN 84 3HB ASN 84 23.997 -17.707 23.416 680 HD21 ASN 84 2HD2 ASN 84 26.133 -16.988 23.208 681 HD22 ASN 84 1HD2 ASN 84 27.477 -18.092 23.007 682 H TYR 85 H TYR 85 23.534 -16.035 25.759 683 HA TYR 85 HA TYR 85 26.205 -15.049 26.120 684 HB2 TYR 85 2HB TYR 85 24.333 -13.755 25.205 685 HB3 TYR 85 3HB TYR 85 23.467 -13.877 26.734 686 HD1 TYR 85 HD1 TYR 85 26.530 -12.478 25.119 687 HD2 TYR 85 HD2 TYR 85 23.841 -12.309 28.471 688 HE1 TYR 85 HE1 TYR 85 27.515 -10.309 25.792 689 HE2 TYR 85 HE2 TYR 85 24.859 -10.157 29.180 690 HH TYR 85 HH TYR 85 27.484 -8.590 27.308 691 H LEU 86 H LEU 86 23.588 -16.015 28.363 692 HA LEU 86 HA LEU 86 24.981 -14.960 30.683 693 HB2 LEU 86 2HB LEU 86 22.601 -16.825 30.365 694 HB3 LEU 86 3HB LEU 86 23.170 -16.200 31.922 695 HG LEU 86 HG LEU 86 22.241 -14.450 29.604 696 HD11 LEU 86 1HD1 LEU 86 20.407 -15.773 30.602 697 HD12 LEU 86 2HD1 LEU 86 20.890 -15.230 32.226 698 HD13 LEU 86 3HD1 LEU 86 20.262 -14.062 31.047 699 HD21 LEU 86 3HD2 LEU 86 22.982 -13.816 32.493 700 HD22 LEU 86 1HD2 LEU 86 23.856 -13.284 31.034 701 HD23 LEU 86 2HD2 LEU 86 22.224 -12.677 31.361 702 H VAL 87 H VAL 87 24.933 -18.126 29.033 703 HA VAL 87 HA VAL 87 26.381 -19.317 31.310 704 HB VAL 87 HB VAL 87 26.381 -21.368 30.001 705 HG11 VAL 87 1HG1 VAL 87 23.658 -19.991 30.007 706 HG12 VAL 87 2HG1 VAL 87 23.957 -21.745 29.968 707 HG13 VAL 87 3HG1 VAL 87 24.419 -20.799 31.397 708 HG21 VAL 87 3HG2 VAL 87 24.974 -19.737 27.853 709 HG22 VAL 87 1HG2 VAL 87 26.604 -20.439 27.734 710 HG23 VAL 87 2HG2 VAL 87 25.185 -21.501 27.848 711 H ALA 88 H ALA 88 27.134 -17.669 28.336 712 HA ALA 88 HA ALA 88 29.793 -18.815 28.073 713 HB1 ALA 88 1HB ALA 88 28.547 -16.289 26.904 714 HB2 ALA 88 2HB ALA 88 30.086 -17.006 26.398 715 HB3 ALA 88 3HB ALA 88 28.575 -17.900 26.134 716 H GLN 89 H GLN 89 28.403 -16.564 30.233 717 HA GLN 89 HA GLN 89 31.123 -15.502 30.872 718 HB2 GLN 89 2HB GLN 89 28.403 -14.260 31.408 719 HB3 GLN 89 3HB GLN 89 29.985 -13.560 31.827 720 HG2 GLN 89 2HG GLN 89 30.592 -13.541 29.408 721 HG3 GLN 89 3HG GLN 89 28.991 -14.182 29.012 722 HE21 GLN 89 2HE2 GLN 89 28.886 -12.166 27.657 723 HE22 GLN 89 1HE2 GLN 89 28.361 -10.688 28.438 724 H GLY 90 H GLY 90 28.394 -17.376 31.993 725 HA2 GLY 90 2HA GLY 90 29.128 -17.150 34.815 726 HA3 GLY 90 3HA GLY 90 27.866 -18.180 34.100 727 H ARG 91 H ARG 91 30.124 -19.077 32.089 728 HA ARG 91 HA ARG 91 31.145 -21.217 33.861 729 HB2 ARG 91 2HB ARG 91 30.857 -21.080 30.841 730 HB3 ARG 91 3HB ARG 91 31.548 -22.441 31.745 731 HG2 ARG 91 2HG ARG 91 29.435 -22.685 33.019 732 HG3 ARG 91 3HG ARG 91 28.713 -21.366 32.079 733 HD2 ARG 91 2HD ARG 91 29.782 -23.972 30.929 734 HD3 ARG 91 3HD ARG 91 28.070 -23.590 31.197 735 HE ARG 91 HE ARG 91 29.109 -21.517 29.620 736 HH11 ARG 91 1HH1 ARG 91 28.593 -25.000 29.350 737 HH12 ARG 91 2HH1 ARG 91 28.409 -24.964 27.611 738 HH21 ARG 91 1HH2 ARG 91 28.882 -21.494 27.342 739 HH22 ARG 91 2HH2 ARG 91 28.574 -22.979 26.479 740 H ARG 92 H ARG 92 32.280 -18.301 33.117 741 HA ARG 92 HA ARG 92 34.982 -19.150 32.277 742 HB2 ARG 92 2HB ARG 92 33.734 -16.413 32.715 743 HB3 ARG 92 3HB ARG 92 35.420 -16.688 32.234 744 HG2 ARG 92 2HG ARG 92 34.647 -17.907 30.211 745 HG3 ARG 92 3HG ARG 92 32.964 -17.599 30.685 746 HD2 ARG 92 2HD ARG 92 33.661 -15.963 29.013 747 HD3 ARG 92 3HD ARG 92 33.389 -15.156 30.566 748 HE ARG 92 HE ARG 92 36.143 -15.910 30.334 749 HH11 ARG 92 1HH1 ARG 92 33.809 -13.601 29.035 750 HH12 ARG 92 2HH1 ARG 92 35.021 -12.386 28.695 751 HH21 ARG 92 1HH2 ARG 92 37.708 -14.316 29.870 752 HH22 ARG 92 2HH2 ARG 92 37.223 -12.796 29.149 753 H LEU 93 H LEU 93 33.371 -19.062 35.177 754 HA LEU 93 HA LEU 93 35.932 -18.752 36.628 755 HB2 LEU 93 2HB LEU 93 34.714 -16.579 36.650 756 HB3 LEU 93 3HB LEU 93 33.330 -17.381 37.411 757 HG LEU 93 HG LEU 93 34.675 -17.881 39.405 758 HD11 LEU 93 1HD1 LEU 93 36.916 -16.458 37.899 759 HD12 LEU 93 2HD1 LEU 93 36.961 -16.909 39.620 760 HD13 LEU 93 3HD1 LEU 93 36.900 -18.172 38.381 761 HD21 LEU 93 3HD2 LEU 93 34.963 -14.992 38.500 762 HD22 LEU 93 1HD2 LEU 93 33.511 -15.710 39.234 763 HD23 LEU 93 2HD2 LEU 93 35.012 -15.581 40.182 764 H GLU 94 H GLU 94 33.098 -20.539 36.005 765 HA GLU 94 HA GLU 94 33.013 -21.744 38.698 766 HB2 GLU 94 2HB GLU 94 30.906 -21.150 37.574 767 HB3 GLU 94 3HB GLU 94 31.315 -22.231 36.225 768 HG2 GLU 94 2HG GLU 94 31.360 -24.155 37.782 769 HG3 GLU 94 3HG GLU 94 30.987 -23.071 39.135 770 H LEU 95 H LEU 95 34.033 -23.521 39.193 771 HA LEU 95 HA LEU 95 34.877 -25.436 37.087 772 HB2 LEU 95 2HB LEU 95 36.605 -24.293 39.321 773 HB3 LEU 95 3HB LEU 95 37.077 -25.649 38.289 774 HG LEU 95 HG LEU 95 36.464 -22.844 37.261 775 HD11 LEU 95 1HD1 LEU 95 39.108 -24.278 37.731 776 HD12 LEU 95 2HD1 LEU 95 38.905 -22.683 36.964 777 HD13 LEU 95 3HD1 LEU 95 38.480 -22.913 38.679 778 HD21 LEU 95 3HD2 LEU 95 37.697 -25.307 35.942 779 HD22 LEU 95 1HD2 LEU 95 36.099 -24.622 35.568 780 HD23 LEU 95 2HD2 LEU 95 37.568 -23.697 35.199 781 H VAL 96 H VAL 96 32.866 -25.087 39.524 782 HA VAL 96 HA VAL 96 33.384 -27.776 40.679 783 HB VAL 96 HB VAL 96 32.604 -26.881 42.866 784 HG11 VAL 96 1HG1 VAL 96 35.058 -25.456 41.756 785 HG12 VAL 96 2HG1 VAL 96 34.703 -25.767 43.468 786 HG13 VAL 96 3HG1 VAL 96 35.025 -27.127 42.373 787 HG21 VAL 96 3HG2 VAL 96 32.937 -24.150 41.558 788 HG22 VAL 96 1HG2 VAL 96 31.390 -24.883 42.046 789 HG23 VAL 96 2HG2 VAL 96 32.606 -24.466 43.272 790 HA PRO 97 HA PRO 97 29.120 -28.455 39.772 791 HB2 PRO 97 2HB PRO 97 28.390 -30.282 41.665 792 HB3 PRO 97 3HB PRO 97 29.560 -30.663 40.357 793 HG2 PRO 97 2HG PRO 97 30.175 -29.787 43.194 794 HG3 PRO 97 3HG PRO 97 30.838 -31.202 42.311 795 HD2 PRO 97 2HD PRO 97 32.204 -28.863 42.422 796 HD3 PRO 97 3HD PRO 97 32.168 -29.822 40.913 797 H ARG 98 H ARG 98 26.908 -28.343 40.737 798 HA ARG 98 HA ARG 98 26.796 -26.357 42.953 799 HB2 ARG 98 2HB ARG 98 26.451 -25.411 40.684 800 HB3 ARG 98 3HB ARG 98 25.083 -26.497 40.444 801 HG2 ARG 98 2HG ARG 98 24.409 -24.196 41.000 802 HG3 ARG 98 3HG ARG 98 23.801 -25.346 42.185 803 HD2 ARG 98 2HD ARG 98 26.379 -23.785 42.595 804 HD3 ARG 98 3HD ARG 98 24.792 -23.138 43.051 805 HE ARG 98 HE ARG 98 24.850 -25.624 44.241 806 HH11 ARG 98 1HH1 ARG 98 26.873 -22.731 44.370 807 HH12 ARG 98 2HH1 ARG 98 27.394 -23.015 46.013 808 HH21 ARG 98 1HH2 ARG 98 25.530 -25.975 46.391 809 HH22 ARG 98 2HH2 ARG 98 26.637 -24.860 47.155 810 H GLY 99 H GLY 99 26.279 -29.493 42.422 811 HA2 GLY 99 2HA GLY 99 25.065 -31.005 43.715 812 HA3 GLY 99 3HA GLY 99 24.128 -29.669 44.395 813 H SER 100 H SER 100 22.287 -31.146 44.086 814 HA SER 100 HA SER 100 21.112 -30.847 41.379 815 HB2 SER 100 2HB SER 100 22.185 -33.083 41.492 816 HB3 SER 100 3HB SER 100 21.228 -33.456 42.941 817 HG SER 100 HG SER 100 20.284 -34.226 40.981 818 H HIS 101 H HIS 101 18.758 -31.292 41.398 819 HA HIS 101 HA HIS 101 17.532 -30.061 43.750 820 HB2 HIS 101 2HB HIS 101 15.546 -29.949 42.333 821 HB3 HIS 101 3HB HIS 101 16.959 -29.312 41.481 822 HD2 HIS 101 HD2 HIS 101 14.379 -32.129 41.367 823 HE1 HIS 101 HE1 HIS 101 16.846 -32.647 37.941 824 HE2 HIS 101 HE2 HIS 101 14.721 -33.427 39.116 825 H HIS 102 H HIS 102 18.400 -33.182 43.088 826 HA HIS 102 HA HIS 102 16.270 -34.245 44.853 827 HB2 HIS 102 2HB HIS 102 15.547 -34.695 42.538 828 HB3 HIS 102 3HB HIS 102 17.099 -35.478 42.200 829 HD2 HIS 102 HD2 HIS 102 16.904 -38.043 42.272 830 HE1 HIS 102 HE1 HIS 102 13.937 -38.489 45.289 831 HE2 HIS 102 HE2 HIS 102 15.458 -39.731 43.668 832 H HIS 103 H HIS 103 16.880 -36.176 45.960 833 HA HIS 103 HA HIS 103 19.639 -37.144 45.730 834 HB2 HIS 103 2HB HIS 103 19.821 -35.117 47.157 835 HB3 HIS 103 3HB HIS 103 18.607 -35.796 48.253 836 HD2 HIS 103 HD2 HIS 103 19.716 -36.790 50.352 837 HE1 HIS 103 HE1 HIS 103 23.332 -38.272 48.676 838 HE2 HIS 103 HE2 HIS 103 21.971 -38.039 50.814 839 H HIS 104 H HIS 104 20.003 -39.020 47.178 840 HA HIS 104 HA HIS 104 17.575 -40.265 48.297 841 HB2 HIS 104 2HB HIS 104 17.937 -42.338 47.048 842 HB3 HIS 104 3HB HIS 104 17.580 -40.995 45.963 843 HD2 HIS 104 HD2 HIS 104 20.121 -43.682 46.605 844 HE1 HIS 104 HE1 HIS 104 21.973 -41.098 43.779 845 HE2 HIS 104 HE2 HIS 104 22.130 -43.354 44.953 846 H HIS 105 H HIS 105 18.063 -42.166 49.580 847 HA HIS 105 HA HIS 105 19.092 -43.047 51.390 848 HB2 HIS 105 2HB HIS 105 21.564 -42.827 49.650 849 HB3 HIS 105 3HB HIS 105 21.406 -43.818 51.101 850 HD2 HIS 105 HD2 HIS 105 22.077 -45.178 48.323 851 HE1 HIS 105 HE1 HIS 105 18.068 -46.591 48.356 852 HE2 HIS 105 HE2 HIS 105 20.385 -46.921 47.351 853 H HIS 106 H HIS 106 21.309 -42.788 52.820 854 HA HIS 106 HA HIS 106 21.288 -39.914 53.598 855 HB2 HIS 106 2HB HIS 106 21.881 -42.401 55.236 856 HB3 HIS 106 3HB HIS 106 21.938 -40.741 55.830 857 HD2 HIS 106 HD2 HIS 106 19.559 -43.606 55.243 858 HE1 HIS 106 HE1 HIS 106 17.090 -40.293 56.245 859 HE2 HIS 106 HE2 HIS 106 17.148 -42.814 55.900 Start of MODEL 17 1 H1 MET 1 H1 MET 1 -2.231 1.970 3.405 2 H2 MET 1 H2 MET 1 -1.454 3.416 3.527 3 H3 MET 1 H3 MET 1 -1.660 2.479 4.865 4 HA MET 1 HA MET 1 0.584 2.376 4.114 5 HB2 MET 1 2HB MET 1 0.796 -0.080 3.986 6 HB3 MET 1 3HB MET 1 -0.306 0.440 5.262 7 HG2 MET 1 2HG MET 1 -1.295 -1.436 4.212 8 HG3 MET 1 3HG MET 1 -2.243 -0.025 3.743 9 HE1 MET 1 1HE MET 1 -3.456 -1.462 1.920 10 HE2 MET 1 2HE MET 1 -2.610 -2.429 0.690 11 HE3 MET 1 3HE MET 1 -2.494 -2.877 2.409 12 H SER 2 H SER 2 2.023 1.158 2.476 13 HA SER 2 HA SER 2 0.979 1.336 -0.290 14 HB2 SER 2 2HB SER 2 3.464 2.786 0.697 15 HB3 SER 2 3HB SER 2 2.906 2.694 -0.984 16 HG SER 2 HG SER 2 1.009 3.792 -0.337 17 H GLU 3 H GLU 3 2.522 0.369 -1.867 18 HA GLU 3 HA GLU 3 3.552 -2.123 -0.804 19 HB2 GLU 3 2HB GLU 3 3.720 -0.889 -3.576 20 HB3 GLU 3 3HB GLU 3 4.175 -2.548 -3.164 21 HG2 GLU 3 2HG GLU 3 1.393 -1.351 -2.843 22 HG3 GLU 3 3HG GLU 3 1.910 -2.413 -4.153 23 H GLN 4 H GLN 4 5.616 -2.730 -0.399 24 HA GLN 4 HA GLN 4 7.898 -1.199 -1.364 25 HB2 GLN 4 2HB GLN 4 8.789 -0.704 0.871 26 HB3 GLN 4 3HB GLN 4 7.287 0.179 0.559 27 HG2 GLN 4 2HG GLN 4 6.014 -1.500 1.871 28 HG3 GLN 4 3HG GLN 4 7.499 -2.410 2.165 29 HE21 GLN 4 2HE2 GLN 4 6.231 -1.775 4.397 30 HE22 GLN 4 1HE2 GLN 4 6.967 -0.415 5.219 31 H LEU 5 H LEU 5 9.897 -2.070 0.040 32 HA LEU 5 HA LEU 5 10.102 -4.886 -0.598 33 HB2 LEU 5 2HB LEU 5 11.989 -3.055 0.924 34 HB3 LEU 5 3HB LEU 5 12.388 -4.613 0.220 35 HG LEU 5 HG LEU 5 13.296 -2.820 -1.097 36 HD11 LEU 5 1HD1 LEU 5 12.620 -4.863 -2.263 37 HD12 LEU 5 2HD1 LEU 5 10.989 -4.183 -2.540 38 HD13 LEU 5 3HD1 LEU 5 12.413 -3.447 -3.308 39 HD21 LEU 5 3HD2 LEU 5 12.095 -1.175 -2.279 40 HD22 LEU 5 1HD2 LEU 5 10.531 -1.855 -1.844 41 HD23 LEU 5 2HD2 LEU 5 11.552 -1.080 -0.588 42 H THR 6 H THR 6 10.593 -6.582 0.857 43 HA THR 6 HA THR 6 9.842 -6.164 3.704 44 HB THR 6 HB THR 6 8.584 -8.255 1.885 45 HG1 THR 6 1HG THR 6 6.740 -6.979 2.098 46 HG21 THR 6 1HG2 THR 6 8.586 -9.075 4.135 47 HG22 THR 6 2HG2 THR 6 8.170 -7.475 4.796 48 HG23 THR 6 3HG2 THR 6 6.971 -8.403 3.856 49 H ASP 7 H ASP 7 10.195 -8.357 4.905 50 HA ASP 7 HA ASP 7 12.909 -9.041 4.747 51 HB2 ASP 7 2HB ASP 7 12.327 -10.851 6.298 52 HB3 ASP 7 3HB ASP 7 11.504 -9.346 6.724 53 H GLN 8 H GLN 8 10.305 -10.153 2.732 54 HA GLN 8 HA GLN 8 11.398 -12.686 1.978 55 HB2 GLN 8 2HB GLN 8 9.082 -12.049 1.498 56 HB3 GLN 8 3HB GLN 8 9.628 -10.688 0.508 57 HG2 GLN 8 2HG GLN 8 8.927 -12.558 -0.903 58 HG3 GLN 8 3HG GLN 8 10.660 -12.258 -1.104 59 HE21 GLN 8 2HE2 GLN 8 12.185 -13.745 -0.146 60 HE22 GLN 8 1HE2 GLN 8 11.695 -15.379 0.259 61 H VAL 9 H VAL 9 11.638 -9.417 0.453 62 HA VAL 9 HA VAL 9 13.583 -10.444 -1.482 63 HB VAL 9 HB VAL 9 11.872 -8.997 -2.305 64 HG11 VAL 9 1HG1 VAL 9 12.843 -6.910 -0.316 65 HG12 VAL 9 2HG1 VAL 9 11.607 -6.673 -1.567 66 HG13 VAL 9 3HG1 VAL 9 11.297 -7.808 -0.240 67 HG21 VAL 9 3HG2 VAL 9 14.450 -7.385 -2.130 68 HG22 VAL 9 1HG2 VAL 9 14.170 -8.729 -3.269 69 HG23 VAL 9 2HG2 VAL 9 13.191 -7.248 -3.374 70 H LEU 10 H LEU 10 13.583 -8.644 1.550 71 HA LEU 10 HA LEU 10 16.235 -7.556 1.248 72 HB2 LEU 10 2HB LEU 10 14.210 -7.896 3.433 73 HB3 LEU 10 3HB LEU 10 15.905 -7.707 3.919 74 HG LEU 10 HG LEU 10 16.107 -5.630 2.689 75 HD11 LEU 10 1HD1 LEU 10 14.188 -4.538 1.645 76 HD12 LEU 10 2HD1 LEU 10 14.579 -6.056 0.820 77 HD13 LEU 10 3HD1 LEU 10 13.188 -5.981 1.940 78 HD21 LEU 10 3HD2 LEU 10 14.531 -4.256 4.023 79 HD22 LEU 10 1HD2 LEU 10 13.570 -5.711 4.382 80 HD23 LEU 10 2HD2 LEU 10 15.224 -5.560 5.013 81 H VAL 11 H VAL 11 14.964 -10.726 2.331 82 HA VAL 11 HA VAL 11 17.585 -11.500 3.364 83 HB VAL 11 HB VAL 11 14.997 -13.010 2.917 84 HG11 VAL 11 1HG1 VAL 11 16.109 -14.849 4.206 85 HG12 VAL 11 2HG1 VAL 11 16.808 -14.619 2.592 86 HG13 VAL 11 3HG1 VAL 11 17.661 -13.996 4.023 87 HG21 VAL 11 3HG2 VAL 11 16.580 -12.233 5.420 88 HG22 VAL 11 1HG2 VAL 11 15.154 -11.362 4.821 89 HG23 VAL 11 2HG2 VAL 11 14.991 -13.039 5.380 90 H GLU 12 H GLU 12 15.837 -11.694 0.266 91 HA GLU 12 HA GLU 12 17.552 -13.708 -0.880 92 HB2 GLU 12 2HB GLU 12 15.741 -11.561 -2.022 93 HB3 GLU 12 3HB GLU 12 16.675 -12.662 -3.046 94 HG2 GLU 12 2HG GLU 12 15.617 -14.611 -1.976 95 HG3 GLU 12 3HG GLU 12 14.652 -13.540 -0.950 96 H ARG 13 H ARG 13 17.734 -10.102 -0.723 97 HA ARG 13 HA ARG 13 19.939 -10.180 -2.632 98 HB2 ARG 13 2HB ARG 13 19.920 -7.809 -2.568 99 HB3 ARG 13 3HB ARG 13 18.253 -8.405 -2.671 100 HG2 ARG 13 2HG ARG 13 18.001 -8.035 -0.212 101 HG3 ARG 13 3HG ARG 13 19.680 -7.438 -0.160 102 HD2 ARG 13 2HD ARG 13 18.025 -5.568 -0.286 103 HD3 ARG 13 3HD ARG 13 19.122 -5.617 -1.684 104 HE ARG 13 HE ARG 13 16.708 -7.093 -2.219 105 HH11 ARG 13 1HH1 ARG 13 17.950 -3.793 -1.922 106 HH12 ARG 13 2HH1 ARG 13 16.779 -3.127 -3.033 107 HH21 ARG 13 1HH2 ARG 13 15.195 -6.191 -3.687 108 HH22 ARG 13 2HH2 ARG 13 15.218 -4.477 -4.012 109 H VAL 14 H VAL 14 19.689 -10.111 0.913 110 HA VAL 14 HA VAL 14 22.470 -9.365 1.264 111 HB VAL 14 HB VAL 14 22.222 -10.251 3.535 112 HG11 VAL 14 1HG1 VAL 14 19.946 -8.511 2.534 113 HG12 VAL 14 2HG1 VAL 14 20.306 -8.787 4.253 114 HG13 VAL 14 3HG1 VAL 14 21.506 -7.988 3.207 115 HG21 VAL 14 3HG2 VAL 14 19.463 -11.093 2.626 116 HG22 VAL 14 1HG2 VAL 14 20.792 -12.174 3.148 117 HG23 VAL 14 2HG2 VAL 14 20.047 -11.054 4.312 118 H GLN 15 H GLN 15 20.760 -12.329 0.424 119 HA GLN 15 HA GLN 15 23.069 -14.055 0.852 120 HB2 GLN 15 2HB GLN 15 20.425 -14.379 -0.620 121 HB3 GLN 15 3HB GLN 15 21.649 -15.659 -0.502 122 HG2 GLN 15 2HG GLN 15 21.508 -15.669 1.928 123 HG3 GLN 15 3HG GLN 15 20.410 -14.298 1.929 124 HE21 GLN 15 2HE2 GLN 15 19.621 -16.566 3.246 125 HE22 GLN 15 1HE2 GLN 15 18.333 -17.362 2.361 126 H LYS 16 H LYS 16 21.933 -11.881 -1.647 127 HA LYS 16 HA LYS 16 23.702 -13.041 -3.689 128 HB2 LYS 16 2HB LYS 16 21.767 -10.712 -3.675 129 HB3 LYS 16 3HB LYS 16 22.769 -11.159 -5.073 130 HG2 LYS 16 2HG LYS 16 21.782 -13.368 -5.192 131 HG3 LYS 16 3HG LYS 16 20.903 -13.126 -3.678 132 HD2 LYS 16 2HD LYS 16 19.685 -11.200 -4.743 133 HD3 LYS 16 3HD LYS 16 20.442 -11.634 -6.292 134 HE2 LYS 16 2HE LYS 16 19.469 -13.916 -6.105 135 HE3 LYS 16 3HE LYS 16 18.717 -13.461 -4.562 136 HZ1 LYS 16 3HZ LYS 16 17.180 -13.286 -6.394 137 HZ2 LYS 16 1HZ LYS 16 17.452 -11.799 -5.744 138 HZ3 LYS 16 2HZ LYS 16 18.153 -12.216 -7.173 139 H GLY 17 H GLY 17 24.037 -10.872 -1.077 140 HA2 GLY 17 2HA GLY 17 26.416 -10.434 -0.640 141 HA3 GLY 17 3HA GLY 17 26.575 -9.892 -2.317 142 H ASP 18 H ASP 18 23.579 -8.676 -1.227 143 HA ASP 18 HA ASP 18 24.820 -6.041 -0.835 144 HB2 ASP 18 2HB ASP 18 21.943 -6.990 -1.089 145 HB3 ASP 18 3HB ASP 18 22.413 -5.314 -0.839 146 H GLN 19 H GLN 19 25.874 -6.476 1.206 147 HA GLN 19 HA GLN 19 24.453 -7.371 3.515 148 HB2 GLN 19 2HB GLN 19 26.934 -7.361 3.065 149 HB3 GLN 19 3HB GLN 19 26.948 -5.625 3.364 150 HG2 GLN 19 2HG GLN 19 25.948 -7.696 5.371 151 HG3 GLN 19 3HG GLN 19 27.634 -7.170 5.276 152 HE21 GLN 19 2HE2 GLN 19 27.712 -4.535 5.084 153 HE22 GLN 19 1HE2 GLN 19 26.838 -3.755 6.386 154 H LYS 20 H LYS 20 24.682 -4.283 1.876 155 HA LYS 20 HA LYS 20 23.947 -2.504 3.948 156 HB2 LYS 20 2HB LYS 20 23.244 -1.046 2.101 157 HB3 LYS 20 3HB LYS 20 24.766 -1.862 1.695 158 HG2 LYS 20 2HG LYS 20 23.437 -3.577 0.411 159 HG3 LYS 20 3HG LYS 20 21.967 -2.635 0.747 160 HD2 LYS 20 2HD LYS 20 22.989 -0.680 -0.420 161 HD3 LYS 20 3HD LYS 20 24.422 -1.676 -0.774 162 HE2 LYS 20 2HE LYS 20 22.974 -3.301 -1.983 163 HE3 LYS 20 3HE LYS 20 21.566 -2.281 -1.655 164 HZ1 LYS 20 3HZ LYS 20 22.610 -0.530 -2.925 165 HZ2 LYS 20 1HZ LYS 20 23.927 -1.467 -3.219 166 HZ3 LYS 20 2HZ LYS 20 22.466 -1.886 -3.840 167 H ALA 21 H ALA 21 22.075 -4.936 2.226 168 HA ALA 21 HA ALA 21 19.513 -3.734 2.957 169 HB1 ALA 21 1HB ALA 21 18.591 -5.743 1.882 170 HB2 ALA 21 2HB ALA 21 19.801 -4.948 0.839 171 HB3 ALA 21 3HB ALA 21 20.222 -6.430 1.744 172 H PHE 22 H PHE 22 21.824 -5.960 4.387 173 HA PHE 22 HA PHE 22 19.857 -7.218 6.125 174 HB2 PHE 22 2HB PHE 22 21.998 -8.308 5.512 175 HB3 PHE 22 3HB PHE 22 22.882 -7.054 6.370 176 HD1 PHE 22 HD1 PHE 22 20.091 -9.519 6.889 177 HD2 PHE 22 HD2 PHE 22 23.437 -7.452 8.632 178 HE1 PHE 22 HE1 PHE 22 19.787 -10.800 8.980 179 HE2 PHE 22 HE2 PHE 22 23.126 -8.741 10.734 180 HZ PHE 22 HZ PHE 22 21.305 -10.418 10.904 181 H ASN 23 H ASN 23 22.056 -4.409 6.239 182 HA ASN 23 HA ASN 23 21.689 -3.728 8.987 183 HB2 ASN 23 2HB ASN 23 23.450 -2.725 7.719 184 HB3 ASN 23 3HB ASN 23 22.338 -2.227 6.439 185 HD21 ASN 23 2HD2 ASN 23 21.286 -0.274 6.554 186 HD22 ASN 23 1HD2 ASN 23 21.461 0.838 7.889 187 H LEU 24 H LEU 24 19.888 -2.902 6.010 188 HA LEU 24 HA LEU 24 17.940 -1.264 7.387 189 HB2 LEU 24 2HB LEU 24 17.954 -2.582 4.642 190 HB3 LEU 24 3HB LEU 24 16.754 -1.394 5.184 191 HG LEU 24 HG LEU 24 19.752 -0.867 5.027 192 HD11 LEU 24 1HD1 LEU 24 19.186 0.467 3.029 193 HD12 LEU 24 2HD1 LEU 24 18.740 -1.240 2.805 194 HD13 LEU 24 3HD1 LEU 24 17.486 -0.033 3.172 195 HD21 LEU 24 3HD2 LEU 24 19.068 1.504 5.246 196 HD22 LEU 24 1HD2 LEU 24 17.379 0.986 5.481 197 HD23 LEU 24 2HD2 LEU 24 18.630 0.559 6.676 198 H LEU 25 H LEU 25 18.343 -4.693 6.935 199 HA LEU 25 HA LEU 25 15.505 -5.285 7.381 200 HB2 LEU 25 2HB LEU 25 16.884 -6.705 5.924 201 HB3 LEU 25 3HB LEU 25 17.996 -7.032 7.257 202 HG LEU 25 HG LEU 25 16.146 -8.152 8.502 203 HD11 LEU 25 1HD1 LEU 25 14.207 -6.995 7.489 204 HD12 LEU 25 2HD1 LEU 25 14.596 -7.735 5.910 205 HD13 LEU 25 3HD1 LEU 25 14.088 -8.753 7.276 206 HD21 LEU 25 3HD2 LEU 25 16.048 -10.133 7.009 207 HD22 LEU 25 1HD2 LEU 25 16.655 -9.143 5.661 208 HD23 LEU 25 2HD2 LEU 25 17.685 -9.437 7.081 209 H VAL 26 H VAL 26 18.581 -5.489 9.316 210 HA VAL 26 HA VAL 26 17.182 -6.686 11.517 211 HB VAL 26 HB VAL 26 19.143 -6.315 12.830 212 HG11 VAL 26 1HG1 VAL 26 20.821 -7.456 11.465 213 HG12 VAL 26 2HG1 VAL 26 19.202 -8.165 11.237 214 HG13 VAL 26 3HG1 VAL 26 19.902 -7.103 9.995 215 HG21 VAL 26 3HG2 VAL 26 20.137 -4.537 10.581 216 HG22 VAL 26 1HG2 VAL 26 19.716 -4.043 12.248 217 HG23 VAL 26 2HG2 VAL 26 21.105 -5.101 11.965 218 H VAL 27 H VAL 27 17.521 -3.309 10.506 219 HA VAL 27 HA VAL 27 17.010 -2.270 13.144 220 HB VAL 27 HB VAL 27 18.092 -0.963 11.384 221 HG11 VAL 27 1HG1 VAL 27 16.773 -1.723 9.450 222 HG12 VAL 27 2HG1 VAL 27 15.335 -0.880 10.085 223 HG13 VAL 27 3HG1 VAL 27 16.769 0.044 9.576 224 HG21 VAL 27 3HG2 VAL 27 16.910 1.146 11.789 225 HG22 VAL 27 1HG2 VAL 27 15.459 0.269 12.309 226 HG23 VAL 27 2HG2 VAL 27 16.956 0.169 13.269 227 H ARG 28 H ARG 28 14.922 -3.558 10.586 228 HA ARG 28 HA ARG 28 12.454 -2.488 11.621 229 HB2 ARG 28 2HB ARG 28 12.891 -5.129 10.158 230 HB3 ARG 28 3HB ARG 28 11.396 -4.187 10.245 231 HG2 ARG 28 2HG ARG 28 12.533 -2.347 8.956 232 HG3 ARG 28 3HG ARG 28 13.989 -3.366 8.879 233 HD2 ARG 28 2HD ARG 28 12.823 -3.616 6.805 234 HD3 ARG 28 3HD ARG 28 12.653 -5.127 7.709 235 HE ARG 28 HE ARG 28 10.376 -3.941 8.432 236 HH11 ARG 28 1HH1 ARG 28 11.883 -3.998 5.228 237 HH12 ARG 28 2HH1 ARG 28 10.353 -3.906 4.384 238 HH21 ARG 28 1HH2 ARG 28 8.409 -3.807 7.296 239 HH22 ARG 28 2HH2 ARG 28 8.401 -3.792 5.549 240 H TYR 29 H TYR 29 14.540 -5.198 12.406 241 HA TYR 29 HA TYR 29 12.569 -6.248 14.367 242 HB2 TYR 29 2HB TYR 29 15.111 -7.412 13.186 243 HB3 TYR 29 3HB TYR 29 14.157 -8.173 14.441 244 HD1 TYR 29 HD1 TYR 29 13.942 -6.940 10.927 245 HD2 TYR 29 HD2 TYR 29 12.242 -9.420 13.984 246 HE1 TYR 29 HE1 TYR 29 12.374 -7.878 9.257 247 HE2 TYR 29 HE2 TYR 29 10.671 -10.399 12.335 248 HH TYR 29 HH TYR 29 10.633 -9.350 8.895 249 H GLN 30 H GLN 30 15.219 -4.105 14.347 250 HA GLN 30 HA GLN 30 16.648 -5.007 16.627 251 HB2 GLN 30 2HB GLN 30 17.425 -3.377 14.936 252 HB3 GLN 30 3HB GLN 30 16.286 -2.179 15.569 253 HG2 GLN 30 2HG GLN 30 17.451 -2.173 17.717 254 HG3 GLN 30 3HG GLN 30 18.497 -3.510 17.190 255 HE21 GLN 30 2HE2 GLN 30 19.577 -3.030 14.918 256 HE22 GLN 30 1HE2 GLN 30 20.332 -1.451 14.801 257 H HIS 31 H HIS 31 13.661 -3.130 16.301 258 HA HIS 31 HA HIS 31 13.545 -2.593 19.190 259 HB2 HIS 31 2HB HIS 31 11.573 -2.129 16.928 260 HB3 HIS 31 3HB HIS 31 11.364 -1.583 18.595 261 HD2 HIS 31 HD2 HIS 31 13.197 0.305 19.486 262 HE1 HIS 31 HE1 HIS 31 14.325 1.607 15.593 263 HE2 HIS 31 HE2 HIS 31 14.427 2.150 18.087 264 H LYS 32 H LYS 32 12.207 -4.933 16.856 265 HA LYS 32 HA LYS 32 10.160 -5.872 18.712 266 HB2 LYS 32 2HB LYS 32 11.212 -7.025 16.098 267 HB3 LYS 32 3HB LYS 32 9.746 -7.555 16.952 268 HG2 LYS 32 2HG LYS 32 8.751 -5.326 16.687 269 HG3 LYS 32 3HG LYS 32 10.217 -4.748 15.861 270 HD2 LYS 32 2HD LYS 32 9.881 -6.401 14.064 271 HD3 LYS 32 3HD LYS 32 8.456 -7.045 14.913 272 HE2 LYS 32 2HE LYS 32 7.787 -5.530 13.106 273 HE3 LYS 32 3HE LYS 32 7.315 -4.886 14.689 274 HZ1 LYS 32 3HZ LYS 32 8.323 -3.221 13.244 275 HZ2 LYS 32 1HZ LYS 32 9.195 -3.436 14.619 276 HZ3 LYS 32 2HZ LYS 32 9.733 -4.077 13.209 277 H VAL 33 H VAL 33 13.410 -6.937 17.720 278 HA VAL 33 HA VAL 33 13.320 -9.488 19.066 279 HB VAL 33 HB VAL 33 15.638 -7.701 18.168 280 HG11 VAL 33 1HG1 VAL 33 15.474 -10.664 18.713 281 HG12 VAL 33 2HG1 VAL 33 16.900 -9.787 18.093 282 HG13 VAL 33 3HG1 VAL 33 16.326 -9.498 19.777 283 HG21 VAL 33 3HG2 VAL 33 14.548 -10.215 16.855 284 HG22 VAL 33 1HG2 VAL 33 14.048 -8.582 16.354 285 HG23 VAL 33 2HG2 VAL 33 15.777 -9.081 16.244 286 H ALA 34 H ALA 34 14.426 -6.183 19.873 287 HA ALA 34 HA ALA 34 15.598 -6.836 22.378 288 HB1 ALA 34 1HB ALA 34 14.297 -4.255 21.418 289 HB2 ALA 34 2HB ALA 34 15.402 -4.416 22.804 290 HB3 ALA 34 3HB ALA 34 15.993 -4.724 21.154 291 H SER 35 H SER 35 12.232 -6.534 21.380 292 HA SER 35 HA SER 35 11.198 -5.952 24.021 293 HB2 SER 35 2HB SER 35 10.038 -5.404 21.876 294 HB3 SER 35 3HB SER 35 9.807 -7.143 21.591 295 HG SER 35 HG SER 35 8.001 -6.161 22.626 296 H LEU 36 H LEU 36 11.508 -8.944 22.018 297 HA LEU 36 HA LEU 36 10.328 -10.509 24.188 298 HB2 LEU 36 2HB LEU 36 10.488 -12.386 22.723 299 HB3 LEU 36 3HB LEU 36 9.903 -10.991 21.805 300 HG LEU 36 HG LEU 36 12.465 -10.715 21.166 301 HD11 LEU 36 1HD1 LEU 36 12.236 -13.698 21.795 302 HD12 LEU 36 2HD1 LEU 36 13.570 -12.926 20.907 303 HD13 LEU 36 3HD1 LEU 36 13.333 -12.576 22.626 304 HD21 LEU 36 3HD2 LEU 36 10.675 -12.922 20.068 305 HD22 LEU 36 1HD2 LEU 36 10.637 -11.204 19.597 306 HD23 LEU 36 2HD2 LEU 36 12.069 -12.198 19.233 307 H VAL 37 H VAL 37 13.597 -9.676 23.112 308 HA VAL 37 HA VAL 37 14.716 -11.861 24.685 309 HB VAL 37 HB VAL 37 15.600 -10.932 22.471 310 HG11 VAL 37 1HG1 VAL 37 17.083 -9.125 22.476 311 HG12 VAL 37 2HG1 VAL 37 15.688 -8.524 23.420 312 HG13 VAL 37 3HG1 VAL 37 17.179 -9.071 24.243 313 HG21 VAL 37 3HG2 VAL 37 17.890 -11.527 23.076 314 HG22 VAL 37 1HG2 VAL 37 17.523 -11.296 24.801 315 HG23 VAL 37 2HG2 VAL 37 16.742 -12.614 23.889 316 H SER 38 H SER 38 13.742 -8.582 25.319 317 HA SER 38 HA SER 38 15.429 -8.120 27.599 318 HB2 SER 38 2HB SER 38 14.140 -6.348 26.441 319 HB3 SER 38 3HB SER 38 12.631 -7.103 26.981 320 HG SER 38 HG SER 38 13.308 -5.411 28.367 321 H ARG 39 H ARG 39 12.928 -10.372 26.968 322 HA ARG 39 HA ARG 39 12.079 -10.673 29.757 323 HB2 ARG 39 2HB ARG 39 11.496 -12.419 27.347 324 HB3 ARG 39 3HB ARG 39 10.626 -12.407 28.892 325 HG2 ARG 39 2HG ARG 39 9.898 -10.073 28.475 326 HG3 ARG 39 3HG ARG 39 10.782 -10.070 26.934 327 HD2 ARG 39 2HD ARG 39 9.388 -11.999 26.173 328 HD3 ARG 39 3HD ARG 39 8.438 -11.858 27.669 329 HE ARG 39 HE ARG 39 8.553 -9.320 26.341 330 HH11 ARG 39 1HH1 ARG 39 7.066 -12.514 26.018 331 HH12 ARG 39 2HH1 ARG 39 5.687 -11.907 25.128 332 HH21 ARG 39 1HH2 ARG 39 6.752 -8.559 25.180 333 HH22 ARG 39 2HH2 ARG 39 5.503 -9.668 24.673 334 H TYR 40 H TYR 40 14.835 -11.551 28.056 335 HA TYR 40 HA TYR 40 15.220 -13.961 29.769 336 HB2 TYR 40 2HB TYR 40 16.194 -13.461 26.940 337 HB3 TYR 40 3HB TYR 40 16.664 -14.835 27.945 338 HD1 TYR 40 HD2 TYR 40 14.953 -16.509 28.676 339 HD2 TYR 40 HD1 TYR 40 14.095 -13.458 25.768 340 HE1 TYR 40 HE2 TYR 40 12.956 -17.778 27.935 341 HE2 TYR 40 HE1 TYR 40 12.111 -14.728 25.003 342 HH TYR 40 HH TYR 40 10.809 -16.601 25.318 343 H VAL 41 H VAL 41 16.424 -10.835 28.846 344 HA VAL 41 HA VAL 41 18.609 -11.179 30.804 345 HB VAL 41 HB VAL 41 20.097 -9.780 29.284 346 HG11 VAL 41 1HG1 VAL 41 19.465 -12.594 28.320 347 HG12 VAL 41 2HG1 VAL 41 20.983 -11.701 28.094 348 HG13 VAL 41 3HG1 VAL 41 20.479 -12.191 29.723 349 HG21 VAL 41 3HG2 VAL 41 18.264 -10.824 27.098 350 HG22 VAL 41 1HG2 VAL 41 18.313 -9.130 27.652 351 HG23 VAL 41 2HG2 VAL 41 19.744 -9.866 26.896 352 HA PRO 42 HA PRO 42 17.110 -7.315 32.214 353 HB2 PRO 42 2HB PRO 42 19.341 -6.091 33.230 354 HB3 PRO 42 3HB PRO 42 18.608 -7.548 33.979 355 HG2 PRO 42 2HG PRO 42 20.914 -7.435 32.009 356 HG3 PRO 42 3HG PRO 42 20.866 -8.280 33.592 357 HD2 PRO 42 2HD PRO 42 20.361 -9.622 31.313 358 HD3 PRO 42 3HD PRO 42 19.350 -9.919 32.762 359 H SER 43 H SER 43 17.295 -4.927 31.943 360 HA SER 43 HA SER 43 17.447 -4.330 29.165 361 HB2 SER 43 2HB SER 43 16.899 -2.036 29.905 362 HB3 SER 43 3HB SER 43 15.869 -3.252 30.692 363 HG SER 43 HG SER 43 16.717 -1.701 32.165 364 H GLY 44 H GLY 44 19.972 -4.492 31.475 365 HA2 GLY 44 2HA GLY 44 21.630 -2.409 30.210 366 HA3 GLY 44 3HA GLY 44 22.071 -3.478 31.550 367 H ASP 45 H ASP 45 20.971 -5.828 29.808 368 HA ASP 45 HA ASP 45 23.435 -6.128 28.148 369 HB2 ASP 45 2HB ASP 45 21.827 -8.192 29.683 370 HB3 ASP 45 3HB ASP 45 23.197 -8.550 28.619 371 H VAL 46 H VAL 46 20.105 -5.685 27.968 372 HA VAL 46 HA VAL 46 19.428 -7.663 26.037 373 HB VAL 46 HB VAL 46 17.852 -6.437 27.528 374 HG11 VAL 46 1HG1 VAL 46 18.103 -4.213 25.469 375 HG12 VAL 46 2HG1 VAL 46 16.893 -4.329 26.764 376 HG13 VAL 46 3HG1 VAL 46 18.608 -4.123 27.183 377 HG21 VAL 46 3HG2 VAL 46 17.000 -7.779 25.760 378 HG22 VAL 46 1HG2 VAL 46 16.056 -6.276 25.802 379 HG23 VAL 46 2HG2 VAL 46 17.289 -6.490 24.546 380 HA PRO 47 HA PRO 47 20.147 -4.410 22.686 381 HB2 PRO 47 2HB PRO 47 22.063 -2.514 22.879 382 HB3 PRO 47 3HB PRO 47 20.453 -2.301 23.651 383 HG2 PRO 47 2HG PRO 47 23.019 -3.296 24.937 384 HG3 PRO 47 3HG PRO 47 21.930 -1.992 25.522 385 HD2 PRO 47 2HD PRO 47 21.787 -4.559 26.422 386 HD3 PRO 47 3HD PRO 47 20.322 -3.542 26.249 387 H ASP 48 H ASP 48 22.791 -5.753 24.591 388 HA ASP 48 HA ASP 48 24.616 -5.931 22.318 389 HB2 ASP 48 2HB ASP 48 25.347 -5.608 24.706 390 HB3 ASP 48 3HB ASP 48 24.746 -7.236 25.059 391 H VAL 49 H VAL 49 22.207 -7.958 23.939 392 HA VAL 49 HA VAL 49 23.049 -10.394 22.593 393 HB VAL 49 HB VAL 49 20.553 -9.633 24.158 394 HG11 VAL 49 1HG1 VAL 49 21.468 -12.352 23.132 395 HG12 VAL 49 2HG1 VAL 49 20.108 -12.062 24.249 396 HG13 VAL 49 3HG1 VAL 49 20.032 -11.467 22.576 397 HG21 VAL 49 3HG2 VAL 49 22.677 -9.732 25.452 398 HG22 VAL 49 1HG2 VAL 49 21.582 -11.065 25.888 399 HG23 VAL 49 2HG2 VAL 49 22.972 -11.362 24.816 400 H VAL 50 H VAL 50 20.803 -7.712 21.897 401 HA VAL 50 HA VAL 50 19.536 -9.011 19.636 402 HB VAL 50 HB VAL 50 19.920 -6.104 20.453 403 HG11 VAL 50 1HG1 VAL 50 18.269 -7.262 18.163 404 HG12 VAL 50 2HG1 VAL 50 18.203 -5.581 18.738 405 HG13 VAL 50 3HG1 VAL 50 19.694 -6.206 18.000 406 HG21 VAL 50 3HG2 VAL 50 17.544 -6.244 20.998 407 HG22 VAL 50 1HG2 VAL 50 17.472 -7.906 20.370 408 HG23 VAL 50 2HG2 VAL 50 18.415 -7.550 21.841 409 H GLN 51 H GLN 51 22.532 -7.097 20.140 410 HA GLN 51 HA GLN 51 23.095 -6.889 17.316 411 HB2 GLN 51 2HB GLN 51 24.032 -5.354 19.012 412 HB3 GLN 51 3HB GLN 51 24.957 -6.703 19.716 413 HG2 GLN 51 2HG GLN 51 26.186 -6.992 17.621 414 HG3 GLN 51 3HG GLN 51 25.204 -5.742 16.837 415 HE21 GLN 51 2HE2 GLN 51 27.729 -5.200 16.553 416 HE22 GLN 51 1HE2 GLN 51 28.327 -4.025 17.711 417 H GLU 52 H GLU 52 24.104 -9.198 19.922 418 HA GLU 52 HA GLU 52 25.822 -10.665 18.156 419 HB2 GLU 52 2HB GLU 52 25.979 -10.748 20.634 420 HB3 GLU 52 3HB GLU 52 24.415 -11.588 20.700 421 HG2 GLU 52 2HG GLU 52 25.339 -13.452 19.375 422 HG3 GLU 52 3HG GLU 52 26.882 -12.601 19.221 423 H ALA 53 H ALA 53 22.331 -10.735 18.820 424 HA ALA 53 HA ALA 53 21.862 -13.264 17.548 425 HB1 ALA 53 1HB ALA 53 20.015 -10.880 17.987 426 HB2 ALA 53 2HB ALA 53 19.507 -12.523 17.541 427 HB3 ALA 53 3HB ALA 53 20.270 -12.229 19.117 428 H PHE 54 H PHE 54 22.003 -9.868 16.359 429 HA PHE 54 HA PHE 54 21.217 -10.617 13.669 430 HB2 PHE 54 2HB PHE 54 22.609 -8.159 14.790 431 HB3 PHE 54 3HB PHE 54 22.042 -8.313 13.132 432 HD1 PHE 54 HD1 PHE 54 19.409 -9.872 13.921 433 HD2 PHE 54 HD2 PHE 54 21.244 -6.223 15.305 434 HE1 PHE 54 HE1 PHE 54 17.202 -9.011 14.592 435 HE2 PHE 54 HE2 PHE 54 19.006 -5.352 15.923 436 HZ PHE 54 HZ PHE 54 16.992 -6.751 15.579 437 H ILE 55 H ILE 55 24.368 -10.338 15.357 438 HA ILE 55 HA ILE 55 25.910 -10.597 12.920 439 HB ILE 55 HB ILE 55 26.568 -11.155 15.835 440 HG12 ILE 55 2HG1 ILE 55 27.345 -8.805 14.041 441 HG13 ILE 55 3HG1 ILE 55 25.998 -8.769 15.171 442 HG21 ILE 55 1HG2 ILE 55 28.418 -10.952 13.420 443 HG22 ILE 55 2HG2 ILE 55 28.939 -11.139 15.104 444 HG23 ILE 55 3HG2 ILE 55 28.050 -12.447 14.320 445 HD11 ILE 55 3HD1 ILE 55 27.577 -9.268 17.047 446 HD12 ILE 55 1HD1 ILE 55 28.934 -9.187 15.892 447 HD13 ILE 55 2HD1 ILE 55 27.950 -7.747 16.205 448 H LYS 56 H LYS 56 24.553 -12.841 15.336 449 HA LYS 56 HA LYS 56 25.745 -15.202 14.170 450 HB2 LYS 56 2HB LYS 56 25.124 -14.908 16.550 451 HB3 LYS 56 3HB LYS 56 23.414 -14.810 16.089 452 HG2 LYS 56 2HG LYS 56 23.529 -17.118 15.179 453 HG3 LYS 56 3HG LYS 56 25.241 -17.212 15.650 454 HD2 LYS 56 2HD LYS 56 22.900 -16.725 17.536 455 HD3 LYS 56 3HD LYS 56 23.726 -18.281 17.325 456 HE2 LYS 56 2HE LYS 56 25.854 -17.244 18.082 457 HE3 LYS 56 3HE LYS 56 25.022 -15.695 18.287 458 HZ1 LYS 56 3HZ LYS 56 23.609 -16.726 19.909 459 HZ2 LYS 56 1HZ LYS 56 24.392 -18.168 19.750 460 HZ3 LYS 56 2HZ LYS 56 25.190 -16.861 20.356 461 H ALA 57 H ALA 57 22.709 -13.389 13.748 462 HA ALA 57 HA ALA 57 21.337 -15.480 12.326 463 HB1 ALA 57 1HB ALA 57 20.935 -12.463 12.372 464 HB2 ALA 57 2HB ALA 57 19.825 -13.636 11.631 465 HB3 ALA 57 3HB ALA 57 20.099 -13.671 13.385 466 H TYR 58 H TYR 58 23.342 -12.641 11.269 467 HA TYR 58 HA TYR 58 22.750 -12.893 8.525 468 HB2 TYR 58 2HB TYR 58 23.896 -10.981 9.631 469 HB3 TYR 58 3HB TYR 58 25.329 -11.983 9.860 470 HD1 TYR 58 HD2 TYR 58 22.987 -10.924 7.102 471 HD2 TYR 58 HD1 TYR 58 27.027 -11.820 8.282 472 HE1 TYR 58 HE2 TYR 58 23.787 -10.212 4.873 473 HE2 TYR 58 HE1 TYR 58 27.837 -11.136 6.035 474 HH TYR 58 HH TYR 58 27.260 -10.330 3.968 475 H ARG 59 H ARG 59 25.241 -14.495 10.526 476 HA ARG 59 HA ARG 59 26.587 -15.751 8.300 477 HB2 ARG 59 2HB ARG 59 26.546 -16.352 11.276 478 HB3 ARG 59 3HB ARG 59 27.682 -17.056 10.103 479 HG2 ARG 59 2HG ARG 59 28.645 -14.900 9.617 480 HG3 ARG 59 3HG ARG 59 27.373 -14.047 10.522 481 HD2 ARG 59 2HD ARG 59 28.105 -15.057 12.611 482 HD3 ARG 59 3HD ARG 59 29.302 -16.039 11.758 483 HE ARG 59 HE ARG 59 29.456 -13.156 12.386 484 HH11 ARG 59 1HH1 ARG 59 30.847 -15.871 10.595 485 HH12 ARG 59 2HH1 ARG 59 32.387 -15.077 10.370 486 HH21 ARG 59 1HH2 ARG 59 31.473 -12.139 12.058 487 HH22 ARG 59 2HH2 ARG 59 32.740 -12.982 11.196 488 H ALA 60 H ALA 60 23.841 -16.605 10.342 489 HA ALA 60 HA ALA 60 23.720 -19.338 9.245 490 HB1 ALA 60 1HB ALA 60 21.900 -17.828 11.149 491 HB2 ALA 60 2HB ALA 60 21.796 -19.563 10.760 492 HB3 ALA 60 3HB ALA 60 23.217 -18.930 11.615 493 H LEU 61 H LEU 61 22.691 -16.207 8.312 494 HA LEU 61 HA LEU 61 20.128 -16.918 7.206 495 HB2 LEU 61 2HB LEU 61 20.899 -14.620 8.009 496 HB3 LEU 61 3HB LEU 61 21.914 -14.541 6.557 497 HG LEU 61 HG LEU 61 19.805 -14.857 5.186 498 HD11 LEU 61 1HD1 LEU 61 17.658 -14.353 6.403 499 HD12 LEU 61 2HD1 LEU 61 18.357 -15.928 6.845 500 HD13 LEU 61 3HD1 LEU 61 18.554 -14.537 7.936 501 HD21 LEU 61 3HD2 LEU 61 19.020 -12.543 5.583 502 HD22 LEU 61 1HD2 LEU 61 19.842 -12.536 7.161 503 HD23 LEU 61 2HD2 LEU 61 20.798 -12.633 5.665 504 H ASP 62 H ASP 62 23.477 -16.885 6.057 505 HA ASP 62 HA ASP 62 22.827 -17.258 3.267 506 HB2 ASP 62 2HB ASP 62 25.320 -17.901 4.889 507 HB3 ASP 62 3HB ASP 62 25.212 -18.005 3.124 508 H SER 63 H SER 63 22.305 -19.211 5.975 509 HA SER 63 HA SER 63 22.360 -21.696 4.343 510 HB2 SER 63 2HB SER 63 22.478 -21.318 7.362 511 HB3 SER 63 3HB SER 63 22.491 -22.867 6.507 512 HG SER 63 HG SER 63 24.440 -22.212 5.512 513 H PHE 64 H PHE 64 20.264 -19.306 5.173 514 HA PHE 64 HA PHE 64 18.054 -20.982 6.096 515 HB2 PHE 64 2HB PHE 64 18.396 -18.706 6.941 516 HB3 PHE 64 3HB PHE 64 18.251 -18.061 5.308 517 HD1 PHE 64 HD1 PHE 64 16.165 -20.561 7.228 518 HD2 PHE 64 HD2 PHE 64 16.335 -16.791 5.165 519 HE1 PHE 64 HE1 PHE 64 13.730 -20.277 7.541 520 HE2 PHE 64 HE2 PHE 64 13.893 -16.497 5.506 521 HZ PHE 64 HZ PHE 64 12.591 -18.248 6.684 522 H ARG 65 H ARG 65 16.093 -21.326 4.901 523 HA ARG 65 HA ARG 65 16.485 -21.190 1.941 524 HB2 ARG 65 2HB ARG 65 15.252 -23.447 3.575 525 HB3 ARG 65 3HB ARG 65 15.246 -23.328 1.814 526 HG2 ARG 65 2HG ARG 65 17.016 -24.758 2.191 527 HG3 ARG 65 3HG ARG 65 17.821 -23.202 1.968 528 HD2 ARG 65 2HD ARG 65 18.810 -24.411 3.843 529 HD3 ARG 65 3HD ARG 65 17.977 -22.978 4.462 530 HE ARG 65 HE ARG 65 16.242 -25.287 4.466 531 HH11 ARG 65 1HH1 ARG 65 18.918 -23.770 6.201 532 HH12 ARG 65 2HH1 ARG 65 18.522 -24.522 7.727 533 HH21 ARG 65 1HH2 ARG 65 15.744 -26.267 6.472 534 HH22 ARG 65 2HH2 ARG 65 16.725 -25.938 7.879 535 H GLY 66 H GLY 66 14.593 -19.991 4.434 536 HA2 GLY 66 2HA GLY 66 12.610 -18.823 4.354 537 HA3 GLY 66 3HA GLY 66 12.610 -19.013 2.600 538 H ASP 67 H ASP 67 12.837 -21.972 4.455 539 HA ASP 67 HA ASP 67 10.324 -22.937 3.452 540 HB2 ASP 67 2HB ASP 67 12.319 -24.336 3.910 541 HB3 ASP 67 3HB ASP 67 12.140 -24.020 5.643 542 H SER 68 H SER 68 11.098 -20.903 6.038 543 HA SER 68 HA SER 68 8.356 -21.106 7.150 544 HB2 SER 68 2HB SER 68 10.929 -20.995 8.787 545 HB3 SER 68 3HB SER 68 9.284 -20.814 9.433 546 HG SER 68 HG SER 68 10.320 -23.084 8.079 547 H ALA 69 H ALA 69 8.010 -19.026 8.605 548 HA ALA 69 HA ALA 69 8.661 -16.754 6.967 549 HB1 ALA 69 1HB ALA 69 7.529 -16.894 9.785 550 HB2 ALA 69 2HB ALA 69 7.521 -15.471 8.714 551 HB3 ALA 69 3HB ALA 69 6.582 -16.913 8.275 552 H PHE 70 H PHE 70 10.032 -14.996 7.387 553 HA PHE 70 HA PHE 70 12.553 -15.769 8.495 554 HB2 PHE 70 2HB PHE 70 12.432 -14.211 6.646 555 HB3 PHE 70 3HB PHE 70 11.429 -13.100 7.588 556 HD1 PHE 70 HD2 PHE 70 14.795 -14.777 7.748 557 HD2 PHE 70 HD1 PHE 70 12.430 -11.304 8.667 558 HE1 PHE 70 HE2 PHE 70 16.814 -13.624 8.612 559 HE2 PHE 70 HE1 PHE 70 14.449 -10.149 9.511 560 HZ PHE 70 HZ PHE 70 16.650 -11.307 9.475 561 H TYR 71 H TYR 71 9.780 -13.935 9.846 562 HA TYR 71 HA TYR 71 11.362 -12.769 11.938 563 HB2 TYR 71 2HB TYR 71 9.265 -12.118 12.921 564 HB3 TYR 71 3HB TYR 71 9.272 -11.785 11.191 565 HD1 TYR 71 HD2 TYR 71 7.928 -14.006 13.839 566 HD2 TYR 71 HD1 TYR 71 7.668 -12.795 9.723 567 HE1 TYR 71 HE2 TYR 71 5.768 -15.212 13.624 568 HE2 TYR 71 HE1 TYR 71 5.500 -13.986 9.500 569 HH TYR 71 HH TYR 71 3.921 -15.257 10.552 570 H THR 72 H THR 72 9.465 -15.810 11.680 571 HA THR 72 HA THR 72 9.778 -16.479 14.472 572 HB THR 72 HB THR 72 9.306 -18.315 12.086 573 HG1 THR 72 1HG THR 72 7.117 -17.976 12.611 574 HG21 THR 72 1HG2 THR 72 8.670 -18.580 15.057 575 HG22 THR 72 2HG2 THR 72 8.145 -19.719 13.792 576 HG23 THR 72 3HG2 THR 72 9.870 -19.528 14.149 577 H TRP 73 H TRP 73 11.668 -16.990 11.509 578 HA TRP 73 HA TRP 73 13.504 -18.900 12.671 579 HB2 TRP 73 2HB TRP 73 13.073 -18.815 10.279 580 HB3 TRP 73 3HB TRP 73 13.586 -17.128 10.210 581 HD1 TRP 73 HD1 TRP 73 14.934 -20.640 10.180 582 HE1 TRP 73 HE1 TRP 73 17.460 -20.622 9.748 583 HE3 TRP 73 HE3 TRP 73 15.794 -15.616 10.624 584 HZ2 TRP 73 HZ2 TRP 73 19.605 -18.704 9.779 585 HZ3 TRP 73 HZ3 TRP 73 18.097 -14.732 10.435 586 HH2 TRP 73 HH2 TRP 73 20.001 -16.259 10.058 587 H LEU 74 H LEU 74 13.306 -15.356 12.547 588 HA LEU 74 HA LEU 74 16.111 -15.040 13.335 589 HB2 LEU 74 2HB LEU 74 15.013 -13.428 11.819 590 HB3 LEU 74 3HB LEU 74 13.796 -13.084 13.056 591 HG LEU 74 HG LEU 74 15.598 -12.238 14.573 592 HD11 LEU 74 1HD1 LEU 74 17.825 -11.751 13.586 593 HD12 LEU 74 2HD1 LEU 74 17.517 -13.497 13.654 594 HD13 LEU 74 3HD1 LEU 74 17.355 -12.623 12.110 595 HD21 LEU 74 3HD2 LEU 74 14.312 -10.723 13.141 596 HD22 LEU 74 1HD2 LEU 74 15.978 -10.149 13.357 597 HD23 LEU 74 2HD2 LEU 74 15.501 -10.940 11.828 598 H TYR 75 H TYR 75 12.865 -14.903 14.866 599 HA TYR 75 HA TYR 75 13.877 -13.794 17.326 600 HB2 TYR 75 2HB TYR 75 11.320 -15.290 16.654 601 HB3 TYR 75 3HB TYR 75 11.648 -14.556 18.222 602 HD1 TYR 75 HD2 TYR 75 13.115 -12.037 17.072 603 HD2 TYR 75 HD1 TYR 75 9.375 -13.970 16.161 604 HE1 TYR 75 HE2 TYR 75 12.221 -9.897 16.294 605 HE2 TYR 75 HE1 TYR 75 8.469 -11.817 15.331 606 HH TYR 75 HH TYR 75 8.886 -9.598 14.958 607 H ARG 76 H ARG 76 13.892 -17.093 16.062 608 HA ARG 76 HA ARG 76 14.384 -18.166 18.732 609 HB2 ARG 76 2HB ARG 76 14.877 -20.263 17.645 610 HB3 ARG 76 3HB ARG 76 13.372 -19.576 17.019 611 HG2 ARG 76 2HG ARG 76 14.531 -18.803 15.003 612 HG3 ARG 76 3HG ARG 76 16.091 -19.387 15.650 613 HD2 ARG 76 2HD ARG 76 15.090 -21.688 15.781 614 HD3 ARG 76 3HD ARG 76 13.654 -21.073 14.947 615 HE ARG 76 HE ARG 76 15.862 -20.337 13.376 616 HH11 ARG 76 1HH1 ARG 76 14.343 -23.324 14.513 617 HH12 ARG 76 2HH1 ARG 76 14.898 -24.268 13.152 618 HH21 ARG 76 1HH2 ARG 76 16.592 -21.602 11.620 619 HH22 ARG 76 2HH2 ARG 76 16.158 -23.295 11.515 620 H ILE 77 H ILE 77 16.329 -16.615 16.231 621 HA ILE 77 HA ILE 77 18.866 -17.570 17.249 622 HB ILE 77 HB ILE 77 18.344 -14.899 15.905 623 HG12 ILE 77 2HG1 ILE 77 17.361 -16.581 14.432 624 HG13 ILE 77 3HG1 ILE 77 18.839 -15.921 13.745 625 HG21 ILE 77 1HG2 ILE 77 20.559 -15.138 16.879 626 HG22 ILE 77 2HG2 ILE 77 20.778 -16.715 16.098 627 HG23 ILE 77 3HG2 ILE 77 20.687 -15.234 15.110 628 HD11 ILE 77 3HD1 ILE 77 18.681 -18.344 13.399 629 HD12 ILE 77 1HD1 ILE 77 20.093 -17.936 14.384 630 HD13 ILE 77 2HD1 ILE 77 18.631 -18.613 15.155 631 H ALA 78 H ALA 78 16.593 -14.984 18.122 632 HA ALA 78 HA ALA 78 18.526 -13.497 19.660 633 HB1 ALA 78 1HB ALA 78 15.491 -13.339 19.596 634 HB2 ALA 78 2HB ALA 78 16.585 -12.118 20.275 635 HB3 ALA 78 3HB ALA 78 16.610 -12.460 18.532 636 H VAL 79 H VAL 79 15.906 -15.838 20.522 637 HA VAL 79 HA VAL 79 16.375 -15.381 23.358 638 HB VAL 79 HB VAL 79 14.146 -15.882 22.540 639 HG11 VAL 79 1HG1 VAL 79 15.229 -18.640 21.835 640 HG12 VAL 79 2HG1 VAL 79 13.541 -18.095 21.712 641 HG13 VAL 79 3HG1 VAL 79 14.781 -17.382 20.655 642 HG21 VAL 79 3HG2 VAL 79 13.538 -17.590 24.158 643 HG22 VAL 79 1HG2 VAL 79 15.213 -18.190 24.216 644 HG23 VAL 79 2HG2 VAL 79 14.831 -16.573 24.844 645 H ASN 80 H ASN 80 17.538 -17.673 20.919 646 HA ASN 80 HA ASN 80 18.648 -19.492 22.899 647 HB2 ASN 80 2HB ASN 80 19.110 -19.146 19.910 648 HB3 ASN 80 3HB ASN 80 19.869 -20.406 20.885 649 HD21 ASN 80 2HD2 ASN 80 18.343 -21.218 18.778 650 HD22 ASN 80 1HD2 ASN 80 16.859 -21.943 19.365 651 H THR 81 H THR 81 19.673 -16.481 21.371 652 HA THR 81 HA THR 81 22.460 -16.850 22.186 653 HB THR 81 HB THR 81 20.950 -14.427 21.119 654 HG1 THR 81 1HG THR 81 21.127 -15.945 19.566 655 HG21 THR 81 1HG2 THR 81 23.233 -13.562 20.630 656 HG22 THR 81 2HG2 THR 81 22.958 -13.708 22.372 657 HG23 THR 81 3HG2 THR 81 23.929 -14.934 21.530 658 H ALA 82 H ALA 82 19.492 -15.506 23.578 659 HA ALA 82 HA ALA 82 20.871 -13.964 25.609 660 HB1 ALA 82 1HB ALA 82 18.624 -13.772 26.595 661 HB2 ALA 82 2HB ALA 82 18.574 -13.476 24.844 662 HB3 ALA 82 3HB ALA 82 18.024 -15.039 25.493 663 H LYS 83 H LYS 83 19.664 -17.305 25.334 664 HA LYS 83 HA LYS 83 20.194 -17.906 28.140 665 HB2 LYS 83 2HB LYS 83 19.580 -19.615 25.698 666 HB3 LYS 83 3HB LYS 83 19.795 -20.269 27.333 667 HG2 LYS 83 2HG LYS 83 17.952 -18.889 28.179 668 HG3 LYS 83 3HG LYS 83 17.741 -18.141 26.586 669 HD2 LYS 83 2HD LYS 83 17.185 -20.330 25.603 670 HD3 LYS 83 3HD LYS 83 17.415 -21.116 27.178 671 HE2 LYS 83 2HE LYS 83 15.379 -18.918 26.604 672 HE3 LYS 83 3HE LYS 83 15.016 -20.651 26.613 673 HZ1 LYS 83 3HZ LYS 83 16.028 -19.124 28.918 674 HZ2 LYS 83 1HZ LYS 83 14.484 -19.653 28.713 675 HZ3 LYS 83 2HZ LYS 83 15.703 -20.735 28.904 676 H ASN 84 H ASN 84 21.989 -17.937 25.099 677 HA ASN 84 HA ASN 84 24.204 -19.444 26.262 678 HB2 ASN 84 2HB ASN 84 23.662 -19.682 23.915 679 HB3 ASN 84 3HB ASN 84 23.901 -17.945 23.639 680 HD21 ASN 84 2HD2 ASN 84 26.008 -17.130 23.408 681 HD22 ASN 84 1HD2 ASN 84 27.418 -18.168 23.360 682 H TYR 85 H TYR 85 23.114 -16.138 26.225 683 HA TYR 85 HA TYR 85 25.747 -14.954 26.596 684 HB2 TYR 85 2HB TYR 85 23.823 -13.783 25.563 685 HB3 TYR 85 3HB TYR 85 22.945 -13.881 27.092 686 HD1 TYR 85 HD1 TYR 85 25.819 -12.358 25.331 687 HD2 TYR 85 HD2 TYR 85 23.448 -12.385 28.915 688 HE1 TYR 85 HE1 TYR 85 26.886 -10.240 26.036 689 HE2 TYR 85 HE2 TYR 85 24.539 -10.276 29.656 690 HH TYR 85 HH TYR 85 27.018 -8.626 27.657 691 H LEU 86 H LEU 86 23.068 -16.125 28.645 692 HA LEU 86 HA LEU 86 24.295 -15.089 31.086 693 HB2 LEU 86 2HB LEU 86 21.923 -16.914 30.573 694 HB3 LEU 86 3HB LEU 86 22.437 -16.367 32.179 695 HG LEU 86 HG LEU 86 21.533 -14.545 29.913 696 HD11 LEU 86 1HD1 LEU 86 20.251 -15.390 32.549 697 HD12 LEU 86 2HD1 LEU 86 19.615 -14.154 31.443 698 HD13 LEU 86 3HD1 LEU 86 19.705 -15.847 30.913 699 HD21 LEU 86 3HD2 LEU 86 21.558 -12.803 31.719 700 HD22 LEU 86 1HD2 LEU 86 22.363 -13.965 32.793 701 HD23 LEU 86 2HD2 LEU 86 23.180 -13.393 31.319 702 H VAL 87 H VAL 87 24.510 -18.083 29.220 703 HA VAL 87 HA VAL 87 25.645 -19.516 31.518 704 HB VAL 87 HB VAL 87 24.281 -20.578 29.668 705 HG11 VAL 87 1HG1 VAL 87 26.893 -20.411 28.109 706 HG12 VAL 87 2HG1 VAL 87 25.371 -21.165 27.595 707 HG13 VAL 87 3HG1 VAL 87 25.465 -19.396 27.799 708 HG21 VAL 87 3HG2 VAL 87 25.663 -21.906 31.231 709 HG22 VAL 87 1HG2 VAL 87 25.613 -22.624 29.602 710 HG23 VAL 87 2HG2 VAL 87 27.058 -21.740 30.135 711 H ALA 88 H ALA 88 26.763 -17.469 28.888 712 HA ALA 88 HA ALA 88 29.485 -18.399 28.946 713 HB1 ALA 88 1HB ALA 88 28.511 -17.239 27.002 714 HB2 ALA 88 2HB ALA 88 28.276 -15.769 27.977 715 HB3 ALA 88 3HB ALA 88 29.918 -16.349 27.615 716 H GLN 89 H GLN 89 27.601 -16.280 30.964 717 HA GLN 89 HA GLN 89 30.080 -15.333 32.318 718 HB2 GLN 89 2HB GLN 89 28.709 -13.546 33.233 719 HB3 GLN 89 3HB GLN 89 28.558 -13.599 31.464 720 HG2 GLN 89 2HG GLN 89 26.420 -14.896 31.736 721 HG3 GLN 89 3HG GLN 89 26.546 -14.667 33.493 722 HE21 GLN 89 2HE2 GLN 89 26.105 -13.065 30.349 723 HE22 GLN 89 1HE2 GLN 89 25.455 -11.569 30.986 724 H GLY 90 H GLY 90 27.395 -17.502 32.586 725 HA2 GLY 90 2HA GLY 90 27.433 -17.627 35.494 726 HA3 GLY 90 3HA GLY 90 26.556 -18.698 34.372 727 H ARG 91 H ARG 91 29.271 -18.950 32.883 728 HA ARG 91 HA ARG 91 30.456 -21.085 34.601 729 HB2 ARG 91 2HB ARG 91 30.643 -20.506 31.621 730 HB3 ARG 91 3HB ARG 91 31.496 -21.814 32.449 731 HG2 ARG 91 2HG ARG 91 28.457 -21.502 32.366 732 HG3 ARG 91 3HG ARG 91 29.401 -22.554 31.305 733 HD2 ARG 91 2HD ARG 91 29.329 -22.763 34.345 734 HD3 ARG 91 3HD ARG 91 28.391 -23.765 33.238 735 HE ARG 91 HE ARG 91 31.315 -23.880 33.685 736 HH11 ARG 91 1HH1 ARG 91 28.505 -25.070 31.890 737 HH12 ARG 91 2HH1 ARG 91 29.338 -26.497 31.315 738 HH21 ARG 91 1HH2 ARG 91 32.364 -25.721 32.911 739 HH22 ARG 91 2HH2 ARG 91 31.516 -26.875 31.906 740 H ARG 92 H ARG 92 30.964 -17.840 33.664 741 HA ARG 92 HA ARG 92 32.788 -16.471 33.682 742 HB2 ARG 92 2HB ARG 92 33.463 -18.239 36.059 743 HB3 ARG 92 3HB ARG 92 34.130 -16.625 35.735 744 HG2 ARG 92 2HG ARG 92 31.839 -15.666 35.813 745 HG3 ARG 92 3HG ARG 92 31.185 -17.280 36.175 746 HD2 ARG 92 2HD ARG 92 32.547 -17.370 38.233 747 HD3 ARG 92 3HD ARG 92 33.205 -15.762 37.875 748 HE ARG 92 HE ARG 92 30.376 -15.571 37.874 749 HH11 ARG 92 1HH1 ARG 92 33.029 -16.161 40.139 750 HH12 ARG 92 2HH1 ARG 92 32.159 -15.504 41.506 751 HH21 ARG 92 1HH2 ARG 92 29.269 -14.726 39.675 752 HH22 ARG 92 2HH2 ARG 92 30.036 -14.696 41.243 753 H LEU 93 H LEU 93 33.145 -18.349 31.714 754 HA LEU 93 HA LEU 93 34.689 -19.244 30.340 755 HB2 LEU 93 2HB LEU 93 36.386 -17.195 31.776 756 HB3 LEU 93 3HB LEU 93 37.029 -18.206 30.479 757 HG LEU 93 HG LEU 93 35.288 -17.385 28.931 758 HD11 LEU 93 1HD1 LEU 93 34.577 -15.514 31.233 759 HD12 LEU 93 2HD1 LEU 93 34.073 -15.274 29.546 760 HD13 LEU 93 3HD1 LEU 93 33.491 -16.686 30.432 761 HD21 LEU 93 3HD2 LEU 93 36.930 -15.223 30.305 762 HD22 LEU 93 1HD2 LEU 93 37.525 -16.350 29.062 763 HD23 LEU 93 2HD2 LEU 93 36.280 -15.152 28.650 764 H GLU 94 H GLU 94 34.232 -20.560 32.999 765 HA GLU 94 HA GLU 94 36.636 -21.861 33.830 766 HB2 GLU 94 2HB GLU 94 34.594 -21.673 35.149 767 HB3 GLU 94 3HB GLU 94 33.686 -22.631 33.975 768 HG2 GLU 94 2HG GLU 94 36.066 -23.690 35.542 769 HG3 GLU 94 3HG GLU 94 34.390 -23.747 36.121 770 H LEU 95 H LEU 95 34.637 -22.208 31.017 771 HA LEU 95 HA LEU 95 35.816 -24.861 30.417 772 HB2 LEU 95 2HB LEU 95 33.324 -24.595 30.562 773 HB3 LEU 95 3HB LEU 95 33.392 -23.492 29.189 774 HG LEU 95 HG LEU 95 34.216 -25.311 27.737 775 HD11 LEU 95 1HD1 LEU 95 34.054 -27.014 30.268 776 HD12 LEU 95 2HD1 LEU 95 34.298 -27.640 28.620 777 HD13 LEU 95 3HD1 LEU 95 35.533 -26.615 29.361 778 HD21 LEU 95 3HD2 LEU 95 31.830 -26.144 29.426 779 HD22 LEU 95 1HD2 LEU 95 31.788 -25.008 28.057 780 HD23 LEU 95 2HD2 LEU 95 32.200 -26.712 27.778 781 H VAL 96 H VAL 96 36.839 -21.895 30.044 782 HA VAL 96 HA VAL 96 37.596 -22.223 27.182 783 HB VAL 96 HB VAL 96 36.965 -19.632 28.645 784 HG11 VAL 96 1HG1 VAL 96 38.689 -19.391 26.857 785 HG12 VAL 96 2HG1 VAL 96 37.564 -20.149 25.700 786 HG13 VAL 96 3HG1 VAL 96 37.164 -18.585 26.432 787 HG21 VAL 96 3HG2 VAL 96 35.418 -21.138 26.491 788 HG22 VAL 96 1HG2 VAL 96 34.908 -20.905 28.180 789 HG23 VAL 96 2HG2 VAL 96 35.023 -19.512 27.093 790 HA PRO 97 HA PRO 97 41.682 -22.015 28.943 791 HB2 PRO 97 2HB PRO 97 43.168 -21.700 26.679 792 HB3 PRO 97 3HB PRO 97 42.316 -23.234 27.066 793 HG2 PRO 97 2HG PRO 97 41.360 -20.975 25.282 794 HG3 PRO 97 3HG PRO 97 41.429 -22.730 24.897 795 HD2 PRO 97 2HD PRO 97 39.140 -21.556 25.773 796 HD3 PRO 97 3HD PRO 97 39.599 -23.195 26.333 797 H ARG 98 H ARG 98 43.485 -20.518 29.179 798 HA ARG 98 HA ARG 98 42.591 -17.707 28.885 799 HB2 ARG 98 2HB ARG 98 43.032 -18.562 31.145 800 HB3 ARG 98 3HB ARG 98 44.673 -19.018 30.679 801 HG2 ARG 98 2HG ARG 98 44.583 -16.902 31.974 802 HG3 ARG 98 3HG ARG 98 45.301 -16.686 30.377 803 HD2 ARG 98 2HD ARG 98 43.121 -15.821 29.525 804 HD3 ARG 98 3HD ARG 98 42.415 -16.049 31.134 805 HE ARG 98 HE ARG 98 43.489 -14.134 31.874 806 HH11 ARG 98 1HH1 ARG 98 44.863 -15.102 28.754 807 HH12 ARG 98 2HH1 ARG 98 45.753 -13.609 28.558 808 HH21 ARG 98 1HH2 ARG 98 44.668 -12.206 31.586 809 HH22 ARG 98 2HH2 ARG 98 45.654 -11.984 30.161 810 H GLY 99 H GLY 99 44.656 -19.928 27.363 811 HA2 GLY 99 2HA GLY 99 46.909 -18.251 26.784 812 HA3 GLY 99 3HA GLY 99 46.431 -19.710 25.913 813 H SER 100 H SER 100 47.487 -17.570 24.529 814 HA SER 100 HA SER 100 45.237 -16.828 22.785 815 HB2 SER 100 2HB SER 100 45.317 -14.976 24.397 816 HB3 SER 100 3HB SER 100 47.057 -14.776 24.110 817 HG SER 100 HG SER 100 45.704 -13.341 22.889 818 H HIS 101 H HIS 101 45.946 -16.078 20.701 819 HA HIS 101 HA HIS 101 48.542 -17.222 19.919 820 HB2 HIS 101 2HB HIS 101 47.672 -17.000 17.649 821 HB3 HIS 101 3HB HIS 101 46.499 -17.823 18.682 822 HD2 HIS 101 HD2 HIS 101 46.961 -14.685 16.575 823 HE1 HIS 101 HE1 HIS 101 43.066 -14.392 18.262 824 HE2 HIS 101 HE2 HIS 101 44.686 -13.384 16.571 825 H HIS 102 H HIS 102 47.632 -14.304 21.123 826 HA HIS 102 HA HIS 102 49.605 -12.833 19.449 827 HB2 HIS 102 2HB HIS 102 47.227 -12.194 19.006 828 HB3 HIS 102 3HB HIS 102 47.084 -11.697 20.698 829 HD2 HIS 102 HD2 HIS 102 47.216 -9.129 20.843 830 HE1 HIS 102 HE1 HIS 102 50.162 -8.347 17.874 831 HE2 HIS 102 HE2 HIS 102 48.640 -7.294 19.624 832 H HIS 103 H HIS 103 49.711 -14.372 22.109 833 HA HIS 103 HA HIS 103 51.035 -12.204 23.649 834 HB2 HIS 103 2HB HIS 103 48.708 -12.639 24.497 835 HB3 HIS 103 3HB HIS 103 49.195 -14.301 24.845 836 HD2 HIS 103 HD2 HIS 103 48.941 -14.097 27.477 837 HE1 HIS 103 HE1 HIS 103 51.863 -11.079 28.143 838 HE2 HIS 103 HE2 HIS 103 50.320 -12.769 29.267 839 H HIS 104 H HIS 104 52.294 -13.297 25.540 840 HA HIS 104 HA HIS 104 54.129 -14.446 26.096 841 HB2 HIS 104 2HB HIS 104 52.756 -16.791 24.760 842 HB3 HIS 104 3HB HIS 104 54.090 -16.869 25.919 843 HD2 HIS 104 HD2 HIS 104 50.437 -17.130 25.811 844 HE1 HIS 104 HE1 HIS 104 51.218 -15.849 29.791 845 HE2 HIS 104 HE2 HIS 104 49.461 -16.823 28.223 846 H HIS 105 H HIS 105 53.909 -13.244 23.237 847 HA HIS 105 HA HIS 105 56.055 -14.773 21.904 848 HB2 HIS 105 2HB HIS 105 54.513 -12.286 21.084 849 HB3 HIS 105 3HB HIS 105 55.716 -13.115 20.092 850 HD2 HIS 105 HD2 HIS 105 52.291 -12.770 19.831 851 HE1 HIS 105 HE1 HIS 105 52.598 -16.994 19.437 852 HE2 HIS 105 HE2 HIS 105 51.099 -14.970 19.055 853 H HIS 106 H HIS 106 55.931 -12.525 24.345 854 HA HIS 106 HA HIS 106 58.709 -11.687 23.890 855 HB2 HIS 106 2HB HIS 106 58.177 -9.319 24.284 856 HB3 HIS 106 3HB HIS 106 57.425 -9.915 22.803 857 HD2 HIS 106 HD2 HIS 106 54.711 -10.360 22.884 858 HE1 HIS 106 HE1 HIS 106 54.006 -7.957 26.321 859 HE2 HIS 106 HE2 HIS 106 52.907 -9.160 24.363 Start of MODEL 18 1 H1 MET 1 H1 MET 1 4.943 6.136 -6.307 2 H2 MET 1 H2 MET 1 6.572 6.235 -6.070 3 H3 MET 1 H3 MET 1 5.548 6.246 -4.781 4 HA MET 1 HA MET 1 5.958 3.999 -6.623 5 HB2 MET 1 2HB MET 1 6.792 4.360 -3.721 6 HB3 MET 1 3HB MET 1 6.924 2.853 -4.644 7 HG2 MET 1 2HG MET 1 8.303 5.482 -5.314 8 HG3 MET 1 3HG MET 1 9.064 4.063 -4.587 9 HE1 MET 1 1HE MET 1 10.707 4.166 -8.112 10 HE2 MET 1 2HE MET 1 10.238 5.550 -7.095 11 HE3 MET 1 3HE MET 1 10.966 4.106 -6.353 12 H SER 2 H SER 2 4.927 1.988 -5.877 13 HA SER 2 HA SER 2 2.496 2.444 -4.222 14 HB2 SER 2 2HB SER 2 2.588 1.031 -6.912 15 HB3 SER 2 3HB SER 2 1.173 1.166 -5.852 16 HG SER 2 HG SER 2 1.225 2.767 -7.508 17 H GLU 3 H GLU 3 5.323 0.874 -4.299 18 HA GLU 3 HA GLU 3 4.276 -1.407 -2.778 19 HB2 GLU 3 2HB GLU 3 4.333 -2.178 -5.143 20 HB3 GLU 3 3HB GLU 3 6.057 -1.765 -5.224 21 HG2 GLU 3 2HG GLU 3 6.560 -3.420 -3.484 22 HG3 GLU 3 3HG GLU 3 4.835 -3.756 -3.261 23 H GLN 4 H GLN 4 5.925 -2.383 -1.441 24 HA GLN 4 HA GLN 4 8.539 -1.014 -1.376 25 HB2 GLN 4 2HB GLN 4 7.134 0.262 0.129 26 HB3 GLN 4 3HB GLN 4 6.599 -1.225 0.946 27 HG2 GLN 4 2HG GLN 4 8.238 -0.044 2.305 28 HG3 GLN 4 3HG GLN 4 8.887 -1.593 1.791 29 HE21 GLN 4 2HE2 GLN 4 10.925 -0.364 2.494 30 HE22 GLN 4 1HE2 GLN 4 11.744 0.573 1.263 31 H LEU 5 H LEU 5 10.118 -2.125 -0.093 32 HA LEU 5 HA LEU 5 10.052 -4.961 -0.655 33 HB2 LEU 5 2HB LEU 5 12.140 -3.307 0.787 34 HB3 LEU 5 3HB LEU 5 12.381 -4.857 -0.052 35 HG LEU 5 HG LEU 5 11.656 -2.180 -1.318 36 HD11 LEU 5 1HD1 LEU 5 14.012 -2.416 -0.585 37 HD12 LEU 5 2HD1 LEU 5 14.135 -3.947 -1.483 38 HD13 LEU 5 3HD1 LEU 5 13.896 -2.410 -2.355 39 HD21 LEU 5 3HD2 LEU 5 12.148 -4.883 -2.639 40 HD22 LEU 5 1HD2 LEU 5 10.584 -4.032 -2.559 41 HD23 LEU 5 2HD2 LEU 5 11.929 -3.348 -3.487 42 H THR 6 H THR 6 10.549 -6.633 0.837 43 HA THR 6 HA THR 6 9.821 -6.162 3.675 44 HB THR 6 HB THR 6 8.531 -8.254 1.876 45 HG1 THR 6 1HG THR 6 6.704 -6.953 2.084 46 HG21 THR 6 1HG2 THR 6 6.910 -8.354 3.850 47 HG22 THR 6 2HG2 THR 6 8.513 -9.055 4.135 48 HG23 THR 6 3HG2 THR 6 8.126 -7.440 4.776 49 H ASP 7 H ASP 7 10.129 -8.419 4.855 50 HA ASP 7 HA ASP 7 12.847 -9.058 4.721 51 HB2 ASP 7 2HB ASP 7 12.271 -10.901 6.233 52 HB3 ASP 7 3HB ASP 7 11.422 -9.415 6.676 53 H GLN 8 H GLN 8 10.311 -10.190 2.647 54 HA GLN 8 HA GLN 8 11.444 -12.723 1.916 55 HB2 GLN 8 2HB GLN 8 9.128 -12.130 1.412 56 HB3 GLN 8 3HB GLN 8 9.665 -10.750 0.441 57 HG2 GLN 8 2HG GLN 8 9.012 -12.624 -1.006 58 HG3 GLN 8 3HG GLN 8 10.737 -12.286 -1.176 59 HE21 GLN 8 2HE2 GLN 8 12.294 -13.758 -0.212 60 HE22 GLN 8 1HE2 GLN 8 11.828 -15.399 0.184 61 H VAL 9 H VAL 9 11.656 -9.462 0.393 62 HA VAL 9 HA VAL 9 13.666 -10.442 -1.506 63 HB VAL 9 HB VAL 9 11.974 -8.992 -2.370 64 HG11 VAL 9 1HG1 VAL 9 11.218 -7.906 -0.322 65 HG12 VAL 9 2HG1 VAL 9 12.754 -7.007 -0.203 66 HG13 VAL 9 3HG1 VAL 9 11.627 -6.690 -1.539 67 HG21 VAL 9 3HG2 VAL 9 14.294 -8.595 -3.215 68 HG22 VAL 9 1HG2 VAL 9 13.264 -7.151 -3.304 69 HG23 VAL 9 2HG2 VAL 9 14.475 -7.283 -2.021 70 H LEU 10 H LEU 10 13.563 -8.671 1.553 71 HA LEU 10 HA LEU 10 16.223 -7.569 1.313 72 HB2 LEU 10 2HB LEU 10 14.142 -7.891 3.440 73 HB3 LEU 10 3HB LEU 10 15.818 -7.712 3.981 74 HG LEU 10 HG LEU 10 16.079 -5.643 2.762 75 HD11 LEU 10 1HD1 LEU 10 14.177 -4.533 1.657 76 HD12 LEU 10 2HD1 LEU 10 14.623 -6.040 0.831 77 HD13 LEU 10 3HD1 LEU 10 13.185 -5.992 1.888 78 HD21 LEU 10 3HD2 LEU 10 13.488 -5.713 4.380 79 HD22 LEU 10 1HD2 LEU 10 15.132 -5.553 5.043 80 HD23 LEU 10 2HD2 LEU 10 14.456 -4.257 4.041 81 H VAL 11 H VAL 11 14.959 -10.764 2.307 82 HA VAL 11 HA VAL 11 17.598 -11.490 3.371 83 HB VAL 11 HB VAL 11 15.059 -13.080 2.923 84 HG11 VAL 11 1HG1 VAL 11 17.765 -13.944 4.032 85 HG12 VAL 11 2HG1 VAL 11 16.248 -14.853 4.239 86 HG13 VAL 11 3HG1 VAL 11 16.926 -14.615 2.613 87 HG21 VAL 11 3HG2 VAL 11 15.146 -11.413 4.823 88 HG22 VAL 11 1HG2 VAL 11 15.044 -13.095 5.386 89 HG23 VAL 11 2HG2 VAL 11 16.598 -12.231 5.425 90 H GLU 12 H GLU 12 15.843 -11.712 0.277 91 HA GLU 12 HA GLU 12 17.716 -13.586 -0.897 92 HB2 GLU 12 2HB GLU 12 15.739 -11.581 -2.049 93 HB3 GLU 12 3HB GLU 12 16.750 -12.642 -3.048 94 HG2 GLU 12 2HG GLU 12 15.793 -14.627 -1.903 95 HG3 GLU 12 3HG GLU 12 14.760 -13.566 -0.932 96 H ARG 13 H ARG 13 17.540 -10.023 -0.596 97 HA ARG 13 HA ARG 13 19.619 -9.532 -2.517 98 HB2 ARG 13 2HB ARG 13 17.905 -7.905 -2.000 99 HB3 ARG 13 3HB ARG 13 18.421 -7.821 -0.303 100 HG2 ARG 13 2HG ARG 13 20.499 -6.821 -0.880 101 HG3 ARG 13 3HG ARG 13 20.304 -7.189 -2.608 102 HD2 ARG 13 2HD ARG 13 18.512 -5.315 -1.017 103 HD3 ARG 13 3HD ARG 13 19.870 -4.781 -2.025 104 HE ARG 13 HE ARG 13 17.232 -5.574 -2.907 105 HH11 ARG 13 1HH1 ARG 13 20.642 -5.504 -3.904 106 HH12 ARG 13 2HH1 ARG 13 20.246 -5.440 -5.603 107 HH21 ARG 13 1HH2 ARG 13 16.776 -5.517 -5.131 108 HH22 ARG 13 2HH2 ARG 13 18.078 -5.473 -6.293 109 H VAL 14 H VAL 14 19.646 -10.004 1.049 110 HA VAL 14 HA VAL 14 22.434 -9.265 1.267 111 HB VAL 14 HB VAL 14 22.287 -10.189 3.521 112 HG11 VAL 14 1HG1 VAL 14 19.917 -8.506 2.616 113 HG12 VAL 14 2HG1 VAL 14 20.361 -8.766 4.310 114 HG13 VAL 14 3HG1 VAL 14 21.498 -7.940 3.207 115 HG21 VAL 14 3HG2 VAL 14 20.867 -12.145 3.128 116 HG22 VAL 14 1HG2 VAL 14 20.148 -11.074 4.354 117 HG23 VAL 14 2HG2 VAL 14 19.502 -11.080 2.697 118 H GLN 15 H GLN 15 20.718 -12.210 0.385 119 HA GLN 15 HA GLN 15 23.058 -13.912 0.717 120 HB2 GLN 15 2HB GLN 15 20.384 -14.252 -0.676 121 HB3 GLN 15 3HB GLN 15 21.631 -15.515 -0.643 122 HG2 GLN 15 2HG GLN 15 21.599 -15.552 1.812 123 HG3 GLN 15 3HG GLN 15 20.435 -14.241 1.855 124 HE21 GLN 15 2HE2 GLN 15 19.759 -16.521 3.180 125 HE22 GLN 15 1HE2 GLN 15 18.507 -17.384 2.320 126 H LYS 16 H LYS 16 21.905 -11.646 -1.691 127 HA LYS 16 HA LYS 16 23.627 -12.666 -3.799 128 HB2 LYS 16 2HB LYS 16 21.468 -10.776 -3.531 129 HB3 LYS 16 3HB LYS 16 22.878 -9.920 -4.178 130 HG2 LYS 16 2HG LYS 16 21.681 -10.810 -6.052 131 HG3 LYS 16 3HG LYS 16 23.162 -11.770 -5.852 132 HD2 LYS 16 2HD LYS 16 21.371 -13.310 -6.301 133 HD3 LYS 16 3HD LYS 16 21.795 -13.483 -4.591 134 HE2 LYS 16 2HE LYS 16 19.386 -13.464 -4.777 135 HE3 LYS 16 3HE LYS 16 19.885 -11.946 -4.021 136 HZ1 LYS 16 3HZ LYS 16 19.211 -12.297 -6.869 137 HZ2 LYS 16 1HZ LYS 16 18.246 -11.606 -5.736 138 HZ3 LYS 16 2HZ LYS 16 19.661 -10.882 -6.164 139 H GLY 17 H GLY 17 24.225 -11.044 -0.909 140 HA2 GLY 17 2HA GLY 17 26.496 -10.698 -0.262 141 HA3 GLY 17 3HA GLY 17 26.894 -10.219 -1.924 142 H ASP 18 H ASP 18 23.951 -8.745 -1.176 143 HA ASP 18 HA ASP 18 25.270 -6.165 -0.659 144 HB2 ASP 18 2HB ASP 18 22.460 -7.098 -1.291 145 HB3 ASP 18 3HB ASP 18 22.760 -5.458 -0.744 146 H GLN 19 H GLN 19 26.117 -6.630 1.462 147 HA GLN 19 HA GLN 19 24.467 -7.455 3.636 148 HB2 GLN 19 2HB GLN 19 26.920 -7.626 3.529 149 HB3 GLN 19 3HB GLN 19 27.078 -5.870 3.590 150 HG2 GLN 19 2HG GLN 19 25.598 -7.407 5.748 151 HG3 GLN 19 3HG GLN 19 27.361 -7.283 5.774 152 HE21 GLN 19 2HE2 GLN 19 25.959 -6.290 7.926 153 HE22 GLN 19 1HE2 GLN 19 26.035 -4.542 7.922 154 H LYS 20 H LYS 20 24.762 -4.418 1.959 155 HA LYS 20 HA LYS 20 23.973 -2.618 4.009 156 HB2 LYS 20 2HB LYS 20 23.333 -1.169 2.119 157 HB3 LYS 20 3HB LYS 20 24.894 -1.957 1.824 158 HG2 LYS 20 2HG LYS 20 23.717 -3.687 0.436 159 HG3 LYS 20 3HG LYS 20 22.195 -2.801 0.679 160 HD2 LYS 20 2HD LYS 20 23.197 -0.806 -0.406 161 HD3 LYS 20 3HD LYS 20 24.713 -1.712 -0.645 162 HE2 LYS 20 2HE LYS 20 23.500 -3.376 -2.006 163 HE3 LYS 20 3HE LYS 20 21.991 -2.482 -1.773 164 HZ1 LYS 20 3HZ LYS 20 22.990 -0.620 -2.911 165 HZ2 LYS 20 1HZ LYS 20 24.404 -1.432 -3.105 166 HZ3 LYS 20 2HZ LYS 20 23.049 -1.956 -3.866 167 H ALA 21 H ALA 21 22.139 -5.024 2.190 168 HA ALA 21 HA ALA 21 19.575 -3.810 2.897 169 HB1 ALA 21 1HB ALA 21 19.837 -5.010 0.784 170 HB2 ALA 21 2HB ALA 21 20.287 -6.498 1.658 171 HB3 ALA 21 3HB ALA 21 18.646 -5.833 1.821 172 H PHE 22 H PHE 22 21.870 -5.997 4.390 173 HA PHE 22 HA PHE 22 19.886 -7.252 6.111 174 HB2 PHE 22 2HB PHE 22 22.050 -8.350 5.532 175 HB3 PHE 22 3HB PHE 22 22.908 -7.083 6.405 176 HD1 PHE 22 HD2 PHE 22 20.086 -9.527 6.907 177 HD2 PHE 22 HD1 PHE 22 23.457 -7.498 8.652 178 HE1 PHE 22 HE2 PHE 22 19.762 -10.792 9.007 179 HE2 PHE 22 HE1 PHE 22 23.121 -8.763 10.759 180 HZ PHE 22 HZ PHE 22 21.279 -10.411 10.937 181 H ASN 23 H ASN 23 22.110 -4.466 6.216 182 HA ASN 23 HA ASN 23 21.780 -3.795 8.965 183 HB2 ASN 23 2HB ASN 23 23.538 -2.802 7.681 184 HB3 ASN 23 3HB ASN 23 22.409 -2.259 6.431 185 HD21 ASN 23 2HD2 ASN 23 21.307 -0.334 6.635 186 HD22 ASN 23 1HD2 ASN 23 21.532 0.767 7.973 187 H LEU 24 H LEU 24 19.934 -2.943 6.019 188 HA LEU 24 HA LEU 24 18.056 -1.287 7.490 189 HB2 LEU 24 2HB LEU 24 17.924 -2.486 4.700 190 HB3 LEU 24 3HB LEU 24 16.823 -1.255 5.354 191 HG LEU 24 HG LEU 24 19.840 -0.874 5.106 192 HD11 LEU 24 1HD1 LEU 24 18.795 -1.162 2.893 193 HD12 LEU 24 2HD1 LEU 24 17.581 0.079 3.299 194 HD13 LEU 24 3HD1 LEU 24 19.296 0.522 3.137 195 HD21 LEU 24 3HD2 LEU 24 17.559 1.080 5.628 196 HD22 LEU 24 1HD2 LEU 24 18.790 0.562 6.807 197 HD23 LEU 24 2HD2 LEU 24 19.265 1.516 5.394 198 H LEU 25 H LEU 25 18.358 -4.698 6.924 199 HA LEU 25 HA LEU 25 15.512 -5.259 7.373 200 HB2 LEU 25 2HB LEU 25 16.870 -6.683 5.907 201 HB3 LEU 25 3HB LEU 25 17.999 -7.012 7.219 202 HG LEU 25 HG LEU 25 16.191 -8.161 8.487 203 HD11 LEU 25 1HD1 LEU 25 14.103 -8.757 7.294 204 HD12 LEU 25 2HD1 LEU 25 14.221 -7.001 7.540 205 HD13 LEU 25 3HD1 LEU 25 14.570 -7.706 5.942 206 HD21 LEU 25 3HD2 LEU 25 17.706 -9.426 7.010 207 HD22 LEU 25 1HD2 LEU 25 16.076 -10.131 6.974 208 HD23 LEU 25 2HD2 LEU 25 16.635 -9.122 5.623 209 H VAL 26 H VAL 26 18.570 -5.359 9.338 210 HA VAL 26 HA VAL 26 17.137 -6.604 11.508 211 HB VAL 26 HB VAL 26 19.079 -6.230 12.856 212 HG11 VAL 26 1HG1 VAL 26 20.765 -7.402 11.513 213 HG12 VAL 26 2HG1 VAL 26 19.144 -8.093 11.266 214 HG13 VAL 26 3HG1 VAL 26 19.867 -7.041 10.029 215 HG21 VAL 26 3HG2 VAL 26 20.147 -4.512 10.597 216 HG22 VAL 26 1HG2 VAL 26 19.664 -3.961 12.228 217 HG23 VAL 26 2HG2 VAL 26 21.056 -5.042 12.034 218 H VAL 27 H VAL 27 17.486 -3.203 10.518 219 HA VAL 27 HA VAL 27 16.929 -2.160 13.140 220 HB VAL 27 HB VAL 27 16.264 -0.084 11.934 221 HG11 VAL 27 1HG1 VAL 27 18.494 0.334 10.932 222 HG12 VAL 27 2HG1 VAL 27 18.609 -0.464 12.528 223 HG13 VAL 27 3HG1 VAL 27 18.850 -1.402 11.034 224 HG21 VAL 27 3HG2 VAL 27 15.319 -1.148 9.888 225 HG22 VAL 27 1HG2 VAL 27 16.575 0.046 9.508 226 HG23 VAL 27 2HG2 VAL 27 16.968 -1.685 9.450 227 H ARG 28 H ARG 28 14.885 -3.561 10.625 228 HA ARG 28 HA ARG 28 12.393 -2.523 11.650 229 HB2 ARG 28 2HB ARG 28 12.825 -5.154 10.185 230 HB3 ARG 28 3HB ARG 28 11.366 -4.145 10.226 231 HG2 ARG 28 2HG ARG 28 12.682 -2.351 8.997 232 HG3 ARG 28 3HG ARG 28 14.033 -3.489 8.912 233 HD2 ARG 28 2HD ARG 28 12.872 -3.626 6.829 234 HD3 ARG 28 3HD ARG 28 12.548 -5.124 7.721 235 HE ARG 28 HE ARG 28 10.398 -3.669 8.430 236 HH11 ARG 28 1HH1 ARG 28 11.881 -4.104 5.247 237 HH12 ARG 28 2HH1 ARG 28 10.374 -3.883 4.386 238 HH21 ARG 28 1HH2 ARG 28 8.453 -3.403 7.281 239 HH22 ARG 28 2HH2 ARG 28 8.443 -3.493 5.534 240 H TYR 29 H TYR 29 14.494 -5.243 12.385 241 HA TYR 29 HA TYR 29 12.534 -6.313 14.332 242 HB2 TYR 29 2HB TYR 29 15.103 -7.435 13.164 243 HB3 TYR 29 3HB TYR 29 14.160 -8.223 14.415 244 HD1 TYR 29 HD1 TYR 29 13.892 -6.959 10.908 245 HD2 TYR 29 HD2 TYR 29 12.286 -9.517 13.961 246 HE1 TYR 29 HE1 TYR 29 12.315 -7.914 9.255 247 HE2 TYR 29 HE2 TYR 29 10.726 -10.517 12.313 248 HH TYR 29 HH TYR 29 10.616 -9.426 8.896 249 H GLN 30 H GLN 30 15.148 -4.132 14.337 250 HA GLN 30 HA GLN 30 16.593 -4.991 16.627 251 HB2 GLN 30 2HB GLN 30 17.316 -3.367 14.919 252 HB3 GLN 30 3HB GLN 30 16.140 -2.192 15.513 253 HG2 GLN 30 2HG GLN 30 17.315 -2.097 17.671 254 HG3 GLN 30 3HG GLN 30 18.437 -3.374 17.126 255 HE21 GLN 30 2HE2 GLN 30 19.362 -2.839 14.785 256 HE22 GLN 30 1HE2 GLN 30 19.984 -1.212 14.591 257 H HIS 31 H HIS 31 13.560 -3.176 16.279 258 HA HIS 31 HA HIS 31 13.436 -2.602 19.160 259 HB2 HIS 31 2HB HIS 31 11.464 -2.182 16.888 260 HB3 HIS 31 3HB HIS 31 11.237 -1.628 18.550 261 HD2 HIS 31 HD2 HIS 31 13.087 0.250 19.470 262 HE1 HIS 31 HE1 HIS 31 14.161 1.613 15.586 263 HE2 HIS 31 HE2 HIS 31 14.280 2.124 18.082 264 H LYS 32 H LYS 32 12.131 -4.979 16.857 265 HA LYS 32 HA LYS 32 10.106 -5.930 18.725 266 HB2 LYS 32 2HB LYS 32 11.127 -7.075 16.097 267 HB3 LYS 32 3HB LYS 32 9.689 -7.625 16.982 268 HG2 LYS 32 2HG LYS 32 8.704 -5.358 16.780 269 HG3 LYS 32 3HG LYS 32 10.103 -4.850 15.806 270 HD2 LYS 32 2HD LYS 32 9.613 -6.648 14.167 271 HD3 LYS 32 3HD LYS 32 8.200 -7.140 15.120 272 HE2 LYS 32 2HE LYS 32 8.630 -4.388 13.905 273 HE3 LYS 32 3HE LYS 32 7.639 -5.673 13.186 274 HZ1 LYS 32 3HZ LYS 32 7.153 -4.403 15.804 275 HZ2 LYS 32 1HZ LYS 32 6.295 -4.129 14.429 276 HZ3 LYS 32 2HZ LYS 32 6.242 -5.602 15.140 277 H VAL 33 H VAL 33 13.362 -6.973 17.705 278 HA VAL 33 HA VAL 33 13.308 -9.514 19.049 279 HB VAL 33 HB VAL 33 15.605 -7.706 18.141 280 HG11 VAL 33 1HG1 VAL 33 15.488 -10.667 18.704 281 HG12 VAL 33 2HG1 VAL 33 16.897 -9.765 18.074 282 HG13 VAL 33 3HG1 VAL 33 16.327 -9.478 19.755 283 HG21 VAL 33 3HG2 VAL 33 14.010 -8.611 16.347 284 HG22 VAL 33 1HG2 VAL 33 15.743 -9.096 16.225 285 HG23 VAL 33 2HG2 VAL 33 14.532 -10.235 16.859 286 H ALA 34 H ALA 34 14.353 -6.197 19.856 287 HA ALA 34 HA ALA 34 15.537 -6.820 22.362 288 HB1 ALA 34 1HB ALA 34 14.189 -4.263 21.399 289 HB2 ALA 34 2HB ALA 34 15.304 -4.401 22.781 290 HB3 ALA 34 3HB ALA 34 15.890 -4.705 21.132 291 H SER 35 H SER 35 12.161 -6.577 21.363 292 HA SER 35 HA SER 35 11.122 -6.006 24.000 293 HB2 SER 35 2HB SER 35 9.943 -5.501 21.856 294 HB3 SER 35 3HB SER 35 9.751 -7.243 21.582 295 HG SER 35 HG SER 35 7.930 -6.281 22.619 296 H LEU 36 H LEU 36 11.515 -8.999 22.020 297 HA LEU 36 HA LEU 36 10.355 -10.584 24.185 298 HB2 LEU 36 2HB LEU 36 10.551 -12.454 22.708 299 HB3 LEU 36 3HB LEU 36 9.929 -11.067 21.806 300 HG LEU 36 HG LEU 36 12.469 -10.732 21.129 301 HD11 LEU 36 1HD1 LEU 36 12.332 -13.718 21.777 302 HD12 LEU 36 2HD1 LEU 36 13.623 -12.910 20.860 303 HD13 LEU 36 3HD1 LEU 36 13.407 -12.555 22.581 304 HD21 LEU 36 3HD2 LEU 36 10.727 -12.983 20.062 305 HD22 LEU 36 1HD2 LEU 36 10.646 -11.269 19.574 306 HD23 LEU 36 2HD2 LEU 36 12.093 -12.234 19.205 307 H VAL 37 H VAL 37 13.600 -9.666 23.117 308 HA VAL 37 HA VAL 37 14.767 -11.831 24.692 309 HB VAL 37 HB VAL 37 15.628 -10.907 22.462 310 HG11 VAL 37 1HG1 VAL 37 15.688 -8.501 23.384 311 HG12 VAL 37 2HG1 VAL 37 17.173 -9.019 24.236 312 HG13 VAL 37 3HG1 VAL 37 17.105 -9.085 22.461 313 HG21 VAL 37 3HG2 VAL 37 17.572 -11.243 24.775 314 HG22 VAL 37 1HG2 VAL 37 16.785 -12.572 23.886 315 HG23 VAL 37 2HG2 VAL 37 17.913 -11.486 23.048 316 H SER 38 H SER 38 13.732 -8.571 25.305 317 HA SER 38 HA SER 38 15.416 -8.077 27.582 318 HB2 SER 38 2HB SER 38 14.098 -6.319 26.415 319 HB3 SER 38 3HB SER 38 12.599 -7.094 26.962 320 HG SER 38 HG SER 38 13.289 -5.370 28.332 321 H ARG 39 H ARG 39 12.962 -10.363 26.955 322 HA ARG 39 HA ARG 39 12.082 -10.665 29.735 323 HB2 ARG 39 2HB ARG 39 11.567 -12.430 27.325 324 HB3 ARG 39 3HB ARG 39 10.683 -12.433 28.862 325 HG2 ARG 39 2HG ARG 39 9.903 -10.120 28.431 326 HG3 ARG 39 3HG ARG 39 10.818 -10.093 26.907 327 HD2 ARG 39 2HD ARG 39 9.492 -12.055 26.116 328 HD3 ARG 39 3HD ARG 39 8.494 -11.925 27.583 329 HE ARG 39 HE ARG 39 8.581 -9.391 26.274 330 HH11 ARG 39 1HH1 ARG 39 7.240 -12.629 25.829 331 HH12 ARG 39 2HH1 ARG 39 5.881 -12.066 24.883 332 HH21 ARG 39 1HH2 ARG 39 6.808 -8.679 25.042 333 HH22 ARG 39 2HH2 ARG 39 5.640 -9.835 24.439 334 H TYR 40 H TYR 40 14.865 -11.539 28.036 335 HA TYR 40 HA TYR 40 15.282 -13.908 29.802 336 HB2 TYR 40 2HB TYR 40 16.257 -13.453 26.970 337 HB3 TYR 40 3HB TYR 40 16.720 -14.807 28.000 338 HD1 TYR 40 HD1 TYR 40 14.842 -16.359 28.870 339 HD2 TYR 40 HD2 TYR 40 14.320 -13.571 25.636 340 HE1 TYR 40 HE1 TYR 40 12.837 -17.613 28.112 341 HE2 TYR 40 HE2 TYR 40 12.335 -14.831 24.858 342 HH TYR 40 HH TYR 40 11.151 -17.750 26.573 343 H VAL 41 H VAL 41 16.460 -10.779 28.802 344 HA VAL 41 HA VAL 41 18.666 -11.093 30.746 345 HB VAL 41 HB VAL 41 20.131 -9.699 29.211 346 HG11 VAL 41 1HG1 VAL 41 19.449 -12.507 28.258 347 HG12 VAL 41 2HG1 VAL 41 20.974 -11.633 27.984 348 HG13 VAL 41 3HG1 VAL 41 20.504 -12.110 29.631 349 HG21 VAL 41 3HG2 VAL 41 18.275 -10.732 27.034 350 HG22 VAL 41 1HG2 VAL 41 18.337 -9.037 27.596 351 HG23 VAL 41 2HG2 VAL 41 19.751 -9.780 26.821 352 HA PRO 42 HA PRO 42 17.149 -7.249 32.175 353 HB2 PRO 42 2HB PRO 42 19.372 -6.035 33.218 354 HB3 PRO 42 3HB PRO 42 18.636 -7.509 33.936 355 HG2 PRO 42 2HG PRO 42 20.950 -7.352 31.975 356 HG3 PRO 42 3HG PRO 42 20.901 -8.221 33.549 357 HD2 PRO 42 2HD PRO 42 20.416 -9.520 31.233 358 HD3 PRO 42 3HD PRO 42 19.411 -9.862 32.676 359 H SER 43 H SER 43 17.361 -4.837 31.937 360 HA SER 43 HA SER 43 17.490 -4.225 29.169 361 HB2 SER 43 2HB SER 43 16.995 -1.917 29.929 362 HB3 SER 43 3HB SER 43 15.949 -3.132 30.703 363 HG SER 43 HG SER 43 16.815 -1.615 32.200 364 H GLY 44 H GLY 44 20.046 -4.401 31.453 365 HA2 GLY 44 2HA GLY 44 21.700 -2.347 30.142 366 HA3 GLY 44 3HA GLY 44 22.148 -3.405 31.493 367 H ASP 45 H ASP 45 21.009 -5.757 29.773 368 HA ASP 45 HA ASP 45 23.446 -6.081 28.072 369 HB2 ASP 45 2HB ASP 45 21.884 -8.098 29.710 370 HB3 ASP 45 3HB ASP 45 23.142 -8.520 28.540 371 H VAL 46 H VAL 46 20.119 -5.610 27.939 372 HA VAL 46 HA VAL 46 19.429 -7.592 26.004 373 HB VAL 46 HB VAL 46 17.864 -6.389 27.530 374 HG11 VAL 46 1HG1 VAL 46 18.058 -4.161 25.467 375 HG12 VAL 46 2HG1 VAL 46 16.864 -4.293 26.778 376 HG13 VAL 46 3HG1 VAL 46 18.580 -4.061 27.174 377 HG21 VAL 46 3HG2 VAL 46 17.015 -7.733 25.750 378 HG22 VAL 46 1HG2 VAL 46 16.039 -6.256 25.834 379 HG23 VAL 46 2HG2 VAL 46 17.256 -6.427 24.549 380 HA PRO 47 HA PRO 47 20.137 -4.312 22.662 381 HB2 PRO 47 2HB PRO 47 22.052 -2.423 22.872 382 HB3 PRO 47 3HB PRO 47 20.444 -2.212 23.643 383 HG2 PRO 47 2HG PRO 47 23.000 -3.214 24.934 384 HG3 PRO 47 3HG PRO 47 21.916 -1.908 25.514 385 HD2 PRO 47 2HD PRO 47 21.756 -4.473 26.413 386 HD3 PRO 47 3HD PRO 47 20.294 -3.457 26.225 387 H ASP 48 H ASP 48 22.784 -5.658 24.580 388 HA ASP 48 HA ASP 48 24.601 -5.834 22.305 389 HB2 ASP 48 2HB ASP 48 25.340 -5.485 24.673 390 HB3 ASP 48 3HB ASP 48 24.742 -7.110 25.066 391 H VAL 49 H VAL 49 22.185 -7.850 23.904 392 HA VAL 49 HA VAL 49 23.069 -10.291 22.577 393 HB VAL 49 HB VAL 49 20.606 -9.568 24.212 394 HG11 VAL 49 1HG1 VAL 49 20.065 -11.407 22.632 395 HG12 VAL 49 2HG1 VAL 49 21.520 -12.283 23.169 396 HG13 VAL 49 3HG1 VAL 49 20.179 -11.997 24.303 397 HG21 VAL 49 3HG2 VAL 49 22.786 -9.656 25.427 398 HG22 VAL 49 1HG2 VAL 49 21.706 -10.986 25.905 399 HG23 VAL 49 2HG2 VAL 49 23.058 -11.290 24.792 400 H VAL 50 H VAL 50 20.755 -7.654 21.906 401 HA VAL 50 HA VAL 50 19.502 -8.974 19.652 402 HB VAL 50 HB VAL 50 19.877 -6.058 20.427 403 HG11 VAL 50 1HG1 VAL 50 18.253 -7.261 18.142 404 HG12 VAL 50 2HG1 VAL 50 18.150 -5.575 18.699 405 HG13 VAL 50 3HG1 VAL 50 19.656 -6.178 17.975 406 HG21 VAL 50 3HG2 VAL 50 18.361 -7.474 21.838 407 HG22 VAL 50 1HG2 VAL 50 17.487 -6.199 20.958 408 HG23 VAL 50 2HG2 VAL 50 17.430 -7.874 20.371 409 H GLN 51 H GLN 51 22.482 -7.035 20.138 410 HA GLN 51 HA GLN 51 23.054 -6.843 17.321 411 HB2 GLN 51 2HB GLN 51 23.971 -5.304 19.030 412 HB3 GLN 51 3HB GLN 51 24.919 -6.647 19.717 413 HG2 GLN 51 2HG GLN 51 26.120 -6.916 17.599 414 HG3 GLN 51 3HG GLN 51 25.134 -5.654 16.844 415 HE21 GLN 51 2HE2 GLN 51 27.654 -5.094 16.544 416 HE22 GLN 51 1HE2 GLN 51 28.258 -3.942 17.720 417 H GLU 52 H GLU 52 24.083 -9.137 19.941 418 HA GLU 52 HA GLU 52 25.781 -10.620 18.156 419 HB2 GLU 52 2HB GLU 52 25.964 -10.691 20.632 420 HB3 GLU 52 3HB GLU 52 24.403 -11.539 20.716 421 HG2 GLU 52 2HG GLU 52 25.317 -13.407 19.400 422 HG3 GLU 52 3HG GLU 52 26.838 -12.533 19.179 423 H ALA 53 H ALA 53 22.290 -10.668 18.849 424 HA ALA 53 HA ALA 53 21.803 -13.214 17.606 425 HB1 ALA 53 1HB ALA 53 19.459 -12.463 17.584 426 HB2 ALA 53 2HB ALA 53 20.220 -12.175 19.162 427 HB3 ALA 53 3HB ALA 53 19.967 -10.821 18.031 428 H PHE 54 H PHE 54 21.977 -9.832 16.382 429 HA PHE 54 HA PHE 54 21.162 -10.595 13.704 430 HB2 PHE 54 2HB PHE 54 22.561 -8.133 14.810 431 HB3 PHE 54 3HB PHE 54 21.995 -8.305 13.147 432 HD1 PHE 54 HD2 PHE 54 19.353 -9.841 13.957 433 HD2 PHE 54 HD1 PHE 54 21.203 -6.185 15.304 434 HE1 PHE 54 HE2 PHE 54 17.151 -8.952 14.598 435 HE2 PHE 54 HE1 PHE 54 18.975 -5.289 15.891 436 HZ PHE 54 HZ PHE 54 16.950 -6.683 15.560 437 H ILE 55 H ILE 55 24.314 -10.314 15.385 438 HA ILE 55 HA ILE 55 25.848 -10.587 12.950 439 HB ILE 55 HB ILE 55 26.506 -11.090 15.884 440 HG12 ILE 55 2HG1 ILE 55 27.281 -8.781 14.036 441 HG13 ILE 55 3HG1 ILE 55 25.936 -8.719 15.166 442 HG21 ILE 55 1HG2 ILE 55 28.374 -10.952 13.477 443 HG22 ILE 55 2HG2 ILE 55 28.878 -11.092 15.183 444 HG23 ILE 55 3HG2 ILE 55 27.999 -12.412 14.414 445 HD11 ILE 55 3HD1 ILE 55 28.871 -9.103 15.886 446 HD12 ILE 55 1HD1 ILE 55 27.887 -7.661 16.164 447 HD13 ILE 55 2HD1 ILE 55 27.521 -9.162 17.049 448 H LYS 56 H LYS 56 24.492 -12.816 15.384 449 HA LYS 56 HA LYS 56 25.679 -15.191 14.229 450 HB2 LYS 56 2HB LYS 56 25.060 -14.907 16.609 451 HB3 LYS 56 3HB LYS 56 23.349 -14.791 16.156 452 HG2 LYS 56 2HG LYS 56 23.442 -17.081 15.213 453 HG3 LYS 56 3HG LYS 56 25.156 -17.199 15.695 454 HD2 LYS 56 2HD LYS 56 22.817 -16.707 17.585 455 HD3 LYS 56 3HD LYS 56 23.616 -18.276 17.342 456 HE2 LYS 56 2HE LYS 56 25.757 -17.304 18.115 457 HE3 LYS 56 3HE LYS 56 24.972 -15.731 18.330 458 HZ1 LYS 56 3HZ LYS 56 23.524 -16.740 19.945 459 HZ2 LYS 56 1HZ LYS 56 24.277 -18.198 19.775 460 HZ3 LYS 56 2HZ LYS 56 25.106 -16.913 20.387 461 H ALA 57 H ALA 57 22.628 -13.384 13.825 462 HA ALA 57 HA ALA 57 21.263 -15.467 12.407 463 HB1 ALA 57 1HB ALA 57 20.906 -12.442 12.382 464 HB2 ALA 57 2HB ALA 57 19.785 -13.609 11.645 465 HB3 ALA 57 3HB ALA 57 20.035 -13.610 13.400 466 H TYR 58 H TYR 58 23.337 -12.695 11.311 467 HA TYR 58 HA TYR 58 22.781 -13.028 8.555 468 HB2 TYR 58 2HB TYR 58 23.906 -11.080 9.642 469 HB3 TYR 58 3HB TYR 58 25.338 -12.080 9.895 470 HD1 TYR 58 HD1 TYR 58 23.038 -10.911 7.164 471 HD2 TYR 58 HD2 TYR 58 27.005 -12.155 8.256 472 HE1 TYR 58 HE1 TYR 58 23.853 -10.230 4.929 473 HE2 TYR 58 HE2 TYR 58 27.834 -11.509 6.003 474 HH TYR 58 HH TYR 58 25.668 -10.118 3.510 475 H ARG 59 H ARG 59 25.197 -14.573 10.673 476 HA ARG 59 HA ARG 59 26.630 -15.898 8.551 477 HB2 ARG 59 2HB ARG 59 26.407 -16.384 11.549 478 HB3 ARG 59 3HB ARG 59 27.584 -17.190 10.488 479 HG2 ARG 59 2HG ARG 59 28.661 -15.107 9.943 480 HG3 ARG 59 3HG ARG 59 27.380 -14.156 10.722 481 HD2 ARG 59 2HD ARG 59 27.937 -15.073 12.903 482 HD3 ARG 59 3HD ARG 59 29.120 -16.173 12.173 483 HE ARG 59 HE ARG 59 29.853 -13.553 11.420 484 HH11 ARG 59 1HH1 ARG 59 29.587 -15.461 14.393 485 HH12 ARG 59 2HH1 ARG 59 30.820 -14.547 15.223 486 HH21 ARG 59 1HH2 ARG 59 31.477 -12.394 12.528 487 HH22 ARG 59 2HH2 ARG 59 31.902 -12.829 14.167 488 H ALA 60 H ALA 60 23.724 -16.605 10.372 489 HA ALA 60 HA ALA 60 23.625 -19.382 9.343 490 HB1 ALA 60 1HB ALA 60 21.795 -17.857 11.229 491 HB2 ALA 60 2HB ALA 60 21.679 -19.586 10.830 492 HB3 ALA 60 3HB ALA 60 23.099 -18.960 11.709 493 H LEU 61 H LEU 61 22.649 -16.243 8.395 494 HA LEU 61 HA LEU 61 20.088 -16.918 7.254 495 HB2 LEU 61 2HB LEU 61 20.892 -14.628 8.060 496 HB3 LEU 61 3HB LEU 61 21.930 -14.574 6.627 497 HG LEU 61 HG LEU 61 19.840 -14.846 5.224 498 HD11 LEU 61 1HD1 LEU 61 18.543 -14.495 7.955 499 HD12 LEU 61 2HD1 LEU 61 17.681 -14.309 6.405 500 HD13 LEU 61 3HD1 LEU 61 18.349 -15.888 6.863 501 HD21 LEU 61 3HD2 LEU 61 19.886 -12.511 7.188 502 HD22 LEU 61 1HD2 LEU 61 20.862 -12.643 5.704 503 HD23 LEU 61 2HD2 LEU 61 19.083 -12.530 5.599 504 H ASP 62 H ASP 62 23.440 -17.058 6.219 505 HA ASP 62 HA ASP 62 22.967 -17.305 3.404 506 HB2 ASP 62 2HB ASP 62 25.151 -16.795 4.468 507 HB3 ASP 62 3HB ASP 62 25.190 -18.430 5.151 508 H SER 63 H SER 63 22.129 -19.327 6.034 509 HA SER 63 HA SER 63 21.991 -21.737 4.300 510 HB2 SER 63 2HB SER 63 21.896 -21.476 7.324 511 HB3 SER 63 3HB SER 63 21.874 -22.994 6.396 512 HG SER 63 HG SER 63 23.924 -22.444 5.585 513 H PHE 64 H PHE 64 20.082 -19.175 5.231 514 HA PHE 64 HA PHE 64 17.629 -20.619 5.873 515 HB2 PHE 64 2HB PHE 64 18.113 -18.399 6.768 516 HB3 PHE 64 3HB PHE 64 18.199 -17.736 5.131 517 HD1 PHE 64 HD1 PHE 64 15.895 -19.363 7.574 518 HD2 PHE 64 HD2 PHE 64 16.263 -17.020 3.994 519 HE1 PHE 64 HE1 PHE 64 13.466 -18.897 7.637 520 HE2 PHE 64 HE2 PHE 64 13.827 -16.534 4.060 521 HZ PHE 64 HZ PHE 64 12.427 -17.463 5.880 522 H ARG 65 H ARG 65 16.037 -21.245 4.494 523 HA ARG 65 HA ARG 65 16.409 -20.619 1.600 524 HB2 ARG 65 2HB ARG 65 15.586 -23.278 2.828 525 HB3 ARG 65 3HB ARG 65 15.696 -22.932 1.101 526 HG2 ARG 65 2HG ARG 65 17.999 -22.965 3.094 527 HG3 ARG 65 3HG ARG 65 17.655 -24.175 1.851 528 HD2 ARG 65 2HD ARG 65 18.474 -21.279 1.394 529 HD3 ARG 65 3HD ARG 65 19.463 -22.715 1.118 530 HE ARG 65 HE ARG 65 17.650 -23.358 -0.590 531 HH11 ARG 65 1HH1 ARG 65 18.462 -19.998 0.171 532 HH12 ARG 65 2HH1 ARG 65 17.959 -19.402 -1.395 533 HH21 ARG 65 1HH2 ARG 65 17.021 -22.555 -2.625 534 HH22 ARG 65 2HH2 ARG 65 17.148 -20.845 -2.971 535 H GLY 66 H GLY 66 14.416 -19.938 4.098 536 HA2 GLY 66 2HA GLY 66 12.338 -18.942 3.997 537 HA3 GLY 66 3HA GLY 66 12.234 -19.338 2.278 538 H ASP 67 H ASP 67 12.934 -22.047 4.380 539 HA ASP 67 HA ASP 67 10.435 -23.325 3.731 540 HB2 ASP 67 2HB ASP 67 12.577 -24.004 5.783 541 HB3 ASP 67 3HB ASP 67 11.237 -25.068 5.315 542 H SER 68 H SER 68 11.225 -20.960 6.026 543 HA SER 68 HA SER 68 8.622 -21.281 7.379 544 HB2 SER 68 2HB SER 68 11.273 -20.965 8.864 545 HB3 SER 68 3HB SER 68 9.659 -20.931 9.599 546 HG SER 68 HG SER 68 9.371 -23.075 8.867 547 H ALA 69 H ALA 69 8.134 -19.217 8.648 548 HA ALA 69 HA ALA 69 8.679 -16.945 6.996 549 HB1 ALA 69 1HB ALA 69 7.563 -17.087 9.828 550 HB2 ALA 69 2HB ALA 69 7.473 -15.691 8.727 551 HB3 ALA 69 3HB ALA 69 6.611 -17.193 8.330 552 H PHE 70 H PHE 70 10.011 -15.113 7.361 553 HA PHE 70 HA PHE 70 12.545 -15.801 8.494 554 HB2 PHE 70 2HB PHE 70 12.380 -14.273 6.612 555 HB3 PHE 70 3HB PHE 70 11.371 -13.166 7.553 556 HD1 PHE 70 HD1 PHE 70 14.735 -14.846 7.767 557 HD2 PHE 70 HD2 PHE 70 12.393 -11.321 8.541 558 HE1 PHE 70 HE1 PHE 70 16.756 -13.678 8.615 559 HE2 PHE 70 HE2 PHE 70 14.411 -10.157 9.378 560 HZ PHE 70 HZ PHE 70 16.603 -11.342 9.410 561 H TYR 71 H TYR 71 9.749 -13.962 9.795 562 HA TYR 71 HA TYR 71 11.312 -12.768 11.887 563 HB2 TYR 71 2HB TYR 71 9.198 -12.101 12.847 564 HB3 TYR 71 3HB TYR 71 9.196 -11.827 11.104 565 HD1 TYR 71 HD1 TYR 71 7.891 -13.967 13.837 566 HD2 TYR 71 HD2 TYR 71 7.612 -12.923 9.674 567 HE1 TYR 71 HE1 TYR 71 5.758 -15.225 13.670 568 HE2 TYR 71 HE2 TYR 71 5.471 -14.176 9.497 569 HH TYR 71 HH TYR 71 4.046 -15.900 12.302 570 H THR 72 H THR 72 9.380 -15.806 11.686 571 HA THR 72 HA THR 72 9.731 -16.428 14.486 572 HB THR 72 HB THR 72 9.216 -18.292 12.126 573 HG1 THR 72 1HG THR 72 7.057 -18.013 12.744 574 HG21 THR 72 1HG2 THR 72 9.934 -19.478 14.172 575 HG22 THR 72 2HG2 THR 72 8.727 -18.584 15.120 576 HG23 THR 72 3HG2 THR 72 8.205 -19.747 13.874 577 H TRP 73 H TRP 73 11.582 -17.050 11.493 578 HA TRP 73 HA TRP 73 13.403 -18.926 12.687 579 HB2 TRP 73 2HB TRP 73 13.032 -18.818 10.293 580 HB3 TRP 73 3HB TRP 73 13.564 -17.139 10.245 581 HD1 TRP 73 HD1 TRP 73 14.883 -20.671 10.260 582 HE1 TRP 73 HE1 TRP 73 17.411 -20.671 9.883 583 HE3 TRP 73 HE3 TRP 73 15.759 -15.639 10.641 584 HZ2 TRP 73 HZ2 TRP 73 19.564 -18.750 9.880 585 HZ3 TRP 73 HZ3 TRP 73 18.062 -14.766 10.451 586 HH2 TRP 73 HH2 TRP 73 19.966 -16.307 10.097 587 H LEU 74 H LEU 74 13.307 -15.367 12.454 588 HA LEU 74 HA LEU 74 16.065 -15.067 13.311 589 HB2 LEU 74 2HB LEU 74 14.959 -13.456 11.819 590 HB3 LEU 74 3HB LEU 74 13.760 -13.098 13.074 591 HG LEU 74 HG LEU 74 15.566 -12.270 14.567 592 HD11 LEU 74 1HD1 LEU 74 17.333 -12.701 12.117 593 HD12 LEU 74 2HD1 LEU 74 17.808 -11.823 13.592 594 HD13 LEU 74 3HD1 LEU 74 17.473 -13.562 13.666 595 HD21 LEU 74 3HD2 LEU 74 14.324 -10.736 13.108 596 HD22 LEU 74 1HD2 LEU 74 15.995 -10.200 13.355 597 HD23 LEU 74 2HD2 LEU 74 15.527 -10.973 11.814 598 H TYR 75 H TYR 75 12.826 -14.964 14.868 599 HA TYR 75 HA TYR 75 13.859 -13.891 17.327 600 HB2 TYR 75 2HB TYR 75 11.301 -15.388 16.683 601 HB3 TYR 75 3HB TYR 75 11.646 -14.633 18.243 602 HD1 TYR 75 HD1 TYR 75 13.100 -12.129 17.044 603 HD2 TYR 75 HD2 TYR 75 9.342 -14.063 16.202 604 HE1 TYR 75 HE1 TYR 75 12.201 -10.001 16.251 605 HE2 TYR 75 HE2 TYR 75 8.428 -11.912 15.372 606 HH TYR 75 HH TYR 75 10.382 -8.914 15.318 607 H ARG 76 H ARG 76 13.911 -17.131 15.998 608 HA ARG 76 HA ARG 76 14.410 -18.383 18.585 609 HB2 ARG 76 2HB ARG 76 14.898 -19.289 15.724 610 HB3 ARG 76 3HB ARG 76 15.222 -20.286 17.162 611 HG2 ARG 76 2HG ARG 76 12.861 -19.946 17.895 612 HG3 ARG 76 3HG ARG 76 12.542 -19.118 16.356 613 HD2 ARG 76 2HD ARG 76 13.502 -21.997 16.687 614 HD3 ARG 76 3HD ARG 76 11.849 -21.501 16.312 615 HE ARG 76 HE ARG 76 12.546 -20.756 14.143 616 HH11 ARG 76 1HH1 ARG 76 15.098 -22.420 15.946 617 HH12 ARG 76 2HH1 ARG 76 16.034 -22.778 14.514 618 HH21 ARG 76 1HH2 ARG 76 13.761 -21.278 12.302 619 HH22 ARG 76 2HH2 ARG 76 15.284 -22.129 12.463 620 H ILE 77 H ILE 77 16.333 -16.587 16.236 621 HA ILE 77 HA ILE 77 18.875 -17.544 17.256 622 HB ILE 77 HB ILE 77 18.362 -14.880 15.884 623 HG12 ILE 77 2HG1 ILE 77 17.340 -16.519 14.422 624 HG13 ILE 77 3HG1 ILE 77 18.864 -15.959 13.737 625 HG21 ILE 77 1HG2 ILE 77 20.579 -15.142 16.840 626 HG22 ILE 77 2HG2 ILE 77 20.775 -16.724 16.058 627 HG23 ILE 77 3HG2 ILE 77 20.688 -15.249 15.074 628 HD11 ILE 77 3HD1 ILE 77 18.610 -18.358 13.428 629 HD12 ILE 77 1HD1 ILE 77 19.978 -18.036 14.513 630 HD13 ILE 77 2HD1 ILE 77 18.414 -18.603 15.177 631 H ALA 78 H ALA 78 16.577 -14.980 18.111 632 HA ALA 78 HA ALA 78 18.482 -13.478 19.675 633 HB1 ALA 78 1HB ALA 78 15.451 -13.353 19.565 634 HB2 ALA 78 2HB ALA 78 16.522 -12.121 20.263 635 HB3 ALA 78 3HB ALA 78 16.583 -12.460 18.519 636 H VAL 79 H VAL 79 15.936 -15.913 20.456 637 HA VAL 79 HA VAL 79 16.335 -15.481 23.313 638 HB VAL 79 HB VAL 79 14.138 -16.021 22.432 639 HG11 VAL 79 1HG1 VAL 79 14.846 -17.509 20.558 640 HG12 VAL 79 2HG1 VAL 79 15.293 -18.758 21.744 641 HG13 VAL 79 3HG1 VAL 79 13.599 -18.250 21.588 642 HG21 VAL 79 3HG2 VAL 79 15.211 -18.315 24.126 643 HG22 VAL 79 1HG2 VAL 79 14.803 -16.705 24.751 644 HG23 VAL 79 2HG2 VAL 79 13.535 -17.735 24.040 645 H ASN 80 H ASN 80 17.587 -17.713 20.850 646 HA ASN 80 HA ASN 80 18.723 -19.526 22.831 647 HB2 ASN 80 2HB ASN 80 19.199 -19.139 19.854 648 HB3 ASN 80 3HB ASN 80 20.007 -20.370 20.829 649 HD21 ASN 80 2HD2 ASN 80 18.681 -21.404 18.808 650 HD22 ASN 80 1HD2 ASN 80 17.163 -22.120 19.314 651 H THR 81 H THR 81 19.680 -16.467 21.361 652 HA THR 81 HA THR 81 22.483 -16.813 22.129 653 HB THR 81 HB THR 81 20.934 -14.389 21.115 654 HG1 THR 81 1HG THR 81 21.103 -15.880 19.535 655 HG21 THR 81 1HG2 THR 81 23.930 -14.854 21.452 656 HG22 THR 81 2HG2 THR 81 23.179 -13.474 20.618 657 HG23 THR 81 3HG2 THR 81 22.951 -13.685 22.364 658 H ALA 82 H ALA 82 19.522 -15.451 23.554 659 HA ALA 82 HA ALA 82 20.928 -13.922 25.564 660 HB1 ALA 82 1HB ALA 82 18.617 -13.434 24.802 661 HB2 ALA 82 2HB ALA 82 18.067 -14.981 25.482 662 HB3 ALA 82 3HB ALA 82 18.684 -13.707 26.559 663 H LYS 83 H LYS 83 19.637 -17.243 25.357 664 HA LYS 83 HA LYS 83 20.195 -17.802 28.163 665 HB2 LYS 83 2HB LYS 83 19.517 -19.550 25.767 666 HB3 LYS 83 3HB LYS 83 19.722 -20.167 27.419 667 HG2 LYS 83 2HG LYS 83 17.921 -18.733 28.235 668 HG3 LYS 83 3HG LYS 83 17.728 -17.994 26.634 669 HD2 LYS 83 2HD LYS 83 17.096 -20.157 25.670 670 HD3 LYS 83 3HD LYS 83 17.323 -20.955 27.244 671 HE2 LYS 83 2HE LYS 83 15.349 -18.700 26.702 672 HE3 LYS 83 3HE LYS 83 14.929 -20.420 26.715 673 HZ1 LYS 83 3HZ LYS 83 16.037 -18.933 28.996 674 HZ2 LYS 83 1HZ LYS 83 14.467 -19.399 28.820 675 HZ3 LYS 83 2HZ LYS 83 15.644 -20.530 28.991 676 H ASN 84 H ASN 84 21.954 -18.001 25.096 677 HA ASN 84 HA ASN 84 24.120 -19.594 26.211 678 HB2 ASN 84 2HB ASN 84 23.514 -19.653 23.829 679 HB3 ASN 84 3HB ASN 84 23.904 -17.929 23.673 680 HD21 ASN 84 2HD2 ASN 84 26.080 -17.269 23.537 681 HD22 ASN 84 1HD2 ASN 84 27.396 -18.414 23.413 682 H TYR 85 H TYR 85 23.273 -16.179 26.016 683 HA TYR 85 HA TYR 85 25.939 -15.150 26.416 684 HB2 TYR 85 2HB TYR 85 24.113 -13.905 25.350 685 HB3 TYR 85 3HB TYR 85 23.177 -13.955 26.845 686 HD1 TYR 85 HD2 TYR 85 26.305 -12.623 25.295 687 HD2 TYR 85 HD1 TYR 85 23.487 -12.323 28.532 688 HE1 TYR 85 HE2 TYR 85 27.292 -10.445 25.939 689 HE2 TYR 85 HE1 TYR 85 24.510 -10.172 29.225 690 HH TYR 85 HH TYR 85 26.077 -8.569 28.740 691 H LEU 86 H LEU 86 23.231 -16.054 28.575 692 HA LEU 86 HA LEU 86 24.558 -14.898 30.901 693 HB2 LEU 86 2HB LEU 86 22.113 -16.674 30.582 694 HB3 LEU 86 3HB LEU 86 22.690 -16.036 32.131 695 HG LEU 86 HG LEU 86 21.816 -14.340 29.750 696 HD11 LEU 86 1HD1 LEU 86 19.927 -13.766 31.253 697 HD12 LEU 86 2HD1 LEU 86 19.956 -15.500 30.861 698 HD13 LEU 86 3HD1 LEU 86 20.529 -14.937 32.448 699 HD21 LEU 86 3HD2 LEU 86 21.939 -12.474 31.421 700 HD22 LEU 86 1HD2 LEU 86 22.703 -13.593 32.571 701 HD23 LEU 86 2HD2 LEU 86 23.530 -13.162 31.058 702 H VAL 87 H VAL 87 24.560 -18.122 29.378 703 HA VAL 87 HA VAL 87 25.754 -19.263 31.813 704 HB VAL 87 HB VAL 87 25.919 -21.334 30.544 705 HG11 VAL 87 1HG1 VAL 87 23.209 -19.969 30.269 706 HG12 VAL 87 2HG1 VAL 87 23.513 -21.722 30.271 707 HG13 VAL 87 3HG1 VAL 87 23.835 -20.760 31.732 708 HG21 VAL 87 3HG2 VAL 87 26.376 -20.454 28.303 709 HG22 VAL 87 1HG2 VAL 87 24.935 -21.492 28.276 710 HG23 VAL 87 2HG2 VAL 87 24.758 -19.724 28.242 711 H ALA 88 H ALA 88 26.831 -17.708 28.880 712 HA ALA 88 HA ALA 88 29.517 -18.828 28.987 713 HB1 ALA 88 1HB ALA 88 28.357 -16.445 27.474 714 HB2 ALA 88 2HB ALA 88 29.955 -17.172 27.193 715 HB3 ALA 88 3HB ALA 88 28.483 -18.111 26.857 716 H GLN 89 H GLN 89 27.856 -16.397 30.741 717 HA GLN 89 HA GLN 89 30.473 -15.254 31.623 718 HB2 GLN 89 2HB GLN 89 27.724 -13.953 31.636 719 HB3 GLN 89 3HB GLN 89 29.251 -13.227 32.195 720 HG2 GLN 89 2HG GLN 89 30.183 -13.481 29.893 721 HG3 GLN 89 3HG GLN 89 28.630 -14.128 29.347 722 HE21 GLN 89 2HE2 GLN 89 28.733 -12.283 27.789 723 HE22 GLN 89 1HE2 GLN 89 28.196 -10.710 28.336 724 H GLY 90 H GLY 90 27.621 -17.036 32.510 725 HA2 GLY 90 2HA GLY 90 27.909 -16.534 35.376 726 HA3 GLY 90 3HA GLY 90 26.806 -17.679 34.576 727 H ARG 91 H ARG 91 29.275 -18.695 32.989 728 HA ARG 91 HA ARG 91 30.327 -20.476 35.128 729 HB2 ARG 91 2HB ARG 91 30.197 -20.876 32.119 730 HB3 ARG 91 3HB ARG 91 30.836 -22.037 33.301 731 HG2 ARG 91 2HG ARG 91 28.610 -22.150 34.402 732 HG3 ARG 91 3HG ARG 91 27.972 -20.980 33.235 733 HD2 ARG 91 2HD ARG 91 27.330 -23.196 32.527 734 HD3 ARG 91 3HD ARG 91 28.530 -22.554 31.387 735 HE ARG 91 HE ARG 91 29.743 -24.125 33.506 736 HH11 ARG 91 1HH1 ARG 91 28.038 -24.350 30.415 737 HH12 ARG 91 2HH1 ARG 91 28.732 -25.901 30.011 738 HH21 ARG 91 1HH2 ARG 91 30.629 -26.156 32.955 739 HH22 ARG 91 2HH2 ARG 91 30.198 -26.919 31.445 740 H ARG 92 H ARG 92 31.187 -17.694 33.590 741 HA ARG 92 HA ARG 92 33.842 -18.282 32.666 742 HB2 ARG 92 2HB ARG 92 32.515 -16.355 31.914 743 HB3 ARG 92 3HB ARG 92 32.555 -15.675 33.553 744 HG2 ARG 92 2HG ARG 92 34.992 -15.454 33.435 745 HG3 ARG 92 3HG ARG 92 35.010 -16.231 31.834 746 HD2 ARG 92 2HD ARG 92 33.591 -14.398 30.948 747 HD3 ARG 92 3HD ARG 92 33.616 -13.618 32.542 748 HE ARG 92 HE ARG 92 36.297 -14.072 31.723 749 HH11 ARG 92 1HH1 ARG 92 33.512 -12.085 30.846 750 HH12 ARG 92 2HH1 ARG 92 34.495 -10.790 30.196 751 HH21 ARG 92 1HH2 ARG 92 37.552 -12.369 30.875 752 HH22 ARG 92 2HH2 ARG 92 36.775 -10.952 30.212 753 H LEU 93 H LEU 93 35.675 -18.532 33.732 754 HA LEU 93 HA LEU 93 37.093 -18.934 35.437 755 HB2 LEU 93 2HB LEU 93 36.148 -16.130 35.921 756 HB3 LEU 93 3HB LEU 93 37.179 -16.895 37.131 757 HG LEU 93 HG LEU 93 38.894 -17.392 35.463 758 HD11 LEU 93 1HD1 LEU 93 37.122 -15.845 33.526 759 HD12 LEU 93 2HD1 LEU 93 38.796 -16.361 33.220 760 HD13 LEU 93 3HD1 LEU 93 37.523 -17.579 33.419 761 HD21 LEU 93 3HD2 LEU 93 37.978 -14.486 35.455 762 HD22 LEU 93 1HD2 LEU 93 38.940 -15.272 36.727 763 HD23 LEU 93 2HD2 LEU 93 39.623 -15.064 35.099 764 H GLU 94 H GLU 94 34.125 -19.745 35.890 765 HA GLU 94 HA GLU 94 34.208 -19.971 38.843 766 HB2 GLU 94 2HB GLU 94 32.129 -19.235 37.667 767 HB3 GLU 94 3HB GLU 94 32.062 -20.805 36.848 768 HG2 GLU 94 2HG GLU 94 31.848 -21.952 39.018 769 HG3 GLU 94 3HG GLU 94 32.050 -20.408 39.868 770 H LEU 95 H LEU 95 35.055 -21.705 35.998 771 HA LEU 95 HA LEU 95 35.647 -24.096 37.615 772 HB2 LEU 95 2HB LEU 95 34.735 -25.555 35.769 773 HB3 LEU 95 3HB LEU 95 33.546 -24.711 36.752 774 HG LEU 95 HG LEU 95 33.236 -23.007 34.983 775 HD11 LEU 95 1HD1 LEU 95 35.134 -24.774 33.383 776 HD12 LEU 95 2HD1 LEU 95 34.109 -23.488 32.701 777 HD13 LEU 95 3HD1 LEU 95 35.399 -23.067 33.837 778 HD21 LEU 95 3HD2 LEU 95 32.966 -25.890 34.046 779 HD22 LEU 95 1HD2 LEU 95 31.812 -25.020 35.082 780 HD23 LEU 95 2HD2 LEU 95 32.073 -24.491 33.403 781 H VAL 96 H VAL 96 37.039 -21.762 36.162 782 HA VAL 96 HA VAL 96 38.837 -21.365 34.837 783 HB VAL 96 HB VAL 96 39.723 -24.115 35.780 784 HG11 VAL 96 1HG1 VAL 96 41.259 -21.599 34.981 785 HG12 VAL 96 2HG1 VAL 96 41.977 -23.109 35.580 786 HG13 VAL 96 3HG1 VAL 96 41.147 -23.086 34.012 787 HG21 VAL 96 3HG2 VAL 96 39.956 -21.379 37.104 788 HG22 VAL 96 1HG2 VAL 96 38.989 -22.751 37.697 789 HG23 VAL 96 2HG2 VAL 96 40.756 -22.866 37.661 790 HA PRO 97 HA PRO 97 37.041 -23.817 31.366 791 HB2 PRO 97 2HB PRO 97 36.593 -21.742 29.649 792 HB3 PRO 97 3HB PRO 97 35.478 -22.155 30.991 793 HG2 PRO 97 2HG PRO 97 37.674 -20.063 30.983 794 HG3 PRO 97 3HG PRO 97 35.962 -19.860 31.487 795 HD2 PRO 97 2HD PRO 97 37.926 -20.338 33.304 796 HD3 PRO 97 3HD PRO 97 36.318 -21.105 33.477 797 H ARG 98 H ARG 98 38.008 -24.468 29.444 798 HA ARG 98 HA ARG 98 39.793 -25.091 28.211 799 HB2 ARG 98 2HB ARG 98 40.227 -22.087 28.070 800 HB3 ARG 98 3HB ARG 98 40.946 -23.291 26.982 801 HG2 ARG 98 2HG ARG 98 38.669 -24.030 26.311 802 HG3 ARG 98 3HG ARG 98 37.967 -22.769 27.348 803 HD2 ARG 98 2HD ARG 98 39.128 -21.034 26.046 804 HD3 ARG 98 3HD ARG 98 39.878 -22.282 25.029 805 HE ARG 98 HE ARG 98 37.065 -22.651 24.951 806 HH11 ARG 98 1HH1 ARG 98 39.493 -20.311 23.893 807 HH12 ARG 98 2HH1 ARG 98 38.542 -19.769 22.527 808 HH21 ARG 98 1HH2 ARG 98 35.847 -21.929 23.171 809 HH22 ARG 98 2HH2 ARG 98 36.485 -20.686 22.118 810 H GLY 99 H GLY 99 40.243 -24.712 31.202 811 HA2 GLY 99 2HA GLY 99 43.022 -23.989 31.510 812 HA3 GLY 99 3HA GLY 99 41.995 -24.787 32.702 813 H SER 100 H SER 100 44.590 -25.566 32.520 814 HA SER 100 HA SER 100 44.325 -28.342 31.546 815 HB2 SER 100 2HB SER 100 46.548 -28.242 30.472 816 HB3 SER 100 3HB SER 100 45.397 -27.135 29.700 817 HG SER 100 HG SER 100 47.430 -26.151 30.121 818 H HIS 101 H HIS 101 44.884 -26.367 34.100 819 HA HIS 101 HA HIS 101 46.447 -28.434 35.502 820 HB2 HIS 101 2HB HIS 101 48.146 -26.879 34.610 821 HB3 HIS 101 3HB HIS 101 47.290 -25.516 35.340 822 HD2 HIS 101 HD2 HIS 101 49.128 -28.784 36.455 823 HE1 HIS 101 HE1 HIS 101 49.438 -25.977 39.634 824 HE2 HIS 101 HE2 HIS 101 50.135 -28.287 38.819 825 H HIS 102 H HIS 102 46.185 -28.373 37.761 826 HA HIS 102 HA HIS 102 44.360 -26.367 38.930 827 HB2 HIS 102 2HB HIS 102 43.861 -29.367 38.965 828 HB3 HIS 102 3HB HIS 102 42.985 -28.180 39.934 829 HD2 HIS 102 HD2 HIS 102 43.092 -29.710 36.467 830 HE1 HIS 102 HE1 HIS 102 40.079 -26.712 36.312 831 HE2 HIS 102 HE2 HIS 102 41.124 -28.682 35.076 832 H HIS 103 H HIS 103 44.314 -26.516 41.298 833 HA HIS 103 HA HIS 103 46.608 -27.975 42.480 834 HB2 HIS 103 2HB HIS 103 47.319 -25.664 41.793 835 HB3 HIS 103 3HB HIS 103 46.086 -25.004 42.867 836 HD2 HIS 103 HD2 HIS 103 47.088 -24.259 45.120 837 HE1 HIS 103 HE1 HIS 103 50.262 -27.061 45.511 838 HE2 HIS 103 HE2 HIS 103 49.100 -25.069 46.593 839 H HIS 104 H HIS 104 43.437 -27.768 42.496 840 HA HIS 104 HA HIS 104 42.904 -27.196 45.305 841 HB2 HIS 104 2HB HIS 104 41.119 -28.343 43.131 842 HB3 HIS 104 3HB HIS 104 40.591 -27.700 44.693 843 HD2 HIS 104 HD2 HIS 104 40.431 -25.046 44.950 844 HE1 HIS 104 HE1 HIS 104 41.497 -24.015 40.965 845 HE2 HIS 104 HE2 HIS 104 40.584 -23.129 43.170 846 H HIS 105 H HIS 105 44.286 -29.811 43.782 847 HA HIS 105 HA HIS 105 43.636 -31.601 46.023 848 HB2 HIS 105 2HB HIS 105 43.074 -33.451 44.522 849 HB3 HIS 105 3HB HIS 105 41.914 -32.125 44.365 850 HD2 HIS 105 HD2 HIS 105 44.715 -33.928 42.426 851 HE1 HIS 105 HE1 HIS 105 42.777 -31.351 39.655 852 HE2 HIS 105 HE2 HIS 105 44.513 -33.195 39.917 853 H HIS 106 H HIS 106 45.043 -33.563 45.952 854 HA HIS 106 HA HIS 106 47.511 -33.307 44.356 855 HB2 HIS 106 2HB HIS 106 47.923 -31.960 46.377 856 HB3 HIS 106 3HB HIS 106 47.458 -33.329 47.397 857 HD2 HIS 106 HD2 HIS 106 49.298 -35.128 47.933 858 HE1 HIS 106 HE1 HIS 106 52.400 -33.649 45.429 859 HE2 HIS 106 HE2 HIS 106 51.818 -35.341 47.240
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