NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
517532 | 2rrf | 11251 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 -25.741 -12.003 -4.204 2 HA2 GLY 1 1HA GLY 1 -23.306 -11.921 -3.822 3 HA3 GLY 1 2HA GLY 1 -23.170 -11.186 -5.412 4 H SER 2 H SER 2 -22.366 -10.258 -2.686 5 HA SER 2 HA SER 2 -23.994 -7.820 -2.487 6 HB2 SER 2 1HB SER 2 -23.006 -7.540 -0.257 7 HB3 SER 2 2HB SER 2 -23.759 -9.127 -0.412 8 HG SER 2 HG SER 2 -21.603 -9.915 -0.920 9 H SER 3 H SER 3 -23.186 -5.893 -3.032 10 HA SER 3 HA SER 3 -20.722 -5.691 -4.404 11 HB2 SER 3 1HB SER 3 -22.748 -4.233 -4.771 12 HB3 SER 3 2HB SER 3 -22.338 -3.399 -3.272 13 HG SER 3 HG SER 3 -20.546 -2.586 -4.195 14 H GLY 4 H GLY 4 -21.755 -4.321 -1.274 15 HA2 GLY 4 1HA GLY 4 -19.966 -4.813 0.501 16 HA3 GLY 4 2HA GLY 4 -18.912 -3.940 -0.602 17 H SER 5 H SER 5 -19.174 -3.080 1.974 18 HA SER 5 HA SER 5 -20.919 -0.716 1.753 19 HB2 SER 5 1HB SER 5 -20.027 -2.350 4.110 20 HB3 SER 5 2HB SER 5 -20.504 -0.667 4.331 21 HG SER 5 HG SER 5 -22.534 -1.143 3.725 22 H SER 6 H SER 6 -17.759 -1.804 2.966 23 HA SER 6 HA SER 6 -16.596 0.735 2.143 24 HB2 SER 6 1HB SER 6 -16.710 -0.228 4.990 25 HB3 SER 6 2HB SER 6 -15.380 0.791 4.438 26 HG SER 6 HG SER 6 -18.135 1.438 4.208 27 H GLY 7 H GLY 7 -14.514 0.553 1.473 28 HA2 GLY 7 1HA GLY 7 -12.551 -0.451 0.836 29 HA3 GLY 7 2HA GLY 7 -12.671 -1.391 2.315 30 H ALA 8 H ALA 8 -11.550 -2.787 0.486 31 HA ALA 8 HA ALA 8 -13.668 -4.444 -0.723 32 HB1 ALA 8 1HB ALA 8 -12.694 -4.093 -2.686 33 HB2 ALA 8 2HB ALA 8 -11.357 -3.227 -1.927 34 HB3 ALA 8 3HB ALA 8 -11.291 -4.982 -2.092 35 H GLU 9 H GLU 9 -13.892 -6.131 0.623 36 HA GLU 9 HA GLU 9 -12.310 -7.222 2.470 37 HB2 GLU 9 1HB GLU 9 -14.052 -8.640 0.465 38 HB3 GLU 9 2HB GLU 9 -13.245 -9.506 1.765 39 HG2 GLU 9 1HG GLU 9 -15.291 -9.112 2.701 40 HG3 GLU 9 2HG GLU 9 -14.382 -7.717 3.282 41 H PHE 10 H PHE 10 -12.004 -7.869 -0.999 42 HA PHE 10 HA PHE 10 -9.989 -9.791 -0.889 43 HB2 PHE 10 1HB PHE 10 -11.378 -8.870 -2.904 44 HB3 PHE 10 2HB PHE 10 -10.039 -7.738 -3.074 45 HD1 PHE 10 1HD PHE 10 -7.645 -8.998 -2.867 46 HD2 PHE 10 2HD PHE 10 -11.288 -10.722 -4.236 47 HE1 PHE 10 1HE PHE 10 -6.370 -10.692 -4.115 48 HE2 PHE 10 2HE PHE 10 -10.019 -12.419 -5.486 49 HZ PHE 10 HZ PHE 10 -7.557 -12.407 -5.426 50 H TYR 11 H TYR 11 -9.680 -6.265 -1.284 51 HA TYR 11 HA TYR 11 -6.830 -6.312 -1.129 52 HB2 TYR 11 1HB TYR 11 -8.935 -4.210 -1.259 53 HB3 TYR 11 2HB TYR 11 -7.353 -3.742 -0.646 54 HD1 TYR 11 2HD TYR 11 -9.103 -5.203 -3.566 55 HD2 TYR 11 1HD TYR 11 -5.533 -3.401 -2.114 56 HE1 TYR 11 2HE TYR 11 -8.282 -4.985 -5.874 57 HE2 TYR 11 1HE TYR 11 -4.702 -3.176 -4.418 58 HH TYR 11 HH TYR 11 -5.743 -4.808 -6.915 59 H ASP 12 H ASP 12 -9.338 -6.376 1.181 60 HA ASP 12 HA ASP 12 -7.870 -5.159 3.330 61 HB2 ASP 12 1HB ASP 12 -10.463 -6.665 3.135 62 HB3 ASP 12 2HB ASP 12 -9.758 -6.293 4.705 63 H LYS 13 H LYS 13 -8.433 -8.416 2.151 64 HA LYS 13 HA LYS 13 -7.515 -9.878 4.341 65 HB2 LYS 13 1HB LYS 13 -7.476 -10.440 1.382 66 HB3 LYS 13 2HB LYS 13 -6.884 -11.606 2.558 67 HG2 LYS 13 1HG LYS 13 -9.601 -10.478 2.958 68 HG3 LYS 13 2HG LYS 13 -9.364 -11.662 1.669 69 HD2 LYS 13 1HD LYS 13 -8.488 -13.266 3.246 70 HD3 LYS 13 2HD LYS 13 -8.555 -12.075 4.547 71 HE2 LYS 13 1HE LYS 13 -10.945 -13.100 3.018 72 HE3 LYS 13 2HE LYS 13 -10.432 -13.691 4.597 73 HZ1 LYS 13 3HZ LYS 13 -11.955 -12.142 5.221 74 HZ2 LYS 13 1HZ LYS 13 -11.684 -11.145 3.882 75 HZ3 LYS 13 2HZ LYS 13 -10.587 -11.148 5.170 76 H GLN 14 H GLN 14 -5.795 -7.946 2.066 77 HA GLN 14 HA GLN 14 -3.227 -9.157 2.691 78 HB2 GLN 14 1HB GLN 14 -3.619 -6.647 1.085 79 HB3 GLN 14 2HB GLN 14 -2.313 -7.820 0.987 80 HG2 GLN 14 1HG GLN 14 -5.122 -8.580 0.292 81 HG3 GLN 14 2HG GLN 14 -4.077 -7.772 -0.875 82 HE21 GLN 14 1HE2 GLN 14 -5.247 -10.617 -0.343 83 HE22 GLN 14 2HE2 GLN 14 -3.907 -11.643 -0.709 84 H LEU 15 H LEU 15 -5.038 -6.219 3.366 85 HA LEU 15 HA LEU 15 -3.236 -4.508 4.412 86 HB2 LEU 15 1HB LEU 15 -4.949 -3.502 5.524 87 HB3 LEU 15 2HB LEU 15 -5.863 -4.523 4.416 88 HG LEU 15 HG LEU 15 -5.841 -6.206 6.423 89 HD11 LEU 15 1HD1 LEU 15 -4.498 -5.221 8.019 90 HD12 LEU 15 2HD1 LEU 15 -6.108 -4.733 8.547 91 HD13 LEU 15 3HD1 LEU 15 -5.087 -3.597 7.666 92 HD21 LEU 15 3HD2 LEU 15 -7.963 -5.645 5.943 93 HD22 LEU 15 1HD2 LEU 15 -7.576 -3.937 5.739 94 HD23 LEU 15 2HD2 LEU 15 -7.815 -4.599 7.356 95 H LYS 16 H LYS 16 -4.449 -7.423 5.997 96 HA LYS 16 HA LYS 16 -3.076 -6.991 8.452 97 HB2 LYS 16 1HB LYS 16 -3.644 -9.333 8.937 98 HB3 LYS 16 2HB LYS 16 -5.035 -8.440 8.337 99 HG2 LYS 16 1HG LYS 16 -4.922 -9.491 6.227 100 HG3 LYS 16 2HG LYS 16 -3.319 -10.150 6.561 101 HD2 LYS 16 1HD LYS 16 -4.400 -11.437 8.461 102 HD3 LYS 16 2HD LYS 16 -5.953 -10.957 7.774 103 HE2 LYS 16 1HE LYS 16 -4.886 -11.915 5.564 104 HE3 LYS 16 2HE LYS 16 -3.886 -12.817 6.703 105 HZ1 LYS 16 3HZ LYS 16 -6.307 -13.221 7.732 106 HZ2 LYS 16 1HZ LYS 16 -5.590 -14.257 6.602 107 HZ3 LYS 16 2HZ LYS 16 -6.708 -13.095 6.093 108 H VAL 17 H VAL 17 -2.325 -8.741 5.485 109 HA VAL 17 HA VAL 17 0.035 -9.990 6.448 110 HB VAL 17 HB VAL 17 -0.922 -9.390 3.652 111 HG11 VAL 17 1HG1 VAL 17 1.247 -9.585 3.078 112 HG12 VAL 17 2HG1 VAL 17 1.689 -10.366 4.598 113 HG13 VAL 17 3HG1 VAL 17 0.947 -11.308 3.303 114 HG21 VAL 17 3HG2 VAL 17 -2.249 -11.118 4.224 115 HG22 VAL 17 1HG2 VAL 17 -0.809 -12.084 3.906 116 HG23 VAL 17 2HG2 VAL 17 -1.206 -11.612 5.557 117 H LEU 18 H LEU 18 -0.615 -6.930 4.826 118 HA LEU 18 HA LEU 18 2.086 -6.235 4.337 119 HB2 LEU 18 1HB LEU 18 -0.471 -4.680 4.496 120 HB3 LEU 18 2HB LEU 18 1.076 -3.864 4.280 121 HG LEU 18 HG LEU 18 0.121 -6.010 2.402 122 HD11 LEU 18 1HD1 LEU 18 -1.376 -4.649 1.503 123 HD12 LEU 18 2HD1 LEU 18 -0.145 -3.406 1.283 124 HD13 LEU 18 3HD1 LEU 18 -1.068 -3.476 2.784 125 HD21 LEU 18 3HD2 LEU 18 1.792 -5.257 0.970 126 HD22 LEU 18 1HD2 LEU 18 2.558 -5.194 2.558 127 HD23 LEU 18 2HD2 LEU 18 1.954 -3.714 1.811 128 H LEU 19 H LEU 19 -0.190 -5.145 6.858 129 HA LEU 19 HA LEU 19 1.557 -3.556 8.307 130 HB2 LEU 19 1HB LEU 19 -0.757 -5.240 9.242 131 HB3 LEU 19 2HB LEU 19 0.075 -4.069 10.263 132 HG LEU 19 HG LEU 19 -1.263 -3.294 7.682 133 HD11 LEU 19 1HD1 LEU 19 -2.505 -4.158 10.116 134 HD12 LEU 19 2HD1 LEU 19 -3.249 -3.622 8.610 135 HD13 LEU 19 3HD1 LEU 19 -2.823 -2.444 9.851 136 HD21 LEU 19 3HD2 LEU 19 -1.386 -1.159 9.314 137 HD22 LEU 19 1HD2 LEU 19 -0.050 -1.464 8.204 138 HD23 LEU 19 2HD2 LEU 19 0.097 -1.911 9.904 139 H SER 20 H SER 20 0.817 -7.004 8.794 140 HA SER 20 HA SER 20 2.207 -7.709 10.954 141 HB2 SER 20 1HB SER 20 1.108 -9.267 9.285 142 HB3 SER 20 2HB SER 20 2.607 -9.205 8.357 143 HG SER 20 HG SER 20 2.774 -9.813 11.077 144 H GLY 21 H GLY 21 3.716 -7.051 7.805 145 HA2 GLY 21 1HA GLY 21 5.807 -6.011 7.509 146 HA3 GLY 21 2HA GLY 21 6.187 -6.344 9.192 147 H ALA 22 H ALA 22 7.089 -7.066 6.162 148 HA ALA 22 HA ALA 22 7.892 -9.816 6.857 149 HB1 ALA 22 1HB ALA 22 6.944 -10.356 4.915 150 HB2 ALA 22 2HB ALA 22 6.807 -8.667 4.422 151 HB3 ALA 22 3HB ALA 22 8.308 -9.549 4.140 152 H THR 23 H THR 23 10.016 -10.494 6.294 153 HA THR 23 HA THR 23 11.969 -8.363 6.546 154 HB THR 23 HB THR 23 12.477 -11.338 6.401 155 HG1 THR 23 1HG THR 23 12.429 -11.258 8.672 156 HG21 THR 23 3HG2 THR 23 14.285 -9.350 6.177 157 HG22 THR 23 1HG2 THR 23 14.639 -10.907 6.923 158 HG23 THR 23 2HG2 THR 23 14.229 -9.519 7.931 159 H PHE 24 H PHE 24 13.467 -7.780 5.042 160 HA PHE 24 HA PHE 24 13.727 -9.289 2.574 161 HB2 PHE 24 1HB PHE 24 12.814 -6.404 2.574 162 HB3 PHE 24 2HB PHE 24 13.246 -7.341 1.147 163 HD1 PHE 24 2HD PHE 24 11.904 -9.571 0.833 164 HD2 PHE 24 1HD PHE 24 10.606 -6.278 3.198 165 HE1 PHE 24 2HE PHE 24 9.580 -10.355 0.644 166 HE2 PHE 24 1HE PHE 24 8.280 -7.058 3.013 167 HZ PHE 24 HZ PHE 24 7.764 -9.098 1.734 168 H LEU 25 H LEU 25 15.252 -7.847 1.044 169 HA LEU 25 HA LEU 25 17.523 -7.075 2.748 170 HB2 LEU 25 1HB LEU 25 17.340 -8.324 0.034 171 HB3 LEU 25 2HB LEU 25 18.797 -7.463 0.527 172 HG LEU 25 HG LEU 25 17.640 -9.812 2.023 173 HD11 LEU 25 1HD1 LEU 25 19.914 -10.755 0.958 174 HD12 LEU 25 2HD1 LEU 25 19.410 -9.665 -0.333 175 HD13 LEU 25 3HD1 LEU 25 18.332 -10.953 0.203 176 HD21 LEU 25 3HD2 LEU 25 20.466 -9.263 2.307 177 HD22 LEU 25 1HD2 LEU 25 19.225 -9.461 3.544 178 HD23 LEU 25 2HD2 LEU 25 19.480 -7.884 2.796 179 H VAL 26 H VAL 26 17.679 -4.941 2.945 180 HA VAL 26 HA VAL 26 16.875 -3.214 0.723 181 HB VAL 26 HB VAL 26 17.577 -2.530 3.581 182 HG11 VAL 26 1HG1 VAL 26 16.170 -0.432 2.343 183 HG12 VAL 26 2HG1 VAL 26 17.844 -0.433 2.902 184 HG13 VAL 26 3HG1 VAL 26 17.468 -0.886 1.240 185 HG21 VAL 26 3HG2 VAL 26 14.883 -2.224 2.309 186 HG22 VAL 26 1HG2 VAL 26 15.387 -3.773 2.984 187 HG23 VAL 26 2HG2 VAL 26 15.303 -2.347 4.018 188 H THR 27 H THR 27 18.281 -2.080 -0.472 189 HA THR 27 HA THR 27 21.101 -2.027 0.383 190 HB THR 27 HB THR 27 20.283 -2.146 -2.512 191 HG1 THR 27 1HG THR 27 21.203 -4.439 -1.173 192 HG21 THR 27 3HG2 THR 27 22.828 -2.562 -0.969 193 HG22 THR 27 1HG2 THR 27 22.515 -1.447 -2.298 194 HG23 THR 27 2HG2 THR 27 22.629 -3.180 -2.609 195 H PHE 28 H PHE 28 21.770 -0.022 0.728 196 HA PHE 28 HA PHE 28 20.329 2.226 -0.399 197 HB2 PHE 28 1HB PHE 28 22.633 2.056 1.548 198 HB3 PHE 28 2HB PHE 28 21.923 3.573 1.007 199 HD1 PHE 28 2HD PHE 28 19.310 3.726 1.302 200 HD2 PHE 28 1HD PHE 28 21.857 1.108 3.488 201 HE1 PHE 28 2HE PHE 28 17.615 3.567 3.079 202 HE2 PHE 28 1HE PHE 28 20.166 0.944 5.268 203 HZ PHE 28 HZ PHE 28 18.042 2.175 5.066 204 H GLY 29 H GLY 29 21.195 3.798 -1.755 205 HA2 GLY 29 1HA GLY 29 22.695 3.089 -3.896 206 HA3 GLY 29 2HA GLY 29 22.654 4.736 -3.283 207 H ASN 30 H ASN 30 23.965 4.268 -0.813 208 HA ASN 30 HA ASN 30 26.682 4.309 -1.728 209 HB2 ASN 30 1HB ASN 30 25.346 4.645 0.941 210 HB3 ASN 30 2HB ASN 30 27.095 4.473 0.837 211 HD21 ASN 30 1HD2 ASN 30 24.864 6.687 1.248 212 HD22 ASN 30 2HD2 ASN 30 25.560 8.034 0.419 213 H SER 31 H SER 31 24.715 2.125 0.247 214 HA SER 31 HA SER 31 26.890 0.285 0.666 215 HB2 SER 31 1HB SER 31 23.943 -0.192 1.150 216 HB3 SER 31 2HB SER 31 25.298 -1.059 1.871 217 HG SER 31 HG SER 31 25.277 0.394 3.372 218 H GLU 32 H GLU 32 27.526 -1.261 -0.675 219 HA GLU 32 HA GLU 32 25.942 -1.834 -3.046 220 HB2 GLU 32 1HB GLU 32 27.901 -2.885 -3.926 221 HB3 GLU 32 2HB GLU 32 28.405 -1.382 -3.165 222 HG2 GLU 32 1HG GLU 32 29.016 -2.727 -1.139 223 HG3 GLU 32 2HG GLU 32 28.724 -4.174 -2.102 224 H LYS 33 H LYS 33 26.561 -3.188 0.021 225 HA LYS 33 HA LYS 33 25.710 -5.860 -0.842 226 HB2 LYS 33 1HB LYS 33 27.505 -6.259 0.516 227 HB3 LYS 33 2HB LYS 33 27.249 -4.800 1.464 228 HG2 LYS 33 1HG LYS 33 25.735 -5.814 2.871 229 HG3 LYS 33 2HG LYS 33 25.319 -7.063 1.694 230 HD2 LYS 33 1HD LYS 33 28.113 -6.971 2.706 231 HD3 LYS 33 2HD LYS 33 26.857 -7.572 3.791 232 HE2 LYS 33 1HE LYS 33 26.223 -9.262 2.202 233 HE3 LYS 33 2HE LYS 33 27.321 -8.597 0.994 234 HZ1 LYS 33 3HZ LYS 33 28.636 -9.245 3.456 235 HZ2 LYS 33 1HZ LYS 33 29.035 -9.684 1.872 236 HZ3 LYS 33 2HZ LYS 33 27.905 -10.593 2.741 237 HA PRO 34 HA PRO 34 21.620 -5.146 0.648 238 HB2 PRO 34 1HB PRO 34 20.829 -7.733 0.872 239 HB3 PRO 34 2HB PRO 34 20.997 -6.911 -0.684 240 HG2 PRO 34 1HG PRO 34 22.892 -8.782 0.684 241 HG3 PRO 34 2HG PRO 34 22.421 -8.718 -1.024 242 HD2 PRO 34 1HD PRO 34 24.750 -7.679 -0.116 243 HD3 PRO 34 2HD PRO 34 23.864 -6.982 -1.488 244 H GLU 35 H GLU 35 20.659 -4.903 2.595 245 HA GLU 35 HA GLU 35 21.833 -6.344 4.883 246 HB2 GLU 35 1HB GLU 35 22.406 -3.925 4.832 247 HB3 GLU 35 2HB GLU 35 20.691 -3.545 4.890 248 HG2 GLU 35 1HG GLU 35 20.502 -4.581 7.068 249 HG3 GLU 35 2HG GLU 35 22.197 -5.062 7.008 250 H THR 36 H THR 36 20.475 -7.303 6.303 251 HA THR 36 HA THR 36 17.800 -7.805 5.512 252 HB THR 36 HB THR 36 18.996 -8.344 8.234 253 HG1 THR 36 1HG THR 36 19.320 -10.500 7.125 254 HG21 THR 36 3HG2 THR 36 16.445 -8.600 7.630 255 HG22 THR 36 1HG2 THR 36 17.274 -9.826 8.588 256 HG23 THR 36 2HG2 THR 36 17.001 -10.088 6.865 257 H MET 37 H MET 37 16.210 -6.366 5.651 258 HA MET 37 HA MET 37 15.981 -4.778 8.119 259 HB2 MET 37 1HB MET 37 15.621 -3.875 5.267 260 HB3 MET 37 2HB MET 37 14.922 -2.995 6.619 261 HG2 MET 37 1HG MET 37 17.379 -3.079 7.531 262 HG3 MET 37 2HG MET 37 17.769 -3.314 5.829 263 HE1 MET 37 3HE MET 37 17.213 -1.272 8.597 264 HE2 MET 37 1HE MET 37 17.317 0.391 8.016 265 HE3 MET 37 2HE MET 37 15.743 -0.387 8.186 266 H THR 38 H THR 38 13.685 -3.815 8.277 267 HA THR 38 HA THR 38 11.752 -5.903 7.502 268 HB THR 38 HB THR 38 11.696 -4.164 9.976 269 HG1 THR 38 1HG THR 38 12.375 -5.948 11.045 270 HG21 THR 38 3HG2 THR 38 9.491 -4.965 8.832 271 HG22 THR 38 1HG2 THR 38 9.689 -5.153 10.573 272 HG23 THR 38 2HG2 THR 38 9.932 -6.534 9.504 273 H CYS 39 H CYS 39 10.028 -5.294 6.352 274 HA CYS 39 HA CYS 39 9.487 -2.408 6.105 275 HB2 CYS 39 1HB CYS 39 8.987 -4.549 4.028 276 HB3 CYS 39 2HB CYS 39 8.735 -2.820 3.828 277 HG CYS 39 HG CYS 39 11.823 -3.171 4.737 278 H ARG 40 H ARG 40 7.556 -1.733 6.756 279 HA ARG 40 HA ARG 40 5.254 -3.515 6.615 280 HB2 ARG 40 1HB ARG 40 4.662 -3.344 8.899 281 HB3 ARG 40 2HB ARG 40 6.369 -3.769 8.884 282 HG2 ARG 40 1HG ARG 40 6.897 -1.352 9.202 283 HG3 ARG 40 2HG ARG 40 5.169 -1.063 9.412 284 HD2 ARG 40 1HD ARG 40 5.274 -2.851 11.234 285 HD3 ARG 40 2HD ARG 40 7.025 -2.667 11.144 286 HE ARG 40 HE ARG 40 6.196 -0.132 11.480 287 HH11 ARG 40 1HH1 ARG 40 5.450 -3.089 13.160 288 HH12 ARG 40 2HH1 ARG 40 5.175 -2.307 14.682 289 HH21 ARG 40 1HH2 ARG 40 5.835 0.908 13.477 290 HH22 ARG 40 2HH2 ARG 40 5.393 -0.034 14.861 291 H LEU 41 H LEU 41 3.213 -2.312 7.247 292 HA LEU 41 HA LEU 41 3.375 0.407 6.152 293 HB2 LEU 41 1HB LEU 41 1.325 -1.737 6.116 294 HB3 LEU 41 2HB LEU 41 0.756 -0.069 6.129 295 HG LEU 41 HG LEU 41 2.740 -1.025 4.089 296 HD11 LEU 41 1HD1 LEU 41 1.227 -2.249 3.034 297 HD12 LEU 41 2HD1 LEU 41 0.104 -0.890 3.014 298 HD13 LEU 41 3HD1 LEU 41 0.110 -2.008 4.378 299 HD21 LEU 41 3HD2 LEU 41 0.726 1.218 4.176 300 HD22 LEU 41 1HD2 LEU 41 1.738 0.819 2.788 301 HD23 LEU 41 2HD2 LEU 41 2.480 1.367 4.291 302 H SER 42 H SER 42 1.788 1.993 7.028 303 HA SER 42 HA SER 42 2.006 2.057 9.904 304 HB2 SER 42 1HB SER 42 2.361 4.067 8.431 305 HB3 SER 42 2HB SER 42 0.629 4.057 8.100 306 HG SER 42 HG SER 42 1.764 4.225 10.695 307 H ASN 43 H ASN 43 -0.053 3.065 11.039 308 HA ASN 43 HA ASN 43 -1.935 1.071 11.320 309 HB2 ASN 43 1HB ASN 43 -2.320 4.030 11.827 310 HB3 ASN 43 2HB ASN 43 -3.326 2.742 12.483 311 HD21 ASN 43 1HD2 ASN 43 -1.801 4.724 13.911 312 HD22 ASN 43 2HD2 ASN 43 -0.672 3.866 14.898 313 H ASN 44 H ASN 44 -2.107 3.974 9.293 314 HA ASN 44 HA ASN 44 -4.581 2.949 8.088 315 HB2 ASN 44 1HB ASN 44 -3.403 5.664 8.420 316 HB3 ASN 44 2HB ASN 44 -4.385 5.373 6.988 317 HD21 ASN 44 1HD2 ASN 44 -4.353 5.568 10.454 318 HD22 ASN 44 2HD2 ASN 44 -6.066 5.642 10.668 319 H GLN 45 H GLN 45 -1.901 1.891 7.520 320 HA GLN 45 HA GLN 45 -0.423 1.559 5.771 321 HB2 GLN 45 1HB GLN 45 -3.070 1.267 4.343 322 HB3 GLN 45 2HB GLN 45 -1.547 0.514 3.889 323 HG2 GLN 45 1HG GLN 45 -2.558 -1.225 4.951 324 HG3 GLN 45 2HG GLN 45 -1.692 -0.497 6.303 325 HE21 GLN 45 1HE2 GLN 45 -4.776 -1.099 4.863 326 HE22 GLN 45 2HE2 GLN 45 -5.738 -0.577 6.199 327 H ARG 46 H ARG 46 -0.800 4.321 6.129 328 HA ARG 46 HA ARG 46 -0.936 5.332 3.369 329 HB2 ARG 46 1HB ARG 46 -1.587 6.515 6.021 330 HB3 ARG 46 2HB ARG 46 -0.946 7.592 4.787 331 HG2 ARG 46 1HG ARG 46 -3.220 5.783 4.118 332 HG3 ARG 46 2HG ARG 46 -3.514 7.258 5.041 333 HD2 ARG 46 1HD ARG 46 -2.115 8.390 3.163 334 HD3 ARG 46 2HD ARG 46 -2.505 6.938 2.244 335 HE ARG 46 HE ARG 46 -4.623 7.740 1.977 336 HH11 ARG 46 1HH1 ARG 46 -3.140 9.380 4.666 337 HH12 ARG 46 2HH1 ARG 46 -4.458 10.482 4.889 338 HH21 ARG 46 1HH2 ARG 46 -6.364 9.186 2.260 339 HH22 ARG 46 2HH2 ARG 46 -6.291 10.371 3.520 340 H TYR 47 H TYR 47 1.262 4.333 5.583 341 HA TYR 47 HA TYR 47 3.405 5.773 4.270 342 HB2 TYR 47 1HB TYR 47 3.160 5.901 7.280 343 HB3 TYR 47 2HB TYR 47 4.405 6.649 6.285 344 HD1 TYR 47 1HD TYR 47 3.665 8.462 4.632 345 HD2 TYR 47 2HD TYR 47 1.208 7.073 7.815 346 HE1 TYR 47 1HE TYR 47 2.316 10.512 4.477 347 HE2 TYR 47 2HE TYR 47 -0.149 9.119 7.669 348 HH TYR 47 HH TYR 47 -0.620 10.926 6.366 349 H LEU 48 H LEU 48 5.399 4.738 4.414 350 HA LEU 48 HA LEU 48 5.259 1.992 5.440 351 HB2 LEU 48 1HB LEU 48 6.798 3.324 3.259 352 HB3 LEU 48 2HB LEU 48 7.448 1.865 4.003 353 HG LEU 48 HG LEU 48 4.751 2.057 2.664 354 HD11 LEU 48 1HD1 LEU 48 6.336 0.348 1.199 355 HD12 LEU 48 2HD1 LEU 48 7.425 1.678 1.592 356 HD13 LEU 48 3HD1 LEU 48 5.905 2.001 0.759 357 HD21 LEU 48 3HD2 LEU 48 6.209 -0.068 4.132 358 HD22 LEU 48 1HD2 LEU 48 5.302 -0.540 2.695 359 HD23 LEU 48 2HD2 LEU 48 4.479 0.262 4.033 360 H PHE 49 H PHE 49 6.718 1.197 6.887 361 HA PHE 49 HA PHE 49 8.675 3.116 7.972 362 HB2 PHE 49 1HB PHE 49 7.180 0.977 9.504 363 HB3 PHE 49 2HB PHE 49 8.323 2.135 10.178 364 HD1 PHE 49 1HD PHE 49 7.256 4.461 8.395 365 HD2 PHE 49 2HD PHE 49 5.398 1.636 10.979 366 HE1 PHE 49 1HE PHE 49 5.415 6.044 8.795 367 HE2 PHE 49 2HE PHE 49 3.553 3.213 11.383 368 HZ PHE 49 HZ PHE 49 3.560 5.420 10.290 369 H LEU 50 H LEU 50 10.620 2.214 8.862 370 HA LEU 50 HA LEU 50 11.237 -0.523 8.004 371 HB2 LEU 50 1HB LEU 50 13.144 1.764 7.595 372 HB3 LEU 50 2HB LEU 50 13.288 0.111 7.000 373 HG LEU 50 HG LEU 50 11.292 2.166 6.050 374 HD11 LEU 50 1HD1 LEU 50 13.240 2.873 5.078 375 HD12 LEU 50 2HD1 LEU 50 12.704 1.684 3.892 376 HD13 LEU 50 3HD1 LEU 50 13.951 1.259 5.064 377 HD21 LEU 50 3HD2 LEU 50 11.189 -0.644 5.941 378 HD22 LEU 50 1HD2 LEU 50 11.627 -0.090 4.325 379 HD23 LEU 50 2HD2 LEU 50 10.160 0.514 5.097 380 H ASP 51 H ASP 51 12.682 -1.626 9.286 381 HA ASP 51 HA ASP 51 13.819 -0.189 11.583 382 HB2 ASP 51 1HB ASP 51 11.937 -2.495 11.607 383 HB3 ASP 51 2HB ASP 51 13.242 -2.502 12.790 384 H GLY 52 H GLY 52 15.849 -0.785 12.142 385 HA2 GLY 52 1HA GLY 52 17.070 -3.243 11.827 386 HA3 GLY 52 2HA GLY 52 17.342 -2.386 10.317 387 H ASP 53 H ASP 53 19.411 -1.782 10.343 388 HA ASP 53 HA ASP 53 21.003 -1.295 12.554 389 HB2 ASP 53 1HB ASP 53 21.872 -1.617 10.267 390 HB3 ASP 53 2HB ASP 53 21.256 -0.029 9.818 391 H SER 54 H SER 54 18.655 0.750 11.043 392 HA SER 54 HA SER 54 18.920 2.684 13.172 393 HB2 SER 54 1HB SER 54 19.590 3.365 10.314 394 HB3 SER 54 2HB SER 54 19.019 4.593 11.444 395 HG SER 54 HG SER 54 21.183 2.901 12.090 396 H HIS 55 H HIS 55 17.262 4.520 12.798 397 HA HIS 55 HA HIS 55 14.740 3.236 12.171 398 HB2 HIS 55 1HB HIS 55 15.248 6.036 13.196 399 HB3 HIS 55 2HB HIS 55 13.706 5.186 13.185 400 HD2 HIS 55 2HD HIS 55 17.049 5.225 15.207 401 HE1 HIS 55 1HE HIS 55 14.240 2.803 17.268 402 HE2 HIS 55 2HE HIS 55 16.476 3.956 17.387 403 H TYR 56 H TYR 56 14.045 3.232 10.141 404 HA TYR 56 HA TYR 56 14.378 5.687 8.547 405 HB2 TYR 56 1HB TYR 56 14.912 2.844 7.840 406 HB3 TYR 56 2HB TYR 56 14.227 3.879 6.592 407 HD1 TYR 56 1HD TYR 56 15.494 6.387 6.787 408 HD2 TYR 56 2HD TYR 56 17.176 2.554 7.552 409 HE1 TYR 56 1HE TYR 56 17.733 7.278 6.293 410 HE2 TYR 56 2HE TYR 56 19.419 3.434 7.061 411 HH TYR 56 HH TYR 56 19.959 6.860 6.458 412 H GLU 57 H GLU 57 12.677 6.266 7.182 413 HA GLU 57 HA GLU 57 10.261 4.648 7.175 414 HB2 GLU 57 1HB GLU 57 10.314 7.456 8.295 415 HB3 GLU 57 2HB GLU 57 8.855 6.538 7.947 416 HG2 GLU 57 1HG GLU 57 9.236 5.037 9.684 417 HG3 GLU 57 2HG GLU 57 10.939 5.474 9.811 418 H ILE 58 H ILE 58 9.367 4.709 5.224 419 HA ILE 58 HA ILE 58 10.093 6.927 3.430 420 HB ILE 58 HB ILE 58 9.210 4.123 2.734 421 HG12 ILE 58 1HG1 ILE 58 11.891 5.504 2.488 422 HG13 ILE 58 2HG1 ILE 58 11.490 4.204 3.606 423 HG21 ILE 58 1HG2 ILE 58 8.911 4.754 0.615 424 HG22 ILE 58 2HG2 ILE 58 8.875 6.405 1.230 425 HG23 ILE 58 3HG2 ILE 58 10.382 5.727 0.612 426 HD11 ILE 58 3HD1 ILE 58 10.956 2.835 1.511 427 HD12 ILE 58 1HD1 ILE 58 11.841 4.087 0.639 428 HD13 ILE 58 2HD1 ILE 58 12.648 3.149 1.896 429 H GLU 59 H GLU 59 8.494 8.401 3.632 430 HA GLU 59 HA GLU 59 5.777 7.805 4.086 431 HB2 GLU 59 1HB GLU 59 7.186 10.262 3.060 432 HB3 GLU 59 2HB GLU 59 5.440 10.204 3.257 433 HG2 GLU 59 1HG GLU 59 5.571 10.075 5.562 434 HG3 GLU 59 2HG GLU 59 7.233 9.490 5.535 435 H ILE 60 H ILE 60 4.235 7.122 2.757 436 HA ILE 60 HA ILE 60 4.752 6.467 0.061 437 HB ILE 60 HB ILE 60 2.158 6.634 1.591 438 HG12 ILE 60 1HG1 ILE 60 3.883 4.308 0.713 439 HG13 ILE 60 2HG1 ILE 60 3.692 4.898 2.360 440 HG21 ILE 60 1HG2 ILE 60 1.256 6.770 -0.481 441 HG22 ILE 60 2HG2 ILE 60 2.689 6.110 -1.267 442 HG23 ILE 60 3HG2 ILE 60 1.548 5.031 -0.465 443 HD11 ILE 60 3HD1 ILE 60 1.123 4.407 1.721 444 HD12 ILE 60 1HD1 ILE 60 1.939 3.184 0.748 445 HD13 ILE 60 2HD1 ILE 60 2.194 3.237 2.492 446 H VAL 61 H VAL 61 3.679 9.358 1.568 447 HA VAL 61 HA VAL 61 2.257 10.488 -0.617 448 HB VAL 61 HB VAL 61 2.386 12.585 0.553 449 HG11 VAL 61 1HG1 VAL 61 1.784 11.725 2.943 450 HG12 VAL 61 2HG1 VAL 61 0.749 11.322 1.571 451 HG13 VAL 61 3HG1 VAL 61 1.899 10.135 2.188 452 HG21 VAL 61 3HG2 VAL 61 4.845 11.461 1.580 453 HG22 VAL 61 1HG2 VAL 61 4.311 13.141 1.525 454 HG23 VAL 61 2HG2 VAL 61 3.840 12.110 2.875 455 H HIS 62 H HIS 62 5.621 10.227 0.192 456 HA HIS 62 HA HIS 62 6.416 12.229 -1.762 457 HB2 HIS 62 1HB HIS 62 7.812 10.628 0.332 458 HB3 HIS 62 2HB HIS 62 8.761 11.217 -1.029 459 HD2 HIS 62 2HD HIS 62 6.520 12.778 1.826 460 HE1 HIS 62 1HE HIS 62 9.358 15.647 0.518 461 HE2 HIS 62 2HE HIS 62 7.582 15.103 2.219 462 H ILE 63 H ILE 63 6.409 8.736 -1.355 463 HA ILE 63 HA ILE 63 8.039 7.915 -3.409 464 HB ILE 63 HB ILE 63 5.398 6.667 -2.642 465 HG12 ILE 63 1HG1 ILE 63 8.185 6.078 -1.623 466 HG13 ILE 63 2HG1 ILE 63 6.971 7.000 -0.743 467 HG21 ILE 63 1HG2 ILE 63 6.463 5.944 -4.822 468 HG22 ILE 63 2HG2 ILE 63 7.787 5.301 -3.851 469 HG23 ILE 63 3HG2 ILE 63 6.154 4.668 -3.645 470 HD11 ILE 63 3HD1 ILE 63 6.260 5.108 0.142 471 HD12 ILE 63 1HD1 ILE 63 5.744 4.588 -1.462 472 HD13 ILE 63 2HD1 ILE 63 7.355 4.174 -0.876 473 H SER 64 H SER 64 7.975 7.920 -5.574 474 HA SER 64 HA SER 64 5.633 9.134 -6.856 475 HB2 SER 64 1HB SER 64 7.985 10.099 -7.149 476 HB3 SER 64 2HB SER 64 8.325 8.680 -8.140 477 HG SER 64 HG SER 64 6.218 10.527 -8.599 478 H THR 65 H THR 65 8.074 6.696 -7.765 479 HA THR 65 HA THR 65 5.944 5.207 -9.146 480 HB THR 65 HB THR 65 8.937 5.104 -9.569 481 HG1 THR 65 1HG THR 65 7.895 6.978 -10.424 482 HG21 THR 65 3HG2 THR 65 8.200 2.949 -10.095 483 HG22 THR 65 1HG2 THR 65 8.163 3.788 -11.646 484 HG23 THR 65 2HG2 THR 65 6.668 3.531 -10.747 485 H VAL 66 H VAL 66 5.801 2.950 -8.913 486 HA VAL 66 HA VAL 66 7.469 1.630 -6.935 487 HB VAL 66 HB VAL 66 4.511 2.049 -6.535 488 HG11 VAL 66 1HG1 VAL 66 4.680 -0.230 -6.120 489 HG12 VAL 66 2HG1 VAL 66 6.312 -0.090 -5.462 490 HG13 VAL 66 3HG1 VAL 66 4.930 0.482 -4.526 491 HG21 VAL 66 3HG2 VAL 66 6.987 2.699 -4.969 492 HG22 VAL 66 1HG2 VAL 66 5.689 3.775 -5.488 493 HG23 VAL 66 2HG2 VAL 66 5.404 2.609 -4.196 494 H GLN 67 H GLN 67 8.112 -0.025 -8.176 495 HA GLN 67 HA GLN 67 6.024 -1.718 -9.368 496 HB2 GLN 67 1HB GLN 67 7.314 -2.074 -11.342 497 HB3 GLN 67 2HB GLN 67 7.223 -0.336 -11.092 498 HG2 GLN 67 1HG GLN 67 9.476 -0.435 -10.041 499 HG3 GLN 67 2HG GLN 67 9.558 -2.135 -10.501 500 HE21 GLN 67 1HE2 GLN 67 10.862 -2.358 -12.163 501 HE22 GLN 67 2HE2 GLN 67 10.924 -1.338 -13.556 502 H ILE 68 H ILE 68 6.677 -3.961 -9.687 503 HA ILE 68 HA ILE 68 8.523 -4.816 -7.571 504 HB ILE 68 HB ILE 68 6.489 -6.494 -9.040 505 HG12 ILE 68 1HG1 ILE 68 6.285 -5.141 -6.340 506 HG13 ILE 68 2HG1 ILE 68 5.383 -4.698 -7.785 507 HG21 ILE 68 1HG2 ILE 68 7.362 -7.269 -6.356 508 HG22 ILE 68 2HG2 ILE 68 7.165 -8.243 -7.813 509 HG23 ILE 68 3HG2 ILE 68 8.639 -7.305 -7.572 510 HD11 ILE 68 3HD1 ILE 68 5.181 -7.459 -6.668 511 HD12 ILE 68 1HD1 ILE 68 4.248 -6.135 -5.972 512 HD13 ILE 68 2HD1 ILE 68 4.034 -6.568 -7.669 513 H LEU 69 H LEU 69 10.326 -5.958 -7.991 514 HA LEU 69 HA LEU 69 11.152 -6.217 -10.753 515 HB2 LEU 69 1HB LEU 69 12.603 -6.914 -8.204 516 HB3 LEU 69 2HB LEU 69 13.311 -6.886 -9.818 517 HG LEU 69 HG LEU 69 12.176 -4.460 -8.432 518 HD11 LEU 69 1HD1 LEU 69 15.095 -5.020 -8.782 519 HD12 LEU 69 2HD1 LEU 69 14.225 -5.607 -7.365 520 HD13 LEU 69 3HD1 LEU 69 14.297 -3.877 -7.700 521 HD21 LEU 69 3HD2 LEU 69 14.167 -3.962 -10.428 522 HD22 LEU 69 1HD2 LEU 69 12.493 -3.410 -10.359 523 HD23 LEU 69 2HD2 LEU 69 12.880 -4.959 -11.108 524 H THR 70 H THR 70 10.580 -7.942 -11.888 525 HA THR 70 HA THR 70 10.207 -10.508 -10.516 526 HB THR 70 HB THR 70 9.029 -11.242 -12.542 527 HG1 THR 70 1HG THR 70 8.757 -9.847 -14.261 528 HG21 THR 70 3HG2 THR 70 7.346 -10.438 -11.283 529 HG22 THR 70 1HG2 THR 70 7.329 -9.106 -12.439 530 HG23 THR 70 2HG2 THR 70 8.206 -8.942 -10.917 531 H GLU 71 H GLU 71 11.453 -12.251 -10.929 532 HA GLU 71 HA GLU 71 13.994 -11.975 -12.031 533 HB2 GLU 71 1HB GLU 71 14.042 -14.483 -12.016 534 HB3 GLU 71 2HB GLU 71 13.573 -13.751 -10.488 535 HG2 GLU 71 1HG GLU 71 12.005 -15.383 -10.622 536 HG3 GLU 71 2HG GLU 71 11.149 -14.090 -11.462 537 H GLY 72 H GLY 72 11.073 -13.427 -13.453 538 HA2 GLY 72 1HA GLY 72 11.382 -12.521 -16.018 539 HA3 GLY 72 2HA GLY 72 12.359 -13.982 -15.957 540 H PHE 73 H PHE 73 11.302 -15.596 -16.886 541 HA PHE 73 HA PHE 73 8.492 -15.678 -17.193 542 HB2 PHE 73 1HB PHE 73 8.954 -18.082 -17.914 543 HB3 PHE 73 2HB PHE 73 9.764 -16.816 -18.831 544 HD1 PHE 73 1HD PHE 73 12.173 -16.381 -18.467 545 HD2 PHE 73 2HD PHE 73 10.177 -19.684 -16.673 546 HE1 PHE 73 1HE PHE 73 14.345 -17.449 -18.026 547 HE2 PHE 73 2HE PHE 73 12.345 -20.757 -16.227 548 HZ PHE 73 HZ PHE 73 14.433 -19.640 -16.903 549 HA PRO 74 HA PRO 74 7.190 -17.410 -13.362 550 HB2 PRO 74 1HB PRO 74 4.850 -18.525 -14.168 551 HB3 PRO 74 2HB PRO 74 5.066 -16.781 -13.974 552 HG2 PRO 74 1HG PRO 74 5.154 -18.435 -16.468 553 HG3 PRO 74 2HG PRO 74 4.385 -16.860 -16.196 554 HD2 PRO 74 1HD PRO 74 6.781 -17.117 -17.430 555 HD3 PRO 74 2HD PRO 74 6.369 -15.710 -16.429 556 HA PRO 75 HA PRO 75 8.697 -21.585 -13.557 557 HB2 PRO 75 1HB PRO 75 8.237 -22.214 -10.957 558 HB3 PRO 75 2HB PRO 75 9.583 -21.192 -11.474 559 HG2 PRO 75 1HG PRO 75 6.925 -20.398 -10.349 560 HG3 PRO 75 2HG PRO 75 8.535 -19.754 -9.977 561 HD2 PRO 75 1HD PRO 75 6.811 -18.493 -11.640 562 HD3 PRO 75 2HD PRO 75 8.572 -18.415 -11.853 563 H GLY 76 H GLY 76 5.633 -20.907 -11.864 564 HA2 GLY 76 1HA GLY 76 4.605 -23.467 -12.926 565 HA3 GLY 76 2HA GLY 76 4.123 -22.801 -11.372 566 H GLY 77 H GLY 77 1.931 -22.787 -11.903 567 HA2 GLY 77 1HA GLY 77 0.859 -21.668 -14.258 568 HA3 GLY 77 2HA GLY 77 -0.017 -21.923 -12.756 569 H GLY 78 H GLY 78 -1.151 -19.962 -13.057 570 HA2 GLY 78 1HA GLY 78 0.356 -17.482 -13.161 571 HA3 GLY 78 2HA GLY 78 -1.394 -17.642 -13.162 572 H ASN 79 H ASN 79 1.117 -16.491 -11.426 573 HA ASN 79 HA ASN 79 -0.485 -16.334 -9.015 574 HB2 ASN 79 1HB ASN 79 1.696 -16.969 -7.694 575 HB3 ASN 79 2HB ASN 79 0.617 -18.232 -8.280 576 HD21 ASN 79 1HD2 ASN 79 2.343 -19.704 -8.240 577 HD22 ASN 79 2HD2 ASN 79 3.556 -19.700 -9.470 578 H ALA 80 H ALA 80 0.945 -15.070 -7.286 579 HA ALA 80 HA ALA 80 1.679 -12.602 -8.605 580 HB1 ALA 80 1HB ALA 80 0.484 -12.055 -6.749 581 HB2 ALA 80 2HB ALA 80 1.080 -13.431 -5.821 582 HB3 ALA 80 3HB ALA 80 2.103 -12.013 -6.051 583 H ARG 81 H ARG 81 3.479 -14.511 -9.336 584 HA ARG 81 HA ARG 81 5.717 -15.000 -7.852 585 HB2 ARG 81 1HB ARG 81 6.977 -15.057 -9.969 586 HB3 ARG 81 2HB ARG 81 5.427 -15.876 -10.102 587 HG2 ARG 81 1HG ARG 81 4.596 -13.588 -11.013 588 HG3 ARG 81 2HG ARG 81 6.312 -13.294 -11.303 589 HD2 ARG 81 1HD ARG 81 6.479 -15.151 -12.758 590 HD3 ARG 81 2HD ARG 81 4.909 -15.776 -12.257 591 HE ARG 81 HE ARG 81 5.420 -13.682 -14.184 592 HH11 ARG 81 1HH1 ARG 81 3.089 -15.223 -12.108 593 HH12 ARG 81 2HH1 ARG 81 1.720 -14.654 -13.004 594 HH21 ARG 81 1HH2 ARG 81 3.626 -12.927 -15.373 595 HH22 ARG 81 2HH2 ARG 81 2.027 -13.349 -14.862 596 H ALA 82 H ALA 82 7.040 -13.735 -6.744 597 HA ALA 82 HA ALA 82 8.139 -11.338 -7.896 598 HB1 ALA 82 1HB ALA 82 6.239 -11.170 -5.571 599 HB2 ALA 82 2HB ALA 82 7.422 -9.912 -5.936 600 HB3 ALA 82 3HB ALA 82 6.164 -10.307 -7.107 601 H THR 83 H THR 83 10.217 -11.447 -7.396 602 HA THR 83 HA THR 83 11.004 -12.712 -4.859 603 HB THR 83 HB THR 83 13.276 -12.903 -5.940 604 HG1 THR 83 1HG THR 83 11.980 -12.525 -8.414 605 HG21 THR 83 3HG2 THR 83 12.641 -14.990 -6.391 606 HG22 THR 83 1HG2 THR 83 11.784 -14.452 -7.835 607 HG23 THR 83 2HG2 THR 83 10.959 -14.474 -6.276 608 H GLY 84 H GLY 84 11.159 -9.781 -6.716 609 HA2 GLY 84 1HA GLY 84 12.601 -8.514 -4.478 610 HA3 GLY 84 2HA GLY 84 13.069 -8.185 -6.139 611 H MET 85 H MET 85 12.586 -5.972 -5.014 612 HA MET 85 HA MET 85 10.011 -5.122 -6.052 613 HB2 MET 85 1HB MET 85 9.408 -5.628 -3.777 614 HB3 MET 85 2HB MET 85 10.803 -4.753 -3.162 615 HG2 MET 85 1HG MET 85 8.849 -3.422 -2.831 616 HG3 MET 85 2HG MET 85 9.847 -2.666 -4.071 617 HE1 MET 85 3HE MET 85 6.082 -2.003 -4.371 618 HE2 MET 85 1HE MET 85 5.764 -3.630 -3.769 619 HE3 MET 85 2HE MET 85 6.946 -2.604 -2.955 620 H PHE 86 H PHE 86 9.896 -2.888 -6.493 621 HA PHE 86 HA PHE 86 12.379 -1.369 -6.114 622 HB2 PHE 86 1HB PHE 86 12.218 -2.426 -8.429 623 HB3 PHE 86 2HB PHE 86 10.862 -1.341 -8.721 624 HD1 PHE 86 2HD PHE 86 14.470 -1.443 -7.911 625 HD2 PHE 86 1HD PHE 86 11.210 0.893 -9.337 626 HE1 PHE 86 2HE PHE 86 16.038 0.328 -8.587 627 HE2 PHE 86 1HE PHE 86 12.774 2.668 -10.016 628 HZ PHE 86 HZ PHE 86 15.191 2.387 -9.640 629 H LEU 87 H LEU 87 11.976 0.525 -5.197 630 HA LEU 87 HA LEU 87 9.423 1.867 -5.767 631 HB2 LEU 87 1HB LEU 87 10.650 2.052 -3.053 632 HB3 LEU 87 2HB LEU 87 8.977 2.309 -3.545 633 HG LEU 87 HG LEU 87 10.135 -0.438 -3.705 634 HD11 LEU 87 1HD1 LEU 87 8.883 0.547 -1.173 635 HD12 LEU 87 2HD1 LEU 87 10.622 0.682 -1.432 636 HD13 LEU 87 3HD1 LEU 87 9.848 -0.902 -1.453 637 HD21 LEU 87 3HD2 LEU 87 7.471 -0.133 -2.645 638 HD22 LEU 87 1HD2 LEU 87 8.018 -0.999 -4.081 639 HD23 LEU 87 2HD2 LEU 87 7.644 0.722 -4.178 640 H GLN 88 H GLN 88 9.518 4.053 -6.020 641 HA GLN 88 HA GLN 88 12.180 5.289 -5.757 642 HB2 GLN 88 1HB GLN 88 10.026 5.724 -7.822 643 HB3 GLN 88 2HB GLN 88 11.370 6.836 -7.603 644 HG2 GLN 88 1HG GLN 88 12.930 4.969 -8.053 645 HG3 GLN 88 2HG GLN 88 11.541 3.938 -8.390 646 HE21 GLN 88 1HE2 GLN 88 13.348 6.742 -9.445 647 HE22 GLN 88 2HE2 GLN 88 12.777 6.736 -11.076 648 H TYR 89 H TYR 89 12.346 7.269 -4.797 649 HA TYR 89 HA TYR 89 10.069 8.907 -4.225 650 HB2 TYR 89 1HB TYR 89 10.063 8.712 -1.821 651 HB3 TYR 89 2HB TYR 89 9.841 7.107 -2.509 652 HD1 TYR 89 1HD TYR 89 12.220 9.332 -0.785 653 HD2 TYR 89 2HD TYR 89 11.465 5.381 -2.171 654 HE1 TYR 89 1HE TYR 89 14.124 8.511 0.538 655 HE2 TYR 89 2HE TYR 89 13.366 4.548 -0.851 656 HH TYR 89 HH TYR 89 15.039 6.570 1.439 657 H THR 90 H THR 90 10.644 10.900 -3.162 658 HA THR 90 HA THR 90 13.530 11.481 -3.331 659 HB THR 90 HB THR 90 12.926 13.803 -3.904 660 HG1 THR 90 1HG THR 90 10.820 14.381 -4.197 661 HG21 THR 90 3HG2 THR 90 11.391 12.408 -5.963 662 HG22 THR 90 1HG2 THR 90 12.913 11.615 -5.563 663 HG23 THR 90 2HG2 THR 90 12.908 13.297 -6.091 664 H VAL 91 H VAL 91 14.461 12.780 -1.759 665 HA VAL 91 HA VAL 91 12.824 13.166 0.660 666 HB VAL 91 HB VAL 91 15.812 12.783 0.418 667 HG11 VAL 91 1HG1 VAL 91 14.271 12.883 2.988 668 HG12 VAL 91 2HG1 VAL 91 16.008 13.048 2.727 669 HG13 VAL 91 3HG1 VAL 91 14.916 14.349 2.251 670 HG21 VAL 91 3HG2 VAL 91 14.485 10.739 0.075 671 HG22 VAL 91 1HG2 VAL 91 15.432 10.676 1.562 672 HG23 VAL 91 2HG2 VAL 91 13.700 11.002 1.632 673 HA PRO 92 HA PRO 92 13.339 17.523 0.201 674 HB2 PRO 92 1HB PRO 92 12.749 18.255 2.747 675 HB3 PRO 92 2HB PRO 92 11.521 17.723 1.592 676 HG2 PRO 92 1HG PRO 92 12.860 16.179 3.779 677 HG3 PRO 92 2HG PRO 92 11.151 16.199 3.309 678 HD2 PRO 92 1HD PRO 92 12.842 14.217 2.571 679 HD3 PRO 92 2HD PRO 92 11.488 14.745 1.552 680 H GLY 93 H GLY 93 15.340 18.317 -0.051 681 HA2 GLY 93 1HA GLY 93 16.995 19.625 1.323 682 HA3 GLY 93 2HA GLY 93 17.197 18.139 2.240 683 H THR 94 H THR 94 17.288 16.259 0.227 684 HA THR 94 HA THR 94 19.959 16.690 -0.768 685 HB THR 94 HB THR 94 18.924 14.470 0.124 686 HG1 THR 94 1HG THR 94 20.305 13.364 -1.588 687 HG21 THR 94 3HG2 THR 94 18.310 14.045 -2.781 688 HG22 THR 94 1HG2 THR 94 17.078 14.656 -1.678 689 HG23 THR 94 2HG2 THR 94 17.817 13.082 -1.388 690 H GLU 95 H GLU 95 20.266 15.648 -3.123 691 HA GLU 95 HA GLU 95 18.372 17.028 -4.910 692 HB2 GLU 95 1HB GLU 95 20.543 17.161 -6.410 693 HB3 GLU 95 2HB GLU 95 20.203 18.379 -5.189 694 HG2 GLU 95 1HG GLU 95 21.702 17.267 -3.634 695 HG3 GLU 95 2HG GLU 95 22.017 16.005 -4.824 696 H GLY 96 H GLY 96 17.337 15.666 -6.201 697 HA2 GLY 96 1HA GLY 96 17.582 14.091 -8.070 698 HA3 GLY 96 2HA GLY 96 18.759 13.232 -7.088 699 H VAL 97 H VAL 97 17.471 11.330 -7.481 700 HA VAL 97 HA VAL 97 15.134 11.192 -5.690 701 HB VAL 97 HB VAL 97 15.479 9.731 -8.313 702 HG11 VAL 97 1HG1 VAL 97 13.310 9.617 -6.225 703 HG12 VAL 97 2HG1 VAL 97 13.125 8.994 -7.866 704 HG13 VAL 97 3HG1 VAL 97 14.336 8.298 -6.788 705 HG21 VAL 97 3HG2 VAL 97 14.845 12.245 -8.258 706 HG22 VAL 97 1HG2 VAL 97 13.892 11.139 -9.247 707 HG23 VAL 97 2HG2 VAL 97 13.284 11.665 -7.677 708 H THR 98 H THR 98 14.897 9.338 -4.460 709 HA THR 98 HA THR 98 17.241 7.550 -4.423 710 HB THR 98 HB THR 98 15.417 8.240 -2.111 711 HG1 THR 98 1HG THR 98 17.646 9.160 -1.457 712 HG21 THR 98 3HG2 THR 98 17.544 7.211 -0.925 713 HG22 THR 98 1HG2 THR 98 17.706 6.366 -2.464 714 HG23 THR 98 2HG2 THR 98 16.235 6.183 -1.508 715 H GLN 99 H GLN 99 16.921 5.442 -4.752 716 HA GLN 99 HA GLN 99 14.147 4.454 -4.752 717 HB2 GLN 99 1HB GLN 99 14.764 2.885 -6.451 718 HB3 GLN 99 2HB GLN 99 15.337 4.470 -6.955 719 HG2 GLN 99 1HG GLN 99 17.071 2.416 -5.606 720 HG3 GLN 99 2HG GLN 99 16.928 2.593 -7.355 721 HE21 GLN 99 1HE2 GLN 99 19.135 3.019 -5.311 722 HE22 GLN 99 2HE2 GLN 99 19.767 4.578 -5.703 723 H LEU 100 H LEU 100 13.699 2.412 -3.882 724 HA LEU 100 HA LEU 100 15.830 1.263 -2.205 725 HB2 LEU 100 1HB LEU 100 13.960 2.620 -1.047 726 HB3 LEU 100 2HB LEU 100 12.945 1.223 -1.401 727 HG LEU 100 HG LEU 100 14.902 -0.065 -0.174 728 HD11 LEU 100 1HD1 LEU 100 15.119 2.008 1.758 729 HD12 LEU 100 2HD1 LEU 100 15.643 2.641 0.198 730 HD13 LEU 100 3HD1 LEU 100 16.401 1.194 0.861 731 HD21 LEU 100 3HD2 LEU 100 13.591 0.665 2.027 732 HD22 LEU 100 1HD2 LEU 100 12.882 -0.394 0.807 733 HD23 LEU 100 2HD2 LEU 100 12.483 1.324 0.823 734 H LYS 101 H LYS 101 16.121 -0.877 -2.367 735 HA LYS 101 HA LYS 101 14.160 -2.401 -3.950 736 HB2 LYS 101 1HB LYS 101 16.676 -2.024 -4.678 737 HB3 LYS 101 2HB LYS 101 16.963 -3.357 -3.567 738 HG2 LYS 101 1HG LYS 101 15.530 -4.801 -4.825 739 HG3 LYS 101 2HG LYS 101 15.014 -3.465 -5.857 740 HD2 LYS 101 1HD LYS 101 16.601 -4.396 -7.209 741 HD3 LYS 101 2HD LYS 101 17.618 -3.278 -6.297 742 HE2 LYS 101 1HE LYS 101 18.829 -5.235 -6.159 743 HE3 LYS 101 2HE LYS 101 17.893 -5.287 -4.666 744 HZ1 LYS 101 3HZ LYS 101 17.088 -7.229 -5.315 745 HZ2 LYS 101 1HZ LYS 101 17.916 -7.134 -6.788 746 HZ3 LYS 101 2HZ LYS 101 16.358 -6.490 -6.651 747 H LEU 102 H LEU 102 13.400 -4.337 -3.203 748 HA LEU 102 HA LEU 102 14.380 -5.253 -0.586 749 HB2 LEU 102 1HB LEU 102 11.479 -5.360 -1.332 750 HB3 LEU 102 2HB LEU 102 12.215 -5.535 0.259 751 HG LEU 102 HG LEU 102 12.190 -2.941 -1.272 752 HD11 LEU 102 1HD1 LEU 102 9.954 -3.087 -0.932 753 HD12 LEU 102 2HD1 LEU 102 10.417 -2.504 0.666 754 HD13 LEU 102 3HD1 LEU 102 10.116 -4.222 0.408 755 HD21 LEU 102 3HD2 LEU 102 13.558 -2.287 0.349 756 HD22 LEU 102 1HD2 LEU 102 13.423 -3.851 1.154 757 HD23 LEU 102 2HD2 LEU 102 12.259 -2.573 1.509 758 H THR 103 H THR 103 15.058 -7.279 -0.695 759 HA THR 103 HA THR 103 13.801 -9.084 -2.658 760 HB THR 103 HB THR 103 16.616 -9.447 -1.662 761 HG1 THR 103 1HG THR 103 15.676 -7.802 -3.776 762 HG21 THR 103 3HG2 THR 103 15.951 -11.382 -2.746 763 HG22 THR 103 1HG2 THR 103 16.696 -10.473 -4.060 764 HG23 THR 103 2HG2 THR 103 14.940 -10.513 -3.901 765 H VAL 104 H VAL 104 13.905 -11.398 -2.078 766 HA VAL 104 HA VAL 104 13.071 -11.767 0.656 767 HB VAL 104 HB VAL 104 13.379 -13.817 -1.543 768 HG11 VAL 104 1HG1 VAL 104 13.358 -14.642 0.845 769 HG12 VAL 104 2HG1 VAL 104 11.711 -14.018 0.954 770 HG13 VAL 104 3HG1 VAL 104 12.098 -15.290 -0.205 771 HG21 VAL 104 3HG2 VAL 104 11.631 -11.718 -1.513 772 HG22 VAL 104 1HG2 VAL 104 11.365 -13.249 -2.347 773 HG23 VAL 104 2HG2 VAL 104 10.688 -12.992 -0.739 774 H VAL 105 H VAL 105 14.348 -12.319 2.285 775 HA VAL 105 HA VAL 105 17.098 -12.725 2.075 776 HB VAL 105 HB VAL 105 15.336 -13.700 4.325 777 HG11 VAL 105 1HG1 VAL 105 18.247 -12.913 4.266 778 HG12 VAL 105 2HG1 VAL 105 17.336 -13.392 5.700 779 HG13 VAL 105 3HG1 VAL 105 17.619 -14.555 4.404 780 HG21 VAL 105 3HG2 VAL 105 14.773 -11.548 4.563 781 HG22 VAL 105 1HG2 VAL 105 16.429 -11.309 5.120 782 HG23 VAL 105 2HG2 VAL 105 16.013 -11.008 3.432 783 H GLU 106 H GLU 106 18.406 -14.566 2.304 784 HA GLU 106 HA GLU 106 17.131 -17.034 1.360 785 HB2 GLU 106 1HB GLU 106 20.016 -16.136 1.325 786 HB3 GLU 106 2HB GLU 106 19.475 -17.724 0.800 787 HG2 GLU 106 1HG GLU 106 18.010 -16.578 -0.871 788 HG3 GLU 106 2HG GLU 106 18.797 -15.065 -0.425 789 H ASP 107 H ASP 107 16.869 -16.312 4.092 790 HA ASP 107 HA ASP 107 18.749 -17.999 5.544 791 HB2 ASP 107 1HB ASP 107 17.746 -15.686 6.297 792 HB3 ASP 107 2HB ASP 107 16.393 -16.678 6.835 793 H VAL 108 H VAL 108 17.559 -19.292 7.412 794 HA VAL 108 HA VAL 108 16.108 -21.367 6.091 795 HB VAL 108 HB VAL 108 17.657 -21.874 7.917 796 HG11 VAL 108 1HG1 VAL 108 17.065 -21.359 10.237 797 HG12 VAL 108 2HG1 VAL 108 17.289 -19.890 9.285 798 HG13 VAL 108 3HG1 VAL 108 15.663 -20.450 9.676 799 HG21 VAL 108 3HG2 VAL 108 15.204 -22.753 9.223 800 HG22 VAL 108 1HG2 VAL 108 15.191 -23.004 7.477 801 HG23 VAL 108 2HG2 VAL 108 16.481 -23.699 8.458 802 H THR 109 H THR 109 15.268 -18.814 8.383 803 HA THR 109 HA THR 109 12.426 -19.503 8.008 804 HB THR 109 HB THR 109 12.027 -18.298 10.170 805 HG1 THR 109 1HG THR 109 14.080 -18.229 11.484 806 HG21 THR 109 3HG2 THR 109 13.227 -20.145 11.570 807 HG22 THR 109 1HG2 THR 109 13.654 -20.802 9.991 808 HG23 THR 109 2HG2 THR 109 11.958 -20.597 10.432 809 H VAL 110 H VAL 110 12.187 -18.215 6.155 810 HA VAL 110 HA VAL 110 12.456 -15.313 6.598 811 HB VAL 110 HB VAL 110 13.835 -16.028 4.752 812 HG11 VAL 110 1HG1 VAL 110 11.326 -17.209 3.563 813 HG12 VAL 110 2HG1 VAL 110 12.906 -17.133 2.781 814 HG13 VAL 110 3HG1 VAL 110 12.683 -18.118 4.228 815 HG21 VAL 110 3HG2 VAL 110 11.981 -14.915 2.938 816 HG22 VAL 110 1HG2 VAL 110 11.677 -14.174 4.510 817 HG23 VAL 110 2HG2 VAL 110 13.288 -14.099 3.795 818 H GLY 111 H GLY 111 10.388 -17.807 5.139 819 HA2 GLY 111 1HA GLY 111 8.041 -17.877 5.338 820 HA3 GLY 111 2HA GLY 111 8.052 -16.184 5.806 821 H ARG 112 H ARG 112 9.335 -17.912 2.967 822 HA ARG 112 HA ARG 112 9.045 -16.059 1.047 823 HB2 ARG 112 1HB ARG 112 8.679 -19.014 1.024 824 HB3 ARG 112 2HB ARG 112 8.207 -18.123 -0.416 825 HG2 ARG 112 1HG ARG 112 10.888 -17.617 0.773 826 HG3 ARG 112 2HG ARG 112 10.623 -19.091 -0.161 827 HD2 ARG 112 1HD ARG 112 9.744 -17.662 -2.013 828 HD3 ARG 112 2HD ARG 112 10.239 -16.248 -1.083 829 HE ARG 112 HE ARG 112 12.453 -17.921 -1.320 830 HH11 ARG 112 1HH1 ARG 112 10.377 -16.017 -3.365 831 HH12 ARG 112 2HH1 ARG 112 11.606 -15.710 -4.548 832 HH21 ARG 112 1HH2 ARG 112 14.079 -17.524 -2.869 833 HH22 ARG 112 2HH2 ARG 112 13.711 -16.569 -4.265 834 H ARG 113 H ARG 113 6.419 -17.976 2.415 835 HA ARG 113 HA ARG 113 4.382 -17.230 0.654 836 HB2 ARG 113 1HB ARG 113 4.337 -18.024 3.562 837 HB3 ARG 113 2HB ARG 113 2.867 -17.695 2.655 838 HG2 ARG 113 1HG ARG 113 4.900 -19.743 1.815 839 HG3 ARG 113 2HG ARG 113 3.508 -20.109 2.836 840 HD2 ARG 113 1HD ARG 113 2.118 -19.025 0.962 841 HD3 ARG 113 2HD ARG 113 3.564 -19.220 -0.027 842 HE ARG 113 HE ARG 113 3.092 -21.683 1.111 843 HH11 ARG 113 1HH1 ARG 113 1.378 -19.486 -0.976 844 HH12 ARG 113 2HH1 ARG 113 0.507 -20.738 -1.797 845 HH21 ARG 113 1HH2 ARG 113 1.951 -23.341 0.038 846 HH22 ARG 113 2HH2 ARG 113 0.833 -22.931 -1.219 847 H GLN 114 H GLN 114 5.209 -15.814 3.822 848 HA GLN 114 HA GLN 114 3.374 -13.668 3.601 849 HB2 GLN 114 1HB GLN 114 4.251 -14.455 5.759 850 HB3 GLN 114 2HB GLN 114 5.858 -13.901 5.309 851 HG2 GLN 114 1HG GLN 114 5.348 -11.704 5.628 852 HG3 GLN 114 2HG GLN 114 3.639 -11.933 5.262 853 HE21 GLN 114 1HE2 GLN 114 2.363 -11.670 6.933 854 HE22 GLN 114 2HE2 GLN 114 2.750 -12.007 8.582 855 H ALA 115 H ALA 115 6.886 -13.869 3.091 856 HA ALA 115 HA ALA 115 7.386 -11.213 2.470 857 HB1 ALA 115 1HB ALA 115 9.169 -12.428 0.874 858 HB2 ALA 115 2HB ALA 115 9.354 -12.312 2.624 859 HB3 ALA 115 3HB ALA 115 8.713 -13.787 1.901 860 H VAL 116 H VAL 116 7.082 -13.807 0.036 861 HA VAL 116 HA VAL 116 6.849 -12.186 -2.191 862 HB VAL 116 HB VAL 116 5.562 -14.881 -1.734 863 HG11 VAL 116 1HG1 VAL 116 5.715 -15.001 -4.263 864 HG12 VAL 116 2HG1 VAL 116 4.470 -13.939 -3.601 865 HG13 VAL 116 3HG1 VAL 116 5.970 -13.256 -4.231 866 HG21 VAL 116 3HG2 VAL 116 7.823 -14.953 -3.460 867 HG22 VAL 116 1HG2 VAL 116 8.275 -14.104 -1.982 868 HG23 VAL 116 2HG2 VAL 116 7.607 -15.734 -1.894 869 H ALA 117 H ALA 117 4.419 -13.089 0.156 870 HA ALA 117 HA ALA 117 2.171 -12.208 -1.362 871 HB1 ALA 117 1HB ALA 117 1.013 -12.280 0.885 872 HB2 ALA 117 2HB ALA 117 1.743 -13.791 0.339 873 HB3 ALA 117 3HB ALA 117 2.555 -12.810 1.560 874 H TRP 118 H TRP 118 4.346 -10.701 0.947 875 HA TRP 118 HA TRP 118 2.827 -8.351 1.376 876 HB2 TRP 118 1HB TRP 118 4.746 -9.192 2.799 877 HB3 TRP 118 2HB TRP 118 5.833 -8.585 1.553 878 HD1 TRP 118 HD TRP 118 3.937 -7.501 4.581 879 HE1 TRP 118 1HE TRP 118 4.225 -4.968 4.938 880 HE3 TRP 118 3HE TRP 118 6.065 -6.285 0.094 881 HZ2 TRP 118 2HZ TRP 118 5.222 -2.749 3.507 882 HZ3 TRP 118 3HZ TRP 118 6.656 -3.935 -0.333 883 HH2 TRP 118 HH TRP 118 6.242 -2.205 1.340 884 H LEU 119 H LEU 119 5.620 -8.999 -0.739 885 HA LEU 119 HA LEU 119 5.958 -6.556 -1.910 886 HB2 LEU 119 1HB LEU 119 6.063 -9.246 -3.266 887 HB3 LEU 119 2HB LEU 119 6.744 -7.757 -3.918 888 HG LEU 119 HG LEU 119 7.639 -9.099 -1.367 889 HD11 LEU 119 1HD1 LEU 119 9.112 -8.977 -3.985 890 HD12 LEU 119 2HD1 LEU 119 8.101 -10.344 -3.517 891 HD13 LEU 119 3HD1 LEU 119 9.511 -9.919 -2.547 892 HD21 LEU 119 3HD2 LEU 119 8.740 -7.224 -0.934 893 HD22 LEU 119 1HD2 LEU 119 8.007 -6.468 -2.349 894 HD23 LEU 119 2HD2 LEU 119 9.545 -7.318 -2.501 895 H VAL 120 H VAL 120 3.959 -9.130 -3.370 896 HA VAL 120 HA VAL 120 2.771 -7.609 -5.348 897 HB VAL 120 HB VAL 120 2.575 -10.067 -5.185 898 HG11 VAL 120 1HG1 VAL 120 0.982 -11.104 -3.714 899 HG12 VAL 120 2HG1 VAL 120 2.093 -10.131 -2.748 900 HG13 VAL 120 3HG1 VAL 120 0.469 -9.535 -3.094 901 HG21 VAL 120 3HG2 VAL 120 1.112 -9.267 -6.764 902 HG22 VAL 120 1HG2 VAL 120 -0.008 -10.071 -5.662 903 HG23 VAL 120 2HG2 VAL 120 0.195 -8.320 -5.593 904 H ALA 121 H ALA 121 1.611 -8.193 -2.040 905 HA ALA 121 HA ALA 121 -0.803 -6.853 -2.152 906 HB1 ALA 121 1HB ALA 121 1.126 -7.479 0.013 907 HB2 ALA 121 2HB ALA 121 -0.142 -6.303 0.359 908 HB3 ALA 121 3HB ALA 121 -0.570 -7.932 -0.163 909 H MET 122 H MET 122 2.395 -5.519 -1.335 910 HA MET 122 HA MET 122 1.659 -2.908 -0.801 911 HB2 MET 122 1HB MET 122 3.942 -3.898 -0.514 912 HB3 MET 122 2HB MET 122 4.173 -3.748 -2.251 913 HG2 MET 122 1HG MET 122 5.242 -1.896 -1.264 914 HG3 MET 122 2HG MET 122 3.756 -1.290 -1.993 915 HE1 MET 122 3HE MET 122 3.427 1.140 0.049 916 HE2 MET 122 1HE MET 122 2.609 0.211 -1.207 917 HE3 MET 122 2HE MET 122 1.880 0.363 0.392 918 H HIS 123 H HIS 123 2.983 -4.037 -3.919 919 HA HIS 123 HA HIS 123 2.520 -1.793 -5.421 920 HB2 HIS 123 1HB HIS 123 3.729 -3.494 -6.483 921 HB3 HIS 123 2HB HIS 123 2.505 -4.711 -6.135 922 HD2 HIS 123 2HD HIS 123 2.698 -1.503 -8.460 923 HE1 HIS 123 1HE HIS 123 0.304 -4.480 -10.305 924 HE2 HIS 123 2HE HIS 123 1.383 -2.220 -10.569 925 H LYS 124 H LYS 124 0.275 -4.524 -4.994 926 HA LYS 124 HA LYS 124 -1.829 -3.753 -6.532 927 HB2 LYS 124 1HB LYS 124 -1.638 -5.179 -3.923 928 HB3 LYS 124 2HB LYS 124 -3.234 -4.684 -4.471 929 HG2 LYS 124 1HG LYS 124 -2.427 -5.835 -6.710 930 HG3 LYS 124 2HG LYS 124 -1.386 -6.716 -5.589 931 HD2 LYS 124 1HD LYS 124 -3.505 -7.154 -4.235 932 HD3 LYS 124 2HD LYS 124 -4.390 -6.601 -5.658 933 HE2 LYS 124 1HE LYS 124 -3.327 -8.334 -7.003 934 HE3 LYS 124 2HE LYS 124 -2.402 -8.871 -5.602 935 HZ1 LYS 124 3HZ LYS 124 -4.918 -8.972 -4.677 936 HZ2 LYS 124 1HZ LYS 124 -4.095 -10.291 -5.344 937 HZ3 LYS 124 2HZ LYS 124 -5.157 -9.386 -6.299 938 H ALA 125 H ALA 125 -1.327 -2.744 -3.149 939 HA ALA 125 HA ALA 125 -3.514 -0.955 -3.085 940 HB1 ALA 125 1HB ALA 125 -1.480 -0.132 -1.257 941 HB2 ALA 125 2HB ALA 125 -3.013 -0.937 -0.925 942 HB3 ALA 125 3HB ALA 125 -1.572 -1.893 -1.271 943 H ALA 126 H ALA 126 -0.045 -0.461 -3.657 944 HA ALA 126 HA ALA 126 -0.001 2.306 -3.812 945 HB1 ALA 126 1HB ALA 126 1.730 1.150 -5.805 946 HB2 ALA 126 2HB ALA 126 2.140 1.961 -4.293 947 HB3 ALA 126 3HB ALA 126 1.795 0.232 -4.301 948 H LYS 127 H LYS 127 -1.446 0.046 -5.942 949 HA LYS 127 HA LYS 127 -1.425 1.726 -8.275 950 HB2 LYS 127 1HB LYS 127 -2.951 -0.790 -7.594 951 HB3 LYS 127 2HB LYS 127 -3.072 0.031 -9.145 952 HG2 LYS 127 1HG LYS 127 -0.375 -0.727 -8.150 953 HG3 LYS 127 2HG LYS 127 -1.433 -1.989 -8.786 954 HD2 LYS 127 1HD LYS 127 -1.121 0.506 -10.373 955 HD3 LYS 127 2HD LYS 127 0.227 -0.633 -10.346 956 HE2 LYS 127 1HE LYS 127 -1.060 -1.267 -12.202 957 HE3 LYS 127 2HE LYS 127 -1.491 -2.420 -10.940 958 HZ1 LYS 127 3HZ LYS 127 -3.534 -1.368 -10.586 959 HZ2 LYS 127 1HZ LYS 127 -3.375 -1.413 -12.270 960 HZ3 LYS 127 2HZ LYS 127 -3.080 0.026 -11.432 961 H LEU 128 H LEU 128 -3.910 0.712 -5.935 962 HA LEU 128 HA LEU 128 -5.969 2.319 -7.011 963 HB2 LEU 128 1HB LEU 128 -5.522 0.839 -4.474 964 HB3 LEU 128 2HB LEU 128 -6.804 2.049 -4.508 965 HG LEU 128 HG LEU 128 -6.651 -0.200 -6.501 966 HD11 LEU 128 1HD1 LEU 128 -6.981 -0.582 -3.801 967 HD12 LEU 128 2HD1 LEU 128 -7.542 -1.664 -5.075 968 HD13 LEU 128 3HD1 LEU 128 -8.639 -0.464 -4.392 969 HD21 LEU 128 3HD2 LEU 128 -8.640 0.531 -7.261 970 HD22 LEU 128 1HD2 LEU 128 -8.124 2.063 -6.555 971 HD23 LEU 128 2HD2 LEU 128 -9.204 0.997 -5.656 972 H LEU 129 H LEU 129 -3.384 2.955 -4.766 973 HA LEU 129 HA LEU 129 -4.361 5.258 -3.521 974 HB2 LEU 129 1HB LEU 129 -1.677 4.114 -4.053 975 HB3 LEU 129 2HB LEU 129 -1.756 5.809 -3.578 976 HG LEU 129 HG LEU 129 -2.743 3.444 -1.987 977 HD11 LEU 129 1HD1 LEU 129 -0.531 3.398 -1.524 978 HD12 LEU 129 2HD1 LEU 129 -0.977 4.692 -0.412 979 HD13 LEU 129 3HD1 LEU 129 -0.284 5.082 -1.986 980 HD21 LEU 129 3HD2 LEU 129 -4.153 4.890 -1.044 981 HD22 LEU 129 1HD2 LEU 129 -3.414 6.267 -1.862 982 HD23 LEU 129 2HD2 LEU 129 -2.728 5.668 -0.352 983 H TYR 130 H TYR 130 -2.861 4.789 -6.656 984 HA TYR 130 HA TYR 130 -2.998 7.678 -7.165 985 HB2 TYR 130 1HB TYR 130 -1.775 5.786 -9.122 986 HB3 TYR 130 2HB TYR 130 -1.318 7.439 -8.724 987 HD1 TYR 130 2HD TYR 130 -1.110 7.136 -5.733 988 HD2 TYR 130 1HD TYR 130 0.295 4.682 -8.912 989 HE1 TYR 130 2HE TYR 130 0.686 6.293 -4.280 990 HE2 TYR 130 1HE TYR 130 2.094 3.831 -7.468 991 HH TYR 130 HH TYR 130 2.851 5.255 -4.443 992 H GLU 131 H GLU 131 -3.660 4.620 -8.885 993 HA GLU 131 HA GLU 131 -5.112 5.600 -10.997 994 HB2 GLU 131 1HB GLU 131 -5.548 3.036 -9.459 995 HB3 GLU 131 2HB GLU 131 -6.277 3.388 -11.019 996 HG2 GLU 131 1HG GLU 131 -3.778 3.802 -11.722 997 HG3 GLU 131 2HG GLU 131 -3.456 2.753 -10.342 998 H SER 132 H SER 132 -6.013 5.479 -7.678 999 HA SER 132 HA SER 132 -8.534 6.792 -8.310 1000 HB2 SER 132 1HB SER 132 -9.017 4.331 -8.134 1001 HB3 SER 132 2HB SER 132 -8.467 4.399 -6.460 1002 HG SER 132 HG SER 132 -10.871 4.882 -7.321 1003 H ARG 133 H ARG 133 -9.660 7.349 -6.094 1004 HA ARG 133 HA ARG 133 -7.598 8.654 -4.482 1005 HB2 ARG 133 1HB ARG 133 -10.557 9.113 -4.815 1006 HB3 ARG 133 2HB ARG 133 -9.636 9.876 -3.525 1007 HG2 ARG 133 1HG ARG 133 -9.536 11.518 -5.092 1008 HG3 ARG 133 2HG ARG 133 -8.090 10.607 -5.533 1009 HD2 ARG 133 1HD ARG 133 -10.678 9.837 -6.778 1010 HD3 ARG 133 2HD ARG 133 -9.896 11.317 -7.331 1011 HE ARG 133 HE ARG 133 -8.041 9.182 -7.281 1012 HH11 ARG 133 1HH1 ARG 133 -10.761 10.404 -9.077 1013 HH12 ARG 133 2HH1 ARG 133 -10.261 9.688 -10.573 1014 HH21 ARG 133 1HH2 ARG 133 -7.372 8.234 -9.244 1015 HH22 ARG 133 2HH2 ARG 133 -8.334 8.453 -10.667 1016 H ASP 134 H ASP 134 -7.752 8.668 -2.159 1017 HA ASP 134 HA ASP 134 -8.364 6.064 -1.107 1018 HB2 ASP 134 1HB ASP 134 -6.448 7.778 -0.467 1019 HB3 ASP 134 2HB ASP 134 -7.660 8.356 0.672 1020 H GLN 135 H GLN 135 -9.442 9.358 -0.256 1021 HA GLN 135 HA GLN 135 -11.836 8.176 0.969 1022 HB2 GLN 135 1HB GLN 135 -10.367 9.682 2.347 1023 HB3 GLN 135 2HB GLN 135 -10.812 11.000 1.272 1024 HG2 GLN 135 1HG GLN 135 -12.128 11.035 3.314 1025 HG3 GLN 135 2HG GLN 135 -13.143 10.754 1.900 1026 HE21 GLN 135 1HE2 GLN 135 -14.753 9.862 3.225 1027 HE22 GLN 135 2HE2 GLN 135 -14.610 8.266 3.871 1028 H SER 136 H SER 136 -13.764 8.417 0.044 1029 HA SER 136 HA SER 136 -13.959 10.004 -2.386 1030 HB2 SER 136 1HB SER 136 -16.128 8.870 -2.689 1031 HB3 SER 136 2HB SER 136 -14.827 7.711 -2.416 1032 HG SER 136 HG SER 136 -15.704 7.148 -0.573 1033 H GLY 137 H GLY 137 -14.312 12.113 -2.024 1034 HA2 GLY 137 1HA GLY 137 -16.726 13.177 -1.328 1035 HA3 GLY 137 2HA GLY 137 -15.871 13.053 0.202 1036 HA PRO 138 HA PRO 138 -13.530 16.688 -0.546 1037 HB2 PRO 138 1HB PRO 138 -10.916 15.995 -0.308 1038 HB3 PRO 138 2HB PRO 138 -12.020 16.068 1.071 1039 HG2 PRO 138 1HG PRO 138 -11.111 13.690 -0.504 1040 HG3 PRO 138 2HG PRO 138 -11.291 13.868 1.251 1041 HD2 PRO 138 1HD PRO 138 -13.138 12.617 -0.284 1042 HD3 PRO 138 2HD PRO 138 -13.570 13.526 1.178 1043 H SER 139 H SER 139 -13.223 14.125 -2.719 1044 HA SER 139 HA SER 139 -11.242 14.982 -4.483 1045 HB2 SER 139 1HB SER 139 -12.345 13.594 -6.157 1046 HB3 SER 139 2HB SER 139 -12.359 12.770 -4.598 1047 HG SER 139 HG SER 139 -14.439 12.707 -4.777 1048 H SER 140 H SER 140 -11.368 16.101 -6.487 1049 HA SER 140 HA SER 140 -13.182 18.364 -6.381 1050 HB2 SER 140 1HB SER 140 -11.790 19.325 -8.128 1051 HB3 SER 140 2HB SER 140 -10.759 18.682 -6.850 1052 HG SER 140 HG SER 140 -11.397 16.977 -8.958 1053 H GLY 141 H GLY 141 -14.412 15.868 -6.947 1054 HA2 GLY 141 1HA GLY 141 -15.248 16.303 -9.749 1055 HA3 GLY 141 2HA GLY 141 -15.164 14.710 -9.012 Start of MODEL 2 1 H1 GLY 1 H GLY 1 -22.335 11.364 2.371 2 HA2 GLY 1 1HA GLY 1 -19.781 11.169 2.877 3 HA3 GLY 1 2HA GLY 1 -20.288 11.843 4.418 4 H SER 2 H SER 2 -22.463 10.573 5.154 5 HA SER 2 HA SER 2 -21.646 8.147 6.149 6 HB2 SER 2 1HB SER 2 -23.727 9.577 6.738 7 HB3 SER 2 2HB SER 2 -24.544 8.627 5.497 8 HG SER 2 HG SER 2 -23.821 7.926 8.029 9 H SER 3 H SER 3 -21.375 6.168 5.355 10 HA SER 3 HA SER 3 -22.990 5.100 3.248 11 HB2 SER 3 1HB SER 3 -21.557 6.383 1.810 12 HB3 SER 3 2HB SER 3 -20.115 5.835 2.665 13 HG SER 3 HG SER 3 -20.636 4.742 0.621 14 H GLY 4 H GLY 4 -23.291 3.075 3.882 15 HA2 GLY 4 1HA GLY 4 -21.041 1.674 5.188 16 HA3 GLY 4 2HA GLY 4 -22.730 1.400 5.591 17 H SER 5 H SER 5 -20.276 0.962 3.103 18 HA SER 5 HA SER 5 -21.966 -1.115 1.877 19 HB2 SER 5 1HB SER 5 -19.942 0.780 0.768 20 HB3 SER 5 2HB SER 5 -20.110 -0.800 0.001 21 HG SER 5 HG SER 5 -21.486 0.898 -0.862 22 H SER 6 H SER 6 -20.695 -2.951 0.895 23 HA SER 6 HA SER 6 -19.112 -4.161 2.939 24 HB2 SER 6 1HB SER 6 -19.765 -5.058 0.123 25 HB3 SER 6 2HB SER 6 -18.920 -6.051 1.311 26 HG SER 6 HG SER 6 -21.523 -4.960 1.626 27 H GLY 7 H GLY 7 -18.374 -3.393 -0.472 28 HA2 GLY 7 1HA GLY 7 -16.412 -2.354 -1.253 29 HA3 GLY 7 2HA GLY 7 -15.674 -2.614 0.320 30 H ALA 8 H ALA 8 -13.800 -3.360 -0.839 31 HA ALA 8 HA ALA 8 -14.071 -5.912 -2.233 32 HB1 ALA 8 1HB ALA 8 -12.037 -5.510 -3.206 33 HB2 ALA 8 2HB ALA 8 -12.595 -3.857 -2.939 34 HB3 ALA 8 3HB ALA 8 -11.436 -4.587 -1.828 35 H GLU 9 H GLU 9 -14.445 -7.415 -0.638 36 HA GLU 9 HA GLU 9 -13.110 -7.532 1.835 37 HB2 GLU 9 1HB GLU 9 -14.487 -9.694 0.235 38 HB3 GLU 9 2HB GLU 9 -13.914 -9.907 1.884 39 HG2 GLU 9 1HG GLU 9 -15.452 -8.299 2.714 40 HG3 GLU 9 2HG GLU 9 -15.894 -7.793 1.085 41 H PHE 10 H PHE 10 -12.341 -8.840 -1.327 42 HA PHE 10 HA PHE 10 -10.351 -10.661 -0.607 43 HB2 PHE 10 1HB PHE 10 -11.432 -10.222 -2.912 44 HB3 PHE 10 2HB PHE 10 -10.189 -8.990 -3.104 45 HD1 PHE 10 2HD PHE 10 -10.852 -12.580 -2.842 46 HD2 PHE 10 1HD PHE 10 -7.883 -9.586 -3.424 47 HE1 PHE 10 2HE PHE 10 -9.271 -14.302 -3.609 48 HE2 PHE 10 1HE PHE 10 -6.297 -11.303 -4.193 49 HZ PHE 10 HZ PHE 10 -6.990 -13.665 -4.285 50 H TYR 11 H TYR 11 -10.254 -7.178 -0.982 51 HA TYR 11 HA TYR 11 -7.381 -7.036 -0.768 52 HB2 TYR 11 1HB TYR 11 -9.595 -5.023 -0.961 53 HB3 TYR 11 2HB TYR 11 -7.986 -4.510 -0.467 54 HD1 TYR 11 2HD TYR 11 -9.639 -6.515 -3.155 55 HD2 TYR 11 1HD TYR 11 -6.513 -3.824 -2.108 56 HE1 TYR 11 2HE TYR 11 -8.960 -6.394 -5.516 57 HE2 TYR 11 1HE TYR 11 -5.827 -3.695 -4.466 58 HH TYR 11 HH TYR 11 -6.243 -5.572 -6.609 59 H ASP 12 H ASP 12 -10.140 -6.785 1.354 60 HA ASP 12 HA ASP 12 -8.884 -5.544 3.547 61 HB2 ASP 12 1HB ASP 12 -11.296 -7.319 3.275 62 HB3 ASP 12 2HB ASP 12 -10.743 -6.780 4.858 63 H LYS 13 H LYS 13 -8.488 -8.634 2.211 64 HA LYS 13 HA LYS 13 -7.606 -9.877 4.686 65 HB2 LYS 13 1HB LYS 13 -7.962 -10.814 1.859 66 HB3 LYS 13 2HB LYS 13 -6.987 -11.756 2.980 67 HG2 LYS 13 1HG LYS 13 -9.029 -11.651 4.530 68 HG3 LYS 13 2HG LYS 13 -9.917 -11.148 3.090 69 HD2 LYS 13 1HD LYS 13 -8.820 -13.235 2.000 70 HD3 LYS 13 2HD LYS 13 -8.561 -13.754 3.668 71 HE2 LYS 13 1HE LYS 13 -11.032 -13.337 4.034 72 HE3 LYS 13 2HE LYS 13 -11.170 -13.174 2.284 73 HZ1 LYS 13 3HZ LYS 13 -11.043 -15.531 3.843 74 HZ2 LYS 13 1HZ LYS 13 -9.763 -15.510 2.737 75 HZ3 LYS 13 2HZ LYS 13 -11.356 -15.365 2.189 76 H GLN 14 H GLN 14 -6.271 -8.260 1.931 77 HA GLN 14 HA GLN 14 -3.605 -9.254 2.226 78 HB2 GLN 14 1HB GLN 14 -4.768 -6.910 0.727 79 HB3 GLN 14 2HB GLN 14 -3.050 -7.282 0.722 80 HG2 GLN 14 1HG GLN 14 -3.401 -9.340 -0.382 81 HG3 GLN 14 2HG GLN 14 -5.142 -9.264 -0.117 82 HE21 GLN 14 1HE2 GLN 14 -5.994 -9.142 -2.081 83 HE22 GLN 14 2HE2 GLN 14 -5.564 -7.987 -3.292 84 H LEU 15 H LEU 15 -5.469 -6.856 3.801 85 HA LEU 15 HA LEU 15 -3.492 -5.028 4.571 86 HB2 LEU 15 1HB LEU 15 -5.964 -5.885 6.069 87 HB3 LEU 15 2HB LEU 15 -5.009 -4.444 6.412 88 HG LEU 15 HG LEU 15 -6.941 -4.968 4.208 89 HD11 LEU 15 1HD1 LEU 15 -6.342 -2.375 5.577 90 HD12 LEU 15 2HD1 LEU 15 -7.315 -3.613 6.371 91 HD13 LEU 15 3HD1 LEU 15 -7.844 -2.926 4.836 92 HD21 LEU 15 3HD2 LEU 15 -5.971 -3.014 2.984 93 HD22 LEU 15 1HD2 LEU 15 -4.990 -4.478 2.928 94 HD23 LEU 15 2HD2 LEU 15 -4.542 -3.157 4.008 95 H LYS 16 H LYS 16 -4.943 -7.507 6.685 96 HA LYS 16 HA LYS 16 -3.277 -7.462 8.795 97 HB2 LYS 16 1HB LYS 16 -3.907 -9.659 9.294 98 HB3 LYS 16 2HB LYS 16 -5.219 -9.073 8.281 99 HG2 LYS 16 1HG LYS 16 -4.208 -10.201 6.347 100 HG3 LYS 16 2HG LYS 16 -2.933 -10.823 7.398 101 HD2 LYS 16 1HD LYS 16 -4.407 -12.599 7.346 102 HD3 LYS 16 2HD LYS 16 -4.928 -11.747 8.802 103 HE2 LYS 16 1HE LYS 16 -6.951 -12.047 7.787 104 HE3 LYS 16 2HE LYS 16 -6.494 -10.497 7.082 105 HZ1 LYS 16 3HZ LYS 16 -5.481 -11.923 5.231 106 HZ2 LYS 16 1HZ LYS 16 -7.164 -11.752 5.272 107 HZ3 LYS 16 2HZ LYS 16 -6.445 -13.173 5.841 108 H VAL 17 H VAL 17 -2.513 -8.754 5.628 109 HA VAL 17 HA VAL 17 -0.051 -9.982 6.401 110 HB VAL 17 HB VAL 17 -0.949 -9.115 3.649 111 HG11 VAL 17 1HG1 VAL 17 0.795 -11.419 3.803 112 HG12 VAL 17 2HG1 VAL 17 0.951 -9.949 2.839 113 HG13 VAL 17 3HG1 VAL 17 1.548 -9.984 4.499 114 HG21 VAL 17 3HG2 VAL 17 -1.801 -11.322 3.341 115 HG22 VAL 17 1HG2 VAL 17 -1.153 -11.851 4.893 116 HG23 VAL 17 2HG2 VAL 17 -2.486 -10.698 4.841 117 H LEU 18 H LEU 18 -0.856 -6.959 4.702 118 HA LEU 18 HA LEU 18 1.744 -6.025 4.336 119 HB2 LEU 18 1HB LEU 18 -0.859 -4.563 4.707 120 HB3 LEU 18 2HB LEU 18 0.653 -3.743 4.319 121 HG LEU 18 HG LEU 18 -0.654 -5.842 2.589 122 HD11 LEU 18 1HD1 LEU 18 -1.413 -4.076 1.185 123 HD12 LEU 18 2HD1 LEU 18 -0.573 -2.864 2.151 124 HD13 LEU 18 3HD1 LEU 18 -1.960 -3.721 2.823 125 HD21 LEU 18 3HD2 LEU 18 1.672 -5.820 2.163 126 HD22 LEU 18 1HD2 LEU 18 1.744 -4.059 2.239 127 HD23 LEU 18 2HD2 LEU 18 0.931 -4.851 0.889 128 H LEU 19 H LEU 19 -0.543 -4.927 6.849 129 HA LEU 19 HA LEU 19 1.136 -3.406 8.369 130 HB2 LEU 19 1HB LEU 19 -0.941 -5.299 9.460 131 HB3 LEU 19 2HB LEU 19 -0.299 -3.871 10.269 132 HG LEU 19 HG LEU 19 -1.677 -3.538 7.645 133 HD11 LEU 19 1HD1 LEU 19 -3.513 -3.223 9.833 134 HD12 LEU 19 2HD1 LEU 19 -2.909 -4.879 9.766 135 HD13 LEU 19 3HD1 LEU 19 -3.683 -4.166 8.351 136 HD21 LEU 19 3HD2 LEU 19 -2.363 -1.422 8.721 137 HD22 LEU 19 1HD2 LEU 19 -0.611 -1.616 8.645 138 HD23 LEU 19 2HD2 LEU 19 -1.463 -1.892 10.164 139 H SER 20 H SER 20 0.587 -6.903 8.780 140 HA SER 20 HA SER 20 2.144 -7.521 10.888 141 HB2 SER 20 1HB SER 20 1.712 -8.941 8.285 142 HB3 SER 20 2HB SER 20 2.847 -9.611 9.456 143 HG SER 20 HG SER 20 1.152 -10.397 10.398 144 H GLY 21 H GLY 21 3.291 -6.584 7.702 145 HA2 GLY 21 1HA GLY 21 5.353 -5.790 7.048 146 HA3 GLY 21 2HA GLY 21 5.828 -5.792 8.740 147 H ALA 22 H ALA 22 6.891 -6.848 5.972 148 HA ALA 22 HA ALA 22 7.681 -9.505 6.974 149 HB1 ALA 22 1HB ALA 22 6.885 -8.550 4.322 150 HB2 ALA 22 2HB ALA 22 8.334 -9.557 4.330 151 HB3 ALA 22 3HB ALA 22 6.829 -10.173 5.011 152 H THR 23 H THR 23 9.856 -10.158 5.744 153 HA THR 23 HA THR 23 11.773 -8.027 6.399 154 HB THR 23 HB THR 23 12.410 -10.962 6.100 155 HG1 THR 23 1HG THR 23 12.414 -10.683 8.557 156 HG21 THR 23 3HG2 THR 23 13.881 -8.994 7.806 157 HG22 THR 23 1HG2 THR 23 14.174 -9.035 6.068 158 HG23 THR 23 2HG2 THR 23 14.465 -10.474 7.046 159 H PHE 24 H PHE 24 13.326 -7.385 4.965 160 HA PHE 24 HA PHE 24 13.640 -8.772 2.434 161 HB2 PHE 24 1HB PHE 24 12.823 -5.862 2.467 162 HB3 PHE 24 2HB PHE 24 13.096 -6.872 1.051 163 HD1 PHE 24 2HD PHE 24 11.584 -9.018 0.918 164 HD2 PHE 24 1HD PHE 24 10.671 -5.544 3.203 165 HE1 PHE 24 2HE PHE 24 9.203 -9.636 0.901 166 HE2 PHE 24 1HE PHE 24 8.288 -6.158 3.190 167 HZ PHE 24 HZ PHE 24 7.552 -8.206 2.037 168 H LEU 25 H LEU 25 15.387 -7.785 1.104 169 HA LEU 25 HA LEU 25 17.530 -6.871 2.866 170 HB2 LEU 25 1HB LEU 25 17.438 -8.111 0.144 171 HB3 LEU 25 2HB LEU 25 18.887 -7.275 0.696 172 HG LEU 25 HG LEU 25 17.633 -9.602 2.146 173 HD11 LEU 25 1HD1 LEU 25 18.390 -10.810 0.417 174 HD12 LEU 25 2HD1 LEU 25 19.975 -10.529 1.135 175 HD13 LEU 25 3HD1 LEU 25 19.410 -9.503 -0.184 176 HD21 LEU 25 3HD2 LEU 25 20.475 -8.994 2.479 177 HD22 LEU 25 1HD2 LEU 25 19.245 -9.375 3.684 178 HD23 LEU 25 2HD2 LEU 25 19.395 -7.729 3.066 179 H VAL 26 H VAL 26 17.879 -4.765 3.034 180 HA VAL 26 HA VAL 26 17.146 -3.005 0.803 181 HB VAL 26 HB VAL 26 17.817 -2.279 3.659 182 HG11 VAL 26 1HG1 VAL 26 16.876 -0.652 1.309 183 HG12 VAL 26 2HG1 VAL 26 16.736 -0.096 2.979 184 HG13 VAL 26 3HG1 VAL 26 18.326 -0.421 2.286 185 HG21 VAL 26 3HG2 VAL 26 15.190 -2.664 2.243 186 HG22 VAL 26 1HG2 VAL 26 15.769 -3.457 3.708 187 HG23 VAL 26 2HG2 VAL 26 15.342 -1.747 3.741 188 H THR 27 H THR 27 18.652 -2.084 -0.421 189 HA THR 27 HA THR 27 21.433 -2.069 0.558 190 HB THR 27 HB THR 27 20.585 -2.230 -2.337 191 HG1 THR 27 1HG THR 27 21.751 -4.392 -0.972 192 HG21 THR 27 3HG2 THR 27 23.257 -3.012 -1.247 193 HG22 THR 27 1HG2 THR 27 22.900 -1.311 -1.541 194 HG23 THR 27 2HG2 THR 27 22.824 -2.470 -2.868 195 H PHE 28 H PHE 28 21.899 -0.047 1.151 196 HA PHE 28 HA PHE 28 20.710 2.227 -0.178 197 HB2 PHE 28 1HB PHE 28 22.804 2.148 2.005 198 HB3 PHE 28 2HB PHE 28 21.896 3.565 1.488 199 HD1 PHE 28 2HD PHE 28 19.447 3.673 1.909 200 HD2 PHE 28 1HD PHE 28 21.901 0.599 3.537 201 HE1 PHE 28 2HE PHE 28 17.695 3.151 3.554 202 HE2 PHE 28 1HE PHE 28 20.151 0.071 5.184 203 HZ PHE 28 HZ PHE 28 18.045 1.348 5.196 204 H GLY 29 H GLY 29 21.652 3.561 -1.627 205 HA2 GLY 29 1HA GLY 29 23.527 2.879 -3.402 206 HA3 GLY 29 2HA GLY 29 23.348 4.547 -2.879 207 H ASN 30 H ASN 30 24.250 4.163 -0.195 208 HA ASN 30 HA ASN 30 27.057 4.382 -0.631 209 HB2 ASN 30 1HB ASN 30 26.257 5.733 1.106 210 HB3 ASN 30 2HB ASN 30 25.296 4.432 1.803 211 HD21 ASN 30 1HD2 ASN 30 26.090 4.326 3.809 212 HD22 ASN 30 2HD2 ASN 30 27.742 4.009 4.201 213 H SER 31 H SER 31 24.994 1.951 0.922 214 HA SER 31 HA SER 31 27.269 0.213 1.401 215 HB2 SER 31 1HB SER 31 24.345 -0.405 1.855 216 HB3 SER 31 2HB SER 31 25.738 -1.213 2.576 217 HG SER 31 HG SER 31 25.116 0.182 4.112 218 H GLU 32 H GLU 32 27.987 -1.209 -0.030 219 HA GLU 32 HA GLU 32 26.457 -1.765 -2.424 220 HB2 GLU 32 1HB GLU 32 29.115 -2.985 -1.718 221 HB3 GLU 32 2HB GLU 32 28.434 -2.697 -3.312 222 HG2 GLU 32 1HG GLU 32 28.579 -0.219 -2.742 223 HG3 GLU 32 2HG GLU 32 29.607 -0.713 -1.397 224 H LYS 33 H LYS 33 26.651 -3.090 0.624 225 HA LYS 33 HA LYS 33 25.938 -5.777 -0.348 226 HB2 LYS 33 1HB LYS 33 27.673 -6.237 1.067 227 HB3 LYS 33 2HB LYS 33 27.398 -4.803 2.047 228 HG2 LYS 33 1HG LYS 33 25.743 -5.835 3.315 229 HG3 LYS 33 2HG LYS 33 25.490 -7.109 2.120 230 HD2 LYS 33 1HD LYS 33 28.165 -6.856 3.411 231 HD3 LYS 33 2HD LYS 33 26.839 -7.570 4.332 232 HE2 LYS 33 1HE LYS 33 27.565 -8.493 1.564 233 HE3 LYS 33 2HE LYS 33 28.318 -9.164 3.010 234 HZ1 LYS 33 3HZ LYS 33 25.948 -9.959 1.867 235 HZ2 LYS 33 1HZ LYS 33 25.488 -9.114 3.259 236 HZ3 LYS 33 2HZ LYS 33 26.550 -10.426 3.378 237 HA PRO 34 HA PRO 34 21.802 -5.038 0.998 238 HB2 PRO 34 1HB PRO 34 20.962 -7.618 1.101 239 HB3 PRO 34 2HB PRO 34 21.205 -6.747 -0.417 240 HG2 PRO 34 1HG PRO 34 23.014 -8.695 0.959 241 HG3 PRO 34 2HG PRO 34 22.613 -8.565 -0.763 242 HD2 PRO 34 1HD PRO 34 24.920 -7.597 0.272 243 HD3 PRO 34 2HD PRO 34 24.101 -6.839 -1.109 244 H GLU 35 H GLU 35 20.658 -4.971 2.886 245 HA GLU 35 HA GLU 35 21.780 -6.437 5.182 246 HB2 GLU 35 1HB GLU 35 22.331 -4.053 5.320 247 HB3 GLU 35 2HB GLU 35 20.629 -3.642 5.161 248 HG2 GLU 35 1HG GLU 35 21.287 -3.463 7.461 249 HG3 GLU 35 2HG GLU 35 20.171 -4.815 7.274 250 H THR 36 H THR 36 20.338 -7.220 6.721 251 HA THR 36 HA THR 36 17.705 -7.810 5.715 252 HB THR 36 HB THR 36 18.869 -8.510 8.416 253 HG1 THR 36 1HG THR 36 20.182 -9.571 7.063 254 HG21 THR 36 3HG2 THR 36 16.722 -9.129 8.738 255 HG22 THR 36 1HG2 THR 36 17.172 -10.515 7.746 256 HG23 THR 36 2HG2 THR 36 16.356 -9.134 7.013 257 H MET 37 H MET 37 16.177 -6.292 5.844 258 HA MET 37 HA MET 37 15.792 -4.947 8.432 259 HB2 MET 37 1HB MET 37 15.585 -3.702 5.686 260 HB3 MET 37 2HB MET 37 15.034 -2.928 7.166 261 HG2 MET 37 1HG MET 37 17.381 -3.144 8.029 262 HG3 MET 37 2HG MET 37 17.848 -3.653 6.409 263 HE1 MET 37 3HE MET 37 16.845 0.530 7.884 264 HE2 MET 37 1HE MET 37 15.497 -0.607 7.861 265 HE3 MET 37 2HE MET 37 16.941 -0.971 8.805 266 H THR 38 H THR 38 13.567 -4.119 8.731 267 HA THR 38 HA THR 38 11.631 -5.952 7.487 268 HB THR 38 HB THR 38 11.210 -4.421 10.052 269 HG1 THR 38 1HG THR 38 13.053 -5.897 10.138 270 HG21 THR 38 3HG2 THR 38 9.957 -7.043 9.400 271 HG22 THR 38 1HG2 THR 38 9.347 -5.599 8.593 272 HG23 THR 38 2HG2 THR 38 9.329 -5.700 10.354 273 H CYS 39 H CYS 39 9.678 -5.188 6.694 274 HA CYS 39 HA CYS 39 9.357 -2.269 6.569 275 HB2 CYS 39 1HB CYS 39 10.341 -3.323 4.446 276 HB3 CYS 39 2HB CYS 39 8.758 -4.057 4.219 277 HG CYS 39 HG CYS 39 9.770 -0.985 3.528 278 H ARG 40 H ARG 40 7.302 -1.521 6.770 279 HA ARG 40 HA ARG 40 5.029 -3.279 6.480 280 HB2 ARG 40 1HB ARG 40 4.314 -3.363 8.687 281 HB3 ARG 40 2HB ARG 40 6.052 -3.570 8.851 282 HG2 ARG 40 1HG ARG 40 6.289 -1.211 9.421 283 HG3 ARG 40 2HG ARG 40 4.547 -0.992 9.241 284 HD2 ARG 40 1HD ARG 40 5.389 -1.292 11.603 285 HD3 ARG 40 2HD ARG 40 4.084 -2.368 11.104 286 HE ARG 40 HE ARG 40 6.659 -3.527 10.685 287 HH11 ARG 40 1HH1 ARG 40 4.224 -2.887 13.089 288 HH12 ARG 40 2HH1 ARG 40 4.693 -4.210 14.105 289 HH21 ARG 40 1HH2 ARG 40 7.286 -5.272 12.013 290 HH22 ARG 40 2HH2 ARG 40 6.436 -5.565 13.492 291 H LEU 41 H LEU 41 2.960 -2.092 6.963 292 HA LEU 41 HA LEU 41 3.254 0.705 6.111 293 HB2 LEU 41 1HB LEU 41 1.233 -1.411 5.627 294 HB3 LEU 41 2HB LEU 41 0.659 0.253 5.717 295 HG LEU 41 HG LEU 41 2.920 -0.438 3.887 296 HD11 LEU 41 1HD1 LEU 41 1.108 -0.719 2.115 297 HD12 LEU 41 2HD1 LEU 41 0.009 -1.029 3.459 298 HD13 LEU 41 3HD1 LEU 41 1.401 -2.080 3.198 299 HD21 LEU 41 3HD2 LEU 41 2.391 1.900 4.220 300 HD22 LEU 41 1HD2 LEU 41 0.697 1.600 3.828 301 HD23 LEU 41 2HD2 LEU 41 1.936 1.409 2.587 302 H SER 42 H SER 42 1.641 2.252 6.940 303 HA SER 42 HA SER 42 1.517 2.121 9.794 304 HB2 SER 42 1HB SER 42 1.828 4.216 8.339 305 HB3 SER 42 2HB SER 42 0.084 4.151 8.084 306 HG SER 42 HG SER 42 1.158 4.064 10.686 307 H ASN 43 H ASN 43 -0.648 2.854 10.855 308 HA ASN 43 HA ASN 43 -2.448 0.748 10.727 309 HB2 ASN 43 1HB ASN 43 -4.012 2.316 11.965 310 HB3 ASN 43 2HB ASN 43 -2.422 2.096 12.689 311 HD21 ASN 43 1HD2 ASN 43 -4.645 4.297 11.341 312 HD22 ASN 43 2HD2 ASN 43 -3.680 5.722 11.491 313 H ASN 44 H ASN 44 -2.437 3.809 9.003 314 HA ASN 44 HA ASN 44 -4.921 3.037 7.634 315 HB2 ASN 44 1HB ASN 44 -4.501 5.365 8.811 316 HB3 ASN 44 2HB ASN 44 -3.680 5.737 7.298 317 HD21 ASN 44 1HD2 ASN 44 -4.889 6.632 5.806 318 HD22 ASN 44 2HD2 ASN 44 -6.601 6.470 5.645 319 H GLN 45 H GLN 45 -1.896 2.351 7.203 320 HA GLN 45 HA GLN 45 -0.458 2.035 5.457 321 HB2 GLN 45 1HB GLN 45 -2.858 1.882 3.666 322 HB3 GLN 45 2HB GLN 45 -1.391 0.913 3.636 323 HG2 GLN 45 1HG GLN 45 -3.288 0.753 5.942 324 HG3 GLN 45 2HG GLN 45 -3.576 -0.159 4.461 325 HE21 GLN 45 1HE2 GLN 45 -2.343 -1.925 4.008 326 HE22 GLN 45 2HE2 GLN 45 -1.181 -2.586 5.101 327 H ARG 46 H ARG 46 -0.466 4.632 5.957 328 HA ARG 46 HA ARG 46 -0.696 5.918 3.314 329 HB2 ARG 46 1HB ARG 46 -1.235 6.955 6.073 330 HB3 ARG 46 2HB ARG 46 -0.726 8.068 4.810 331 HG2 ARG 46 1HG ARG 46 -2.983 6.220 4.239 332 HG3 ARG 46 2HG ARG 46 -3.266 7.607 5.293 333 HD2 ARG 46 1HD ARG 46 -2.103 8.963 3.424 334 HD3 ARG 46 2HD ARG 46 -2.439 7.556 2.415 335 HE ARG 46 HE ARG 46 -4.655 8.141 2.391 336 HH11 ARG 46 1HH1 ARG 46 -3.020 9.927 4.892 337 HH12 ARG 46 2HH1 ARG 46 -4.372 10.958 5.222 338 HH21 ARG 46 1HH2 ARG 46 -6.443 9.492 2.816 339 HH22 ARG 46 2HH2 ARG 46 -6.320 10.709 4.041 340 H TYR 47 H TYR 47 1.453 4.691 5.470 341 HA TYR 47 HA TYR 47 3.656 6.117 4.265 342 HB2 TYR 47 1HB TYR 47 3.039 6.364 7.207 343 HB3 TYR 47 2HB TYR 47 4.649 6.643 6.553 344 HD1 TYR 47 2HD TYR 47 1.175 7.873 6.599 345 HD2 TYR 47 1HD TYR 47 5.172 8.652 5.365 346 HE1 TYR 47 2HE TYR 47 0.558 10.198 6.088 347 HE2 TYR 47 1HE TYR 47 4.566 10.980 4.852 348 HH TYR 47 HH TYR 47 2.936 12.482 4.765 349 H LEU 48 H LEU 48 5.622 5.027 4.440 350 HA LEU 48 HA LEU 48 5.405 2.298 5.524 351 HB2 LEU 48 1HB LEU 48 7.149 3.375 3.314 352 HB3 LEU 48 2HB LEU 48 7.196 1.721 3.920 353 HG LEU 48 HG LEU 48 4.738 2.944 2.683 354 HD11 LEU 48 1HD1 LEU 48 5.479 2.550 0.617 355 HD12 LEU 48 2HD1 LEU 48 6.198 1.007 1.074 356 HD13 LEU 48 3HD1 LEU 48 7.090 2.506 1.333 357 HD21 LEU 48 3HD2 LEU 48 4.630 0.889 4.194 358 HD22 LEU 48 1HD2 LEU 48 5.487 0.045 2.904 359 HD23 LEU 48 2HD2 LEU 48 3.903 0.756 2.591 360 H PHE 49 H PHE 49 7.029 1.461 6.798 361 HA PHE 49 HA PHE 49 9.191 3.301 7.571 362 HB2 PHE 49 1HB PHE 49 7.436 1.666 9.411 363 HB3 PHE 49 2HB PHE 49 8.926 2.452 9.921 364 HD1 PHE 49 2HD PHE 49 5.587 3.128 8.455 365 HD2 PHE 49 1HD PHE 49 8.921 4.679 10.599 366 HE1 PHE 49 2HE PHE 49 4.337 5.201 8.893 367 HE2 PHE 49 1HE PHE 49 7.676 6.754 11.041 368 HZ PHE 49 HZ PHE 49 5.381 7.018 10.187 369 H LEU 50 H LEU 50 11.123 2.318 8.293 370 HA LEU 50 HA LEU 50 11.363 -0.528 7.569 371 HB2 LEU 50 1HB LEU 50 13.591 1.483 7.437 372 HB3 LEU 50 2HB LEU 50 13.542 -0.135 6.741 373 HG LEU 50 HG LEU 50 11.728 2.071 5.798 374 HD11 LEU 50 1HD1 LEU 50 14.490 2.142 5.609 375 HD12 LEU 50 2HD1 LEU 50 13.343 3.038 4.615 376 HD13 LEU 50 3HD1 LEU 50 13.965 1.486 4.058 377 HD21 LEU 50 3HD2 LEU 50 12.320 0.373 3.718 378 HD22 LEU 50 1HD2 LEU 50 10.858 0.332 4.702 379 HD23 LEU 50 2HD2 LEU 50 12.220 -0.715 5.103 380 H ASP 51 H ASP 51 13.010 -1.743 8.717 381 HA ASP 51 HA ASP 51 13.759 -0.614 11.322 382 HB2 ASP 51 1HB ASP 51 11.655 -2.183 11.290 383 HB3 ASP 51 2HB ASP 51 12.856 -3.465 11.159 384 H GLY 52 H GLY 52 15.736 -1.227 12.089 385 HA2 GLY 52 1HA GLY 52 17.296 -3.339 11.825 386 HA3 GLY 52 2HA GLY 52 17.426 -2.684 10.199 387 H ASP 53 H ASP 53 19.505 -2.020 10.165 388 HA ASP 53 HA ASP 53 21.168 -1.097 12.040 389 HB2 ASP 53 1HB ASP 53 20.933 0.437 9.459 390 HB3 ASP 53 2HB ASP 53 22.386 0.062 10.381 391 H SER 54 H SER 54 18.518 0.751 10.644 392 HA SER 54 HA SER 54 18.574 2.552 12.913 393 HB2 SER 54 1HB SER 54 20.121 3.495 11.084 394 HB3 SER 54 2HB SER 54 18.645 3.787 10.164 395 HG SER 54 HG SER 54 18.716 4.670 12.807 396 H HIS 55 H HIS 55 16.727 4.214 12.664 397 HA HIS 55 HA HIS 55 14.375 2.731 11.750 398 HB2 HIS 55 1HB HIS 55 14.743 5.022 13.674 399 HB3 HIS 55 2HB HIS 55 13.153 4.533 13.096 400 HD2 HIS 55 2HD HIS 55 16.078 3.006 15.250 401 HE1 HIS 55 1HE HIS 55 12.478 0.925 16.091 402 HE2 HIS 55 2HE HIS 55 14.884 1.271 16.751 403 H TYR 56 H TYR 56 14.409 3.158 9.545 404 HA TYR 56 HA TYR 56 14.286 5.961 8.705 405 HB2 TYR 56 1HB TYR 56 14.917 3.387 7.329 406 HB3 TYR 56 2HB TYR 56 14.267 4.712 6.370 407 HD1 TYR 56 1HD TYR 56 15.547 6.772 6.062 408 HD2 TYR 56 2HD TYR 56 17.140 3.502 8.269 409 HE1 TYR 56 1HE TYR 56 17.791 7.766 5.904 410 HE2 TYR 56 2HE TYR 56 19.388 4.488 8.119 411 HH TYR 56 HH TYR 56 20.035 7.292 6.131 412 H GLU 57 H GLU 57 12.661 6.591 7.107 413 HA GLU 57 HA GLU 57 10.231 4.974 7.069 414 HB2 GLU 57 1HB GLU 57 9.501 6.218 8.841 415 HB3 GLU 57 2HB GLU 57 10.548 7.577 8.457 416 HG2 GLU 57 1HG GLU 57 9.054 8.216 6.634 417 HG3 GLU 57 2HG GLU 57 8.003 6.855 7.022 418 H ILE 58 H ILE 58 9.465 4.907 5.070 419 HA ILE 58 HA ILE 58 10.247 7.030 3.193 420 HB ILE 58 HB ILE 58 9.288 4.224 2.620 421 HG12 ILE 58 1HG1 ILE 58 12.018 5.356 2.047 422 HG13 ILE 58 2HG1 ILE 58 11.642 4.619 3.601 423 HG21 ILE 58 1HG2 ILE 58 10.575 5.741 0.477 424 HG22 ILE 58 2HG2 ILE 58 9.134 4.727 0.443 425 HG23 ILE 58 3HG2 ILE 58 9.022 6.399 0.992 426 HD11 ILE 58 3HD1 ILE 58 10.769 2.697 1.932 427 HD12 ILE 58 1HD1 ILE 58 12.081 3.384 0.975 428 HD13 ILE 58 2HD1 ILE 58 12.401 2.766 2.596 429 H GLU 59 H GLU 59 8.684 8.558 3.313 430 HA GLU 59 HA GLU 59 5.914 7.953 3.621 431 HB2 GLU 59 1HB GLU 59 5.664 10.423 2.980 432 HB3 GLU 59 2HB GLU 59 6.553 10.052 4.451 433 HG2 GLU 59 1HG GLU 59 8.071 10.341 1.913 434 HG3 GLU 59 2HG GLU 59 7.453 11.791 2.703 435 H ILE 60 H ILE 60 4.484 7.391 2.124 436 HA ILE 60 HA ILE 60 5.155 6.891 -0.542 437 HB ILE 60 HB ILE 60 2.366 7.384 0.499 438 HG12 ILE 60 1HG1 ILE 60 4.047 4.870 0.549 439 HG13 ILE 60 2HG1 ILE 60 3.464 5.772 1.944 440 HG21 ILE 60 1HG2 ILE 60 3.405 5.762 -1.820 441 HG22 ILE 60 2HG2 ILE 60 1.726 5.809 -1.285 442 HG23 ILE 60 3HG2 ILE 60 2.492 7.268 -1.914 443 HD11 ILE 60 3HD1 ILE 60 2.107 3.838 1.686 444 HD12 ILE 60 1HD1 ILE 60 1.142 5.239 1.221 445 HD13 ILE 60 2HD1 ILE 60 1.830 4.190 -0.019 446 H VAL 61 H VAL 61 3.869 9.747 1.004 447 HA VAL 61 HA VAL 61 2.852 11.130 -1.179 448 HB VAL 61 HB VAL 61 3.565 13.218 0.104 449 HG11 VAL 61 1HG1 VAL 61 2.069 12.225 2.168 450 HG12 VAL 61 2HG1 VAL 61 1.422 12.863 0.654 451 HG13 VAL 61 3HG1 VAL 61 1.663 11.126 0.850 452 HG21 VAL 61 3HG2 VAL 61 5.348 11.560 1.306 453 HG22 VAL 61 1HG2 VAL 61 4.804 13.098 1.977 454 HG23 VAL 61 2HG2 VAL 61 4.051 11.591 2.501 455 H HIS 62 H HIS 62 6.145 10.484 -0.284 456 HA HIS 62 HA HIS 62 7.198 12.432 -2.176 457 HB2 HIS 62 1HB HIS 62 8.397 10.642 -0.095 458 HB3 HIS 62 2HB HIS 62 9.420 11.278 -1.381 459 HD2 HIS 62 2HD HIS 62 6.815 13.071 1.025 460 HE1 HIS 62 1HE HIS 62 10.412 15.314 0.849 461 HE2 HIS 62 2HE HIS 62 8.123 15.131 1.883 462 H ILE 63 H ILE 63 7.181 8.913 -1.698 463 HA ILE 63 HA ILE 63 8.694 7.968 -3.710 464 HB ILE 63 HB ILE 63 5.903 6.964 -3.138 465 HG12 ILE 63 1HG1 ILE 63 8.562 6.350 -1.837 466 HG13 ILE 63 2HG1 ILE 63 7.150 7.076 -1.077 467 HG21 ILE 63 1HG2 ILE 63 7.908 6.115 -4.987 468 HG22 ILE 63 2HG2 ILE 63 7.684 4.872 -3.758 469 HG23 ILE 63 3HG2 ILE 63 6.305 5.440 -4.699 470 HD11 ILE 63 3HD1 ILE 63 7.718 4.251 -1.725 471 HD12 ILE 63 1HD1 ILE 63 6.901 4.958 -0.332 472 HD13 ILE 63 2HD1 ILE 63 6.047 4.794 -1.867 473 H SER 64 H SER 64 8.706 7.865 -5.890 474 HA SER 64 HA SER 64 6.507 9.228 -7.300 475 HB2 SER 64 1HB SER 64 8.903 10.214 -7.321 476 HB3 SER 64 2HB SER 64 9.276 8.895 -8.430 477 HG SER 64 HG SER 64 8.379 11.128 -9.172 478 H THR 65 H THR 65 9.020 6.760 -7.860 479 HA THR 65 HA THR 65 7.168 5.396 -9.693 480 HB THR 65 HB THR 65 10.173 5.204 -9.441 481 HG1 THR 65 1HG THR 65 10.025 6.032 -11.612 482 HG21 THR 65 3HG2 THR 65 8.209 3.559 -11.008 483 HG22 THR 65 1HG2 THR 65 9.551 3.017 -10.001 484 HG23 THR 65 2HG2 THR 65 9.870 3.775 -11.562 485 H VAL 66 H VAL 66 6.599 3.282 -9.395 486 HA VAL 66 HA VAL 66 7.777 1.802 -7.163 487 HB VAL 66 HB VAL 66 4.858 2.489 -7.422 488 HG11 VAL 66 1HG1 VAL 66 6.128 0.164 -6.007 489 HG12 VAL 66 2HG1 VAL 66 4.574 0.833 -5.503 490 HG13 VAL 66 3HG1 VAL 66 4.764 0.162 -7.124 491 HG21 VAL 66 3HG2 VAL 66 5.874 2.494 -4.761 492 HG22 VAL 66 1HG2 VAL 66 6.987 3.395 -5.792 493 HG23 VAL 66 2HG2 VAL 66 5.285 3.851 -5.721 494 H GLN 67 H GLN 67 8.566 0.105 -8.256 495 HA GLN 67 HA GLN 67 6.670 -1.493 -9.825 496 HB2 GLN 67 1HB GLN 67 8.129 -1.779 -11.631 497 HB3 GLN 67 2HB GLN 67 8.265 -0.067 -11.254 498 HG2 GLN 67 1HG GLN 67 10.351 -0.405 -10.144 499 HG3 GLN 67 2HG GLN 67 10.186 -2.156 -10.263 500 HE21 GLN 67 1HE2 GLN 67 12.097 -2.415 -11.379 501 HE22 GLN 67 2HE2 GLN 67 12.295 -1.916 -13.021 502 H ILE 68 H ILE 68 6.972 -3.712 -9.737 503 HA ILE 68 HA ILE 68 8.520 -4.635 -7.466 504 HB ILE 68 HB ILE 68 6.694 -6.167 -9.321 505 HG12 ILE 68 1HG1 ILE 68 6.238 -5.041 -6.549 506 HG13 ILE 68 2HG1 ILE 68 5.498 -4.465 -8.039 507 HG21 ILE 68 1HG2 ILE 68 6.984 -7.398 -6.782 508 HG22 ILE 68 2HG2 ILE 68 7.446 -8.021 -8.365 509 HG23 ILE 68 3HG2 ILE 68 8.596 -7.076 -7.420 510 HD11 ILE 68 3HD1 ILE 68 4.562 -6.443 -6.268 511 HD12 ILE 68 1HD1 ILE 68 3.841 -5.898 -7.782 512 HD13 ILE 68 2HD1 ILE 68 4.977 -7.247 -7.782 513 H LEU 69 H LEU 69 10.243 -6.020 -7.525 514 HA LEU 69 HA LEU 69 11.648 -6.194 -10.063 515 HB2 LEU 69 1HB LEU 69 12.447 -6.896 -7.246 516 HB3 LEU 69 2HB LEU 69 13.492 -7.119 -8.647 517 HG LEU 69 HG LEU 69 12.454 -4.487 -7.597 518 HD11 LEU 69 1HD1 LEU 69 15.285 -5.501 -7.681 519 HD12 LEU 69 2HD1 LEU 69 14.242 -5.653 -6.267 520 HD13 LEU 69 3HD1 LEU 69 14.670 -4.055 -6.880 521 HD21 LEU 69 3HD2 LEU 69 12.630 -4.235 -9.930 522 HD22 LEU 69 1HD2 LEU 69 14.107 -5.197 -10.005 523 HD23 LEU 69 2HD2 LEU 69 14.137 -3.590 -9.277 524 H THR 70 H THR 70 10.983 -7.816 -11.332 525 HA THR 70 HA THR 70 10.464 -10.443 -10.125 526 HB THR 70 HB THR 70 9.268 -11.033 -12.121 527 HG1 THR 70 1HG THR 70 9.577 -10.024 -13.967 528 HG21 THR 70 3HG2 THR 70 8.618 -8.281 -11.088 529 HG22 THR 70 1HG2 THR 70 7.883 -9.818 -10.638 530 HG23 THR 70 2HG2 THR 70 7.582 -9.131 -12.234 531 H GLU 71 H GLU 71 11.249 -12.357 -11.254 532 HA GLU 71 HA GLU 71 13.928 -11.893 -12.358 533 HB2 GLU 71 1HB GLU 71 13.490 -13.385 -10.302 534 HB3 GLU 71 2HB GLU 71 12.852 -14.552 -11.452 535 HG2 GLU 71 1HG GLU 71 14.906 -14.952 -12.399 536 HG3 GLU 71 2HG GLU 71 15.560 -13.394 -11.898 537 H GLY 72 H GLY 72 13.739 -11.653 -14.520 538 HA2 GLY 72 1HA GLY 72 13.625 -12.448 -16.693 539 HA3 GLY 72 2HA GLY 72 12.999 -13.967 -16.069 540 H PHE 73 H PHE 73 12.260 -11.230 -17.816 541 HA PHE 73 HA PHE 73 9.755 -10.411 -17.260 542 HB2 PHE 73 1HB PHE 73 9.578 -9.710 -19.445 543 HB3 PHE 73 2HB PHE 73 11.310 -10.018 -19.362 544 HD1 PHE 73 1HD PHE 73 12.156 -12.273 -20.183 545 HD2 PHE 73 2HD PHE 73 8.251 -10.797 -21.015 546 HE1 PHE 73 1HE PHE 73 11.969 -13.841 -22.070 547 HE2 PHE 73 2HE PHE 73 8.057 -12.363 -22.903 548 HZ PHE 73 HZ PHE 73 9.917 -13.888 -23.432 549 HA PRO 74 HA PRO 74 7.253 -14.066 -17.145 550 HB2 PRO 74 1HB PRO 74 4.853 -12.810 -16.962 551 HB3 PRO 74 2HB PRO 74 5.974 -12.943 -15.601 552 HG2 PRO 74 1HG PRO 74 5.516 -10.641 -17.460 553 HG3 PRO 74 2HG PRO 74 5.729 -10.633 -15.699 554 HD2 PRO 74 1HD PRO 74 7.730 -10.004 -17.411 555 HD3 PRO 74 2HD PRO 74 8.023 -10.795 -15.849 556 HA PRO 75 HA PRO 75 5.979 -14.644 -21.332 557 HB2 PRO 75 1HB PRO 75 4.323 -16.766 -20.979 558 HB3 PRO 75 2HB PRO 75 6.083 -16.897 -20.893 559 HG2 PRO 75 1HG PRO 75 4.088 -16.689 -18.671 560 HG3 PRO 75 2HG PRO 75 5.511 -17.740 -18.802 561 HD2 PRO 75 1HD PRO 75 5.513 -15.459 -17.342 562 HD3 PRO 75 2HD PRO 75 6.962 -16.064 -18.171 563 H GLY 76 H GLY 76 3.324 -14.968 -18.959 564 HA2 GLY 76 1HA GLY 76 1.686 -12.996 -19.277 565 HA3 GLY 76 2HA GLY 76 1.535 -13.662 -20.896 566 H GLY 77 H GLY 77 0.219 -13.640 -17.846 567 HA2 GLY 77 1HA GLY 77 -1.852 -15.403 -18.434 568 HA3 GLY 77 2HA GLY 77 -0.638 -16.326 -17.561 569 H GLY 78 H GLY 78 -2.287 -16.617 -15.926 570 HA2 GLY 78 1HA GLY 78 -3.155 -14.280 -14.446 571 HA3 GLY 78 2HA GLY 78 -3.564 -15.952 -14.093 572 H ASN 79 H ASN 79 -1.733 -17.298 -13.220 573 HA ASN 79 HA ASN 79 -0.872 -16.515 -10.802 574 HB2 ASN 79 1HB ASN 79 0.306 -18.381 -12.811 575 HB3 ASN 79 2HB ASN 79 1.251 -18.007 -11.372 576 HD21 ASN 79 1HD2 ASN 79 -0.131 -20.474 -12.323 577 HD22 ASN 79 2HD2 ASN 79 -1.124 -20.961 -10.997 578 H ALA 80 H ALA 80 1.170 -15.784 -9.921 579 HA ALA 80 HA ALA 80 3.168 -14.571 -11.522 580 HB1 ALA 80 1HB ALA 80 2.633 -12.372 -11.578 581 HB2 ALA 80 2HB ALA 80 0.992 -13.019 -11.540 582 HB3 ALA 80 3HB ALA 80 1.744 -12.435 -10.055 583 H ARG 81 H ARG 81 4.961 -14.032 -10.330 584 HA ARG 81 HA ARG 81 4.707 -14.207 -7.401 585 HB2 ARG 81 1HB ARG 81 6.636 -15.561 -7.234 586 HB3 ARG 81 2HB ARG 81 5.671 -16.280 -8.516 587 HG2 ARG 81 1HG ARG 81 7.856 -14.330 -9.137 588 HG3 ARG 81 2HG ARG 81 8.198 -16.041 -8.871 589 HD2 ARG 81 1HD ARG 81 7.900 -16.022 -11.143 590 HD3 ARG 81 2HD ARG 81 6.258 -16.372 -10.605 591 HE ARG 81 HE ARG 81 6.784 -13.568 -10.923 592 HH11 ARG 81 1HH1 ARG 81 5.830 -16.497 -12.545 593 HH12 ARG 81 2HH1 ARG 81 4.989 -15.673 -13.817 594 HH21 ARG 81 1HH2 ARG 81 5.680 -12.472 -12.592 595 HH22 ARG 81 2HH2 ARG 81 4.906 -13.384 -13.843 596 H ALA 82 H ALA 82 7.149 -13.613 -6.552 597 HA ALA 82 HA ALA 82 8.371 -11.442 -7.962 598 HB1 ALA 82 1HB ALA 82 6.394 -10.279 -7.153 599 HB2 ALA 82 2HB ALA 82 6.755 -10.785 -5.502 600 HB3 ALA 82 3HB ALA 82 7.843 -9.681 -6.344 601 H THR 83 H THR 83 10.448 -11.365 -7.395 602 HA THR 83 HA THR 83 11.237 -12.632 -4.857 603 HB THR 83 HB THR 83 13.461 -12.970 -5.905 604 HG1 THR 83 1HG THR 83 13.334 -12.749 -8.331 605 HG21 THR 83 3HG2 THR 83 12.368 -14.495 -7.861 606 HG22 THR 83 1HG2 THR 83 10.957 -14.206 -6.845 607 HG23 THR 83 2HG2 THR 83 12.401 -14.949 -6.158 608 H GLY 84 H GLY 84 10.496 -9.732 -5.591 609 HA2 GLY 84 1HA GLY 84 12.093 -8.421 -3.747 610 HA3 GLY 84 2HA GLY 84 12.872 -8.193 -5.305 611 H MET 85 H MET 85 12.229 -5.925 -4.274 612 HA MET 85 HA MET 85 9.927 -5.045 -5.833 613 HB2 MET 85 1HB MET 85 8.759 -5.195 -3.845 614 HB3 MET 85 2HB MET 85 10.175 -4.845 -2.863 615 HG2 MET 85 1HG MET 85 10.061 -2.525 -3.392 616 HG3 MET 85 2HG MET 85 8.809 -2.808 -4.599 617 HE1 MET 85 3HE MET 85 5.995 -2.361 -3.660 618 HE2 MET 85 1HE MET 85 6.714 -3.890 -4.167 619 HE3 MET 85 2HE MET 85 5.762 -3.811 -2.684 620 H PHE 86 H PHE 86 10.010 -2.871 -6.460 621 HA PHE 86 HA PHE 86 12.512 -1.461 -5.811 622 HB2 PHE 86 1HB PHE 86 12.326 -2.565 -8.159 623 HB3 PHE 86 2HB PHE 86 11.226 -1.239 -8.517 624 HD1 PHE 86 2HD PHE 86 14.398 -1.354 -6.566 625 HD2 PHE 86 1HD PHE 86 12.314 0.215 -9.929 626 HE1 PHE 86 2HE PHE 86 16.319 0.096 -7.075 627 HE2 PHE 86 1HE PHE 86 14.232 1.668 -10.444 628 HZ PHE 86 HZ PHE 86 16.238 1.610 -9.015 629 H LEU 87 H LEU 87 12.282 0.587 -5.168 630 HA LEU 87 HA LEU 87 9.881 2.081 -5.899 631 HB2 LEU 87 1HB LEU 87 10.796 1.974 -3.041 632 HB3 LEU 87 2HB LEU 87 9.305 2.659 -3.685 633 HG LEU 87 HG LEU 87 9.889 -0.289 -3.784 634 HD11 LEU 87 1HD1 LEU 87 7.995 0.471 -1.756 635 HD12 LEU 87 2HD1 LEU 87 9.569 1.201 -1.448 636 HD13 LEU 87 3HD1 LEU 87 9.430 -0.547 -1.630 637 HD21 LEU 87 3HD2 LEU 87 7.701 -0.548 -4.404 638 HD22 LEU 87 1HD2 LEU 87 8.055 1.009 -5.153 639 HD23 LEU 87 2HD2 LEU 87 7.185 0.945 -3.619 640 H GLN 88 H GLN 88 10.201 4.250 -6.103 641 HA GLN 88 HA GLN 88 12.897 5.248 -5.454 642 HB2 GLN 88 1HB GLN 88 11.116 5.976 -7.785 643 HB3 GLN 88 2HB GLN 88 12.626 6.788 -7.394 644 HG2 GLN 88 1HG GLN 88 13.900 4.861 -7.884 645 HG3 GLN 88 2HG GLN 88 12.463 3.842 -7.948 646 HE21 GLN 88 1HE2 GLN 88 13.964 6.640 -9.507 647 HE22 GLN 88 2HE2 GLN 88 13.384 6.288 -11.096 648 H TYR 89 H TYR 89 13.093 7.283 -4.566 649 HA TYR 89 HA TYR 89 10.751 8.944 -4.188 650 HB2 TYR 89 1HB TYR 89 11.084 9.011 -1.696 651 HB3 TYR 89 2HB TYR 89 10.451 7.488 -2.311 652 HD1 TYR 89 1HD TYR 89 13.485 9.164 -1.022 653 HD2 TYR 89 2HD TYR 89 11.650 5.458 -2.023 654 HE1 TYR 89 1HE TYR 89 15.316 7.961 0.096 655 HE2 TYR 89 2HE TYR 89 13.476 4.245 -0.907 656 HH TYR 89 HH TYR 89 15.190 4.541 0.666 657 H THR 90 H THR 90 11.298 11.004 -3.100 658 HA THR 90 HA THR 90 14.098 11.747 -3.643 659 HB THR 90 HB THR 90 13.212 14.085 -3.918 660 HG1 THR 90 1HG THR 90 10.675 12.828 -4.166 661 HG21 THR 90 3HG2 THR 90 12.937 13.776 -6.153 662 HG22 THR 90 1HG2 THR 90 11.768 12.473 -5.941 663 HG23 THR 90 2HG2 THR 90 13.492 12.151 -5.752 664 H VAL 91 H VAL 91 15.290 12.578 -2.040 665 HA VAL 91 HA VAL 91 14.114 12.773 0.603 666 HB VAL 91 HB VAL 91 16.986 13.243 -0.203 667 HG11 VAL 91 1HG1 VAL 91 17.519 12.957 2.096 668 HG12 VAL 91 2HG1 VAL 91 16.198 14.124 2.017 669 HG13 VAL 91 3HG1 VAL 91 15.874 12.453 2.482 670 HG21 VAL 91 3HG2 VAL 91 15.795 10.699 0.887 671 HG22 VAL 91 1HG2 VAL 91 16.091 10.983 -0.828 672 HG23 VAL 91 2HG2 VAL 91 17.440 10.960 0.308 673 HA PRO 92 HA PRO 92 13.560 17.152 0.490 674 HB2 PRO 92 1HB PRO 92 13.347 17.572 3.164 675 HB3 PRO 92 2HB PRO 92 12.057 16.844 2.201 676 HG2 PRO 92 1HG PRO 92 14.104 15.518 3.936 677 HG3 PRO 92 2HG PRO 92 12.371 15.173 3.787 678 HD2 PRO 92 1HD PRO 92 14.265 13.682 2.554 679 HD3 PRO 92 2HD PRO 92 12.654 13.945 1.857 680 H GLY 93 H GLY 93 15.756 17.531 -0.292 681 HA2 GLY 93 1HA GLY 93 17.279 19.391 0.521 682 HA3 GLY 93 2HA GLY 93 17.630 18.302 1.855 683 H THR 94 H THR 94 17.135 16.657 -1.053 684 HA THR 94 HA THR 94 20.046 16.480 -1.493 685 HB THR 94 HB THR 94 18.838 14.413 -0.545 686 HG1 THR 94 1HG THR 94 20.101 13.062 -2.033 687 HG21 THR 94 3HG2 THR 94 16.917 14.608 -2.154 688 HG22 THR 94 1HG2 THR 94 17.665 13.012 -2.087 689 HG23 THR 94 2HG2 THR 94 18.020 14.097 -3.432 690 H GLU 95 H GLU 95 20.594 15.665 -3.736 691 HA GLU 95 HA GLU 95 18.857 17.020 -5.687 692 HB2 GLU 95 1HB GLU 95 21.822 16.453 -5.849 693 HB3 GLU 95 2HB GLU 95 20.872 17.285 -7.072 694 HG2 GLU 95 1HG GLU 95 20.283 18.862 -5.043 695 HG3 GLU 95 2HG GLU 95 21.809 18.236 -4.423 696 H GLY 96 H GLY 96 17.677 15.660 -6.855 697 HA2 GLY 96 1HA GLY 96 17.664 14.041 -8.653 698 HA3 GLY 96 2HA GLY 96 18.965 13.193 -7.830 699 H VAL 97 H VAL 97 17.520 11.328 -8.199 700 HA VAL 97 HA VAL 97 15.481 11.142 -6.076 701 HB VAL 97 HB VAL 97 15.470 9.579 -8.658 702 HG11 VAL 97 1HG1 VAL 97 14.184 9.112 -6.252 703 HG12 VAL 97 2HG1 VAL 97 12.959 9.901 -7.246 704 HG13 VAL 97 3HG1 VAL 97 13.752 8.434 -7.821 705 HG21 VAL 97 3HG2 VAL 97 14.891 11.568 -9.560 706 HG22 VAL 97 1HG2 VAL 97 13.320 11.189 -8.853 707 HG23 VAL 97 2HG2 VAL 97 14.433 12.261 -8.004 708 H THR 98 H THR 98 15.479 9.349 -4.780 709 HA THR 98 HA THR 98 17.856 7.640 -4.976 710 HB THR 98 HB THR 98 16.004 8.161 -2.643 711 HG1 THR 98 1HG THR 98 18.535 9.103 -3.430 712 HG21 THR 98 3HG2 THR 98 16.742 5.931 -2.377 713 HG22 THR 98 1HG2 THR 98 17.813 6.905 -1.370 714 HG23 THR 98 2HG2 THR 98 18.368 6.320 -2.939 715 H GLN 99 H GLN 99 17.716 5.512 -5.362 716 HA GLN 99 HA GLN 99 15.023 4.346 -5.574 717 HB2 GLN 99 1HB GLN 99 16.023 2.732 -7.142 718 HB3 GLN 99 2HB GLN 99 16.224 4.391 -7.688 719 HG2 GLN 99 1HG GLN 99 18.533 4.227 -6.522 720 HG3 GLN 99 2HG GLN 99 18.266 2.488 -6.634 721 HE21 GLN 99 1HE2 GLN 99 19.550 1.808 -8.206 722 HE22 GLN 99 2HE2 GLN 99 19.632 2.473 -9.798 723 H LEU 100 H LEU 100 14.525 2.457 -4.552 724 HA LEU 100 HA LEU 100 16.604 1.329 -2.793 725 HB2 LEU 100 1HB LEU 100 14.626 2.618 -1.764 726 HB3 LEU 100 2HB LEU 100 13.666 1.207 -2.205 727 HG LEU 100 HG LEU 100 15.443 -0.108 -0.838 728 HD11 LEU 100 1HD1 LEU 100 17.003 1.047 0.228 729 HD12 LEU 100 2HD1 LEU 100 15.769 2.011 1.039 730 HD13 LEU 100 3HD1 LEU 100 16.405 2.527 -0.522 731 HD21 LEU 100 3HD2 LEU 100 13.152 1.533 0.115 732 HD22 LEU 100 1HD2 LEU 100 14.152 0.706 1.310 733 HD23 LEU 100 2HD2 LEU 100 13.339 -0.220 0.048 734 H LYS 101 H LYS 101 16.763 -0.882 -2.619 735 HA LYS 101 HA LYS 101 15.064 -2.452 -4.446 736 HB2 LYS 101 1HB LYS 101 17.621 -2.043 -4.965 737 HB3 LYS 101 2HB LYS 101 17.844 -3.329 -3.787 738 HG2 LYS 101 1HG LYS 101 16.082 -4.581 -5.252 739 HG3 LYS 101 2HG LYS 101 16.591 -3.428 -6.488 740 HD2 LYS 101 1HD LYS 101 18.093 -5.098 -6.895 741 HD3 LYS 101 2HD LYS 101 18.998 -4.191 -5.681 742 HE2 LYS 101 1HE LYS 101 17.145 -6.370 -4.822 743 HE3 LYS 101 2HE LYS 101 18.730 -6.784 -5.473 744 HZ1 LYS 101 3HZ LYS 101 19.631 -5.156 -3.775 745 HZ2 LYS 101 1HZ LYS 101 19.028 -6.619 -3.175 746 HZ3 LYS 101 2HZ LYS 101 18.103 -5.208 -3.050 747 H LEU 102 H LEU 102 14.073 -4.192 -3.617 748 HA LEU 102 HA LEU 102 14.921 -5.129 -0.956 749 HB2 LEU 102 1HB LEU 102 12.101 -4.886 -1.993 750 HB3 LEU 102 2HB LEU 102 12.567 -5.561 -0.433 751 HG LEU 102 HG LEU 102 13.122 -2.706 -1.214 752 HD11 LEU 102 1HD1 LEU 102 10.904 -2.415 -1.134 753 HD12 LEU 102 2HD1 LEU 102 11.104 -2.591 0.609 754 HD13 LEU 102 3HD1 LEU 102 10.625 -3.979 -0.367 755 HD21 LEU 102 3HD2 LEU 102 13.021 -4.112 1.453 756 HD22 LEU 102 1HD2 LEU 102 13.355 -2.399 1.194 757 HD23 LEU 102 2HD2 LEU 102 14.483 -3.617 0.599 758 H THR 103 H THR 103 14.932 -7.313 -0.602 759 HA THR 103 HA THR 103 13.998 -9.067 -2.762 760 HB THR 103 HB THR 103 16.722 -9.310 -1.471 761 HG1 THR 103 1HG THR 103 16.449 -7.598 -3.085 762 HG21 THR 103 3HG2 THR 103 15.235 -10.975 -3.484 763 HG22 THR 103 1HG2 THR 103 16.012 -11.491 -1.988 764 HG23 THR 103 2HG2 THR 103 16.994 -11.007 -3.370 765 H VAL 104 H VAL 104 13.748 -11.311 -2.109 766 HA VAL 104 HA VAL 104 12.824 -11.496 0.643 767 HB VAL 104 HB VAL 104 12.591 -13.499 -1.607 768 HG11 VAL 104 1HG1 VAL 104 12.229 -13.831 1.156 769 HG12 VAL 104 2HG1 VAL 104 10.612 -13.741 0.454 770 HG13 VAL 104 3HG1 VAL 104 11.765 -14.940 -0.134 771 HG21 VAL 104 3HG2 VAL 104 11.059 -11.111 -0.903 772 HG22 VAL 104 1HG2 VAL 104 11.102 -12.030 -2.408 773 HG23 VAL 104 2HG2 VAL 104 10.074 -12.563 -1.079 774 H VAL 105 H VAL 105 13.708 -12.740 2.205 775 HA VAL 105 HA VAL 105 16.151 -14.234 1.503 776 HB VAL 105 HB VAL 105 16.778 -13.883 3.935 777 HG11 VAL 105 1HG1 VAL 105 16.548 -11.321 2.376 778 HG12 VAL 105 2HG1 VAL 105 17.816 -11.804 3.504 779 HG13 VAL 105 3HG1 VAL 105 17.672 -12.608 1.941 780 HG21 VAL 105 3HG2 VAL 105 14.605 -13.271 4.807 781 HG22 VAL 105 1HG2 VAL 105 15.737 -11.941 5.050 782 HG23 VAL 105 2HG2 VAL 105 14.547 -11.860 3.751 783 H GLU 106 H GLU 106 16.310 -16.328 2.072 784 HA GLU 106 HA GLU 106 14.142 -17.455 3.721 785 HB2 GLU 106 1HB GLU 106 14.300 -19.506 2.394 786 HB3 GLU 106 2HB GLU 106 13.914 -18.124 1.378 787 HG2 GLU 106 1HG GLU 106 16.464 -18.021 0.963 788 HG3 GLU 106 2HG GLU 106 16.457 -19.679 1.561 789 H ASP 107 H ASP 107 17.545 -17.374 3.007 790 HA ASP 107 HA ASP 107 18.357 -19.599 4.542 791 HB2 ASP 107 1HB ASP 107 20.061 -17.148 4.193 792 HB3 ASP 107 2HB ASP 107 20.552 -18.839 4.237 793 H VAL 108 H VAL 108 18.880 -16.170 5.370 794 HA VAL 108 HA VAL 108 19.407 -16.611 8.076 795 HB VAL 108 HB VAL 108 20.024 -14.520 7.064 796 HG11 VAL 108 1HG1 VAL 108 17.206 -13.568 6.919 797 HG12 VAL 108 2HG1 VAL 108 18.620 -13.056 5.996 798 HG13 VAL 108 3HG1 VAL 108 17.827 -14.587 5.621 799 HG21 VAL 108 3HG2 VAL 108 18.581 -14.727 9.500 800 HG22 VAL 108 1HG2 VAL 108 19.866 -13.597 9.076 801 HG23 VAL 108 2HG2 VAL 108 18.182 -13.178 8.759 802 H THR 109 H THR 109 16.384 -15.528 6.533 803 HA THR 109 HA THR 109 14.911 -16.662 8.808 804 HB THR 109 HB THR 109 13.308 -14.731 8.656 805 HG1 THR 109 1HG THR 109 14.111 -12.835 7.640 806 HG21 THR 109 3HG2 THR 109 16.084 -14.588 9.678 807 HG22 THR 109 1HG2 THR 109 14.552 -14.467 10.542 808 HG23 THR 109 2HG2 THR 109 15.171 -13.080 9.646 809 H VAL 110 H VAL 110 13.109 -17.774 8.276 810 HA VAL 110 HA VAL 110 12.559 -18.147 5.445 811 HB VAL 110 HB VAL 110 10.942 -19.910 6.332 812 HG11 VAL 110 1HG1 VAL 110 13.906 -19.946 6.514 813 HG12 VAL 110 2HG1 VAL 110 13.021 -21.329 7.162 814 HG13 VAL 110 3HG1 VAL 110 12.824 -20.868 5.470 815 HG21 VAL 110 3HG2 VAL 110 10.841 -20.444 8.548 816 HG22 VAL 110 1HG2 VAL 110 12.471 -19.857 8.877 817 HG23 VAL 110 2HG2 VAL 110 11.143 -18.712 8.689 818 H GLY 111 H GLY 111 10.423 -18.044 4.559 819 HA2 GLY 111 1HA GLY 111 8.036 -17.414 5.456 820 HA3 GLY 111 2HA GLY 111 8.852 -15.889 5.771 821 H ARG 112 H ARG 112 9.274 -18.070 3.014 822 HA ARG 112 HA ARG 112 9.399 -16.126 1.071 823 HB2 ARG 112 1HB ARG 112 9.956 -18.519 0.732 824 HB3 ARG 112 2HB ARG 112 8.239 -18.897 0.736 825 HG2 ARG 112 1HG ARG 112 9.371 -18.708 -1.521 826 HG3 ARG 112 2HG ARG 112 7.878 -17.793 -1.301 827 HD2 ARG 112 1HD ARG 112 9.026 -15.756 -1.102 828 HD3 ARG 112 2HD ARG 112 10.571 -16.558 -0.820 829 HE ARG 112 HE ARG 112 9.349 -15.987 -3.361 830 HH11 ARG 112 1HH1 ARG 112 11.622 -17.998 -1.654 831 HH12 ARG 112 2HH1 ARG 112 12.538 -18.389 -3.071 832 HH21 ARG 112 1HH2 ARG 112 10.548 -16.496 -5.234 833 HH22 ARG 112 2HH2 ARG 112 11.928 -17.534 -5.106 834 H ARG 113 H ARG 113 6.521 -18.150 1.682 835 HA ARG 113 HA ARG 113 4.715 -16.876 0.081 836 HB2 ARG 113 1HB ARG 113 4.488 -18.362 2.648 837 HB3 ARG 113 2HB ARG 113 3.079 -17.458 2.112 838 HG2 ARG 113 1HG ARG 113 2.651 -19.476 1.150 839 HG3 ARG 113 2HG ARG 113 3.551 -18.702 -0.155 840 HD2 ARG 113 1HD ARG 113 5.606 -19.776 1.119 841 HD3 ARG 113 2HD ARG 113 4.363 -20.891 1.685 842 HE ARG 113 HE ARG 113 4.369 -21.844 -0.383 843 HH11 ARG 113 1HH1 ARG 113 5.676 -18.628 -0.645 844 HH12 ARG 113 2HH1 ARG 113 6.085 -18.790 -2.321 845 HH21 ARG 113 1HH2 ARG 113 4.901 -22.069 -2.590 846 HH22 ARG 113 2HH2 ARG 113 5.642 -20.747 -3.427 847 H GLN 114 H GLN 114 5.242 -16.104 3.526 848 HA GLN 114 HA GLN 114 3.565 -13.978 3.824 849 HB2 GLN 114 1HB GLN 114 4.979 -14.941 5.618 850 HB3 GLN 114 2HB GLN 114 6.376 -14.130 4.924 851 HG2 GLN 114 1HG GLN 114 5.151 -13.063 6.930 852 HG3 GLN 114 2HG GLN 114 5.669 -12.044 5.588 853 HE21 GLN 114 1HE2 GLN 114 3.124 -12.889 7.564 854 HE22 GLN 114 2HE2 GLN 114 1.834 -12.188 6.654 855 H ALA 115 H ALA 115 6.998 -13.652 2.902 856 HA ALA 115 HA ALA 115 6.932 -10.931 2.311 857 HB1 ALA 115 1HB ALA 115 9.088 -11.577 2.356 858 HB2 ALA 115 2HB ALA 115 8.733 -13.181 1.711 859 HB3 ALA 115 3HB ALA 115 8.850 -11.798 0.622 860 H VAL 116 H VAL 116 6.871 -13.619 -0.042 861 HA VAL 116 HA VAL 116 6.440 -12.250 -2.353 862 HB VAL 116 HB VAL 116 5.152 -14.856 -1.533 863 HG11 VAL 116 1HG1 VAL 116 5.291 -15.065 -4.183 864 HG12 VAL 116 2HG1 VAL 116 3.877 -14.403 -3.360 865 HG13 VAL 116 3HG1 VAL 116 5.077 -13.319 -4.066 866 HG21 VAL 116 3HG2 VAL 116 7.812 -14.251 -1.922 867 HG22 VAL 116 1HG2 VAL 116 7.091 -15.859 -2.003 868 HG23 VAL 116 2HG2 VAL 116 7.317 -14.919 -3.478 869 H ALA 117 H ALA 117 4.110 -12.888 0.187 870 HA ALA 117 HA ALA 117 1.833 -12.000 -1.307 871 HB1 ALA 117 1HB ALA 117 2.366 -12.954 1.420 872 HB2 ALA 117 2HB ALA 117 1.035 -11.805 1.273 873 HB3 ALA 117 3HB ALA 117 1.018 -13.299 0.336 874 H TRP 118 H TRP 118 3.939 -10.554 1.151 875 HA TRP 118 HA TRP 118 2.550 -8.124 1.412 876 HB2 TRP 118 1HB TRP 118 4.311 -8.965 2.977 877 HB3 TRP 118 2HB TRP 118 5.522 -8.564 1.762 878 HD1 TRP 118 HD TRP 118 3.460 -7.038 4.512 879 HE1 TRP 118 1HE TRP 118 4.032 -4.539 4.733 880 HE3 TRP 118 3HE TRP 118 6.236 -6.461 0.258 881 HZ2 TRP 118 2HZ TRP 118 5.469 -2.581 3.295 882 HZ3 TRP 118 3HZ TRP 118 7.173 -4.242 -0.247 883 HH2 TRP 118 HH TRP 118 6.796 -2.344 1.241 884 H LEU 119 H LEU 119 5.131 -9.139 -0.775 885 HA LEU 119 HA LEU 119 5.699 -6.647 -1.917 886 HB2 LEU 119 1HB LEU 119 5.864 -9.423 -3.073 887 HB3 LEU 119 2HB LEU 119 6.503 -7.987 -3.871 888 HG LEU 119 HG LEU 119 7.422 -8.889 -1.150 889 HD11 LEU 119 1HD1 LEU 119 9.412 -9.782 -2.372 890 HD12 LEU 119 2HD1 LEU 119 8.497 -9.607 -3.869 891 HD13 LEU 119 3HD1 LEU 119 7.927 -10.702 -2.610 892 HD21 LEU 119 3HD2 LEU 119 7.748 -6.494 -2.142 893 HD22 LEU 119 1HD2 LEU 119 8.998 -7.280 -3.106 894 HD23 LEU 119 2HD2 LEU 119 9.090 -7.317 -1.345 895 H VAL 120 H VAL 120 3.496 -9.206 -3.053 896 HA VAL 120 HA VAL 120 2.475 -7.666 -5.217 897 HB VAL 120 HB VAL 120 2.389 -10.117 -5.227 898 HG11 VAL 120 1HG1 VAL 120 0.615 -11.240 -3.859 899 HG12 VAL 120 2HG1 VAL 120 1.979 -10.615 -2.930 900 HG13 VAL 120 3HG1 VAL 120 0.449 -9.736 -2.953 901 HG21 VAL 120 3HG2 VAL 120 0.862 -9.024 -6.689 902 HG22 VAL 120 1HG2 VAL 120 -0.017 -10.346 -5.919 903 HG23 VAL 120 2HG2 VAL 120 -0.259 -8.688 -5.370 904 H ALA 121 H ALA 121 1.532 -8.127 -1.874 905 HA ALA 121 HA ALA 121 -1.054 -6.972 -2.083 906 HB1 ALA 121 1HB ALA 121 -0.329 -8.447 -0.227 907 HB2 ALA 121 2HB ALA 121 0.699 -7.140 0.364 908 HB3 ALA 121 3HB ALA 121 -1.052 -6.935 0.322 909 H MET 122 H MET 122 2.155 -5.668 -1.656 910 HA MET 122 HA MET 122 1.281 -3.065 -0.826 911 HB2 MET 122 1HB MET 122 3.470 -3.814 -0.154 912 HB3 MET 122 2HB MET 122 3.942 -4.084 -1.826 913 HG2 MET 122 1HG MET 122 4.965 -2.091 -1.422 914 HG3 MET 122 2HG MET 122 3.423 -1.533 -2.066 915 HE1 MET 122 3HE MET 122 4.499 0.680 -1.029 916 HE2 MET 122 1HE MET 122 2.744 0.783 -0.891 917 HE3 MET 122 2HE MET 122 3.763 1.260 0.466 918 H HIS 123 H HIS 123 2.498 -4.461 -3.856 919 HA HIS 123 HA HIS 123 2.377 -2.084 -5.367 920 HB2 HIS 123 1HB HIS 123 3.662 -3.684 -6.415 921 HB3 HIS 123 2HB HIS 123 2.562 -4.994 -5.999 922 HD2 HIS 123 2HD HIS 123 0.247 -5.155 -7.711 923 HE1 HIS 123 1HE HIS 123 2.046 -2.856 -10.790 924 HE2 HIS 123 2HE HIS 123 0.095 -4.318 -10.154 925 H LYS 124 H LYS 124 0.091 -4.796 -5.088 926 HA LYS 124 HA LYS 124 -1.856 -3.898 -6.842 927 HB2 LYS 124 1HB LYS 124 -1.987 -5.565 -4.346 928 HB3 LYS 124 2HB LYS 124 -3.450 -5.163 -5.236 929 HG2 LYS 124 1HG LYS 124 -2.030 -6.085 -7.268 930 HG3 LYS 124 2HG LYS 124 -1.207 -6.957 -5.973 931 HD2 LYS 124 1HD LYS 124 -4.201 -6.949 -6.241 932 HD3 LYS 124 2HD LYS 124 -3.188 -8.116 -7.093 933 HE2 LYS 124 1HE LYS 124 -2.164 -8.494 -4.708 934 HE3 LYS 124 2HE LYS 124 -3.699 -7.814 -4.169 935 HZ1 LYS 124 3HZ LYS 124 -4.475 -9.625 -6.006 936 HZ2 LYS 124 1HZ LYS 124 -4.424 -9.904 -4.338 937 HZ3 LYS 124 2HZ LYS 124 -3.136 -10.395 -5.318 938 H ALA 125 H ALA 125 -1.252 -2.980 -3.502 939 HA ALA 125 HA ALA 125 -3.623 -1.309 -3.396 940 HB1 ALA 125 1HB ALA 125 -1.801 -2.460 -1.483 941 HB2 ALA 125 2HB ALA 125 -2.038 -0.740 -1.175 942 HB3 ALA 125 3HB ALA 125 -3.428 -1.823 -1.243 943 H ALA 126 H ALA 126 -0.216 -0.995 -4.002 944 HA ALA 126 HA ALA 126 0.265 1.664 -3.448 945 HB1 ALA 126 1HB ALA 126 1.360 -0.254 -5.443 946 HB2 ALA 126 2HB ALA 126 1.795 1.450 -5.580 947 HB3 ALA 126 3HB ALA 126 2.162 0.563 -4.101 948 H LYS 127 H LYS 127 -1.125 0.264 -6.402 949 HA LYS 127 HA LYS 127 -1.426 2.747 -7.747 950 HB2 LYS 127 1HB LYS 127 -2.939 1.460 -9.259 951 HB3 LYS 127 2HB LYS 127 -1.359 0.720 -9.036 952 HG2 LYS 127 1HG LYS 127 -2.676 -0.559 -7.108 953 HG3 LYS 127 2HG LYS 127 -4.033 -0.213 -8.184 954 HD2 LYS 127 1HD LYS 127 -1.548 -1.310 -9.390 955 HD3 LYS 127 2HD LYS 127 -2.554 -2.404 -8.437 956 HE2 LYS 127 1HE LYS 127 -4.329 -2.255 -9.895 957 HE3 LYS 127 2HE LYS 127 -3.838 -0.674 -10.499 958 HZ1 LYS 127 3HZ LYS 127 -3.469 -2.340 -12.172 959 HZ2 LYS 127 1HZ LYS 127 -2.537 -3.272 -11.111 960 HZ3 LYS 127 2HZ LYS 127 -1.972 -1.765 -11.632 961 H LEU 128 H LEU 128 -3.459 0.889 -5.578 962 HA LEU 128 HA LEU 128 -5.906 2.150 -6.017 963 HB2 LEU 128 1HB LEU 128 -4.665 0.671 -3.766 964 HB3 LEU 128 2HB LEU 128 -6.108 1.620 -3.415 965 HG LEU 128 HG LEU 128 -6.260 -0.928 -4.055 966 HD11 LEU 128 1HD1 LEU 128 -8.016 1.213 -3.987 967 HD12 LEU 128 2HD1 LEU 128 -8.440 -0.497 -4.052 968 HD13 LEU 128 3HD1 LEU 128 -8.331 0.440 -5.541 969 HD21 LEU 128 3HD2 LEU 128 -5.035 -0.290 -6.270 970 HD22 LEU 128 1HD2 LEU 128 -6.644 0.215 -6.786 971 HD23 LEU 128 2HD2 LEU 128 -6.359 -1.455 -6.295 972 H LEU 129 H LEU 129 -3.140 3.125 -4.082 973 HA LEU 129 HA LEU 129 -4.384 5.241 -2.691 974 HB2 LEU 129 1HB LEU 129 -1.597 4.420 -3.284 975 HB3 LEU 129 2HB LEU 129 -1.858 6.084 -2.765 976 HG LEU 129 HG LEU 129 -2.794 3.693 -1.189 977 HD11 LEU 129 1HD1 LEU 129 -0.754 4.580 0.261 978 HD12 LEU 129 2HD1 LEU 129 -0.143 5.010 -1.336 979 HD13 LEU 129 3HD1 LEU 129 -0.562 3.335 -0.974 980 HD21 LEU 129 3HD2 LEU 129 -2.535 5.587 0.616 981 HD22 LEU 129 1HD2 LEU 129 -3.993 5.464 -0.370 982 HD23 LEU 129 2HD2 LEU 129 -2.747 6.643 -0.782 983 H TYR 130 H TYR 130 -2.498 5.179 -5.701 984 HA TYR 130 HA TYR 130 -2.929 7.993 -6.170 985 HB2 TYR 130 1HB TYR 130 -1.954 6.187 -8.331 986 HB3 TYR 130 2HB TYR 130 -1.414 7.803 -7.889 987 HD1 TYR 130 2HD TYR 130 -0.851 7.397 -4.994 988 HD2 TYR 130 1HD TYR 130 0.034 4.952 -8.361 989 HE1 TYR 130 2HE TYR 130 1.060 6.431 -3.783 990 HE2 TYR 130 1HE TYR 130 1.947 3.978 -7.160 991 HH TYR 130 HH TYR 130 2.515 3.676 -4.543 992 H GLU 131 H GLU 131 -3.721 5.086 -8.086 993 HA GLU 131 HA GLU 131 -5.452 6.251 -9.882 994 HB2 GLU 131 1HB GLU 131 -5.635 3.481 -8.685 995 HB3 GLU 131 2HB GLU 131 -6.462 4.007 -10.144 996 HG2 GLU 131 1HG GLU 131 -3.516 4.328 -10.023 997 HG3 GLU 131 2HG GLU 131 -4.171 2.704 -10.226 998 H SER 132 H SER 132 -5.963 5.547 -6.538 999 HA SER 132 HA SER 132 -8.661 6.678 -6.740 1000 HB2 SER 132 1HB SER 132 -8.573 4.073 -6.537 1001 HB3 SER 132 2HB SER 132 -8.163 4.396 -4.853 1002 HG SER 132 HG SER 132 -10.110 5.735 -4.830 1003 H ARG 133 H ARG 133 -9.104 8.160 -5.220 1004 HA ARG 133 HA ARG 133 -7.280 8.355 -2.914 1005 HB2 ARG 133 1HB ARG 133 -7.550 10.829 -3.064 1006 HB3 ARG 133 2HB ARG 133 -6.712 10.125 -4.440 1007 HG2 ARG 133 1HG ARG 133 -9.175 10.093 -5.431 1008 HG3 ARG 133 2HG ARG 133 -9.365 11.428 -4.293 1009 HD2 ARG 133 1HD ARG 133 -7.167 12.310 -5.337 1010 HD3 ARG 133 2HD ARG 133 -7.538 11.199 -6.655 1011 HE ARG 133 HE ARG 133 -9.721 12.931 -5.952 1012 HH11 ARG 133 1HH1 ARG 133 -6.826 12.599 -7.857 1013 HH12 ARG 133 2HH1 ARG 133 -7.309 13.774 -9.035 1014 HH21 ARG 133 1HH2 ARG 133 -10.369 14.480 -7.497 1015 HH22 ARG 133 2HH2 ARG 133 -9.325 14.844 -8.828 1016 H ASP 134 H ASP 134 -8.241 9.771 -1.144 1017 HA ASP 134 HA ASP 134 -11.032 8.952 -0.752 1018 HB2 ASP 134 1HB ASP 134 -10.618 9.279 1.639 1019 HB3 ASP 134 2HB ASP 134 -9.423 8.188 0.942 1020 H GLN 135 H GLN 135 -11.810 10.702 -2.094 1021 HA GLN 135 HA GLN 135 -11.371 13.419 -1.236 1022 HB2 GLN 135 1HB GLN 135 -11.763 12.668 -3.634 1023 HB3 GLN 135 2HB GLN 135 -13.452 12.457 -3.194 1024 HG2 GLN 135 1HG GLN 135 -13.047 14.598 -4.295 1025 HG3 GLN 135 2HG GLN 135 -13.642 14.802 -2.648 1026 HE21 GLN 135 1HE2 GLN 135 -12.657 16.322 -1.546 1027 HE22 GLN 135 2HE2 GLN 135 -11.022 16.840 -1.750 1028 H SER 136 H SER 136 -12.141 13.468 0.889 1029 HA SER 136 HA SER 136 -13.663 13.709 2.565 1030 HB2 SER 136 1HB SER 136 -15.456 14.456 0.242 1031 HB3 SER 136 2HB SER 136 -15.817 14.767 1.940 1032 HG SER 136 HG SER 136 -14.256 16.265 2.017 1033 H GLY 137 H GLY 137 -13.310 11.089 1.792 1034 HA2 GLY 137 1HA GLY 137 -14.255 9.018 2.084 1035 HA3 GLY 137 2HA GLY 137 -15.587 9.842 2.882 1036 HA PRO 138 HA PRO 138 -16.743 9.686 -1.814 1037 HB2 PRO 138 1HB PRO 138 -15.137 8.190 -3.412 1038 HB3 PRO 138 2HB PRO 138 -14.872 9.914 -3.129 1039 HG2 PRO 138 1HG PRO 138 -13.532 7.558 -1.858 1040 HG3 PRO 138 2HG PRO 138 -12.816 9.071 -2.445 1041 HD2 PRO 138 1HD PRO 138 -13.322 8.620 0.176 1042 HD3 PRO 138 2HD PRO 138 -13.415 10.237 -0.550 1043 H SER 139 H SER 139 -17.914 8.076 -3.019 1044 HA SER 139 HA SER 139 -17.848 5.376 -1.856 1045 HB2 SER 139 1HB SER 139 -20.366 6.953 -2.439 1046 HB3 SER 139 2HB SER 139 -20.289 5.311 -1.800 1047 HG SER 139 HG SER 139 -20.579 6.743 -0.100 1048 H SER 140 H SER 140 -18.410 3.695 -3.235 1049 HA SER 140 HA SER 140 -19.414 4.122 -5.869 1050 HB2 SER 140 1HB SER 140 -17.412 3.445 -7.119 1051 HB3 SER 140 2HB SER 140 -17.113 4.930 -6.216 1052 HG SER 140 HG SER 140 -15.681 3.924 -5.038 1053 H GLY 141 H GLY 141 -20.204 2.259 -6.727 1054 HA2 GLY 141 1HA GLY 141 -19.676 -0.234 -6.899 1055 HA3 GLY 141 2HA GLY 141 -19.737 -0.185 -5.143 Start of MODEL 3 1 H1 GLY 1 H GLY 1 -8.760 7.666 0.626 2 HA2 GLY 1 1HA GLY 1 -9.965 5.686 0.661 3 HA3 GLY 1 2HA GLY 1 -11.248 6.762 0.129 4 H SER 2 H SER 2 -12.156 4.923 -0.963 5 HA SER 2 HA SER 2 -11.342 4.790 -3.703 6 HB2 SER 2 1HB SER 2 -10.876 2.395 -3.804 7 HB3 SER 2 2HB SER 2 -9.753 3.179 -2.693 8 HG SER 2 HG SER 2 -10.729 1.187 -1.915 9 H SER 3 H SER 3 -12.716 2.980 -4.839 10 HA SER 3 HA SER 3 -15.343 3.637 -4.786 11 HB2 SER 3 1HB SER 3 -14.267 2.153 -6.475 12 HB3 SER 3 2HB SER 3 -14.328 0.832 -5.308 13 HG SER 3 HG SER 3 -16.734 1.627 -5.311 14 H GLY 4 H GLY 4 -13.976 0.825 -3.062 15 HA2 GLY 4 1HA GLY 4 -14.560 0.048 -0.940 16 HA3 GLY 4 2HA GLY 4 -15.855 1.235 -0.889 17 H SER 5 H SER 5 -15.190 -1.275 -3.307 18 HA SER 5 HA SER 5 -17.809 -2.030 -3.719 19 HB2 SER 5 1HB SER 5 -15.199 -3.473 -4.062 20 HB3 SER 5 2HB SER 5 -16.717 -4.315 -4.368 21 HG SER 5 HG SER 5 -17.060 -2.155 -5.648 22 H SER 6 H SER 6 -19.236 -3.399 -2.779 23 HA SER 6 HA SER 6 -18.846 -4.087 -0.045 24 HB2 SER 6 1HB SER 6 -21.087 -5.136 -0.231 25 HB3 SER 6 2HB SER 6 -21.061 -3.494 -0.873 26 HG SER 6 HG SER 6 -21.011 -4.334 -2.946 27 H GLY 7 H GLY 7 -17.988 -5.865 0.806 28 HA2 GLY 7 1HA GLY 7 -17.469 -8.115 1.053 29 HA3 GLY 7 2HA GLY 7 -18.230 -8.431 -0.500 30 H ALA 8 H ALA 8 -15.287 -7.350 1.085 31 HA ALA 8 HA ALA 8 -13.797 -8.127 -1.333 32 HB1 ALA 8 1HB ALA 8 -12.768 -5.941 0.420 33 HB2 ALA 8 2HB ALA 8 -12.445 -6.263 -1.285 34 HB3 ALA 8 3HB ALA 8 -13.996 -5.582 -0.794 35 H GLU 9 H GLU 9 -13.332 -10.157 -0.456 36 HA GLU 9 HA GLU 9 -12.112 -10.414 2.134 37 HB2 GLU 9 1HB GLU 9 -12.475 -12.392 -0.121 38 HB3 GLU 9 2HB GLU 9 -11.804 -12.800 1.452 39 HG2 GLU 9 1HG GLU 9 -13.848 -12.390 2.545 40 HG3 GLU 9 2HG GLU 9 -14.527 -11.582 1.134 41 H PHE 10 H PHE 10 -10.993 -10.820 -1.220 42 HA PHE 10 HA PHE 10 -8.376 -11.509 -0.794 43 HB2 PHE 10 1HB PHE 10 -9.713 -11.083 -3.005 44 HB3 PHE 10 2HB PHE 10 -9.014 -9.471 -2.897 45 HD1 PHE 10 2HD PHE 10 -8.063 -13.067 -2.869 46 HD2 PHE 10 1HD PHE 10 -6.911 -9.069 -3.766 47 HE1 PHE 10 2HE PHE 10 -5.994 -13.899 -3.907 48 HE2 PHE 10 1HE PHE 10 -4.840 -9.895 -4.806 49 HZ PHE 10 HZ PHE 10 -4.379 -12.313 -4.877 50 H TYR 11 H TYR 11 -9.592 -8.175 -1.141 51 HA TYR 11 HA TYR 11 -7.155 -6.914 -0.539 52 HB2 TYR 11 1HB TYR 11 -9.137 -5.831 -1.627 53 HB3 TYR 11 2HB TYR 11 -9.926 -5.806 -0.054 54 HD1 TYR 11 2HD TYR 11 -6.833 -4.647 -1.783 55 HD2 TYR 11 1HD TYR 11 -9.631 -3.975 1.351 56 HE1 TYR 11 2HE TYR 11 -5.748 -2.497 -1.282 57 HE2 TYR 11 1HE TYR 11 -8.555 -1.823 1.860 58 HH TYR 11 HH TYR 11 -6.850 -0.465 1.410 59 H ASP 12 H ASP 12 -9.991 -7.525 1.527 60 HA ASP 12 HA ASP 12 -9.198 -6.424 3.884 61 HB2 ASP 12 1HB ASP 12 -10.817 -8.824 3.197 62 HB3 ASP 12 2HB ASP 12 -10.321 -8.639 4.877 63 H LYS 13 H LYS 13 -8.199 -9.572 2.603 64 HA LYS 13 HA LYS 13 -6.668 -10.364 4.835 65 HB2 LYS 13 1HB LYS 13 -6.748 -11.174 1.950 66 HB3 LYS 13 2HB LYS 13 -5.472 -11.787 2.995 67 HG2 LYS 13 1HG LYS 13 -7.183 -12.697 4.512 68 HG3 LYS 13 2HG LYS 13 -8.436 -12.132 3.404 69 HD2 LYS 13 1HD LYS 13 -8.202 -14.320 2.730 70 HD3 LYS 13 2HD LYS 13 -7.073 -13.510 1.641 71 HE2 LYS 13 1HE LYS 13 -5.991 -15.454 2.513 72 HE3 LYS 13 2HE LYS 13 -5.250 -14.040 3.260 73 HZ1 LYS 13 3HZ LYS 13 -7.275 -14.695 4.957 74 HZ2 LYS 13 1HZ LYS 13 -5.639 -15.063 5.179 75 HZ3 LYS 13 2HZ LYS 13 -6.674 -16.202 4.478 76 H GLN 14 H GLN 14 -5.707 -8.846 1.762 77 HA GLN 14 HA GLN 14 -2.983 -8.679 2.185 78 HB2 GLN 14 1HB GLN 14 -4.773 -6.678 0.797 79 HB3 GLN 14 2HB GLN 14 -3.022 -6.737 0.648 80 HG2 GLN 14 1HG GLN 14 -3.428 -9.180 -0.123 81 HG3 GLN 14 2HG GLN 14 -5.074 -8.622 -0.416 82 HE21 GLN 14 1HE2 GLN 14 -5.187 -6.526 -1.681 83 HE22 GLN 14 2HE2 GLN 14 -4.126 -6.391 -3.038 84 H LEU 15 H LEU 15 -5.554 -6.737 3.533 85 HA LEU 15 HA LEU 15 -4.158 -4.517 4.424 86 HB2 LEU 15 1HB LEU 15 -6.377 -5.959 5.867 87 HB3 LEU 15 2HB LEU 15 -5.877 -4.290 6.132 88 HG LEU 15 HG LEU 15 -7.163 -5.396 3.635 89 HD11 LEU 15 1HD1 LEU 15 -8.538 -5.033 5.780 90 HD12 LEU 15 2HD1 LEU 15 -9.121 -4.322 4.275 91 HD13 LEU 15 3HD1 LEU 15 -8.298 -3.315 5.466 92 HD21 LEU 15 3HD2 LEU 15 -5.854 -2.802 4.266 93 HD22 LEU 15 1HD2 LEU 15 -7.315 -2.783 3.278 94 HD23 LEU 15 2HD2 LEU 15 -5.907 -3.706 2.752 95 H LYS 16 H LYS 16 -4.868 -7.456 6.322 96 HA LYS 16 HA LYS 16 -3.187 -6.773 8.480 97 HB2 LYS 16 1HB LYS 16 -3.428 -9.135 9.150 98 HB3 LYS 16 2HB LYS 16 -4.972 -8.403 8.730 99 HG2 LYS 16 1HG LYS 16 -5.129 -9.594 6.731 100 HG3 LYS 16 2HG LYS 16 -3.409 -9.994 6.729 101 HD2 LYS 16 1HD LYS 16 -3.663 -11.613 8.392 102 HD3 LYS 16 2HD LYS 16 -5.223 -10.969 8.911 103 HE2 LYS 16 1HE LYS 16 -4.962 -11.982 6.125 104 HE3 LYS 16 2HE LYS 16 -5.044 -13.156 7.438 105 HZ1 LYS 16 3HZ LYS 16 -7.156 -11.845 6.230 106 HZ2 LYS 16 1HZ LYS 16 -7.028 -11.168 7.775 107 HZ3 LYS 16 2HZ LYS 16 -7.216 -12.839 7.597 108 H VAL 17 H VAL 17 -2.648 -8.658 5.547 109 HA VAL 17 HA VAL 17 -0.139 -9.722 6.179 110 HB VAL 17 HB VAL 17 -1.238 -8.928 3.479 111 HG11 VAL 17 1HG1 VAL 17 1.387 -9.611 4.134 112 HG12 VAL 17 2HG1 VAL 17 0.681 -11.077 3.451 113 HG13 VAL 17 3HG1 VAL 17 0.664 -9.575 2.526 114 HG21 VAL 17 3HG2 VAL 17 -2.678 -10.570 4.167 115 HG22 VAL 17 1HG2 VAL 17 -1.407 -11.558 3.448 116 HG23 VAL 17 2HG2 VAL 17 -1.475 -11.347 5.197 117 H LEU 18 H LEU 18 -1.036 -6.626 4.722 118 HA LEU 18 HA LEU 18 1.604 -5.770 4.165 119 HB2 LEU 18 1HB LEU 18 -1.048 -4.418 4.402 120 HB3 LEU 18 2HB LEU 18 0.418 -3.447 4.286 121 HG LEU 18 HG LEU 18 -0.527 -5.455 2.240 122 HD11 LEU 18 1HD1 LEU 18 -1.437 -3.761 1.035 123 HD12 LEU 18 2HD1 LEU 18 -0.320 -2.555 1.672 124 HD13 LEU 18 3HD1 LEU 18 -1.684 -3.096 2.650 125 HD21 LEU 18 3HD2 LEU 18 1.855 -3.616 2.339 126 HD22 LEU 18 1HD2 LEU 18 1.262 -4.361 0.855 127 HD23 LEU 18 2HD2 LEU 18 1.846 -5.372 2.176 128 H LEU 19 H LEU 19 -0.640 -4.728 6.739 129 HA LEU 19 HA LEU 19 1.146 -3.179 8.185 130 HB2 LEU 19 1HB LEU 19 -1.087 -4.866 9.304 131 HB3 LEU 19 2HB LEU 19 -0.341 -3.471 10.081 132 HG LEU 19 HG LEU 19 -1.822 -3.268 7.470 133 HD11 LEU 19 1HD1 LEU 19 -3.818 -3.158 8.484 134 HD12 LEU 19 2HD1 LEU 19 -3.168 -2.333 9.901 135 HD13 LEU 19 3HD1 LEU 19 -3.029 -4.086 9.760 136 HD21 LEU 19 3HD2 LEU 19 -1.610 -1.070 9.446 137 HD22 LEU 19 1HD2 LEU 19 -1.607 -1.018 7.683 138 HD23 LEU 19 2HD2 LEU 19 -0.151 -1.501 8.553 139 H SER 20 H SER 20 0.399 -6.633 8.564 140 HA SER 20 HA SER 20 1.734 -7.412 10.733 141 HB2 SER 20 1HB SER 20 0.697 -8.935 9.029 142 HB3 SER 20 2HB SER 20 2.169 -8.781 8.070 143 HG SER 20 HG SER 20 3.088 -9.425 10.348 144 H GLY 21 H GLY 21 3.344 -6.704 7.639 145 HA2 GLY 21 1HA GLY 21 5.436 -5.673 7.389 146 HA3 GLY 21 2HA GLY 21 5.740 -5.924 9.102 147 H ALA 22 H ALA 22 6.853 -6.734 6.188 148 HA ALA 22 HA ALA 22 7.712 -9.412 7.074 149 HB1 ALA 22 1HB ALA 22 7.262 -8.452 4.251 150 HB2 ALA 22 2HB ALA 22 7.909 -10.030 4.703 151 HB3 ALA 22 3HB ALA 22 6.258 -9.595 5.143 152 H THR 23 H THR 23 9.855 -10.066 6.409 153 HA THR 23 HA THR 23 11.724 -7.847 6.545 154 HB THR 23 HB THR 23 12.328 -10.809 6.504 155 HG1 THR 23 1HG THR 23 11.042 -9.551 8.349 156 HG21 THR 23 3HG2 THR 23 13.962 -8.404 6.596 157 HG22 THR 23 1HG2 THR 23 14.434 -10.077 6.305 158 HG23 THR 23 2HG2 THR 23 14.271 -9.482 7.957 159 H PHE 24 H PHE 24 13.339 -7.416 5.041 160 HA PHE 24 HA PHE 24 13.518 -8.946 2.600 161 HB2 PHE 24 1HB PHE 24 12.597 -6.067 2.478 162 HB3 PHE 24 2HB PHE 24 12.930 -7.116 1.103 163 HD1 PHE 24 2HD PHE 24 11.480 -9.155 0.768 164 HD2 PHE 24 1HD PHE 24 10.491 -6.032 3.485 165 HE1 PHE 24 2HE PHE 24 9.137 -9.906 0.772 166 HE2 PHE 24 1HE PHE 24 8.146 -6.778 3.494 167 HZ PHE 24 HZ PHE 24 7.466 -8.716 2.136 168 H LEU 25 H LEU 25 15.268 -8.227 1.214 169 HA LEU 25 HA LEU 25 17.458 -7.156 2.774 170 HB2 LEU 25 1HB LEU 25 17.164 -8.552 0.169 171 HB3 LEU 25 2HB LEU 25 18.594 -7.552 0.411 172 HG LEU 25 HG LEU 25 17.765 -9.974 2.004 173 HD11 LEU 25 1HD1 LEU 25 19.891 -9.380 -0.010 174 HD12 LEU 25 2HD1 LEU 25 18.804 -10.764 0.099 175 HD13 LEU 25 3HD1 LEU 25 20.154 -10.612 1.224 176 HD21 LEU 25 3HD2 LEU 25 20.010 -9.554 3.138 177 HD22 LEU 25 1HD2 LEU 25 18.659 -8.526 3.618 178 HD23 LEU 25 2HD2 LEU 25 19.887 -7.909 2.512 179 H VAL 26 H VAL 26 17.849 -5.055 2.879 180 HA VAL 26 HA VAL 26 16.964 -3.321 0.680 181 HB VAL 26 HB VAL 26 17.800 -2.579 3.488 182 HG11 VAL 26 1HG1 VAL 26 16.786 -0.941 1.177 183 HG12 VAL 26 2HG1 VAL 26 16.738 -0.376 2.848 184 HG13 VAL 26 3HG1 VAL 26 18.286 -0.739 2.082 185 HG21 VAL 26 3HG2 VAL 26 15.444 -2.153 3.888 186 HG22 VAL 26 1HG2 VAL 26 15.054 -2.640 2.239 187 HG23 VAL 26 2HG2 VAL 26 15.679 -3.827 3.384 188 H THR 27 H THR 27 18.410 -2.556 -0.702 189 HA THR 27 HA THR 27 21.255 -2.669 0.017 190 HB THR 27 HB THR 27 20.155 -2.225 -2.754 191 HG1 THR 27 1HG THR 27 19.980 -4.369 -3.003 192 HG21 THR 27 3HG2 THR 27 22.810 -3.056 -1.613 193 HG22 THR 27 1HG2 THR 27 22.449 -1.704 -2.685 194 HG23 THR 27 2HG2 THR 27 22.385 -3.357 -3.297 195 H PHE 28 H PHE 28 22.237 -0.844 0.557 196 HA PHE 28 HA PHE 28 21.013 1.710 -0.175 197 HB2 PHE 28 1HB PHE 28 23.168 1.030 1.834 198 HB3 PHE 28 2HB PHE 28 22.588 2.661 1.516 199 HD1 PHE 28 2HD PHE 28 20.092 3.108 1.873 200 HD2 PHE 28 1HD PHE 28 22.114 -0.310 3.405 201 HE1 PHE 28 2HE PHE 28 18.297 2.792 3.526 202 HE2 PHE 28 1HE PHE 28 20.322 -0.632 5.060 203 HZ PHE 28 HZ PHE 28 18.411 0.920 5.123 204 H GLY 29 H GLY 29 21.883 3.055 -1.627 205 HA2 GLY 29 1HA GLY 29 23.683 2.416 -3.532 206 HA3 GLY 29 2HA GLY 29 23.480 4.068 -2.966 207 H ASN 30 H ASN 30 24.484 3.569 -0.305 208 HA ASN 30 HA ASN 30 27.258 3.946 -0.821 209 HB2 ASN 30 1HB ASN 30 26.351 5.125 1.031 210 HB3 ASN 30 2HB ASN 30 25.654 3.661 1.717 211 HD21 ASN 30 1HD2 ASN 30 26.641 3.562 3.636 212 HD22 ASN 30 2HD2 ASN 30 28.352 3.471 3.863 213 H SER 31 H SER 31 25.386 1.330 0.682 214 HA SER 31 HA SER 31 27.774 -0.337 0.826 215 HB2 SER 31 1HB SER 31 26.177 -0.256 2.740 216 HB3 SER 31 2HB SER 31 24.947 -0.977 1.702 217 HG SER 31 HG SER 31 26.305 -2.406 3.118 218 H GLU 32 H GLU 32 28.203 -2.007 -0.497 219 HA GLU 32 HA GLU 32 26.673 -2.276 -2.909 220 HB2 GLU 32 1HB GLU 32 29.008 -3.927 -1.926 221 HB3 GLU 32 2HB GLU 32 28.372 -3.905 -3.565 222 HG2 GLU 32 1HG GLU 32 29.385 -1.407 -2.266 223 HG3 GLU 32 2HG GLU 32 30.482 -2.545 -3.047 224 H LYS 33 H LYS 33 26.931 -3.989 0.105 225 HA LYS 33 HA LYS 33 25.214 -6.138 -0.935 226 HB2 LYS 33 1HB LYS 33 27.020 -7.195 0.064 227 HB3 LYS 33 2HB LYS 33 27.174 -5.973 1.320 228 HG2 LYS 33 1HG LYS 33 25.358 -6.851 2.538 229 HG3 LYS 33 2HG LYS 33 24.844 -7.863 1.186 230 HD2 LYS 33 1HD LYS 33 27.534 -8.201 2.480 231 HD3 LYS 33 2HD LYS 33 26.092 -8.995 3.116 232 HE2 LYS 33 1HE LYS 33 26.867 -9.240 0.228 233 HE3 LYS 33 2HE LYS 33 27.572 -10.289 1.457 234 HZ1 LYS 33 3HZ LYS 33 24.654 -9.992 1.006 235 HZ2 LYS 33 1HZ LYS 33 25.419 -11.109 2.020 236 HZ3 LYS 33 2HZ LYS 33 25.593 -11.233 0.342 237 HA PRO 34 HA PRO 34 21.796 -4.356 1.227 238 HB2 PRO 34 1HB PRO 34 20.141 -6.505 1.116 239 HB3 PRO 34 2HB PRO 34 20.470 -5.472 -0.281 240 HG2 PRO 34 1HG PRO 34 21.661 -8.124 0.436 241 HG3 PRO 34 2HG PRO 34 21.109 -7.535 -1.143 242 HD2 PRO 34 1HD PRO 34 23.721 -7.570 -0.434 243 HD3 PRO 34 2HD PRO 34 23.042 -6.335 -1.512 244 H GLU 35 H GLU 35 20.389 -4.843 3.113 245 HA GLU 35 HA GLU 35 21.632 -6.705 5.018 246 HB2 GLU 35 1HB GLU 35 22.481 -4.539 5.618 247 HB3 GLU 35 2HB GLU 35 20.878 -3.826 5.521 248 HG2 GLU 35 1HG GLU 35 21.356 -4.072 7.810 249 HG3 GLU 35 2HG GLU 35 20.205 -5.346 7.407 250 H THR 36 H THR 36 20.248 -7.565 6.600 251 HA THR 36 HA THR 36 17.585 -8.004 5.749 252 HB THR 36 HB THR 36 18.710 -8.564 8.497 253 HG1 THR 36 1HG THR 36 18.682 -10.727 6.941 254 HG21 THR 36 3HG2 THR 36 16.438 -8.974 8.656 255 HG22 THR 36 1HG2 THR 36 17.049 -10.550 8.156 256 HG23 THR 36 2HG2 THR 36 16.304 -9.477 6.971 257 H MET 37 H MET 37 16.141 -6.391 5.756 258 HA MET 37 HA MET 37 15.727 -4.949 8.285 259 HB2 MET 37 1HB MET 37 15.742 -3.775 5.502 260 HB3 MET 37 2HB MET 37 15.108 -2.934 6.911 261 HG2 MET 37 1HG MET 37 17.476 -3.447 7.901 262 HG3 MET 37 2HG MET 37 17.920 -3.597 6.202 263 HE1 MET 37 3HE MET 37 16.611 -1.749 9.000 264 HE2 MET 37 1HE MET 37 17.708 -0.371 8.904 265 HE3 MET 37 2HE MET 37 16.032 -0.201 8.383 266 H THR 38 H THR 38 13.592 -4.419 8.782 267 HA THR 38 HA THR 38 11.603 -5.998 7.327 268 HB THR 38 HB THR 38 11.317 -4.623 10.005 269 HG1 THR 38 1HG THR 38 12.907 -6.429 9.794 270 HG21 THR 38 3HG2 THR 38 9.668 -6.927 9.046 271 HG22 THR 38 1HG2 THR 38 9.268 -5.290 8.527 272 HG23 THR 38 2HG2 THR 38 9.278 -5.693 10.244 273 H CYS 39 H CYS 39 9.979 -5.114 6.195 274 HA CYS 39 HA CYS 39 9.682 -2.184 6.298 275 HB2 CYS 39 1HB CYS 39 10.548 -3.466 4.146 276 HB3 CYS 39 2HB CYS 39 8.828 -3.744 3.899 277 HG CYS 39 HG CYS 39 10.434 -1.277 2.814 278 H ARG 40 H ARG 40 7.765 -1.413 6.889 279 HA ARG 40 HA ARG 40 5.366 -3.042 6.494 280 HB2 ARG 40 1HB ARG 40 4.618 -2.787 8.754 281 HB3 ARG 40 2HB ARG 40 6.248 -3.446 8.805 282 HG2 ARG 40 1HG ARG 40 7.004 -1.010 9.098 283 HG3 ARG 40 2HG ARG 40 5.314 -0.688 9.492 284 HD2 ARG 40 1HD ARG 40 6.873 -2.862 10.855 285 HD3 ARG 40 2HD ARG 40 6.918 -1.194 11.423 286 HE ARG 40 HE ARG 40 4.266 -1.742 11.251 287 HH11 ARG 40 1HH1 ARG 40 6.960 -3.291 12.819 288 HH12 ARG 40 2HH1 ARG 40 6.006 -3.932 14.115 289 HH21 ARG 40 1HH2 ARG 40 2.998 -2.579 12.952 290 HH22 ARG 40 2HH2 ARG 40 3.752 -3.527 14.190 291 H LEU 41 H LEU 41 3.355 -1.745 6.990 292 HA LEU 41 HA LEU 41 3.738 0.984 5.978 293 HB2 LEU 41 1HB LEU 41 1.605 -1.056 5.720 294 HB3 LEU 41 2HB LEU 41 1.100 0.632 5.759 295 HG LEU 41 HG LEU 41 3.196 -0.309 3.831 296 HD11 LEU 41 1HD1 LEU 41 0.215 -0.347 3.380 297 HD12 LEU 41 2HD1 LEU 41 1.249 -1.767 3.539 298 HD13 LEU 41 3HD1 LEU 41 1.459 -0.672 2.173 299 HD21 LEU 41 3HD2 LEU 41 1.711 2.135 4.367 300 HD22 LEU 41 1HD2 LEU 41 1.619 1.632 2.679 301 HD23 LEU 41 2HD2 LEU 41 3.191 1.887 3.438 302 H SER 42 H SER 42 2.055 2.588 6.746 303 HA SER 42 HA SER 42 2.089 2.593 9.643 304 HB2 SER 42 1HB SER 42 1.764 4.875 9.517 305 HB3 SER 42 2HB SER 42 2.522 4.586 7.951 306 HG SER 42 HG SER 42 0.569 5.874 7.883 307 H ASN 43 H ASN 43 0.009 3.640 10.660 308 HA ASN 43 HA ASN 43 -1.977 1.771 10.784 309 HB2 ASN 43 1HB ASN 43 -1.650 3.762 12.307 310 HB3 ASN 43 2HB ASN 43 -2.490 4.732 11.101 311 HD21 ASN 43 1HD2 ASN 43 -2.890 1.687 12.877 312 HD22 ASN 43 2HD2 ASN 43 -4.576 1.894 13.190 313 H ASN 44 H ASN 44 -2.152 4.788 8.886 314 HA ASN 44 HA ASN 44 -4.415 3.698 7.396 315 HB2 ASN 44 1HB ASN 44 -3.161 6.452 7.304 316 HB3 ASN 44 2HB ASN 44 -4.636 5.967 6.473 317 HD21 ASN 44 1HD2 ASN 44 -3.583 7.650 8.995 318 HD22 ASN 44 2HD2 ASN 44 -4.898 7.440 10.097 319 H GLN 45 H GLN 45 -1.468 2.926 7.130 320 HA GLN 45 HA GLN 45 0.057 2.467 5.493 321 HB2 GLN 45 1HB GLN 45 -2.358 2.351 3.689 322 HB3 GLN 45 2HB GLN 45 -0.851 1.460 3.523 323 HG2 GLN 45 1HG GLN 45 -1.364 0.203 5.548 324 HG3 GLN 45 2HG GLN 45 -2.870 1.101 5.726 325 HE21 GLN 45 1HE2 GLN 45 -2.395 -1.769 5.387 326 HE22 GLN 45 2HE2 GLN 45 -3.299 -2.235 3.990 327 H ARG 46 H ARG 46 0.034 5.127 5.921 328 HA ARG 46 HA ARG 46 0.066 6.315 3.226 329 HB2 ARG 46 1HB ARG 46 -0.512 7.475 5.930 330 HB3 ARG 46 2HB ARG 46 0.089 8.509 4.641 331 HG2 ARG 46 1HG ARG 46 -2.310 6.758 4.250 332 HG3 ARG 46 2HG ARG 46 -2.436 8.359 4.982 333 HD2 ARG 46 1HD ARG 46 -1.263 9.265 2.954 334 HD3 ARG 46 2HD ARG 46 -1.430 7.667 2.228 335 HE ARG 46 HE ARG 46 -3.603 8.172 1.765 336 HH11 ARG 46 1HH1 ARG 46 -2.501 10.262 4.322 337 HH12 ARG 46 2HH1 ARG 46 -3.960 11.196 4.365 338 HH21 ARG 46 1HH2 ARG 46 -5.528 9.394 1.811 339 HH22 ARG 46 2HH2 ARG 46 -5.681 10.701 2.936 340 H TYR 47 H TYR 47 2.013 5.145 5.664 341 HA TYR 47 HA TYR 47 4.349 6.448 4.503 342 HB2 TYR 47 1HB TYR 47 3.957 6.362 7.497 343 HB3 TYR 47 2HB TYR 47 5.274 7.126 6.614 344 HD1 TYR 47 1HD TYR 47 4.599 9.048 4.992 345 HD2 TYR 47 2HD TYR 47 2.127 7.632 8.153 346 HE1 TYR 47 1HE TYR 47 3.352 11.167 4.957 347 HE2 TYR 47 2HE TYR 47 0.872 9.747 8.126 348 HH TYR 47 HH TYR 47 1.582 12.276 5.745 349 H LEU 48 H LEU 48 6.253 5.259 4.685 350 HA LEU 48 HA LEU 48 5.858 2.470 5.521 351 HB2 LEU 48 1HB LEU 48 7.540 3.796 3.450 352 HB3 LEU 48 2HB LEU 48 8.091 2.272 4.142 353 HG LEU 48 HG LEU 48 5.389 2.602 2.854 354 HD11 LEU 48 1HD1 LEU 48 7.719 2.912 1.491 355 HD12 LEU 48 2HD1 LEU 48 6.225 2.280 0.800 356 HD13 LEU 48 3HD1 LEU 48 7.472 1.170 1.370 357 HD21 LEU 48 3HD2 LEU 48 6.623 0.541 4.352 358 HD22 LEU 48 1HD2 LEU 48 6.520 -0.003 2.678 359 HD23 LEU 48 2HD2 LEU 48 5.063 0.515 3.527 360 H PHE 49 H PHE 49 7.163 1.511 7.001 361 HA PHE 49 HA PHE 49 9.273 3.181 8.202 362 HB2 PHE 49 1HB PHE 49 7.574 1.163 9.675 363 HB3 PHE 49 2HB PHE 49 8.721 2.301 10.372 364 HD1 PHE 49 1HD PHE 49 8.002 4.767 8.907 365 HD2 PHE 49 2HD PHE 49 5.551 1.756 10.651 366 HE1 PHE 49 1HE PHE 49 6.195 6.411 9.196 367 HE2 PHE 49 2HE PHE 49 3.739 3.395 10.942 368 HZ PHE 49 HZ PHE 49 4.059 5.726 10.214 369 H LEU 50 H LEU 50 11.203 2.221 8.705 370 HA LEU 50 HA LEU 50 11.494 -0.616 7.964 371 HB2 LEU 50 1HB LEU 50 13.583 1.519 7.581 372 HB3 LEU 50 2HB LEU 50 13.648 -0.154 7.029 373 HG LEU 50 HG LEU 50 11.759 1.958 5.988 374 HD11 LEU 50 1HD1 LEU 50 14.461 1.069 5.175 375 HD12 LEU 50 2HD1 LEU 50 13.680 2.641 5.002 376 HD13 LEU 50 3HD1 LEU 50 13.280 1.331 3.891 377 HD21 LEU 50 3HD2 LEU 50 10.580 0.166 5.351 378 HD22 LEU 50 1HD2 LEU 50 11.906 -0.947 5.692 379 HD23 LEU 50 2HD2 LEU 50 11.860 -0.073 4.161 380 H ASP 51 H ASP 51 12.665 -1.900 9.305 381 HA ASP 51 HA ASP 51 13.807 -0.621 11.703 382 HB2 ASP 51 1HB ASP 51 11.671 -2.125 11.880 383 HB3 ASP 51 2HB ASP 51 12.818 -3.452 11.717 384 H GLY 52 H GLY 52 15.769 -1.361 12.478 385 HA2 GLY 52 1HA GLY 52 17.271 -3.482 12.197 386 HA3 GLY 52 2HA GLY 52 17.328 -2.911 10.536 387 H ASP 53 H ASP 53 19.412 -2.298 10.344 388 HA ASP 53 HA ASP 53 21.181 -1.318 12.114 389 HB2 ASP 53 1HB ASP 53 20.807 -0.215 9.321 390 HB3 ASP 53 2HB ASP 53 22.279 -0.114 10.283 391 H SER 54 H SER 54 18.560 0.508 10.637 392 HA SER 54 HA SER 54 18.691 2.463 12.756 393 HB2 SER 54 1HB SER 54 20.288 3.116 10.742 394 HB3 SER 54 2HB SER 54 18.774 3.657 10.018 395 HG SER 54 HG SER 54 19.235 4.419 12.648 396 H HIS 55 H HIS 55 16.859 3.941 12.724 397 HA HIS 55 HA HIS 55 14.492 2.621 11.696 398 HB2 HIS 55 1HB HIS 55 13.373 4.611 12.940 399 HB3 HIS 55 2HB HIS 55 14.150 3.344 13.884 400 HD2 HIS 55 2HD HIS 55 16.489 6.020 12.343 401 HE1 HIS 55 1HE HIS 55 16.101 6.842 16.487 402 HE2 HIS 55 2HE HIS 55 17.259 7.471 14.341 403 H TYR 56 H TYR 56 14.389 2.958 9.514 404 HA TYR 56 HA TYR 56 14.524 5.711 8.523 405 HB2 TYR 56 1HB TYR 56 14.876 3.023 7.300 406 HB3 TYR 56 2HB TYR 56 14.228 4.297 6.272 407 HD1 TYR 56 1HD TYR 56 15.606 6.639 6.661 408 HD2 TYR 56 2HD TYR 56 17.143 2.698 7.121 409 HE1 TYR 56 1HE TYR 56 17.882 7.488 6.273 410 HE2 TYR 56 2HE TYR 56 19.423 3.536 6.735 411 HH TYR 56 HH TYR 56 20.186 6.859 6.741 412 H GLU 57 H GLU 57 12.899 6.445 6.981 413 HA GLU 57 HA GLU 57 10.327 5.083 7.058 414 HB2 GLU 57 1HB GLU 57 9.777 6.362 8.868 415 HB3 GLU 57 2HB GLU 57 10.934 7.623 8.465 416 HG2 GLU 57 1HG GLU 57 9.462 8.494 6.769 417 HG3 GLU 57 2HG GLU 57 8.327 7.171 7.032 418 H ILE 58 H ILE 58 9.770 4.966 4.993 419 HA ILE 58 HA ILE 58 10.529 7.135 3.172 420 HB ILE 58 HB ILE 58 9.548 4.339 2.591 421 HG12 ILE 58 1HG1 ILE 58 12.213 5.423 1.774 422 HG13 ILE 58 2HG1 ILE 58 11.981 4.920 3.445 423 HG21 ILE 58 1HG2 ILE 58 9.138 4.926 0.488 424 HG22 ILE 58 2HG2 ILE 58 9.325 6.609 0.980 425 HG23 ILE 58 3HG2 ILE 58 10.708 5.717 0.347 426 HD11 ILE 58 3HD1 ILE 58 12.604 3.326 1.219 427 HD12 ILE 58 1HD1 ILE 58 12.292 2.811 2.876 428 HD13 ILE 58 2HD1 ILE 58 10.967 2.896 1.714 429 H GLU 59 H GLU 59 8.998 8.694 3.340 430 HA GLU 59 HA GLU 59 6.248 8.248 3.739 431 HB2 GLU 59 1HB GLU 59 7.786 10.607 2.665 432 HB3 GLU 59 2HB GLU 59 6.040 10.636 2.865 433 HG2 GLU 59 1HG GLU 59 6.644 11.548 4.846 434 HG3 GLU 59 2HG GLU 59 6.666 9.846 5.306 435 H ILE 60 H ILE 60 4.989 7.158 2.382 436 HA ILE 60 HA ILE 60 5.441 6.553 -0.259 437 HB ILE 60 HB ILE 60 2.727 6.980 0.995 438 HG12 ILE 60 1HG1 ILE 60 4.461 4.504 0.864 439 HG13 ILE 60 2HG1 ILE 60 4.121 5.446 2.311 440 HG21 ILE 60 1HG2 ILE 60 1.784 5.839 -0.754 441 HG22 ILE 60 2HG2 ILE 60 3.083 6.690 -1.589 442 HG23 ILE 60 3HG2 ILE 60 3.279 4.993 -1.152 443 HD11 ILE 60 3HD1 ILE 60 1.764 4.464 0.858 444 HD12 ILE 60 1HD1 ILE 60 2.780 3.230 1.602 445 HD13 ILE 60 2HD1 ILE 60 2.096 4.522 2.589 446 H VAL 61 H VAL 61 3.972 9.441 1.094 447 HA VAL 61 HA VAL 61 2.841 10.541 -1.199 448 HB VAL 61 HB VAL 61 3.158 12.749 -0.109 449 HG11 VAL 61 1HG1 VAL 61 1.491 10.738 0.601 450 HG12 VAL 61 2HG1 VAL 61 2.271 11.084 2.146 451 HG13 VAL 61 3HG1 VAL 61 1.427 12.366 1.276 452 HG21 VAL 61 3HG2 VAL 61 5.384 11.713 0.996 453 HG22 VAL 61 1HG2 VAL 61 4.536 13.117 1.643 454 HG23 VAL 61 2HG2 VAL 61 4.257 11.521 2.339 455 H HIS 62 H HIS 62 6.172 10.361 -0.185 456 HA HIS 62 HA HIS 62 7.093 12.266 -2.152 457 HB2 HIS 62 1HB HIS 62 8.379 10.570 -0.057 458 HB3 HIS 62 2HB HIS 62 9.376 11.175 -1.376 459 HD2 HIS 62 2HD HIS 62 7.439 12.530 1.732 460 HE1 HIS 62 1HE HIS 62 9.803 15.668 0.131 461 HE2 HIS 62 2HE HIS 62 8.387 14.913 2.072 462 H ILE 63 H ILE 63 7.016 8.762 -1.752 463 HA ILE 63 HA ILE 63 8.632 7.927 -3.808 464 HB ILE 63 HB ILE 63 5.972 6.702 -3.072 465 HG12 ILE 63 1HG1 ILE 63 8.735 6.127 -1.980 466 HG13 ILE 63 2HG1 ILE 63 7.483 7.030 -1.133 467 HG21 ILE 63 1HG2 ILE 63 8.101 4.907 -3.882 468 HG22 ILE 63 2HG2 ILE 63 6.434 5.012 -4.447 469 HG23 ILE 63 3HG2 ILE 63 7.671 6.053 -5.152 470 HD11 ILE 63 3HD1 ILE 63 6.966 5.069 -0.218 471 HD12 ILE 63 1HD1 ILE 63 6.190 4.712 -1.760 472 HD13 ILE 63 2HD1 ILE 63 7.836 4.157 -1.451 473 H SER 64 H SER 64 8.569 7.932 -5.974 474 HA SER 64 HA SER 64 6.232 9.164 -7.255 475 HB2 SER 64 1HB SER 64 8.575 10.148 -7.531 476 HB3 SER 64 2HB SER 64 8.939 8.736 -8.522 477 HG SER 64 HG SER 64 7.317 10.923 -9.062 478 H THR 65 H THR 65 8.660 6.664 -8.025 479 HA THR 65 HA THR 65 6.617 5.267 -9.608 480 HB THR 65 HB THR 65 9.607 4.817 -9.607 481 HG1 THR 65 1HG THR 65 8.408 6.872 -10.553 482 HG21 THR 65 3HG2 THR 65 7.413 3.329 -10.688 483 HG22 THR 65 1HG2 THR 65 9.138 2.979 -10.777 484 HG23 THR 65 2HG2 THR 65 8.378 3.987 -12.008 485 H VAL 66 H VAL 66 5.995 3.211 -9.152 486 HA VAL 66 HA VAL 66 7.336 1.810 -6.945 487 HB VAL 66 HB VAL 66 4.347 2.170 -7.203 488 HG11 VAL 66 1HG1 VAL 66 4.226 0.882 -5.109 489 HG12 VAL 66 2HG1 VAL 66 4.881 -0.071 -6.443 490 HG13 VAL 66 3HG1 VAL 66 5.960 0.581 -5.209 491 HG21 VAL 66 3HG2 VAL 66 5.658 4.107 -6.292 492 HG22 VAL 66 1HG2 VAL 66 4.458 3.435 -5.187 493 HG23 VAL 66 2HG2 VAL 66 6.167 3.056 -4.970 494 H GLN 67 H GLN 67 8.202 0.170 -8.103 495 HA GLN 67 HA GLN 67 6.317 -1.554 -9.564 496 HB2 GLN 67 1HB GLN 67 7.929 -1.980 -11.277 497 HB3 GLN 67 2HB GLN 67 7.794 -0.235 -11.104 498 HG2 GLN 67 1HG GLN 67 9.832 -0.317 -9.649 499 HG3 GLN 67 2HG GLN 67 10.003 -2.010 -10.108 500 HE21 GLN 67 1HE2 GLN 67 10.462 -2.522 -12.280 501 HE22 GLN 67 2HE2 GLN 67 11.178 -1.362 -13.340 502 H ILE 68 H ILE 68 7.026 -3.810 -9.740 503 HA ILE 68 HA ILE 68 8.582 -4.606 -7.369 504 HB ILE 68 HB ILE 68 6.430 -6.129 -8.842 505 HG12 ILE 68 1HG1 ILE 68 6.448 -5.050 -6.018 506 HG13 ILE 68 2HG1 ILE 68 5.685 -4.233 -7.378 507 HG21 ILE 68 1HG2 ILE 68 6.823 -7.499 -6.549 508 HG22 ILE 68 2HG2 ILE 68 7.584 -7.908 -8.086 509 HG23 ILE 68 3HG2 ILE 68 8.467 -6.960 -6.890 510 HD11 ILE 68 3HD1 ILE 68 3.846 -5.335 -6.815 511 HD12 ILE 68 1HD1 ILE 68 4.624 -6.769 -7.483 512 HD13 ILE 68 2HD1 ILE 68 4.731 -6.432 -5.755 513 H LEU 69 H LEU 69 10.284 -5.970 -7.566 514 HA LEU 69 HA LEU 69 11.227 -6.507 -10.270 515 HB2 LEU 69 1HB LEU 69 12.627 -6.995 -7.648 516 HB3 LEU 69 2HB LEU 69 13.352 -7.007 -9.255 517 HG LEU 69 HG LEU 69 12.111 -4.536 -8.071 518 HD11 LEU 69 1HD1 LEU 69 13.982 -3.998 -6.931 519 HD12 LEU 69 2HD1 LEU 69 15.046 -4.824 -8.069 520 HD13 LEU 69 3HD1 LEU 69 14.170 -5.750 -6.851 521 HD21 LEU 69 3HD2 LEU 69 14.216 -3.898 -9.756 522 HD22 LEU 69 1HD2 LEU 69 12.496 -3.797 -10.134 523 HD23 LEU 69 2HD2 LEU 69 13.409 -5.245 -10.561 524 H THR 70 H THR 70 11.531 -8.508 -11.129 525 HA THR 70 HA THR 70 10.844 -10.831 -9.458 526 HB THR 70 HB THR 70 9.708 -11.830 -11.468 527 HG1 THR 70 1HG THR 70 10.339 -10.595 -13.163 528 HG21 THR 70 3HG2 THR 70 8.456 -9.282 -10.439 529 HG22 THR 70 1HG2 THR 70 8.462 -10.820 -9.578 530 HG23 THR 70 2HG2 THR 70 7.611 -10.673 -11.116 531 H GLU 71 H GLU 71 12.041 -12.650 -9.790 532 HA GLU 71 HA GLU 71 14.446 -12.348 -11.369 533 HB2 GLU 71 1HB GLU 71 14.529 -13.321 -9.102 534 HB3 GLU 71 2HB GLU 71 13.524 -14.656 -9.648 535 HG2 GLU 71 1HG GLU 71 15.976 -15.137 -9.500 536 HG3 GLU 71 2HG GLU 71 15.226 -15.490 -11.055 537 H GLY 72 H GLY 72 14.932 -13.356 -13.244 538 HA2 GLY 72 1HA GLY 72 14.706 -15.235 -14.751 539 HA3 GLY 72 2HA GLY 72 13.025 -15.366 -14.255 540 H PHE 73 H PHE 73 11.751 -13.240 -14.688 541 HA PHE 73 HA PHE 73 10.939 -11.706 -16.168 542 HB2 PHE 73 1HB PHE 73 13.494 -11.079 -16.216 543 HB3 PHE 73 2HB PHE 73 13.433 -11.802 -17.820 544 HD1 PHE 73 2HD PHE 73 11.637 -9.302 -15.721 545 HD2 PHE 73 1HD PHE 73 12.883 -10.477 -19.618 546 HE1 PHE 73 2HE PHE 73 10.763 -7.191 -16.633 547 HE2 PHE 73 1HE PHE 73 12.011 -8.368 -20.536 548 HZ PHE 73 HZ PHE 73 10.948 -6.722 -19.044 549 HA PRO 74 HA PRO 74 10.500 -15.421 -19.058 550 HB2 PRO 74 1HB PRO 74 8.052 -16.214 -18.193 551 HB3 PRO 74 2HB PRO 74 9.559 -16.813 -17.491 552 HG2 PRO 74 1HG PRO 74 7.727 -14.667 -16.492 553 HG3 PRO 74 2HG PRO 74 8.537 -15.957 -15.586 554 HD2 PRO 74 1HD PRO 74 9.462 -13.413 -15.639 555 HD3 PRO 74 2HD PRO 74 10.539 -14.818 -15.508 556 HA PRO 75 HA PRO 75 7.919 -13.242 -21.873 557 HB2 PRO 75 1HB PRO 75 6.670 -15.252 -23.203 558 HB3 PRO 75 2HB PRO 75 8.383 -14.876 -23.421 559 HG2 PRO 75 1HG PRO 75 7.109 -17.006 -21.747 560 HG3 PRO 75 2HG PRO 75 8.535 -17.111 -22.796 561 HD2 PRO 75 1HD PRO 75 8.721 -16.853 -20.107 562 HD3 PRO 75 2HD PRO 75 9.922 -16.163 -21.218 563 H GLY 76 H GLY 76 6.643 -14.840 -19.270 564 HA2 GLY 76 1HA GLY 76 4.287 -13.362 -19.150 565 HA3 GLY 76 2HA GLY 76 3.877 -14.907 -19.879 566 H GLY 77 H GLY 77 6.109 -14.006 -17.249 567 HA2 GLY 77 1HA GLY 77 6.126 -14.620 -15.028 568 HA3 GLY 77 2HA GLY 77 4.455 -15.132 -15.213 569 H GLY 78 H GLY 78 6.961 -16.335 -13.943 570 HA2 GLY 78 1HA GLY 78 6.622 -18.996 -15.172 571 HA3 GLY 78 2HA GLY 78 8.219 -18.397 -14.747 572 H ASN 79 H ASN 79 5.015 -18.817 -13.235 573 HA ASN 79 HA ASN 79 4.395 -19.587 -11.188 574 HB2 ASN 79 1HB ASN 79 5.817 -21.546 -12.103 575 HB3 ASN 79 2HB ASN 79 7.049 -20.989 -10.974 576 HD21 ASN 79 1HD2 ASN 79 7.065 -22.211 -9.243 577 HD22 ASN 79 2HD2 ASN 79 5.680 -22.823 -8.410 578 H ALA 80 H ALA 80 5.526 -17.054 -11.226 579 HA ALA 80 HA ALA 80 6.520 -16.894 -8.494 580 HB1 ALA 80 1HB ALA 80 8.025 -15.129 -10.278 581 HB2 ALA 80 2HB ALA 80 8.576 -16.116 -8.923 582 HB3 ALA 80 3HB ALA 80 8.356 -16.846 -10.513 583 H ARG 81 H ARG 81 5.547 -15.289 -7.438 584 HA ARG 81 HA ARG 81 3.895 -13.424 -8.938 585 HB2 ARG 81 1HB ARG 81 4.139 -14.030 -5.990 586 HB3 ARG 81 2HB ARG 81 3.099 -12.765 -6.631 587 HG2 ARG 81 1HG ARG 81 1.663 -14.560 -6.347 588 HG3 ARG 81 2HG ARG 81 2.063 -14.625 -8.065 589 HD2 ARG 81 1HD ARG 81 2.171 -16.847 -7.150 590 HD3 ARG 81 2HD ARG 81 3.802 -16.310 -7.549 591 HE ARG 81 HE ARG 81 3.642 -15.657 -4.964 592 HH11 ARG 81 1HH1 ARG 81 2.795 -18.581 -6.653 593 HH12 ARG 81 2HH1 ARG 81 3.132 -19.613 -5.303 594 HH21 ARG 81 1HH2 ARG 81 4.090 -17.005 -3.180 595 HH22 ARG 81 2HH2 ARG 81 3.868 -18.716 -3.328 596 H ALA 82 H ALA 82 6.180 -13.132 -6.208 597 HA ALA 82 HA ALA 82 7.580 -10.962 -7.427 598 HB1 ALA 82 1HB ALA 82 6.865 -9.530 -5.246 599 HB2 ALA 82 2HB ALA 82 6.108 -9.368 -6.832 600 HB3 ALA 82 3HB ALA 82 5.356 -10.376 -5.595 601 H THR 83 H THR 83 9.598 -11.326 -6.813 602 HA THR 83 HA THR 83 10.107 -12.579 -4.214 603 HB THR 83 HB THR 83 11.125 -13.717 -6.096 604 HG1 THR 83 1HG THR 83 12.338 -13.611 -4.135 605 HG21 THR 83 3HG2 THR 83 11.308 -11.959 -7.710 606 HG22 THR 83 1HG2 THR 83 12.935 -12.562 -7.393 607 HG23 THR 83 2HG2 THR 83 12.400 -11.044 -6.671 608 H GLY 84 H GLY 84 10.641 -9.642 -6.008 609 HA2 GLY 84 1HA GLY 84 11.892 -8.483 -3.606 610 HA3 GLY 84 2HA GLY 84 12.617 -8.220 -5.185 611 H MET 85 H MET 85 12.346 -5.945 -4.781 612 HA MET 85 HA MET 85 9.951 -4.926 -5.940 613 HB2 MET 85 1HB MET 85 9.146 -5.303 -3.640 614 HB3 MET 85 2HB MET 85 10.443 -4.287 -3.026 615 HG2 MET 85 1HG MET 85 9.497 -2.345 -3.886 616 HG3 MET 85 2HG MET 85 8.475 -3.232 -5.014 617 HE1 MET 85 3HE MET 85 6.460 -3.352 -4.937 618 HE2 MET 85 1HE MET 85 5.593 -4.247 -3.688 619 HE3 MET 85 2HE MET 85 5.469 -2.489 -3.759 620 H PHE 86 H PHE 86 10.112 -2.719 -6.500 621 HA PHE 86 HA PHE 86 12.666 -1.411 -5.887 622 HB2 PHE 86 1HB PHE 86 12.796 -2.566 -8.110 623 HB3 PHE 86 2HB PHE 86 11.484 -1.532 -8.667 624 HD1 PHE 86 2HD PHE 86 15.008 -1.650 -7.673 625 HD2 PHE 86 1HD PHE 86 11.853 0.784 -9.170 626 HE1 PHE 86 2HE PHE 86 16.644 0.075 -8.306 627 HE2 PHE 86 1HE PHE 86 13.484 2.513 -9.806 628 HZ PHE 86 HZ PHE 86 15.883 2.160 -9.373 629 H LEU 87 H LEU 87 11.982 0.294 -4.741 630 HA LEU 87 HA LEU 87 9.716 1.857 -5.779 631 HB2 LEU 87 1HB LEU 87 10.908 1.939 -3.014 632 HB3 LEU 87 2HB LEU 87 9.429 2.730 -3.556 633 HG LEU 87 HG LEU 87 9.633 -0.248 -3.685 634 HD11 LEU 87 1HD1 LEU 87 8.610 1.065 -1.211 635 HD12 LEU 87 2HD1 LEU 87 10.337 0.753 -1.379 636 HD13 LEU 87 3HD1 LEU 87 9.188 -0.583 -1.456 637 HD21 LEU 87 3HD2 LEU 87 7.727 1.309 -4.568 638 HD22 LEU 87 1HD2 LEU 87 7.251 1.354 -2.871 639 HD23 LEU 87 2HD2 LEU 87 7.334 -0.189 -3.722 640 H GLN 88 H GLN 88 9.869 4.129 -5.879 641 HA GLN 88 HA GLN 88 12.605 5.206 -5.737 642 HB2 GLN 88 1HB GLN 88 10.573 5.490 -7.936 643 HB3 GLN 88 2HB GLN 88 11.851 6.678 -7.716 644 HG2 GLN 88 1HG GLN 88 13.481 4.748 -7.852 645 HG3 GLN 88 2HG GLN 88 12.121 3.770 -8.402 646 HE21 GLN 88 1HE2 GLN 88 14.035 6.632 -9.118 647 HE22 GLN 88 2HE2 GLN 88 13.750 6.623 -10.822 648 H TYR 89 H TYR 89 12.822 7.085 -4.681 649 HA TYR 89 HA TYR 89 10.576 8.891 -4.369 650 HB2 TYR 89 1HB TYR 89 10.895 8.927 -1.854 651 HB3 TYR 89 2HB TYR 89 10.108 7.493 -2.503 652 HD1 TYR 89 1HD TYR 89 13.276 8.805 -1.127 653 HD2 TYR 89 2HD TYR 89 11.087 5.338 -2.262 654 HE1 TYR 89 1HE TYR 89 14.950 7.390 -0.011 655 HE2 TYR 89 2HE TYR 89 12.754 3.913 -1.148 656 HH TYR 89 HH TYR 89 15.040 5.096 1.002 657 H THR 90 H THR 90 11.201 10.930 -3.349 658 HA THR 90 HA THR 90 14.030 11.530 -3.873 659 HB THR 90 HB THR 90 13.281 13.916 -3.981 660 HG1 THR 90 1HG THR 90 10.639 13.154 -4.349 661 HG21 THR 90 3HG2 THR 90 13.573 12.718 -6.042 662 HG22 THR 90 1HG2 THR 90 12.101 13.680 -6.171 663 HG23 THR 90 2HG2 THR 90 11.998 11.945 -5.872 664 H VAL 91 H VAL 91 15.242 12.773 -2.419 665 HA VAL 91 HA VAL 91 14.200 12.752 0.334 666 HB VAL 91 HB VAL 91 17.060 12.730 -0.639 667 HG11 VAL 91 1HG1 VAL 91 17.794 12.797 1.567 668 HG12 VAL 91 2HG1 VAL 91 16.492 13.988 1.542 669 HG13 VAL 91 3HG1 VAL 91 16.206 12.382 2.211 670 HG21 VAL 91 3HG2 VAL 91 17.128 10.493 -0.237 671 HG22 VAL 91 1HG2 VAL 91 15.924 10.576 1.049 672 HG23 VAL 91 2HG2 VAL 91 15.416 10.630 -0.639 673 HA PRO 92 HA PRO 92 14.222 17.163 0.337 674 HB2 PRO 92 1HB PRO 92 14.217 17.552 3.024 675 HB3 PRO 92 2HB PRO 92 12.792 17.011 2.129 676 HG2 PRO 92 1HG PRO 92 14.752 15.404 3.723 677 HG3 PRO 92 2HG PRO 92 12.983 15.282 3.672 678 HD2 PRO 92 1HD PRO 92 14.601 13.591 2.310 679 HD3 PRO 92 2HD PRO 92 12.999 14.068 1.713 680 H GLY 93 H GLY 93 16.002 18.252 -0.234 681 HA2 GLY 93 1HA GLY 93 17.888 19.555 0.407 682 HA3 GLY 93 2HA GLY 93 18.210 18.403 1.695 683 H THR 94 H THR 94 18.224 16.015 0.369 684 HA THR 94 HA THR 94 20.801 16.026 -0.813 685 HB THR 94 HB THR 94 18.715 13.838 -0.750 686 HG1 THR 94 1HG THR 94 19.538 14.535 1.309 687 HG21 THR 94 3HG2 THR 94 20.747 13.840 -2.472 688 HG22 THR 94 1HG2 THR 94 20.211 12.372 -1.656 689 HG23 THR 94 2HG2 THR 94 21.611 13.257 -1.050 690 H GLU 95 H GLU 95 21.447 15.982 -2.902 691 HA GLU 95 HA GLU 95 19.459 16.629 -4.915 692 HB2 GLU 95 1HB GLU 95 22.474 16.566 -4.939 693 HB3 GLU 95 2HB GLU 95 21.522 16.877 -6.383 694 HG2 GLU 95 1HG GLU 95 21.628 18.533 -3.877 695 HG3 GLU 95 2HG GLU 95 22.224 18.966 -5.479 696 H GLY 96 H GLY 96 18.538 15.154 -6.168 697 HA2 GLY 96 1HA GLY 96 18.917 13.415 -7.859 698 HA3 GLY 96 2HA GLY 96 20.034 12.668 -6.726 699 H VAL 97 H VAL 97 18.200 11.043 -7.725 700 HA VAL 97 HA VAL 97 16.065 10.872 -5.704 701 HB VAL 97 HB VAL 97 16.213 9.561 -8.423 702 HG11 VAL 97 1HG1 VAL 97 14.800 8.742 -6.173 703 HG12 VAL 97 2HG1 VAL 97 13.617 9.609 -7.155 704 HG13 VAL 97 3HG1 VAL 97 14.510 8.251 -7.842 705 HG21 VAL 97 3HG2 VAL 97 15.315 12.158 -7.569 706 HG22 VAL 97 1HG2 VAL 97 15.428 11.491 -9.198 707 HG23 VAL 97 2HG2 VAL 97 13.974 11.228 -8.236 708 H THR 98 H THR 98 15.849 9.085 -4.446 709 HA THR 98 HA THR 98 18.024 7.114 -4.604 710 HB THR 98 HB THR 98 16.204 7.765 -2.276 711 HG1 THR 98 1HG THR 98 18.982 8.231 -2.322 712 HG21 THR 98 3HG2 THR 98 16.814 5.587 -1.841 713 HG22 THR 98 1HG2 THR 98 18.161 6.455 -1.107 714 HG23 THR 98 2HG2 THR 98 18.345 5.729 -2.704 715 H GLN 99 H GLN 99 17.624 4.942 -4.704 716 HA GLN 99 HA GLN 99 14.816 4.165 -5.129 717 HB2 GLN 99 1HB GLN 99 15.537 2.518 -6.679 718 HB3 GLN 99 2HB GLN 99 16.402 3.993 -7.091 719 HG2 GLN 99 1HG GLN 99 17.577 1.812 -5.391 720 HG3 GLN 99 2HG GLN 99 17.754 1.884 -7.143 721 HE21 GLN 99 1HE2 GLN 99 19.551 2.243 -4.657 722 HE22 GLN 99 2HE2 GLN 99 20.476 3.649 -5.048 723 H LEU 100 H LEU 100 14.225 1.974 -4.493 724 HA LEU 100 HA LEU 100 15.870 0.925 -2.289 725 HB2 LEU 100 1HB LEU 100 13.840 2.242 -1.556 726 HB3 LEU 100 2HB LEU 100 12.862 0.969 -2.283 727 HG LEU 100 HG LEU 100 14.051 -0.637 -0.712 728 HD11 LEU 100 1HD1 LEU 100 14.833 0.577 1.405 729 HD12 LEU 100 2HD1 LEU 100 15.006 1.992 0.367 730 HD13 LEU 100 3HD1 LEU 100 15.931 0.530 0.025 731 HD21 LEU 100 3HD2 LEU 100 12.118 1.485 0.125 732 HD22 LEU 100 1HD2 LEU 100 12.680 0.286 1.290 733 HD23 LEU 100 2HD2 LEU 100 11.841 -0.232 -0.172 734 H LYS 101 H LYS 101 16.552 -1.032 -2.827 735 HA LYS 101 HA LYS 101 14.846 -2.723 -4.520 736 HB2 LYS 101 1HB LYS 101 17.305 -2.109 -5.107 737 HB3 LYS 101 2HB LYS 101 17.723 -3.310 -3.892 738 HG2 LYS 101 1HG LYS 101 16.802 -5.058 -5.128 739 HG3 LYS 101 2HG LYS 101 15.860 -3.965 -6.144 740 HD2 LYS 101 1HD LYS 101 17.818 -3.213 -7.279 741 HD3 LYS 101 2HD LYS 101 18.873 -4.041 -6.132 742 HE2 LYS 101 1HE LYS 101 18.362 -6.141 -6.992 743 HE3 LYS 101 2HE LYS 101 16.874 -5.575 -7.751 744 HZ1 LYS 101 3HZ LYS 101 19.628 -4.872 -8.617 745 HZ2 LYS 101 1HZ LYS 101 18.197 -4.342 -9.349 746 HZ3 LYS 101 2HZ LYS 101 18.608 -5.982 -9.384 747 H LEU 102 H LEU 102 13.672 -4.176 -3.469 748 HA LEU 102 HA LEU 102 14.690 -5.266 -0.937 749 HB2 LEU 102 1HB LEU 102 11.884 -5.288 -2.039 750 HB3 LEU 102 2HB LEU 102 12.382 -5.890 -0.459 751 HG LEU 102 HG LEU 102 12.525 -3.006 -1.338 752 HD11 LEU 102 1HD1 LEU 102 10.598 -2.603 -0.031 753 HD12 LEU 102 2HD1 LEU 102 10.616 -4.235 0.634 754 HD13 LEU 102 3HD1 LEU 102 10.214 -3.980 -1.064 755 HD21 LEU 102 3HD2 LEU 102 12.680 -2.860 1.288 756 HD22 LEU 102 1HD2 LEU 102 14.117 -3.117 0.298 757 HD23 LEU 102 2HD2 LEU 102 13.350 -4.482 1.110 758 H THR 103 H THR 103 15.028 -7.409 -0.669 759 HA THR 103 HA THR 103 14.123 -9.277 -2.725 760 HB THR 103 HB THR 103 17.020 -9.159 -1.871 761 HG1 THR 103 1HG THR 103 15.955 -8.516 -4.428 762 HG21 THR 103 3HG2 THR 103 16.416 -11.395 -2.431 763 HG22 THR 103 1HG2 THR 103 17.270 -10.734 -3.824 764 HG23 THR 103 2HG2 THR 103 15.511 -10.863 -3.848 765 H VAL 104 H VAL 104 13.347 -11.070 -1.826 766 HA VAL 104 HA VAL 104 13.451 -11.478 0.989 767 HB VAL 104 HB VAL 104 12.473 -13.318 -1.199 768 HG11 VAL 104 1HG1 VAL 104 11.133 -14.273 0.778 769 HG12 VAL 104 2HG1 VAL 104 12.830 -14.729 0.621 770 HG13 VAL 104 3HG1 VAL 104 12.350 -13.498 1.790 771 HG21 VAL 104 3HG2 VAL 104 10.237 -12.538 -0.484 772 HG22 VAL 104 1HG2 VAL 104 11.016 -11.380 0.595 773 HG23 VAL 104 2HG2 VAL 104 11.234 -11.244 -1.150 774 H VAL 105 H VAL 105 14.752 -12.726 2.194 775 HA VAL 105 HA VAL 105 16.957 -14.091 0.843 776 HB VAL 105 HB VAL 105 17.544 -12.511 2.620 777 HG11 VAL 105 1HG1 VAL 105 16.378 -12.370 4.503 778 HG12 VAL 105 2HG1 VAL 105 15.366 -13.711 3.962 779 HG13 VAL 105 3HG1 VAL 105 16.812 -14.027 4.922 780 HG21 VAL 105 3HG2 VAL 105 18.258 -15.345 2.639 781 HG22 VAL 105 1HG2 VAL 105 19.288 -13.915 2.659 782 HG23 VAL 105 2HG2 VAL 105 18.588 -14.518 4.161 783 H GLU 106 H GLU 106 17.350 -16.249 0.998 784 HA GLU 106 HA GLU 106 15.155 -17.936 1.746 785 HB2 GLU 106 1HB GLU 106 17.937 -18.534 0.741 786 HB3 GLU 106 2HB GLU 106 16.753 -19.784 1.096 787 HG2 GLU 106 1HG GLU 106 15.249 -18.382 -0.528 788 HG3 GLU 106 2HG GLU 106 16.804 -17.788 -1.109 789 H ASP 107 H ASP 107 18.340 -17.196 3.059 790 HA ASP 107 HA ASP 107 18.877 -19.039 4.899 791 HB2 ASP 107 1HB ASP 107 20.135 -16.949 4.735 792 HB3 ASP 107 2HB ASP 107 18.797 -16.069 5.470 793 H VAL 108 H VAL 108 16.702 -16.339 5.749 794 HA VAL 108 HA VAL 108 15.785 -17.273 8.161 795 HB VAL 108 HB VAL 108 14.248 -15.735 6.066 796 HG11 VAL 108 1HG1 VAL 108 12.768 -16.884 7.699 797 HG12 VAL 108 2HG1 VAL 108 13.595 -16.020 8.996 798 HG13 VAL 108 3HG1 VAL 108 12.681 -15.125 7.782 799 HG21 VAL 108 3HG2 VAL 108 16.243 -15.040 8.103 800 HG22 VAL 108 1HG2 VAL 108 15.779 -14.190 6.628 801 HG23 VAL 108 2HG2 VAL 108 14.812 -14.010 8.092 802 H THR 109 H THR 109 14.051 -18.521 8.859 803 HA THR 109 HA THR 109 13.554 -20.925 7.702 804 HB THR 109 HB THR 109 11.424 -21.024 8.994 805 HG1 THR 109 1HG THR 109 12.068 -18.371 9.803 806 HG21 THR 109 3HG2 THR 109 14.079 -20.554 10.005 807 HG22 THR 109 1HG2 THR 109 12.833 -21.645 10.608 808 HG23 THR 109 2HG2 THR 109 12.872 -19.967 11.149 809 H VAL 110 H VAL 110 11.583 -21.820 6.704 810 HA VAL 110 HA VAL 110 11.001 -20.679 4.254 811 HB VAL 110 HB VAL 110 9.267 -22.579 5.840 812 HG11 VAL 110 1HG1 VAL 110 7.998 -21.543 4.056 813 HG12 VAL 110 2HG1 VAL 110 9.272 -21.922 2.896 814 HG13 VAL 110 3HG1 VAL 110 8.347 -23.222 3.648 815 HG21 VAL 110 3HG2 VAL 110 11.788 -23.061 5.086 816 HG22 VAL 110 1HG2 VAL 110 10.538 -24.306 5.102 817 HG23 VAL 110 2HG2 VAL 110 10.959 -23.497 3.592 818 H GLY 111 H GLY 111 10.161 -18.707 3.972 819 HA2 GLY 111 1HA GLY 111 7.500 -18.178 5.020 820 HA3 GLY 111 2HA GLY 111 8.760 -17.075 5.555 821 H ARG 112 H ARG 112 8.438 -18.588 2.376 822 HA ARG 112 HA ARG 112 8.820 -16.089 1.053 823 HB2 ARG 112 1HB ARG 112 8.335 -18.908 0.201 824 HB3 ARG 112 2HB ARG 112 8.064 -17.625 -0.971 825 HG2 ARG 112 1HG ARG 112 10.633 -17.857 0.559 826 HG3 ARG 112 2HG ARG 112 10.352 -18.729 -0.949 827 HD2 ARG 112 1HD ARG 112 9.618 -16.314 -1.764 828 HD3 ARG 112 2HD ARG 112 10.703 -15.820 -0.465 829 HE ARG 112 HE ARG 112 12.488 -16.534 -1.720 830 HH11 ARG 112 1HH1 ARG 112 9.531 -17.732 -3.114 831 HH12 ARG 112 2HH1 ARG 112 10.293 -18.310 -4.559 832 HH21 ARG 112 1HH2 ARG 112 13.503 -17.291 -3.617 833 HH22 ARG 112 2HH2 ARG 112 12.553 -18.060 -4.843 834 H ARG 113 H ARG 113 6.049 -18.307 1.331 835 HA ARG 113 HA ARG 113 4.181 -17.028 -0.186 836 HB2 ARG 113 1HB ARG 113 3.831 -18.385 2.488 837 HB3 ARG 113 2HB ARG 113 2.482 -17.873 1.482 838 HG2 ARG 113 1HG ARG 113 2.977 -19.435 -0.182 839 HG3 ARG 113 2HG ARG 113 4.610 -19.700 0.431 840 HD2 ARG 113 1HD ARG 113 3.629 -20.701 2.474 841 HD3 ARG 113 2HD ARG 113 2.029 -20.522 1.755 842 HE ARG 113 HE ARG 113 3.698 -21.953 -0.004 843 HH11 ARG 113 1HH1 ARG 113 2.045 -22.304 3.040 844 HH12 ARG 113 2HH1 ARG 113 1.862 -24.021 2.891 845 HH21 ARG 113 1HH2 ARG 113 3.464 -24.212 -0.211 846 HH22 ARG 113 2HH2 ARG 113 2.670 -25.105 1.042 847 H GLN 114 H GLN 114 5.030 -16.263 3.176 848 HA GLN 114 HA GLN 114 3.165 -14.196 3.538 849 HB2 GLN 114 1HB GLN 114 4.377 -15.271 5.390 850 HB3 GLN 114 2HB GLN 114 5.876 -14.540 4.832 851 HG2 GLN 114 1HG GLN 114 3.453 -13.058 5.828 852 HG3 GLN 114 2HG GLN 114 4.946 -13.332 6.724 853 HE21 GLN 114 1HE2 GLN 114 3.291 -11.142 4.938 854 HE22 GLN 114 2HE2 GLN 114 4.598 -10.144 4.410 855 H ALA 115 H ALA 115 6.682 -13.719 3.228 856 HA ALA 115 HA ALA 115 6.748 -11.053 2.719 857 HB1 ALA 115 1HB ALA 115 8.895 -11.628 2.668 858 HB2 ALA 115 2HB ALA 115 8.507 -13.288 2.215 859 HB3 ALA 115 3HB ALA 115 8.666 -12.049 0.971 860 H VAL 116 H VAL 116 6.676 -13.514 0.130 861 HA VAL 116 HA VAL 116 6.421 -11.899 -2.057 862 HB VAL 116 HB VAL 116 4.952 -14.504 -1.622 863 HG11 VAL 116 1HG1 VAL 116 5.420 -12.794 -4.019 864 HG12 VAL 116 2HG1 VAL 116 5.370 -14.548 -4.208 865 HG13 VAL 116 3HG1 VAL 116 3.980 -13.692 -3.540 866 HG21 VAL 116 3HG2 VAL 116 7.473 -14.347 -3.173 867 HG22 VAL 116 1HG2 VAL 116 7.594 -14.223 -1.418 868 HG23 VAL 116 2HG2 VAL 116 6.848 -15.642 -2.152 869 H ALA 117 H ALA 117 3.873 -12.879 0.181 870 HA ALA 117 HA ALA 117 1.685 -11.850 -1.251 871 HB1 ALA 117 1HB ALA 117 0.417 -12.292 0.618 872 HB2 ALA 117 2HB ALA 117 1.789 -13.374 0.866 873 HB3 ALA 117 3HB ALA 117 1.706 -11.840 1.733 874 H TRP 118 H TRP 118 3.906 -10.360 1.044 875 HA TRP 118 HA TRP 118 2.486 -7.918 1.314 876 HB2 TRP 118 1HB TRP 118 4.222 -8.731 2.912 877 HB3 TRP 118 2HB TRP 118 5.449 -8.396 1.693 878 HD1 TRP 118 HD TRP 118 3.392 -6.736 4.372 879 HE1 TRP 118 1HE TRP 118 4.021 -4.244 4.520 880 HE3 TRP 118 3HE TRP 118 6.232 -6.362 0.137 881 HZ2 TRP 118 2HZ TRP 118 5.521 -2.369 3.037 882 HZ3 TRP 118 3HZ TRP 118 7.227 -4.184 -0.427 883 HH2 TRP 118 HH TRP 118 6.878 -2.229 0.994 884 H LEU 119 H LEU 119 5.379 -8.770 -0.588 885 HA LEU 119 HA LEU 119 5.910 -6.414 -1.837 886 HB2 LEU 119 1HB LEU 119 5.901 -9.134 -3.136 887 HB3 LEU 119 2HB LEU 119 6.754 -7.714 -3.736 888 HG LEU 119 HG LEU 119 7.335 -9.052 -1.096 889 HD11 LEU 119 1HD1 LEU 119 8.292 -9.590 -3.844 890 HD12 LEU 119 2HD1 LEU 119 8.125 -10.676 -2.464 891 HD13 LEU 119 3HD1 LEU 119 9.500 -9.576 -2.559 892 HD21 LEU 119 3HD2 LEU 119 7.889 -6.557 -1.582 893 HD22 LEU 119 1HD2 LEU 119 9.166 -7.227 -2.597 894 HD23 LEU 119 2HD2 LEU 119 9.120 -7.604 -0.875 895 H VAL 120 H VAL 120 3.723 -8.897 -3.178 896 HA VAL 120 HA VAL 120 2.756 -7.340 -5.296 897 HB VAL 120 HB VAL 120 2.420 -9.724 -5.307 898 HG11 VAL 120 1HG1 VAL 120 2.043 -9.678 -2.711 899 HG12 VAL 120 2HG1 VAL 120 0.343 -9.591 -3.174 900 HG13 VAL 120 3HG1 VAL 120 1.333 -10.952 -3.702 901 HG21 VAL 120 3HG2 VAL 120 0.809 -8.497 -6.585 902 HG22 VAL 120 1HG2 VAL 120 -0.030 -9.822 -5.779 903 HG23 VAL 120 2HG2 VAL 120 -0.165 -8.180 -5.150 904 H ALA 121 H ALA 121 1.529 -7.790 -2.004 905 HA ALA 121 HA ALA 121 -0.876 -6.422 -2.217 906 HB1 ALA 121 1HB ALA 121 0.944 -7.159 -0.030 907 HB2 ALA 121 2HB ALA 121 -0.126 -5.797 0.308 908 HB3 ALA 121 3HB ALA 121 -0.804 -7.353 -0.172 909 H MET 122 H MET 122 2.208 -5.081 -1.009 910 HA MET 122 HA MET 122 1.575 -2.483 -0.650 911 HB2 MET 122 1HB MET 122 3.843 -3.521 -0.372 912 HB3 MET 122 2HB MET 122 4.073 -3.355 -2.108 913 HG2 MET 122 1HG MET 122 5.165 -1.518 -1.170 914 HG3 MET 122 2HG MET 122 3.641 -0.880 -1.782 915 HE1 MET 122 3HE MET 122 4.223 1.452 0.651 916 HE2 MET 122 1HE MET 122 3.421 0.994 -0.852 917 HE3 MET 122 2HE MET 122 2.482 1.166 0.631 918 H HIS 123 H HIS 123 2.616 -3.824 -3.787 919 HA HIS 123 HA HIS 123 2.224 -1.486 -5.278 920 HB2 HIS 123 1HB HIS 123 3.522 -3.308 -6.183 921 HB3 HIS 123 2HB HIS 123 2.132 -4.388 -6.121 922 HD2 HIS 123 2HD HIS 123 1.912 -0.807 -7.719 923 HE1 HIS 123 1HE HIS 123 1.399 -3.720 -10.761 924 HE2 HIS 123 2HE HIS 123 1.436 -1.260 -10.221 925 H LYS 124 H LYS 124 0.103 -4.346 -5.048 926 HA LYS 124 HA LYS 124 -2.018 -3.624 -6.541 927 HB2 LYS 124 1HB LYS 124 -2.021 -4.905 -3.809 928 HB3 LYS 124 2HB LYS 124 -3.474 -4.756 -4.789 929 HG2 LYS 124 1HG LYS 124 -0.975 -6.144 -5.724 930 HG3 LYS 124 2HG LYS 124 -2.318 -6.966 -4.926 931 HD2 LYS 124 1HD LYS 124 -3.753 -5.812 -6.775 932 HD3 LYS 124 2HD LYS 124 -2.210 -5.681 -7.623 933 HE2 LYS 124 1HE LYS 124 -1.957 -8.186 -7.137 934 HE3 LYS 124 2HE LYS 124 -3.678 -8.152 -6.758 935 HZ1 LYS 124 3HZ LYS 124 -2.381 -8.123 -9.304 936 HZ2 LYS 124 1HZ LYS 124 -3.490 -6.854 -9.149 937 HZ3 LYS 124 2HZ LYS 124 -3.996 -8.451 -8.923 938 H ALA 125 H ALA 125 -1.749 -2.738 -3.093 939 HA ALA 125 HA ALA 125 -3.946 -0.953 -3.151 940 HB1 ALA 125 1HB ALA 125 -1.663 -1.245 -1.208 941 HB2 ALA 125 2HB ALA 125 -3.034 -0.163 -0.960 942 HB3 ALA 125 3HB ALA 125 -3.293 -1.904 -1.064 943 H ALA 126 H ALA 126 -0.441 -0.458 -3.366 944 HA ALA 126 HA ALA 126 -0.267 2.274 -3.286 945 HB1 ALA 126 1HB ALA 126 1.831 1.547 -3.539 946 HB2 ALA 126 2HB ALA 126 1.324 0.120 -4.444 947 HB3 ALA 126 3HB ALA 126 1.522 1.665 -5.271 948 H LYS 127 H LYS 127 -1.610 0.293 -5.804 949 HA LYS 127 HA LYS 127 -1.543 2.184 -7.905 950 HB2 LYS 127 1HB LYS 127 -3.207 -0.261 -7.362 951 HB3 LYS 127 2HB LYS 127 -3.516 0.752 -8.766 952 HG2 LYS 127 1HG LYS 127 -1.437 0.260 -9.721 953 HG3 LYS 127 2HG LYS 127 -0.795 -0.374 -8.204 954 HD2 LYS 127 1HD LYS 127 -1.245 -2.330 -9.315 955 HD3 LYS 127 2HD LYS 127 -2.773 -2.090 -8.465 956 HE2 LYS 127 1HE LYS 127 -3.364 -0.746 -10.667 957 HE3 LYS 127 2HE LYS 127 -2.131 -1.801 -11.355 958 HZ1 LYS 127 3HZ LYS 127 -3.528 -3.509 -11.332 959 HZ2 LYS 127 1HZ LYS 127 -4.768 -2.420 -10.959 960 HZ3 LYS 127 2HZ LYS 127 -3.965 -3.245 -9.719 961 H LEU 128 H LEU 128 -4.268 1.185 -5.827 962 HA LEU 128 HA LEU 128 -6.207 2.898 -6.622 963 HB2 LEU 128 1HB LEU 128 -5.457 1.855 -3.931 964 HB3 LEU 128 2HB LEU 128 -6.760 3.034 -4.064 965 HG LEU 128 HG LEU 128 -6.731 0.412 -5.549 966 HD11 LEU 128 1HD1 LEU 128 -7.189 -0.596 -3.626 967 HD12 LEU 128 2HD1 LEU 128 -8.682 0.341 -3.558 968 HD13 LEU 128 3HD1 LEU 128 -7.227 0.941 -2.761 969 HD21 LEU 128 3HD2 LEU 128 -8.799 0.946 -6.309 970 HD22 LEU 128 1HD2 LEU 128 -8.174 2.585 -6.123 971 HD23 LEU 128 2HD2 LEU 128 -9.207 1.888 -4.874 972 H LEU 129 H LEU 129 -3.589 3.677 -4.355 973 HA LEU 129 HA LEU 129 -4.198 6.157 -3.495 974 HB2 LEU 129 1HB LEU 129 -1.656 4.873 -4.304 975 HB3 LEU 129 2HB LEU 129 -1.627 6.618 -4.065 976 HG LEU 129 HG LEU 129 -2.766 4.883 -1.921 977 HD11 LEU 129 1HD1 LEU 129 -0.076 4.670 -2.916 978 HD12 LEU 129 2HD1 LEU 129 -0.872 3.765 -1.629 979 HD13 LEU 129 3HD1 LEU 129 -0.082 5.300 -1.269 980 HD21 LEU 129 3HD2 LEU 129 -2.983 7.010 -1.198 981 HD22 LEU 129 1HD2 LEU 129 -1.691 7.612 -2.237 982 HD23 LEU 129 2HD2 LEU 129 -1.297 6.791 -0.726 983 H TYR 130 H TYR 130 -2.443 5.608 -6.555 984 HA TYR 130 HA TYR 130 -3.351 8.250 -7.461 985 HB2 TYR 130 1HB TYR 130 -1.308 6.661 -8.954 986 HB3 TYR 130 2HB TYR 130 -1.458 8.406 -8.776 987 HD1 TYR 130 2HD TYR 130 -0.607 9.528 -6.770 988 HD2 TYR 130 1HD TYR 130 -0.118 5.339 -7.326 989 HE1 TYR 130 2HE TYR 130 1.100 9.498 -4.999 990 HE2 TYR 130 1HE TYR 130 1.589 5.297 -5.556 991 HH TYR 130 HH TYR 130 2.046 6.941 -3.401 992 H GLU 131 H GLU 131 -2.732 5.029 -8.871 993 HA GLU 131 HA GLU 131 -4.009 5.247 -11.253 994 HB2 GLU 131 1HB GLU 131 -4.116 2.884 -9.370 995 HB3 GLU 131 2HB GLU 131 -4.545 2.824 -11.074 996 HG2 GLU 131 1HG GLU 131 -1.851 3.811 -10.259 997 HG3 GLU 131 2HG GLU 131 -2.184 2.080 -10.293 998 H SER 132 H SER 132 -6.125 4.687 -12.028 999 HA SER 132 HA SER 132 -8.264 5.054 -10.038 1000 HB2 SER 132 1HB SER 132 -7.640 7.046 -11.673 1001 HB3 SER 132 2HB SER 132 -8.627 6.122 -12.805 1002 HG SER 132 HG SER 132 -9.803 6.333 -10.365 1003 H ARG 133 H ARG 133 -10.374 4.237 -10.727 1004 HA ARG 133 HA ARG 133 -10.066 1.861 -12.434 1005 HB2 ARG 133 1HB ARG 133 -12.147 2.415 -10.311 1006 HB3 ARG 133 2HB ARG 133 -11.965 0.920 -11.218 1007 HG2 ARG 133 1HG ARG 133 -9.872 2.051 -9.376 1008 HG3 ARG 133 2HG ARG 133 -11.054 0.824 -8.917 1009 HD2 ARG 133 1HD ARG 133 -10.182 -0.629 -10.719 1010 HD3 ARG 133 2HD ARG 133 -8.952 0.585 -11.066 1011 HE ARG 133 HE ARG 133 -8.902 -0.196 -8.332 1012 HH11 ARG 133 1HH1 ARG 133 -7.961 -1.198 -11.530 1013 HH12 ARG 133 2HH1 ARG 133 -6.639 -2.173 -10.978 1014 HH21 ARG 133 1HH2 ARG 133 -7.165 -1.476 -7.592 1015 HH22 ARG 133 2HH2 ARG 133 -6.188 -2.331 -8.737 1016 H ASP 134 H ASP 134 -11.488 1.445 -14.085 1017 HA ASP 134 HA ASP 134 -13.291 3.661 -14.799 1018 HB2 ASP 134 1HB ASP 134 -11.668 1.758 -16.465 1019 HB3 ASP 134 2HB ASP 134 -13.073 2.575 -17.146 1020 H GLN 135 H GLN 135 -12.981 0.134 -15.238 1021 HA GLN 135 HA GLN 135 -15.912 -0.047 -14.996 1022 HB2 GLN 135 1HB GLN 135 -14.018 -1.706 -16.662 1023 HB3 GLN 135 2HB GLN 135 -15.700 -2.139 -16.381 1024 HG2 GLN 135 1HG GLN 135 -14.725 0.367 -17.734 1025 HG3 GLN 135 2HG GLN 135 -15.404 -1.049 -18.534 1026 HE21 GLN 135 1HE2 GLN 135 -16.310 1.728 -18.532 1027 HE22 GLN 135 2HE2 GLN 135 -17.936 1.698 -17.949 1028 H SER 136 H SER 136 -12.871 -1.803 -14.453 1029 HA SER 136 HA SER 136 -13.598 -4.005 -13.114 1030 HB2 SER 136 1HB SER 136 -11.397 -2.054 -12.458 1031 HB3 SER 136 2HB SER 136 -11.595 -3.559 -11.560 1032 HG SER 136 HG SER 136 -10.407 -3.198 -13.899 1033 H GLY 137 H GLY 137 -14.661 -4.575 -11.315 1034 HA2 GLY 137 1HA GLY 137 -15.571 -2.401 -9.547 1035 HA3 GLY 137 2HA GLY 137 -16.409 -3.926 -9.789 1036 HA PRO 138 HA PRO 138 -14.603 -5.345 -6.043 1037 HB2 PRO 138 1HB PRO 138 -14.847 -8.021 -6.429 1038 HB3 PRO 138 2HB PRO 138 -16.222 -6.975 -6.054 1039 HG2 PRO 138 1HG PRO 138 -15.318 -8.040 -8.702 1040 HG3 PRO 138 2HG PRO 138 -16.962 -7.919 -8.046 1041 HD2 PRO 138 1HD PRO 138 -15.968 -6.136 -9.826 1042 HD3 PRO 138 2HD PRO 138 -17.142 -5.682 -8.575 1043 H SER 139 H SER 139 -12.872 -6.797 -5.232 1044 HA SER 139 HA SER 139 -10.533 -6.554 -6.897 1045 HB2 SER 139 1HB SER 139 -9.348 -7.487 -4.901 1046 HB3 SER 139 2HB SER 139 -10.309 -6.053 -4.541 1047 HG SER 139 HG SER 139 -10.661 -8.683 -3.733 1048 H SER 140 H SER 140 -12.446 -9.196 -5.521 1049 HA SER 140 HA SER 140 -11.299 -10.989 -7.536 1050 HB2 SER 140 1HB SER 140 -10.058 -11.415 -5.462 1051 HB3 SER 140 2HB SER 140 -11.574 -11.673 -4.598 1052 HG SER 140 HG SER 140 -11.410 -13.664 -5.219 1053 H GLY 141 H GLY 141 -12.713 -12.454 -8.387 1054 HA2 GLY 141 1HA GLY 141 -14.683 -13.657 -8.646 1055 HA3 GLY 141 2HA GLY 141 -15.239 -13.021 -7.105 Start of MODEL 4 1 H1 GLY 1 H GLY 1 -14.271 9.903 9.520 2 HA2 GLY 1 1HA GLY 1 -16.506 9.711 7.596 3 HA3 GLY 1 2HA GLY 1 -14.860 9.253 7.186 4 H SER 2 H SER 2 -17.786 8.035 7.947 5 HA SER 2 HA SER 2 -17.245 6.006 9.812 6 HB2 SER 2 1HB SER 2 -19.261 4.883 8.812 7 HB3 SER 2 2HB SER 2 -19.529 6.560 9.289 8 HG SER 2 HG SER 2 -19.631 5.409 6.812 9 H SER 3 H SER 3 -17.563 5.691 6.271 10 HA SER 3 HA SER 3 -16.634 3.076 6.082 11 HB2 SER 3 1HB SER 3 -16.399 3.457 3.737 12 HB3 SER 3 2HB SER 3 -17.757 4.450 4.268 13 HG SER 3 HG SER 3 -15.279 5.201 3.305 14 H GLY 4 H GLY 4 -14.623 2.173 5.549 15 HA2 GLY 4 1HA GLY 4 -12.238 3.291 4.968 16 HA3 GLY 4 2HA GLY 4 -12.375 3.593 6.694 17 H SER 5 H SER 5 -11.999 1.963 8.122 18 HA SER 5 HA SER 5 -10.372 -0.146 7.446 19 HB2 SER 5 1HB SER 5 -11.019 0.816 9.779 20 HB3 SER 5 2HB SER 5 -12.285 -0.412 9.748 21 HG SER 5 HG SER 5 -10.287 -1.100 10.737 22 H SER 6 H SER 6 -13.897 -0.186 7.856 23 HA SER 6 HA SER 6 -14.061 -2.964 7.065 24 HB2 SER 6 1HB SER 6 -15.593 -2.039 8.774 25 HB3 SER 6 2HB SER 6 -16.275 -0.957 7.560 26 HG SER 6 HG SER 6 -16.348 -3.794 7.563 27 H GLY 7 H GLY 7 -15.041 -3.753 5.187 28 HA2 GLY 7 1HA GLY 7 -16.271 -3.296 3.121 29 HA3 GLY 7 2HA GLY 7 -15.418 -1.762 3.037 30 H ALA 8 H ALA 8 -15.626 -4.418 1.393 31 HA ALA 8 HA ALA 8 -14.280 -5.351 -0.203 32 HB1 ALA 8 1HB ALA 8 -12.511 -4.181 -0.952 33 HB2 ALA 8 2HB ALA 8 -13.082 -2.960 0.185 34 HB3 ALA 8 3HB ALA 8 -11.782 -4.056 0.650 35 H GLU 9 H GLU 9 -14.774 -6.740 2.088 36 HA GLU 9 HA GLU 9 -12.671 -7.650 3.617 37 HB2 GLU 9 1HB GLU 9 -15.228 -8.252 3.621 38 HB3 GLU 9 2HB GLU 9 -14.709 -9.605 2.626 39 HG2 GLU 9 1HG GLU 9 -13.020 -10.087 4.480 40 HG3 GLU 9 2HG GLU 9 -13.979 -8.981 5.462 41 H PHE 10 H PHE 10 -13.409 -8.342 0.293 42 HA PHE 10 HA PHE 10 -11.788 -10.663 0.033 43 HB2 PHE 10 1HB PHE 10 -13.662 -9.761 -1.532 44 HB3 PHE 10 2HB PHE 10 -12.373 -8.799 -2.248 45 HD1 PHE 10 1HD PHE 10 -10.365 -9.990 -3.198 46 HD2 PHE 10 2HD PHE 10 -13.944 -12.012 -2.096 47 HE1 PHE 10 1HE PHE 10 -9.710 -11.905 -4.597 48 HE2 PHE 10 2HE PHE 10 -13.294 -13.931 -3.492 49 HZ PHE 10 HZ PHE 10 -11.174 -13.879 -4.744 50 H TYR 11 H TYR 11 -11.167 -7.244 -0.074 51 HA TYR 11 HA TYR 11 -8.481 -7.641 -1.139 52 HB2 TYR 11 1HB TYR 11 -10.172 -5.674 -1.665 53 HB3 TYR 11 2HB TYR 11 -9.464 -4.976 -0.212 54 HD1 TYR 11 2HD TYR 11 -8.243 -6.728 -3.289 55 HD2 TYR 11 1HD TYR 11 -7.754 -3.484 -0.579 56 HE1 TYR 11 2HE TYR 11 -6.339 -5.913 -4.616 57 HE2 TYR 11 1HE TYR 11 -5.850 -2.660 -1.899 58 HH TYR 11 HH TYR 11 -5.047 -2.851 -4.288 59 H ASP 12 H ASP 12 -10.127 -6.974 1.853 60 HA ASP 12 HA ASP 12 -8.071 -5.923 3.395 61 HB2 ASP 12 1HB ASP 12 -10.534 -7.493 3.970 62 HB3 ASP 12 2HB ASP 12 -9.338 -7.361 5.256 63 H LYS 13 H LYS 13 -8.705 -9.236 2.435 64 HA LYS 13 HA LYS 13 -7.122 -10.669 4.161 65 HB2 LYS 13 1HB LYS 13 -7.861 -11.008 1.290 66 HB3 LYS 13 2HB LYS 13 -6.624 -12.063 1.960 67 HG2 LYS 13 1HG LYS 13 -8.137 -12.914 3.599 68 HG3 LYS 13 2HG LYS 13 -9.363 -11.723 3.156 69 HD2 LYS 13 1HD LYS 13 -9.442 -12.737 0.886 70 HD3 LYS 13 2HD LYS 13 -8.333 -13.989 1.451 71 HE2 LYS 13 1HE LYS 13 -10.143 -14.251 3.350 72 HE3 LYS 13 2HE LYS 13 -11.195 -13.526 2.134 73 HZ1 LYS 13 3HZ LYS 13 -10.636 -16.155 2.325 74 HZ2 LYS 13 1HZ LYS 13 -9.543 -15.662 1.131 75 HZ3 LYS 13 2HZ LYS 13 -11.199 -15.388 0.926 76 H GLN 14 H GLN 14 -6.122 -8.756 1.375 77 HA GLN 14 HA GLN 14 -3.348 -9.525 1.668 78 HB2 GLN 14 1HB GLN 14 -4.765 -7.583 -0.154 79 HB3 GLN 14 2HB GLN 14 -3.018 -7.784 -0.150 80 HG2 GLN 14 1HG GLN 14 -5.034 -9.941 -0.739 81 HG3 GLN 14 2HG GLN 14 -4.076 -9.065 -1.932 82 HE21 GLN 14 1HE2 GLN 14 -4.298 -11.938 -0.665 83 HE22 GLN 14 2HE2 GLN 14 -2.639 -12.404 -0.544 84 H LEU 15 H LEU 15 -5.387 -6.740 2.370 85 HA LEU 15 HA LEU 15 -3.432 -4.874 3.020 86 HB2 LEU 15 1HB LEU 15 -6.097 -5.211 4.383 87 HB3 LEU 15 2HB LEU 15 -5.128 -3.741 4.311 88 HG LEU 15 HG LEU 15 -6.544 -5.074 2.004 89 HD11 LEU 15 1HD1 LEU 15 -8.196 -3.555 2.222 90 HD12 LEU 15 2HD1 LEU 15 -7.110 -2.293 2.803 91 HD13 LEU 15 3HD1 LEU 15 -7.671 -3.550 3.906 92 HD21 LEU 15 3HD2 LEU 15 -5.762 -2.576 1.185 93 HD22 LEU 15 1HD2 LEU 15 -4.973 -4.093 0.754 94 HD23 LEU 15 2HD2 LEU 15 -4.365 -3.137 2.105 95 H LYS 16 H LYS 16 -5.112 -7.153 5.180 96 HA LYS 16 HA LYS 16 -3.825 -6.497 7.548 97 HB2 LYS 16 1HB LYS 16 -4.415 -8.762 8.313 98 HB3 LYS 16 2HB LYS 16 -5.753 -7.983 7.479 99 HG2 LYS 16 1HG LYS 16 -5.335 -9.279 5.494 100 HG3 LYS 16 2HG LYS 16 -3.890 -9.986 6.222 101 HD2 LYS 16 1HD LYS 16 -5.414 -10.872 8.045 102 HD3 LYS 16 2HD LYS 16 -6.765 -10.403 7.010 103 HE2 LYS 16 1HE LYS 16 -6.287 -12.726 6.642 104 HE3 LYS 16 2HE LYS 16 -5.802 -11.819 5.210 105 HZ1 LYS 16 3HZ LYS 16 -3.756 -12.597 5.425 106 HZ2 LYS 16 1HZ LYS 16 -4.245 -13.534 6.746 107 HZ3 LYS 16 2HZ LYS 16 -3.631 -11.978 6.994 108 H VAL 17 H VAL 17 -2.783 -8.611 4.932 109 HA VAL 17 HA VAL 17 -0.570 -9.774 6.220 110 HB VAL 17 HB VAL 17 -1.214 -9.299 3.323 111 HG11 VAL 17 1HG1 VAL 17 1.334 -10.281 4.531 112 HG12 VAL 17 2HG1 VAL 17 0.776 -10.953 2.998 113 HG13 VAL 17 3HG1 VAL 17 1.083 -9.222 3.143 114 HG21 VAL 17 3HG2 VAL 17 -1.631 -11.624 3.247 115 HG22 VAL 17 1HG2 VAL 17 -0.849 -11.890 4.805 116 HG23 VAL 17 2HG2 VAL 17 -2.396 -11.046 4.727 117 H LEU 18 H LEU 18 -0.868 -6.837 4.261 118 HA LEU 18 HA LEU 18 1.864 -6.174 4.204 119 HB2 LEU 18 1HB LEU 18 -0.677 -4.658 3.826 120 HB3 LEU 18 2HB LEU 18 0.844 -3.775 3.948 121 HG LEU 18 HG LEU 18 0.424 -5.970 1.935 122 HD11 LEU 18 1HD1 LEU 18 -0.007 -3.026 1.470 123 HD12 LEU 18 2HD1 LEU 18 -1.308 -4.197 1.682 124 HD13 LEU 18 3HD1 LEU 18 -0.211 -4.338 0.309 125 HD21 LEU 18 3HD2 LEU 18 2.507 -5.513 1.318 126 HD22 LEU 18 1HD2 LEU 18 2.648 -4.478 2.739 127 HD23 LEU 18 2HD2 LEU 18 2.148 -3.790 1.193 128 H LEU 19 H LEU 19 -0.725 -4.784 6.232 129 HA LEU 19 HA LEU 19 0.641 -3.115 7.843 130 HB2 LEU 19 1HB LEU 19 -1.426 -5.118 8.738 131 HB3 LEU 19 2HB LEU 19 -0.916 -3.712 9.669 132 HG LEU 19 HG LEU 19 -2.237 -3.557 6.962 133 HD11 LEU 19 1HD1 LEU 19 -3.720 -2.700 9.345 134 HD12 LEU 19 2HD1 LEU 19 -3.473 -4.440 9.207 135 HD13 LEU 19 3HD1 LEU 19 -4.272 -3.557 7.906 136 HD21 LEU 19 3HD2 LEU 19 -1.458 -1.468 7.072 137 HD22 LEU 19 1HD2 LEU 19 -1.009 -1.631 8.770 138 HD23 LEU 19 2HD2 LEU 19 -2.666 -1.213 8.332 139 H SER 20 H SER 20 0.215 -6.568 8.648 140 HA SER 20 HA SER 20 1.726 -6.812 10.869 141 HB2 SER 20 1HB SER 20 0.558 -8.635 9.416 142 HB3 SER 20 2HB SER 20 2.144 -8.814 8.667 143 HG SER 20 HG SER 20 2.969 -9.529 10.540 144 H GLY 21 H GLY 21 2.997 -6.734 7.553 145 HA2 GLY 21 1HA GLY 21 5.038 -5.793 6.889 146 HA3 GLY 21 2HA GLY 21 5.522 -5.707 8.576 147 H ALA 22 H ALA 22 6.921 -6.744 6.164 148 HA ALA 22 HA ALA 22 7.507 -9.433 7.215 149 HB1 ALA 22 1HB ALA 22 8.110 -9.162 4.394 150 HB2 ALA 22 2HB ALA 22 7.181 -10.402 5.237 151 HB3 ALA 22 3HB ALA 22 6.398 -8.904 4.734 152 H THR 23 H THR 23 9.701 -10.187 6.108 153 HA THR 23 HA THR 23 11.632 -8.056 6.701 154 HB THR 23 HB THR 23 12.284 -10.988 6.468 155 HG1 THR 23 1HG THR 23 11.798 -11.220 8.609 156 HG21 THR 23 3HG2 THR 23 14.104 -9.249 6.464 157 HG22 THR 23 1HG2 THR 23 14.213 -10.439 7.760 158 HG23 THR 23 2HG2 THR 23 13.600 -8.820 8.099 159 H PHE 24 H PHE 24 13.377 -7.633 5.337 160 HA PHE 24 HA PHE 24 13.648 -9.037 2.829 161 HB2 PHE 24 1HB PHE 24 12.953 -6.097 2.751 162 HB3 PHE 24 2HB PHE 24 13.182 -7.178 1.380 163 HD1 PHE 24 1HD PHE 24 10.942 -6.261 4.142 164 HD2 PHE 24 2HD PHE 24 11.440 -8.631 0.642 165 HE1 PHE 24 1HE PHE 24 8.532 -6.755 4.138 166 HE2 PHE 24 2HE PHE 24 9.031 -9.129 0.632 167 HZ PHE 24 HZ PHE 24 7.573 -8.190 2.381 168 H LEU 25 H LEU 25 15.385 -7.917 1.449 169 HA LEU 25 HA LEU 25 17.511 -7.004 3.264 170 HB2 LEU 25 1HB LEU 25 17.529 -8.564 0.711 171 HB3 LEU 25 2HB LEU 25 18.967 -7.688 1.230 172 HG LEU 25 HG LEU 25 17.593 -9.820 2.862 173 HD11 LEU 25 1HD1 LEU 25 19.808 -9.952 0.858 174 HD12 LEU 25 2HD1 LEU 25 18.430 -11.030 1.077 175 HD13 LEU 25 3HD1 LEU 25 19.769 -11.067 2.224 176 HD21 LEU 25 3HD2 LEU 25 18.787 -8.747 4.452 177 HD22 LEU 25 1HD2 LEU 25 19.883 -8.007 3.286 178 HD23 LEU 25 2HD2 LEU 25 20.116 -9.686 3.771 179 H VAL 26 H VAL 26 18.007 -4.925 3.170 180 HA VAL 26 HA VAL 26 17.364 -3.412 0.738 181 HB VAL 26 HB VAL 26 18.001 -2.394 3.511 182 HG11 VAL 26 1HG1 VAL 26 18.527 -0.545 2.330 183 HG12 VAL 26 2HG1 VAL 26 17.636 -1.074 0.901 184 HG13 VAL 26 3HG1 VAL 26 16.776 -0.346 2.258 185 HG21 VAL 26 3HG2 VAL 26 15.608 -1.811 3.594 186 HG22 VAL 26 1HG2 VAL 26 15.374 -2.625 2.047 187 HG23 VAL 26 2HG2 VAL 26 15.870 -3.550 3.464 188 H THR 27 H THR 27 18.894 -2.401 -0.444 189 HA THR 27 HA THR 27 21.674 -2.530 0.528 190 HB THR 27 HB THR 27 20.856 -2.789 -2.368 191 HG1 THR 27 1HG THR 27 21.838 -4.940 -0.831 192 HG21 THR 27 3HG2 THR 27 23.135 -3.480 -2.726 193 HG22 THR 27 1HG2 THR 27 23.467 -3.436 -0.995 194 HG23 THR 27 2HG2 THR 27 23.145 -1.939 -1.870 195 H PHE 28 H PHE 28 22.332 -0.529 0.949 196 HA PHE 28 HA PHE 28 21.218 1.736 -0.481 197 HB2 PHE 28 1HB PHE 28 23.230 1.587 1.774 198 HB3 PHE 28 2HB PHE 28 22.588 3.083 1.102 199 HD1 PHE 28 2HD PHE 28 20.300 3.757 1.527 200 HD2 PHE 28 1HD PHE 28 21.882 0.168 3.179 201 HE1 PHE 28 2HE PHE 28 18.402 3.644 3.089 202 HE2 PHE 28 1HE PHE 28 19.986 0.049 4.743 203 HZ PHE 28 HZ PHE 28 18.244 1.789 4.700 204 H GLY 29 H GLY 29 22.347 3.139 -1.802 205 HA2 GLY 29 1HA GLY 29 24.136 2.230 -3.617 206 HA3 GLY 29 2HA GLY 29 24.073 3.917 -3.130 207 H ASN 30 H ASN 30 24.962 3.619 -0.469 208 HA ASN 30 HA ASN 30 27.784 3.501 -0.928 209 HB2 ASN 30 1HB ASN 30 26.173 3.868 1.606 210 HB3 ASN 30 2HB ASN 30 27.929 3.983 1.527 211 HD21 ASN 30 1HD2 ASN 30 28.874 5.774 0.645 212 HD22 ASN 30 2HD2 ASN 30 27.990 7.193 0.208 213 H SER 31 H SER 31 25.427 1.477 0.755 214 HA SER 31 HA SER 31 27.455 -0.397 1.617 215 HB2 SER 31 1HB SER 31 24.447 -0.698 1.751 216 HB3 SER 31 2HB SER 31 25.649 -1.604 2.671 217 HG SER 31 HG SER 31 24.578 0.236 3.755 218 H GLU 32 H GLU 32 28.233 -1.957 0.377 219 HA GLU 32 HA GLU 32 26.902 -2.653 -2.104 220 HB2 GLU 32 1HB GLU 32 28.921 -3.929 -2.600 221 HB3 GLU 32 2HB GLU 32 29.331 -2.300 -2.083 222 HG2 GLU 32 1HG GLU 32 30.065 -3.042 0.027 223 HG3 GLU 32 2HG GLU 32 29.340 -4.634 -0.198 224 H LYS 33 H LYS 33 26.965 -3.785 1.077 225 HA LYS 33 HA LYS 33 26.092 -6.471 0.246 226 HB2 LYS 33 1HB LYS 33 27.823 -6.888 1.707 227 HB3 LYS 33 2HB LYS 33 27.514 -5.440 2.656 228 HG2 LYS 33 1HG LYS 33 25.914 -6.453 3.942 229 HG3 LYS 33 2HG LYS 33 25.503 -7.633 2.695 230 HD2 LYS 33 1HD LYS 33 26.685 -8.643 4.613 231 HD3 LYS 33 2HD LYS 33 27.567 -8.830 3.096 232 HE2 LYS 33 1HE LYS 33 29.188 -8.206 4.679 233 HE3 LYS 33 2HE LYS 33 28.849 -6.739 3.762 234 HZ1 LYS 33 3HZ LYS 33 27.542 -7.366 6.348 235 HZ2 LYS 33 1HZ LYS 33 27.539 -5.892 5.518 236 HZ3 LYS 33 2HZ LYS 33 28.965 -6.459 6.229 237 HA PRO 34 HA PRO 34 21.989 -5.378 1.460 238 HB2 PRO 34 1HB PRO 34 20.965 -7.888 1.605 239 HB3 PRO 34 2HB PRO 34 21.300 -7.075 0.072 240 HG2 PRO 34 1HG PRO 34 22.936 -9.112 1.533 241 HG3 PRO 34 2HG PRO 34 22.580 -8.997 -0.200 242 HD2 PRO 34 1HD PRO 34 24.929 -8.170 0.862 243 HD3 PRO 34 2HD PRO 34 24.195 -7.391 -0.554 244 H GLU 35 H GLU 35 20.796 -5.204 3.315 245 HA GLU 35 HA GLU 35 21.777 -6.675 5.672 246 HB2 GLU 35 1HB GLU 35 22.450 -4.293 5.710 247 HB3 GLU 35 2HB GLU 35 20.758 -3.830 5.607 248 HG2 GLU 35 1HG GLU 35 21.372 -3.629 7.871 249 HG3 GLU 35 2HG GLU 35 20.389 -5.087 7.748 250 H THR 36 H THR 36 20.259 -7.350 7.181 251 HA THR 36 HA THR 36 17.655 -7.896 6.146 252 HB THR 36 HB THR 36 18.600 -8.291 8.988 253 HG1 THR 36 1HG THR 36 19.348 -10.287 8.307 254 HG21 THR 36 3HG2 THR 36 16.436 -8.883 9.201 255 HG22 THR 36 1HG2 THR 36 16.938 -10.358 8.377 256 HG23 THR 36 2HG2 THR 36 16.205 -9.042 7.460 257 H MET 37 H MET 37 16.108 -6.406 6.052 258 HA MET 37 HA MET 37 15.636 -4.736 8.421 259 HB2 MET 37 1HB MET 37 15.609 -3.779 5.553 260 HB3 MET 37 2HB MET 37 15.070 -2.832 6.933 261 HG2 MET 37 1HG MET 37 17.410 -3.168 7.871 262 HG3 MET 37 2HG MET 37 17.848 -3.731 6.260 263 HE1 MET 37 3HE MET 37 15.624 -1.108 7.851 264 HE2 MET 37 1HE MET 37 17.120 -0.360 8.410 265 HE3 MET 37 2HE MET 37 16.150 0.432 7.168 266 H THR 38 H THR 38 13.479 -4.188 8.813 267 HA THR 38 HA THR 38 11.557 -5.973 7.536 268 HB THR 38 HB THR 38 11.274 -4.213 9.979 269 HG1 THR 38 1HG THR 38 11.262 -7.037 9.958 270 HG21 THR 38 3HG2 THR 38 9.361 -5.993 8.530 271 HG22 THR 38 1HG2 THR 38 9.084 -4.420 9.275 272 HG23 THR 38 2HG2 THR 38 9.256 -5.856 10.285 273 H CYS 39 H CYS 39 9.772 -5.307 6.418 274 HA CYS 39 HA CYS 39 9.487 -2.412 5.964 275 HB2 CYS 39 1HB CYS 39 9.447 -4.663 3.961 276 HB3 CYS 39 2HB CYS 39 8.716 -3.100 3.615 277 HG CYS 39 HG CYS 39 10.872 -2.015 2.769 278 H ARG 40 H ARG 40 7.541 -1.648 6.444 279 HA ARG 40 HA ARG 40 5.183 -3.327 6.077 280 HB2 ARG 40 1HB ARG 40 4.342 -2.957 8.299 281 HB3 ARG 40 2HB ARG 40 5.953 -3.650 8.427 282 HG2 ARG 40 1HG ARG 40 6.751 -1.213 8.649 283 HG3 ARG 40 2HG ARG 40 5.058 -0.854 8.994 284 HD2 ARG 40 1HD ARG 40 6.663 -2.933 10.469 285 HD3 ARG 40 2HD ARG 40 6.494 -1.263 11.010 286 HE ARG 40 HE ARG 40 3.969 -2.511 10.540 287 HH11 ARG 40 1HH1 ARG 40 6.570 -2.200 12.833 288 HH12 ARG 40 2HH1 ARG 40 5.576 -2.558 14.206 289 HH21 ARG 40 1HH2 ARG 40 2.650 -2.985 12.340 290 HH22 ARG 40 2HH2 ARG 40 3.347 -3.006 13.924 291 H LEU 41 H LEU 41 3.145 -2.034 6.431 292 HA LEU 41 HA LEU 41 3.548 0.661 5.337 293 HB2 LEU 41 1HB LEU 41 1.440 -1.406 5.063 294 HB3 LEU 41 2HB LEU 41 0.932 0.280 4.999 295 HG LEU 41 HG LEU 41 3.146 -0.683 3.231 296 HD11 LEU 41 1HD1 LEU 41 0.675 -0.694 1.821 297 HD12 LEU 41 2HD1 LEU 41 0.536 -1.770 3.210 298 HD13 LEU 41 3HD1 LEU 41 1.832 -2.007 2.039 299 HD21 LEU 41 3HD2 LEU 41 1.001 1.400 2.842 300 HD22 LEU 41 1HD2 LEU 41 2.412 1.118 1.822 301 HD23 LEU 41 2HD2 LEU 41 2.619 1.732 3.462 302 H SER 42 H SER 42 1.813 2.270 5.968 303 HA SER 42 HA SER 42 1.762 2.443 8.844 304 HB2 SER 42 1HB SER 42 1.172 4.683 8.564 305 HB3 SER 42 2HB SER 42 2.111 4.361 7.107 306 HG SER 42 HG SER 42 -0.097 5.429 6.975 307 H ASN 43 H ASN 43 -0.422 3.453 9.737 308 HA ASN 43 HA ASN 43 -2.271 1.410 9.929 309 HB2 ASN 43 1HB ASN 43 -2.397 4.350 10.497 310 HB3 ASN 43 2HB ASN 43 -3.859 3.378 10.632 311 HD21 ASN 43 1HD2 ASN 43 -2.841 4.677 12.804 312 HD22 ASN 43 2HD2 ASN 43 -2.212 3.528 13.930 313 H ASN 44 H ASN 44 -2.289 4.215 7.770 314 HA ASN 44 HA ASN 44 -4.665 3.142 6.424 315 HB2 ASN 44 1HB ASN 44 -4.412 5.614 7.226 316 HB3 ASN 44 2HB ASN 44 -3.429 5.799 5.777 317 HD21 ASN 44 1HD2 ASN 44 -4.688 6.970 4.483 318 HD22 ASN 44 2HD2 ASN 44 -6.286 6.535 3.990 319 H GLN 45 H GLN 45 -1.470 2.748 6.216 320 HA GLN 45 HA GLN 45 -0.064 1.973 4.604 321 HB2 GLN 45 1HB GLN 45 -2.522 1.846 2.851 322 HB3 GLN 45 2HB GLN 45 -1.001 1.002 2.587 323 HG2 GLN 45 1HG GLN 45 -1.486 -0.042 4.917 324 HG3 GLN 45 2HG GLN 45 -3.144 0.460 4.588 325 HE21 GLN 45 1HE2 GLN 45 -2.511 -2.182 4.916 326 HE22 GLN 45 2HE2 GLN 45 -2.678 -3.012 3.410 327 H ARG 46 H ARG 46 -0.614 4.822 4.909 328 HA ARG 46 HA ARG 46 -0.260 5.830 2.181 329 HB2 ARG 46 1HB ARG 46 -1.132 7.029 4.764 330 HB3 ARG 46 2HB ARG 46 -0.320 8.077 3.609 331 HG2 ARG 46 1HG ARG 46 -1.989 7.485 1.913 332 HG3 ARG 46 2HG ARG 46 -2.811 6.465 3.096 333 HD2 ARG 46 1HD ARG 46 -3.944 8.580 2.975 334 HD3 ARG 46 2HD ARG 46 -3.119 8.465 4.530 335 HE ARG 46 HE ARG 46 -1.732 10.193 3.899 336 HH11 ARG 46 1HH1 ARG 46 -3.593 9.102 1.166 337 HH12 ARG 46 2HH1 ARG 46 -3.144 10.440 0.161 338 HH21 ARG 46 1HH2 ARG 46 -1.132 11.958 2.585 339 HH22 ARG 46 2HH2 ARG 46 -1.743 12.063 0.968 340 H TYR 47 H TYR 47 1.622 4.712 4.625 341 HA TYR 47 HA TYR 47 3.947 6.155 3.618 342 HB2 TYR 47 1HB TYR 47 3.408 5.929 6.584 343 HB3 TYR 47 2HB TYR 47 4.774 6.730 5.814 344 HD1 TYR 47 1HD TYR 47 4.140 8.680 4.168 345 HD2 TYR 47 2HD TYR 47 1.588 7.203 7.235 346 HE1 TYR 47 1HE TYR 47 2.888 10.797 4.137 347 HE2 TYR 47 2HE TYR 47 0.329 9.315 7.212 348 HH TYR 47 HH TYR 47 0.919 11.781 4.797 349 H LEU 48 H LEU 48 5.994 5.144 4.306 350 HA LEU 48 HA LEU 48 5.653 2.281 4.914 351 HB2 LEU 48 1HB LEU 48 7.407 3.633 2.890 352 HB3 LEU 48 2HB LEU 48 7.782 2.024 3.503 353 HG LEU 48 HG LEU 48 5.234 2.769 2.071 354 HD11 LEU 48 1HD1 LEU 48 6.164 2.222 0.105 355 HD12 LEU 48 2HD1 LEU 48 7.138 0.930 0.807 356 HD13 LEU 48 3HD1 LEU 48 7.683 2.603 0.917 357 HD21 LEU 48 3HD2 LEU 48 6.005 -0.025 2.149 358 HD22 LEU 48 1HD2 LEU 48 4.468 0.736 2.561 359 HD23 LEU 48 2HD2 LEU 48 5.756 0.643 3.763 360 H PHE 49 H PHE 49 6.859 1.482 6.524 361 HA PHE 49 HA PHE 49 8.965 3.214 7.641 362 HB2 PHE 49 1HB PHE 49 7.380 1.148 9.171 363 HB3 PHE 49 2HB PHE 49 8.434 2.397 9.825 364 HD1 PHE 49 1HD PHE 49 7.468 4.679 8.095 365 HD2 PHE 49 2HD PHE 49 5.382 1.686 10.288 366 HE1 PHE 49 1HE PHE 49 5.539 6.191 8.317 367 HE2 PHE 49 2HE PHE 49 3.450 3.192 10.512 368 HZ PHE 49 HZ PHE 49 3.526 5.447 9.526 369 H LEU 50 H LEU 50 10.853 2.227 8.462 370 HA LEU 50 HA LEU 50 11.273 -0.572 7.669 371 HB2 LEU 50 1HB LEU 50 13.394 1.520 7.321 372 HB3 LEU 50 2HB LEU 50 13.338 -0.109 6.653 373 HG LEU 50 HG LEU 50 11.397 2.028 5.814 374 HD11 LEU 50 1HD1 LEU 50 13.069 1.977 3.751 375 HD12 LEU 50 2HD1 LEU 50 14.228 1.635 5.034 376 HD13 LEU 50 3HD1 LEU 50 13.259 3.107 5.092 377 HD21 LEU 50 3HD2 LEU 50 11.873 0.345 3.709 378 HD22 LEU 50 1HD2 LEU 50 10.515 0.224 4.828 379 HD23 LEU 50 2HD2 LEU 50 11.964 -0.746 5.093 380 H ASP 51 H ASP 51 12.836 -1.712 8.876 381 HA ASP 51 HA ASP 51 13.828 -0.365 11.291 382 HB2 ASP 51 1HB ASP 51 11.706 -1.740 11.686 383 HB3 ASP 51 2HB ASP 51 12.700 -3.159 11.365 384 H GLY 52 H GLY 52 15.857 -0.922 11.916 385 HA2 GLY 52 1HA GLY 52 17.217 -3.277 11.512 386 HA3 GLY 52 2HA GLY 52 17.481 -2.348 10.044 387 H ASP 53 H ASP 53 19.498 -1.604 10.133 388 HA ASP 53 HA ASP 53 21.099 -1.196 12.311 389 HB2 ASP 53 1HB ASP 53 21.031 0.010 9.580 390 HB3 ASP 53 2HB ASP 53 22.133 0.695 10.772 391 H SER 54 H SER 54 18.746 1.037 10.933 392 HA SER 54 HA SER 54 18.708 2.525 13.423 393 HB2 SER 54 1HB SER 54 20.447 3.521 11.718 394 HB3 SER 54 2HB SER 54 19.005 4.167 10.934 395 HG SER 54 HG SER 54 20.265 5.057 13.122 396 H HIS 55 H HIS 55 17.065 4.475 13.065 397 HA HIS 55 HA HIS 55 14.610 3.214 12.205 398 HB2 HIS 55 1HB HIS 55 13.481 4.934 13.347 399 HB3 HIS 55 2HB HIS 55 14.922 4.643 14.316 400 HD2 HIS 55 2HD HIS 55 16.676 6.779 14.510 401 HE1 HIS 55 1HE HIS 55 14.420 9.454 12.111 402 HE2 HIS 55 2HE HIS 55 16.437 9.187 13.595 403 H TYR 56 H TYR 56 13.938 3.320 10.175 404 HA TYR 56 HA TYR 56 14.478 5.778 8.642 405 HB2 TYR 56 1HB TYR 56 14.793 2.912 7.896 406 HB3 TYR 56 2HB TYR 56 14.229 4.022 6.652 407 HD1 TYR 56 1HD TYR 56 15.663 6.300 6.567 408 HD2 TYR 56 2HD TYR 56 17.063 2.551 8.013 409 HE1 TYR 56 1HE TYR 56 17.980 7.008 6.142 410 HE2 TYR 56 2HE TYR 56 19.384 3.249 7.593 411 HH TYR 56 HH TYR 56 20.546 4.926 6.028 412 H GLU 57 H GLU 57 12.848 6.564 7.328 413 HA GLU 57 HA GLU 57 10.317 5.131 7.197 414 HB2 GLU 57 1HB GLU 57 10.627 7.838 8.497 415 HB3 GLU 57 2HB GLU 57 9.082 7.190 7.962 416 HG2 GLU 57 1HG GLU 57 9.333 5.309 9.493 417 HG3 GLU 57 2HG GLU 57 10.889 5.945 10.022 418 H ILE 58 H ILE 58 9.878 5.137 5.098 419 HA ILE 58 HA ILE 58 10.516 7.538 3.521 420 HB ILE 58 HB ILE 58 10.084 4.692 2.608 421 HG12 ILE 58 1HG1 ILE 58 12.591 6.321 2.297 422 HG13 ILE 58 2HG1 ILE 58 12.275 5.431 3.783 423 HG21 ILE 58 1HG2 ILE 58 9.791 5.419 0.529 424 HG22 ILE 58 2HG2 ILE 58 9.645 7.050 1.180 425 HG23 ILE 58 3HG2 ILE 58 11.213 6.457 0.635 426 HD11 ILE 58 3HD1 ILE 58 12.875 4.419 1.054 427 HD12 ILE 58 1HD1 ILE 58 13.524 3.918 2.615 428 HD13 ILE 58 2HD1 ILE 58 11.896 3.433 2.139 429 H GLU 59 H GLU 59 8.766 8.819 3.493 430 HA GLU 59 HA GLU 59 6.096 7.927 3.663 431 HB2 GLU 59 1HB GLU 59 7.246 10.542 2.681 432 HB3 GLU 59 2HB GLU 59 5.529 10.256 2.931 433 HG2 GLU 59 1HG GLU 59 5.911 9.864 5.292 434 HG3 GLU 59 2HG GLU 59 7.646 10.074 5.063 435 H ILE 60 H ILE 60 4.436 7.991 2.061 436 HA ILE 60 HA ILE 60 5.332 6.979 -0.493 437 HB ILE 60 HB ILE 60 2.581 7.360 0.682 438 HG12 ILE 60 1HG1 ILE 60 4.234 4.909 0.042 439 HG13 ILE 60 2HG1 ILE 60 3.862 5.527 1.647 440 HG21 ILE 60 1HG2 ILE 60 3.426 6.754 -2.085 441 HG22 ILE 60 2HG2 ILE 60 2.109 5.785 -1.426 442 HG23 ILE 60 3HG2 ILE 60 1.965 7.541 -1.490 443 HD11 ILE 60 3HD1 ILE 60 2.268 3.948 1.557 444 HD12 ILE 60 1HD1 ILE 60 1.377 5.206 0.701 445 HD13 ILE 60 2HD1 ILE 60 2.214 3.945 -0.206 446 H VAL 61 H VAL 61 4.474 10.001 0.789 447 HA VAL 61 HA VAL 61 3.283 11.216 -1.467 448 HB VAL 61 HB VAL 61 4.022 13.371 -0.410 449 HG11 VAL 61 1HG1 VAL 61 2.093 11.518 0.416 450 HG12 VAL 61 2HG1 VAL 61 2.822 12.144 1.896 451 HG13 VAL 61 3HG1 VAL 61 2.114 13.254 0.722 452 HG21 VAL 61 3HG2 VAL 61 5.586 11.466 1.197 453 HG22 VAL 61 1HG2 VAL 61 5.893 13.162 0.826 454 HG23 VAL 61 2HG2 VAL 61 4.768 12.731 2.113 455 H HIS 62 H HIS 62 6.647 11.127 -0.323 456 HA HIS 62 HA HIS 62 7.718 12.699 -2.405 457 HB2 HIS 62 1HB HIS 62 8.869 10.773 -0.420 458 HB3 HIS 62 2HB HIS 62 9.880 11.377 -1.730 459 HD2 HIS 62 2HD HIS 62 8.470 12.522 1.664 460 HE1 HIS 62 1HE HIS 62 10.518 15.820 -0.048 461 HE2 HIS 62 2HE HIS 62 9.479 14.874 2.042 462 H ILE 63 H ILE 63 7.799 9.162 -1.946 463 HA ILE 63 HA ILE 63 9.046 8.212 -4.082 464 HB ILE 63 HB ILE 63 6.273 7.160 -3.657 465 HG12 ILE 63 1HG1 ILE 63 8.596 7.007 -1.736 466 HG13 ILE 63 2HG1 ILE 63 6.964 7.579 -1.412 467 HG21 ILE 63 1HG2 ILE 63 8.829 5.609 -3.851 468 HG22 ILE 63 2HG2 ILE 63 7.184 5.092 -4.221 469 HG23 ILE 63 3HG2 ILE 63 8.017 6.217 -5.293 470 HD11 ILE 63 3HD1 ILE 63 7.813 4.747 -1.953 471 HD12 ILE 63 1HD1 ILE 63 7.254 5.421 -0.423 472 HD13 ILE 63 2HD1 ILE 63 6.140 5.276 -1.783 473 H SER 64 H SER 64 8.694 7.810 -6.272 474 HA SER 64 HA SER 64 6.507 9.353 -7.506 475 HB2 SER 64 1HB SER 64 8.577 10.550 -7.884 476 HB3 SER 64 2HB SER 64 9.370 9.081 -8.451 477 HG SER 64 HG SER 64 8.425 9.289 -10.336 478 H THR 65 H THR 65 8.665 6.577 -7.746 479 HA THR 65 HA THR 65 6.716 5.312 -9.558 480 HB THR 65 HB THR 65 9.725 5.031 -9.646 481 HG1 THR 65 1HG THR 65 8.083 5.845 -11.789 482 HG21 THR 65 3HG2 THR 65 8.995 2.899 -10.203 483 HG22 THR 65 1HG2 THR 65 9.069 3.692 -11.775 484 HG23 THR 65 2HG2 THR 65 7.517 3.492 -10.960 485 H VAL 66 H VAL 66 6.203 3.188 -9.171 486 HA VAL 66 HA VAL 66 7.595 1.786 -7.011 487 HB VAL 66 HB VAL 66 4.606 2.217 -7.084 488 HG11 VAL 66 1HG1 VAL 66 4.480 0.215 -6.108 489 HG12 VAL 66 2HG1 VAL 66 6.229 0.121 -5.889 490 HG13 VAL 66 3HG1 VAL 66 5.234 0.972 -4.706 491 HG21 VAL 66 3HG2 VAL 66 4.824 3.651 -5.328 492 HG22 VAL 66 1HG2 VAL 66 6.279 2.861 -4.721 493 HG23 VAL 66 2HG2 VAL 66 6.378 3.945 -6.108 494 H GLN 67 H GLN 67 8.260 -0.032 -7.947 495 HA GLN 67 HA GLN 67 6.305 -1.622 -9.448 496 HB2 GLN 67 1HB GLN 67 7.912 -2.163 -11.164 497 HB3 GLN 67 2HB GLN 67 7.765 -0.413 -11.055 498 HG2 GLN 67 1HG GLN 67 9.822 -0.424 -9.626 499 HG3 GLN 67 2HG GLN 67 10.000 -2.134 -10.018 500 HE21 GLN 67 1HE2 GLN 67 10.607 -2.736 -12.080 501 HE22 GLN 67 2HE2 GLN 67 11.236 -1.611 -13.231 502 H ILE 68 H ILE 68 6.649 -3.875 -9.395 503 HA ILE 68 HA ILE 68 8.217 -4.741 -7.085 504 HB ILE 68 HB ILE 68 6.246 -6.359 -8.700 505 HG12 ILE 68 1HG1 ILE 68 5.821 -4.788 -6.148 506 HG13 ILE 68 2HG1 ILE 68 5.132 -4.410 -7.723 507 HG21 ILE 68 1HG2 ILE 68 6.449 -7.181 -5.997 508 HG22 ILE 68 2HG2 ILE 68 6.911 -8.065 -7.450 509 HG23 ILE 68 3HG2 ILE 68 8.085 -7.028 -6.639 510 HD11 ILE 68 3HD1 ILE 68 3.375 -5.637 -7.197 511 HD12 ILE 68 1HD1 ILE 68 4.412 -7.063 -7.155 512 HD13 ILE 68 2HD1 ILE 68 4.133 -6.132 -5.683 513 H LEU 69 H LEU 69 9.876 -6.181 -7.191 514 HA LEU 69 HA LEU 69 11.019 -6.647 -9.826 515 HB2 LEU 69 1HB LEU 69 12.104 -7.224 -7.073 516 HB3 LEU 69 2HB LEU 69 12.990 -7.427 -8.582 517 HG LEU 69 HG LEU 69 12.001 -4.807 -7.457 518 HD11 LEU 69 1HD1 LEU 69 14.820 -5.837 -7.709 519 HD12 LEU 69 2HD1 LEU 69 13.881 -5.859 -6.216 520 HD13 LEU 69 3HD1 LEU 69 14.294 -4.322 -6.974 521 HD21 LEU 69 3HD2 LEU 69 13.411 -5.551 -9.995 522 HD22 LEU 69 1HD2 LEU 69 13.603 -3.951 -9.278 523 HD23 LEU 69 2HD2 LEU 69 12.003 -4.512 -9.766 524 H THR 70 H THR 70 10.703 -8.468 -10.903 525 HA THR 70 HA THR 70 10.135 -10.929 -9.382 526 HB THR 70 HB THR 70 8.780 -11.654 -11.394 527 HG1 THR 70 1HG THR 70 8.674 -8.877 -11.981 528 HG21 THR 70 3HG2 THR 70 7.956 -9.409 -9.585 529 HG22 THR 70 1HG2 THR 70 7.506 -11.112 -9.517 530 HG23 THR 70 2HG2 THR 70 6.833 -10.071 -10.772 531 H GLU 71 H GLU 71 10.532 -12.935 -10.742 532 HA GLU 71 HA GLU 71 12.551 -12.668 -12.800 533 HB2 GLU 71 1HB GLU 71 13.914 -12.557 -10.784 534 HB3 GLU 71 2HB GLU 71 13.161 -14.020 -10.166 535 HG2 GLU 71 1HG GLU 71 14.065 -15.151 -12.275 536 HG3 GLU 71 2HG GLU 71 15.081 -13.721 -12.443 537 H GLY 72 H GLY 72 12.244 -14.190 -14.292 538 HA2 GLY 72 1HA GLY 72 11.659 -16.194 -15.267 539 HA3 GLY 72 2HA GLY 72 11.590 -16.895 -13.657 540 H PHE 73 H PHE 73 9.787 -15.087 -16.076 541 HA PHE 73 HA PHE 73 7.297 -15.702 -14.640 542 HB2 PHE 73 1HB PHE 73 7.503 -13.354 -15.103 543 HB3 PHE 73 2HB PHE 73 7.915 -13.667 -16.786 544 HD1 PHE 73 2HD PHE 73 5.175 -14.040 -14.310 545 HD2 PHE 73 1HD PHE 73 6.260 -13.728 -18.414 546 HE1 PHE 73 2HE PHE 73 2.799 -13.861 -14.921 547 HE2 PHE 73 1HE PHE 73 3.885 -13.548 -19.031 548 HZ PHE 73 HZ PHE 73 2.150 -13.615 -17.284 549 HA PRO 74 HA PRO 74 7.227 -18.829 -17.977 550 HB2 PRO 74 1HB PRO 74 5.723 -20.595 -16.567 551 HB3 PRO 74 2HB PRO 74 7.477 -20.475 -16.393 552 HG2 PRO 74 1HG PRO 74 5.320 -19.324 -14.667 553 HG3 PRO 74 2HG PRO 74 6.827 -20.126 -14.188 554 HD2 PRO 74 1HD PRO 74 6.546 -17.433 -14.184 555 HD3 PRO 74 2HD PRO 74 8.093 -18.231 -14.532 556 HA PRO 75 HA PRO 75 3.271 -17.889 -19.658 557 HB2 PRO 75 1HB PRO 75 2.745 -20.150 -21.066 558 HB3 PRO 75 2HB PRO 75 3.958 -18.966 -21.568 559 HG2 PRO 75 1HG PRO 75 4.330 -21.564 -20.127 560 HG3 PRO 75 2HG PRO 75 5.278 -20.877 -21.459 561 HD2 PRO 75 1HD PRO 75 6.092 -20.759 -18.879 562 HD3 PRO 75 2HD PRO 75 6.473 -19.489 -20.059 563 H GLY 76 H GLY 76 3.692 -20.652 -17.617 564 HA2 GLY 76 1HA GLY 76 0.769 -20.901 -17.304 565 HA3 GLY 76 2HA GLY 76 1.929 -22.163 -16.918 566 H GLY 77 H GLY 77 1.381 -22.465 -14.796 567 HA2 GLY 77 1HA GLY 77 0.878 -20.383 -12.953 568 HA3 GLY 77 2HA GLY 77 1.271 -22.046 -12.542 569 H GLY 78 H GLY 78 2.191 -20.108 -10.910 570 HA2 GLY 78 1HA GLY 78 5.021 -20.511 -11.049 571 HA3 GLY 78 2HA GLY 78 4.579 -18.850 -11.416 572 H ASN 79 H ASN 79 5.362 -21.002 -8.982 573 HA ASN 79 HA ASN 79 3.832 -19.898 -6.844 574 HB2 ASN 79 1HB ASN 79 4.716 -22.146 -6.652 575 HB3 ASN 79 2HB ASN 79 6.364 -21.554 -6.840 576 HD21 ASN 79 1HD2 ASN 79 4.413 -22.788 -4.656 577 HD22 ASN 79 2HD2 ASN 79 4.938 -21.968 -3.229 578 H ALA 80 H ALA 80 7.294 -19.635 -7.668 579 HA ALA 80 HA ALA 80 7.551 -17.327 -5.914 580 HB1 ALA 80 1HB ALA 80 9.922 -17.900 -7.437 581 HB2 ALA 80 2HB ALA 80 9.661 -17.985 -5.695 582 HB3 ALA 80 3HB ALA 80 9.281 -19.375 -6.712 583 H ARG 81 H ARG 81 6.308 -15.788 -7.040 584 HA ARG 81 HA ARG 81 7.144 -15.056 -9.735 585 HB2 ARG 81 1HB ARG 81 4.710 -15.196 -9.008 586 HB3 ARG 81 2HB ARG 81 5.003 -13.736 -8.073 587 HG2 ARG 81 1HG ARG 81 5.211 -12.416 -9.939 588 HG3 ARG 81 2HG ARG 81 5.690 -13.765 -10.971 589 HD2 ARG 81 1HD ARG 81 2.931 -13.335 -9.829 590 HD3 ARG 81 2HD ARG 81 3.423 -12.938 -11.475 591 HE ARG 81 HE ARG 81 4.045 -15.579 -11.201 592 HH11 ARG 81 1HH1 ARG 81 1.156 -13.680 -10.789 593 HH12 ARG 81 2HH1 ARG 81 0.088 -14.973 -11.225 594 HH21 ARG 81 1HH2 ARG 81 2.649 -17.288 -11.776 595 HH22 ARG 81 2HH2 ARG 81 0.938 -17.025 -11.785 596 H ALA 82 H ALA 82 6.413 -13.167 -6.797 597 HA ALA 82 HA ALA 82 8.176 -11.051 -7.631 598 HB1 ALA 82 1HB ALA 82 6.932 -11.283 -4.911 599 HB2 ALA 82 2HB ALA 82 7.361 -9.829 -5.813 600 HB3 ALA 82 3HB ALA 82 5.988 -10.811 -6.324 601 H THR 83 H THR 83 10.282 -10.945 -7.248 602 HA THR 83 HA THR 83 11.380 -12.461 -4.970 603 HB THR 83 HB THR 83 13.423 -12.845 -6.251 604 HG1 THR 83 1HG THR 83 13.350 -11.040 -7.636 605 HG21 THR 83 3HG2 THR 83 10.856 -13.959 -6.867 606 HG22 THR 83 1HG2 THR 83 12.435 -14.744 -6.867 607 HG23 THR 83 2HG2 THR 83 11.852 -13.937 -8.323 608 H GLY 84 H GLY 84 10.509 -9.671 -5.057 609 HA2 GLY 84 1HA GLY 84 12.251 -8.370 -3.502 610 HA3 GLY 84 2HA GLY 84 12.966 -8.117 -5.087 611 H MET 85 H MET 85 12.564 -5.828 -4.364 612 HA MET 85 HA MET 85 10.128 -4.904 -5.625 613 HB2 MET 85 1HB MET 85 9.472 -5.242 -3.258 614 HB3 MET 85 2HB MET 85 10.746 -4.133 -2.767 615 HG2 MET 85 1HG MET 85 8.802 -2.852 -2.737 616 HG3 MET 85 2HG MET 85 9.599 -2.415 -4.246 617 HE1 MET 85 3HE MET 85 6.835 -1.842 -3.281 618 HE2 MET 85 1HE MET 85 5.607 -2.360 -4.437 619 HE3 MET 85 2HE MET 85 5.911 -3.316 -2.986 620 H PHE 86 H PHE 86 10.259 -2.788 -6.372 621 HA PHE 86 HA PHE 86 12.817 -1.407 -5.916 622 HB2 PHE 86 1HB PHE 86 12.496 -2.669 -8.189 623 HB3 PHE 86 2HB PHE 86 11.475 -1.293 -8.593 624 HD1 PHE 86 2HD PHE 86 14.868 -2.072 -7.266 625 HD2 PHE 86 1HD PHE 86 12.434 0.565 -9.555 626 HE1 PHE 86 2HE PHE 86 16.866 -0.784 -7.899 627 HE2 PHE 86 1HE PHE 86 14.429 1.857 -10.193 628 HZ PHE 86 HZ PHE 86 16.648 1.184 -9.364 629 H LEU 87 H LEU 87 12.351 0.415 -4.881 630 HA LEU 87 HA LEU 87 9.987 1.949 -5.743 631 HB2 LEU 87 1HB LEU 87 11.258 1.885 -3.010 632 HB3 LEU 87 2HB LEU 87 9.856 2.846 -3.477 633 HG LEU 87 HG LEU 87 9.804 -0.147 -3.660 634 HD11 LEU 87 1HD1 LEU 87 10.064 -0.280 -1.452 635 HD12 LEU 87 2HD1 LEU 87 8.482 0.489 -1.330 636 HD13 LEU 87 3HD1 LEU 87 9.947 1.468 -1.248 637 HD21 LEU 87 3HD2 LEU 87 7.514 1.630 -2.962 638 HD22 LEU 87 1HD2 LEU 87 7.525 0.086 -3.815 639 HD23 LEU 87 2HD2 LEU 87 8.065 1.551 -4.637 640 H GLN 88 H GLN 88 10.210 4.123 -6.108 641 HA GLN 88 HA GLN 88 12.942 5.208 -5.902 642 HB2 GLN 88 1HB GLN 88 10.892 5.594 -8.083 643 HB3 GLN 88 2HB GLN 88 12.326 6.599 -7.920 644 HG2 GLN 88 1HG GLN 88 13.611 4.359 -7.977 645 HG3 GLN 88 2HG GLN 88 12.119 3.713 -8.657 646 HE21 GLN 88 1HE2 GLN 88 14.313 6.472 -9.062 647 HE22 GLN 88 2HE2 GLN 88 14.261 6.479 -10.789 648 H TYR 89 H TYR 89 13.179 7.120 -4.905 649 HA TYR 89 HA TYR 89 10.948 8.948 -4.623 650 HB2 TYR 89 1HB TYR 89 11.286 9.038 -2.107 651 HB3 TYR 89 2HB TYR 89 10.467 7.608 -2.724 652 HD1 TYR 89 1HD TYR 89 13.798 8.848 -1.624 653 HD2 TYR 89 2HD TYR 89 11.274 5.474 -2.212 654 HE1 TYR 89 1HE TYR 89 15.450 7.422 -0.489 655 HE2 TYR 89 2HE TYR 89 12.918 4.039 -1.077 656 HH TYR 89 HH TYR 89 16.071 4.979 -0.474 657 H THR 90 H THR 90 11.568 11.045 -4.080 658 HA THR 90 HA THR 90 14.448 11.547 -4.339 659 HB THR 90 HB THR 90 13.641 13.955 -4.741 660 HG1 THR 90 1HG THR 90 11.403 13.187 -3.992 661 HG21 THR 90 3HG2 THR 90 14.495 12.795 -6.595 662 HG22 THR 90 1HG2 THR 90 12.901 13.337 -7.118 663 HG23 THR 90 2HG2 THR 90 13.144 11.662 -6.620 664 H VAL 91 H VAL 91 15.529 12.981 -2.957 665 HA VAL 91 HA VAL 91 14.197 13.384 -0.361 666 HB VAL 91 HB VAL 91 17.145 13.132 -0.973 667 HG11 VAL 91 1HG1 VAL 91 17.583 13.388 1.332 668 HG12 VAL 91 2HG1 VAL 91 16.494 14.708 0.904 669 HG13 VAL 91 3HG1 VAL 91 15.873 13.289 1.747 670 HG21 VAL 91 3HG2 VAL 91 15.863 11.253 0.878 671 HG22 VAL 91 1HG2 VAL 91 15.317 11.126 -0.794 672 HG23 VAL 91 2HG2 VAL 91 17.030 10.959 -0.411 673 HA PRO 92 HA PRO 92 14.434 17.740 -1.046 674 HB2 PRO 92 1HB PRO 92 14.046 18.543 1.519 675 HB3 PRO 92 2HB PRO 92 12.745 17.911 0.502 676 HG2 PRO 92 1HG PRO 92 14.352 16.514 2.606 677 HG3 PRO 92 2HG PRO 92 12.608 16.439 2.297 678 HD2 PRO 92 1HD PRO 92 14.318 14.508 1.473 679 HD3 PRO 92 2HD PRO 92 12.852 14.935 0.567 680 H GLY 93 H GLY 93 16.270 18.806 -1.420 681 HA2 GLY 93 1HA GLY 93 18.017 20.172 -0.351 682 HA3 GLY 93 2HA GLY 93 18.340 18.793 0.690 683 H THR 94 H THR 94 18.414 16.717 -1.094 684 HA THR 94 HA THR 94 20.964 17.196 -2.370 685 HB THR 94 HB THR 94 20.209 15.060 -1.075 686 HG1 THR 94 1HG THR 94 21.931 14.172 -1.987 687 HG21 THR 94 3HG2 THR 94 19.244 13.319 -2.401 688 HG22 THR 94 1HG2 THR 94 19.300 14.317 -3.854 689 HG23 THR 94 2HG2 THR 94 18.197 14.731 -2.541 690 H GLU 95 H GLU 95 21.338 16.263 -4.595 691 HA GLU 95 HA GLU 95 19.089 16.995 -6.352 692 HB2 GLU 95 1HB GLU 95 22.061 17.215 -6.863 693 HB3 GLU 95 2HB GLU 95 20.808 17.577 -8.043 694 HG2 GLU 95 1HG GLU 95 20.030 19.427 -6.771 695 HG3 GLU 95 2HG GLU 95 21.044 18.985 -5.399 696 H GLY 96 H GLY 96 18.163 15.229 -7.157 697 HA2 GLY 96 1HA GLY 96 18.785 13.549 -9.003 698 HA3 GLY 96 2HA GLY 96 19.861 12.902 -7.773 699 H VAL 97 H VAL 97 18.458 10.975 -8.420 700 HA VAL 97 HA VAL 97 16.121 10.885 -6.626 701 HB VAL 97 HB VAL 97 16.433 9.451 -9.267 702 HG11 VAL 97 1HG1 VAL 97 14.192 8.603 -8.887 703 HG12 VAL 97 2HG1 VAL 97 15.259 8.109 -7.571 704 HG13 VAL 97 3HG1 VAL 97 14.118 9.433 -7.333 705 HG21 VAL 97 3HG2 VAL 97 14.411 11.549 -8.505 706 HG22 VAL 97 1HG2 VAL 97 15.915 11.909 -9.354 707 HG23 VAL 97 2HG2 VAL 97 14.709 10.862 -10.102 708 H THR 98 H THR 98 15.980 9.192 -5.249 709 HA THR 98 HA THR 98 18.228 7.299 -5.256 710 HB THR 98 HB THR 98 16.357 8.034 -2.996 711 HG1 THR 98 1HG THR 98 18.075 9.576 -3.795 712 HG21 THR 98 3HG2 THR 98 18.509 6.005 -3.292 713 HG22 THR 98 1HG2 THR 98 17.021 5.943 -2.350 714 HG23 THR 98 2HG2 THR 98 18.401 6.870 -1.760 715 H GLN 99 H GLN 99 17.889 5.084 -5.001 716 HA GLN 99 HA GLN 99 15.112 4.168 -5.345 717 HB2 GLN 99 1HB GLN 99 15.810 2.514 -6.928 718 HB3 GLN 99 2HB GLN 99 16.442 4.064 -7.465 719 HG2 GLN 99 1HG GLN 99 18.573 3.320 -6.156 720 HG3 GLN 99 2HG GLN 99 17.887 1.709 -6.357 721 HE21 GLN 99 1HE2 GLN 99 18.428 4.636 -8.295 722 HE22 GLN 99 2HE2 GLN 99 19.015 3.807 -9.692 723 H LEU 100 H LEU 100 14.543 2.249 -4.337 724 HA LEU 100 HA LEU 100 16.557 1.120 -2.507 725 HB2 LEU 100 1HB LEU 100 14.599 2.580 -1.577 726 HB3 LEU 100 2HB LEU 100 13.646 1.121 -1.840 727 HG LEU 100 HG LEU 100 15.472 -0.033 -0.403 728 HD11 LEU 100 1HD1 LEU 100 17.145 1.368 0.115 729 HD12 LEU 100 2HD1 LEU 100 16.042 1.945 1.363 730 HD13 LEU 100 3HD1 LEU 100 16.167 2.808 -0.170 731 HD21 LEU 100 3HD2 LEU 100 12.981 0.877 0.114 732 HD22 LEU 100 1HD2 LEU 100 13.909 1.767 1.321 733 HD23 LEU 100 2HD2 LEU 100 13.977 0.005 1.280 734 H LYS 101 H LYS 101 16.951 -0.957 -2.841 735 HA LYS 101 HA LYS 101 14.991 -2.546 -4.342 736 HB2 LYS 101 1HB LYS 101 17.547 -2.219 -4.961 737 HB3 LYS 101 2HB LYS 101 17.758 -3.524 -3.801 738 HG2 LYS 101 1HG LYS 101 16.139 -4.875 -5.112 739 HG3 LYS 101 2HG LYS 101 16.109 -3.585 -6.318 740 HD2 LYS 101 1HD LYS 101 17.702 -4.983 -7.211 741 HD3 LYS 101 2HD LYS 101 18.712 -3.892 -6.260 742 HE2 LYS 101 1HE LYS 101 18.247 -5.705 -4.383 743 HE3 LYS 101 2HE LYS 101 18.010 -6.742 -5.788 744 HZ1 LYS 101 3HZ LYS 101 20.380 -5.076 -5.860 745 HZ2 LYS 101 1HZ LYS 101 20.182 -6.700 -6.294 746 HZ3 LYS 101 2HZ LYS 101 20.383 -6.277 -4.668 747 H LEU 102 H LEU 102 14.208 -4.474 -3.579 748 HA LEU 102 HA LEU 102 15.003 -5.245 -0.851 749 HB2 LEU 102 1HB LEU 102 12.203 -5.282 -1.964 750 HB3 LEU 102 2HB LEU 102 12.689 -5.784 -0.346 751 HG LEU 102 HG LEU 102 12.901 -2.966 -1.404 752 HD11 LEU 102 1HD1 LEU 102 10.680 -2.949 -1.134 753 HD12 LEU 102 2HD1 LEU 102 11.047 -2.927 0.591 754 HD13 LEU 102 3HD1 LEU 102 10.681 -4.454 -0.213 755 HD21 LEU 102 3HD2 LEU 102 12.852 -3.424 1.475 756 HD22 LEU 102 1HD2 LEU 102 13.925 -2.417 0.503 757 HD23 LEU 102 2HD2 LEU 102 14.252 -4.141 0.676 758 H THR 103 H THR 103 15.158 -7.409 -0.428 759 HA THR 103 HA THR 103 14.340 -9.312 -2.493 760 HB THR 103 HB THR 103 17.145 -9.260 -1.364 761 HG1 THR 103 1HG THR 103 17.537 -8.911 -3.753 762 HG21 THR 103 3HG2 THR 103 16.469 -11.518 -1.794 763 HG22 THR 103 1HG2 THR 103 17.527 -11.017 -3.112 764 HG23 THR 103 2HG2 THR 103 15.781 -11.072 -3.355 765 H VAL 104 H VAL 104 13.875 -11.359 -1.738 766 HA VAL 104 HA VAL 104 13.171 -11.587 0.998 767 HB VAL 104 HB VAL 104 13.328 -13.692 -1.162 768 HG11 VAL 104 1HG1 VAL 104 11.512 -14.518 0.771 769 HG12 VAL 104 2HG1 VAL 104 13.115 -15.192 0.471 770 HG13 VAL 104 3HG1 VAL 104 12.900 -13.935 1.689 771 HG21 VAL 104 3HG2 VAL 104 10.730 -13.396 -0.760 772 HG22 VAL 104 1HG2 VAL 104 11.240 -11.792 -0.234 773 HG23 VAL 104 2HG2 VAL 104 11.619 -12.347 -1.864 774 H VAL 105 H VAL 105 14.254 -12.378 2.694 775 HA VAL 105 HA VAL 105 17.025 -12.829 2.591 776 HB VAL 105 HB VAL 105 15.077 -13.645 4.753 777 HG11 VAL 105 1HG1 VAL 105 16.940 -13.797 6.227 778 HG12 VAL 105 2HG1 VAL 105 17.327 -14.761 4.800 779 HG13 VAL 105 3HG1 VAL 105 18.039 -13.160 5.004 780 HG21 VAL 105 3HG2 VAL 105 16.814 -11.192 4.708 781 HG22 VAL 105 1HG2 VAL 105 15.171 -11.196 4.066 782 HG23 VAL 105 2HG2 VAL 105 15.453 -11.556 5.769 783 H GLU 106 H GLU 106 18.262 -14.662 2.591 784 HA GLU 106 HA GLU 106 16.855 -17.150 1.906 785 HB2 GLU 106 1HB GLU 106 18.948 -17.860 0.847 786 HB3 GLU 106 2HB GLU 106 18.381 -16.335 0.182 787 HG2 GLU 106 1HG GLU 106 19.980 -15.149 1.649 788 HG3 GLU 106 2HG GLU 106 20.597 -16.712 2.181 789 H ASP 107 H ASP 107 19.078 -15.690 4.137 790 HA ASP 107 HA ASP 107 20.244 -17.962 5.269 791 HB2 ASP 107 1HB ASP 107 19.672 -15.197 6.273 792 HB3 ASP 107 2HB ASP 107 20.276 -16.418 7.390 793 H VAL 108 H VAL 108 17.260 -16.252 6.164 794 HA VAL 108 HA VAL 108 16.551 -17.785 8.374 795 HB VAL 108 HB VAL 108 14.714 -16.484 6.357 796 HG11 VAL 108 1HG1 VAL 108 13.970 -16.956 9.204 797 HG12 VAL 108 2HG1 VAL 108 12.941 -16.800 7.779 798 HG13 VAL 108 3HG1 VAL 108 13.846 -18.289 8.056 799 HG21 VAL 108 3HG2 VAL 108 16.558 -15.240 7.906 800 HG22 VAL 108 1HG2 VAL 108 15.039 -14.509 7.387 801 HG23 VAL 108 2HG2 VAL 108 15.164 -15.244 8.985 802 H THR 109 H THR 109 15.499 -19.689 8.674 803 HA THR 109 HA THR 109 15.768 -21.809 7.018 804 HB THR 109 HB THR 109 13.412 -21.352 8.859 805 HG1 THR 109 1HG THR 109 16.077 -22.111 9.246 806 HG21 THR 109 3HG2 THR 109 12.887 -23.583 8.710 807 HG22 THR 109 1HG2 THR 109 14.520 -24.048 8.235 808 HG23 THR 109 2HG2 THR 109 13.444 -23.287 7.063 809 H VAL 110 H VAL 110 12.559 -20.304 7.395 810 HA VAL 110 HA VAL 110 12.175 -20.422 4.499 811 HB VAL 110 HB VAL 110 10.461 -21.854 6.514 812 HG11 VAL 110 1HG1 VAL 110 8.746 -20.828 5.406 813 HG12 VAL 110 2HG1 VAL 110 9.676 -20.632 3.920 814 HG13 VAL 110 3HG1 VAL 110 9.006 -22.208 4.340 815 HG21 VAL 110 3HG2 VAL 110 10.715 -23.727 4.995 816 HG22 VAL 110 1HG2 VAL 110 11.600 -22.713 3.856 817 HG23 VAL 110 2HG2 VAL 110 12.300 -23.089 5.431 818 H GLY 111 H GLY 111 10.967 -18.779 3.709 819 HA2 GLY 111 1HA GLY 111 8.931 -17.413 5.068 820 HA3 GLY 111 2HA GLY 111 10.432 -16.535 5.322 821 H ARG 112 H ARG 112 9.180 -18.270 2.480 822 HA ARG 112 HA ARG 112 9.829 -15.959 0.833 823 HB2 ARG 112 1HB ARG 112 10.390 -18.394 0.244 824 HB3 ARG 112 2HB ARG 112 8.683 -18.566 -0.141 825 HG2 ARG 112 1HG ARG 112 9.607 -18.091 -2.195 826 HG3 ARG 112 2HG ARG 112 9.069 -16.500 -1.653 827 HD2 ARG 112 1HD ARG 112 11.261 -16.230 -2.526 828 HD3 ARG 112 2HD ARG 112 11.391 -16.128 -0.771 829 HE ARG 112 HE ARG 112 12.611 -18.081 -0.768 830 HH11 ARG 112 1HH1 ARG 112 11.213 -17.561 -3.913 831 HH12 ARG 112 2HH1 ARG 112 12.134 -18.816 -4.674 832 HH21 ARG 112 1HH2 ARG 112 13.830 -19.736 -1.757 833 HH22 ARG 112 2HH2 ARG 112 13.622 -20.053 -3.446 834 H ARG 113 H ARG 113 7.042 -18.185 0.975 835 HA ARG 113 HA ARG 113 5.178 -16.868 -0.426 836 HB2 ARG 113 1HB ARG 113 5.037 -18.956 1.222 837 HB3 ARG 113 2HB ARG 113 4.276 -17.763 2.267 838 HG2 ARG 113 1HG ARG 113 3.316 -17.979 -0.534 839 HG3 ARG 113 2HG ARG 113 2.877 -19.254 0.605 840 HD2 ARG 113 1HD ARG 113 1.721 -17.773 1.996 841 HD3 ARG 113 2HD ARG 113 2.501 -16.359 1.288 842 HE ARG 113 HE ARG 113 1.037 -17.615 -0.722 843 HH11 ARG 113 1HH1 ARG 113 0.472 -15.959 2.288 844 HH12 ARG 113 2HH1 ARG 113 -1.090 -15.372 1.822 845 HH21 ARG 113 1HH2 ARG 113 -1.018 -16.848 -1.347 846 HH22 ARG 113 2HH2 ARG 113 -1.937 -15.878 -0.246 847 H GLN 114 H GLN 114 5.672 -16.235 3.053 848 HA GLN 114 HA GLN 114 3.950 -14.134 3.388 849 HB2 GLN 114 1HB GLN 114 5.645 -15.330 5.028 850 HB3 GLN 114 2HB GLN 114 6.645 -13.932 4.657 851 HG2 GLN 114 1HG GLN 114 3.941 -13.984 5.957 852 HG3 GLN 114 2HG GLN 114 5.467 -13.417 6.631 853 HE21 GLN 114 1HE2 GLN 114 2.807 -12.120 6.188 854 HE22 GLN 114 2HE2 GLN 114 3.167 -10.664 5.332 855 H ALA 115 H ALA 115 7.446 -13.589 2.957 856 HA ALA 115 HA ALA 115 7.444 -10.922 2.442 857 HB1 ALA 115 1HB ALA 115 9.320 -12.895 2.308 858 HB2 ALA 115 2HB ALA 115 9.223 -12.373 0.626 859 HB3 ALA 115 3HB ALA 115 9.597 -11.204 1.892 860 H VAL 116 H VAL 116 7.146 -13.447 -0.061 861 HA VAL 116 HA VAL 116 6.839 -11.829 -2.275 862 HB VAL 116 HB VAL 116 5.506 -14.481 -1.715 863 HG11 VAL 116 1HG1 VAL 116 5.997 -13.914 -4.496 864 HG12 VAL 116 2HG1 VAL 116 4.499 -14.392 -3.695 865 HG13 VAL 116 3HG1 VAL 116 4.950 -12.688 -3.782 866 HG21 VAL 116 3HG2 VAL 116 7.948 -14.546 -1.625 867 HG22 VAL 116 1HG2 VAL 116 7.338 -15.413 -3.035 868 HG23 VAL 116 2HG2 VAL 116 8.031 -13.802 -3.222 869 H ALA 117 H ALA 117 4.338 -12.973 -0.034 870 HA ALA 117 HA ALA 117 2.108 -11.927 -1.343 871 HB1 ALA 117 1HB ALA 117 1.260 -11.775 1.163 872 HB2 ALA 117 2HB ALA 117 1.474 -13.322 0.342 873 HB3 ALA 117 3HB ALA 117 2.715 -12.732 1.448 874 H TRP 118 H TRP 118 4.096 -10.462 1.222 875 HA TRP 118 HA TRP 118 2.708 -8.040 1.399 876 HB2 TRP 118 1HB TRP 118 4.386 -8.810 3.050 877 HB3 TRP 118 2HB TRP 118 5.659 -8.515 1.869 878 HD1 TRP 118 HD TRP 118 3.720 -6.830 4.562 879 HE1 TRP 118 1HE TRP 118 4.317 -4.328 4.651 880 HE3 TRP 118 3HE TRP 118 6.285 -6.449 0.156 881 HZ2 TRP 118 2HZ TRP 118 5.693 -2.442 3.064 882 HZ3 TRP 118 3HZ TRP 118 7.209 -4.261 -0.486 883 HH2 TRP 118 HH TRP 118 6.918 -2.300 0.939 884 H LEU 119 H LEU 119 5.208 -9.114 -0.811 885 HA LEU 119 HA LEU 119 5.891 -6.612 -1.903 886 HB2 LEU 119 1HB LEU 119 5.976 -9.383 -3.077 887 HB3 LEU 119 2HB LEU 119 6.647 -7.962 -3.875 888 HG LEU 119 HG LEU 119 7.556 -8.949 -1.176 889 HD11 LEU 119 1HD1 LEU 119 8.645 -10.583 -2.203 890 HD12 LEU 119 2HD1 LEU 119 9.547 -9.367 -3.108 891 HD13 LEU 119 3HD1 LEU 119 8.061 -10.041 -3.777 892 HD21 LEU 119 3HD2 LEU 119 9.153 -7.253 -3.036 893 HD22 LEU 119 1HD2 LEU 119 9.206 -7.358 -1.276 894 HD23 LEU 119 2HD2 LEU 119 7.881 -6.505 -2.069 895 H VAL 120 H VAL 120 3.749 -9.130 -3.250 896 HA VAL 120 HA VAL 120 2.742 -7.529 -5.337 897 HB VAL 120 HB VAL 120 1.441 -9.913 -4.014 898 HG11 VAL 120 1HG1 VAL 120 0.981 -8.967 -6.823 899 HG12 VAL 120 2HG1 VAL 120 0.012 -10.080 -5.856 900 HG13 VAL 120 3HG1 VAL 120 0.021 -8.357 -5.476 901 HG21 VAL 120 3HG2 VAL 120 3.084 -9.869 -6.535 902 HG22 VAL 120 1HG2 VAL 120 3.759 -10.245 -4.950 903 HG23 VAL 120 2HG2 VAL 120 2.504 -11.274 -5.640 904 H ALA 121 H ALA 121 1.441 -8.289 -2.121 905 HA ALA 121 HA ALA 121 -0.998 -6.981 -2.312 906 HB1 ALA 121 1HB ALA 121 0.746 -7.183 0.139 907 HB2 ALA 121 2HB ALA 121 -0.994 -6.897 0.108 908 HB3 ALA 121 3HB ALA 121 -0.344 -8.441 -0.443 909 H MET 122 H MET 122 2.123 -5.683 -1.194 910 HA MET 122 HA MET 122 1.346 -3.126 -0.522 911 HB2 MET 122 1HB MET 122 3.619 -4.080 -0.190 912 HB3 MET 122 2HB MET 122 3.923 -3.879 -1.910 913 HG2 MET 122 1HG MET 122 3.197 -1.593 -0.106 914 HG3 MET 122 2HG MET 122 4.859 -2.104 -0.391 915 HE1 MET 122 3HE MET 122 4.016 0.542 -0.570 916 HE2 MET 122 1HE MET 122 4.568 1.206 -2.108 917 HE3 MET 122 2HE MET 122 2.843 0.993 -1.808 918 H HIS 123 H HIS 123 2.905 -3.914 -3.633 919 HA HIS 123 HA HIS 123 2.378 -1.573 -4.958 920 HB2 HIS 123 1HB HIS 123 3.742 -3.567 -5.762 921 HB3 HIS 123 2HB HIS 123 2.221 -4.266 -6.310 922 HD2 HIS 123 2HD HIS 123 4.954 -2.059 -7.647 923 HE1 HIS 123 1HE HIS 123 1.554 -1.269 -10.059 924 HE2 HIS 123 2HE HIS 123 4.054 -1.046 -9.851 925 H LYS 124 H LYS 124 0.342 -4.498 -5.014 926 HA LYS 124 HA LYS 124 -1.704 -3.730 -6.615 927 HB2 LYS 124 1HB LYS 124 -1.685 -5.320 -4.071 928 HB3 LYS 124 2HB LYS 124 -3.205 -4.996 -4.895 929 HG2 LYS 124 1HG LYS 124 -0.861 -6.231 -6.303 930 HG3 LYS 124 2HG LYS 124 -2.045 -7.192 -5.415 931 HD2 LYS 124 1HD LYS 124 -2.875 -5.226 -7.528 932 HD3 LYS 124 2HD LYS 124 -2.406 -6.878 -7.934 933 HE2 LYS 124 1HE LYS 124 -4.456 -6.361 -5.815 934 HE3 LYS 124 2HE LYS 124 -4.908 -6.319 -7.519 935 HZ1 LYS 124 3HZ LYS 124 -3.514 -8.611 -7.359 936 HZ2 LYS 124 1HZ LYS 124 -5.198 -8.505 -7.247 937 HZ3 LYS 124 2HZ LYS 124 -4.261 -8.576 -5.842 938 H ALA 125 H ALA 125 -1.741 -3.179 -3.087 939 HA ALA 125 HA ALA 125 -3.987 -1.504 -3.078 940 HB1 ALA 125 1HB ALA 125 -3.394 -0.941 -0.833 941 HB2 ALA 125 2HB ALA 125 -2.996 -2.641 -1.089 942 HB3 ALA 125 3HB ALA 125 -1.718 -1.425 -1.098 943 H ALA 126 H ALA 126 -0.552 -0.789 -3.438 944 HA ALA 126 HA ALA 126 -0.507 1.939 -3.128 945 HB1 ALA 126 1HB ALA 126 1.607 1.474 -3.626 946 HB2 ALA 126 2HB ALA 126 1.149 -0.038 -4.411 947 HB3 ALA 126 3HB ALA 126 1.143 1.469 -5.328 948 H LYS 127 H LYS 127 -1.790 0.078 -5.794 949 HA LYS 127 HA LYS 127 -2.004 2.179 -7.672 950 HB2 LYS 127 1HB LYS 127 -3.328 -0.494 -7.353 951 HB3 LYS 127 2HB LYS 127 -3.895 0.627 -8.585 952 HG2 LYS 127 1HG LYS 127 -1.541 0.716 -9.447 953 HG3 LYS 127 2HG LYS 127 -1.162 -0.604 -8.337 954 HD2 LYS 127 1HD LYS 127 -3.500 -0.916 -10.152 955 HD3 LYS 127 2HD LYS 127 -1.882 -1.056 -10.844 956 HE2 LYS 127 1HE LYS 127 -2.839 -2.611 -8.445 957 HE3 LYS 127 2HE LYS 127 -2.886 -3.220 -10.099 958 HZ1 LYS 127 3HZ LYS 127 -0.354 -2.500 -9.965 959 HZ2 LYS 127 1HZ LYS 127 -0.885 -4.033 -9.486 960 HZ3 LYS 127 2HZ LYS 127 -0.606 -2.834 -8.326 961 H LEU 128 H LEU 128 -4.154 0.991 -5.143 962 HA LEU 128 HA LEU 128 -6.398 2.564 -5.859 963 HB2 LEU 128 1HB LEU 128 -5.549 1.006 -3.479 964 HB3 LEU 128 2HB LEU 128 -6.833 2.193 -3.264 965 HG LEU 128 HG LEU 128 -6.880 -0.153 -5.162 966 HD11 LEU 128 1HD1 LEU 128 -7.658 0.193 -2.383 967 HD12 LEU 128 2HD1 LEU 128 -7.479 -1.280 -3.336 968 HD13 LEU 128 3HD1 LEU 128 -8.985 -0.364 -3.402 969 HD21 LEU 128 3HD2 LEU 128 -8.729 2.155 -4.722 970 HD22 LEU 128 1HD2 LEU 128 -9.366 0.588 -5.225 971 HD23 LEU 128 2HD2 LEU 128 -8.185 1.425 -6.234 972 H LEU 129 H LEU 129 -3.616 3.122 -3.780 973 HA LEU 129 HA LEU 129 -4.444 5.394 -2.425 974 HB2 LEU 129 1HB LEU 129 -1.824 4.297 -3.277 975 HB3 LEU 129 2HB LEU 129 -1.864 5.975 -2.739 976 HG LEU 129 HG LEU 129 -2.731 3.582 -1.118 977 HD11 LEU 129 1HD1 LEU 129 -0.647 3.413 -0.377 978 HD12 LEU 129 2HD1 LEU 129 -0.558 5.145 -0.056 979 HD13 LEU 129 3HD1 LEU 129 -0.164 4.524 -1.659 980 HD21 LEU 129 3HD2 LEU 129 -2.965 6.508 -0.731 981 HD22 LEU 129 1HD2 LEU 129 -2.478 5.548 0.666 982 HD23 LEU 129 2HD2 LEU 129 -3.999 5.199 -0.156 983 H TYR 130 H TYR 130 -2.802 5.183 -5.574 984 HA TYR 130 HA TYR 130 -3.083 8.027 -6.011 985 HB2 TYR 130 1HB TYR 130 -2.284 6.161 -8.199 986 HB3 TYR 130 2HB TYR 130 -1.667 7.763 -7.811 987 HD1 TYR 130 2HD TYR 130 -1.076 7.281 -4.882 988 HD2 TYR 130 1HD TYR 130 -0.258 4.956 -8.350 989 HE1 TYR 130 2HE TYR 130 0.850 6.265 -3.739 990 HE2 TYR 130 1HE TYR 130 1.670 3.933 -7.217 991 HH TYR 130 HH TYR 130 2.552 4.854 -3.900 992 H GLU 131 H GLU 131 -4.287 5.069 -7.592 993 HA GLU 131 HA GLU 131 -6.106 6.519 -9.265 994 HB2 GLU 131 1HB GLU 131 -6.008 3.561 -8.645 995 HB3 GLU 131 2HB GLU 131 -6.907 4.312 -9.955 996 HG2 GLU 131 1HG GLU 131 -3.976 4.771 -9.802 997 HG3 GLU 131 2HG GLU 131 -4.562 3.203 -10.356 998 H SER 132 H SER 132 -8.480 5.457 -9.265 999 HA SER 132 HA SER 132 -9.620 6.302 -6.740 1000 HB2 SER 132 1HB SER 132 -10.566 6.987 -8.970 1001 HB3 SER 132 2HB SER 132 -11.071 5.314 -9.204 1002 HG SER 132 HG SER 132 -12.080 7.260 -7.492 1003 H ARG 133 H ARG 133 -11.809 4.889 -6.311 1004 HA ARG 133 HA ARG 133 -10.778 2.351 -5.388 1005 HB2 ARG 133 1HB ARG 133 -13.400 3.787 -5.005 1006 HB3 ARG 133 2HB ARG 133 -13.123 2.159 -4.402 1007 HG2 ARG 133 1HG ARG 133 -12.584 3.347 -2.544 1008 HG3 ARG 133 2HG ARG 133 -11.001 3.300 -3.323 1009 HD2 ARG 133 1HD ARG 133 -11.550 5.547 -2.517 1010 HD3 ARG 133 2HD ARG 133 -11.382 5.505 -4.272 1011 HE ARG 133 HE ARG 133 -14.068 5.134 -3.732 1012 HH11 ARG 133 1HH1 ARG 133 -11.661 7.592 -3.198 1013 HH12 ARG 133 2HH1 ARG 133 -12.797 8.899 -3.252 1014 HH21 ARG 133 1HH2 ARG 133 -15.573 6.846 -3.805 1015 HH22 ARG 133 2HH2 ARG 133 -15.021 8.474 -3.596 1016 H ASP 134 H ASP 134 -11.977 0.334 -5.699 1017 HA ASP 134 HA ASP 134 -12.273 -0.372 -8.352 1018 HB2 ASP 134 1HB ASP 134 -12.012 -1.939 -6.404 1019 HB3 ASP 134 2HB ASP 134 -13.720 -1.695 -6.051 1020 H GLN 135 H GLN 135 -13.579 0.803 -9.652 1021 HA GLN 135 HA GLN 135 -16.124 1.788 -8.915 1022 HB2 GLN 135 1HB GLN 135 -14.643 1.493 -11.498 1023 HB3 GLN 135 2HB GLN 135 -16.350 1.917 -11.528 1024 HG2 GLN 135 1HG GLN 135 -14.404 3.460 -9.858 1025 HG3 GLN 135 2HG GLN 135 -14.610 3.799 -11.576 1026 HE21 GLN 135 1HE2 GLN 135 -15.314 5.902 -10.902 1027 HE22 GLN 135 2HE2 GLN 135 -16.942 6.140 -10.375 1028 H SER 136 H SER 136 -15.115 -1.039 -10.807 1029 HA SER 136 HA SER 136 -17.835 -2.122 -10.465 1030 HB2 SER 136 1HB SER 136 -16.017 -2.165 -12.855 1031 HB3 SER 136 2HB SER 136 -17.212 -3.442 -12.629 1032 HG SER 136 HG SER 136 -17.574 -0.734 -13.192 1033 H GLY 137 H GLY 137 -17.807 -3.751 -9.072 1034 HA2 GLY 137 1HA GLY 137 -15.570 -5.056 -8.086 1035 HA3 GLY 137 2HA GLY 137 -17.202 -5.705 -8.028 1036 HA PRO 138 HA PRO 138 -14.304 -7.824 -11.269 1037 HB2 PRO 138 1HB PRO 138 -12.873 -9.553 -9.741 1038 HB3 PRO 138 2HB PRO 138 -12.296 -7.935 -10.157 1039 HG2 PRO 138 1HG PRO 138 -13.595 -8.892 -7.636 1040 HG3 PRO 138 2HG PRO 138 -12.201 -7.814 -7.837 1041 HD2 PRO 138 1HD PRO 138 -14.689 -6.892 -7.296 1042 HD3 PRO 138 2HD PRO 138 -13.524 -5.978 -8.276 1043 H SER 139 H SER 139 -16.233 -8.751 -8.571 1044 HA SER 139 HA SER 139 -16.631 -11.471 -9.507 1045 HB2 SER 139 1HB SER 139 -17.558 -9.894 -7.128 1046 HB3 SER 139 2HB SER 139 -18.385 -11.389 -7.565 1047 HG SER 139 HG SER 139 -16.806 -12.069 -6.253 1048 H SER 140 H SER 140 -18.862 -12.293 -9.816 1049 HA SER 140 HA SER 140 -20.500 -10.300 -11.240 1050 HB2 SER 140 1HB SER 140 -20.214 -13.269 -11.757 1051 HB3 SER 140 2HB SER 140 -21.323 -12.200 -12.615 1052 HG SER 140 HG SER 140 -18.504 -12.249 -12.671 1053 H GLY 141 H GLY 141 -22.689 -10.218 -10.881 1054 HA2 GLY 141 1HA GLY 141 -23.903 -12.179 -9.085 1055 HA3 GLY 141 2HA GLY 141 -23.853 -10.512 -8.529 Start of MODEL 5 1 H1 GLY 1 H GLY 1 -21.720 -9.542 -11.154 2 HA2 GLY 1 1HA GLY 1 -23.267 -8.387 -13.355 3 HA3 GLY 1 2HA GLY 1 -24.155 -8.957 -11.950 4 H SER 2 H SER 2 -23.867 -6.242 -13.073 5 HA SER 2 HA SER 2 -22.372 -4.854 -10.980 6 HB2 SER 2 1HB SER 2 -23.438 -4.111 -13.662 7 HB3 SER 2 2HB SER 2 -23.297 -2.831 -12.457 8 HG SER 2 HG SER 2 -21.119 -4.539 -12.786 9 H SER 3 H SER 3 -23.852 -5.467 -9.285 10 HA SER 3 HA SER 3 -26.312 -3.843 -9.295 11 HB2 SER 3 1HB SER 3 -25.862 -6.512 -7.935 12 HB3 SER 3 2HB SER 3 -27.325 -5.536 -7.807 13 HG SER 3 HG SER 3 -27.903 -6.121 -9.765 14 H GLY 4 H GLY 4 -24.191 -5.538 -6.971 15 HA2 GLY 4 1HA GLY 4 -23.668 -3.063 -5.568 16 HA3 GLY 4 2HA GLY 4 -24.688 -4.189 -4.685 17 H SER 5 H SER 5 -21.511 -3.323 -5.501 18 HA SER 5 HA SER 5 -20.330 -5.887 -4.879 19 HB2 SER 5 1HB SER 5 -18.182 -4.722 -5.179 20 HB3 SER 5 2HB SER 5 -19.266 -4.420 -6.537 21 HG SER 5 HG SER 5 -18.132 -2.657 -4.864 22 H SER 6 H SER 6 -20.749 -6.438 -2.791 23 HA SER 6 HA SER 6 -19.747 -4.596 -0.718 24 HB2 SER 6 1HB SER 6 -22.055 -6.547 -0.551 25 HB3 SER 6 2HB SER 6 -21.406 -5.651 0.821 26 HG SER 6 HG SER 6 -21.920 -3.718 -0.365 27 H GLY 7 H GLY 7 -18.526 -5.454 0.954 28 HA2 GLY 7 1HA GLY 7 -17.607 -7.276 2.202 29 HA3 GLY 7 2HA GLY 7 -17.903 -8.324 0.823 30 H ALA 8 H ALA 8 -15.587 -6.604 2.502 31 HA ALA 8 HA ALA 8 -13.772 -6.539 0.185 32 HB1 ALA 8 1HB ALA 8 -12.551 -4.828 1.212 33 HB2 ALA 8 2HB ALA 8 -14.236 -4.414 1.529 34 HB3 ALA 8 3HB ALA 8 -13.256 -5.153 2.796 35 H GLU 9 H GLU 9 -14.377 -8.974 1.535 36 HA GLU 9 HA GLU 9 -12.502 -9.684 3.494 37 HB2 GLU 9 1HB GLU 9 -13.770 -11.464 1.405 38 HB3 GLU 9 2HB GLU 9 -13.007 -12.002 2.895 39 HG2 GLU 9 1HG GLU 9 -15.371 -10.154 2.868 40 HG3 GLU 9 2HG GLU 9 -15.530 -11.909 2.877 41 H PHE 10 H PHE 10 -12.221 -9.342 0.057 42 HA PHE 10 HA PHE 10 -9.797 -10.862 -0.187 43 HB2 PHE 10 1HB PHE 10 -11.512 -10.404 -2.033 44 HB3 PHE 10 2HB PHE 10 -10.792 -8.802 -2.149 45 HD1 PHE 10 1HD PHE 10 -8.170 -8.796 -2.404 46 HD2 PHE 10 2HD PHE 10 -10.704 -12.072 -3.385 47 HE1 PHE 10 1HE PHE 10 -6.435 -9.684 -3.906 48 HE2 PHE 10 2HE PHE 10 -8.973 -12.966 -4.888 49 HZ PHE 10 HZ PHE 10 -6.835 -11.772 -5.150 50 H TYR 11 H TYR 11 -10.554 -7.385 -0.399 51 HA TYR 11 HA TYR 11 -7.869 -6.533 -0.510 52 HB2 TYR 11 1HB TYR 11 -9.753 -5.122 -1.224 53 HB3 TYR 11 2HB TYR 11 -10.307 -5.016 0.443 54 HD1 TYR 11 2HD TYR 11 -7.402 -4.212 -1.741 55 HD2 TYR 11 1HD TYR 11 -9.532 -3.305 1.829 56 HE1 TYR 11 2HE TYR 11 -5.979 -2.235 -1.402 57 HE2 TYR 11 1HE TYR 11 -8.116 -1.325 2.177 58 HH TYR 11 HH TYR 11 -6.633 0.231 0.299 59 H ASP 12 H ASP 12 -9.641 -7.845 2.024 60 HA ASP 12 HA ASP 12 -8.308 -6.411 4.154 61 HB2 ASP 12 1HB ASP 12 -10.291 -8.667 4.050 62 HB3 ASP 12 2HB ASP 12 -9.458 -8.272 5.551 63 H LYS 13 H LYS 13 -7.636 -9.073 2.164 64 HA LYS 13 HA LYS 13 -5.993 -10.510 4.045 65 HB2 LYS 13 1HB LYS 13 -6.464 -10.761 1.079 66 HB3 LYS 13 2HB LYS 13 -5.275 -11.745 1.922 67 HG2 LYS 13 1HG LYS 13 -6.937 -12.804 3.226 68 HG3 LYS 13 2HG LYS 13 -8.167 -11.639 2.730 69 HD2 LYS 13 1HD LYS 13 -8.446 -12.606 0.670 70 HD3 LYS 13 2HD LYS 13 -6.797 -13.234 0.622 71 HE2 LYS 13 1HE LYS 13 -7.498 -14.815 2.475 72 HE3 LYS 13 2HE LYS 13 -9.156 -14.310 2.151 73 HZ1 LYS 13 3HZ LYS 13 -9.014 -15.156 -0.051 74 HZ2 LYS 13 1HZ LYS 13 -8.455 -16.372 0.984 75 HZ3 LYS 13 2HZ LYS 13 -7.354 -15.452 0.089 76 H GLN 14 H GLN 14 -5.531 -8.115 1.529 77 HA GLN 14 HA GLN 14 -2.665 -8.325 1.537 78 HB2 GLN 14 1HB GLN 14 -4.565 -6.309 0.339 79 HB3 GLN 14 2HB GLN 14 -2.817 -6.199 0.175 80 HG2 GLN 14 1HG GLN 14 -4.081 -7.240 -1.748 81 HG3 GLN 14 2HG GLN 14 -2.704 -8.146 -1.121 82 HE21 GLN 14 1HE2 GLN 14 -3.016 -10.132 -0.266 83 HE22 GLN 14 2HE2 GLN 14 -4.547 -10.929 -0.198 84 H LEU 15 H LEU 15 -5.073 -6.184 2.976 85 HA LEU 15 HA LEU 15 -3.243 -4.304 4.036 86 HB2 LEU 15 1HB LEU 15 -5.049 -3.299 4.999 87 HB3 LEU 15 2HB LEU 15 -5.843 -4.226 3.727 88 HG LEU 15 HG LEU 15 -6.210 -6.011 5.546 89 HD11 LEU 15 1HD1 LEU 15 -5.073 -5.496 7.425 90 HD12 LEU 15 2HD1 LEU 15 -6.521 -4.553 7.777 91 HD13 LEU 15 3HD1 LEU 15 -5.097 -3.763 7.099 92 HD21 LEU 15 3HD2 LEU 15 -7.762 -3.544 6.144 93 HD22 LEU 15 1HD2 LEU 15 -8.320 -5.196 5.877 94 HD23 LEU 15 2HD2 LEU 15 -7.822 -4.202 4.508 95 H LYS 16 H LYS 16 -4.742 -7.219 5.366 96 HA LYS 16 HA LYS 16 -3.695 -6.947 7.980 97 HB2 LYS 16 1HB LYS 16 -4.643 -8.997 8.416 98 HB3 LYS 16 2HB LYS 16 -5.581 -8.507 7.011 99 HG2 LYS 16 1HG LYS 16 -4.079 -9.845 5.583 100 HG3 LYS 16 2HG LYS 16 -3.229 -10.388 7.032 101 HD2 LYS 16 1HD LYS 16 -5.273 -11.408 7.870 102 HD3 LYS 16 2HD LYS 16 -6.164 -10.816 6.467 103 HE2 LYS 16 1HE LYS 16 -5.685 -13.047 5.953 104 HE3 LYS 16 2HE LYS 16 -4.471 -12.125 5.068 105 HZ1 LYS 16 3HZ LYS 16 -4.130 -13.712 7.537 106 HZ2 LYS 16 1HZ LYS 16 -3.009 -12.526 7.092 107 HZ3 LYS 16 2HZ LYS 16 -3.293 -13.845 6.074 108 H VAL 17 H VAL 17 -2.462 -8.400 5.032 109 HA VAL 17 HA VAL 17 -0.223 -9.667 6.304 110 HB VAL 17 HB VAL 17 -0.930 -9.154 3.424 111 HG11 VAL 17 1HG1 VAL 17 1.112 -10.859 3.186 112 HG12 VAL 17 2HG1 VAL 17 1.316 -9.109 3.100 113 HG13 VAL 17 3HG1 VAL 17 1.662 -9.965 4.603 114 HG21 VAL 17 3HG2 VAL 17 -1.071 -11.607 3.349 115 HG22 VAL 17 1HG2 VAL 17 -0.662 -11.673 5.063 116 HG23 VAL 17 2HG2 VAL 17 -2.170 -10.920 4.545 117 H LEU 18 H LEU 18 -0.754 -6.677 4.498 118 HA LEU 18 HA LEU 18 1.923 -5.870 4.283 119 HB2 LEU 18 1HB LEU 18 -0.703 -4.453 4.240 120 HB3 LEU 18 2HB LEU 18 0.787 -3.513 4.287 121 HG LEU 18 HG LEU 18 0.284 -5.587 2.171 122 HD11 LEU 18 1HD1 LEU 18 -0.157 -2.729 1.555 123 HD12 LEU 18 2HD1 LEU 18 -1.428 -3.559 2.451 124 HD13 LEU 18 3HD1 LEU 18 -0.916 -4.170 0.878 125 HD21 LEU 18 3HD2 LEU 18 1.811 -3.249 1.451 126 HD22 LEU 18 1HD2 LEU 18 2.261 -4.953 1.378 127 HD23 LEU 18 2HD2 LEU 18 2.497 -4.042 2.870 128 H LEU 19 H LEU 19 -0.498 -5.260 6.797 129 HA LEU 19 HA LEU 19 1.047 -3.518 8.368 130 HB2 LEU 19 1HB LEU 19 -1.192 -5.399 9.077 131 HB3 LEU 19 2HB LEU 19 -0.474 -4.276 10.230 132 HG LEU 19 HG LEU 19 -1.802 -3.417 7.664 133 HD11 LEU 19 1HD1 LEU 19 -3.064 -3.094 10.345 134 HD12 LEU 19 2HD1 LEU 19 -3.225 -4.629 9.493 135 HD13 LEU 19 3HD1 LEU 19 -3.807 -3.142 8.745 136 HD21 LEU 19 3HD2 LEU 19 -1.680 -1.576 9.920 137 HD22 LEU 19 1HD2 LEU 19 -1.258 -1.325 8.225 138 HD23 LEU 19 2HD2 LEU 19 -0.089 -2.055 9.326 139 H SER 20 H SER 20 0.458 -7.012 8.786 140 HA SER 20 HA SER 20 1.912 -7.637 10.947 141 HB2 SER 20 1HB SER 20 0.786 -9.190 9.189 142 HB3 SER 20 2HB SER 20 2.390 -9.256 8.459 143 HG SER 20 HG SER 20 2.569 -10.844 9.865 144 H GLY 21 H GLY 21 3.290 -6.974 7.746 145 HA2 GLY 21 1HA GLY 21 5.357 -5.917 7.368 146 HA3 GLY 21 2HA GLY 21 5.810 -6.255 9.032 147 H ALA 22 H ALA 22 6.859 -6.838 6.126 148 HA ALA 22 HA ALA 22 7.602 -9.632 6.704 149 HB1 ALA 22 1HB ALA 22 6.521 -8.426 4.281 150 HB2 ALA 22 2HB ALA 22 7.994 -9.355 4.001 151 HB3 ALA 22 3HB ALA 22 6.601 -10.120 4.767 152 H THR 23 H THR 23 9.730 -10.270 6.192 153 HA THR 23 HA THR 23 11.676 -8.178 6.527 154 HB THR 23 HB THR 23 12.192 -11.113 6.023 155 HG1 THR 23 1HG THR 23 11.876 -9.732 8.500 156 HG21 THR 23 3HG2 THR 23 13.903 -9.164 7.545 157 HG22 THR 23 1HG2 THR 23 14.074 -9.395 5.806 158 HG23 THR 23 2HG2 THR 23 14.344 -10.747 6.906 159 H PHE 24 H PHE 24 13.302 -7.575 5.102 160 HA PHE 24 HA PHE 24 13.495 -8.740 2.478 161 HB2 PHE 24 1HB PHE 24 12.453 -5.914 2.771 162 HB3 PHE 24 2HB PHE 24 12.932 -6.671 1.255 163 HD1 PHE 24 2HD PHE 24 11.689 -8.859 0.629 164 HD2 PHE 24 1HD PHE 24 10.257 -6.026 3.464 165 HE1 PHE 24 2HE PHE 24 9.407 -9.734 0.346 166 HE2 PHE 24 1HE PHE 24 7.973 -6.897 3.186 167 HZ PHE 24 HZ PHE 24 7.545 -8.753 1.625 168 H LEU 25 H LEU 25 15.267 -7.883 1.243 169 HA LEU 25 HA LEU 25 17.362 -6.822 2.964 170 HB2 LEU 25 1HB LEU 25 17.310 -8.131 0.273 171 HB3 LEU 25 2HB LEU 25 18.737 -7.248 0.811 172 HG LEU 25 HG LEU 25 17.531 -9.570 2.309 173 HD11 LEU 25 1HD1 LEU 25 19.029 -11.017 1.292 174 HD12 LEU 25 2HD1 LEU 25 20.046 -9.707 0.694 175 HD13 LEU 25 3HD1 LEU 25 18.478 -10.016 -0.052 176 HD21 LEU 25 3HD2 LEU 25 20.338 -9.015 2.705 177 HD22 LEU 25 1HD2 LEU 25 19.039 -9.159 3.890 178 HD23 LEU 25 2HD2 LEU 25 19.343 -7.612 3.099 179 H VAL 26 H VAL 26 17.884 -4.745 2.995 180 HA VAL 26 HA VAL 26 17.088 -3.060 0.713 181 HB VAL 26 HB VAL 26 17.517 -2.271 3.598 182 HG11 VAL 26 1HG1 VAL 26 17.866 -0.215 2.829 183 HG12 VAL 26 2HG1 VAL 26 17.531 -0.716 1.170 184 HG13 VAL 26 3HG1 VAL 26 16.208 -0.223 2.228 185 HG21 VAL 26 3HG2 VAL 26 14.975 -1.589 3.032 186 HG22 VAL 26 1HG2 VAL 26 15.149 -3.009 2.001 187 HG23 VAL 26 2HG2 VAL 26 15.434 -3.139 3.737 188 H THR 27 H THR 27 18.603 -1.980 -0.390 189 HA THR 27 HA THR 27 21.332 -1.900 0.725 190 HB THR 27 HB THR 27 20.736 -2.069 -2.225 191 HG1 THR 27 1HG THR 27 20.850 -4.087 -0.288 192 HG21 THR 27 3HG2 THR 27 23.067 -2.800 -2.355 193 HG22 THR 27 1HG2 THR 27 23.215 -2.664 -0.603 194 HG23 THR 27 2HG2 THR 27 22.944 -1.221 -1.580 195 H PHE 28 H PHE 28 21.609 0.158 1.345 196 HA PHE 28 HA PHE 28 20.423 2.364 -0.058 197 HB2 PHE 28 1HB PHE 28 22.433 2.272 2.200 198 HB3 PHE 28 2HB PHE 28 21.705 3.750 1.578 199 HD1 PHE 28 2HD PHE 28 19.233 4.072 1.790 200 HD2 PHE 28 1HD PHE 28 21.306 0.913 3.748 201 HE1 PHE 28 2HE PHE 28 17.333 3.781 3.325 202 HE2 PHE 28 1HE PHE 28 19.409 0.616 5.286 203 HZ PHE 28 HZ PHE 28 17.419 2.052 5.077 204 H GLY 29 H GLY 29 21.742 4.231 -0.809 205 HA2 GLY 29 1HA GLY 29 23.479 3.483 -2.866 206 HA3 GLY 29 2HA GLY 29 23.310 5.114 -2.233 207 H ASN 30 H ASN 30 24.142 4.268 0.474 208 HA ASN 30 HA ASN 30 26.993 4.494 0.030 209 HB2 ASN 30 1HB ASN 30 26.912 4.478 2.657 210 HB3 ASN 30 2HB ASN 30 26.365 5.893 1.763 211 HD21 ASN 30 1HD2 ASN 30 24.706 6.726 2.800 212 HD22 ASN 30 2HD2 ASN 30 23.352 5.851 3.422 213 H SER 31 H SER 31 24.709 2.144 1.312 214 HA SER 31 HA SER 31 26.853 0.295 1.993 215 HB2 SER 31 1HB SER 31 23.866 -0.145 2.188 216 HB3 SER 31 2HB SER 31 25.135 -1.089 2.969 217 HG SER 31 HG SER 31 25.625 0.688 4.248 218 H GLU 32 H GLU 32 27.616 -1.150 0.608 219 HA GLU 32 HA GLU 32 26.267 -1.585 -1.921 220 HB2 GLU 32 1HB GLU 32 28.907 -2.607 -0.862 221 HB3 GLU 32 2HB GLU 32 28.302 -2.899 -2.486 222 HG2 GLU 32 1HG GLU 32 28.525 -0.094 -1.527 223 HG3 GLU 32 2HG GLU 32 29.990 -0.958 -1.990 224 H LYS 33 H LYS 33 26.843 -3.270 1.069 225 HA LYS 33 HA LYS 33 25.836 -5.784 -0.020 226 HB2 LYS 33 1HB LYS 33 27.541 -6.357 1.392 227 HB3 LYS 33 2HB LYS 33 27.288 -4.966 2.437 228 HG2 LYS 33 1HG LYS 33 25.416 -6.028 3.496 229 HG3 LYS 33 2HG LYS 33 25.484 -7.374 2.357 230 HD2 LYS 33 1HD LYS 33 27.906 -6.736 3.972 231 HD3 LYS 33 2HD LYS 33 26.558 -7.564 4.754 232 HE2 LYS 33 1HE LYS 33 28.009 -8.478 2.271 233 HE3 LYS 33 2HE LYS 33 28.192 -9.157 3.888 234 HZ1 LYS 33 3HZ LYS 33 25.567 -9.370 3.571 235 HZ2 LYS 33 1HZ LYS 33 26.652 -10.587 3.121 236 HZ3 LYS 33 2HZ LYS 33 26.051 -9.517 1.957 237 HA PRO 34 HA PRO 34 21.703 -5.010 1.312 238 HB2 PRO 34 1HB PRO 34 20.802 -7.571 1.291 239 HB3 PRO 34 2HB PRO 34 21.084 -6.640 -0.185 240 HG2 PRO 34 1HG PRO 34 22.829 -8.690 1.125 241 HG3 PRO 34 2HG PRO 34 22.453 -8.475 -0.594 242 HD2 PRO 34 1HD PRO 34 24.769 -7.609 0.510 243 HD3 PRO 34 2HD PRO 34 23.986 -6.772 -0.846 244 H GLU 35 H GLU 35 20.629 -4.896 3.214 245 HA GLU 35 HA GLU 35 21.637 -6.542 5.443 246 HB2 GLU 35 1HB GLU 35 22.235 -4.092 5.540 247 HB3 GLU 35 2HB GLU 35 20.516 -3.749 5.682 248 HG2 GLU 35 1HG GLU 35 20.480 -5.186 7.724 249 HG3 GLU 35 2HG GLU 35 22.237 -5.279 7.614 250 H THR 36 H THR 36 20.170 -7.498 6.778 251 HA THR 36 HA THR 36 17.538 -7.899 5.790 252 HB THR 36 HB THR 36 18.473 -8.604 8.569 253 HG1 THR 36 1HG THR 36 19.282 -10.523 7.642 254 HG21 THR 36 3HG2 THR 36 16.313 -9.544 6.722 255 HG22 THR 36 1HG2 THR 36 16.218 -9.128 8.433 256 HG23 THR 36 2HG2 THR 36 16.975 -10.641 7.934 257 H MET 37 H MET 37 16.083 -6.301 5.848 258 HA MET 37 HA MET 37 15.685 -4.907 8.412 259 HB2 MET 37 1HB MET 37 15.342 -3.735 5.646 260 HB3 MET 37 2HB MET 37 15.015 -2.904 7.161 261 HG2 MET 37 1HG MET 37 17.410 -3.182 7.760 262 HG3 MET 37 2HG MET 37 17.685 -3.851 6.153 263 HE1 MET 37 3HE MET 37 15.514 -0.165 6.939 264 HE2 MET 37 1HE MET 37 16.249 -1.164 8.193 265 HE3 MET 37 2HE MET 37 17.074 0.288 7.627 266 H THR 38 H THR 38 13.454 -3.985 8.625 267 HA THR 38 HA THR 38 11.497 -5.863 7.474 268 HB THR 38 HB THR 38 11.247 -4.313 10.058 269 HG1 THR 38 1HG THR 38 11.575 -6.445 10.984 270 HG21 THR 38 3HG2 THR 38 9.626 -6.721 9.430 271 HG22 THR 38 1HG2 THR 38 9.206 -5.219 8.608 272 HG23 THR 38 2HG2 THR 38 9.206 -5.289 10.370 273 H CYS 39 H CYS 39 9.743 -5.098 6.421 274 HA CYS 39 HA CYS 39 9.388 -2.175 6.327 275 HB2 CYS 39 1HB CYS 39 10.345 -3.300 4.234 276 HB3 CYS 39 2HB CYS 39 8.755 -4.025 4.034 277 HG CYS 39 HG CYS 39 8.128 -2.078 2.460 278 H ARG 40 H ARG 40 7.475 -1.493 7.013 279 HA ARG 40 HA ARG 40 5.115 -3.178 6.620 280 HB2 ARG 40 1HB ARG 40 4.426 -3.116 8.863 281 HB3 ARG 40 2HB ARG 40 6.141 -3.496 8.946 282 HG2 ARG 40 1HG ARG 40 6.358 -0.876 9.159 283 HG3 ARG 40 2HG ARG 40 4.701 -1.029 9.747 284 HD2 ARG 40 1HD ARG 40 5.618 -2.855 11.289 285 HD3 ARG 40 2HD ARG 40 7.212 -2.228 10.874 286 HE ARG 40 HE ARG 40 5.515 -0.131 11.726 287 HH11 ARG 40 1HH1 ARG 40 7.335 -2.844 12.927 288 HH12 ARG 40 2HH1 ARG 40 7.576 -2.154 14.498 289 HH21 ARG 40 1HH2 ARG 40 5.825 0.788 13.791 290 HH22 ARG 40 2HH2 ARG 40 6.715 -0.088 14.988 291 H LEU 41 H LEU 41 3.077 -1.960 7.083 292 HA LEU 41 HA LEU 41 3.388 0.816 6.178 293 HB2 LEU 41 1HB LEU 41 1.330 -1.283 5.787 294 HB3 LEU 41 2HB LEU 41 0.778 0.389 5.853 295 HG LEU 41 HG LEU 41 2.977 -0.405 3.981 296 HD11 LEU 41 1HD1 LEU 41 1.649 -1.588 2.660 297 HD12 LEU 41 2HD1 LEU 41 0.428 -0.316 2.672 298 HD13 LEU 41 3HD1 LEU 41 0.421 -1.555 3.926 299 HD21 LEU 41 3HD2 LEU 41 1.072 1.855 4.318 300 HD22 LEU 41 1HD2 LEU 41 1.608 1.440 2.690 301 HD23 LEU 41 2HD2 LEU 41 2.792 1.873 3.924 302 H SER 42 H SER 42 1.676 2.350 6.966 303 HA SER 42 HA SER 42 1.677 2.336 9.834 304 HB2 SER 42 1HB SER 42 1.878 4.373 8.250 305 HB3 SER 42 2HB SER 42 0.121 4.278 8.140 306 HG SER 42 HG SER 42 1.292 4.236 10.677 307 H ASN 43 H ASN 43 -0.521 3.168 10.864 308 HA ASN 43 HA ASN 43 -2.231 1.058 11.113 309 HB2 ASN 43 1HB ASN 43 -3.039 3.968 11.321 310 HB3 ASN 43 2HB ASN 43 -3.853 2.602 12.080 311 HD21 ASN 43 1HD2 ASN 43 -3.006 1.695 13.910 312 HD22 ASN 43 2HD2 ASN 43 -1.692 2.392 14.789 313 H ASN 44 H ASN 44 -2.887 3.936 9.105 314 HA ASN 44 HA ASN 44 -4.933 2.417 7.667 315 HB2 ASN 44 1HB ASN 44 -4.366 5.309 8.089 316 HB3 ASN 44 2HB ASN 44 -5.147 4.849 6.579 317 HD21 ASN 44 1HD2 ASN 44 -6.272 6.437 8.648 318 HD22 ASN 44 2HD2 ASN 44 -7.652 5.596 9.256 319 H GLN 45 H GLN 45 -1.861 2.322 7.388 320 HA GLN 45 HA GLN 45 -0.324 2.056 5.731 321 HB2 GLN 45 1HB GLN 45 -2.804 1.620 4.059 322 HB3 GLN 45 2HB GLN 45 -1.168 1.189 3.581 323 HG2 GLN 45 1HG GLN 45 -1.036 -0.537 5.132 324 HG3 GLN 45 2HG GLN 45 -2.374 0.094 6.089 325 HE21 GLN 45 1HE2 GLN 45 -4.508 -0.127 5.270 326 HE22 GLN 45 2HE2 GLN 45 -4.893 -1.380 4.144 327 H ARG 46 H ARG 46 -0.814 4.685 6.295 328 HA ARG 46 HA ARG 46 -1.165 6.077 3.755 329 HB2 ARG 46 1HB ARG 46 -0.997 6.968 6.621 330 HB3 ARG 46 2HB ARG 46 -0.828 8.121 5.304 331 HG2 ARG 46 1HG ARG 46 -3.023 7.791 4.577 332 HG3 ARG 46 2HG ARG 46 -3.188 6.284 5.480 333 HD2 ARG 46 1HD ARG 46 -2.913 7.672 7.579 334 HD3 ARG 46 2HD ARG 46 -3.101 9.093 6.553 335 HE ARG 46 HE ARG 46 -5.236 7.312 6.103 336 HH11 ARG 46 1HH1 ARG 46 -4.003 9.509 8.506 337 HH12 ARG 46 2HH1 ARG 46 -5.563 9.857 9.176 338 HH21 ARG 46 1HH2 ARG 46 -7.295 7.762 6.977 339 HH22 ARG 46 2HH2 ARG 46 -7.434 8.862 8.306 340 H TYR 47 H TYR 47 1.325 4.821 5.664 341 HA TYR 47 HA TYR 47 3.322 6.036 3.955 342 HB2 TYR 47 1HB TYR 47 3.651 6.303 6.941 343 HB3 TYR 47 2HB TYR 47 4.644 7.016 5.675 344 HD1 TYR 47 2HD TYR 47 1.482 7.259 7.515 345 HD2 TYR 47 1HD TYR 47 3.928 9.014 4.508 346 HE1 TYR 47 2HE TYR 47 0.116 9.302 7.604 347 HE2 TYR 47 1HE TYR 47 2.569 11.062 4.589 348 HH TYR 47 HH TYR 47 0.929 12.143 5.644 349 H LEU 48 H LEU 48 5.556 5.149 4.539 350 HA LEU 48 HA LEU 48 5.275 2.347 5.407 351 HB2 LEU 48 1HB LEU 48 6.919 3.578 3.220 352 HB3 LEU 48 2HB LEU 48 7.325 2.005 3.904 353 HG LEU 48 HG LEU 48 4.663 2.631 2.637 354 HD11 LEU 48 1HD1 LEU 48 7.188 2.310 1.374 355 HD12 LEU 48 2HD1 LEU 48 5.596 2.476 0.635 356 HD13 LEU 48 3HD1 LEU 48 6.214 0.877 1.046 357 HD21 LEU 48 3HD2 LEU 48 4.812 0.738 4.263 358 HD22 LEU 48 1HD2 LEU 48 5.992 -0.016 3.191 359 HD23 LEU 48 2HD2 LEU 48 4.344 0.265 2.629 360 H PHE 49 H PHE 49 6.918 1.443 6.655 361 HA PHE 49 HA PHE 49 8.911 3.337 7.709 362 HB2 PHE 49 1HB PHE 49 7.516 1.217 9.349 363 HB3 PHE 49 2HB PHE 49 8.604 2.472 9.931 364 HD1 PHE 49 1HD PHE 49 7.573 4.838 8.524 365 HD2 PHE 49 2HD PHE 49 5.506 1.637 10.422 366 HE1 PHE 49 1HE PHE 49 5.650 6.320 8.922 367 HE2 PHE 49 2HE PHE 49 3.580 3.114 10.822 368 HZ PHE 49 HZ PHE 49 3.649 5.458 10.071 369 H LEU 50 H LEU 50 10.805 2.285 8.696 370 HA LEU 50 HA LEU 50 11.323 -0.439 7.773 371 HB2 LEU 50 1HB LEU 50 13.238 1.818 7.226 372 HB3 LEU 50 2HB LEU 50 13.393 0.137 6.720 373 HG LEU 50 HG LEU 50 11.177 1.921 5.740 374 HD11 LEU 50 1HD1 LEU 50 14.014 1.827 4.952 375 HD12 LEU 50 2HD1 LEU 50 12.823 3.114 4.770 376 HD13 LEU 50 3HD1 LEU 50 12.843 1.765 3.635 377 HD21 LEU 50 3HD2 LEU 50 10.486 -0.083 5.011 378 HD22 LEU 50 1HD2 LEU 50 12.060 -0.832 5.278 379 HD23 LEU 50 2HD2 LEU 50 11.763 0.091 3.805 380 H ASP 51 H ASP 51 12.754 -1.578 9.027 381 HA ASP 51 HA ASP 51 13.871 -0.152 11.353 382 HB2 ASP 51 1HB ASP 51 11.870 -1.818 11.672 383 HB3 ASP 51 2HB ASP 51 13.118 -3.049 11.497 384 H GLY 52 H GLY 52 15.983 -0.444 11.779 385 HA2 GLY 52 1HA GLY 52 17.537 -2.679 11.350 386 HA3 GLY 52 2HA GLY 52 17.617 -1.769 9.849 387 H ASP 53 H ASP 53 19.648 -0.993 9.864 388 HA ASP 53 HA ASP 53 21.284 -0.321 11.916 389 HB2 ASP 53 1HB ASP 53 20.990 0.714 9.141 390 HB3 ASP 53 2HB ASP 53 22.033 1.617 10.236 391 H SER 54 H SER 54 18.757 1.726 10.525 392 HA SER 54 HA SER 54 18.646 3.252 12.990 393 HB2 SER 54 1HB SER 54 19.261 4.559 10.330 394 HB3 SER 54 2HB SER 54 18.784 5.435 11.785 395 HG SER 54 HG SER 54 21.209 4.576 11.083 396 H HIS 55 H HIS 55 16.800 4.830 12.941 397 HA HIS 55 HA HIS 55 14.454 3.507 12.044 398 HB2 HIS 55 1HB HIS 55 14.936 6.225 13.259 399 HB3 HIS 55 2HB HIS 55 13.327 5.662 12.816 400 HD2 HIS 55 2HD HIS 55 13.173 2.768 14.088 401 HE1 HIS 55 1HE HIS 55 14.689 4.509 17.647 402 HE2 HIS 55 2HE HIS 55 13.579 2.492 16.627 403 H TYR 56 H TYR 56 14.384 3.312 9.839 404 HA TYR 56 HA TYR 56 14.571 5.749 8.225 405 HB2 TYR 56 1HB TYR 56 14.902 2.844 7.679 406 HB3 TYR 56 2HB TYR 56 14.284 3.845 6.370 407 HD1 TYR 56 1HD TYR 56 15.696 6.227 6.284 408 HD2 TYR 56 2HD TYR 56 17.159 2.435 7.544 409 HE1 TYR 56 1HE TYR 56 17.988 6.936 5.740 410 HE2 TYR 56 2HE TYR 56 19.455 3.135 7.005 411 HH TYR 56 HH TYR 56 20.414 5.067 5.209 412 H GLU 57 H GLU 57 12.921 6.422 6.861 413 HA GLU 57 HA GLU 57 10.387 4.987 6.901 414 HB2 GLU 57 1HB GLU 57 10.636 7.854 7.829 415 HB3 GLU 57 2HB GLU 57 9.125 6.993 7.573 416 HG2 GLU 57 1HG GLU 57 9.430 5.638 9.425 417 HG3 GLU 57 2HG GLU 57 11.168 5.925 9.472 418 H ILE 58 H ILE 58 9.415 5.075 4.978 419 HA ILE 58 HA ILE 58 10.306 7.143 3.075 420 HB ILE 58 HB ILE 58 9.403 4.321 2.491 421 HG12 ILE 58 1HG1 ILE 58 12.086 5.533 1.866 422 HG13 ILE 58 2HG1 ILE 58 11.764 4.791 3.429 423 HG21 ILE 58 1HG2 ILE 58 10.448 6.315 0.502 424 HG22 ILE 58 2HG2 ILE 58 9.661 4.768 0.195 425 HG23 ILE 58 3HG2 ILE 58 8.727 6.121 0.832 426 HD11 ILE 58 3HD1 ILE 58 12.880 3.343 1.694 427 HD12 ILE 58 1HD1 ILE 58 11.444 2.671 2.466 428 HD13 ILE 58 2HD1 ILE 58 11.338 3.342 0.838 429 H GLU 59 H GLU 59 8.730 8.651 3.171 430 HA GLU 59 HA GLU 59 5.985 8.091 3.563 431 HB2 GLU 59 1HB GLU 59 7.481 10.518 2.599 432 HB3 GLU 59 2HB GLU 59 5.725 10.493 2.676 433 HG2 GLU 59 1HG GLU 59 6.177 11.396 4.705 434 HG3 GLU 59 2HG GLU 59 6.187 9.688 5.142 435 H ILE 60 H ILE 60 4.551 7.300 2.184 436 HA ILE 60 HA ILE 60 5.125 6.622 -0.465 437 HB ILE 60 HB ILE 60 2.410 7.014 0.801 438 HG12 ILE 60 1HG1 ILE 60 3.930 4.435 0.407 439 HG13 ILE 60 2HG1 ILE 60 4.018 5.372 1.895 440 HG21 ILE 60 1HG2 ILE 60 2.539 5.013 -1.260 441 HG22 ILE 60 2HG2 ILE 60 1.484 6.419 -1.128 442 HG23 ILE 60 3HG2 ILE 60 3.071 6.576 -1.880 443 HD11 ILE 60 3HD1 ILE 60 1.760 4.988 2.393 444 HD12 ILE 60 1HD1 ILE 60 1.412 4.418 0.761 445 HD13 ILE 60 2HD1 ILE 60 2.394 3.435 1.848 446 H VAL 61 H VAL 61 3.563 9.465 0.903 447 HA VAL 61 HA VAL 61 2.517 10.600 -1.413 448 HB VAL 61 HB VAL 61 2.612 12.747 -0.271 449 HG11 VAL 61 1HG1 VAL 61 1.210 10.571 0.540 450 HG12 VAL 61 2HG1 VAL 61 2.006 11.043 2.042 451 HG13 VAL 61 3HG1 VAL 61 0.988 12.198 1.182 452 HG21 VAL 61 3HG2 VAL 61 3.940 11.677 2.135 453 HG22 VAL 61 1HG2 VAL 61 4.981 11.957 0.739 454 HG23 VAL 61 2HG2 VAL 61 4.027 13.281 1.407 455 H HIS 62 H HIS 62 5.791 10.256 -0.399 456 HA HIS 62 HA HIS 62 6.756 12.273 -2.270 457 HB2 HIS 62 1HB HIS 62 8.085 10.564 -0.180 458 HB3 HIS 62 2HB HIS 62 9.030 11.449 -1.374 459 HD2 HIS 62 2HD HIS 62 9.203 12.266 1.808 460 HE1 HIS 62 1HE HIS 62 6.981 15.672 0.600 461 HE2 HIS 62 2HE HIS 62 8.513 14.700 2.347 462 H ILE 63 H ILE 63 6.775 8.777 -1.803 463 HA ILE 63 HA ILE 63 8.524 7.895 -3.686 464 HB ILE 63 HB ILE 63 5.763 6.758 -3.235 465 HG12 ILE 63 1HG1 ILE 63 8.394 6.076 -1.904 466 HG13 ILE 63 2HG1 ILE 63 7.100 7.012 -1.164 467 HG21 ILE 63 1HG2 ILE 63 7.366 6.062 -5.246 468 HG22 ILE 63 2HG2 ILE 63 8.067 5.056 -3.980 469 HG23 ILE 63 3HG2 ILE 63 6.359 4.896 -4.388 470 HD11 ILE 63 3HD1 ILE 63 5.683 4.876 -1.747 471 HD12 ILE 63 1HD1 ILE 63 7.267 4.102 -1.712 472 HD13 ILE 63 2HD1 ILE 63 6.672 4.958 -0.289 473 H SER 64 H SER 64 8.788 8.156 -5.798 474 HA SER 64 HA SER 64 6.595 9.310 -7.359 475 HB2 SER 64 1HB SER 64 8.787 10.471 -7.380 476 HB3 SER 64 2HB SER 64 9.524 9.030 -8.079 477 HG SER 64 HG SER 64 7.960 9.297 -9.825 478 H THR 65 H THR 65 9.064 6.759 -7.640 479 HA THR 65 HA THR 65 7.402 5.454 -9.683 480 HB THR 65 HB THR 65 10.298 4.939 -8.975 481 HG1 THR 65 1HG THR 65 9.035 6.453 -11.015 482 HG21 THR 65 3HG2 THR 65 10.343 3.579 -10.998 483 HG22 THR 65 1HG2 THR 65 8.630 3.899 -11.270 484 HG23 THR 65 2HG2 THR 65 9.141 2.959 -9.867 485 H VAL 66 H VAL 66 6.877 3.259 -9.527 486 HA VAL 66 HA VAL 66 7.562 1.805 -7.107 487 HB VAL 66 HB VAL 66 4.708 2.524 -7.781 488 HG11 VAL 66 1HG1 VAL 66 4.378 0.366 -7.130 489 HG12 VAL 66 2HG1 VAL 66 5.855 0.313 -6.167 490 HG13 VAL 66 3HG1 VAL 66 4.423 1.132 -5.543 491 HG21 VAL 66 3HG2 VAL 66 6.565 3.190 -5.525 492 HG22 VAL 66 1HG2 VAL 66 5.576 4.269 -6.508 493 HG23 VAL 66 2HG2 VAL 66 4.816 3.229 -5.304 494 H GLN 67 H GLN 67 8.381 0.049 -8.079 495 HA GLN 67 HA GLN 67 6.599 -1.484 -9.828 496 HB2 GLN 67 1HB GLN 67 8.325 -1.944 -11.422 497 HB3 GLN 67 2HB GLN 67 8.235 -0.199 -11.222 498 HG2 GLN 67 1HG GLN 67 10.136 -0.490 -9.530 499 HG3 GLN 67 2HG GLN 67 10.331 -2.094 -10.235 500 HE21 GLN 67 1HE2 GLN 67 12.474 -1.252 -10.762 501 HE22 GLN 67 2HE2 GLN 67 12.675 -0.345 -12.219 502 H ILE 68 H ILE 68 7.197 -3.763 -9.996 503 HA ILE 68 HA ILE 68 8.400 -4.700 -7.491 504 HB ILE 68 HB ILE 68 6.525 -6.025 -9.440 505 HG12 ILE 68 1HG1 ILE 68 6.290 -5.416 -6.485 506 HG13 ILE 68 2HG1 ILE 68 5.552 -4.475 -7.776 507 HG21 ILE 68 1HG2 ILE 68 6.616 -8.003 -7.953 508 HG22 ILE 68 2HG2 ILE 68 8.132 -7.699 -8.800 509 HG23 ILE 68 3HG2 ILE 68 7.968 -7.260 -7.100 510 HD11 ILE 68 3HD1 ILE 68 4.752 -7.138 -8.169 511 HD12 ILE 68 1HD1 ILE 68 4.570 -6.797 -6.449 512 HD13 ILE 68 2HD1 ILE 68 3.771 -5.771 -7.641 513 H LEU 69 H LEU 69 10.004 -6.266 -7.448 514 HA LEU 69 HA LEU 69 11.489 -6.564 -9.965 515 HB2 LEU 69 1HB LEU 69 12.383 -6.868 -7.103 516 HB3 LEU 69 2HB LEU 69 13.407 -7.144 -8.510 517 HG LEU 69 HG LEU 69 12.127 -4.492 -7.863 518 HD11 LEU 69 1HD1 LEU 69 13.588 -4.777 -6.082 519 HD12 LEU 69 2HD1 LEU 69 14.572 -3.929 -7.274 520 HD13 LEU 69 3HD1 LEU 69 14.759 -5.669 -7.054 521 HD21 LEU 69 3HD2 LEU 69 14.533 -4.412 -9.421 522 HD22 LEU 69 1HD2 LEU 69 12.922 -3.815 -9.820 523 HD23 LEU 69 2HD2 LEU 69 13.358 -5.486 -10.181 524 H THR 70 H THR 70 11.856 -8.516 -10.848 525 HA THR 70 HA THR 70 11.044 -10.897 -9.313 526 HB THR 70 HB THR 70 10.190 -11.911 -11.370 527 HG1 THR 70 1HG THR 70 11.621 -10.276 -12.644 528 HG21 THR 70 3HG2 THR 70 8.230 -10.386 -11.730 529 HG22 THR 70 1HG2 THR 70 9.037 -9.204 -10.700 530 HG23 THR 70 2HG2 THR 70 8.560 -10.769 -10.041 531 H GLU 71 H GLU 71 12.768 -12.118 -8.940 532 HA GLU 71 HA GLU 71 14.967 -12.120 -10.884 533 HB2 GLU 71 1HB GLU 71 14.783 -12.601 -7.948 534 HB3 GLU 71 2HB GLU 71 16.044 -13.438 -8.843 535 HG2 GLU 71 1HG GLU 71 16.605 -11.098 -9.781 536 HG3 GLU 71 2HG GLU 71 15.669 -10.507 -8.409 537 H GLY 72 H GLY 72 16.087 -14.201 -11.252 538 HA2 GLY 72 1HA GLY 72 16.029 -16.350 -12.060 539 HA3 GLY 72 2HA GLY 72 15.061 -16.706 -10.638 540 H PHE 73 H PHE 73 12.882 -16.996 -10.833 541 HA PHE 73 HA PHE 73 11.887 -17.639 -13.418 542 HB2 PHE 73 1HB PHE 73 10.273 -17.301 -10.886 543 HB3 PHE 73 2HB PHE 73 9.850 -18.258 -12.302 544 HD1 PHE 73 2HD PHE 73 11.924 -18.085 -9.295 545 HD2 PHE 73 1HD PHE 73 10.842 -20.420 -12.685 546 HE1 PHE 73 2HE PHE 73 12.984 -20.055 -8.272 547 HE2 PHE 73 1HE PHE 73 11.899 -22.394 -11.667 548 HZ PHE 73 HZ PHE 73 12.973 -22.213 -9.458 549 HA PRO 74 HA PRO 74 10.238 -13.777 -14.722 550 HB2 PRO 74 1HB PRO 74 8.263 -14.657 -16.363 551 HB3 PRO 74 2HB PRO 74 9.976 -14.751 -16.786 552 HG2 PRO 74 1HG PRO 74 8.175 -16.880 -15.699 553 HG3 PRO 74 2HG PRO 74 9.385 -16.990 -16.990 554 HD2 PRO 74 1HD PRO 74 9.863 -17.850 -14.467 555 HD3 PRO 74 2HD PRO 74 11.137 -17.176 -15.503 556 HA PRO 75 HA PRO 75 6.664 -12.651 -12.421 557 HB2 PRO 75 1HB PRO 75 5.347 -10.972 -14.098 558 HB3 PRO 75 2HB PRO 75 6.860 -10.536 -13.295 559 HG2 PRO 75 1HG PRO 75 6.411 -11.507 -16.091 560 HG3 PRO 75 2HG PRO 75 7.470 -10.206 -15.514 561 HD2 PRO 75 1HD PRO 75 8.398 -12.673 -16.135 562 HD3 PRO 75 2HD PRO 75 9.125 -11.671 -14.862 563 H GLY 76 H GLY 76 6.257 -14.232 -15.459 564 HA2 GLY 76 1HA GLY 76 3.397 -14.476 -15.327 565 HA3 GLY 76 2HA GLY 76 4.469 -15.334 -16.425 566 H GLY 77 H GLY 77 2.813 -17.048 -15.859 567 HA2 GLY 77 1HA GLY 77 2.422 -18.265 -13.464 568 HA3 GLY 77 2HA GLY 77 2.588 -19.165 -14.964 569 H GLY 78 H GLY 78 3.406 -19.871 -12.224 570 HA2 GLY 78 1HA GLY 78 5.486 -21.438 -12.413 571 HA3 GLY 78 2HA GLY 78 6.330 -19.897 -12.458 572 H ASN 79 H ASN 79 6.416 -22.110 -10.490 573 HA ASN 79 HA ASN 79 5.119 -21.777 -8.145 574 HB2 ASN 79 1HB ASN 79 7.036 -23.375 -8.673 575 HB3 ASN 79 2HB ASN 79 8.122 -22.067 -8.213 576 HD21 ASN 79 1HD2 ASN 79 8.774 -22.098 -6.197 577 HD22 ASN 79 2HD2 ASN 79 7.935 -22.806 -4.862 578 H ALA 80 H ALA 80 7.671 -19.702 -9.404 579 HA ALA 80 HA ALA 80 7.332 -17.916 -7.092 580 HB1 ALA 80 1HB ALA 80 9.617 -18.629 -7.436 581 HB2 ALA 80 2HB ALA 80 9.569 -18.067 -9.107 582 HB3 ALA 80 3HB ALA 80 9.469 -16.906 -7.783 583 H ARG 81 H ARG 81 6.695 -15.821 -7.346 584 HA ARG 81 HA ARG 81 5.993 -14.978 -10.082 585 HB2 ARG 81 1HB ARG 81 4.527 -14.302 -7.525 586 HB3 ARG 81 2HB ARG 81 4.081 -13.780 -9.144 587 HG2 ARG 81 1HG ARG 81 4.130 -16.630 -8.170 588 HG3 ARG 81 2HG ARG 81 2.691 -15.628 -8.368 589 HD2 ARG 81 1HD ARG 81 3.668 -15.364 -10.817 590 HD3 ARG 81 2HD ARG 81 4.421 -16.908 -10.418 591 HE ARG 81 HE ARG 81 2.396 -17.865 -10.791 592 HH11 ARG 81 1HH1 ARG 81 1.869 -14.581 -9.762 593 HH12 ARG 81 2HH1 ARG 81 0.144 -14.678 -9.895 594 HH21 ARG 81 1HH2 ARG 81 0.126 -18.005 -10.970 595 HH22 ARG 81 2HH2 ARG 81 -0.846 -16.627 -10.581 596 H ALA 82 H ALA 82 6.476 -13.606 -6.821 597 HA ALA 82 HA ALA 82 8.066 -11.462 -8.070 598 HB1 ALA 82 1HB ALA 82 5.883 -11.270 -6.037 599 HB2 ALA 82 2HB ALA 82 7.173 -10.067 -6.068 600 HB3 ALA 82 3HB ALA 82 6.153 -10.303 -7.487 601 H THR 83 H THR 83 10.101 -11.536 -7.412 602 HA THR 83 HA THR 83 10.665 -12.457 -4.668 603 HB THR 83 HB THR 83 12.412 -12.858 -7.105 604 HG1 THR 83 1HG THR 83 10.655 -14.556 -5.670 605 HG21 THR 83 3HG2 THR 83 13.202 -14.522 -4.988 606 HG22 THR 83 1HG2 THR 83 12.977 -12.921 -4.284 607 HG23 THR 83 2HG2 THR 83 14.075 -13.138 -5.647 608 H GLY 84 H GLY 84 10.166 -9.763 -5.296 609 HA2 GLY 84 1HA GLY 84 12.158 -8.408 -4.010 610 HA3 GLY 84 2HA GLY 84 12.646 -8.368 -5.698 611 H MET 85 H MET 85 12.266 -5.995 -4.593 612 HA MET 85 HA MET 85 9.963 -4.988 -6.025 613 HB2 MET 85 1HB MET 85 9.147 -5.565 -3.706 614 HB3 MET 85 2HB MET 85 10.245 -4.336 -3.091 615 HG2 MET 85 1HG MET 85 9.027 -2.600 -4.004 616 HG3 MET 85 2HG MET 85 8.250 -3.638 -5.196 617 HE1 MET 85 3HE MET 85 6.283 -2.645 -4.992 618 HE2 MET 85 1HE MET 85 5.218 -3.938 -4.439 619 HE3 MET 85 2HE MET 85 5.267 -2.404 -3.570 620 H PHE 86 H PHE 86 10.395 -3.060 -6.918 621 HA PHE 86 HA PHE 86 12.746 -1.589 -5.920 622 HB2 PHE 86 1HB PHE 86 13.058 -2.699 -8.148 623 HB3 PHE 86 2HB PHE 86 11.771 -1.677 -8.780 624 HD1 PHE 86 1HD PHE 86 12.113 0.898 -8.384 625 HD2 PHE 86 2HD PHE 86 15.234 -1.995 -8.361 626 HE1 PHE 86 1HE PHE 86 13.752 2.669 -8.865 627 HE2 PHE 86 2HE PHE 86 16.879 -0.230 -8.841 628 HZ PHE 86 HZ PHE 86 16.139 2.106 -9.093 629 H LEU 87 H LEU 87 12.212 0.282 -5.029 630 HA LEU 87 HA LEU 87 9.998 1.825 -6.205 631 HB2 LEU 87 1HB LEU 87 10.644 1.726 -3.267 632 HB3 LEU 87 2HB LEU 87 9.271 2.518 -4.037 633 HG LEU 87 HG LEU 87 9.629 -0.457 -4.188 634 HD11 LEU 87 1HD1 LEU 87 8.697 -0.830 -2.143 635 HD12 LEU 87 2HD1 LEU 87 7.871 0.727 -2.109 636 HD13 LEU 87 3HD1 LEU 87 9.601 0.641 -1.782 637 HD21 LEU 87 3HD2 LEU 87 7.848 -0.154 -5.499 638 HD22 LEU 87 1HD2 LEU 87 7.623 1.510 -4.957 639 HD23 LEU 87 2HD2 LEU 87 6.960 0.177 -4.011 640 H GLN 88 H GLN 88 10.089 4.172 -5.521 641 HA GLN 88 HA GLN 88 12.791 5.136 -4.984 642 HB2 GLN 88 1HB GLN 88 11.194 5.860 -7.444 643 HB3 GLN 88 2HB GLN 88 12.605 6.754 -6.894 644 HG2 GLN 88 1HG GLN 88 13.886 4.585 -7.060 645 HG3 GLN 88 2HG GLN 88 12.482 3.929 -7.900 646 HE21 GLN 88 1HE2 GLN 88 15.316 5.775 -8.161 647 HE22 GLN 88 2HE2 GLN 88 15.145 6.245 -9.814 648 H TYR 89 H TYR 89 12.881 7.196 -4.092 649 HA TYR 89 HA TYR 89 10.424 8.717 -3.778 650 HB2 TYR 89 1HB TYR 89 10.863 8.846 -1.258 651 HB3 TYR 89 2HB TYR 89 10.153 7.357 -1.872 652 HD1 TYR 89 1HD TYR 89 13.313 8.895 -0.707 653 HD2 TYR 89 2HD TYR 89 11.256 5.281 -1.607 654 HE1 TYR 89 1HE TYR 89 15.132 7.607 0.334 655 HE2 TYR 89 2HE TYR 89 13.069 3.983 -0.568 656 HH TYR 89 HH TYR 89 15.887 4.780 -0.137 657 H THR 90 H THR 90 10.765 10.870 -3.060 658 HA THR 90 HA THR 90 13.519 11.791 -3.497 659 HB THR 90 HB THR 90 12.483 14.037 -3.853 660 HG1 THR 90 1HG THR 90 10.525 13.614 -2.687 661 HG21 THR 90 3HG2 THR 90 11.545 13.524 -6.061 662 HG22 THR 90 1HG2 THR 90 11.428 11.821 -5.617 663 HG23 THR 90 2HG2 THR 90 13.010 12.591 -5.754 664 H VAL 91 H VAL 91 14.659 12.721 -1.915 665 HA VAL 91 HA VAL 91 13.269 13.311 0.616 666 HB VAL 91 HB VAL 91 16.210 12.720 0.308 667 HG11 VAL 91 1HG1 VAL 91 14.960 13.908 2.365 668 HG12 VAL 91 2HG1 VAL 91 14.747 12.217 2.822 669 HG13 VAL 91 3HG1 VAL 91 16.367 12.864 2.559 670 HG21 VAL 91 3HG2 VAL 91 13.978 10.821 1.026 671 HG22 VAL 91 1HG2 VAL 91 14.964 10.774 -0.436 672 HG23 VAL 91 2HG2 VAL 91 15.700 10.460 1.136 673 HA PRO 92 HA PRO 92 14.325 17.551 -0.177 674 HB2 PRO 92 1HB PRO 92 13.488 18.523 2.216 675 HB3 PRO 92 2HB PRO 92 12.375 18.073 0.919 676 HG2 PRO 92 1HG PRO 92 13.174 16.524 3.353 677 HG3 PRO 92 2HG PRO 92 11.566 16.727 2.634 678 HD2 PRO 92 1HD PRO 92 13.061 14.502 2.252 679 HD3 PRO 92 2HD PRO 92 11.946 15.127 1.020 680 H GLY 93 H GLY 93 15.932 15.410 1.737 681 HA2 GLY 93 1HA GLY 93 17.704 17.476 2.877 682 HA3 GLY 93 2HA GLY 93 17.541 15.843 3.504 683 H THR 94 H THR 94 17.548 15.787 0.161 684 HA THR 94 HA THR 94 20.465 15.544 -0.017 685 HB THR 94 HB THR 94 19.336 13.275 0.359 686 HG1 THR 94 1HG THR 94 21.462 13.740 -0.695 687 HG21 THR 94 3HG2 THR 94 17.943 12.373 -1.185 688 HG22 THR 94 1HG2 THR 94 18.745 13.175 -2.535 689 HG23 THR 94 2HG2 THR 94 17.594 14.065 -1.538 690 H GLU 95 H GLU 95 20.988 14.985 -2.474 691 HA GLU 95 HA GLU 95 19.448 16.913 -4.083 692 HB2 GLU 95 1HB GLU 95 21.717 16.797 -5.460 693 HB3 GLU 95 2HB GLU 95 21.520 17.874 -4.084 694 HG2 GLU 95 1HG GLU 95 22.821 16.554 -2.697 695 HG3 GLU 95 2HG GLU 95 22.614 15.120 -3.702 696 H GLY 96 H GLY 96 18.095 15.860 -5.389 697 HA2 GLY 96 1HA GLY 96 17.911 14.689 -7.504 698 HA3 GLY 96 2HA GLY 96 19.182 13.607 -6.952 699 H VAL 97 H VAL 97 17.898 11.782 -7.373 700 HA VAL 97 HA VAL 97 15.712 11.383 -5.435 701 HB VAL 97 HB VAL 97 15.902 10.205 -8.212 702 HG11 VAL 97 1HG1 VAL 97 13.402 9.685 -7.482 703 HG12 VAL 97 2HG1 VAL 97 14.731 8.579 -7.128 704 HG13 VAL 97 3HG1 VAL 97 14.142 9.679 -5.882 705 HG21 VAL 97 3HG2 VAL 97 14.640 11.883 -8.980 706 HG22 VAL 97 1HG2 VAL 97 13.577 11.838 -7.573 707 HG23 VAL 97 2HG2 VAL 97 15.090 12.741 -7.507 708 H THR 98 H THR 98 15.524 9.336 -4.489 709 HA THR 98 HA THR 98 17.901 7.617 -4.791 710 HB THR 98 HB THR 98 16.276 8.095 -2.284 711 HG1 THR 98 1HG THR 98 17.954 9.332 -1.636 712 HG21 THR 98 3HG2 THR 98 18.287 6.073 -3.033 713 HG22 THR 98 1HG2 THR 98 17.024 6.014 -1.805 714 HG23 THR 98 2HG2 THR 98 18.539 6.853 -1.472 715 H GLN 99 H GLN 99 17.618 5.416 -4.886 716 HA GLN 99 HA GLN 99 14.837 4.511 -5.205 717 HB2 GLN 99 1HB GLN 99 15.571 2.917 -6.766 718 HB3 GLN 99 2HB GLN 99 16.488 4.366 -7.155 719 HG2 GLN 99 1HG GLN 99 17.468 1.970 -5.624 720 HG3 GLN 99 2HG GLN 99 17.923 2.443 -7.260 721 HE21 GLN 99 1HE2 GLN 99 18.584 4.939 -7.224 722 HE22 GLN 99 2HE2 GLN 99 19.819 5.297 -6.071 723 H LEU 100 H LEU 100 14.546 2.116 -4.714 724 HA LEU 100 HA LEU 100 16.189 1.228 -2.459 725 HB2 LEU 100 1HB LEU 100 13.995 2.509 -1.834 726 HB3 LEU 100 2HB LEU 100 13.219 0.987 -2.267 727 HG LEU 100 HG LEU 100 14.934 -0.029 -0.572 728 HD11 LEU 100 1HD1 LEU 100 16.152 1.377 0.629 729 HD12 LEU 100 2HD1 LEU 100 14.706 2.248 1.138 730 HD13 LEU 100 3HD1 LEU 100 15.537 2.711 -0.347 731 HD21 LEU 100 3HD2 LEU 100 13.293 0.372 1.253 732 HD22 LEU 100 1HD2 LEU 100 12.559 -0.160 -0.260 733 HD23 LEU 100 2HD2 LEU 100 12.480 1.538 0.209 734 H LYS 101 H LYS 101 16.647 -0.879 -2.542 735 HA LYS 101 HA LYS 101 15.110 -2.546 -4.422 736 HB2 LYS 101 1HB LYS 101 17.660 -2.022 -4.746 737 HB3 LYS 101 2HB LYS 101 17.873 -3.254 -3.509 738 HG2 LYS 101 1HG LYS 101 18.014 -4.552 -5.366 739 HG3 LYS 101 2HG LYS 101 16.271 -4.625 -5.097 740 HD2 LYS 101 1HD LYS 101 16.568 -4.175 -7.403 741 HD3 LYS 101 2HD LYS 101 16.074 -2.650 -6.664 742 HE2 LYS 101 1HE LYS 101 18.226 -1.751 -6.805 743 HE3 LYS 101 2HE LYS 101 18.972 -3.334 -7.024 744 HZ1 LYS 101 3HZ LYS 101 18.315 -1.569 -9.003 745 HZ2 LYS 101 1HZ LYS 101 17.096 -2.738 -9.092 746 HZ3 LYS 101 2HZ LYS 101 18.718 -3.198 -9.213 747 H LEU 102 H LEU 102 13.865 -4.032 -3.513 748 HA LEU 102 HA LEU 102 14.619 -5.069 -0.860 749 HB2 LEU 102 1HB LEU 102 11.862 -4.971 -2.070 750 HB3 LEU 102 2HB LEU 102 12.283 -5.450 -0.427 751 HG LEU 102 HG LEU 102 12.680 -2.669 -1.522 752 HD11 LEU 102 1HD1 LEU 102 10.696 -2.144 -0.053 753 HD12 LEU 102 2HD1 LEU 102 10.380 -3.878 -0.009 754 HD13 LEU 102 3HD1 LEU 102 10.344 -3.015 -1.546 755 HD21 LEU 102 3HD2 LEU 102 12.545 -2.351 1.106 756 HD22 LEU 102 1HD2 LEU 102 14.061 -2.730 0.288 757 HD23 LEU 102 2HD2 LEU 102 13.145 -4.009 1.086 758 H THR 103 H THR 103 14.795 -7.225 -0.562 759 HA THR 103 HA THR 103 13.830 -9.050 -2.631 760 HB THR 103 HB THR 103 16.697 -9.110 -1.671 761 HG1 THR 103 1HG THR 103 15.883 -8.582 -4.325 762 HG21 THR 103 3HG2 THR 103 15.689 -11.311 -2.223 763 HG22 THR 103 1HG2 THR 103 17.004 -10.862 -3.308 764 HG23 THR 103 2HG2 THR 103 15.330 -10.705 -3.840 765 H VAL 104 H VAL 104 13.371 -11.108 -1.903 766 HA VAL 104 HA VAL 104 12.827 -11.400 0.861 767 HB VAL 104 HB VAL 104 12.838 -13.468 -1.340 768 HG11 VAL 104 1HG1 VAL 104 11.563 -13.656 1.385 769 HG12 VAL 104 2HG1 VAL 104 11.595 -14.898 0.132 770 HG13 VAL 104 3HG1 VAL 104 13.087 -14.426 0.944 771 HG21 VAL 104 3HG2 VAL 104 11.093 -11.316 -0.787 772 HG22 VAL 104 1HG2 VAL 104 10.895 -12.603 -1.977 773 HG23 VAL 104 2HG2 VAL 104 10.247 -12.799 -0.348 774 H VAL 105 H VAL 105 14.089 -12.074 2.461 775 HA VAL 105 HA VAL 105 16.786 -12.519 2.310 776 HB VAL 105 HB VAL 105 14.918 -13.780 4.323 777 HG11 VAL 105 1HG1 VAL 105 16.718 -14.253 5.652 778 HG12 VAL 105 2HG1 VAL 105 17.449 -14.477 4.062 779 HG13 VAL 105 3HG1 VAL 105 17.712 -12.977 4.951 780 HG21 VAL 105 3HG2 VAL 105 16.005 -11.632 5.564 781 HG22 VAL 105 1HG2 VAL 105 15.866 -11.027 3.913 782 HG23 VAL 105 2HG2 VAL 105 14.437 -11.622 4.758 783 H GLU 106 H GLU 106 18.119 -14.179 1.850 784 HA GLU 106 HA GLU 106 16.869 -16.752 1.143 785 HB2 GLU 106 1HB GLU 106 19.164 -15.255 -0.094 786 HB3 GLU 106 2HB GLU 106 18.989 -16.990 -0.317 787 HG2 GLU 106 1HG GLU 106 16.538 -16.280 -1.017 788 HG3 GLU 106 2HG GLU 106 17.355 -14.762 -1.386 789 H ASP 107 H ASP 107 19.594 -15.167 2.691 790 HA ASP 107 HA ASP 107 21.318 -17.158 3.288 791 HB2 ASP 107 1HB ASP 107 21.549 -16.025 5.592 792 HB3 ASP 107 2HB ASP 107 21.850 -15.046 4.159 793 H VAL 108 H VAL 108 18.304 -16.507 5.060 794 HA VAL 108 HA VAL 108 18.372 -19.291 6.015 795 HB VAL 108 HB VAL 108 19.001 -17.786 7.864 796 HG11 VAL 108 1HG1 VAL 108 16.237 -16.651 7.865 797 HG12 VAL 108 2HG1 VAL 108 17.707 -16.029 8.620 798 HG13 VAL 108 3HG1 VAL 108 17.492 -15.909 6.873 799 HG21 VAL 108 3HG2 VAL 108 16.509 -19.404 7.912 800 HG22 VAL 108 1HG2 VAL 108 18.039 -19.654 8.753 801 HG23 VAL 108 2HG2 VAL 108 16.900 -18.440 9.336 802 H THR 109 H THR 109 16.419 -20.353 6.104 803 HA THR 109 HA THR 109 14.421 -19.621 4.308 804 HB THR 109 HB THR 109 14.154 -21.497 6.665 805 HG1 THR 109 1HG THR 109 14.495 -22.998 4.712 806 HG21 THR 109 3HG2 THR 109 12.115 -20.579 5.168 807 HG22 THR 109 1HG2 THR 109 12.167 -22.209 5.837 808 HG23 THR 109 2HG2 THR 109 12.642 -21.928 4.162 809 H VAL 110 H VAL 110 12.603 -18.438 4.438 810 HA VAL 110 HA VAL 110 11.643 -17.583 7.074 811 HB VAL 110 HB VAL 110 11.332 -15.275 6.265 812 HG11 VAL 110 1HG1 VAL 110 13.208 -15.296 7.547 813 HG12 VAL 110 2HG1 VAL 110 14.001 -16.528 6.564 814 HG13 VAL 110 3HG1 VAL 110 13.948 -14.854 6.009 815 HG21 VAL 110 3HG2 VAL 110 13.078 -16.030 3.931 816 HG22 VAL 110 1HG2 VAL 110 11.320 -15.929 3.833 817 HG23 VAL 110 2HG2 VAL 110 12.265 -14.493 4.226 818 H GLY 111 H GLY 111 9.526 -16.197 6.668 819 HA2 GLY 111 1HA GLY 111 7.614 -17.956 5.596 820 HA3 GLY 111 2HA GLY 111 7.319 -16.283 6.046 821 H ARG 112 H ARG 112 8.616 -18.317 3.448 822 HA ARG 112 HA ARG 112 8.901 -16.458 1.445 823 HB2 ARG 112 1HB ARG 112 9.453 -18.911 1.327 824 HB3 ARG 112 2HB ARG 112 7.745 -19.219 1.042 825 HG2 ARG 112 1HG ARG 112 8.813 -19.233 -1.067 826 HG3 ARG 112 2HG ARG 112 7.910 -17.720 -0.963 827 HD2 ARG 112 1HD ARG 112 9.917 -16.963 -1.776 828 HD3 ARG 112 2HD ARG 112 10.181 -16.791 -0.041 829 HE ARG 112 HE ARG 112 11.429 -18.723 -1.818 830 HH11 ARG 112 1HH1 ARG 112 10.858 -17.649 1.444 831 HH12 ARG 112 2HH1 ARG 112 12.209 -18.510 2.103 832 HH21 ARG 112 1HH2 ARG 112 13.211 -19.862 -0.962 833 HH22 ARG 112 2HH2 ARG 112 13.547 -19.768 0.734 834 H ARG 113 H ARG 113 5.955 -18.338 2.154 835 HA ARG 113 HA ARG 113 4.283 -17.250 0.248 836 HB2 ARG 113 1HB ARG 113 2.419 -17.871 1.735 837 HB3 ARG 113 2HB ARG 113 3.627 -19.144 1.627 838 HG2 ARG 113 1HG ARG 113 4.562 -18.406 3.782 839 HG3 ARG 113 2HG ARG 113 3.286 -17.192 3.893 840 HD2 ARG 113 1HD ARG 113 1.653 -18.747 4.298 841 HD3 ARG 113 2HD ARG 113 2.506 -20.024 3.433 842 HE ARG 113 HE ARG 113 2.607 -19.540 6.200 843 HH11 ARG 113 1HH1 ARG 113 4.695 -20.330 3.528 844 HH12 ARG 113 2HH1 ARG 113 5.848 -21.172 4.510 845 HH21 ARG 113 1HH2 ARG 113 4.118 -20.646 7.502 846 HH22 ARG 113 2HH2 ARG 113 5.518 -21.352 6.770 847 H GLN 114 H GLN 114 4.876 -16.073 3.550 848 HA GLN 114 HA GLN 114 3.119 -13.901 3.487 849 HB2 GLN 114 1HB GLN 114 4.472 -14.916 5.456 850 HB3 GLN 114 2HB GLN 114 5.733 -13.796 4.960 851 HG2 GLN 114 1HG GLN 114 4.513 -12.754 6.696 852 HG3 GLN 114 2HG GLN 114 4.067 -11.949 5.193 853 HE21 GLN 114 1HE2 GLN 114 2.305 -11.342 6.818 854 HE22 GLN 114 2HE2 GLN 114 0.894 -12.338 6.805 855 H ALA 115 H ALA 115 6.669 -13.737 3.158 856 HA ALA 115 HA ALA 115 6.952 -11.142 2.382 857 HB1 ALA 115 1HB ALA 115 8.800 -12.759 2.769 858 HB2 ALA 115 2HB ALA 115 8.499 -13.422 1.162 859 HB3 ALA 115 3HB ALA 115 9.026 -11.749 1.341 860 H VAL 116 H VAL 116 6.932 -13.770 -0.030 861 HA VAL 116 HA VAL 116 6.687 -12.370 -2.323 862 HB VAL 116 HB VAL 116 5.137 -14.877 -1.657 863 HG11 VAL 116 1HG1 VAL 116 5.399 -15.186 -4.208 864 HG12 VAL 116 2HG1 VAL 116 4.137 -14.108 -3.608 865 HG13 VAL 116 3HG1 VAL 116 5.644 -13.440 -4.235 866 HG21 VAL 116 3HG2 VAL 116 7.246 -15.592 -3.248 867 HG22 VAL 116 1HG2 VAL 116 7.949 -14.330 -2.237 868 HG23 VAL 116 2HG2 VAL 116 7.198 -15.741 -1.491 869 H ALA 117 H ALA 117 4.041 -13.109 -0.092 870 HA ALA 117 HA ALA 117 1.972 -12.002 -1.668 871 HB1 ALA 117 1HB ALA 117 1.211 -11.744 1.011 872 HB2 ALA 117 2HB ALA 117 0.818 -13.061 -0.095 873 HB3 ALA 117 3HB ALA 117 2.240 -13.175 0.942 874 H TRP 118 H TRP 118 3.815 -10.672 1.073 875 HA TRP 118 HA TRP 118 2.599 -8.185 1.222 876 HB2 TRP 118 1HB TRP 118 4.272 -9.114 2.841 877 HB3 TRP 118 2HB TRP 118 5.538 -8.729 1.679 878 HD1 TRP 118 HD TRP 118 3.680 -7.267 4.525 879 HE1 TRP 118 1HE TRP 118 4.212 -4.759 4.755 880 HE3 TRP 118 3HE TRP 118 6.005 -6.516 0.035 881 HZ2 TRP 118 2HZ TRP 118 5.453 -2.731 3.234 882 HZ3 TRP 118 3HZ TRP 118 6.835 -4.262 -0.501 883 HH2 TRP 118 HH TRP 118 6.564 -2.410 1.066 884 H LEU 119 H LEU 119 5.031 -9.362 -1.004 885 HA LEU 119 HA LEU 119 5.819 -6.862 -2.062 886 HB2 LEU 119 1HB LEU 119 5.828 -9.580 -3.367 887 HB3 LEU 119 2HB LEU 119 6.697 -8.160 -3.946 888 HG LEU 119 HG LEU 119 7.237 -9.326 -1.233 889 HD11 LEU 119 1HD1 LEU 119 8.476 -11.007 -2.032 890 HD12 LEU 119 2HD1 LEU 119 9.109 -10.037 -3.361 891 HD13 LEU 119 3HD1 LEU 119 7.530 -10.807 -3.507 892 HD21 LEU 119 3HD2 LEU 119 8.251 -7.149 -2.821 893 HD22 LEU 119 1HD2 LEU 119 9.535 -8.294 -2.436 894 HD23 LEU 119 2HD2 LEU 119 8.587 -7.564 -1.140 895 H VAL 120 H VAL 120 3.692 -9.344 -3.499 896 HA VAL 120 HA VAL 120 2.735 -7.671 -5.562 897 HB VAL 120 HB VAL 120 2.600 -10.094 -5.742 898 HG11 VAL 120 1HG1 VAL 120 2.114 -11.154 -3.821 899 HG12 VAL 120 2HG1 VAL 120 1.148 -9.811 -3.206 900 HG13 VAL 120 3HG1 VAL 120 0.441 -10.959 -4.343 901 HG21 VAL 120 3HG2 VAL 120 0.557 -8.274 -6.380 902 HG22 VAL 120 1HG2 VAL 120 0.899 -9.825 -7.146 903 HG23 VAL 120 2HG2 VAL 120 -0.246 -9.736 -5.807 904 H ALA 121 H ALA 121 1.801 -8.092 -2.250 905 HA ALA 121 HA ALA 121 -0.828 -7.028 -2.453 906 HB1 ALA 121 1HB ALA 121 -0.696 -8.118 -0.484 907 HB2 ALA 121 2HB ALA 121 1.020 -7.766 -0.279 908 HB3 ALA 121 3HB ALA 121 -0.185 -6.540 0.115 909 H MET 122 H MET 122 2.321 -5.616 -1.631 910 HA MET 122 HA MET 122 1.446 -3.051 -0.963 911 HB2 MET 122 1HB MET 122 3.730 -3.866 -0.548 912 HB3 MET 122 2HB MET 122 4.048 -3.854 -2.278 913 HG2 MET 122 1HG MET 122 5.031 -1.900 -1.460 914 HG3 MET 122 2HG MET 122 3.526 -1.378 -2.213 915 HE1 MET 122 3HE MET 122 4.187 1.009 -0.553 916 HE2 MET 122 1HE MET 122 2.657 0.558 -1.306 917 HE3 MET 122 2HE MET 122 2.688 1.100 0.372 918 H HIS 123 H HIS 123 2.484 -4.351 -4.105 919 HA HIS 123 HA HIS 123 2.227 -2.004 -5.593 920 HB2 HIS 123 1HB HIS 123 3.261 -4.229 -6.305 921 HB3 HIS 123 2HB HIS 123 1.620 -4.753 -6.674 922 HD2 HIS 123 2HD HIS 123 4.049 -1.869 -7.876 923 HE1 HIS 123 1HE HIS 123 1.360 -2.869 -11.001 924 HE2 HIS 123 2HE HIS 123 3.393 -1.531 -10.355 925 H LYS 124 H LYS 124 -0.106 -4.699 -5.405 926 HA LYS 124 HA LYS 124 -2.189 -3.757 -6.823 927 HB2 LYS 124 1HB LYS 124 -2.114 -5.258 -4.230 928 HB3 LYS 124 2HB LYS 124 -3.662 -4.776 -4.911 929 HG2 LYS 124 1HG LYS 124 -2.699 -5.904 -7.077 930 HG3 LYS 124 2HG LYS 124 -1.681 -6.755 -5.912 931 HD2 LYS 124 1HD LYS 124 -4.666 -6.595 -5.600 932 HD3 LYS 124 2HD LYS 124 -3.894 -7.854 -6.568 933 HE2 LYS 124 1HE LYS 124 -2.990 -7.345 -3.763 934 HE3 LYS 124 2HE LYS 124 -4.443 -8.298 -4.063 935 HZ1 LYS 124 3HZ LYS 124 -2.124 -9.440 -3.894 936 HZ2 LYS 124 1HZ LYS 124 -1.982 -8.971 -5.514 937 HZ3 LYS 124 2HZ LYS 124 -3.255 -9.975 -5.033 938 H ALA 125 H ALA 125 -1.933 -3.109 -3.321 939 HA ALA 125 HA ALA 125 -3.952 -1.173 -3.237 940 HB1 ALA 125 1HB ALA 125 -3.441 -1.952 -1.148 941 HB2 ALA 125 2HB ALA 125 -1.702 -1.932 -1.444 942 HB3 ALA 125 3HB ALA 125 -2.561 -0.424 -1.131 943 H ALA 126 H ALA 126 -0.418 -0.756 -3.412 944 HA ALA 126 HA ALA 126 -0.064 1.898 -3.324 945 HB1 ALA 126 1HB ALA 126 1.246 -0.267 -4.761 946 HB2 ALA 126 2HB ALA 126 1.450 1.302 -5.541 947 HB3 ALA 126 3HB ALA 126 1.942 1.081 -3.862 948 H LYS 127 H LYS 127 -1.271 0.163 -6.178 949 HA LYS 127 HA LYS 127 -1.461 2.277 -7.952 950 HB2 LYS 127 1HB LYS 127 -3.144 -0.198 -7.611 951 HB3 LYS 127 2HB LYS 127 -3.435 0.948 -8.913 952 HG2 LYS 127 1HG LYS 127 -0.694 -0.159 -8.528 953 HG3 LYS 127 2HG LYS 127 -1.935 -1.147 -9.302 954 HD2 LYS 127 1HD LYS 127 -1.522 1.657 -10.233 955 HD3 LYS 127 2HD LYS 127 -0.373 0.411 -10.727 956 HE2 LYS 127 1HE LYS 127 -1.997 0.486 -12.431 957 HE3 LYS 127 2HE LYS 127 -2.386 -0.941 -11.472 958 HZ1 LYS 127 3HZ LYS 127 -4.284 -0.015 -10.692 959 HZ2 LYS 127 1HZ LYS 127 -4.203 0.825 -12.158 960 HZ3 LYS 127 2HZ LYS 127 -3.683 1.566 -10.730 961 H LEU 128 H LEU 128 -3.817 1.205 -5.526 962 HA LEU 128 HA LEU 128 -5.899 2.934 -6.141 963 HB2 LEU 128 1HB LEU 128 -4.981 1.752 -3.538 964 HB3 LEU 128 2HB LEU 128 -6.422 2.760 -3.650 965 HG LEU 128 HG LEU 128 -6.106 0.286 -5.322 966 HD11 LEU 128 1HD1 LEU 128 -7.728 -0.563 -3.379 967 HD12 LEU 128 2HD1 LEU 128 -6.700 0.514 -2.434 968 HD13 LEU 128 3HD1 LEU 128 -5.982 -0.813 -3.348 969 HD21 LEU 128 3HD2 LEU 128 -8.116 2.317 -4.929 970 HD22 LEU 128 1HD2 LEU 128 -8.750 0.715 -4.553 971 HD23 LEU 128 2HD2 LEU 128 -8.036 1.031 -6.134 972 H LEU 129 H LEU 129 -3.193 3.443 -3.887 973 HA LEU 129 HA LEU 129 -3.737 5.847 -2.797 974 HB2 LEU 129 1HB LEU 129 -1.131 4.887 -3.955 975 HB3 LEU 129 2HB LEU 129 -1.271 6.359 -2.995 976 HG LEU 129 HG LEU 129 -2.258 3.804 -1.823 977 HD11 LEU 129 1HD1 LEU 129 0.553 4.365 -1.265 978 HD12 LEU 129 2HD1 LEU 129 0.244 3.836 -2.918 979 HD13 LEU 129 3HD1 LEU 129 -0.264 2.830 -1.562 980 HD21 LEU 129 3HD2 LEU 129 -2.594 5.383 -0.254 981 HD22 LEU 129 1HD2 LEU 129 -1.388 6.473 -0.940 982 HD23 LEU 129 2HD2 LEU 129 -0.881 5.130 0.085 983 H TYR 130 H TYR 130 -1.983 5.565 -5.894 984 HA TYR 130 HA TYR 130 -2.750 8.315 -6.527 985 HB2 TYR 130 1HB TYR 130 -1.165 7.799 -8.545 986 HB3 TYR 130 2HB TYR 130 -0.482 8.099 -6.951 987 HD1 TYR 130 2HD TYR 130 0.125 6.074 -5.517 988 HD2 TYR 130 1HD TYR 130 -0.713 5.800 -9.680 989 HE1 TYR 130 2HE TYR 130 1.285 3.908 -5.602 990 HE2 TYR 130 1HE TYR 130 0.444 3.632 -9.776 991 HH TYR 130 HH TYR 130 1.624 2.122 -8.654 992 H GLU 131 H GLU 131 -2.520 5.249 -8.343 993 HA GLU 131 HA GLU 131 -4.315 6.091 -10.369 994 HB2 GLU 131 1HB GLU 131 -3.129 3.450 -9.581 995 HB3 GLU 131 2HB GLU 131 -4.386 3.524 -10.809 996 HG2 GLU 131 1HG GLU 131 -2.789 5.379 -11.809 997 HG3 GLU 131 2HG GLU 131 -1.580 4.473 -10.902 998 H SER 132 H SER 132 -6.397 5.099 -10.870 999 HA SER 132 HA SER 132 -8.598 4.860 -10.301 1000 HB2 SER 132 1HB SER 132 -7.721 2.539 -10.070 1001 HB3 SER 132 2HB SER 132 -7.453 2.843 -8.354 1002 HG SER 132 HG SER 132 -9.609 1.909 -9.360 1003 H ARG 133 H ARG 133 -7.715 7.092 -9.133 1004 HA ARG 133 HA ARG 133 -7.629 7.486 -6.463 1005 HB2 ARG 133 1HB ARG 133 -8.528 9.684 -6.800 1006 HB3 ARG 133 2HB ARG 133 -7.576 9.267 -8.218 1007 HG2 ARG 133 1HG ARG 133 -10.490 8.699 -8.274 1008 HG3 ARG 133 2HG ARG 133 -9.957 10.376 -8.418 1009 HD2 ARG 133 1HD ARG 133 -9.933 9.793 -10.620 1010 HD3 ARG 133 2HD ARG 133 -8.295 9.310 -10.180 1011 HE ARG 133 HE ARG 133 -9.826 7.086 -9.737 1012 HH11 ARG 133 1HH1 ARG 133 -9.204 9.169 -12.456 1013 HH12 ARG 133 2HH1 ARG 133 -9.430 7.918 -13.633 1014 HH21 ARG 133 1HH2 ARG 133 -10.126 5.430 -11.277 1015 HH22 ARG 133 2HH2 ARG 133 -9.955 5.792 -12.962 1016 H ASP 134 H ASP 134 -9.273 8.201 -4.896 1017 HA ASP 134 HA ASP 134 -11.650 6.491 -5.082 1018 HB2 ASP 134 1HB ASP 134 -11.790 6.742 -2.637 1019 HB3 ASP 134 2HB ASP 134 -10.222 6.113 -3.134 1020 H GLN 135 H GLN 135 -13.534 7.392 -5.547 1021 HA GLN 135 HA GLN 135 -13.868 10.218 -5.694 1022 HB2 GLN 135 1HB GLN 135 -16.189 9.692 -6.331 1023 HB3 GLN 135 2HB GLN 135 -15.022 8.752 -7.251 1024 HG2 GLN 135 1HG GLN 135 -15.430 6.828 -5.800 1025 HG3 GLN 135 2HG GLN 135 -16.609 7.771 -4.889 1026 HE21 GLN 135 1HE2 GLN 135 -18.081 6.050 -5.459 1027 HE22 GLN 135 2HE2 GLN 135 -18.868 6.078 -6.996 1028 H SER 136 H SER 136 -15.093 7.704 -3.516 1029 HA SER 136 HA SER 136 -15.565 9.762 -1.494 1030 HB2 SER 136 1HB SER 136 -17.783 8.936 -0.962 1031 HB3 SER 136 2HB SER 136 -17.730 9.368 -2.671 1032 HG SER 136 HG SER 136 -17.717 7.255 -3.219 1033 H GLY 137 H GLY 137 -15.510 9.002 0.653 1034 HA2 GLY 137 1HA GLY 137 -15.549 6.643 1.825 1035 HA3 GLY 137 2HA GLY 137 -14.044 6.486 0.931 1036 HA PRO 138 HA PRO 138 -12.263 8.094 4.672 1037 HB2 PRO 138 1HB PRO 138 -9.692 8.062 3.800 1038 HB3 PRO 138 2HB PRO 138 -10.551 6.604 4.313 1039 HG2 PRO 138 1HG PRO 138 -10.057 7.637 1.547 1040 HG3 PRO 138 2HG PRO 138 -9.938 5.977 2.159 1041 HD2 PRO 138 1HD PRO 138 -12.083 6.866 0.766 1042 HD3 PRO 138 2HD PRO 138 -12.215 5.636 2.040 1043 H SER 139 H SER 139 -12.655 9.617 1.747 1044 HA SER 139 HA SER 139 -10.999 11.687 1.436 1045 HB2 SER 139 1HB SER 139 -13.296 11.264 0.332 1046 HB3 SER 139 2HB SER 139 -13.947 12.276 1.622 1047 HG SER 139 HG SER 139 -13.472 13.764 0.168 1048 H SER 140 H SER 140 -10.104 13.191 2.669 1049 HA SER 140 HA SER 140 -9.618 14.459 4.504 1050 HB2 SER 140 1HB SER 140 -11.715 15.561 3.312 1051 HB3 SER 140 2HB SER 140 -12.514 15.123 4.822 1052 HG SER 140 HG SER 140 -11.269 17.271 4.519 1053 H GLY 141 H GLY 141 -9.775 11.862 5.236 1054 HA2 GLY 141 1HA GLY 141 -9.613 11.063 7.505 1055 HA3 GLY 141 2HA GLY 141 -11.006 12.056 7.906 Start of MODEL 6 1 H1 GLY 1 H GLY 1 -19.906 0.013 10.559 2 HA2 GLY 1 1HA GLY 1 -19.838 0.057 13.495 3 HA3 GLY 1 2HA GLY 1 -21.287 0.075 12.502 4 H SER 2 H SER 2 -22.422 -1.712 12.814 5 HA SER 2 HA SER 2 -20.967 -4.258 13.110 6 HB2 SER 2 1HB SER 2 -23.509 -3.255 14.363 7 HB3 SER 2 2HB SER 2 -23.210 -4.986 14.209 8 HG SER 2 HG SER 2 -21.915 -3.082 15.787 9 H SER 3 H SER 3 -24.019 -2.870 11.912 10 HA SER 3 HA SER 3 -24.269 -5.125 10.055 11 HB2 SER 3 1HB SER 3 -26.257 -3.015 10.920 12 HB3 SER 3 2HB SER 3 -26.589 -4.239 9.694 13 HG SER 3 HG SER 3 -25.609 -5.121 12.146 14 H GLY 4 H GLY 4 -22.886 -4.613 8.400 15 HA2 GLY 4 1HA GLY 4 -23.642 -2.238 6.825 16 HA3 GLY 4 2HA GLY 4 -21.950 -2.585 7.149 17 H SER 5 H SER 5 -22.276 -2.389 4.637 18 HA SER 5 HA SER 5 -22.561 -5.140 3.624 19 HB2 SER 5 1HB SER 5 -24.401 -3.398 2.982 20 HB3 SER 5 2HB SER 5 -23.172 -2.771 1.884 21 HG SER 5 HG SER 5 -23.024 -5.147 1.267 22 H SER 6 H SER 6 -20.150 -4.113 4.521 23 HA SER 6 HA SER 6 -18.667 -3.840 1.992 24 HB2 SER 6 1HB SER 6 -18.487 -1.681 2.928 25 HB3 SER 6 2HB SER 6 -18.299 -2.313 4.564 26 HG SER 6 HG SER 6 -16.409 -2.859 2.538 27 H GLY 7 H GLY 7 -16.738 -4.957 1.834 28 HA2 GLY 7 1HA GLY 7 -15.126 -6.061 3.697 29 HA3 GLY 7 2HA GLY 7 -16.468 -7.195 3.647 30 H ALA 8 H ALA 8 -13.737 -5.893 1.926 31 HA ALA 8 HA ALA 8 -14.165 -7.777 -0.280 32 HB1 ALA 8 1HB ALA 8 -11.884 -6.332 -0.867 33 HB2 ALA 8 2HB ALA 8 -13.509 -6.015 -1.475 34 HB3 ALA 8 3HB ALA 8 -12.921 -5.167 -0.044 35 H GLU 9 H GLU 9 -13.641 -9.582 1.174 36 HA GLU 9 HA GLU 9 -11.497 -10.138 2.647 37 HB2 GLU 9 1HB GLU 9 -11.455 -12.450 1.461 38 HB3 GLU 9 2HB GLU 9 -12.904 -11.954 2.324 39 HG2 GLU 9 1HG GLU 9 -13.871 -12.681 0.416 40 HG3 GLU 9 2HG GLU 9 -13.553 -11.015 -0.066 41 H PHE 10 H PHE 10 -11.426 -10.361 -0.909 42 HA PHE 10 HA PHE 10 -8.873 -11.108 -1.389 43 HB2 PHE 10 1HB PHE 10 -10.750 -10.324 -3.024 44 HB3 PHE 10 2HB PHE 10 -9.957 -8.757 -2.907 45 HD1 PHE 10 2HD PHE 10 -8.933 -12.321 -3.364 46 HD2 PHE 10 1HD PHE 10 -8.500 -8.270 -4.597 47 HE1 PHE 10 2HE PHE 10 -7.311 -13.019 -5.077 48 HE2 PHE 10 1HE PHE 10 -6.878 -8.962 -6.313 49 HZ PHE 10 HZ PHE 10 -6.280 -11.340 -6.553 50 H TYR 11 H TYR 11 -9.858 -7.715 -0.907 51 HA TYR 11 HA TYR 11 -7.168 -6.769 -0.802 52 HB2 TYR 11 1HB TYR 11 -9.253 -5.441 -1.455 53 HB3 TYR 11 2HB TYR 11 -9.584 -5.316 0.270 54 HD1 TYR 11 2HD TYR 11 -6.955 -4.589 -2.268 55 HD2 TYR 11 1HD TYR 11 -8.628 -3.594 1.516 56 HE1 TYR 11 2HE TYR 11 -5.470 -2.634 -2.132 57 HE2 TYR 11 1HE TYR 11 -7.147 -1.635 1.661 58 HH TYR 11 HH TYR 11 -4.975 -0.772 -1.002 59 H ASP 12 H ASP 12 -9.656 -7.423 1.637 60 HA ASP 12 HA ASP 12 -8.424 -6.500 3.909 61 HB2 ASP 12 1HB ASP 12 -9.935 -9.113 3.745 62 HB3 ASP 12 2HB ASP 12 -9.754 -8.075 5.157 63 H LYS 13 H LYS 13 -8.252 -9.897 2.826 64 HA LYS 13 HA LYS 13 -6.426 -10.919 4.523 65 HB2 LYS 13 1HB LYS 13 -6.946 -11.378 1.629 66 HB3 LYS 13 2HB LYS 13 -5.501 -12.105 2.318 67 HG2 LYS 13 1HG LYS 13 -6.984 -13.115 4.082 68 HG3 LYS 13 2HG LYS 13 -8.360 -12.566 3.122 69 HD2 LYS 13 1HD LYS 13 -8.132 -14.668 2.266 70 HD3 LYS 13 2HD LYS 13 -7.027 -13.807 1.192 71 HE2 LYS 13 1HE LYS 13 -5.943 -14.897 3.736 72 HE3 LYS 13 2HE LYS 13 -6.323 -16.035 2.444 73 HZ1 LYS 13 3HZ LYS 13 -4.908 -14.701 0.961 74 HZ2 LYS 13 1HZ LYS 13 -4.046 -15.346 2.266 75 HZ3 LYS 13 2HZ LYS 13 -4.483 -13.712 2.265 76 H GLN 14 H GLN 14 -5.668 -8.929 1.691 77 HA GLN 14 HA GLN 14 -2.867 -9.079 1.906 78 HB2 GLN 14 1HB GLN 14 -4.620 -6.916 0.728 79 HB3 GLN 14 2HB GLN 14 -2.876 -7.005 0.522 80 HG2 GLN 14 1HG GLN 14 -2.992 -8.810 -0.886 81 HG3 GLN 14 2HG GLN 14 -4.540 -9.351 -0.238 82 HE21 GLN 14 1HE2 GLN 14 -3.401 -6.276 -1.593 83 HE22 GLN 14 2HE2 GLN 14 -4.634 -6.154 -2.797 84 H LEU 15 H LEU 15 -5.239 -6.938 3.381 85 HA LEU 15 HA LEU 15 -3.620 -4.944 4.383 86 HB2 LEU 15 1HB LEU 15 -5.968 -6.241 5.760 87 HB3 LEU 15 2HB LEU 15 -5.286 -4.665 6.154 88 HG LEU 15 HG LEU 15 -6.728 -5.427 3.617 89 HD11 LEU 15 1HD1 LEU 15 -7.846 -4.835 5.978 90 HD12 LEU 15 2HD1 LEU 15 -8.555 -4.379 4.430 91 HD13 LEU 15 3HD1 LEU 15 -7.612 -3.205 5.347 92 HD21 LEU 15 3HD2 LEU 15 -5.081 -3.056 4.353 93 HD22 LEU 15 1HD2 LEU 15 -6.518 -2.823 3.358 94 HD23 LEU 15 2HD2 LEU 15 -5.229 -3.893 2.807 95 H LYS 16 H LYS 16 -4.759 -7.650 6.404 96 HA LYS 16 HA LYS 16 -3.120 -7.386 8.542 97 HB2 LYS 16 1HB LYS 16 -3.217 -9.891 8.771 98 HB3 LYS 16 2HB LYS 16 -4.774 -9.103 8.549 99 HG2 LYS 16 1HG LYS 16 -4.834 -9.764 6.236 100 HG3 LYS 16 2HG LYS 16 -3.205 -10.433 6.350 101 HD2 LYS 16 1HD LYS 16 -4.227 -11.888 8.252 102 HD3 LYS 16 2HD LYS 16 -5.767 -11.468 7.498 103 HE2 LYS 16 1HE LYS 16 -5.002 -12.384 5.381 104 HE3 LYS 16 2HE LYS 16 -3.427 -12.746 6.086 105 HZ1 LYS 16 3HZ LYS 16 -5.798 -14.287 6.151 106 HZ2 LYS 16 1HZ LYS 16 -5.306 -13.932 7.731 107 HZ3 LYS 16 2HZ LYS 16 -4.242 -14.706 6.668 108 H VAL 17 H VAL 17 -2.278 -8.967 5.486 109 HA VAL 17 HA VAL 17 0.258 -9.901 6.203 110 HB VAL 17 HB VAL 17 -0.789 -9.020 3.513 111 HG11 VAL 17 1HG1 VAL 17 1.315 -10.874 3.221 112 HG12 VAL 17 2HG1 VAL 17 1.272 -9.187 2.704 113 HG13 VAL 17 3HG1 VAL 17 1.894 -9.606 4.301 114 HG21 VAL 17 3HG2 VAL 17 -0.637 -11.631 3.269 115 HG22 VAL 17 1HG2 VAL 17 -0.746 -11.585 5.029 116 HG23 VAL 17 2HG2 VAL 17 -2.029 -10.877 4.046 117 H LEU 18 H LEU 18 -0.612 -6.887 4.506 118 HA LEU 18 HA LEU 18 1.959 -5.814 4.360 119 HB2 LEU 18 1HB LEU 18 -0.690 -4.393 4.584 120 HB3 LEU 18 2HB LEU 18 0.828 -3.629 4.117 121 HG LEU 18 HG LEU 18 -0.360 -5.899 2.546 122 HD11 LEU 18 1HD1 LEU 18 -0.953 -3.759 1.046 123 HD12 LEU 18 2HD1 LEU 18 -1.174 -3.065 2.651 124 HD13 LEU 18 3HD1 LEU 18 -2.089 -4.496 2.177 125 HD21 LEU 18 3HD2 LEU 18 1.001 -4.161 0.888 126 HD22 LEU 18 1HD2 LEU 18 1.605 -5.695 1.515 127 HD23 LEU 18 2HD2 LEU 18 1.980 -4.190 2.355 128 H LEU 19 H LEU 19 -0.596 -5.024 6.723 129 HA LEU 19 HA LEU 19 0.848 -3.351 8.366 130 HB2 LEU 19 1HB LEU 19 -1.250 -5.367 9.152 131 HB3 LEU 19 2HB LEU 19 -0.689 -4.046 10.174 132 HG LEU 19 HG LEU 19 -2.088 -3.691 7.525 133 HD11 LEU 19 1HD1 LEU 19 -3.306 -4.662 9.688 134 HD12 LEU 19 2HD1 LEU 19 -4.085 -3.531 8.582 135 HD13 LEU 19 3HD1 LEU 19 -3.371 -2.945 10.084 136 HD21 LEU 19 3HD2 LEU 19 -2.289 -1.362 8.228 137 HD22 LEU 19 1HD2 LEU 19 -0.597 -1.850 8.120 138 HD23 LEU 19 2HD2 LEU 19 -1.378 -1.720 9.697 139 H SER 20 H SER 20 0.485 -6.879 8.713 140 HA SER 20 HA SER 20 1.948 -7.365 10.948 141 HB2 SER 20 1HB SER 20 1.562 -8.884 8.411 142 HB3 SER 20 2HB SER 20 2.785 -9.466 9.540 143 HG SER 20 HG SER 20 0.034 -9.026 10.086 144 H GLY 21 H GLY 21 3.238 -6.796 7.694 145 HA2 GLY 21 1HA GLY 21 5.274 -5.753 7.192 146 HA3 GLY 21 2HA GLY 21 5.752 -5.925 8.875 147 H ALA 22 H ALA 22 6.953 -6.657 6.137 148 HA ALA 22 HA ALA 22 7.765 -9.375 6.926 149 HB1 ALA 22 1HB ALA 22 6.491 -8.542 4.480 150 HB2 ALA 22 2HB ALA 22 8.074 -9.250 4.157 151 HB3 ALA 22 3HB ALA 22 6.865 -10.167 5.056 152 H THR 23 H THR 23 9.913 -9.817 6.835 153 HA THR 23 HA THR 23 11.733 -7.634 6.723 154 HB THR 23 HB THR 23 12.437 -10.572 6.690 155 HG1 THR 23 1HG THR 23 12.346 -9.058 9.055 156 HG21 THR 23 3HG2 THR 23 13.990 -8.344 7.968 157 HG22 THR 23 1HG2 THR 23 14.191 -8.729 6.259 158 HG23 THR 23 2HG2 THR 23 14.544 -9.947 7.485 159 H PHE 24 H PHE 24 13.147 -7.010 5.162 160 HA PHE 24 HA PHE 24 13.419 -8.608 2.740 161 HB2 PHE 24 1HB PHE 24 12.424 -5.751 2.728 162 HB3 PHE 24 2HB PHE 24 12.921 -6.647 1.296 163 HD1 PHE 24 2HD PHE 24 11.607 -8.625 0.568 164 HD2 PHE 24 1HD PHE 24 10.285 -6.042 3.682 165 HE1 PHE 24 2HE PHE 24 9.324 -9.512 0.331 166 HE2 PHE 24 1HE PHE 24 8.000 -6.926 3.450 167 HZ PHE 24 HZ PHE 24 7.517 -8.663 1.772 168 H LEU 25 H LEU 25 15.226 -8.019 1.439 169 HA LEU 25 HA LEU 25 17.366 -6.823 2.993 170 HB2 LEU 25 1HB LEU 25 17.209 -8.418 0.472 171 HB3 LEU 25 2HB LEU 25 18.665 -7.493 0.833 172 HG LEU 25 HG LEU 25 17.500 -9.714 2.509 173 HD11 LEU 25 1HD1 LEU 25 19.970 -10.519 1.861 174 HD12 LEU 25 2HD1 LEU 25 19.585 -9.572 0.424 175 HD13 LEU 25 3HD1 LEU 25 18.542 -10.911 0.902 176 HD21 LEU 25 3HD2 LEU 25 19.665 -7.729 2.990 177 HD22 LEU 25 1HD2 LEU 25 19.882 -9.378 3.577 178 HD23 LEU 25 2HD2 LEU 25 18.498 -8.426 4.115 179 H VAL 26 H VAL 26 17.345 -4.653 2.978 180 HA VAL 26 HA VAL 26 16.767 -3.219 0.500 181 HB VAL 26 HB VAL 26 17.304 -2.106 3.258 182 HG11 VAL 26 1HG1 VAL 26 16.988 -0.892 0.653 183 HG12 VAL 26 2HG1 VAL 26 15.761 -0.324 1.786 184 HG13 VAL 26 3HG1 VAL 26 17.472 -0.163 2.184 185 HG21 VAL 26 3HG2 VAL 26 14.875 -3.189 1.983 186 HG22 VAL 26 1HG2 VAL 26 15.305 -3.065 3.688 187 HG23 VAL 26 2HG2 VAL 26 14.683 -1.655 2.830 188 H THR 27 H THR 27 18.252 -2.158 -0.680 189 HA THR 27 HA THR 27 21.038 -2.232 0.275 190 HB THR 27 HB THR 27 20.276 -1.919 -2.615 191 HG1 THR 27 1HG THR 27 20.744 -4.331 -2.566 192 HG21 THR 27 3HG2 THR 27 22.641 -3.455 -1.744 193 HG22 THR 27 1HG2 THR 27 22.673 -1.729 -1.386 194 HG23 THR 27 2HG2 THR 27 22.469 -2.281 -3.048 195 H PHE 28 H PHE 28 21.196 -0.263 1.278 196 HA PHE 28 HA PHE 28 20.099 2.149 0.492 197 HB2 PHE 28 1HB PHE 28 22.679 1.562 1.948 198 HB3 PHE 28 2HB PHE 28 22.043 3.191 1.743 199 HD1 PHE 28 2HD PHE 28 19.349 3.211 2.333 200 HD2 PHE 28 1HD PHE 28 22.326 0.683 4.023 201 HE1 PHE 28 2HE PHE 28 17.957 2.920 4.340 202 HE2 PHE 28 1HE PHE 28 20.938 0.386 6.033 203 HZ PHE 28 HZ PHE 28 18.751 1.506 6.194 204 H GLY 29 H GLY 29 21.761 4.093 -0.035 205 HA2 GLY 29 1HA GLY 29 22.485 3.661 -2.774 206 HA3 GLY 29 2HA GLY 29 22.685 5.152 -1.866 207 H ASN 30 H ASN 30 24.344 2.917 -3.527 208 HA ASN 30 HA ASN 30 26.581 2.543 -3.778 209 HB2 ASN 30 1HB ASN 30 27.075 4.306 -1.379 210 HB3 ASN 30 2HB ASN 30 28.179 3.941 -2.702 211 HD21 ASN 30 1HD2 ASN 30 28.465 5.599 -3.985 212 HD22 ASN 30 2HD2 ASN 30 27.272 6.766 -4.433 213 H SER 31 H SER 31 24.920 0.836 -2.229 214 HA SER 31 HA SER 31 26.891 -0.237 -0.317 215 HB2 SER 31 1HB SER 31 24.788 0.660 0.742 216 HB3 SER 31 2HB SER 31 23.891 -0.584 -0.130 217 HG SER 31 HG SER 31 25.187 -0.805 2.176 218 H GLU 32 H GLU 32 27.857 -1.608 -1.809 219 HA GLU 32 HA GLU 32 26.541 -3.276 -3.620 220 HB2 GLU 32 1HB GLU 32 28.599 -4.389 -3.909 221 HB3 GLU 32 2HB GLU 32 29.028 -2.737 -3.486 222 HG2 GLU 32 1HG GLU 32 28.883 -4.915 -1.432 223 HG3 GLU 32 2HG GLU 32 30.337 -4.613 -2.381 224 H LYS 33 H LYS 33 26.654 -3.425 -0.240 225 HA LYS 33 HA LYS 33 25.857 -6.260 -0.252 226 HB2 LYS 33 1HB LYS 33 27.670 -6.158 1.193 227 HB3 LYS 33 2HB LYS 33 27.252 -4.549 1.769 228 HG2 LYS 33 1HG LYS 33 25.780 -5.333 3.320 229 HG3 LYS 33 2HG LYS 33 25.385 -6.774 2.381 230 HD2 LYS 33 1HD LYS 33 28.104 -6.398 3.595 231 HD3 LYS 33 2HD LYS 33 26.765 -7.063 4.533 232 HE2 LYS 33 1HE LYS 33 27.448 -8.202 1.852 233 HE3 LYS 33 2HE LYS 33 28.376 -8.668 3.276 234 HZ1 LYS 33 3HZ LYS 33 26.695 -10.251 3.124 235 HZ2 LYS 33 1HZ LYS 33 25.507 -9.113 2.729 236 HZ3 LYS 33 2HZ LYS 33 26.121 -9.182 4.303 237 HA PRO 34 HA PRO 34 21.757 -4.876 0.681 238 HB2 PRO 34 1HB PRO 34 20.728 -7.298 1.349 239 HB3 PRO 34 2HB PRO 34 21.049 -6.819 -0.322 240 HG2 PRO 34 1HG PRO 34 22.696 -8.519 1.510 241 HG3 PRO 34 2HG PRO 34 22.322 -8.761 -0.206 242 HD2 PRO 34 1HD PRO 34 24.684 -7.744 0.640 243 HD3 PRO 34 2HD PRO 34 23.937 -7.269 -0.898 244 H GLU 35 H GLU 35 20.368 -4.616 2.477 245 HA GLU 35 HA GLU 35 21.568 -5.324 5.074 246 HB2 GLU 35 1HB GLU 35 21.789 -2.920 4.607 247 HB3 GLU 35 2HB GLU 35 20.050 -2.805 4.376 248 HG2 GLU 35 1HG GLU 35 20.177 -2.093 6.520 249 HG3 GLU 35 2HG GLU 35 20.019 -3.824 6.812 250 H THR 36 H THR 36 20.195 -5.963 6.718 251 HA THR 36 HA THR 36 17.616 -6.965 5.836 252 HB THR 36 HB THR 36 18.795 -7.284 8.592 253 HG1 THR 36 1HG THR 36 20.080 -8.833 7.846 254 HG21 THR 36 3HG2 THR 36 16.418 -8.186 7.294 255 HG22 THR 36 1HG2 THR 36 16.957 -8.491 8.945 256 HG23 THR 36 2HG2 THR 36 17.438 -9.581 7.644 257 H MET 37 H MET 37 15.909 -5.664 5.946 258 HA MET 37 HA MET 37 15.431 -4.180 8.420 259 HB2 MET 37 1HB MET 37 15.152 -2.926 5.684 260 HB3 MET 37 2HB MET 37 14.806 -2.156 7.227 261 HG2 MET 37 1HG MET 37 17.303 -2.717 7.735 262 HG3 MET 37 2HG MET 37 17.428 -2.809 5.980 263 HE1 MET 37 3HE MET 37 17.056 -0.867 9.082 264 HE2 MET 37 1HE MET 37 17.019 0.837 8.627 265 HE3 MET 37 2HE MET 37 15.545 -0.129 8.548 266 H THR 38 H THR 38 13.245 -3.795 8.878 267 HA THR 38 HA THR 38 11.419 -5.576 7.454 268 HB THR 38 HB THR 38 10.850 -4.058 10.001 269 HG1 THR 38 1HG THR 38 11.924 -5.550 11.073 270 HG21 THR 38 3HG2 THR 38 9.206 -5.858 10.350 271 HG22 THR 38 1HG2 THR 38 9.641 -6.545 8.785 272 HG23 THR 38 2HG2 THR 38 8.887 -4.953 8.871 273 H CYS 39 H CYS 39 10.054 -4.817 5.988 274 HA CYS 39 HA CYS 39 9.393 -1.951 6.028 275 HB2 CYS 39 1HB CYS 39 10.542 -3.203 4.000 276 HB3 CYS 39 2HB CYS 39 8.883 -3.662 3.634 277 HG CYS 39 HG CYS 39 9.774 -0.397 4.078 278 H ARG 40 H ARG 40 7.498 -1.604 6.986 279 HA ARG 40 HA ARG 40 5.238 -3.342 6.251 280 HB2 ARG 40 1HB ARG 40 4.369 -3.240 8.474 281 HB3 ARG 40 2HB ARG 40 6.055 -3.725 8.594 282 HG2 ARG 40 1HG ARG 40 6.506 -1.206 8.960 283 HG3 ARG 40 2HG ARG 40 4.783 -1.126 9.331 284 HD2 ARG 40 1HD ARG 40 5.255 -3.087 10.929 285 HD3 ARG 40 2HD ARG 40 6.950 -2.634 10.753 286 HE ARG 40 HE ARG 40 5.399 -0.368 11.418 287 HH11 ARG 40 1HH1 ARG 40 6.684 -3.296 12.794 288 HH12 ARG 40 2HH1 ARG 40 6.765 -2.659 14.403 289 HH21 ARG 40 1HH2 ARG 40 5.500 0.483 13.532 290 HH22 ARG 40 2HH2 ARG 40 6.091 -0.510 14.822 291 H LEU 41 H LEU 41 3.095 -2.260 6.653 292 HA LEU 41 HA LEU 41 3.269 0.533 5.764 293 HB2 LEU 41 1HB LEU 41 1.357 -1.685 5.296 294 HB3 LEU 41 2HB LEU 41 0.707 -0.048 5.336 295 HG LEU 41 HG LEU 41 3.003 -0.772 3.543 296 HD11 LEU 41 1HD1 LEU 41 0.200 -1.582 3.313 297 HD12 LEU 41 2HD1 LEU 41 1.634 -2.201 2.495 298 HD13 LEU 41 3HD1 LEU 41 0.837 -0.747 1.896 299 HD21 LEU 41 3HD2 LEU 41 2.515 1.601 3.936 300 HD22 LEU 41 1HD2 LEU 41 0.860 1.344 3.383 301 HD23 LEU 41 2HD2 LEU 41 2.206 1.132 2.263 302 H SER 42 H SER 42 1.854 2.113 6.646 303 HA SER 42 HA SER 42 1.560 1.935 9.466 304 HB2 SER 42 1HB SER 42 0.809 3.976 7.395 305 HB3 SER 42 2HB SER 42 0.238 4.148 9.054 306 HG SER 42 HG SER 42 2.860 4.233 8.051 307 H ASN 43 H ASN 43 -0.642 2.738 10.432 308 HA ASN 43 HA ASN 43 -2.461 0.677 10.321 309 HB2 ASN 43 1HB ASN 43 -2.825 3.567 11.111 310 HB3 ASN 43 2HB ASN 43 -4.102 2.368 11.300 311 HD21 ASN 43 1HD2 ASN 43 -3.695 3.264 13.564 312 HD22 ASN 43 2HD2 ASN 43 -2.588 2.366 14.540 313 H ASN 44 H ASN 44 -2.483 3.707 8.492 314 HA ASN 44 HA ASN 44 -4.785 2.734 6.952 315 HB2 ASN 44 1HB ASN 44 -3.599 5.477 7.342 316 HB3 ASN 44 2HB ASN 44 -4.752 5.140 6.054 317 HD21 ASN 44 1HD2 ASN 44 -5.515 6.996 7.726 318 HD22 ASN 44 2HD2 ASN 44 -6.707 6.426 8.840 319 H GLN 45 H GLN 45 -1.851 1.967 6.714 320 HA GLN 45 HA GLN 45 -0.227 1.731 5.106 321 HB2 GLN 45 1HB GLN 45 -2.607 1.395 3.284 322 HB3 GLN 45 2HB GLN 45 -1.030 0.629 3.147 323 HG2 GLN 45 1HG GLN 45 -2.194 -1.101 4.024 324 HG3 GLN 45 2HG GLN 45 -1.688 -0.323 5.522 325 HE21 GLN 45 1HE2 GLN 45 -3.597 -1.660 6.221 326 HE22 GLN 45 2HE2 GLN 45 -5.143 -0.888 6.187 327 H ARG 46 H ARG 46 -0.625 4.412 5.531 328 HA ARG 46 HA ARG 46 -0.728 5.603 2.848 329 HB2 ARG 46 1HB ARG 46 -1.111 6.735 5.607 330 HB3 ARG 46 2HB ARG 46 -0.768 7.781 4.236 331 HG2 ARG 46 1HG ARG 46 -2.785 6.438 3.174 332 HG3 ARG 46 2HG ARG 46 -3.206 6.222 4.874 333 HD2 ARG 46 1HD ARG 46 -2.565 8.912 3.696 334 HD3 ARG 46 2HD ARG 46 -4.196 8.242 3.689 335 HE ARG 46 HE ARG 46 -3.374 8.068 6.293 336 HH11 ARG 46 1HH1 ARG 46 -3.704 10.628 3.957 337 HH12 ARG 46 2HH1 ARG 46 -4.038 11.845 5.144 338 HH21 ARG 46 1HH2 ARG 46 -3.814 9.661 7.866 339 HH22 ARG 46 2HH2 ARG 46 -4.100 11.294 7.367 340 H TYR 47 H TYR 47 1.398 4.750 5.376 341 HA TYR 47 HA TYR 47 3.618 5.984 3.937 342 HB2 TYR 47 1HB TYR 47 3.104 6.382 6.890 343 HB3 TYR 47 2HB TYR 47 4.613 6.788 6.081 344 HD1 TYR 47 2HD TYR 47 0.975 7.554 6.099 345 HD2 TYR 47 1HD TYR 47 4.880 8.870 5.041 346 HE1 TYR 47 2HE TYR 47 0.070 9.770 5.538 347 HE2 TYR 47 1HE TYR 47 3.986 11.091 4.477 348 HH TYR 47 HH TYR 47 1.514 12.374 5.432 349 H LEU 48 H LEU 48 5.654 5.003 4.346 350 HA LEU 48 HA LEU 48 5.418 2.298 5.477 351 HB2 LEU 48 1HB LEU 48 7.361 3.390 3.447 352 HB3 LEU 48 2HB LEU 48 7.367 1.742 4.072 353 HG LEU 48 HG LEU 48 5.001 2.879 2.608 354 HD11 LEU 48 1HD1 LEU 48 7.303 2.887 1.355 355 HD12 LEU 48 2HD1 LEU 48 5.846 2.294 0.560 356 HD13 LEU 48 3HD1 LEU 48 7.006 1.153 1.239 357 HD21 LEU 48 3HD2 LEU 48 5.934 0.031 2.880 358 HD22 LEU 48 1HD2 LEU 48 4.366 0.617 2.324 359 HD23 LEU 48 2HD2 LEU 48 4.822 0.794 4.018 360 H PHE 49 H PHE 49 7.219 1.437 6.662 361 HA PHE 49 HA PHE 49 9.086 3.423 7.739 362 HB2 PHE 49 1HB PHE 49 7.195 1.695 9.317 363 HB3 PHE 49 2HB PHE 49 8.692 2.292 10.025 364 HD1 PHE 49 1HD PHE 49 9.016 4.676 10.425 365 HD2 PHE 49 2HD PHE 49 5.349 3.159 8.887 366 HE1 PHE 49 1HE PHE 49 7.906 6.799 10.985 367 HE2 PHE 49 2HE PHE 49 4.233 5.280 9.444 368 HZ PHE 49 HZ PHE 49 5.513 7.104 10.494 369 H LEU 50 H LEU 50 11.048 2.585 8.496 370 HA LEU 50 HA LEU 50 11.547 -0.221 7.748 371 HB2 LEU 50 1HB LEU 50 13.483 2.089 7.699 372 HB3 LEU 50 2HB LEU 50 13.838 0.427 7.230 373 HG LEU 50 HG LEU 50 11.860 2.210 5.813 374 HD11 LEU 50 1HD1 LEU 50 14.042 1.674 4.159 375 HD12 LEU 50 2HD1 LEU 50 14.735 2.147 5.710 376 HD13 LEU 50 3HD1 LEU 50 13.604 3.220 4.886 377 HD21 LEU 50 3HD2 LEU 50 11.382 -0.151 5.552 378 HD22 LEU 50 1HD2 LEU 50 13.059 -0.466 5.105 379 HD23 LEU 50 2HD2 LEU 50 12.032 0.503 4.048 380 H ASP 51 H ASP 51 12.983 -1.435 9.037 381 HA ASP 51 HA ASP 51 13.809 -0.269 11.587 382 HB2 ASP 51 1HB ASP 51 12.194 -2.821 11.391 383 HB3 ASP 51 2HB ASP 51 12.865 -2.130 12.866 384 H GLY 52 H GLY 52 15.905 -0.675 11.778 385 HA2 GLY 52 1HA GLY 52 17.039 -3.219 11.842 386 HA3 GLY 52 2HA GLY 52 17.279 -2.594 10.217 387 H ASP 53 H ASP 53 19.253 -1.812 9.974 388 HA ASP 53 HA ASP 53 21.132 -1.295 11.873 389 HB2 ASP 53 1HB ASP 53 21.301 -1.251 9.280 390 HB3 ASP 53 2HB ASP 53 20.981 0.472 9.449 391 H SER 54 H SER 54 18.842 1.062 10.522 392 HA SER 54 HA SER 54 19.035 2.614 12.979 393 HB2 SER 54 1HB SER 54 19.964 3.554 10.303 394 HB3 SER 54 2HB SER 54 19.132 4.709 11.344 395 HG SER 54 HG SER 54 21.050 3.223 12.629 396 H HIS 55 H HIS 55 17.255 3.985 13.345 397 HA HIS 55 HA HIS 55 14.792 3.048 12.370 398 HB2 HIS 55 1HB HIS 55 15.633 5.417 14.001 399 HB3 HIS 55 2HB HIS 55 13.972 5.303 13.424 400 HD2 HIS 55 2HD HIS 55 15.442 4.712 16.609 401 HE1 HIS 55 1HE HIS 55 13.075 1.228 16.101 402 HE2 HIS 55 2HE HIS 55 14.271 2.708 17.751 403 H TYR 56 H TYR 56 14.428 3.180 10.219 404 HA TYR 56 HA TYR 56 14.593 5.853 8.986 405 HB2 TYR 56 1HB TYR 56 15.275 3.143 7.963 406 HB3 TYR 56 2HB TYR 56 14.563 4.282 6.825 407 HD1 TYR 56 1HD TYR 56 15.681 6.758 7.077 408 HD2 TYR 56 2HD TYR 56 17.571 3.051 7.963 409 HE1 TYR 56 1HE TYR 56 17.880 7.807 6.744 410 HE2 TYR 56 2HE TYR 56 19.776 4.090 7.634 411 HH TYR 56 HH TYR 56 20.414 6.586 6.049 412 H GLU 57 H GLU 57 13.015 6.215 7.212 413 HA GLU 57 HA GLU 57 10.610 4.620 7.221 414 HB2 GLU 57 1HB GLU 57 9.178 6.628 7.816 415 HB3 GLU 57 2HB GLU 57 10.056 5.883 9.143 416 HG2 GLU 57 1HG GLU 57 10.949 8.344 7.661 417 HG3 GLU 57 2HG GLU 57 10.096 8.344 9.204 418 H ILE 58 H ILE 58 9.621 4.726 5.296 419 HA ILE 58 HA ILE 58 10.466 6.863 3.451 420 HB ILE 58 HB ILE 58 9.563 4.058 2.788 421 HG12 ILE 58 1HG1 ILE 58 12.261 5.145 2.115 422 HG13 ILE 58 2HG1 ILE 58 11.956 4.644 3.775 423 HG21 ILE 58 1HG2 ILE 58 9.733 4.559 0.540 424 HG22 ILE 58 2HG2 ILE 58 9.028 6.037 1.192 425 HG23 ILE 58 3HG2 ILE 58 10.752 5.970 0.824 426 HD11 ILE 58 3HD1 ILE 58 12.977 2.957 2.132 427 HD12 ILE 58 1HD1 ILE 58 11.663 2.426 3.182 428 HD13 ILE 58 2HD1 ILE 58 11.339 2.818 1.492 429 H GLU 59 H GLU 59 8.871 8.354 3.625 430 HA GLU 59 HA GLU 59 6.110 7.672 3.882 431 HB2 GLU 59 1HB GLU 59 5.794 10.155 3.392 432 HB3 GLU 59 2HB GLU 59 6.727 9.741 4.824 433 HG2 GLU 59 1HG GLU 59 8.193 10.190 2.283 434 HG3 GLU 59 2HG GLU 59 7.525 11.589 3.123 435 H ILE 60 H ILE 60 4.675 7.217 2.348 436 HA ILE 60 HA ILE 60 5.371 6.801 -0.321 437 HB ILE 60 HB ILE 60 2.615 7.265 0.827 438 HG12 ILE 60 1HG1 ILE 60 4.077 4.677 0.261 439 HG13 ILE 60 2HG1 ILE 60 3.901 5.397 1.858 440 HG21 ILE 60 1HG2 ILE 60 3.477 6.038 -1.789 441 HG22 ILE 60 2HG2 ILE 60 1.833 6.015 -1.153 442 HG23 ILE 60 3HG2 ILE 60 2.595 7.550 -1.572 443 HD11 ILE 60 3HD1 ILE 60 2.186 3.596 0.605 444 HD12 ILE 60 1HD1 ILE 60 1.911 4.469 2.113 445 HD13 ILE 60 2HD1 ILE 60 1.341 5.143 0.586 446 H VAL 61 H VAL 61 4.485 9.686 1.315 447 HA VAL 61 HA VAL 61 3.366 11.196 -0.753 448 HB VAL 61 HB VAL 61 4.085 13.181 0.489 449 HG11 VAL 61 1HG1 VAL 61 3.239 12.208 2.845 450 HG12 VAL 61 2HG1 VAL 61 2.162 12.529 1.484 451 HG13 VAL 61 3HG1 VAL 61 2.745 10.891 1.782 452 HG21 VAL 61 3HG2 VAL 61 5.251 12.115 2.802 453 HG22 VAL 61 1HG2 VAL 61 6.112 11.384 1.447 454 HG23 VAL 61 2HG2 VAL 61 6.017 13.139 1.588 455 H HIS 62 H HIS 62 6.684 10.357 -0.057 456 HA HIS 62 HA HIS 62 7.716 12.207 -2.050 457 HB2 HIS 62 1HB HIS 62 8.898 10.446 0.037 458 HB3 HIS 62 2HB HIS 62 9.891 10.808 -1.372 459 HD2 HIS 62 2HD HIS 62 8.236 12.719 1.634 460 HE1 HIS 62 1HE HIS 62 11.177 15.207 -0.142 461 HE2 HIS 62 2HE HIS 62 9.616 14.899 1.810 462 H ILE 63 H ILE 63 7.707 8.686 -1.507 463 HA ILE 63 HA ILE 63 8.960 7.654 -3.614 464 HB ILE 63 HB ILE 63 6.162 6.779 -2.893 465 HG12 ILE 63 1HG1 ILE 63 8.832 6.137 -1.631 466 HG13 ILE 63 2HG1 ILE 63 7.445 6.904 -0.864 467 HG21 ILE 63 1HG2 ILE 63 8.020 5.828 -4.804 468 HG22 ILE 63 2HG2 ILE 63 7.932 4.640 -3.506 469 HG23 ILE 63 3HG2 ILE 63 6.464 5.133 -4.349 470 HD11 ILE 63 3HD1 ILE 63 7.349 4.747 -0.063 471 HD12 ILE 63 1HD1 ILE 63 6.226 4.696 -1.421 472 HD13 ILE 63 2HD1 ILE 63 7.855 4.042 -1.598 473 H SER 64 H SER 64 8.750 7.415 -5.795 474 HA SER 64 HA SER 64 6.536 8.886 -7.070 475 HB2 SER 64 1HB SER 64 8.977 9.787 -7.244 476 HB3 SER 64 2HB SER 64 9.196 8.480 -8.407 477 HG SER 64 HG SER 64 8.046 10.858 -8.776 478 H THR 65 H THR 65 8.989 6.424 -7.885 479 HA THR 65 HA THR 65 6.965 5.053 -9.516 480 HB THR 65 HB THR 65 9.970 4.711 -9.533 481 HG1 THR 65 1HG THR 65 9.763 5.801 -11.572 482 HG21 THR 65 3HG2 THR 65 8.722 2.682 -10.186 483 HG22 THR 65 1HG2 THR 65 9.624 3.377 -11.532 484 HG23 THR 65 2HG2 THR 65 7.881 3.619 -11.421 485 H VAL 66 H VAL 66 6.315 3.016 -9.071 486 HA VAL 66 HA VAL 66 7.751 1.470 -7.041 487 HB VAL 66 HB VAL 66 4.789 2.055 -6.918 488 HG11 VAL 66 1HG1 VAL 66 6.000 -0.288 -6.207 489 HG12 VAL 66 2HG1 VAL 66 6.031 0.618 -4.693 490 HG13 VAL 66 3HG1 VAL 66 4.499 0.330 -5.519 491 HG21 VAL 66 3HG2 VAL 66 6.864 3.568 -5.953 492 HG22 VAL 66 1HG2 VAL 66 5.212 3.581 -5.336 493 HG23 VAL 66 2HG2 VAL 66 6.435 2.573 -4.562 494 H GLN 67 H GLN 67 8.304 -0.267 -8.207 495 HA GLN 67 HA GLN 67 6.151 -1.756 -9.536 496 HB2 GLN 67 1HB GLN 67 7.468 -2.200 -11.462 497 HB3 GLN 67 2HB GLN 67 7.557 -0.465 -11.190 498 HG2 GLN 67 1HG GLN 67 9.742 -0.976 -11.655 499 HG3 GLN 67 2HG GLN 67 9.729 -1.044 -9.893 500 HE21 GLN 67 1HE2 GLN 67 10.175 -2.926 -8.883 501 HE22 GLN 67 2HE2 GLN 67 10.583 -4.394 -9.698 502 H ILE 68 H ILE 68 6.600 -4.043 -9.803 503 HA ILE 68 HA ILE 68 8.186 -5.060 -7.572 504 HB ILE 68 HB ILE 68 6.151 -6.411 -9.344 505 HG12 ILE 68 1HG1 ILE 68 6.012 -5.884 -6.377 506 HG13 ILE 68 2HG1 ILE 68 5.413 -4.733 -7.566 507 HG21 ILE 68 1HG2 ILE 68 6.893 -8.393 -8.678 508 HG22 ILE 68 2HG2 ILE 68 8.259 -7.593 -7.902 509 HG23 ILE 68 3HG2 ILE 68 6.782 -7.902 -6.988 510 HD11 ILE 68 3HD1 ILE 68 4.133 -7.034 -6.485 511 HD12 ILE 68 1HD1 ILE 68 3.487 -5.810 -7.578 512 HD13 ILE 68 2HD1 ILE 68 4.306 -7.231 -8.228 513 H LEU 69 H LEU 69 9.964 -6.306 -7.791 514 HA LEU 69 HA LEU 69 11.231 -6.412 -10.371 515 HB2 LEU 69 1HB LEU 69 12.095 -7.556 -7.719 516 HB3 LEU 69 2HB LEU 69 13.097 -7.446 -9.165 517 HG LEU 69 HG LEU 69 11.966 -5.051 -7.724 518 HD11 LEU 69 1HD1 LEU 69 13.978 -4.800 -6.567 519 HD12 LEU 69 2HD1 LEU 69 14.809 -5.993 -7.564 520 HD13 LEU 69 3HD1 LEU 69 13.593 -6.513 -6.397 521 HD21 LEU 69 3HD2 LEU 69 13.869 -5.459 -10.001 522 HD22 LEU 69 1HD2 LEU 69 13.956 -4.012 -8.997 523 HD23 LEU 69 2HD2 LEU 69 12.479 -4.379 -9.887 524 H THR 70 H THR 70 10.345 -7.840 -11.757 525 HA THR 70 HA THR 70 10.272 -10.657 -10.904 526 HB THR 70 HB THR 70 8.312 -11.023 -12.361 527 HG1 THR 70 1HG THR 70 8.721 -8.300 -12.862 528 HG21 THR 70 3HG2 THR 70 6.919 -10.608 -10.650 529 HG22 THR 70 1HG2 THR 70 7.252 -8.877 -10.680 530 HG23 THR 70 2HG2 THR 70 8.342 -9.971 -9.827 531 H GLU 71 H GLU 71 11.699 -11.791 -12.031 532 HA GLU 71 HA GLU 71 13.217 -10.967 -14.145 533 HB2 GLU 71 1HB GLU 71 13.589 -13.039 -12.823 534 HB3 GLU 71 2HB GLU 71 12.272 -13.804 -13.703 535 HG2 GLU 71 1HG GLU 71 14.350 -14.510 -14.648 536 HG3 GLU 71 2HG GLU 71 13.528 -13.462 -15.802 537 H GLY 72 H GLY 72 10.388 -13.125 -14.481 538 HA2 GLY 72 1HA GLY 72 8.855 -12.022 -16.316 539 HA3 GLY 72 2HA GLY 72 10.242 -12.422 -17.317 540 H PHE 73 H PHE 73 7.945 -13.889 -15.036 541 HA PHE 73 HA PHE 73 7.251 -16.074 -14.831 542 HB2 PHE 73 1HB PHE 73 5.910 -14.970 -16.714 543 HB3 PHE 73 2HB PHE 73 6.919 -15.894 -17.821 544 HD1 PHE 73 2HD PHE 73 4.900 -16.469 -14.733 545 HD2 PHE 73 1HD PHE 73 6.075 -17.883 -18.572 546 HE1 PHE 73 2HE PHE 73 3.401 -18.403 -14.476 547 HE2 PHE 73 1HE PHE 73 4.577 -19.819 -18.321 548 HZ PHE 73 HZ PHE 73 3.239 -20.082 -16.270 549 HA PRO 74 HA PRO 74 11.255 -17.804 -16.655 550 HB2 PRO 74 1HB PRO 74 12.538 -18.206 -14.297 551 HB3 PRO 74 2HB PRO 74 12.658 -16.698 -15.211 552 HG2 PRO 74 1HG PRO 74 10.945 -17.346 -12.843 553 HG3 PRO 74 2HG PRO 74 11.883 -15.878 -13.177 554 HD2 PRO 74 1HD PRO 74 9.209 -16.023 -13.582 555 HD3 PRO 74 2HD PRO 74 10.275 -15.021 -14.589 556 HA PRO 75 HA PRO 75 9.973 -21.939 -15.866 557 HB2 PRO 75 1HB PRO 75 12.302 -23.282 -16.243 558 HB3 PRO 75 2HB PRO 75 11.378 -22.570 -17.571 559 HG2 PRO 75 1HG PRO 75 13.789 -21.501 -16.154 560 HG3 PRO 75 2HG PRO 75 13.426 -21.514 -17.890 561 HD2 PRO 75 1HD PRO 75 13.084 -19.315 -16.347 562 HD3 PRO 75 2HD PRO 75 12.048 -19.672 -17.744 563 H GLY 76 H GLY 76 9.803 -23.386 -14.208 564 HA2 GLY 76 1HA GLY 76 11.682 -24.139 -12.350 565 HA3 GLY 76 2HA GLY 76 10.968 -22.673 -11.694 566 H GLY 77 H GLY 77 10.768 -25.021 -10.303 567 HA2 GLY 77 1HA GLY 77 8.437 -26.525 -10.856 568 HA3 GLY 77 2HA GLY 77 9.258 -26.434 -9.304 569 H GLY 78 H GLY 78 8.877 -24.293 -8.111 570 HA2 GLY 78 1HA GLY 78 6.076 -24.037 -7.691 571 HA3 GLY 78 2HA GLY 78 7.329 -23.061 -6.938 572 H ASN 79 H ASN 79 5.524 -21.443 -7.260 573 HA ASN 79 HA ASN 79 5.840 -20.174 -9.901 574 HB2 ASN 79 1HB ASN 79 3.547 -21.190 -9.422 575 HB3 ASN 79 2HB ASN 79 3.358 -19.933 -8.203 576 HD21 ASN 79 1HD2 ASN 79 3.700 -17.685 -8.988 577 HD22 ASN 79 2HD2 ASN 79 3.096 -17.290 -10.557 578 H ALA 80 H ALA 80 7.588 -18.956 -9.012 579 HA ALA 80 HA ALA 80 7.274 -17.287 -6.731 580 HB1 ALA 80 1HB ALA 80 9.321 -16.115 -7.928 581 HB2 ALA 80 2HB ALA 80 9.488 -17.672 -7.115 582 HB3 ALA 80 3HB ALA 80 9.310 -17.607 -8.869 583 H ARG 81 H ARG 81 5.299 -16.181 -7.117 584 HA ARG 81 HA ARG 81 4.690 -14.640 -9.355 585 HB2 ARG 81 1HB ARG 81 3.002 -15.140 -7.709 586 HB3 ARG 81 2HB ARG 81 3.895 -14.276 -6.465 587 HG2 ARG 81 1HG ARG 81 2.349 -12.696 -6.983 588 HG3 ARG 81 2HG ARG 81 3.598 -12.265 -8.152 589 HD2 ARG 81 1HD ARG 81 1.364 -14.168 -8.802 590 HD3 ARG 81 2HD ARG 81 1.212 -12.425 -9.018 591 HE ARG 81 HE ARG 81 3.550 -13.296 -10.298 592 HH11 ARG 81 1HH1 ARG 81 0.090 -13.544 -10.593 593 HH12 ARG 81 2HH1 ARG 81 0.120 -13.734 -12.315 594 HH21 ARG 81 1HH2 ARG 81 3.602 -13.545 -12.565 595 HH22 ARG 81 2HH2 ARG 81 2.118 -13.736 -13.435 596 H ALA 82 H ALA 82 6.074 -13.531 -6.259 597 HA ALA 82 HA ALA 82 7.405 -11.362 -7.735 598 HB1 ALA 82 1HB ALA 82 6.243 -9.808 -6.664 599 HB2 ALA 82 2HB ALA 82 5.327 -11.060 -5.824 600 HB3 ALA 82 3HB ALA 82 6.818 -10.436 -5.119 601 H THR 83 H THR 83 9.511 -11.759 -7.583 602 HA THR 83 HA THR 83 10.574 -12.892 -5.088 603 HB THR 83 HB THR 83 11.081 -14.161 -7.140 604 HG1 THR 83 1HG THR 83 13.523 -13.889 -6.837 605 HG21 THR 83 3HG2 THR 83 11.122 -12.323 -8.740 606 HG22 THR 83 1HG2 THR 83 12.640 -13.217 -8.795 607 HG23 THR 83 2HG2 THR 83 12.562 -11.661 -7.968 608 H GLY 84 H GLY 84 9.888 -10.020 -5.640 609 HA2 GLY 84 1HA GLY 84 11.831 -8.746 -4.188 610 HA3 GLY 84 2HA GLY 84 12.378 -8.614 -5.853 611 H MET 85 H MET 85 11.905 -6.326 -4.520 612 HA MET 85 HA MET 85 9.596 -5.269 -5.956 613 HB2 MET 85 1HB MET 85 8.641 -5.706 -3.801 614 HB3 MET 85 2HB MET 85 10.019 -4.986 -2.981 615 HG2 MET 85 1HG MET 85 8.187 -3.463 -2.881 616 HG3 MET 85 2HG MET 85 9.409 -2.803 -3.965 617 HE1 MET 85 3HE MET 85 6.185 -1.986 -3.729 618 HE2 MET 85 1HE MET 85 5.144 -2.876 -4.841 619 HE3 MET 85 2HE MET 85 5.810 -3.682 -3.421 620 H PHE 86 H PHE 86 9.653 -2.958 -6.227 621 HA PHE 86 HA PHE 86 12.258 -1.724 -5.656 622 HB2 PHE 86 1HB PHE 86 11.964 -2.612 -8.068 623 HB3 PHE 86 2HB PHE 86 10.855 -1.261 -8.275 624 HD1 PHE 86 2HD PHE 86 14.205 -1.721 -6.688 625 HD2 PHE 86 1HD PHE 86 11.791 0.487 -9.411 626 HE1 PHE 86 2HE PHE 86 16.109 -0.239 -7.169 627 HE2 PHE 86 1HE PHE 86 13.691 1.972 -9.897 628 HZ PHE 86 HZ PHE 86 15.853 1.611 -8.775 629 H LEU 87 H LEU 87 12.159 0.318 -4.923 630 HA LEU 87 HA LEU 87 9.707 1.866 -5.320 631 HB2 LEU 87 1HB LEU 87 10.994 1.691 -2.615 632 HB3 LEU 87 2HB LEU 87 9.422 2.366 -3.039 633 HG LEU 87 HG LEU 87 9.920 -0.556 -3.419 634 HD11 LEU 87 1HD1 LEU 87 9.252 -1.021 -1.153 635 HD12 LEU 87 2HD1 LEU 87 9.115 0.701 -0.801 636 HD13 LEU 87 3HD1 LEU 87 10.695 -0.006 -1.138 637 HD21 LEU 87 3HD2 LEU 87 7.713 -0.638 -3.733 638 HD22 LEU 87 1HD2 LEU 87 7.779 1.120 -3.863 639 HD23 LEU 87 2HD2 LEU 87 7.390 0.364 -2.317 640 H GLN 88 H GLN 88 10.235 3.793 -6.086 641 HA GLN 88 HA GLN 88 12.906 4.866 -5.495 642 HB2 GLN 88 1HB GLN 88 10.993 5.333 -7.774 643 HB3 GLN 88 2HB GLN 88 12.369 6.387 -7.480 644 HG2 GLN 88 1HG GLN 88 13.691 4.115 -7.496 645 HG3 GLN 88 2HG GLN 88 12.299 3.574 -8.433 646 HE21 GLN 88 1HE2 GLN 88 11.649 5.380 -10.114 647 HE22 GLN 88 2HE2 GLN 88 12.959 5.918 -11.103 648 H TYR 89 H TYR 89 13.181 6.888 -4.644 649 HA TYR 89 HA TYR 89 10.903 8.635 -4.244 650 HB2 TYR 89 1HB TYR 89 11.291 8.774 -1.781 651 HB3 TYR 89 2HB TYR 89 10.664 7.216 -2.310 652 HD1 TYR 89 1HD TYR 89 13.850 8.951 -1.459 653 HD2 TYR 89 2HD TYR 89 11.756 5.254 -1.689 654 HE1 TYR 89 1HE TYR 89 15.729 7.824 -0.341 655 HE2 TYR 89 2HE TYR 89 13.628 4.117 -0.571 656 HH TYR 89 HH TYR 89 15.853 5.509 1.166 657 H THR 90 H THR 90 11.471 10.758 -3.966 658 HA THR 90 HA THR 90 14.295 11.371 -4.390 659 HB THR 90 HB THR 90 13.499 13.674 -4.877 660 HG1 THR 90 1HG THR 90 11.507 14.209 -4.410 661 HG21 THR 90 3HG2 THR 90 12.453 11.306 -6.374 662 HG22 THR 90 1HG2 THR 90 13.721 12.446 -6.825 663 HG23 THR 90 2HG2 THR 90 12.027 12.933 -6.905 664 H VAL 91 H VAL 91 15.554 12.450 -2.968 665 HA VAL 91 HA VAL 91 14.359 13.084 -0.354 666 HB VAL 91 HB VAL 91 17.210 12.416 -1.091 667 HG11 VAL 91 1HG1 VAL 91 16.986 14.202 0.666 668 HG12 VAL 91 2HG1 VAL 91 16.158 13.007 1.667 669 HG13 VAL 91 3HG1 VAL 91 17.832 12.742 1.177 670 HG21 VAL 91 3HG2 VAL 91 16.532 10.325 -0.736 671 HG22 VAL 91 1HG2 VAL 91 16.282 10.762 0.954 672 HG23 VAL 91 2HG2 VAL 91 14.945 10.870 -0.192 673 HA PRO 92 HA PRO 92 15.063 17.373 -1.157 674 HB2 PRO 92 1HB PRO 92 14.788 18.267 1.391 675 HB3 PRO 92 2HB PRO 92 13.416 17.766 0.396 676 HG2 PRO 92 1HG PRO 92 14.872 16.241 2.520 677 HG3 PRO 92 2HG PRO 92 13.128 16.356 2.222 678 HD2 PRO 92 1HD PRO 92 14.603 14.228 1.431 679 HD3 PRO 92 2HD PRO 92 13.187 14.799 0.525 680 H GLY 93 H GLY 93 16.671 15.973 1.707 681 HA2 GLY 93 1HA GLY 93 18.828 17.903 1.523 682 HA3 GLY 93 2HA GLY 93 18.663 16.629 2.723 683 H THR 94 H THR 94 18.576 16.228 -0.780 684 HA THR 94 HA THR 94 21.283 15.218 -0.872 685 HB THR 94 HB THR 94 18.950 13.350 -1.335 686 HG1 THR 94 1HG THR 94 21.080 13.362 0.561 687 HG21 THR 94 3HG2 THR 94 21.899 13.020 -1.870 688 HG22 THR 94 1HG2 THR 94 20.574 12.897 -3.026 689 HG23 THR 94 2HG2 THR 94 20.769 11.669 -1.775 690 H GLU 95 H GLU 95 21.987 14.717 -3.044 691 HA GLU 95 HA GLU 95 20.436 16.202 -5.044 692 HB2 GLU 95 1HB GLU 95 22.537 16.360 -6.300 693 HB3 GLU 95 2HB GLU 95 22.714 16.999 -4.672 694 HG2 GLU 95 1HG GLU 95 23.531 14.541 -4.173 695 HG3 GLU 95 2HG GLU 95 23.895 14.571 -5.898 696 H GLY 96 H GLY 96 19.160 14.953 -6.245 697 HA2 GLY 96 1HA GLY 96 19.095 13.435 -8.138 698 HA3 GLY 96 2HA GLY 96 20.304 12.456 -7.321 699 H VAL 97 H VAL 97 18.451 10.915 -8.072 700 HA VAL 97 HA VAL 97 16.393 10.746 -5.980 701 HB VAL 97 HB VAL 97 16.522 9.339 -8.650 702 HG11 VAL 97 1HG1 VAL 97 14.181 9.456 -6.768 703 HG12 VAL 97 2HG1 VAL 97 14.396 8.431 -8.188 704 HG13 VAL 97 3HG1 VAL 97 15.358 8.143 -6.738 705 HG21 VAL 97 3HG2 VAL 97 15.516 11.108 -9.545 706 HG22 VAL 97 1HG2 VAL 97 14.276 11.089 -8.291 707 HG23 VAL 97 2HG2 VAL 97 15.780 11.974 -8.032 708 H THR 98 H THR 98 16.132 8.913 -4.748 709 HA THR 98 HA THR 98 18.382 7.017 -4.823 710 HB THR 98 HB THR 98 16.522 7.639 -2.520 711 HG1 THR 98 1HG THR 98 19.184 8.462 -3.110 712 HG21 THR 98 3HG2 THR 98 17.406 5.901 -1.434 713 HG22 THR 98 1HG2 THR 98 19.045 6.389 -1.862 714 HG23 THR 98 2HG2 THR 98 18.107 5.388 -2.969 715 H GLN 99 H GLN 99 18.034 4.827 -4.844 716 HA GLN 99 HA GLN 99 15.253 3.977 -5.308 717 HB2 GLN 99 1HB GLN 99 17.742 2.572 -6.277 718 HB3 GLN 99 2HB GLN 99 16.079 2.248 -6.748 719 HG2 GLN 99 1HG GLN 99 15.982 4.022 -8.168 720 HG3 GLN 99 2HG GLN 99 17.150 4.967 -7.245 721 HE21 GLN 99 1HE2 GLN 99 19.395 4.364 -7.406 722 HE22 GLN 99 2HE2 GLN 99 19.983 3.638 -8.859 723 H LEU 100 H LEU 100 14.663 1.832 -4.582 724 HA LEU 100 HA LEU 100 16.343 0.753 -2.434 725 HB2 LEU 100 1HB LEU 100 14.337 2.325 -1.752 726 HB3 LEU 100 2HB LEU 100 13.397 0.860 -2.025 727 HG LEU 100 HG LEU 100 15.246 -0.157 -0.401 728 HD11 LEU 100 1HD1 LEU 100 15.653 2.684 -0.236 729 HD12 LEU 100 2HD1 LEU 100 16.559 1.374 0.521 730 HD13 LEU 100 3HD1 LEU 100 15.136 2.039 1.322 731 HD21 LEU 100 3HD2 LEU 100 12.780 1.390 0.372 732 HD22 LEU 100 1HD2 LEU 100 13.667 0.339 1.477 733 HD23 LEU 100 2HD2 LEU 100 12.910 -0.337 0.034 734 H LYS 101 H LYS 101 16.729 -1.305 -2.868 735 HA LYS 101 HA LYS 101 14.784 -2.824 -4.454 736 HB2 LYS 101 1HB LYS 101 17.394 -2.575 -4.917 737 HB3 LYS 101 2HB LYS 101 17.472 -3.924 -3.790 738 HG2 LYS 101 1HG LYS 101 17.303 -5.088 -5.725 739 HG3 LYS 101 2HG LYS 101 15.583 -4.878 -5.386 740 HD2 LYS 101 1HD LYS 101 15.612 -4.168 -7.552 741 HD3 LYS 101 2HD LYS 101 15.980 -2.636 -6.755 742 HE2 LYS 101 1HE LYS 101 18.440 -3.326 -7.020 743 HE3 LYS 101 2HE LYS 101 17.840 -4.518 -8.172 744 HZ1 LYS 101 3HZ LYS 101 16.623 -2.268 -8.998 745 HZ2 LYS 101 1HZ LYS 101 18.073 -2.863 -9.637 746 HZ3 LYS 101 2HZ LYS 101 18.103 -1.658 -8.451 747 H LEU 102 H LEU 102 13.927 -4.755 -3.758 748 HA LEU 102 HA LEU 102 14.578 -5.594 -1.015 749 HB2 LEU 102 1HB LEU 102 11.800 -5.469 -2.176 750 HB3 LEU 102 2HB LEU 102 12.239 -5.974 -0.545 751 HG LEU 102 HG LEU 102 12.572 -3.184 -1.648 752 HD11 LEU 102 1HD1 LEU 102 10.223 -3.764 -1.409 753 HD12 LEU 102 2HD1 LEU 102 10.709 -2.606 -0.171 754 HD13 LEU 102 3HD1 LEU 102 10.511 -4.309 0.244 755 HD21 LEU 102 3HD2 LEU 102 13.007 -4.363 1.091 756 HD22 LEU 102 1HD2 LEU 102 12.925 -2.633 0.760 757 HD23 LEU 102 2HD2 LEU 102 14.208 -3.608 0.043 758 H THR 103 H THR 103 14.644 -7.764 -0.655 759 HA THR 103 HA THR 103 13.711 -9.582 -2.746 760 HB THR 103 HB THR 103 16.518 -9.757 -1.639 761 HG1 THR 103 1HG THR 103 16.707 -8.136 -3.056 762 HG21 THR 103 3HG2 THR 103 15.426 -11.188 -4.041 763 HG22 THR 103 1HG2 THR 103 15.228 -11.851 -2.420 764 HG23 THR 103 2HG2 THR 103 16.845 -11.576 -3.068 765 H VAL 104 H VAL 104 13.056 -11.558 -2.007 766 HA VAL 104 HA VAL 104 12.488 -11.810 0.765 767 HB VAL 104 HB VAL 104 12.265 -13.839 -1.461 768 HG11 VAL 104 1HG1 VAL 104 11.274 -13.921 1.383 769 HG12 VAL 104 2HG1 VAL 104 10.704 -15.001 0.109 770 HG13 VAL 104 3HG1 VAL 104 12.397 -15.034 0.603 771 HG21 VAL 104 3HG2 VAL 104 10.181 -12.093 -0.152 772 HG22 VAL 104 1HG2 VAL 104 10.860 -11.861 -1.763 773 HG23 VAL 104 2HG2 VAL 104 9.886 -13.289 -1.413 774 H VAL 105 H VAL 105 13.543 -12.845 2.353 775 HA VAL 105 HA VAL 105 16.058 -14.199 1.647 776 HB VAL 105 HB VAL 105 16.747 -13.786 3.981 777 HG11 VAL 105 1HG1 VAL 105 17.090 -11.375 3.767 778 HG12 VAL 105 2HG1 VAL 105 17.357 -12.199 2.229 779 HG13 VAL 105 3HG1 VAL 105 15.859 -11.309 2.506 780 HG21 VAL 105 3HG2 VAL 105 15.465 -12.514 5.497 781 HG22 VAL 105 1HG2 VAL 105 14.315 -12.039 4.248 782 HG23 VAL 105 2HG2 VAL 105 14.352 -13.705 4.826 783 H GLU 106 H GLU 106 16.707 -15.861 3.418 784 HA GLU 106 HA GLU 106 14.367 -17.477 4.168 785 HB2 GLU 106 1HB GLU 106 15.959 -19.478 3.640 786 HB3 GLU 106 2HB GLU 106 15.073 -18.700 2.337 787 HG2 GLU 106 1HG GLU 106 17.115 -18.764 1.374 788 HG3 GLU 106 2HG GLU 106 17.272 -17.228 2.225 789 H ASP 107 H ASP 107 17.723 -16.624 4.742 790 HA ASP 107 HA ASP 107 18.478 -18.213 6.808 791 HB2 ASP 107 1HB ASP 107 19.844 -16.365 7.636 792 HB3 ASP 107 2HB ASP 107 19.875 -16.409 5.875 793 H VAL 108 H VAL 108 16.328 -15.408 7.021 794 HA VAL 108 HA VAL 108 15.755 -16.108 9.820 795 HB VAL 108 HB VAL 108 16.489 -13.781 9.401 796 HG11 VAL 108 1HG1 VAL 108 15.321 -13.730 7.117 797 HG12 VAL 108 2HG1 VAL 108 13.868 -13.306 8.024 798 HG13 VAL 108 3HG1 VAL 108 15.289 -12.264 8.095 799 HG21 VAL 108 3HG2 VAL 108 13.691 -13.361 10.185 800 HG22 VAL 108 1HG2 VAL 108 14.519 -14.655 11.051 801 HG23 VAL 108 2HG2 VAL 108 15.180 -13.020 11.065 802 H THR 109 H THR 109 14.166 -15.214 6.772 803 HA THR 109 HA THR 109 11.539 -15.806 7.761 804 HB THR 109 HB THR 109 12.434 -15.441 4.896 805 HG1 THR 109 1HG THR 109 11.478 -13.271 5.360 806 HG21 THR 109 3HG2 THR 109 9.813 -15.817 6.214 807 HG22 THR 109 1HG2 THR 109 10.330 -16.234 4.581 808 HG23 THR 109 2HG2 THR 109 9.893 -14.570 4.970 809 H VAL 110 H VAL 110 10.234 -17.562 7.286 810 HA VAL 110 HA VAL 110 11.565 -19.868 6.024 811 HB VAL 110 HB VAL 110 10.264 -21.320 7.615 812 HG11 VAL 110 1HG1 VAL 110 12.512 -19.537 8.404 813 HG12 VAL 110 2HG1 VAL 110 11.798 -20.590 9.627 814 HG13 VAL 110 3HG1 VAL 110 12.488 -21.283 8.159 815 HG21 VAL 110 3HG2 VAL 110 10.060 -19.292 9.672 816 HG22 VAL 110 1HG2 VAL 110 9.031 -18.927 8.287 817 HG23 VAL 110 2HG2 VAL 110 8.865 -20.468 9.127 818 H GLY 111 H GLY 111 9.420 -17.736 5.305 819 HA2 GLY 111 1HA GLY 111 7.747 -19.607 3.842 820 HA3 GLY 111 2HA GLY 111 6.901 -18.597 5.005 821 H ARG 112 H ARG 112 8.441 -18.739 1.922 822 HA ARG 112 HA ARG 112 8.797 -16.063 1.305 823 HB2 ARG 112 1HB ARG 112 9.186 -18.320 -0.061 824 HB3 ARG 112 2HB ARG 112 7.665 -17.836 -0.800 825 HG2 ARG 112 1HG ARG 112 8.972 -15.517 -0.983 826 HG3 ARG 112 2HG ARG 112 10.349 -16.620 -1.003 827 HD2 ARG 112 1HD ARG 112 8.027 -17.248 -2.747 828 HD3 ARG 112 2HD ARG 112 9.079 -15.915 -3.220 829 HE ARG 112 HE ARG 112 9.673 -18.704 -3.361 830 HH11 ARG 112 1HH1 ARG 112 11.076 -15.549 -2.916 831 HH12 ARG 112 2HH1 ARG 112 12.636 -16.016 -3.507 832 HH21 ARG 112 1HH2 ARG 112 11.723 -19.331 -4.141 833 HH22 ARG 112 2HH2 ARG 112 13.003 -18.167 -4.204 834 H ARG 113 H ARG 113 5.871 -18.045 0.966 835 HA ARG 113 HA ARG 113 4.126 -16.473 -0.321 836 HB2 ARG 113 1HB ARG 113 3.670 -18.001 2.240 837 HB3 ARG 113 2HB ARG 113 2.362 -17.254 1.334 838 HG2 ARG 113 1HG ARG 113 3.441 -18.636 -0.650 839 HG3 ARG 113 2HG ARG 113 3.998 -19.638 0.692 840 HD2 ARG 113 1HD ARG 113 1.946 -20.578 0.085 841 HD3 ARG 113 2HD ARG 113 1.569 -19.587 1.494 842 HE ARG 113 HE ARG 113 1.133 -17.956 -0.665 843 HH11 ARG 113 1HH1 ARG 113 -0.060 -21.045 0.410 844 HH12 ARG 113 2HH1 ARG 113 -1.614 -20.849 -0.331 845 HH21 ARG 113 1HH2 ARG 113 -0.909 -17.687 -1.645 846 HH22 ARG 113 2HH2 ARG 113 -2.095 -18.939 -1.500 847 H GLN 114 H GLN 114 4.730 -16.135 3.180 848 HA GLN 114 HA GLN 114 3.173 -13.980 3.762 849 HB2 GLN 114 1HB GLN 114 4.432 -15.074 5.490 850 HB3 GLN 114 2HB GLN 114 5.956 -14.601 4.752 851 HG2 GLN 114 1HG GLN 114 5.219 -13.305 6.794 852 HG3 GLN 114 2HG GLN 114 5.700 -12.364 5.383 853 HE21 GLN 114 1HE2 GLN 114 4.521 -10.585 6.128 854 HE22 GLN 114 2HE2 GLN 114 2.798 -10.528 6.022 855 H ALA 115 H ALA 115 6.617 -13.666 2.875 856 HA ALA 115 HA ALA 115 6.608 -10.898 2.545 857 HB1 ALA 115 1HB ALA 115 8.675 -12.106 2.738 858 HB2 ALA 115 2HB ALA 115 8.351 -12.982 1.242 859 HB3 ALA 115 3HB ALA 115 8.662 -11.247 1.197 860 H VAL 116 H VAL 116 6.601 -13.338 -0.064 861 HA VAL 116 HA VAL 116 6.262 -11.815 -2.259 862 HB VAL 116 HB VAL 116 4.668 -14.321 -1.699 863 HG11 VAL 116 1HG1 VAL 116 4.116 -14.436 -3.898 864 HG12 VAL 116 2HG1 VAL 116 4.234 -12.681 -3.758 865 HG13 VAL 116 3HG1 VAL 116 5.580 -13.606 -4.424 866 HG21 VAL 116 3HG2 VAL 116 6.573 -15.459 -1.810 867 HG22 VAL 116 1HG2 VAL 116 6.943 -14.733 -3.373 868 HG23 VAL 116 2HG2 VAL 116 7.460 -13.937 -1.887 869 H ALA 117 H ALA 117 3.684 -12.696 0.007 870 HA ALA 117 HA ALA 117 1.555 -11.508 -1.393 871 HB1 ALA 117 1HB ALA 117 1.988 -12.673 1.226 872 HB2 ALA 117 2HB ALA 117 0.873 -11.307 1.280 873 HB3 ALA 117 3HB ALA 117 0.544 -12.672 0.213 874 H TRP 118 H TRP 118 3.810 -10.219 1.000 875 HA TRP 118 HA TRP 118 2.544 -7.734 1.387 876 HB2 TRP 118 1HB TRP 118 4.346 -8.715 2.838 877 HB3 TRP 118 2HB TRP 118 5.508 -8.293 1.583 878 HD1 TRP 118 HD TRP 118 3.664 -6.851 4.514 879 HE1 TRP 118 1HE TRP 118 4.299 -4.373 4.805 880 HE3 TRP 118 3HE TRP 118 6.150 -6.127 0.106 881 HZ2 TRP 118 2HZ TRP 118 5.672 -2.376 3.357 882 HZ3 TRP 118 3HZ TRP 118 7.094 -3.904 -0.365 883 HH2 TRP 118 HH TRP 118 6.858 -2.068 1.228 884 H LEU 119 H LEU 119 5.104 -8.749 -0.849 885 HA LEU 119 HA LEU 119 5.606 -6.240 -1.992 886 HB2 LEU 119 1HB LEU 119 5.794 -8.901 -3.387 887 HB3 LEU 119 2HB LEU 119 6.670 -7.424 -3.784 888 HG LEU 119 HG LEU 119 7.049 -8.810 -1.147 889 HD11 LEU 119 1HD1 LEU 119 8.711 -10.190 -1.995 890 HD12 LEU 119 2HD1 LEU 119 8.836 -9.283 -3.502 891 HD13 LEU 119 3HD1 LEU 119 7.435 -10.312 -3.206 892 HD21 LEU 119 3HD2 LEU 119 7.900 -6.392 -2.062 893 HD22 LEU 119 1HD2 LEU 119 9.256 -7.433 -2.496 894 HD23 LEU 119 2HD2 LEU 119 8.714 -7.344 -0.820 895 H VAL 120 H VAL 120 3.510 -8.881 -3.149 896 HA VAL 120 HA VAL 120 2.481 -7.512 -5.375 897 HB VAL 120 HB VAL 120 2.263 -9.933 -5.129 898 HG11 VAL 120 1HG1 VAL 120 1.884 -10.053 -2.733 899 HG12 VAL 120 2HG1 VAL 120 0.308 -9.283 -2.925 900 HG13 VAL 120 3HG1 VAL 120 0.595 -10.887 -3.600 901 HG21 VAL 120 3HG2 VAL 120 -0.251 -10.068 -5.637 902 HG22 VAL 120 1HG2 VAL 120 -0.245 -8.316 -5.436 903 HG23 VAL 120 2HG2 VAL 120 0.751 -9.063 -6.685 904 H ALA 121 H ALA 121 1.345 -7.740 -2.034 905 HA ALA 121 HA ALA 121 -1.097 -6.379 -2.406 906 HB1 ALA 121 1HB ALA 121 -0.840 -5.930 0.110 907 HB2 ALA 121 2HB ALA 121 -0.939 -7.607 -0.430 908 HB3 ALA 121 3HB ALA 121 0.624 -6.907 -0.009 909 H MET 122 H MET 122 2.153 -5.256 -1.584 910 HA MET 122 HA MET 122 1.548 -2.603 -0.973 911 HB2 MET 122 1HB MET 122 3.748 -3.645 -0.578 912 HB3 MET 122 2HB MET 122 4.038 -3.676 -2.312 913 HG2 MET 122 1HG MET 122 5.217 -1.820 -1.527 914 HG3 MET 122 2HG MET 122 3.757 -1.160 -2.260 915 HE1 MET 122 3HE MET 122 3.512 1.446 0.408 916 HE2 MET 122 1HE MET 122 4.673 1.065 -0.864 917 HE3 MET 122 2HE MET 122 2.943 0.929 -1.181 918 H HIS 123 H HIS 123 2.350 -4.091 -4.095 919 HA HIS 123 HA HIS 123 2.294 -1.739 -5.627 920 HB2 HIS 123 1HB HIS 123 3.280 -3.702 -6.571 921 HB3 HIS 123 2HB HIS 123 1.795 -4.625 -6.364 922 HD2 HIS 123 2HD HIS 123 2.292 -1.185 -8.274 923 HE1 HIS 123 1HE HIS 123 0.464 -4.015 -10.853 924 HE2 HIS 123 2HE HIS 123 1.344 -1.665 -10.632 925 H LYS 124 H LYS 124 -0.213 -4.276 -5.457 926 HA LYS 124 HA LYS 124 -2.208 -2.958 -6.826 927 HB2 LYS 124 1HB LYS 124 -2.197 -5.051 -4.699 928 HB3 LYS 124 2HB LYS 124 -3.734 -4.316 -5.133 929 HG2 LYS 124 1HG LYS 124 -3.444 -6.328 -6.398 930 HG3 LYS 124 2HG LYS 124 -3.322 -4.947 -7.490 931 HD2 LYS 124 1HD LYS 124 -0.828 -5.105 -7.257 932 HD3 LYS 124 2HD LYS 124 -1.071 -6.617 -6.379 933 HE2 LYS 124 1HE LYS 124 -2.149 -7.604 -8.304 934 HE3 LYS 124 2HE LYS 124 -2.057 -6.076 -9.178 935 HZ1 LYS 124 3HZ LYS 124 0.406 -6.253 -8.968 936 HZ2 LYS 124 1HZ LYS 124 -0.298 -7.447 -9.937 937 HZ3 LYS 124 2HZ LYS 124 0.199 -7.820 -8.365 938 H ALA 125 H ALA 125 -1.757 -2.999 -3.287 939 HA ALA 125 HA ALA 125 -3.798 -1.158 -2.705 940 HB1 ALA 125 1HB ALA 125 -1.341 -1.997 -1.191 941 HB2 ALA 125 2HB ALA 125 -2.508 -0.845 -0.542 942 HB3 ALA 125 3HB ALA 125 -3.014 -2.489 -0.929 943 H ALA 126 H ALA 126 -0.480 -0.728 -3.699 944 HA ALA 126 HA ALA 126 -0.272 2.023 -2.978 945 HB1 ALA 126 1HB ALA 126 1.780 0.952 -3.203 946 HB2 ALA 126 2HB ALA 126 1.330 0.198 -4.732 947 HB3 ALA 126 3HB ALA 126 1.669 1.927 -4.668 948 H LYS 127 H LYS 127 -1.316 0.291 -5.849 949 HA LYS 127 HA LYS 127 -1.317 2.374 -7.698 950 HB2 LYS 127 1HB LYS 127 -2.881 -0.154 -7.398 951 HB3 LYS 127 2HB LYS 127 -3.391 1.013 -8.611 952 HG2 LYS 127 1HG LYS 127 -0.909 0.941 -9.359 953 HG3 LYS 127 2HG LYS 127 -0.869 -0.578 -8.461 954 HD2 LYS 127 1HD LYS 127 -3.079 -0.112 -10.407 955 HD3 LYS 127 2HD LYS 127 -1.477 -0.530 -11.020 956 HE2 LYS 127 1HE LYS 127 -2.414 -2.615 -10.785 957 HE3 LYS 127 2HE LYS 127 -1.617 -2.428 -9.224 958 HZ1 LYS 127 3HZ LYS 127 -4.493 -1.955 -9.791 959 HZ2 LYS 127 1HZ LYS 127 -3.744 -1.684 -8.298 960 HZ3 LYS 127 2HZ LYS 127 -3.843 -3.253 -8.922 961 H LEU 128 H LEU 128 -4.110 1.207 -5.804 962 HA LEU 128 HA LEU 128 -6.001 3.025 -6.459 963 HB2 LEU 128 1HB LEU 128 -5.338 1.821 -3.793 964 HB3 LEU 128 2HB LEU 128 -6.729 2.883 -4.004 965 HG LEU 128 HG LEU 128 -6.414 0.459 -5.732 966 HD11 LEU 128 1HD1 LEU 128 -6.762 0.464 -2.862 967 HD12 LEU 128 2HD1 LEU 128 -6.520 -0.888 -3.967 968 HD13 LEU 128 3HD1 LEU 128 -8.143 -0.259 -3.686 969 HD21 LEU 128 3HD2 LEU 128 -8.923 0.589 -5.579 970 HD22 LEU 128 1HD2 LEU 128 -8.142 1.939 -6.403 971 HD23 LEU 128 2HD2 LEU 128 -8.716 2.131 -4.746 972 H LEU 129 H LEU 129 -3.475 3.523 -4.008 973 HA LEU 129 HA LEU 129 -4.186 6.032 -3.109 974 HB2 LEU 129 1HB LEU 129 -1.629 4.549 -3.347 975 HB3 LEU 129 2HB LEU 129 -1.535 6.277 -3.013 976 HG LEU 129 HG LEU 129 -3.024 4.268 -1.323 977 HD11 LEU 129 1HD1 LEU 129 -1.025 5.170 0.234 978 HD12 LEU 129 2HD1 LEU 129 -0.225 5.185 -1.337 979 HD13 LEU 129 3HD1 LEU 129 -0.932 3.691 -0.722 980 HD21 LEU 129 3HD2 LEU 129 -2.676 6.362 0.274 981 HD22 LEU 129 1HD2 LEU 129 -4.079 6.209 -0.784 982 HD23 LEU 129 2HD2 LEU 129 -2.716 7.218 -1.269 983 H TYR 130 H TYR 130 -1.743 5.398 -5.634 984 HA TYR 130 HA TYR 130 -1.733 8.124 -6.493 985 HB2 TYR 130 1HB TYR 130 -0.677 5.890 -8.186 986 HB3 TYR 130 2HB TYR 130 -0.034 7.512 -7.956 987 HD1 TYR 130 2HD TYR 130 -0.041 7.575 -4.945 988 HD2 TYR 130 1HD TYR 130 1.216 4.578 -7.691 989 HE1 TYR 130 2HE TYR 130 1.542 6.714 -3.271 990 HE2 TYR 130 1HE TYR 130 2.801 3.708 -6.024 991 HH TYR 130 HH TYR 130 3.771 4.074 -4.037 992 H GLU 131 H GLU 131 -2.615 5.144 -8.250 993 HA GLU 131 HA GLU 131 -3.725 6.138 -10.495 994 HB2 GLU 131 1HB GLU 131 -4.908 3.923 -8.810 995 HB3 GLU 131 2HB GLU 131 -5.275 4.214 -10.505 996 HG2 GLU 131 1HG GLU 131 -2.699 3.983 -10.813 997 HG3 GLU 131 2HG GLU 131 -2.786 3.148 -9.263 998 H SER 132 H SER 132 -5.700 6.949 -11.186 999 HA SER 132 HA SER 132 -7.905 7.373 -9.431 1000 HB2 SER 132 1HB SER 132 -6.026 9.661 -9.985 1001 HB3 SER 132 2HB SER 132 -7.732 9.941 -9.635 1002 HG SER 132 HG SER 132 -5.694 9.249 -7.953 1003 H ARG 133 H ARG 133 -9.524 8.945 -10.503 1004 HA ARG 133 HA ARG 133 -9.333 9.442 -13.285 1005 HB2 ARG 133 1HB ARG 133 -11.360 7.754 -13.688 1006 HB3 ARG 133 2HB ARG 133 -9.682 7.279 -13.912 1007 HG2 ARG 133 1HG ARG 133 -10.689 5.543 -12.690 1008 HG3 ARG 133 2HG ARG 133 -9.730 6.457 -11.524 1009 HD2 ARG 133 1HD ARG 133 -12.582 7.208 -11.917 1010 HD3 ARG 133 2HD ARG 133 -12.219 5.739 -11.011 1011 HE ARG 133 HE ARG 133 -10.620 7.623 -9.877 1012 HH11 ARG 133 1HH1 ARG 133 -14.034 7.391 -10.515 1013 HH12 ARG 133 2HH1 ARG 133 -14.487 8.360 -9.152 1014 HH21 ARG 133 1HH2 ARG 133 -11.203 8.900 -8.079 1015 HH22 ARG 133 2HH2 ARG 133 -12.876 9.219 -7.768 1016 H ASP 134 H ASP 134 -11.599 9.958 -14.202 1017 HA ASP 134 HA ASP 134 -13.368 10.990 -12.098 1018 HB2 ASP 134 1HB ASP 134 -12.210 12.954 -12.620 1019 HB3 ASP 134 2HB ASP 134 -12.086 12.541 -14.328 1020 H GLN 135 H GLN 135 -15.542 11.461 -12.833 1021 HA GLN 135 HA GLN 135 -16.709 9.446 -14.306 1022 HB2 GLN 135 1HB GLN 135 -17.748 11.290 -12.769 1023 HB3 GLN 135 2HB GLN 135 -17.947 12.174 -14.276 1024 HG2 GLN 135 1HG GLN 135 -19.481 10.673 -15.113 1025 HG3 GLN 135 2HG GLN 135 -18.929 9.366 -14.067 1026 HE21 GLN 135 1HE2 GLN 135 -21.353 9.264 -13.845 1027 HE22 GLN 135 2HE2 GLN 135 -22.054 10.174 -12.556 1028 H SER 136 H SER 136 -16.297 12.808 -15.434 1029 HA SER 136 HA SER 136 -16.688 11.946 -18.179 1030 HB2 SER 136 1HB SER 136 -16.313 14.661 -16.908 1031 HB3 SER 136 2HB SER 136 -16.426 14.428 -18.652 1032 HG SER 136 HG SER 136 -18.456 13.161 -17.861 1033 H GLY 137 H GLY 137 -15.170 12.952 -19.856 1034 HA2 GLY 137 1HA GLY 137 -12.601 13.757 -19.491 1035 HA3 GLY 137 2HA GLY 137 -12.509 12.017 -19.263 1036 HA PRO 138 HA PRO 138 -13.825 12.945 -23.858 1037 HB2 PRO 138 1HB PRO 138 -13.101 15.406 -24.746 1038 HB3 PRO 138 2HB PRO 138 -14.685 15.068 -24.038 1039 HG2 PRO 138 1HG PRO 138 -12.267 16.297 -22.771 1040 HG3 PRO 138 2HG PRO 138 -13.969 16.776 -22.632 1041 HD2 PRO 138 1HD PRO 138 -12.700 15.334 -20.723 1042 HD3 PRO 138 2HD PRO 138 -14.430 15.144 -21.071 1043 H SER 139 H SER 139 -12.482 12.240 -25.433 1044 HA SER 139 HA SER 139 -9.771 11.804 -24.924 1045 HB2 SER 139 1HB SER 139 -9.620 11.058 -27.251 1046 HB3 SER 139 2HB SER 139 -11.104 10.458 -26.509 1047 HG SER 139 HG SER 139 -12.215 12.171 -27.541 1048 H SER 140 H SER 140 -8.361 13.412 -24.627 1049 HA SER 140 HA SER 140 -7.335 15.460 -24.857 1050 HB2 SER 140 1HB SER 140 -6.476 13.787 -26.705 1051 HB3 SER 140 2HB SER 140 -7.260 14.922 -27.802 1052 HG SER 140 HG SER 140 -5.182 15.451 -25.949 1053 H GLY 141 H GLY 141 -10.085 15.834 -24.788 1054 HA2 GLY 141 1HA GLY 141 -10.940 17.465 -26.997 1055 HA3 GLY 141 2HA GLY 141 -11.796 17.229 -25.481 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -23.870 3.607 7.509 2 HA2 GLY 1 1HA GLY 1 -26.287 3.764 7.816 3 HA3 GLY 1 2HA GLY 1 -25.763 5.070 6.764 4 H SER 2 H SER 2 -25.819 4.610 4.404 5 HA SER 2 HA SER 2 -27.939 2.693 3.707 6 HB2 SER 2 1HB SER 2 -28.781 4.403 2.056 7 HB3 SER 2 2HB SER 2 -29.028 4.832 3.749 8 HG SER 2 HG SER 2 -27.831 6.522 3.442 9 H SER 3 H SER 3 -25.451 4.852 2.355 10 HA SER 3 HA SER 3 -24.997 2.877 0.222 11 HB2 SER 3 1HB SER 3 -25.556 5.082 -0.630 12 HB3 SER 3 2HB SER 3 -24.293 5.819 0.355 13 HG SER 3 HG SER 3 -23.688 3.809 -1.528 14 H GLY 4 H GLY 4 -23.481 1.478 0.895 15 HA2 GLY 4 1HA GLY 4 -20.792 2.174 1.047 16 HA3 GLY 4 2HA GLY 4 -21.390 2.117 2.698 17 H SER 5 H SER 5 -19.912 0.355 0.343 18 HA SER 5 HA SER 5 -21.132 -2.202 0.876 19 HB2 SER 5 1HB SER 5 -18.877 -1.221 -0.822 20 HB3 SER 5 2HB SER 5 -18.932 -2.935 -0.408 21 HG SER 5 HG SER 5 -20.360 -1.612 -2.240 22 H SER 6 H SER 6 -20.412 -3.799 2.198 23 HA SER 6 HA SER 6 -18.017 -3.223 3.817 24 HB2 SER 6 1HB SER 6 -20.427 -3.063 4.894 25 HB3 SER 6 2HB SER 6 -20.274 -4.818 4.962 26 HG SER 6 HG SER 6 -18.367 -4.548 6.160 27 H GLY 7 H GLY 7 -16.811 -4.526 2.331 28 HA2 GLY 7 1HA GLY 7 -16.581 -7.231 3.144 29 HA3 GLY 7 2HA GLY 7 -17.396 -7.143 1.589 30 H ALA 8 H ALA 8 -16.029 -7.593 0.005 31 HA ALA 8 HA ALA 8 -14.181 -7.602 -1.324 32 HB1 ALA 8 1HB ALA 8 -12.684 -5.597 -1.193 33 HB2 ALA 8 2HB ALA 8 -14.392 -5.234 -1.439 34 HB3 ALA 8 3HB ALA 8 -13.669 -5.031 0.156 35 H GLU 9 H GLU 9 -14.049 -9.271 0.849 36 HA GLU 9 HA GLU 9 -12.010 -9.126 2.641 37 HB2 GLU 9 1HB GLU 9 -13.225 -11.379 1.123 38 HB3 GLU 9 2HB GLU 9 -11.739 -11.703 2.005 39 HG2 GLU 9 1HG GLU 9 -13.524 -12.278 3.436 40 HG3 GLU 9 2HG GLU 9 -12.854 -10.764 4.042 41 H PHE 10 H PHE 10 -11.744 -9.870 -0.795 42 HA PHE 10 HA PHE 10 -9.189 -10.766 -1.047 43 HB2 PHE 10 1HB PHE 10 -10.851 -10.301 -2.902 44 HB3 PHE 10 2HB PHE 10 -10.326 -8.622 -2.844 45 HD1 PHE 10 2HD PHE 10 -9.082 -12.080 -3.362 46 HD2 PHE 10 1HD PHE 10 -8.462 -7.924 -4.045 47 HE1 PHE 10 2HE PHE 10 -7.231 -12.611 -4.892 48 HE2 PHE 10 1HE PHE 10 -6.610 -8.449 -5.577 49 HZ PHE 10 HZ PHE 10 -5.991 -10.795 -6.002 50 H TYR 11 H TYR 11 -10.073 -7.310 -1.124 51 HA TYR 11 HA TYR 11 -7.437 -6.346 -1.065 52 HB2 TYR 11 1HB TYR 11 -9.260 -4.919 -1.768 53 HB3 TYR 11 2HB TYR 11 -10.019 -5.042 -0.185 54 HD1 TYR 11 2HD TYR 11 -6.509 -4.315 -1.247 55 HD2 TYR 11 1HD TYR 11 -9.964 -2.976 0.844 56 HE1 TYR 11 2HE TYR 11 -5.280 -2.318 -0.508 57 HE2 TYR 11 1HE TYR 11 -8.745 -0.973 1.588 58 HH TYR 11 HH TYR 11 -5.310 -0.547 0.886 59 H ASP 12 H ASP 12 -9.724 -7.089 1.515 60 HA ASP 12 HA ASP 12 -8.391 -5.983 3.681 61 HB2 ASP 12 1HB ASP 12 -10.208 -8.353 3.384 62 HB3 ASP 12 2HB ASP 12 -9.463 -8.002 4.941 63 H LYS 13 H LYS 13 -7.870 -9.071 2.058 64 HA LYS 13 HA LYS 13 -6.118 -10.264 3.852 65 HB2 LYS 13 1HB LYS 13 -6.228 -10.411 0.838 66 HB3 LYS 13 2HB LYS 13 -5.191 -11.439 1.819 67 HG2 LYS 13 1HG LYS 13 -8.167 -11.312 2.201 68 HG3 LYS 13 2HG LYS 13 -7.391 -12.431 1.077 69 HD2 LYS 13 1HD LYS 13 -6.537 -12.283 3.948 70 HD3 LYS 13 2HD LYS 13 -7.932 -13.249 3.464 71 HE2 LYS 13 1HE LYS 13 -5.372 -13.572 1.975 72 HE3 LYS 13 2HE LYS 13 -5.518 -14.294 3.576 73 HZ1 LYS 13 3HZ LYS 13 -6.304 -15.987 2.305 74 HZ2 LYS 13 1HZ LYS 13 -6.914 -14.971 1.097 75 HZ3 LYS 13 2HZ LYS 13 -7.760 -15.161 2.549 76 H GLN 14 H GLN 14 -5.342 -8.163 1.083 77 HA GLN 14 HA GLN 14 -2.571 -8.133 1.424 78 HB2 GLN 14 1HB GLN 14 -4.517 -6.235 0.157 79 HB3 GLN 14 2HB GLN 14 -2.816 -5.805 0.278 80 HG2 GLN 14 1HG GLN 14 -3.565 -6.868 -1.884 81 HG3 GLN 14 2HG GLN 14 -2.154 -7.578 -1.103 82 HE21 GLN 14 1HE2 GLN 14 -2.161 -9.686 -1.353 83 HE22 GLN 14 2HE2 GLN 14 -3.536 -10.726 -1.231 84 H LEU 15 H LEU 15 -5.099 -6.269 2.980 85 HA LEU 15 HA LEU 15 -3.411 -4.336 4.185 86 HB2 LEU 15 1HB LEU 15 -6.104 -5.318 5.114 87 HB3 LEU 15 2HB LEU 15 -5.315 -3.818 5.597 88 HG LEU 15 HG LEU 15 -6.321 -4.471 2.827 89 HD11 LEU 15 1HD1 LEU 15 -8.272 -3.564 3.383 90 HD12 LEU 15 2HD1 LEU 15 -7.491 -2.194 4.173 91 HD13 LEU 15 3HD1 LEU 15 -7.758 -3.692 5.065 92 HD21 LEU 15 3HD2 LEU 15 -4.583 -2.361 3.898 93 HD22 LEU 15 1HD2 LEU 15 -5.927 -1.789 2.909 94 HD23 LEU 15 2HD2 LEU 15 -4.775 -2.948 2.246 95 H LYS 16 H LYS 16 -5.128 -7.079 5.691 96 HA LYS 16 HA LYS 16 -3.867 -7.000 8.153 97 HB2 LYS 16 1HB LYS 16 -4.482 -9.401 8.352 98 HB3 LYS 16 2HB LYS 16 -5.808 -8.388 7.795 99 HG2 LYS 16 1HG LYS 16 -5.583 -9.171 5.567 100 HG3 LYS 16 2HG LYS 16 -4.057 -9.975 5.937 101 HD2 LYS 16 1HD LYS 16 -6.547 -10.730 7.413 102 HD3 LYS 16 2HD LYS 16 -6.250 -11.370 5.795 103 HE2 LYS 16 1HE LYS 16 -4.010 -12.144 6.624 104 HE3 LYS 16 2HE LYS 16 -4.525 -11.687 8.246 105 HZ1 LYS 16 3HZ LYS 16 -4.980 -13.965 8.041 106 HZ2 LYS 16 1HZ LYS 16 -5.659 -13.791 6.500 107 HZ3 LYS 16 2HZ LYS 16 -6.481 -13.207 7.858 108 H VAL 17 H VAL 17 -2.767 -8.382 5.128 109 HA VAL 17 HA VAL 17 -0.546 -9.788 6.271 110 HB VAL 17 HB VAL 17 -1.188 -9.035 3.421 111 HG11 VAL 17 1HG1 VAL 17 0.683 -11.138 3.496 112 HG12 VAL 17 2HG1 VAL 17 0.909 -9.506 2.865 113 HG13 VAL 17 3HG1 VAL 17 1.306 -9.866 4.546 114 HG21 VAL 17 3HG2 VAL 17 -2.612 -10.734 4.643 115 HG22 VAL 17 1HG2 VAL 17 -1.865 -11.283 3.143 116 HG23 VAL 17 2HG2 VAL 17 -1.179 -11.761 4.696 117 H LEU 18 H LEU 18 -0.934 -6.743 4.487 118 HA LEU 18 HA LEU 18 1.779 -6.034 4.405 119 HB2 LEU 18 1HB LEU 18 -0.758 -4.434 4.310 120 HB3 LEU 18 2HB LEU 18 0.824 -3.662 4.232 121 HG LEU 18 HG LEU 18 0.156 -5.831 2.290 122 HD11 LEU 18 1HD1 LEU 18 -0.464 -3.047 1.509 123 HD12 LEU 18 2HD1 LEU 18 -1.637 -3.873 2.533 124 HD13 LEU 18 3HD1 LEU 18 -1.184 -4.566 0.975 125 HD21 LEU 18 3HD2 LEU 18 1.680 -4.603 0.876 126 HD22 LEU 18 1HD2 LEU 18 2.435 -4.892 2.443 127 HD23 LEU 18 2HD2 LEU 18 1.780 -3.300 2.061 128 H LEU 19 H LEU 19 -0.730 -4.644 6.531 129 HA LEU 19 HA LEU 19 0.777 -3.165 8.218 130 HB2 LEU 19 1HB LEU 19 -1.462 -4.995 9.070 131 HB3 LEU 19 2HB LEU 19 -0.868 -3.602 9.971 132 HG LEU 19 HG LEU 19 -2.007 -3.292 7.213 133 HD11 LEU 19 1HD1 LEU 19 -4.141 -3.420 7.898 134 HD12 LEU 19 2HD1 LEU 19 -3.785 -2.732 9.482 135 HD13 LEU 19 3HD1 LEU 19 -3.479 -4.441 9.174 136 HD21 LEU 19 3HD2 LEU 19 -0.680 -1.511 8.600 137 HD22 LEU 19 1HD2 LEU 19 -2.214 -1.334 9.453 138 HD23 LEU 19 2HD2 LEU 19 -2.136 -1.053 7.714 139 H SER 20 H SER 20 0.220 -6.661 8.534 140 HA SER 20 HA SER 20 1.485 -7.244 10.863 141 HB2 SER 20 1HB SER 20 1.229 -8.694 8.275 142 HB3 SER 20 2HB SER 20 2.371 -9.337 9.455 143 HG SER 20 HG SER 20 0.701 -9.527 10.929 144 H GLY 21 H GLY 21 3.099 -6.896 7.705 145 HA2 GLY 21 1HA GLY 21 5.194 -5.866 7.375 146 HA3 GLY 21 2HA GLY 21 5.515 -6.019 9.096 147 H ALA 22 H ALA 22 6.931 -6.847 6.494 148 HA ALA 22 HA ALA 22 7.546 -9.587 7.384 149 HB1 ALA 22 1HB ALA 22 6.213 -9.373 5.199 150 HB2 ALA 22 2HB ALA 22 7.721 -8.779 4.502 151 HB3 ALA 22 3HB ALA 22 7.650 -10.397 5.201 152 H THR 23 H THR 23 9.691 -10.233 6.004 153 HA THR 23 HA THR 23 11.641 -8.126 6.662 154 HB THR 23 HB THR 23 12.256 -11.069 6.415 155 HG1 THR 23 1HG THR 23 12.136 -11.046 8.742 156 HG21 THR 23 3HG2 THR 23 13.910 -8.875 6.554 157 HG22 THR 23 1HG2 THR 23 14.357 -10.527 6.980 158 HG23 THR 23 2HG2 THR 23 13.822 -9.406 8.233 159 H PHE 24 H PHE 24 13.239 -7.581 5.215 160 HA PHE 24 HA PHE 24 13.414 -8.991 2.675 161 HB2 PHE 24 1HB PHE 24 12.910 -6.015 2.700 162 HB3 PHE 24 2HB PHE 24 12.960 -7.089 1.305 163 HD1 PHE 24 1HD PHE 24 11.033 -6.298 4.368 164 HD2 PHE 24 2HD PHE 24 11.023 -8.139 0.531 165 HE1 PHE 24 1HE PHE 24 8.597 -6.606 4.527 166 HE2 PHE 24 2HE PHE 24 8.587 -8.449 0.683 167 HZ PHE 24 HZ PHE 24 7.371 -7.682 2.682 168 H LEU 25 H LEU 25 15.081 -7.660 1.234 169 HA LEU 25 HA LEU 25 17.362 -7.057 2.997 170 HB2 LEU 25 1HB LEU 25 17.216 -8.315 0.274 171 HB3 LEU 25 2HB LEU 25 18.718 -7.657 0.920 172 HG LEU 25 HG LEU 25 17.120 -9.884 2.182 173 HD11 LEU 25 1HD1 LEU 25 19.252 -11.168 1.471 174 HD12 LEU 25 2HD1 LEU 25 19.440 -9.867 0.296 175 HD13 LEU 25 3HD1 LEU 25 17.988 -10.868 0.277 176 HD21 LEU 25 3HD2 LEU 25 18.310 -9.366 3.992 177 HD22 LEU 25 1HD2 LEU 25 19.313 -8.223 3.098 178 HD23 LEU 25 2HD2 LEU 25 19.727 -9.937 3.109 179 H VAL 26 H VAL 26 17.632 -4.926 3.138 180 HA VAL 26 HA VAL 26 17.084 -3.238 0.810 181 HB VAL 26 HB VAL 26 17.674 -2.468 3.672 182 HG11 VAL 26 1HG1 VAL 26 16.528 -0.289 2.568 183 HG12 VAL 26 2HG1 VAL 26 18.272 -0.531 2.683 184 HG13 VAL 26 3HG1 VAL 26 17.425 -0.911 1.183 185 HG21 VAL 26 3HG2 VAL 26 15.503 -3.612 3.311 186 HG22 VAL 26 1HG2 VAL 26 15.329 -1.939 3.842 187 HG23 VAL 26 2HG2 VAL 26 15.072 -2.358 2.148 188 H THR 27 H THR 27 18.637 -2.256 -0.336 189 HA THR 27 HA THR 27 21.408 -2.458 0.653 190 HB THR 27 HB THR 27 20.792 -2.240 -2.271 191 HG1 THR 27 1HG THR 27 19.684 -4.107 -1.025 192 HG21 THR 27 3HG2 THR 27 23.026 -3.410 -0.618 193 HG22 THR 27 1HG2 THR 27 23.094 -2.017 -1.697 194 HG23 THR 27 2HG2 THR 27 22.890 -3.638 -2.361 195 H PHE 28 H PHE 28 22.527 -0.623 0.850 196 HA PHE 28 HA PHE 28 21.307 1.845 -0.169 197 HB2 PHE 28 1HB PHE 28 23.354 1.426 2.018 198 HB3 PHE 28 2HB PHE 28 22.740 2.994 1.503 199 HD1 PHE 28 2HD PHE 28 20.162 3.297 1.616 200 HD2 PHE 28 1HD PHE 28 22.317 0.307 3.745 201 HE1 PHE 28 2HE PHE 28 18.295 3.088 3.205 202 HE2 PHE 28 1HE PHE 28 20.453 0.093 5.337 203 HZ PHE 28 HZ PHE 28 18.440 1.485 5.069 204 H GLY 29 H GLY 29 22.512 3.367 -1.312 205 HA2 GLY 29 1HA GLY 29 24.220 2.551 -3.264 206 HA3 GLY 29 2HA GLY 29 24.234 4.184 -2.614 207 H ASN 30 H ASN 30 25.100 3.418 0.031 208 HA ASN 30 HA ASN 30 27.931 3.246 -0.515 209 HB2 ASN 30 1HB ASN 30 26.789 4.755 1.233 210 HB3 ASN 30 2HB ASN 30 26.681 3.303 2.224 211 HD21 ASN 30 1HD2 ASN 30 28.493 5.961 1.583 212 HD22 ASN 30 2HD2 ASN 30 30.020 5.424 2.187 213 H SER 31 H SER 31 25.441 1.257 0.982 214 HA SER 31 HA SER 31 27.361 -0.798 1.707 215 HB2 SER 31 1HB SER 31 24.342 -0.825 1.937 216 HB3 SER 31 2HB SER 31 25.459 -1.962 2.692 217 HG SER 31 HG SER 31 25.542 0.826 3.177 218 H GLU 32 H GLU 32 28.152 -1.804 -0.065 219 HA GLU 32 HA GLU 32 26.607 -2.408 -2.373 220 HB2 GLU 32 1HB GLU 32 28.551 -3.655 -3.126 221 HB3 GLU 32 2HB GLU 32 29.054 -2.118 -2.435 222 HG2 GLU 32 1HG GLU 32 30.593 -3.639 -1.600 223 HG3 GLU 32 2HG GLU 32 29.448 -3.426 -0.276 224 H LYS 33 H LYS 33 26.804 -3.844 0.674 225 HA LYS 33 HA LYS 33 25.813 -6.417 -0.360 226 HB2 LYS 33 1HB LYS 33 27.557 -7.069 0.968 227 HB3 LYS 33 2HB LYS 33 27.436 -5.656 2.008 228 HG2 LYS 33 1HG LYS 33 25.769 -6.603 3.315 229 HG3 LYS 33 2HG LYS 33 25.335 -7.784 2.077 230 HD2 LYS 33 1HD LYS 33 26.555 -8.790 3.976 231 HD3 LYS 33 2HD LYS 33 27.403 -8.983 2.440 232 HE2 LYS 33 1HE LYS 33 28.752 -6.956 3.042 233 HE3 LYS 33 2HE LYS 33 28.006 -7.011 4.638 234 HZ1 LYS 33 3HZ LYS 33 29.523 -9.273 3.463 235 HZ2 LYS 33 1HZ LYS 33 28.983 -9.117 5.059 236 HZ3 LYS 33 2HZ LYS 33 30.215 -8.113 4.481 237 HA PRO 34 HA PRO 34 21.807 -5.388 1.177 238 HB2 PRO 34 1HB PRO 34 20.757 -7.891 1.224 239 HB3 PRO 34 2HB PRO 34 21.015 -6.986 -0.272 240 HG2 PRO 34 1HG PRO 34 22.703 -9.129 0.961 241 HG3 PRO 34 2HG PRO 34 22.251 -8.900 -0.738 242 HD2 PRO 34 1HD PRO 34 24.669 -8.168 0.237 243 HD3 PRO 34 2HD PRO 34 23.866 -7.292 -1.083 244 H GLU 35 H GLU 35 20.607 -5.455 3.074 245 HA GLU 35 HA GLU 35 21.715 -7.059 5.278 246 HB2 GLU 35 1HB GLU 35 22.509 -4.743 5.488 247 HB3 GLU 35 2HB GLU 35 20.849 -4.167 5.438 248 HG2 GLU 35 1HG GLU 35 20.385 -5.413 7.512 249 HG3 GLU 35 2HG GLU 35 22.080 -5.891 7.575 250 H THR 36 H THR 36 20.256 -7.860 6.753 251 HA THR 36 HA THR 36 17.597 -8.245 5.853 252 HB THR 36 HB THR 36 18.648 -8.760 8.640 253 HG1 THR 36 1HG THR 36 19.676 -10.437 7.843 254 HG21 THR 36 3HG2 THR 36 16.656 -9.668 9.053 255 HG22 THR 36 1HG2 THR 36 16.788 -10.694 7.625 256 HG23 THR 36 2HG2 THR 36 16.096 -9.077 7.488 257 H MET 37 H MET 37 16.165 -6.630 5.811 258 HA MET 37 HA MET 37 15.912 -4.948 8.217 259 HB2 MET 37 1HB MET 37 15.858 -4.242 5.322 260 HB3 MET 37 2HB MET 37 14.808 -3.344 6.410 261 HG2 MET 37 1HG MET 37 16.881 -2.933 7.819 262 HG3 MET 37 2HG MET 37 17.800 -3.526 6.438 263 HE1 MET 37 3HE MET 37 16.983 0.661 7.153 264 HE2 MET 37 1HE MET 37 15.880 -0.451 7.965 265 HE3 MET 37 2HE MET 37 17.623 -0.679 8.105 266 H THR 38 H THR 38 13.647 -3.884 8.269 267 HA THR 38 HA THR 38 11.639 -5.930 7.576 268 HB THR 38 HB THR 38 11.666 -4.144 10.017 269 HG1 THR 38 1HG THR 38 13.065 -5.806 10.393 270 HG21 THR 38 3HG2 THR 38 9.780 -5.984 10.531 271 HG22 THR 38 1HG2 THR 38 9.600 -5.865 8.781 272 HG23 THR 38 2HG2 THR 38 9.425 -4.426 9.786 273 H CYS 39 H CYS 39 9.805 -5.273 6.587 274 HA CYS 39 HA CYS 39 9.396 -2.375 6.260 275 HB2 CYS 39 1HB CYS 39 9.268 -4.558 4.189 276 HB3 CYS 39 2HB CYS 39 8.450 -3.017 3.959 277 HG CYS 39 HG CYS 39 10.496 -1.694 3.143 278 H ARG 40 H ARG 40 7.414 -1.650 6.721 279 HA ARG 40 HA ARG 40 5.091 -3.354 6.498 280 HB2 ARG 40 1HB ARG 40 4.423 -3.263 8.796 281 HB3 ARG 40 2HB ARG 40 6.062 -3.897 8.742 282 HG2 ARG 40 1HG ARG 40 6.839 -1.530 9.215 283 HG3 ARG 40 2HG ARG 40 5.152 -1.165 9.586 284 HD2 ARG 40 1HD ARG 40 5.226 -3.098 11.212 285 HD3 ARG 40 2HD ARG 40 6.972 -3.127 10.963 286 HE ARG 40 HE ARG 40 7.161 -1.203 12.213 287 HH11 ARG 40 1HH1 ARG 40 3.811 -1.831 11.502 288 HH12 ARG 40 2HH1 ARG 40 3.218 -0.632 12.603 289 HH21 ARG 40 1HH2 ARG 40 6.392 0.379 13.666 290 HH22 ARG 40 2HH2 ARG 40 4.686 0.626 13.832 291 H LEU 41 H LEU 41 3.078 -2.132 7.177 292 HA LEU 41 HA LEU 41 3.368 0.661 6.319 293 HB2 LEU 41 1HB LEU 41 1.254 -1.398 6.041 294 HB3 LEU 41 2HB LEU 41 0.730 0.277 6.201 295 HG LEU 41 HG LEU 41 2.736 -0.538 4.122 296 HD11 LEU 41 1HD1 LEU 41 0.324 -1.727 4.183 297 HD12 LEU 41 2HD1 LEU 41 1.179 -1.321 2.695 298 HD13 LEU 41 3HD1 LEU 41 -0.081 -0.250 3.309 299 HD21 LEU 41 3HD2 LEU 41 2.149 1.893 4.864 300 HD22 LEU 41 1HD2 LEU 41 0.698 1.631 3.896 301 HD23 LEU 41 2HD2 LEU 41 2.291 1.501 3.149 302 H SER 42 H SER 42 1.637 2.155 7.253 303 HA SER 42 HA SER 42 1.764 1.919 10.157 304 HB2 SER 42 1HB SER 42 1.310 4.257 10.239 305 HB3 SER 42 2HB SER 42 2.446 4.028 8.910 306 HG SER 42 HG SER 42 0.305 3.838 7.659 307 H ASN 43 H ASN 43 -0.271 3.054 11.238 308 HA ASN 43 HA ASN 43 -2.363 1.286 11.204 309 HB2 ASN 43 1HB ASN 43 -3.732 3.246 12.152 310 HB3 ASN 43 2HB ASN 43 -2.276 2.776 13.024 311 HD21 ASN 43 1HD2 ASN 43 -3.788 5.186 11.051 312 HD22 ASN 43 2HD2 ASN 43 -2.602 6.421 11.288 313 H ASN 44 H ASN 44 -2.122 4.334 9.395 314 HA ASN 44 HA ASN 44 -4.540 3.617 7.904 315 HB2 ASN 44 1HB ASN 44 -3.087 6.169 8.434 316 HB3 ASN 44 2HB ASN 44 -4.015 6.036 6.943 317 HD21 ASN 44 1HD2 ASN 44 -6.152 6.306 7.013 318 HD22 ASN 44 2HD2 ASN 44 -7.080 6.494 8.458 319 H GLN 45 H GLN 45 -1.843 2.378 7.554 320 HA GLN 45 HA GLN 45 -0.238 2.036 5.908 321 HB2 GLN 45 1HB GLN 45 -1.548 1.305 3.758 322 HB3 GLN 45 2HB GLN 45 -1.676 0.364 5.238 323 HG2 GLN 45 1HG GLN 45 -3.868 0.514 4.582 324 HG3 GLN 45 2HG GLN 45 -3.737 1.862 5.711 325 HE21 GLN 45 1HE2 GLN 45 -3.069 1.275 2.271 326 HE22 GLN 45 2HE2 GLN 45 -3.861 2.700 1.700 327 H ARG 46 H ARG 46 -0.616 4.805 6.189 328 HA ARG 46 HA ARG 46 -0.608 5.765 3.408 329 HB2 ARG 46 1HB ARG 46 -1.359 7.004 6.008 330 HB3 ARG 46 2HB ARG 46 -0.653 8.050 4.784 331 HG2 ARG 46 1HG ARG 46 -2.401 7.281 3.198 332 HG3 ARG 46 2HG ARG 46 -3.144 6.383 4.523 333 HD2 ARG 46 1HD ARG 46 -4.207 8.575 4.145 334 HD3 ARG 46 2HD ARG 46 -3.505 8.429 5.756 335 HE ARG 46 HE ARG 46 -1.633 9.607 4.014 336 HH11 ARG 46 1HH1 ARG 46 -4.632 10.308 5.638 337 HH12 ARG 46 2HH1 ARG 46 -4.337 12.013 5.724 338 HH21 ARG 46 1HH2 ARG 46 -1.234 11.850 4.121 339 HH22 ARG 46 2HH2 ARG 46 -2.405 12.889 4.860 340 H TYR 47 H TYR 47 1.471 4.804 5.765 341 HA TYR 47 HA TYR 47 3.677 6.251 4.536 342 HB2 TYR 47 1HB TYR 47 3.320 6.237 7.538 343 HB3 TYR 47 2HB TYR 47 4.613 7.013 6.631 344 HD1 TYR 47 1HD TYR 47 4.004 8.940 5.087 345 HD2 TYR 47 2HD TYR 47 1.323 7.381 8.000 346 HE1 TYR 47 1HE TYR 47 2.686 11.014 4.976 347 HE2 TYR 47 2HE TYR 47 -0.003 9.450 7.896 348 HH TYR 47 HH TYR 47 -0.080 11.473 5.623 349 H LEU 48 H LEU 48 5.569 5.114 4.510 350 HA LEU 48 HA LEU 48 5.444 2.392 5.609 351 HB2 LEU 48 1HB LEU 48 7.071 3.556 3.357 352 HB3 LEU 48 2HB LEU 48 7.264 1.914 3.967 353 HG LEU 48 HG LEU 48 4.733 2.997 2.733 354 HD11 LEU 48 1HD1 LEU 48 6.079 0.928 1.247 355 HD12 LEU 48 2HD1 LEU 48 7.118 2.338 1.450 356 HD13 LEU 48 3HD1 LEU 48 5.524 2.516 0.716 357 HD21 LEU 48 3HD2 LEU 48 5.561 0.188 3.461 358 HD22 LEU 48 1HD2 LEU 48 4.054 0.658 2.672 359 HD23 LEU 48 2HD2 LEU 48 4.381 1.174 4.327 360 H PHE 49 H PHE 49 7.101 1.559 6.841 361 HA PHE 49 HA PHE 49 9.248 3.419 7.606 362 HB2 PHE 49 1HB PHE 49 7.495 1.763 9.421 363 HB3 PHE 49 2HB PHE 49 9.035 2.439 9.944 364 HD1 PHE 49 1HD PHE 49 9.304 4.821 10.269 365 HD2 PHE 49 2HD PHE 49 5.581 3.177 9.021 366 HE1 PHE 49 1HE PHE 49 8.185 6.940 10.828 367 HE2 PHE 49 2HE PHE 49 4.457 5.294 9.577 368 HZ PHE 49 HZ PHE 49 5.759 7.179 10.481 369 H LEU 50 H LEU 50 11.183 2.417 8.398 370 HA LEU 50 HA LEU 50 11.446 -0.432 7.711 371 HB2 LEU 50 1HB LEU 50 13.628 1.554 7.181 372 HB3 LEU 50 2HB LEU 50 13.456 -0.085 6.559 373 HG LEU 50 HG LEU 50 11.577 2.130 5.780 374 HD11 LEU 50 1HD1 LEU 50 13.132 1.899 3.620 375 HD12 LEU 50 2HD1 LEU 50 14.336 1.585 4.869 376 HD13 LEU 50 3HD1 LEU 50 13.420 3.092 4.886 377 HD21 LEU 50 3HD2 LEU 50 10.594 0.168 5.117 378 HD22 LEU 50 1HD2 LEU 50 12.136 -0.657 4.888 379 HD23 LEU 50 2HD2 LEU 50 11.584 0.525 3.701 380 H ASP 51 H ASP 51 13.306 -1.490 8.722 381 HA ASP 51 HA ASP 51 14.401 -0.137 11.067 382 HB2 ASP 51 1HB ASP 51 12.211 -1.555 11.516 383 HB3 ASP 51 2HB ASP 51 13.346 -2.902 11.476 384 H GLY 52 H GLY 52 16.479 -0.652 11.432 385 HA2 GLY 52 1HA GLY 52 17.823 -2.976 11.305 386 HA3 GLY 52 2HA GLY 52 17.754 -2.514 9.611 387 H ASP 53 H ASP 53 19.489 -1.484 8.909 388 HA ASP 53 HA ASP 53 21.717 -0.792 10.229 389 HB2 ASP 53 1HB ASP 53 20.413 0.378 7.814 390 HB3 ASP 53 2HB ASP 53 21.818 1.206 8.481 391 H SER 54 H SER 54 18.898 1.331 9.856 392 HA SER 54 HA SER 54 19.360 2.591 12.367 393 HB2 SER 54 1HB SER 54 21.037 3.654 10.642 394 HB3 SER 54 2HB SER 54 19.607 4.528 10.094 395 HG SER 54 HG SER 54 20.138 4.451 12.836 396 H HIS 55 H HIS 55 17.810 4.469 12.682 397 HA HIS 55 HA HIS 55 15.205 3.644 12.040 398 HB2 HIS 55 1HB HIS 55 16.196 5.286 13.903 399 HB3 HIS 55 2HB HIS 55 15.670 6.499 12.738 400 HD2 HIS 55 2HD HIS 55 13.869 3.347 14.353 401 HE1 HIS 55 1HE HIS 55 11.186 6.629 14.196 402 HE2 HIS 55 2HE HIS 55 11.523 4.252 14.957 403 H TYR 56 H TYR 56 14.514 3.571 9.991 404 HA TYR 56 HA TYR 56 14.836 5.999 8.351 405 HB2 TYR 56 1HB TYR 56 15.213 3.129 7.685 406 HB3 TYR 56 2HB TYR 56 14.447 4.134 6.460 407 HD1 TYR 56 2HD TYR 56 17.408 4.195 8.742 408 HD2 TYR 56 1HD TYR 56 15.809 5.193 4.928 409 HE1 TYR 56 2HE TYR 56 19.620 5.005 8.034 410 HE2 TYR 56 1HE TYR 56 18.017 6.005 4.208 411 HH TYR 56 HH TYR 56 20.547 6.592 6.351 412 H GLU 57 H GLU 57 13.082 6.669 7.114 413 HA GLU 57 HA GLU 57 10.578 5.186 7.345 414 HB2 GLU 57 1HB GLU 57 10.073 6.526 9.125 415 HB3 GLU 57 2HB GLU 57 11.153 7.811 8.602 416 HG2 GLU 57 1HG GLU 57 9.524 8.422 6.853 417 HG3 GLU 57 2HG GLU 57 8.431 7.190 7.480 418 H ILE 58 H ILE 58 9.405 5.264 5.527 419 HA ILE 58 HA ILE 58 10.048 7.354 3.551 420 HB ILE 58 HB ILE 58 9.441 4.457 2.945 421 HG12 ILE 58 1HG1 ILE 58 12.017 5.888 2.345 422 HG13 ILE 58 2HG1 ILE 58 11.753 5.131 3.912 423 HG21 ILE 58 1HG2 ILE 58 9.039 6.725 1.374 424 HG22 ILE 58 2HG2 ILE 58 10.535 6.008 0.777 425 HG23 ILE 58 3HG2 ILE 58 9.059 5.046 0.836 426 HD11 ILE 58 3HD1 ILE 58 12.940 3.590 2.568 427 HD12 ILE 58 1HD1 ILE 58 11.285 2.997 2.693 428 HD13 ILE 58 2HD1 ILE 58 11.823 3.804 1.220 429 H GLU 59 H GLU 59 8.327 8.626 3.369 430 HA GLU 59 HA GLU 59 5.661 7.628 3.889 431 HB2 GLU 59 1HB GLU 59 6.529 10.380 2.989 432 HB3 GLU 59 2HB GLU 59 4.951 9.940 3.627 433 HG2 GLU 59 1HG GLU 59 7.562 10.176 5.062 434 HG3 GLU 59 2HG GLU 59 6.018 10.946 5.422 435 H ILE 60 H ILE 60 4.028 7.371 2.423 436 HA ILE 60 HA ILE 60 4.721 6.726 -0.236 437 HB ILE 60 HB ILE 60 1.982 7.225 0.936 438 HG12 ILE 60 1HG1 ILE 60 3.409 4.602 0.468 439 HG13 ILE 60 2HG1 ILE 60 3.364 5.425 2.023 440 HG21 ILE 60 1HG2 ILE 60 1.689 5.414 -1.097 441 HG22 ILE 60 2HG2 ILE 60 1.329 7.137 -1.200 442 HG23 ILE 60 3HG2 ILE 60 2.891 6.528 -1.748 443 HD11 ILE 60 3HD1 ILE 60 0.825 5.319 1.797 444 HD12 ILE 60 1HD1 ILE 60 1.118 4.145 0.515 445 HD13 ILE 60 2HD1 ILE 60 1.684 3.821 2.154 446 H VAL 61 H VAL 61 3.943 9.694 1.255 447 HA VAL 61 HA VAL 61 2.850 11.023 -1.027 448 HB VAL 61 HB VAL 61 3.370 13.117 0.280 449 HG11 VAL 61 1HG1 VAL 61 1.691 10.888 1.367 450 HG12 VAL 61 2HG1 VAL 61 1.755 12.453 2.180 451 HG13 VAL 61 3HG1 VAL 61 1.189 12.346 0.513 452 HG21 VAL 61 3HG2 VAL 61 5.210 11.626 1.568 453 HG22 VAL 61 1HG2 VAL 61 4.502 13.098 2.233 454 HG23 VAL 61 2HG2 VAL 61 3.870 11.522 2.709 455 H HIS 62 H HIS 62 5.997 10.127 -0.087 456 HA HIS 62 HA HIS 62 7.235 12.151 -1.813 457 HB2 HIS 62 1HB HIS 62 8.220 10.424 0.414 458 HB3 HIS 62 2HB HIS 62 9.369 10.924 -0.824 459 HD2 HIS 62 2HD HIS 62 7.275 12.487 2.078 460 HE1 HIS 62 1HE HIS 62 9.970 15.420 0.618 461 HE2 HIS 62 2HE HIS 62 8.351 14.810 2.448 462 H ILE 63 H ILE 63 6.676 8.717 -1.500 463 HA ILE 63 HA ILE 63 8.490 7.727 -3.364 464 HB ILE 63 HB ILE 63 5.695 6.685 -2.893 465 HG12 ILE 63 1HG1 ILE 63 8.268 6.032 -1.440 466 HG13 ILE 63 2HG1 ILE 63 6.933 6.971 -0.781 467 HG21 ILE 63 1HG2 ILE 63 6.243 4.868 -4.084 468 HG22 ILE 63 2HG2 ILE 63 7.506 5.890 -4.768 469 HG23 ILE 63 3HG2 ILE 63 7.877 4.810 -3.425 470 HD11 ILE 63 3HD1 ILE 63 6.847 4.073 -1.584 471 HD12 ILE 63 1HD1 ILE 63 6.881 4.709 0.060 472 HD13 ILE 63 2HD1 ILE 63 5.482 5.006 -0.972 473 H SER 64 H SER 64 8.713 8.061 -5.467 474 HA SER 64 HA SER 64 6.589 9.376 -6.953 475 HB2 SER 64 1HB SER 64 9.450 8.697 -7.660 476 HB3 SER 64 2HB SER 64 8.331 9.485 -8.771 477 HG SER 64 HG SER 64 8.099 10.964 -6.756 478 H THR 65 H THR 65 8.786 6.684 -7.755 479 HA THR 65 HA THR 65 6.578 5.444 -9.253 480 HB THR 65 HB THR 65 9.541 4.894 -9.508 481 HG1 THR 65 1HG THR 65 9.228 6.895 -10.368 482 HG21 THR 65 3HG2 THR 65 7.150 3.989 -11.110 483 HG22 THR 65 1HG2 THR 65 8.265 2.980 -10.190 484 HG23 THR 65 2HG2 THR 65 8.820 3.808 -11.645 485 H VAL 66 H VAL 66 6.354 3.124 -9.173 486 HA VAL 66 HA VAL 66 7.636 1.739 -6.955 487 HB VAL 66 HB VAL 66 4.626 1.935 -7.139 488 HG11 VAL 66 1HG1 VAL 66 6.295 -0.033 -5.999 489 HG12 VAL 66 2HG1 VAL 66 5.600 0.892 -4.667 490 HG13 VAL 66 3HG1 VAL 66 4.545 0.127 -5.856 491 HG21 VAL 66 3HG2 VAL 66 4.752 3.166 -5.035 492 HG22 VAL 66 1HG2 VAL 66 6.513 3.093 -5.089 493 HG23 VAL 66 2HG2 VAL 66 5.630 4.010 -6.311 494 H GLN 67 H GLN 67 8.463 0.065 -8.044 495 HA GLN 67 HA GLN 67 6.622 -1.547 -9.676 496 HB2 GLN 67 1HB GLN 67 8.300 -1.944 -11.322 497 HB3 GLN 67 2HB GLN 67 8.230 -0.204 -11.071 498 HG2 GLN 67 1HG GLN 67 10.205 -0.323 -9.646 499 HG3 GLN 67 2HG GLN 67 10.273 -2.069 -9.884 500 HE21 GLN 67 1HE2 GLN 67 12.245 -2.114 -10.868 501 HE22 GLN 67 2HE2 GLN 67 12.547 -1.444 -12.431 502 H ILE 68 H ILE 68 7.148 -3.809 -9.804 503 HA ILE 68 HA ILE 68 8.597 -4.733 -7.418 504 HB ILE 68 HB ILE 68 6.495 -6.158 -9.053 505 HG12 ILE 68 1HG1 ILE 68 6.371 -5.028 -6.248 506 HG13 ILE 68 2HG1 ILE 68 5.643 -4.286 -7.669 507 HG21 ILE 68 1HG2 ILE 68 8.494 -7.299 -7.550 508 HG22 ILE 68 2HG2 ILE 68 7.137 -7.235 -6.427 509 HG23 ILE 68 3HG2 ILE 68 6.960 -8.058 -7.976 510 HD11 ILE 68 3HD1 ILE 68 4.937 -7.047 -6.729 511 HD12 ILE 68 1HD1 ILE 68 4.097 -5.595 -6.184 512 HD13 ILE 68 2HD1 ILE 68 4.078 -6.037 -7.891 513 H LEU 69 H LEU 69 10.355 -5.985 -7.600 514 HA LEU 69 HA LEU 69 11.445 -6.470 -10.227 515 HB2 LEU 69 1HB LEU 69 12.497 -7.133 -7.481 516 HB3 LEU 69 2HB LEU 69 13.390 -7.354 -8.984 517 HG LEU 69 HG LEU 69 12.490 -4.720 -7.818 518 HD11 LEU 69 1HD1 LEU 69 14.588 -6.245 -7.013 519 HD12 LEU 69 2HD1 LEU 69 14.524 -4.487 -6.905 520 HD13 LEU 69 3HD1 LEU 69 15.336 -5.257 -8.268 521 HD21 LEU 69 3HD2 LEU 69 14.392 -4.298 -9.804 522 HD22 LEU 69 1HD2 LEU 69 12.668 -3.937 -9.891 523 HD23 LEU 69 2HD2 LEU 69 13.276 -5.479 -10.491 524 H THR 70 H THR 70 11.898 -8.456 -11.154 525 HA THR 70 HA THR 70 10.908 -10.859 -9.804 526 HB THR 70 HB THR 70 9.828 -11.591 -11.967 527 HG1 THR 70 1HG THR 70 10.367 -10.256 -13.550 528 HG21 THR 70 3HG2 THR 70 7.861 -9.872 -11.627 529 HG22 THR 70 1HG2 THR 70 8.811 -9.399 -10.219 530 HG23 THR 70 2HG2 THR 70 8.246 -11.061 -10.384 531 H GLU 71 H GLU 71 12.689 -12.074 -9.711 532 HA GLU 71 HA GLU 71 14.465 -12.168 -12.050 533 HB2 GLU 71 1HB GLU 71 15.229 -11.640 -9.584 534 HB3 GLU 71 2HB GLU 71 15.184 -13.389 -9.417 535 HG2 GLU 71 1HG GLU 71 17.395 -12.881 -9.975 536 HG3 GLU 71 2HG GLU 71 16.671 -13.480 -11.466 537 H GLY 72 H GLY 72 14.235 -13.843 -13.367 538 HA2 GLY 72 1HA GLY 72 14.554 -16.377 -13.270 539 HA3 GLY 72 2HA GLY 72 13.104 -16.339 -12.277 540 H PHE 73 H PHE 73 14.362 -16.402 -15.445 541 HA PHE 73 HA PHE 73 12.275 -15.351 -16.955 542 HB2 PHE 73 1HB PHE 73 14.463 -17.289 -17.430 543 HB3 PHE 73 2HB PHE 73 13.116 -17.353 -18.561 544 HD1 PHE 73 1HD PHE 73 12.316 -14.729 -19.097 545 HD2 PHE 73 2HD PHE 73 16.247 -16.138 -18.274 546 HE1 PHE 73 1HE PHE 73 13.255 -12.815 -20.325 547 HE2 PHE 73 2HE PHE 73 17.192 -14.225 -19.500 548 HZ PHE 73 HZ PHE 73 15.696 -12.561 -20.526 549 HA PRO 74 HA PRO 74 10.273 -19.742 -17.091 550 HB2 PRO 74 1HB PRO 74 11.286 -21.631 -15.425 551 HB3 PRO 74 2HB PRO 74 11.892 -21.373 -17.065 552 HG2 PRO 74 1HG PRO 74 13.007 -20.408 -14.460 553 HG3 PRO 74 2HG PRO 74 13.859 -21.092 -15.857 554 HD2 PRO 74 1HD PRO 74 13.755 -18.430 -15.373 555 HD3 PRO 74 2HD PRO 74 13.816 -19.100 -17.016 556 HA PRO 75 HA PRO 75 7.696 -18.890 -13.612 557 HB2 PRO 75 1HB PRO 75 5.892 -20.897 -13.915 558 HB3 PRO 75 2HB PRO 75 5.933 -19.475 -14.965 559 HG2 PRO 75 1HG PRO 75 7.039 -22.216 -15.443 560 HG3 PRO 75 2HG PRO 75 6.148 -21.159 -16.554 561 HD2 PRO 75 1HD PRO 75 8.843 -21.413 -16.632 562 HD3 PRO 75 2HD PRO 75 8.013 -19.901 -17.054 563 H GLY 76 H GLY 76 7.793 -19.372 -11.499 564 HA2 GLY 76 1HA GLY 76 9.204 -21.770 -10.677 565 HA3 GLY 76 2HA GLY 76 8.711 -20.440 -9.640 566 H GLY 77 H GLY 77 5.991 -20.343 -10.150 567 HA2 GLY 77 1HA GLY 77 4.134 -22.002 -10.237 568 HA3 GLY 77 2HA GLY 77 5.115 -22.987 -9.162 569 H GLY 78 H GLY 78 2.705 -20.627 -9.361 570 HA2 GLY 78 1HA GLY 78 2.006 -20.705 -6.685 571 HA3 GLY 78 2HA GLY 78 3.092 -19.334 -6.855 572 H ASN 79 H ASN 79 1.770 -17.623 -6.648 573 HA ASN 79 HA ASN 79 -0.547 -17.484 -8.464 574 HB2 ASN 79 1HB ASN 79 -1.301 -17.562 -6.157 575 HB3 ASN 79 2HB ASN 79 -0.207 -16.251 -5.722 576 HD21 ASN 79 1HD2 ASN 79 -3.017 -17.073 -7.671 577 HD22 ASN 79 2HD2 ASN 79 -3.695 -15.484 -7.693 578 H ALA 80 H ALA 80 1.574 -15.300 -6.598 579 HA ALA 80 HA ALA 80 1.682 -13.550 -8.969 580 HB1 ALA 80 1HB ALA 80 1.770 -12.817 -6.047 581 HB2 ALA 80 2HB ALA 80 2.097 -11.690 -7.364 582 HB3 ALA 80 3HB ALA 80 0.503 -12.430 -7.213 583 H ARG 81 H ARG 81 3.580 -13.763 -9.954 584 HA ARG 81 HA ARG 81 5.916 -14.755 -8.670 585 HB2 ARG 81 1HB ARG 81 5.336 -13.600 -11.379 586 HB3 ARG 81 2HB ARG 81 6.993 -13.920 -10.884 587 HG2 ARG 81 1HG ARG 81 6.220 -15.791 -12.134 588 HG3 ARG 81 2HG ARG 81 6.334 -16.280 -10.442 589 HD2 ARG 81 1HD ARG 81 4.287 -17.144 -11.296 590 HD3 ARG 81 2HD ARG 81 3.887 -15.798 -10.230 591 HE ARG 81 HE ARG 81 4.022 -14.658 -12.691 592 HH11 ARG 81 1HH1 ARG 81 2.283 -17.366 -11.365 593 HH12 ARG 81 2HH1 ARG 81 0.933 -17.191 -12.438 594 HH21 ARG 81 1HH2 ARG 81 2.251 -14.416 -14.108 595 HH22 ARG 81 2HH2 ARG 81 0.916 -15.513 -13.998 596 H ALA 82 H ALA 82 7.137 -13.646 -7.304 597 HA ALA 82 HA ALA 82 8.075 -11.004 -7.983 598 HB1 ALA 82 1HB ALA 82 5.916 -11.377 -6.068 599 HB2 ALA 82 2HB ALA 82 7.294 -10.507 -5.392 600 HB3 ALA 82 3HB ALA 82 6.499 -9.906 -6.847 601 H THR 83 H THR 83 10.176 -11.080 -7.576 602 HA THR 83 HA THR 83 11.107 -12.625 -5.243 603 HB THR 83 HB THR 83 12.691 -12.126 -7.767 604 HG1 THR 83 1HG THR 83 12.148 -14.245 -8.327 605 HG21 THR 83 3HG2 THR 83 14.414 -13.000 -6.659 606 HG22 THR 83 1HG2 THR 83 13.464 -14.425 -6.239 607 HG23 THR 83 2HG2 THR 83 13.432 -13.005 -5.194 608 H GLY 84 H GLY 84 10.416 -9.670 -5.755 609 HA2 GLY 84 1HA GLY 84 12.146 -8.497 -3.963 610 HA3 GLY 84 2HA GLY 84 12.884 -8.247 -5.538 611 H MET 85 H MET 85 12.473 -5.967 -4.603 612 HA MET 85 HA MET 85 10.143 -4.932 -5.985 613 HB2 MET 85 1HB MET 85 9.260 -5.344 -3.747 614 HB3 MET 85 2HB MET 85 10.585 -4.432 -3.036 615 HG2 MET 85 1HG MET 85 9.735 -2.405 -3.706 616 HG3 MET 85 2HG MET 85 8.803 -3.113 -5.024 617 HE1 MET 85 3HE MET 85 6.772 -2.729 -5.089 618 HE2 MET 85 1HE MET 85 5.902 -4.071 -4.345 619 HE3 MET 85 2HE MET 85 5.603 -2.419 -3.804 620 H PHE 86 H PHE 86 10.389 -2.829 -6.679 621 HA PHE 86 HA PHE 86 12.881 -1.464 -5.919 622 HB2 PHE 86 1HB PHE 86 13.007 -2.649 -8.168 623 HB3 PHE 86 2HB PHE 86 11.807 -1.493 -8.739 624 HD1 PHE 86 1HD PHE 86 12.369 0.867 -8.979 625 HD2 PHE 86 2HD PHE 86 15.278 -1.997 -7.775 626 HE1 PHE 86 1HE PHE 86 14.159 2.476 -9.488 627 HE2 PHE 86 2HE PHE 86 17.072 -0.392 -8.281 628 HZ PHE 86 HZ PHE 86 16.514 1.849 -9.138 629 H LEU 87 H LEU 87 12.024 0.145 -4.709 630 HA LEU 87 HA LEU 87 9.818 1.718 -5.842 631 HB2 LEU 87 1HB LEU 87 10.936 1.784 -3.045 632 HB3 LEU 87 2HB LEU 87 9.477 2.592 -3.617 633 HG LEU 87 HG LEU 87 9.707 -0.395 -3.716 634 HD11 LEU 87 1HD1 LEU 87 10.249 0.498 -1.404 635 HD12 LEU 87 2HD1 LEU 87 8.897 -0.628 -1.521 636 HD13 LEU 87 3HD1 LEU 87 8.592 1.102 -1.362 637 HD21 LEU 87 3HD2 LEU 87 7.876 0.951 -4.866 638 HD22 LEU 87 1HD2 LEU 87 7.292 1.328 -3.245 639 HD23 LEU 87 2HD2 LEU 87 7.360 -0.348 -3.790 640 H GLN 88 H GLN 88 9.934 4.003 -5.895 641 HA GLN 88 HA GLN 88 12.658 5.106 -5.717 642 HB2 GLN 88 1HB GLN 88 10.613 5.475 -7.898 643 HB3 GLN 88 2HB GLN 88 11.949 6.595 -7.669 644 HG2 GLN 88 1HG GLN 88 13.530 4.737 -7.971 645 HG3 GLN 88 2HG GLN 88 12.171 3.653 -8.265 646 HE21 GLN 88 1HE2 GLN 88 14.259 6.016 -9.580 647 HE22 GLN 88 2HE2 GLN 88 13.611 6.028 -11.182 648 H TYR 89 H TYR 89 12.839 6.882 -4.514 649 HA TYR 89 HA TYR 89 10.506 8.604 -4.120 650 HB2 TYR 89 1HB TYR 89 11.024 8.704 -1.663 651 HB3 TYR 89 2HB TYR 89 10.388 7.157 -2.213 652 HD1 TYR 89 1HD TYR 89 13.604 8.897 -1.486 653 HD2 TYR 89 2HD TYR 89 11.520 5.193 -1.688 654 HE1 TYR 89 1HE TYR 89 15.548 7.756 -0.500 655 HE2 TYR 89 2HE TYR 89 13.457 4.042 -0.702 656 HH TYR 89 HH TYR 89 15.617 4.241 -0.122 657 H THR 90 H THR 90 10.983 10.747 -3.690 658 HA THR 90 HA THR 90 13.755 11.514 -4.237 659 HB THR 90 HB THR 90 12.876 13.751 -4.707 660 HG1 THR 90 1HG THR 90 10.590 14.058 -4.651 661 HG21 THR 90 3HG2 THR 90 11.707 13.246 -6.734 662 HG22 THR 90 1HG2 THR 90 11.179 11.686 -6.106 663 HG23 THR 90 2HG2 THR 90 12.883 11.960 -6.466 664 H VAL 91 H VAL 91 14.957 12.798 -2.889 665 HA VAL 91 HA VAL 91 13.852 13.204 -0.188 666 HB VAL 91 HB VAL 91 16.735 12.889 -1.036 667 HG11 VAL 91 1HG1 VAL 91 15.923 12.809 1.811 668 HG12 VAL 91 2HG1 VAL 91 17.418 13.386 1.072 669 HG13 VAL 91 3HG1 VAL 91 15.968 14.389 1.029 670 HG21 VAL 91 3HG2 VAL 91 16.597 10.709 -0.529 671 HG22 VAL 91 1HG2 VAL 91 15.590 11.008 0.888 672 HG23 VAL 91 2HG2 VAL 91 14.857 10.927 -0.714 673 HA PRO 92 HA PRO 92 14.114 17.552 -1.043 674 HB2 PRO 92 1HB PRO 92 13.524 18.396 1.468 675 HB3 PRO 92 2HB PRO 92 12.303 17.770 0.354 676 HG2 PRO 92 1HG PRO 92 13.705 16.379 2.603 677 HG3 PRO 92 2HG PRO 92 11.992 16.325 2.149 678 HD2 PRO 92 1HD PRO 92 13.735 14.357 1.497 679 HD3 PRO 92 2HD PRO 92 12.357 14.793 0.465 680 H GLY 93 H GLY 93 15.715 16.113 1.782 681 HA2 GLY 93 1HA GLY 93 17.528 18.317 2.113 682 HA3 GLY 93 2HA GLY 93 17.606 16.768 2.939 683 H THR 94 H THR 94 17.419 15.710 -0.031 684 HA THR 94 HA THR 94 20.298 16.013 -0.591 685 HB THR 94 HB THR 94 18.603 13.522 -0.769 686 HG1 THR 94 1HG THR 94 21.135 13.706 0.446 687 HG21 THR 94 3HG2 THR 94 19.805 13.109 -2.644 688 HG22 THR 94 1HG2 THR 94 21.060 12.676 -1.485 689 HG23 THR 94 2HG2 THR 94 21.059 14.277 -2.227 690 H GLU 95 H GLU 95 20.932 16.098 -2.748 691 HA GLU 95 HA GLU 95 18.824 16.915 -4.586 692 HB2 GLU 95 1HB GLU 95 21.834 17.090 -4.722 693 HB3 GLU 95 2HB GLU 95 20.783 17.566 -6.048 694 HG2 GLU 95 1HG GLU 95 21.144 19.576 -5.022 695 HG3 GLU 95 2HG GLU 95 19.648 19.062 -4.243 696 H GLY 96 H GLY 96 17.901 15.408 -5.806 697 HA2 GLY 96 1HA GLY 96 18.397 14.003 -7.812 698 HA3 GLY 96 2HA GLY 96 19.595 13.202 -6.806 699 H VAL 97 H VAL 97 18.071 11.437 -7.811 700 HA VAL 97 HA VAL 97 15.829 10.958 -5.966 701 HB VAL 97 HB VAL 97 16.357 9.637 -8.631 702 HG11 VAL 97 1HG1 VAL 97 15.096 8.190 -7.198 703 HG12 VAL 97 2HG1 VAL 97 14.021 9.509 -6.730 704 HG13 VAL 97 3HG1 VAL 97 13.992 8.890 -8.381 705 HG21 VAL 97 3HG2 VAL 97 14.670 11.991 -7.854 706 HG22 VAL 97 1HG2 VAL 97 15.813 11.834 -9.188 707 HG23 VAL 97 2HG2 VAL 97 14.262 10.998 -9.253 708 H THR 98 H THR 98 15.610 8.968 -4.934 709 HA THR 98 HA THR 98 18.005 7.249 -4.982 710 HB THR 98 HB THR 98 16.301 7.865 -2.560 711 HG1 THR 98 1HG THR 98 17.942 9.196 -1.935 712 HG21 THR 98 3HG2 THR 98 18.971 6.666 -2.259 713 HG22 THR 98 1HG2 THR 98 17.763 5.620 -3.004 714 HG23 THR 98 2HG2 THR 98 17.466 6.312 -1.410 715 H GLN 99 H GLN 99 17.689 5.096 -5.150 716 HA GLN 99 HA GLN 99 14.901 4.168 -5.292 717 HB2 GLN 99 1HB GLN 99 15.561 2.554 -6.874 718 HB3 GLN 99 2HB GLN 99 16.416 4.018 -7.341 719 HG2 GLN 99 1HG GLN 99 17.666 1.879 -5.646 720 HG3 GLN 99 2HG GLN 99 17.733 1.868 -7.407 721 HE21 GLN 99 1HE2 GLN 99 18.676 3.779 -8.439 722 HE22 GLN 99 2HE2 GLN 99 19.976 4.592 -7.643 723 H LEU 100 H LEU 100 14.388 2.067 -4.465 724 HA LEU 100 HA LEU 100 16.265 1.093 -2.416 725 HB2 LEU 100 1HB LEU 100 14.378 2.401 -1.455 726 HB3 LEU 100 2HB LEU 100 13.266 1.219 -2.143 727 HG LEU 100 HG LEU 100 14.758 -0.450 -0.710 728 HD11 LEU 100 1HD1 LEU 100 16.310 0.781 0.387 729 HD12 LEU 100 2HD1 LEU 100 14.988 0.965 1.539 730 HD13 LEU 100 3HD1 LEU 100 15.325 2.244 0.373 731 HD21 LEU 100 3HD2 LEU 100 12.345 1.148 -0.113 732 HD22 LEU 100 1HD2 LEU 100 13.088 0.303 1.245 733 HD23 LEU 100 2HD2 LEU 100 12.565 -0.601 -0.176 734 H LYS 101 H LYS 101 16.782 -0.973 -2.652 735 HA LYS 101 HA LYS 101 15.069 -2.668 -4.334 736 HB2 LYS 101 1HB LYS 101 17.523 -2.265 -4.920 737 HB3 LYS 101 2HB LYS 101 17.912 -3.256 -3.520 738 HG2 LYS 101 1HG LYS 101 17.058 -5.183 -4.486 739 HG3 LYS 101 2HG LYS 101 16.077 -4.284 -5.646 740 HD2 LYS 101 1HD LYS 101 18.090 -3.583 -6.826 741 HD3 LYS 101 2HD LYS 101 19.092 -4.429 -5.645 742 HE2 LYS 101 1HE LYS 101 16.980 -5.871 -7.212 743 HE3 LYS 101 2HE LYS 101 18.584 -5.590 -7.888 744 HZ1 LYS 101 3HZ LYS 101 19.214 -6.586 -5.502 745 HZ2 LYS 101 1HZ LYS 101 19.023 -7.538 -6.888 746 HZ3 LYS 101 2HZ LYS 101 17.756 -7.399 -5.777 747 H LEU 102 H LEU 102 14.162 -4.495 -3.562 748 HA LEU 102 HA LEU 102 14.880 -5.343 -0.836 749 HB2 LEU 102 1HB LEU 102 12.098 -5.248 -1.994 750 HB3 LEU 102 2HB LEU 102 12.537 -5.807 -0.381 751 HG LEU 102 HG LEU 102 12.921 -2.976 -1.347 752 HD11 LEU 102 1HD1 LEU 102 10.874 -2.384 -0.555 753 HD12 LEU 102 2HD1 LEU 102 10.824 -3.696 0.623 754 HD13 LEU 102 3HD1 LEU 102 10.501 -4.026 -1.079 755 HD21 LEU 102 3HD2 LEU 102 12.862 -4.027 1.470 756 HD22 LEU 102 1HD2 LEU 102 13.389 -2.443 0.904 757 HD23 LEU 102 2HD2 LEU 102 14.352 -3.875 0.538 758 H THR 103 H THR 103 15.187 -7.473 -0.554 759 HA THR 103 HA THR 103 14.216 -9.336 -2.601 760 HB THR 103 HB THR 103 17.054 -9.381 -1.558 761 HG1 THR 103 1HG THR 103 16.349 -7.670 -3.170 762 HG21 THR 103 3HG2 THR 103 15.478 -11.401 -2.683 763 HG22 THR 103 1HG2 THR 103 17.226 -11.416 -2.455 764 HG23 THR 103 2HG2 THR 103 16.540 -10.857 -3.981 765 H VAL 104 H VAL 104 13.498 -11.239 -1.814 766 HA VAL 104 HA VAL 104 13.181 -11.535 1.005 767 HB VAL 104 HB VAL 104 12.608 -13.503 -1.216 768 HG11 VAL 104 1HG1 VAL 104 12.713 -13.945 1.540 769 HG12 VAL 104 2HG1 VAL 104 10.998 -13.792 1.155 770 HG13 VAL 104 3HG1 VAL 104 11.988 -14.988 0.318 771 HG21 VAL 104 3HG2 VAL 104 11.224 -11.673 -1.627 772 HG22 VAL 104 1HG2 VAL 104 10.212 -12.742 -0.656 773 HG23 VAL 104 2HG2 VAL 104 10.987 -11.344 0.089 774 H VAL 105 H VAL 105 14.448 -12.537 2.425 775 HA VAL 105 HA VAL 105 16.897 -13.777 1.539 776 HB VAL 105 HB VAL 105 15.814 -13.488 4.345 777 HG11 VAL 105 1HG1 VAL 105 18.040 -13.944 5.096 778 HG12 VAL 105 2HG1 VAL 105 17.555 -15.243 4.004 779 HG13 VAL 105 3HG1 VAL 105 18.647 -13.977 3.440 780 HG21 VAL 105 3HG2 VAL 105 17.191 -11.526 4.542 781 HG22 VAL 105 1HG2 VAL 105 17.828 -11.759 2.914 782 HG23 VAL 105 2HG2 VAL 105 16.132 -11.333 3.145 783 H GLU 106 H GLU 106 17.531 -15.908 1.870 784 HA GLU 106 HA GLU 106 15.413 -17.840 1.749 785 HB2 GLU 106 1HB GLU 106 18.394 -17.927 1.550 786 HB3 GLU 106 2HB GLU 106 17.521 -19.423 1.851 787 HG2 GLU 106 1HG GLU 106 16.096 -18.727 -0.187 788 HG3 GLU 106 2HG GLU 106 17.439 -17.642 -0.545 789 H ASP 107 H ASP 107 18.286 -17.724 3.860 790 HA ASP 107 HA ASP 107 16.966 -19.345 5.844 791 HB2 ASP 107 1HB ASP 107 19.594 -17.916 6.203 792 HB3 ASP 107 2HB ASP 107 19.043 -19.400 6.975 793 H VAL 108 H VAL 108 15.190 -17.955 6.360 794 HA VAL 108 HA VAL 108 15.790 -16.181 8.551 795 HB VAL 108 HB VAL 108 15.964 -14.762 6.439 796 HG11 VAL 108 1HG1 VAL 108 14.127 -15.685 5.184 797 HG12 VAL 108 2HG1 VAL 108 12.987 -15.242 6.456 798 HG13 VAL 108 3HG1 VAL 108 13.797 -13.985 5.520 799 HG21 VAL 108 3HG2 VAL 108 14.527 -12.930 7.473 800 HG22 VAL 108 1HG2 VAL 108 14.091 -14.120 8.700 801 HG23 VAL 108 2HG2 VAL 108 15.776 -13.638 8.498 802 H THR 109 H THR 109 14.039 -15.841 9.909 803 HA THR 109 HA THR 109 12.165 -17.748 10.266 804 HB THR 109 HB THR 109 11.701 -14.808 10.803 805 HG1 THR 109 1HG THR 109 12.604 -16.702 12.695 806 HG21 THR 109 3HG2 THR 109 9.624 -15.790 11.148 807 HG22 THR 109 1HG2 THR 109 10.357 -15.884 12.749 808 HG23 THR 109 2HG2 THR 109 10.323 -17.309 11.710 809 H VAL 110 H VAL 110 11.164 -14.606 8.913 810 HA VAL 110 HA VAL 110 8.697 -15.186 8.007 811 HB VAL 110 HB VAL 110 10.825 -13.515 6.696 812 HG11 VAL 110 1HG1 VAL 110 9.525 -14.092 4.836 813 HG12 VAL 110 2HG1 VAL 110 8.022 -14.044 5.759 814 HG13 VAL 110 3HG1 VAL 110 8.867 -12.546 5.369 815 HG21 VAL 110 3HG2 VAL 110 10.175 -12.287 8.483 816 HG22 VAL 110 1HG2 VAL 110 8.857 -11.830 7.404 817 HG23 VAL 110 2HG2 VAL 110 8.613 -13.095 8.608 818 H GLY 111 H GLY 111 7.737 -15.995 6.114 819 HA2 GLY 111 1HA GLY 111 9.411 -17.972 4.716 820 HA3 GLY 111 2HA GLY 111 7.664 -18.053 4.882 821 H ARG 112 H ARG 112 8.389 -18.502 2.446 822 HA ARG 112 HA ARG 112 8.819 -16.167 0.851 823 HB2 ARG 112 1HB ARG 112 8.344 -19.058 0.340 824 HB3 ARG 112 2HB ARG 112 7.989 -17.938 -0.967 825 HG2 ARG 112 1HG ARG 112 10.626 -17.971 0.469 826 HG3 ARG 112 2HG ARG 112 10.294 -18.958 -0.956 827 HD2 ARG 112 1HD ARG 112 9.610 -16.794 -2.102 828 HD3 ARG 112 2HD ARG 112 10.343 -15.960 -0.732 829 HE ARG 112 HE ARG 112 12.414 -16.473 -1.568 830 HH11 ARG 112 1HH1 ARG 112 10.012 -18.412 -3.177 831 HH12 ARG 112 2HH1 ARG 112 11.117 -19.034 -4.358 832 HH21 ARG 112 1HH2 ARG 112 13.878 -17.284 -3.117 833 HH22 ARG 112 2HH2 ARG 112 13.316 -18.393 -4.322 834 H ARG 113 H ARG 113 6.022 -18.124 1.735 835 HA ARG 113 HA ARG 113 4.167 -16.930 -0.014 836 HB2 ARG 113 1HB ARG 113 3.660 -18.179 2.694 837 HB3 ARG 113 2HB ARG 113 2.451 -17.880 1.453 838 HG2 ARG 113 1HG ARG 113 3.287 -19.555 0.063 839 HG3 ARG 113 2HG ARG 113 4.832 -19.614 0.915 840 HD2 ARG 113 1HD ARG 113 4.000 -20.888 2.619 841 HD3 ARG 113 2HD ARG 113 2.369 -20.239 2.452 842 HE ARG 113 HE ARG 113 3.335 -22.613 1.300 843 HH11 ARG 113 1HH1 ARG 113 1.400 -19.831 0.504 844 HH12 ARG 113 2HH1 ARG 113 0.444 -20.670 -0.672 845 HH21 ARG 113 1HH2 ARG 113 2.084 -23.729 -0.246 846 HH22 ARG 113 2HH2 ARG 113 0.833 -22.887 -1.098 847 H GLN 114 H GLN 114 5.399 -15.992 3.119 848 HA GLN 114 HA GLN 114 3.416 -13.966 3.573 849 HB2 GLN 114 1HB GLN 114 4.525 -15.042 5.458 850 HB3 GLN 114 2HB GLN 114 6.087 -14.460 4.899 851 HG2 GLN 114 1HG GLN 114 5.660 -12.900 6.483 852 HG3 GLN 114 2HG GLN 114 4.890 -12.117 5.103 853 HE21 GLN 114 1HE2 GLN 114 4.178 -11.421 7.633 854 HE22 GLN 114 2HE2 GLN 114 2.579 -11.980 7.973 855 H ALA 115 H ALA 115 6.951 -13.678 3.179 856 HA ALA 115 HA ALA 115 7.114 -10.986 2.716 857 HB1 ALA 115 1HB ALA 115 8.762 -13.306 1.852 858 HB2 ALA 115 2HB ALA 115 9.101 -11.725 1.146 859 HB3 ALA 115 3HB ALA 115 9.180 -11.945 2.894 860 H VAL 116 H VAL 116 6.954 -13.455 0.139 861 HA VAL 116 HA VAL 116 6.780 -11.843 -2.059 862 HB VAL 116 HB VAL 116 5.210 -14.385 -1.609 863 HG11 VAL 116 1HG1 VAL 116 4.585 -12.829 -3.566 864 HG12 VAL 116 2HG1 VAL 116 6.122 -13.342 -4.266 865 HG13 VAL 116 3HG1 VAL 116 4.873 -14.535 -3.906 866 HG21 VAL 116 3HG2 VAL 116 7.693 -14.377 -3.203 867 HG22 VAL 116 1HG2 VAL 116 7.885 -14.155 -1.464 868 HG23 VAL 116 2HG2 VAL 116 7.065 -15.588 -2.085 869 H ALA 117 H ALA 117 4.116 -12.821 0.068 870 HA ALA 117 HA ALA 117 2.005 -11.679 -1.345 871 HB1 ALA 117 1HB ALA 117 2.393 -12.869 1.204 872 HB2 ALA 117 2HB ALA 117 1.482 -11.375 1.426 873 HB3 ALA 117 3HB ALA 117 0.886 -12.615 0.323 874 H TRP 118 H TRP 118 3.859 -10.266 1.356 875 HA TRP 118 HA TRP 118 2.651 -7.787 1.448 876 HB2 TRP 118 1HB TRP 118 4.407 -8.709 3.023 877 HB3 TRP 118 2HB TRP 118 5.614 -8.225 1.835 878 HD1 TRP 118 HD TRP 118 3.571 -6.892 4.673 879 HE1 TRP 118 1HE TRP 118 4.032 -4.378 4.976 880 HE3 TRP 118 3HE TRP 118 6.157 -6.014 0.351 881 HZ2 TRP 118 2HZ TRP 118 5.320 -2.298 3.570 882 HZ3 TRP 118 3HZ TRP 118 6.969 -3.734 -0.095 883 HH2 TRP 118 HH TRP 118 6.558 -1.916 1.482 884 H LEU 119 H LEU 119 5.383 -8.817 -0.571 885 HA LEU 119 HA LEU 119 6.068 -6.438 -1.758 886 HB2 LEU 119 1HB LEU 119 5.901 -9.150 -3.064 887 HB3 LEU 119 2HB LEU 119 6.787 -7.767 -3.703 888 HG LEU 119 HG LEU 119 7.420 -9.005 -1.034 889 HD11 LEU 119 1HD1 LEU 119 9.219 -9.593 -3.262 890 HD12 LEU 119 2HD1 LEU 119 7.639 -10.366 -3.386 891 HD13 LEU 119 3HD1 LEU 119 8.641 -10.633 -1.960 892 HD21 LEU 119 3HD2 LEU 119 8.452 -6.800 -2.642 893 HD22 LEU 119 1HD2 LEU 119 9.698 -7.934 -2.119 894 HD23 LEU 119 2HD2 LEU 119 8.662 -7.150 -0.925 895 H VAL 120 H VAL 120 4.005 -8.802 -3.444 896 HA VAL 120 HA VAL 120 2.993 -7.030 -5.333 897 HB VAL 120 HB VAL 120 2.775 -9.437 -5.596 898 HG11 VAL 120 1HG1 VAL 120 0.670 -9.361 -3.442 899 HG12 VAL 120 2HG1 VAL 120 1.287 -10.777 -4.295 900 HG13 VAL 120 3HG1 VAL 120 2.330 -9.896 -3.178 901 HG21 VAL 120 3HG2 VAL 120 0.185 -7.904 -5.539 902 HG22 VAL 120 1HG2 VAL 120 1.258 -8.176 -6.912 903 HG23 VAL 120 2HG2 VAL 120 0.335 -9.517 -6.235 904 H ALA 121 H ALA 121 1.834 -7.807 -2.100 905 HA ALA 121 HA ALA 121 -0.678 -6.625 -2.179 906 HB1 ALA 121 1HB ALA 121 -0.191 -6.193 0.332 907 HB2 ALA 121 2HB ALA 121 -0.266 -7.852 -0.263 908 HB3 ALA 121 3HB ALA 121 1.298 -7.085 0.017 909 H MET 122 H MET 122 2.474 -5.167 -2.054 910 HA MET 122 HA MET 122 1.617 -2.594 -1.162 911 HB2 MET 122 1HB MET 122 3.954 -3.449 -0.961 912 HB3 MET 122 2HB MET 122 4.116 -3.305 -2.706 913 HG2 MET 122 1HG MET 122 5.082 -1.357 -1.983 914 HG3 MET 122 2HG MET 122 3.430 -0.837 -2.307 915 HE1 MET 122 3HE MET 122 3.662 1.212 -1.107 916 HE2 MET 122 1HE MET 122 2.142 0.677 -0.390 917 HE3 MET 122 2HE MET 122 3.399 1.379 0.630 918 H HIS 123 H HIS 123 2.899 -3.594 -4.340 919 HA HIS 123 HA HIS 123 2.142 -1.324 -5.743 920 HB2 HIS 123 1HB HIS 123 3.669 -2.925 -6.711 921 HB3 HIS 123 2HB HIS 123 2.429 -4.176 -6.706 922 HD2 HIS 123 2HD HIS 123 3.255 -0.871 -8.675 923 HE1 HIS 123 1HE HIS 123 0.515 -3.195 -10.931 924 HE2 HIS 123 2HE HIS 123 2.032 -1.184 -10.932 925 H LYS 124 H LYS 124 0.328 -4.302 -5.145 926 HA LYS 124 HA LYS 124 -1.893 -3.689 -6.765 927 HB2 LYS 124 1HB LYS 124 -1.392 -5.553 -4.483 928 HB3 LYS 124 2HB LYS 124 -3.049 -5.285 -5.008 929 HG2 LYS 124 1HG LYS 124 -0.828 -6.171 -6.835 930 HG3 LYS 124 2HG LYS 124 -1.949 -7.269 -6.025 931 HD2 LYS 124 1HD LYS 124 -3.822 -6.006 -7.123 932 HD3 LYS 124 2HD LYS 124 -2.601 -5.147 -8.065 933 HE2 LYS 124 1HE LYS 124 -1.826 -7.243 -9.013 934 HE3 LYS 124 2HE LYS 124 -2.971 -8.141 -8.018 935 HZ1 LYS 124 3HZ LYS 124 -4.091 -6.058 -9.713 936 HZ2 LYS 124 1HZ LYS 124 -4.690 -7.598 -9.348 937 HZ3 LYS 124 2HZ LYS 124 -3.478 -7.417 -10.513 938 H ALA 125 H ALA 125 -1.187 -3.026 -3.365 939 HA ALA 125 HA ALA 125 -3.726 -1.916 -2.749 940 HB1 ALA 125 1HB ALA 125 -2.330 -0.847 -0.830 941 HB2 ALA 125 2HB ALA 125 -2.575 -2.593 -0.868 942 HB3 ALA 125 3HB ALA 125 -1.049 -1.905 -1.424 943 H ALA 126 H ALA 126 -0.601 -0.463 -3.616 944 HA ALA 126 HA ALA 126 -1.230 2.211 -3.367 945 HB1 ALA 126 1HB ALA 126 0.851 2.400 -4.107 946 HB2 ALA 126 2HB ALA 126 0.846 0.691 -4.542 947 HB3 ALA 126 3HB ALA 126 0.341 1.902 -5.721 948 H LYS 127 H LYS 127 -2.110 -0.033 -5.911 949 HA LYS 127 HA LYS 127 -2.903 1.707 -7.914 950 HB2 LYS 127 1HB LYS 127 -3.884 -1.003 -7.070 951 HB3 LYS 127 2HB LYS 127 -4.652 -0.150 -8.402 952 HG2 LYS 127 1HG LYS 127 -2.274 0.055 -9.360 953 HG3 LYS 127 2HG LYS 127 -1.864 -1.218 -8.209 954 HD2 LYS 127 1HD LYS 127 -2.408 -2.467 -10.060 955 HD3 LYS 127 2HD LYS 127 -3.969 -2.397 -9.239 956 HE2 LYS 127 1HE LYS 127 -4.630 -1.799 -11.336 957 HE3 LYS 127 2HE LYS 127 -4.224 -0.205 -10.702 958 HZ1 LYS 127 3HZ LYS 127 -3.305 -0.682 -12.941 959 HZ2 LYS 127 1HZ LYS 127 -2.339 -1.889 -12.255 960 HZ3 LYS 127 2HZ LYS 127 -2.128 -0.275 -11.797 961 H LEU 128 H LEU 128 -4.280 1.216 -4.819 962 HA LEU 128 HA LEU 128 -6.901 2.215 -5.521 963 HB2 LEU 128 1HB LEU 128 -5.596 1.544 -2.894 964 HB3 LEU 128 2HB LEU 128 -7.232 2.185 -3.024 965 HG LEU 128 HG LEU 128 -6.518 -0.310 -4.502 966 HD11 LEU 128 1HD1 LEU 128 -5.899 -1.297 -2.595 967 HD12 LEU 128 2HD1 LEU 128 -7.612 -1.238 -2.179 968 HD13 LEU 128 3HD1 LEU 128 -6.520 0.019 -1.599 969 HD21 LEU 128 3HD2 LEU 128 -8.663 0.485 -5.005 970 HD22 LEU 128 1HD2 LEU 128 -8.993 0.917 -3.328 971 HD23 LEU 128 2HD2 LEU 128 -8.930 -0.780 -3.805 972 H LEU 129 H LEU 129 -4.166 3.365 -3.549 973 HA LEU 129 HA LEU 129 -5.295 5.943 -3.116 974 HB2 LEU 129 1HB LEU 129 -2.732 6.398 -2.605 975 HB3 LEU 129 2HB LEU 129 -3.782 5.531 -1.486 976 HG LEU 129 HG LEU 129 -2.231 3.952 -3.477 977 HD11 LEU 129 1HD1 LEU 129 -0.844 4.463 -0.941 978 HD12 LEU 129 2HD1 LEU 129 -0.872 5.821 -2.065 979 HD13 LEU 129 3HD1 LEU 129 -0.202 4.271 -2.572 980 HD21 LEU 129 3HD2 LEU 129 -2.261 3.068 -0.728 981 HD22 LEU 129 1HD2 LEU 129 -2.857 2.260 -2.178 982 HD23 LEU 129 2HD2 LEU 129 -3.892 3.398 -1.315 983 H TYR 130 H TYR 130 -3.495 4.514 -5.675 984 HA TYR 130 HA TYR 130 -2.356 6.877 -6.761 985 HB2 TYR 130 1HB TYR 130 -2.916 4.136 -7.866 986 HB3 TYR 130 2HB TYR 130 -2.286 5.419 -8.893 987 HD1 TYR 130 1HD TYR 130 -1.369 5.050 -5.346 988 HD2 TYR 130 2HD TYR 130 -0.196 4.344 -9.375 989 HE1 TYR 130 1HE TYR 130 0.912 4.533 -4.585 990 HE2 TYR 130 2HE TYR 130 2.088 3.823 -8.625 991 HH TYR 130 HH TYR 130 3.425 3.512 -6.874 992 H GLU 131 H GLU 131 -5.063 4.903 -7.997 993 HA GLU 131 HA GLU 131 -6.139 7.329 -9.262 994 HB2 GLU 131 1HB GLU 131 -6.860 4.460 -9.870 995 HB3 GLU 131 2HB GLU 131 -7.307 5.885 -10.797 996 HG2 GLU 131 1HG GLU 131 -4.760 6.221 -11.063 997 HG3 GLU 131 2HG GLU 131 -4.656 4.526 -10.590 998 H SER 132 H SER 132 -8.477 7.603 -9.281 999 HA SER 132 HA SER 132 -9.795 6.385 -6.945 1000 HB2 SER 132 1HB SER 132 -9.758 9.277 -7.803 1001 HB3 SER 132 2HB SER 132 -11.001 8.634 -6.729 1002 HG SER 132 HG SER 132 -9.506 8.270 -5.190 1003 H ARG 133 H ARG 133 -11.017 4.927 -8.078 1004 HA ARG 133 HA ARG 133 -12.274 5.193 -10.492 1005 HB2 ARG 133 1HB ARG 133 -13.771 3.439 -9.814 1006 HB3 ARG 133 2HB ARG 133 -12.194 3.123 -9.101 1007 HG2 ARG 133 1HG ARG 133 -14.178 4.632 -7.489 1008 HG3 ARG 133 2HG ARG 133 -14.420 2.898 -7.710 1009 HD2 ARG 133 1HD ARG 133 -13.129 2.868 -5.828 1010 HD3 ARG 133 2HD ARG 133 -11.864 2.816 -7.055 1011 HE ARG 133 HE ARG 133 -12.211 5.469 -6.602 1012 HH11 ARG 133 1HH1 ARG 133 -11.579 2.727 -4.553 1013 HH12 ARG 133 2HH1 ARG 133 -10.698 3.645 -3.376 1014 HH21 ARG 133 1HH2 ARG 133 -11.053 6.688 -5.061 1015 HH22 ARG 133 2HH2 ARG 133 -10.400 5.898 -3.666 1016 H ASP 134 H ASP 134 -14.728 5.299 -10.824 1017 HA ASP 134 HA ASP 134 -15.666 7.831 -10.553 1018 HB2 ASP 134 1HB ASP 134 -16.670 5.682 -11.730 1019 HB3 ASP 134 2HB ASP 134 -17.673 5.637 -10.283 1020 H GLN 135 H GLN 135 -15.694 8.994 -8.734 1021 HA GLN 135 HA GLN 135 -15.767 8.286 -6.146 1022 HB2 GLN 135 1HB GLN 135 -17.315 10.593 -7.339 1023 HB3 GLN 135 2HB GLN 135 -16.881 10.432 -5.642 1024 HG2 GLN 135 1HG GLN 135 -14.915 10.615 -7.913 1025 HG3 GLN 135 2HG GLN 135 -15.406 11.960 -6.884 1026 HE21 GLN 135 1HE2 GLN 135 -12.764 10.851 -7.276 1027 HE22 GLN 135 2HE2 GLN 135 -12.212 10.333 -5.723 1028 H SER 136 H SER 136 -16.995 6.890 -5.082 1029 HA SER 136 HA SER 136 -19.860 7.204 -5.029 1030 HB2 SER 136 1HB SER 136 -18.558 4.936 -6.467 1031 HB3 SER 136 2HB SER 136 -20.002 4.592 -5.516 1032 HG SER 136 HG SER 136 -20.038 6.786 -7.251 1033 H GLY 137 H GLY 137 -20.118 7.271 -2.891 1034 HA2 GLY 137 1HA GLY 137 -20.460 5.817 -0.943 1035 HA3 GLY 137 2HA GLY 137 -18.894 5.104 -1.298 1036 HA PRO 138 HA PRO 138 -18.068 9.550 0.457 1037 HB2 PRO 138 1HB PRO 138 -20.184 10.761 1.651 1038 HB3 PRO 138 2HB PRO 138 -19.798 10.970 -0.061 1039 HG2 PRO 138 1HG PRO 138 -21.826 9.179 1.218 1040 HG3 PRO 138 2HG PRO 138 -21.982 10.190 -0.231 1041 HD2 PRO 138 1HD PRO 138 -21.535 7.522 -0.357 1042 HD3 PRO 138 2HD PRO 138 -20.906 8.654 -1.571 1043 H SER 139 H SER 139 -16.942 9.231 2.261 1044 HA SER 139 HA SER 139 -18.339 8.193 4.636 1045 HB2 SER 139 1HB SER 139 -16.278 6.937 5.216 1046 HB3 SER 139 2HB SER 139 -16.995 6.386 3.702 1047 HG SER 139 HG SER 139 -14.726 8.044 4.056 1048 H SER 140 H SER 140 -18.540 10.247 5.527 1049 HA SER 140 HA SER 140 -16.013 11.596 6.217 1050 HB2 SER 140 1HB SER 140 -18.808 12.716 5.923 1051 HB3 SER 140 2HB SER 140 -17.442 13.634 6.557 1052 HG SER 140 HG SER 140 -16.403 13.367 4.568 1053 H GLY 141 H GLY 141 -15.477 10.673 8.140 1054 HA2 GLY 141 1HA GLY 141 -16.835 11.525 10.472 1055 HA3 GLY 141 2HA GLY 141 -17.212 9.838 10.153 Start of MODEL 8 1 H1 GLY 1 H GLY 1 -19.405 8.427 -6.305 2 HA2 GLY 1 1HA GLY 1 -16.976 7.672 -6.503 3 HA3 GLY 1 2HA GLY 1 -16.645 9.062 -5.479 4 H SER 2 H SER 2 -16.554 5.952 -5.260 5 HA SER 2 HA SER 2 -17.107 5.894 -2.451 6 HB2 SER 2 1HB SER 2 -19.382 5.541 -3.503 7 HB3 SER 2 2HB SER 2 -18.758 4.033 -4.170 8 HG SER 2 HG SER 2 -18.912 4.722 -1.419 9 H SER 3 H SER 3 -15.941 4.336 -1.437 10 HA SER 3 HA SER 3 -13.834 3.088 -2.783 11 HB2 SER 3 1HB SER 3 -15.047 2.498 -0.075 12 HB3 SER 3 2HB SER 3 -13.539 1.788 -0.653 13 HG SER 3 HG SER 3 -13.170 4.283 -1.051 14 H GLY 4 H GLY 4 -16.942 1.786 -1.672 15 HA2 GLY 4 1HA GLY 4 -17.615 0.112 -3.620 16 HA3 GLY 4 2HA GLY 4 -16.330 -0.809 -2.853 17 H SER 5 H SER 5 -19.265 -1.292 -3.119 18 HA SER 5 HA SER 5 -20.049 -1.314 -0.290 19 HB2 SER 5 1HB SER 5 -21.578 -1.434 -2.866 20 HB3 SER 5 2HB SER 5 -22.297 -2.097 -1.398 21 HG SER 5 HG SER 5 -21.367 0.210 -0.678 22 H SER 6 H SER 6 -20.172 -3.460 -3.136 23 HA SER 6 HA SER 6 -20.912 -5.815 -2.034 24 HB2 SER 6 1HB SER 6 -19.307 -6.917 -3.689 25 HB3 SER 6 2HB SER 6 -20.471 -5.778 -4.366 26 HG SER 6 HG SER 6 -18.605 -4.213 -3.965 27 H GLY 7 H GLY 7 -17.515 -4.723 -2.199 28 HA2 GLY 7 1HA GLY 7 -16.095 -4.864 -0.248 29 HA3 GLY 7 2HA GLY 7 -17.014 -6.273 0.259 30 H ALA 8 H ALA 8 -14.077 -5.684 -0.399 31 HA ALA 8 HA ALA 8 -13.688 -7.887 -2.317 32 HB1 ALA 8 1HB ALA 8 -12.430 -6.390 -3.393 33 HB2 ALA 8 2HB ALA 8 -12.387 -5.300 -2.006 34 HB3 ALA 8 3HB ALA 8 -11.247 -6.642 -2.109 35 H GLU 9 H GLU 9 -13.942 -9.450 -0.622 36 HA GLU 9 HA GLU 9 -12.673 -9.617 1.783 37 HB2 GLU 9 1HB GLU 9 -13.187 -11.813 -0.224 38 HB3 GLU 9 2HB GLU 9 -12.644 -12.115 1.420 39 HG2 GLU 9 1HG GLU 9 -14.651 -11.543 2.341 40 HG3 GLU 9 2HG GLU 9 -15.068 -10.446 1.026 41 H PHE 10 H PHE 10 -11.326 -10.643 -1.346 42 HA PHE 10 HA PHE 10 -8.924 -11.680 -0.613 43 HB2 PHE 10 1HB PHE 10 -9.773 -11.416 -2.957 44 HB3 PHE 10 2HB PHE 10 -9.262 -9.733 -2.900 45 HD1 PHE 10 1HD PHE 10 -6.764 -9.326 -2.303 46 HD2 PHE 10 2HD PHE 10 -8.315 -13.021 -3.738 47 HE1 PHE 10 1HE PHE 10 -4.509 -9.984 -3.036 48 HE2 PHE 10 2HE PHE 10 -6.063 -13.685 -4.472 49 HZ PHE 10 HZ PHE 10 -4.156 -12.166 -4.121 50 H TYR 11 H TYR 11 -9.503 -8.217 -1.230 51 HA TYR 11 HA TYR 11 -6.949 -7.352 -0.434 52 HB2 TYR 11 1HB TYR 11 -9.603 -6.013 -0.788 53 HB3 TYR 11 2HB TYR 11 -8.285 -5.126 -0.029 54 HD1 TYR 11 2HD TYR 11 -8.595 -7.423 -2.970 55 HD2 TYR 11 1HD TYR 11 -7.235 -3.680 -1.474 56 HE1 TYR 11 2HE TYR 11 -7.697 -6.868 -5.192 57 HE2 TYR 11 1HE TYR 11 -6.334 -3.114 -3.692 58 HH TYR 11 HH TYR 11 -7.176 -4.368 -6.393 59 H ASP 12 H ASP 12 -10.040 -7.222 1.340 60 HA ASP 12 HA ASP 12 -9.359 -6.154 3.703 61 HB2 ASP 12 1HB ASP 12 -11.093 -8.535 3.110 62 HB3 ASP 12 2HB ASP 12 -10.876 -7.977 4.766 63 H LYS 13 H LYS 13 -8.618 -9.478 2.728 64 HA LYS 13 HA LYS 13 -7.394 -10.237 5.167 65 HB2 LYS 13 1HB LYS 13 -7.523 -11.335 2.405 66 HB3 LYS 13 2HB LYS 13 -6.233 -11.921 3.446 67 HG2 LYS 13 1HG LYS 13 -7.865 -13.457 3.881 68 HG3 LYS 13 2HG LYS 13 -8.185 -12.276 5.154 69 HD2 LYS 13 1HD LYS 13 -9.553 -11.920 2.537 70 HD3 LYS 13 2HD LYS 13 -10.114 -13.215 3.597 71 HE2 LYS 13 1HE LYS 13 -9.706 -10.456 4.677 72 HE3 LYS 13 2HE LYS 13 -11.171 -10.843 3.777 73 HZ1 LYS 13 3HZ LYS 13 -10.644 -11.351 6.454 74 HZ2 LYS 13 1HZ LYS 13 -10.672 -12.857 5.684 75 HZ3 LYS 13 2HZ LYS 13 -12.003 -11.821 5.563 76 H GLN 14 H GLN 14 -6.018 -9.197 2.050 77 HA GLN 14 HA GLN 14 -3.343 -9.344 2.608 78 HB2 GLN 14 1HB GLN 14 -4.803 -7.200 1.059 79 HB3 GLN 14 2HB GLN 14 -3.059 -7.426 1.031 80 HG2 GLN 14 1HG GLN 14 -5.159 -9.345 0.057 81 HG3 GLN 14 2HG GLN 14 -4.000 -8.439 -0.915 82 HE21 GLN 14 1HE2 GLN 14 -4.547 -11.369 -0.498 83 HE22 GLN 14 2HE2 GLN 14 -3.000 -12.046 -0.134 84 H LEU 15 H LEU 15 -5.666 -7.124 3.903 85 HA LEU 15 HA LEU 15 -4.153 -4.982 4.709 86 HB2 LEU 15 1HB LEU 15 -6.299 -6.370 6.308 87 HB3 LEU 15 2HB LEU 15 -5.720 -4.726 6.573 88 HG LEU 15 HG LEU 15 -7.226 -5.727 4.156 89 HD11 LEU 15 1HD1 LEU 15 -8.653 -3.682 5.258 90 HD12 LEU 15 2HD1 LEU 15 -8.015 -4.494 6.688 91 HD13 LEU 15 3HD1 LEU 15 -8.972 -5.398 5.514 92 HD21 LEU 15 3HD2 LEU 15 -6.264 -2.942 4.804 93 HD22 LEU 15 1HD2 LEU 15 -7.207 -3.429 3.395 94 HD23 LEU 15 2HD2 LEU 15 -5.553 -4.009 3.592 95 H LYS 16 H LYS 16 -4.927 -7.664 6.925 96 HA LYS 16 HA LYS 16 -3.064 -7.081 8.872 97 HB2 LYS 16 1HB LYS 16 -3.356 -9.310 9.678 98 HB3 LYS 16 2HB LYS 16 -4.897 -8.796 9.004 99 HG2 LYS 16 1HG LYS 16 -4.570 -10.113 7.048 100 HG3 LYS 16 2HG LYS 16 -2.900 -10.465 7.497 101 HD2 LYS 16 1HD LYS 16 -3.909 -12.396 8.195 102 HD3 LYS 16 2HD LYS 16 -4.057 -11.432 9.666 103 HE2 LYS 16 1HE LYS 16 -6.220 -11.350 7.606 104 HE3 LYS 16 2HE LYS 16 -6.126 -12.711 8.722 105 HZ1 LYS 16 3HZ LYS 16 -7.406 -11.348 9.962 106 HZ2 LYS 16 1HZ LYS 16 -6.829 -9.933 9.236 107 HZ3 LYS 16 2HZ LYS 16 -5.912 -10.706 10.429 108 H VAL 17 H VAL 17 -2.638 -8.883 5.879 109 HA VAL 17 HA VAL 17 -0.098 -9.952 6.375 110 HB VAL 17 HB VAL 17 -1.353 -9.105 3.763 111 HG11 VAL 17 1HG1 VAL 17 0.625 -11.162 3.498 112 HG12 VAL 17 2HG1 VAL 17 0.535 -9.592 2.699 113 HG13 VAL 17 3HG1 VAL 17 1.337 -9.742 4.263 114 HG21 VAL 17 3HG2 VAL 17 -2.133 -11.096 5.434 115 HG22 VAL 17 1HG2 VAL 17 -2.360 -11.115 3.685 116 HG23 VAL 17 2HG2 VAL 17 -0.982 -11.948 4.405 117 H LEU 18 H LEU 18 -1.010 -6.913 4.759 118 HA LEU 18 HA LEU 18 1.614 -6.022 4.276 119 HB2 LEU 18 1HB LEU 18 -1.063 -4.715 4.414 120 HB3 LEU 18 2HB LEU 18 0.381 -3.708 4.335 121 HG LEU 18 HG LEU 18 -0.324 -5.810 2.291 122 HD11 LEU 18 1HD1 LEU 18 -2.019 -4.065 2.300 123 HD12 LEU 18 2HD1 LEU 18 -1.006 -3.947 0.862 124 HD13 LEU 18 3HD1 LEU 18 -0.765 -2.828 2.203 125 HD21 LEU 18 3HD2 LEU 18 1.322 -3.805 1.237 126 HD22 LEU 18 1HD2 LEU 18 1.758 -5.476 1.597 127 HD23 LEU 18 2HD2 LEU 18 2.013 -4.219 2.807 128 H LEU 19 H LEU 19 -0.679 -5.028 6.823 129 HA LEU 19 HA LEU 19 1.013 -3.359 8.244 130 HB2 LEU 19 1HB LEU 19 -1.141 -5.166 9.332 131 HB3 LEU 19 2HB LEU 19 -0.430 -3.795 10.181 132 HG LEU 19 HG LEU 19 -1.995 -3.572 7.612 133 HD11 LEU 19 1HD1 LEU 19 -3.160 -4.375 9.832 134 HD12 LEU 19 2HD1 LEU 19 -3.914 -3.173 8.784 135 HD13 LEU 19 3HD1 LEU 19 -3.055 -2.661 10.237 136 HD21 LEU 19 3HD2 LEU 19 -1.428 -1.379 9.570 137 HD22 LEU 19 1HD2 LEU 19 -1.861 -1.271 7.863 138 HD23 LEU 19 2HD2 LEU 19 -0.247 -1.807 8.331 139 H SER 20 H SER 20 0.400 -6.823 8.820 140 HA SER 20 HA SER 20 1.884 -7.424 10.951 141 HB2 SER 20 1HB SER 20 0.778 -9.102 9.486 142 HB3 SER 20 2HB SER 20 2.118 -8.955 8.349 143 HG SER 20 HG SER 20 3.332 -10.123 9.623 144 H GLY 21 H GLY 21 3.270 -6.876 7.722 145 HA2 GLY 21 1HA GLY 21 5.322 -5.841 7.266 146 HA3 GLY 21 2HA GLY 21 5.742 -5.974 8.967 147 H ALA 22 H ALA 22 6.883 -6.845 6.169 148 HA ALA 22 HA ALA 22 7.683 -9.538 7.066 149 HB1 ALA 22 1HB ALA 22 7.148 -8.520 4.290 150 HB2 ALA 22 2HB ALA 22 8.073 -9.990 4.598 151 HB3 ALA 22 3HB ALA 22 6.395 -9.878 5.126 152 H THR 23 H THR 23 9.838 -10.223 6.274 153 HA THR 23 HA THR 23 11.742 -8.068 6.667 154 HB THR 23 HB THR 23 12.349 -10.997 6.249 155 HG1 THR 23 1HG THR 23 10.966 -10.017 8.207 156 HG21 THR 23 3HG2 THR 23 13.959 -8.657 6.636 157 HG22 THR 23 1HG2 THR 23 14.469 -10.326 6.383 158 HG23 THR 23 2HG2 THR 23 14.151 -9.739 8.015 159 H PHE 24 H PHE 24 13.388 -7.508 5.234 160 HA PHE 24 HA PHE 24 13.564 -8.744 2.636 161 HB2 PHE 24 1HB PHE 24 12.672 -5.860 2.822 162 HB3 PHE 24 2HB PHE 24 12.993 -6.762 1.345 163 HD1 PHE 24 2HD PHE 24 11.466 -8.554 0.633 164 HD2 PHE 24 1HD PHE 24 10.615 -6.084 3.993 165 HE1 PHE 24 2HE PHE 24 9.113 -9.269 0.559 166 HE2 PHE 24 1HE PHE 24 8.261 -6.796 3.925 167 HZ PHE 24 HZ PHE 24 7.507 -8.389 2.206 168 H LEU 25 H LEU 25 15.403 -8.086 1.452 169 HA LEU 25 HA LEU 25 17.493 -6.961 3.130 170 HB2 LEU 25 1HB LEU 25 17.412 -8.493 0.574 171 HB3 LEU 25 2HB LEU 25 18.843 -7.536 0.952 172 HG LEU 25 HG LEU 25 17.732 -9.731 2.700 173 HD11 LEU 25 1HD1 LEU 25 18.677 -10.400 0.424 174 HD12 LEU 25 2HD1 LEU 25 19.364 -11.175 1.851 175 HD13 LEU 25 3HD1 LEU 25 20.236 -9.867 1.053 176 HD21 LEU 25 3HD2 LEU 25 19.101 -8.944 4.257 177 HD22 LEU 25 1HD2 LEU 25 19.600 -7.637 3.182 178 HD23 LEU 25 2HD2 LEU 25 20.467 -9.173 3.164 179 H VAL 26 H VAL 26 17.588 -4.807 3.180 180 HA VAL 26 HA VAL 26 17.009 -3.266 0.765 181 HB VAL 26 HB VAL 26 17.524 -2.324 3.590 182 HG11 VAL 26 1HG1 VAL 26 16.926 -0.882 1.038 183 HG12 VAL 26 2HG1 VAL 26 16.408 -0.212 2.586 184 HG13 VAL 26 3HG1 VAL 26 18.120 -0.507 2.281 185 HG21 VAL 26 3HG2 VAL 26 14.927 -1.693 2.880 186 HG22 VAL 26 1HG2 VAL 26 15.158 -3.318 2.235 187 HG23 VAL 26 2HG2 VAL 26 15.429 -3.003 3.949 188 H THR 27 H THR 27 18.591 -2.627 -0.527 189 HA THR 27 HA THR 27 21.333 -2.525 0.530 190 HB THR 27 HB THR 27 20.560 -2.555 -2.386 191 HG1 THR 27 1HG THR 27 20.045 -4.579 -2.085 192 HG21 THR 27 3HG2 THR 27 23.006 -2.227 -1.011 193 HG22 THR 27 1HG2 THR 27 22.754 -2.411 -2.746 194 HG23 THR 27 2HG2 THR 27 23.038 -3.832 -1.741 195 H PHE 28 H PHE 28 21.477 -0.471 1.345 196 HA PHE 28 HA PHE 28 20.477 1.826 -0.016 197 HB2 PHE 28 1HB PHE 28 22.502 1.634 2.225 198 HB3 PHE 28 2HB PHE 28 21.691 3.106 1.701 199 HD1 PHE 28 2HD PHE 28 19.260 3.372 2.066 200 HD2 PHE 28 1HD PHE 28 21.433 0.072 3.649 201 HE1 PHE 28 2HE PHE 28 17.418 2.913 3.630 202 HE2 PHE 28 1HE PHE 28 19.593 -0.393 5.215 203 HZ PHE 28 HZ PHE 28 17.583 1.029 5.208 204 H GLY 29 H GLY 29 21.463 3.205 -1.397 205 HA2 GLY 29 1HA GLY 29 23.352 2.566 -3.168 206 HA3 GLY 29 2HA GLY 29 23.200 4.214 -2.576 207 H ASN 30 H ASN 30 24.058 3.704 0.098 208 HA ASN 30 HA ASN 30 26.911 3.670 -0.373 209 HB2 ASN 30 1HB ASN 30 25.704 5.297 1.171 210 HB3 ASN 30 2HB ASN 30 25.523 3.951 2.292 211 HD21 ASN 30 1HD2 ASN 30 27.536 6.420 1.183 212 HD22 ASN 30 2HD2 ASN 30 28.957 5.997 2.070 213 H SER 31 H SER 31 24.521 1.733 1.367 214 HA SER 31 HA SER 31 26.456 -0.089 2.434 215 HB2 SER 31 1HB SER 31 23.461 -0.439 2.161 216 HB3 SER 31 2HB SER 31 24.533 -1.380 3.198 217 HG SER 31 HG SER 31 24.997 0.571 4.325 218 H GLU 32 H GLU 32 27.603 -0.658 0.500 219 HA GLU 32 HA GLU 32 26.618 -1.724 -1.821 220 HB2 GLU 32 1HB GLU 32 28.739 -2.942 -2.033 221 HB3 GLU 32 2HB GLU 32 28.992 -1.297 -1.468 222 HG2 GLU 32 1HG GLU 32 29.405 -2.030 0.749 223 HG3 GLU 32 2HG GLU 32 28.873 -3.668 0.373 224 H LYS 33 H LYS 33 26.870 -3.257 1.315 225 HA LYS 33 HA LYS 33 25.856 -5.775 0.197 226 HB2 LYS 33 1HB LYS 33 27.653 -6.348 1.529 227 HB3 LYS 33 2HB LYS 33 27.352 -5.052 2.678 228 HG2 LYS 33 1HG LYS 33 25.595 -6.247 3.712 229 HG3 LYS 33 2HG LYS 33 25.546 -7.438 2.410 230 HD2 LYS 33 1HD LYS 33 27.991 -7.035 4.112 231 HD3 LYS 33 2HD LYS 33 26.688 -8.127 4.589 232 HE2 LYS 33 1HE LYS 33 27.918 -8.339 1.869 233 HE3 LYS 33 2HE LYS 33 28.725 -9.051 3.265 234 HZ1 LYS 33 3HZ LYS 33 26.756 -10.213 1.776 235 HZ2 LYS 33 1HZ LYS 33 25.947 -9.708 3.173 236 HZ3 LYS 33 2HZ LYS 33 27.289 -10.729 3.296 237 HA PRO 34 HA PRO 34 21.806 -4.830 1.688 238 HB2 PRO 34 1HB PRO 34 20.765 -7.332 1.528 239 HB3 PRO 34 2HB PRO 34 21.053 -6.319 0.108 240 HG2 PRO 34 1HG PRO 34 22.721 -8.542 1.219 241 HG3 PRO 34 2HG PRO 34 22.305 -8.191 -0.469 242 HD2 PRO 34 1HD PRO 34 24.698 -7.527 0.610 243 HD3 PRO 34 2HD PRO 34 23.921 -6.559 -0.659 244 H GLU 35 H GLU 35 20.503 -5.123 3.521 245 HA GLU 35 HA GLU 35 21.595 -6.849 5.636 246 HB2 GLU 35 1HB GLU 35 22.392 -4.647 6.165 247 HB3 GLU 35 2HB GLU 35 20.804 -3.946 5.884 248 HG2 GLU 35 1HG GLU 35 19.935 -4.805 7.859 249 HG3 GLU 35 2HG GLU 35 21.214 -6.009 8.010 250 H THR 36 H THR 36 20.082 -7.541 7.215 251 HA THR 36 HA THR 36 17.463 -7.993 6.157 252 HB THR 36 HB THR 36 18.524 -8.634 8.915 253 HG1 THR 36 1HG THR 36 19.751 -9.770 7.469 254 HG21 THR 36 3HG2 THR 36 16.519 -10.421 7.869 255 HG22 THR 36 1HG2 THR 36 15.915 -8.765 7.907 256 HG23 THR 36 2HG2 THR 36 16.528 -9.514 9.381 257 H MET 37 H MET 37 16.066 -6.337 6.113 258 HA MET 37 HA MET 37 15.661 -4.829 8.612 259 HB2 MET 37 1HB MET 37 15.504 -3.837 5.764 260 HB3 MET 37 2HB MET 37 14.917 -2.924 7.147 261 HG2 MET 37 1HG MET 37 17.330 -3.280 8.055 262 HG3 MET 37 2HG MET 37 17.714 -3.583 6.362 263 HE1 MET 37 3HE MET 37 16.874 -0.473 8.952 264 HE2 MET 37 1HE MET 37 15.664 0.209 7.865 265 HE3 MET 37 2HE MET 37 15.478 -1.438 8.467 266 H THR 38 H THR 38 13.441 -3.842 8.741 267 HA THR 38 HA THR 38 11.466 -5.783 7.741 268 HB THR 38 HB THR 38 11.270 -3.969 10.155 269 HG1 THR 38 1HG THR 38 12.740 -5.825 10.287 270 HG21 THR 38 3HG2 THR 38 9.330 -5.660 8.727 271 HG22 THR 38 1HG2 THR 38 9.063 -4.286 9.800 272 HG23 THR 38 2HG2 THR 38 9.374 -5.886 10.475 273 H CYS 39 H CYS 39 9.699 -5.110 6.628 274 HA CYS 39 HA CYS 39 9.381 -2.212 6.215 275 HB2 CYS 39 1HB CYS 39 9.235 -4.419 4.156 276 HB3 CYS 39 2HB CYS 39 8.669 -2.779 3.864 277 HG CYS 39 HG CYS 39 11.738 -4.003 3.713 278 H ARG 40 H ARG 40 7.475 -1.538 6.915 279 HA ARG 40 HA ARG 40 5.112 -3.210 6.470 280 HB2 ARG 40 1HB ARG 40 4.333 -3.030 8.697 281 HB3 ARG 40 2HB ARG 40 6.016 -3.522 8.821 282 HG2 ARG 40 1HG ARG 40 6.606 -1.124 9.201 283 HG3 ARG 40 2HG ARG 40 4.878 -0.778 9.281 284 HD2 ARG 40 1HD ARG 40 4.620 -2.215 11.185 285 HD3 ARG 40 2HD ARG 40 6.284 -2.778 11.042 286 HE ARG 40 HE ARG 40 6.563 -0.108 11.368 287 HH11 ARG 40 1HH1 ARG 40 4.835 -2.565 13.129 288 HH12 ARG 40 2HH1 ARG 40 4.987 -1.762 14.656 289 HH21 ARG 40 1HH2 ARG 40 6.770 0.959 13.374 290 HH22 ARG 40 2HH2 ARG 40 6.087 0.243 14.794 291 H LEU 41 H LEU 41 3.068 -1.943 6.932 292 HA LEU 41 HA LEU 41 3.416 0.778 5.886 293 HB2 LEU 41 1HB LEU 41 1.280 -1.279 5.671 294 HB3 LEU 41 2HB LEU 41 0.810 0.417 5.597 295 HG LEU 41 HG LEU 41 2.966 -0.597 3.792 296 HD11 LEU 41 1HD1 LEU 41 1.305 -2.218 3.373 297 HD12 LEU 41 2HD1 LEU 41 1.130 -1.006 2.105 298 HD13 LEU 41 3HD1 LEU 41 0.009 -1.026 3.466 299 HD21 LEU 41 3HD2 LEU 41 0.958 1.632 3.781 300 HD22 LEU 41 1HD2 LEU 41 1.788 1.126 2.310 301 HD23 LEU 41 2HD2 LEU 41 2.717 1.724 3.685 302 H SER 42 H SER 42 1.728 2.376 6.618 303 HA SER 42 HA SER 42 1.724 2.428 9.508 304 HB2 SER 42 1HB SER 42 2.221 4.428 8.003 305 HB3 SER 42 2HB SER 42 0.490 4.483 7.672 306 HG SER 42 HG SER 42 1.867 4.986 10.067 307 H ASN 43 H ASN 43 -0.411 3.494 10.454 308 HA ASN 43 HA ASN 43 -2.328 1.589 10.702 309 HB2 ASN 43 1HB ASN 43 -3.912 3.495 11.294 310 HB3 ASN 43 2HB ASN 43 -2.398 3.434 12.191 311 HD21 ASN 43 1HD2 ASN 43 -0.805 4.971 11.781 312 HD22 ASN 43 2HD2 ASN 43 -1.154 6.449 10.956 313 H ASN 44 H ASN 44 -2.711 4.441 8.587 314 HA ASN 44 HA ASN 44 -4.778 3.007 7.097 315 HB2 ASN 44 1HB ASN 44 -3.912 5.905 7.007 316 HB3 ASN 44 2HB ASN 44 -5.214 5.217 6.042 317 HD21 ASN 44 1HD2 ASN 44 -5.820 7.295 7.587 318 HD22 ASN 44 2HD2 ASN 44 -6.749 6.806 8.960 319 H GLN 45 H GLN 45 -1.822 2.498 6.914 320 HA GLN 45 HA GLN 45 -0.191 2.183 5.344 321 HB2 GLN 45 1HB GLN 45 -2.586 1.810 3.539 322 HB3 GLN 45 2HB GLN 45 -0.968 1.173 3.273 323 HG2 GLN 45 1HG GLN 45 -1.192 -0.212 5.280 324 HG3 GLN 45 2HG GLN 45 -2.823 0.412 5.518 325 HE21 GLN 45 1HE2 GLN 45 -3.916 -1.471 5.274 326 HE22 GLN 45 2HE2 GLN 45 -3.974 -2.368 3.799 327 H ARG 46 H ARG 46 -0.657 4.878 5.751 328 HA ARG 46 HA ARG 46 -0.723 6.089 3.087 329 HB2 ARG 46 1HB ARG 46 -1.034 7.145 5.874 330 HB3 ARG 46 2HB ARG 46 -0.570 8.238 4.576 331 HG2 ARG 46 1HG ARG 46 -2.593 7.593 3.337 332 HG3 ARG 46 2HG ARG 46 -3.063 6.554 4.683 333 HD2 ARG 46 1HD ARG 46 -2.618 9.531 4.865 334 HD3 ARG 46 2HD ARG 46 -4.193 8.754 4.711 335 HE ARG 46 HE ARG 46 -2.831 7.674 6.923 336 HH11 ARG 46 1HH1 ARG 46 -4.391 10.609 5.888 337 HH12 ARG 46 2HH1 ARG 46 -4.835 11.093 7.491 338 HH21 ARG 46 1HH2 ARG 46 -3.410 8.300 9.038 339 HH22 ARG 46 2HH2 ARG 46 -4.275 9.779 9.283 340 H TYR 47 H TYR 47 1.431 5.321 5.686 341 HA TYR 47 HA TYR 47 3.645 6.497 4.149 342 HB2 TYR 47 1HB TYR 47 3.350 6.601 7.159 343 HB3 TYR 47 2HB TYR 47 4.741 7.172 6.244 344 HD1 TYR 47 1HD TYR 47 4.548 9.183 4.821 345 HD2 TYR 47 2HD TYR 47 1.351 7.908 7.323 346 HE1 TYR 47 1HE TYR 47 3.499 11.396 4.598 347 HE2 TYR 47 2HE TYR 47 0.293 10.118 7.106 348 HH TYR 47 HH TYR 47 0.322 12.071 5.982 349 H LEU 48 H LEU 48 5.701 5.471 4.471 350 HA LEU 48 HA LEU 48 5.442 2.683 5.387 351 HB2 LEU 48 1HB LEU 48 6.909 3.940 3.116 352 HB3 LEU 48 2HB LEU 48 7.555 2.470 3.842 353 HG LEU 48 HG LEU 48 4.763 2.679 2.728 354 HD11 LEU 48 1HD1 LEU 48 7.263 2.561 1.330 355 HD12 LEU 48 2HD1 LEU 48 5.623 2.626 0.686 356 HD13 LEU 48 3HD1 LEU 48 6.356 1.070 1.076 357 HD21 LEU 48 3HD2 LEU 48 6.270 0.138 2.946 358 HD22 LEU 48 1HD2 LEU 48 4.549 0.461 3.155 359 HD23 LEU 48 2HD2 LEU 48 5.683 0.860 4.445 360 H PHE 49 H PHE 49 6.987 1.812 6.717 361 HA PHE 49 HA PHE 49 9.174 3.574 7.582 362 HB2 PHE 49 1HB PHE 49 7.326 2.009 9.395 363 HB3 PHE 49 2HB PHE 49 8.782 2.844 9.926 364 HD1 PHE 49 1HD PHE 49 8.873 5.278 9.975 365 HD2 PHE 49 2HD PHE 49 5.324 3.212 8.855 366 HE1 PHE 49 1HE PHE 49 7.575 7.344 10.290 367 HE2 PHE 49 2HE PHE 49 4.021 5.275 9.167 368 HZ PHE 49 HZ PHE 49 5.146 7.345 9.885 369 H LEU 50 H LEU 50 11.039 2.523 8.345 370 HA LEU 50 HA LEU 50 11.142 -0.370 7.797 371 HB2 LEU 50 1HB LEU 50 13.404 1.564 7.352 372 HB3 LEU 50 2HB LEU 50 13.330 -0.133 6.880 373 HG LEU 50 HG LEU 50 11.414 1.857 5.719 374 HD11 LEU 50 1HD1 LEU 50 13.188 2.988 4.931 375 HD12 LEU 50 2HD1 LEU 50 13.299 1.643 3.796 376 HD13 LEU 50 3HD1 LEU 50 14.308 1.662 5.242 377 HD21 LEU 50 3HD2 LEU 50 10.753 -0.239 5.070 378 HD22 LEU 50 1HD2 LEU 50 12.394 -0.886 5.093 379 HD23 LEU 50 2HD2 LEU 50 11.875 0.158 3.768 380 H ASP 51 H ASP 51 12.847 -1.531 8.951 381 HA ASP 51 HA ASP 51 13.814 -0.213 11.379 382 HB2 ASP 51 1HB ASP 51 12.415 -2.893 11.443 383 HB3 ASP 51 2HB ASP 51 13.033 -1.984 12.820 384 H GLY 52 H GLY 52 15.937 -0.504 11.441 385 HA2 GLY 52 1HA GLY 52 17.153 -3.056 11.372 386 HA3 GLY 52 2HA GLY 52 17.378 -2.259 9.822 387 H ASP 53 H ASP 53 19.320 -1.376 9.680 388 HA ASP 53 HA ASP 53 21.154 -0.978 11.659 389 HB2 ASP 53 1HB ASP 53 22.049 -0.737 9.542 390 HB3 ASP 53 2HB ASP 53 20.740 0.306 8.993 391 H SER 54 H SER 54 18.785 1.389 10.482 392 HA SER 54 HA SER 54 18.823 2.711 13.062 393 HB2 SER 54 1HB SER 54 19.932 3.941 10.575 394 HB3 SER 54 2HB SER 54 19.032 4.970 11.688 395 HG SER 54 HG SER 54 20.941 3.302 12.816 396 H HIS 55 H HIS 55 17.171 4.508 13.122 397 HA HIS 55 HA HIS 55 14.680 3.537 12.271 398 HB2 HIS 55 1HB HIS 55 15.570 6.209 13.341 399 HB3 HIS 55 2HB HIS 55 13.891 5.894 12.912 400 HD2 HIS 55 2HD HIS 55 15.604 6.094 16.042 401 HE1 HIS 55 1HE HIS 55 13.320 2.550 16.514 402 HE2 HIS 55 2HE HIS 55 14.580 4.386 17.692 403 H TYR 56 H TYR 56 14.274 3.300 10.150 404 HA TYR 56 HA TYR 56 14.736 5.619 8.394 405 HB2 TYR 56 1HB TYR 56 14.961 2.684 7.962 406 HB3 TYR 56 2HB TYR 56 14.376 3.655 6.615 407 HD1 TYR 56 1HD TYR 56 15.864 5.944 6.358 408 HD2 TYR 56 2HD TYR 56 17.211 2.222 7.918 409 HE1 TYR 56 1HE TYR 56 18.179 6.548 5.784 410 HE2 TYR 56 2HE TYR 56 19.529 2.816 7.350 411 HH TYR 56 HH TYR 56 20.301 5.910 5.780 412 H GLU 57 H GLU 57 13.123 6.206 6.901 413 HA GLU 57 HA GLU 57 10.562 4.879 6.933 414 HB2 GLU 57 1HB GLU 57 9.297 6.838 7.712 415 HB3 GLU 57 2HB GLU 57 10.373 6.220 8.957 416 HG2 GLU 57 1HG GLU 57 12.020 8.005 8.148 417 HG3 GLU 57 2HG GLU 57 10.632 8.715 7.325 418 H ILE 58 H ILE 58 9.913 4.907 4.895 419 HA ILE 58 HA ILE 58 10.769 7.120 3.162 420 HB ILE 58 HB ILE 58 9.812 4.349 2.437 421 HG12 ILE 58 1HG1 ILE 58 12.522 5.528 1.877 422 HG13 ILE 58 2HG1 ILE 58 12.175 4.754 3.420 423 HG21 ILE 58 1HG2 ILE 58 11.067 5.894 0.327 424 HG22 ILE 58 2HG2 ILE 58 9.557 4.985 0.317 425 HG23 ILE 58 3HG2 ILE 58 9.583 6.644 0.916 426 HD11 ILE 58 3HD1 ILE 58 12.157 3.520 0.685 427 HD12 ILE 58 1HD1 ILE 58 13.195 3.128 2.055 428 HD13 ILE 58 2HD1 ILE 58 11.479 2.724 2.105 429 H GLU 59 H GLU 59 9.226 8.664 3.342 430 HA GLU 59 HA GLU 59 6.461 8.164 3.625 431 HB2 GLU 59 1HB GLU 59 8.082 10.581 2.892 432 HB3 GLU 59 2HB GLU 59 6.327 10.628 2.802 433 HG2 GLU 59 1HG GLU 59 6.626 11.411 4.911 434 HG3 GLU 59 2HG GLU 59 6.509 9.685 5.251 435 H ILE 60 H ILE 60 5.186 7.267 2.158 436 HA ILE 60 HA ILE 60 5.735 6.737 -0.473 437 HB ILE 60 HB ILE 60 3.005 7.312 0.686 438 HG12 ILE 60 1HG1 ILE 60 4.403 4.656 0.326 439 HG13 ILE 60 2HG1 ILE 60 4.372 5.545 1.845 440 HG21 ILE 60 1HG2 ILE 60 2.066 6.173 -1.149 441 HG22 ILE 60 2HG2 ILE 60 3.236 7.296 -1.839 442 HG23 ILE 60 3HG2 ILE 60 3.638 5.586 -1.691 443 HD11 ILE 60 3HD1 ILE 60 1.967 5.350 1.944 444 HD12 ILE 60 1HD1 ILE 60 1.945 4.544 0.376 445 HD13 ILE 60 2HD1 ILE 60 2.702 3.757 1.762 446 H VAL 61 H VAL 61 4.299 9.656 0.885 447 HA VAL 61 HA VAL 61 3.402 10.936 -1.381 448 HB VAL 61 HB VAL 61 3.732 13.041 -0.237 449 HG11 VAL 61 1HG1 VAL 61 2.340 10.845 0.801 450 HG12 VAL 61 2HG1 VAL 61 3.098 11.632 2.187 451 HG13 VAL 61 3HG1 VAL 61 2.040 12.554 1.117 452 HG21 VAL 61 3HG2 VAL 61 4.900 12.524 2.187 453 HG22 VAL 61 1HG2 VAL 61 5.877 11.559 1.080 454 HG23 VAL 61 2HG2 VAL 61 5.695 13.293 0.813 455 H HIS 62 H HIS 62 6.689 10.470 -0.288 456 HA HIS 62 HA HIS 62 7.805 12.305 -2.219 457 HB2 HIS 62 1HB HIS 62 8.884 10.527 -0.084 458 HB3 HIS 62 2HB HIS 62 9.969 10.994 -1.391 459 HD2 HIS 62 2HD HIS 62 9.551 12.160 1.964 460 HE1 HIS 62 1HE HIS 62 9.753 15.795 -0.215 461 HE2 HIS 62 2HE HIS 62 9.985 14.709 2.046 462 H ILE 63 H ILE 63 7.520 8.803 -1.823 463 HA ILE 63 HA ILE 63 9.091 7.892 -3.882 464 HB ILE 63 HB ILE 63 6.376 6.798 -3.136 465 HG12 ILE 63 1HG1 ILE 63 9.110 6.060 -2.069 466 HG13 ILE 63 2HG1 ILE 63 7.936 7.054 -1.213 467 HG21 ILE 63 1HG2 ILE 63 7.986 6.075 -5.242 468 HG22 ILE 63 2HG2 ILE 63 8.439 4.927 -3.983 469 HG23 ILE 63 3HG2 ILE 63 6.755 5.062 -4.488 470 HD11 ILE 63 3HD1 ILE 63 8.084 4.161 -1.514 471 HD12 ILE 63 1HD1 ILE 63 7.294 5.139 -0.278 472 HD13 ILE 63 2HD1 ILE 63 6.478 4.826 -1.810 473 H SER 64 H SER 64 9.073 8.040 -6.029 474 HA SER 64 HA SER 64 6.754 9.298 -7.310 475 HB2 SER 64 1HB SER 64 8.875 10.448 -7.662 476 HB3 SER 64 2HB SER 64 9.603 8.965 -8.280 477 HG SER 64 HG SER 64 8.440 9.130 -10.102 478 H THR 65 H THR 65 9.128 6.722 -7.973 479 HA THR 65 HA THR 65 7.149 5.433 -9.721 480 HB THR 65 HB THR 65 10.117 4.896 -9.489 481 HG1 THR 65 1HG THR 65 9.726 6.892 -10.482 482 HG21 THR 65 3HG2 THR 65 7.912 3.638 -11.042 483 HG22 THR 65 1HG2 THR 65 9.348 2.907 -10.327 484 HG23 THR 65 2HG2 THR 65 9.480 3.824 -11.828 485 H VAL 66 H VAL 66 6.598 3.266 -9.469 486 HA VAL 66 HA VAL 66 7.654 1.806 -7.177 487 HB VAL 66 HB VAL 66 4.723 2.468 -7.480 488 HG11 VAL 66 1HG1 VAL 66 6.137 0.376 -5.883 489 HG12 VAL 66 2HG1 VAL 66 4.662 1.115 -5.256 490 HG13 VAL 66 3HG1 VAL 66 4.636 0.263 -6.801 491 HG21 VAL 66 3HG2 VAL 66 6.564 2.977 -5.150 492 HG22 VAL 66 1HG2 VAL 66 6.214 4.170 -6.400 493 HG23 VAL 66 2HG2 VAL 66 4.917 3.565 -5.370 494 H GLN 67 H GLN 67 8.362 0.055 -8.240 495 HA GLN 67 HA GLN 67 6.390 -1.493 -9.762 496 HB2 GLN 67 1HB GLN 67 8.056 -2.036 -11.469 497 HB3 GLN 67 2HB GLN 67 7.764 -0.304 -11.402 498 HG2 GLN 67 1HG GLN 67 9.820 -0.206 -9.884 499 HG3 GLN 67 2HG GLN 67 10.156 -1.838 -10.461 500 HE21 GLN 67 1HE2 GLN 67 12.130 -0.613 -11.167 501 HE22 GLN 67 2HE2 GLN 67 12.093 0.088 -12.745 502 H ILE 68 H ILE 68 6.996 -3.776 -10.009 503 HA ILE 68 HA ILE 68 8.449 -4.703 -7.633 504 HB ILE 68 HB ILE 68 6.477 -6.166 -9.392 505 HG12 ILE 68 1HG1 ILE 68 6.203 -5.245 -6.525 506 HG13 ILE 68 2HG1 ILE 68 5.544 -4.378 -7.907 507 HG21 ILE 68 1HG2 ILE 68 7.411 -8.024 -8.597 508 HG22 ILE 68 2HG2 ILE 68 8.424 -7.117 -7.475 509 HG23 ILE 68 3HG2 ILE 68 6.781 -7.562 -7.016 510 HD11 ILE 68 3HD1 ILE 68 3.757 -5.683 -7.968 511 HD12 ILE 68 1HD1 ILE 68 4.737 -7.148 -7.916 512 HD13 ILE 68 2HD1 ILE 68 4.284 -6.336 -6.417 513 H LEU 69 H LEU 69 10.195 -6.018 -7.766 514 HA LEU 69 HA LEU 69 11.405 -6.336 -10.391 515 HB2 LEU 69 1HB LEU 69 12.451 -6.884 -7.619 516 HB3 LEU 69 2HB LEU 69 13.383 -7.099 -9.100 517 HG LEU 69 HG LEU 69 12.283 -4.469 -8.111 518 HD11 LEU 69 1HD1 LEU 69 14.742 -5.933 -7.517 519 HD12 LEU 69 2HD1 LEU 69 13.987 -4.585 -6.667 520 HD13 LEU 69 3HD1 LEU 69 15.004 -4.280 -8.075 521 HD21 LEU 69 3HD2 LEU 69 12.798 -3.639 -10.103 522 HD22 LEU 69 1HD2 LEU 69 13.140 -5.275 -10.667 523 HD23 LEU 69 2HD2 LEU 69 14.435 -4.287 -9.989 524 H THR 70 H THR 70 11.621 -8.212 -11.458 525 HA THR 70 HA THR 70 11.138 -10.733 -10.054 526 HB THR 70 HB THR 70 9.651 -11.523 -11.888 527 HG1 THR 70 1HG THR 70 8.837 -10.033 -13.345 528 HG21 THR 70 3HG2 THR 70 7.668 -10.533 -11.038 529 HG22 THR 70 1HG2 THR 70 8.517 -9.059 -10.576 530 HG23 THR 70 2HG2 THR 70 8.816 -10.560 -9.700 531 H GLU 71 H GLU 71 12.830 -11.981 -10.471 532 HA GLU 71 HA GLU 71 14.858 -11.584 -12.231 533 HB2 GLU 71 1HB GLU 71 15.521 -13.825 -11.892 534 HB3 GLU 71 2HB GLU 71 14.672 -13.362 -10.424 535 HG2 GLU 71 1HG GLU 71 13.761 -15.414 -10.789 536 HG3 GLU 71 2HG GLU 71 12.611 -14.404 -11.664 537 H GLY 72 H GLY 72 11.781 -13.166 -12.898 538 HA2 GLY 72 1HA GLY 72 12.507 -13.159 -15.762 539 HA3 GLY 72 2HA GLY 72 11.618 -14.487 -15.033 540 H PHE 73 H PHE 73 11.347 -11.641 -16.744 541 HA PHE 73 HA PHE 73 8.852 -10.697 -15.728 542 HB2 PHE 73 1HB PHE 73 8.987 -9.049 -17.332 543 HB3 PHE 73 2HB PHE 73 10.684 -9.501 -17.207 544 HD1 PHE 73 2HD PHE 73 7.659 -9.710 -19.263 545 HD2 PHE 73 1HD PHE 73 11.805 -10.637 -18.998 546 HE1 PHE 73 2HE PHE 73 7.700 -10.199 -21.674 547 HE2 PHE 73 1HE PHE 73 11.853 -11.126 -21.409 548 HZ PHE 73 HZ PHE 73 9.799 -10.909 -22.750 549 HA PRO 74 HA PRO 74 6.198 -13.673 -17.630 550 HB2 PRO 74 1HB PRO 74 3.866 -12.316 -17.334 551 HB3 PRO 74 2HB PRO 74 4.682 -13.126 -15.992 552 HG2 PRO 74 1HG PRO 74 4.706 -10.231 -16.754 553 HG3 PRO 74 2HG PRO 74 4.559 -10.964 -15.146 554 HD2 PRO 74 1HD PRO 74 6.889 -9.945 -16.074 555 HD3 PRO 74 2HD PRO 74 6.827 -11.331 -14.967 556 HA PRO 75 HA PRO 75 6.171 -11.943 -21.772 557 HB2 PRO 75 1HB PRO 75 5.544 -14.277 -23.009 558 HB3 PRO 75 2HB PRO 75 7.176 -13.897 -22.445 559 HG2 PRO 75 1HG PRO 75 5.068 -15.581 -21.148 560 HG3 PRO 75 2HG PRO 75 6.807 -15.890 -21.305 561 HD2 PRO 75 1HD PRO 75 5.695 -14.947 -19.024 562 HD3 PRO 75 2HD PRO 75 7.339 -14.513 -19.535 563 H GLY 76 H GLY 76 3.621 -13.677 -20.137 564 HA2 GLY 76 1HA GLY 76 1.618 -12.026 -21.360 565 HA3 GLY 76 2HA GLY 76 1.557 -13.686 -21.934 566 H GLY 77 H GLY 77 1.628 -15.355 -20.076 567 HA2 GLY 77 1HA GLY 77 0.393 -14.459 -17.611 568 HA3 GLY 77 2HA GLY 77 -0.661 -15.390 -18.665 569 H GLY 78 H GLY 78 -0.856 -17.075 -17.168 570 HA2 GLY 78 1HA GLY 78 -0.146 -19.361 -16.944 571 HA3 GLY 78 2HA GLY 78 1.519 -18.812 -17.062 572 H ASN 79 H ASN 79 2.318 -17.455 -15.248 573 HA ASN 79 HA ASN 79 0.911 -17.842 -12.723 574 HB2 ASN 79 1HB ASN 79 3.786 -18.719 -13.042 575 HB3 ASN 79 2HB ASN 79 2.763 -18.904 -11.620 576 HD21 ASN 79 1HD2 ASN 79 1.062 -20.423 -11.676 577 HD22 ASN 79 2HD2 ASN 79 1.094 -21.752 -12.781 578 H ALA 80 H ALA 80 1.577 -16.432 -11.065 579 HA ALA 80 HA ALA 80 3.389 -14.273 -11.930 580 HB1 ALA 80 1HB ALA 80 0.709 -14.110 -10.605 581 HB2 ALA 80 2HB ALA 80 1.893 -12.816 -10.412 582 HB3 ALA 80 3HB ALA 80 1.309 -13.246 -12.020 583 H ARG 81 H ARG 81 4.628 -13.255 -10.307 584 HA ARG 81 HA ARG 81 4.523 -14.061 -7.576 585 HB2 ARG 81 1HB ARG 81 6.551 -15.324 -7.422 586 HB3 ARG 81 2HB ARG 81 5.549 -16.076 -8.655 587 HG2 ARG 81 1HG ARG 81 6.899 -15.292 -10.396 588 HG3 ARG 81 2HG ARG 81 7.686 -14.098 -9.361 589 HD2 ARG 81 1HD ARG 81 9.321 -15.689 -9.422 590 HD3 ARG 81 2HD ARG 81 8.410 -16.255 -8.023 591 HE ARG 81 HE ARG 81 7.718 -18.087 -9.239 592 HH11 ARG 81 1HH1 ARG 81 9.293 -15.792 -11.330 593 HH12 ARG 81 2HH1 ARG 81 9.386 -16.883 -12.673 594 HH21 ARG 81 1HH2 ARG 81 7.833 -19.531 -11.000 595 HH22 ARG 81 2HH2 ARG 81 8.554 -19.009 -12.485 596 H ALA 82 H ALA 82 6.458 -13.190 -6.349 597 HA ALA 82 HA ALA 82 7.706 -10.909 -7.708 598 HB1 ALA 82 1HB ALA 82 7.164 -9.400 -5.911 599 HB2 ALA 82 2HB ALA 82 5.676 -10.109 -6.540 600 HB3 ALA 82 3HB ALA 82 6.357 -10.691 -5.021 601 H THR 83 H THR 83 9.826 -11.095 -7.472 602 HA THR 83 HA THR 83 10.916 -12.612 -5.233 603 HB THR 83 HB THR 83 13.050 -12.518 -6.425 604 HG1 THR 83 1HG THR 83 12.670 -10.416 -7.394 605 HG21 THR 83 3HG2 THR 83 10.751 -13.254 -8.241 606 HG22 THR 83 1HG2 THR 83 11.470 -14.294 -7.012 607 HG23 THR 83 2HG2 THR 83 12.418 -13.802 -8.415 608 H GLY 84 H GLY 84 11.031 -9.364 -6.619 609 HA2 GLY 84 1HA GLY 84 12.031 -8.381 -4.043 610 HA3 GLY 84 2HA GLY 84 12.934 -7.970 -5.494 611 H MET 85 H MET 85 12.374 -5.777 -4.528 612 HA MET 85 HA MET 85 9.996 -4.796 -5.917 613 HB2 MET 85 1HB MET 85 9.374 -5.178 -3.536 614 HB3 MET 85 2HB MET 85 10.636 -4.051 -3.058 615 HG2 MET 85 1HG MET 85 8.584 -2.877 -3.007 616 HG3 MET 85 2HG MET 85 9.480 -2.305 -4.413 617 HE1 MET 85 3HE MET 85 6.066 -1.886 -4.219 618 HE2 MET 85 1HE MET 85 5.285 -3.465 -4.323 619 HE3 MET 85 2HE MET 85 6.404 -3.120 -3.004 620 H PHE 86 H PHE 86 10.133 -2.658 -6.614 621 HA PHE 86 HA PHE 86 12.718 -1.323 -6.170 622 HB2 PHE 86 1HB PHE 86 12.465 -2.486 -8.440 623 HB3 PHE 86 2HB PHE 86 11.269 -1.249 -8.811 624 HD1 PHE 86 1HD PHE 86 11.926 1.067 -9.116 625 HD2 PHE 86 2HD PHE 86 14.808 -1.958 -8.302 626 HE1 PHE 86 1HE PHE 86 13.722 2.592 -9.827 627 HE2 PHE 86 2HE PHE 86 16.608 -0.438 -9.011 628 HZ PHE 86 HZ PHE 86 16.067 1.840 -9.774 629 H LEU 87 H LEU 87 12.473 0.630 -5.330 630 HA LEU 87 HA LEU 87 10.103 2.207 -6.060 631 HB2 LEU 87 1HB LEU 87 11.251 2.075 -3.279 632 HB3 LEU 87 2HB LEU 87 9.807 2.942 -3.797 633 HG LEU 87 HG LEU 87 9.932 -0.033 -4.071 634 HD11 LEU 87 1HD1 LEU 87 9.899 -0.429 -1.889 635 HD12 LEU 87 2HD1 LEU 87 8.628 0.768 -1.640 636 HD13 LEU 87 3HD1 LEU 87 10.321 1.263 -1.622 637 HD21 LEU 87 3HD2 LEU 87 7.779 2.040 -3.745 638 HD22 LEU 87 1HD2 LEU 87 7.473 0.314 -3.552 639 HD23 LEU 87 2HD2 LEU 87 8.049 0.940 -5.097 640 H GLN 88 H GLN 88 10.452 4.351 -6.397 641 HA GLN 88 HA GLN 88 13.207 5.318 -6.002 642 HB2 GLN 88 1HB GLN 88 11.247 5.950 -8.210 643 HB3 GLN 88 2HB GLN 88 12.755 6.819 -7.963 644 HG2 GLN 88 1HG GLN 88 14.011 4.765 -8.322 645 HG3 GLN 88 2HG GLN 88 12.504 3.877 -8.544 646 HE21 GLN 88 1HE2 GLN 88 14.389 6.572 -9.832 647 HE22 GLN 88 2HE2 GLN 88 13.871 6.384 -11.470 648 H TYR 89 H TYR 89 13.507 7.217 -4.973 649 HA TYR 89 HA TYR 89 11.332 9.093 -4.625 650 HB2 TYR 89 1HB TYR 89 11.677 9.063 -2.093 651 HB3 TYR 89 2HB TYR 89 10.763 7.727 -2.785 652 HD1 TYR 89 1HD TYR 89 14.071 8.701 -1.440 653 HD2 TYR 89 2HD TYR 89 11.515 5.492 -2.566 654 HE1 TYR 89 1HE TYR 89 15.616 7.106 -0.381 655 HE2 TYR 89 2HE TYR 89 13.052 3.888 -1.509 656 HH TYR 89 HH TYR 89 16.194 4.804 -0.414 657 H THR 90 H THR 90 12.016 11.118 -3.737 658 HA THR 90 HA THR 90 14.917 11.541 -4.007 659 HB THR 90 HB THR 90 14.323 13.937 -4.439 660 HG1 THR 90 1HG THR 90 12.095 13.511 -3.470 661 HG21 THR 90 3HG2 THR 90 13.592 11.667 -6.204 662 HG22 THR 90 1HG2 THR 90 14.784 12.945 -6.438 663 HG23 THR 90 2HG2 THR 90 13.072 13.276 -6.705 664 H VAL 91 H VAL 91 16.056 12.300 -2.331 665 HA VAL 91 HA VAL 91 14.716 12.680 0.204 666 HB VAL 91 HB VAL 91 17.652 12.806 -0.499 667 HG11 VAL 91 1HG1 VAL 91 16.936 12.277 2.275 668 HG12 VAL 91 2HG1 VAL 91 18.127 13.393 1.604 669 HG13 VAL 91 3HG1 VAL 91 16.435 13.875 1.723 670 HG21 VAL 91 3HG2 VAL 91 15.871 10.625 0.538 671 HG22 VAL 91 1HG2 VAL 91 16.989 10.589 -0.825 672 HG23 VAL 91 2HG2 VAL 91 17.611 10.607 0.825 673 HA PRO 92 HA PRO 92 14.459 17.087 -0.185 674 HB2 PRO 92 1HB PRO 92 13.779 17.603 2.392 675 HB3 PRO 92 2HB PRO 92 12.641 16.940 1.213 676 HG2 PRO 92 1HG PRO 92 14.218 15.525 3.328 677 HG3 PRO 92 2HG PRO 92 12.523 15.300 2.858 678 HD2 PRO 92 1HD PRO 92 14.496 13.640 2.032 679 HD3 PRO 92 2HD PRO 92 13.070 13.997 1.037 680 H GLY 93 H GLY 93 16.695 17.495 -0.553 681 HA2 GLY 93 1HA GLY 93 18.159 19.214 0.590 682 HA3 GLY 93 2HA GLY 93 18.257 18.039 1.893 683 H THR 94 H THR 94 18.166 16.748 -1.275 684 HA THR 94 HA THR 94 21.087 16.596 -1.434 685 HB THR 94 HB THR 94 19.988 14.532 -0.274 686 HG1 THR 94 1HG THR 94 22.186 14.847 -1.394 687 HG21 THR 94 3HG2 THR 94 19.230 12.804 -1.785 688 HG22 THR 94 1HG2 THR 94 19.505 13.851 -3.176 689 HG23 THR 94 2HG2 THR 94 18.240 14.245 -2.012 690 H GLU 95 H GLU 95 21.677 15.348 -3.556 691 HA GLU 95 HA GLU 95 19.944 16.416 -5.685 692 HB2 GLU 95 1HB GLU 95 21.985 17.551 -5.867 693 HB3 GLU 95 2HB GLU 95 22.924 16.118 -5.474 694 HG2 GLU 95 1HG GLU 95 22.755 15.255 -7.600 695 HG3 GLU 95 2HG GLU 95 21.295 16.171 -7.970 696 H GLY 96 H GLY 96 19.441 15.145 -7.455 697 HA2 GLY 96 1HA GLY 96 19.417 13.223 -8.783 698 HA3 GLY 96 2HA GLY 96 20.522 12.455 -7.653 699 H VAL 97 H VAL 97 18.874 10.693 -8.242 700 HA VAL 97 HA VAL 97 16.688 10.780 -6.265 701 HB VAL 97 HB VAL 97 16.666 9.277 -8.886 702 HG11 VAL 97 1HG1 VAL 97 14.137 9.713 -7.510 703 HG12 VAL 97 2HG1 VAL 97 14.812 8.236 -8.201 704 HG13 VAL 97 3HG1 VAL 97 15.272 8.741 -6.575 705 HG21 VAL 97 3HG2 VAL 97 15.968 12.012 -8.227 706 HG22 VAL 97 1HG2 VAL 97 16.103 11.230 -9.802 707 HG23 VAL 97 2HG2 VAL 97 14.597 11.122 -8.890 708 H THR 98 H THR 98 16.404 9.020 -4.960 709 HA THR 98 HA THR 98 18.505 6.964 -5.103 710 HB THR 98 HB THR 98 16.834 7.778 -2.717 711 HG1 THR 98 1HG THR 98 19.257 8.364 -2.183 712 HG21 THR 98 3HG2 THR 98 18.047 5.380 -3.110 713 HG22 THR 98 1HG2 THR 98 17.797 6.119 -1.529 714 HG23 THR 98 2HG2 THR 98 19.348 6.296 -2.350 715 H GLN 99 H GLN 99 17.972 4.908 -5.477 716 HA GLN 99 HA GLN 99 15.117 4.192 -5.417 717 HB2 GLN 99 1HB GLN 99 15.699 2.443 -7.073 718 HB3 GLN 99 2HB GLN 99 16.029 4.071 -7.653 719 HG2 GLN 99 1HG GLN 99 18.219 2.532 -6.353 720 HG3 GLN 99 2HG GLN 99 17.751 2.136 -8.006 721 HE21 GLN 99 1HE2 GLN 99 17.472 4.185 -9.404 722 HE22 GLN 99 2HE2 GLN 99 18.760 5.331 -9.295 723 H LEU 100 H LEU 100 14.447 2.376 -4.356 724 HA LEU 100 HA LEU 100 16.462 1.065 -2.664 725 HB2 LEU 100 1HB LEU 100 14.369 2.329 -1.758 726 HB3 LEU 100 2HB LEU 100 13.516 0.855 -2.208 727 HG LEU 100 HG LEU 100 15.134 -0.394 -0.727 728 HD11 LEU 100 1HD1 LEU 100 16.041 2.390 -0.283 729 HD12 LEU 100 2HD1 LEU 100 16.954 0.882 -0.272 730 HD13 LEU 100 3HD1 LEU 100 15.968 1.326 1.122 731 HD21 LEU 100 3HD2 LEU 100 12.753 0.799 -0.175 732 HD22 LEU 100 1HD2 LEU 100 13.782 1.467 1.091 733 HD23 LEU 100 2HD2 LEU 100 13.616 -0.280 0.922 734 H LYS 101 H LYS 101 16.416 -1.197 -2.379 735 HA LYS 101 HA LYS 101 14.832 -2.704 -4.344 736 HB2 LYS 101 1HB LYS 101 17.276 -2.277 -5.030 737 HB3 LYS 101 2HB LYS 101 17.699 -3.399 -3.743 738 HG2 LYS 101 1HG LYS 101 16.267 -5.107 -4.835 739 HG3 LYS 101 2HG LYS 101 16.019 -3.980 -6.171 740 HD2 LYS 101 1HD LYS 101 18.572 -3.894 -6.330 741 HD3 LYS 101 2HD LYS 101 18.560 -5.326 -5.297 742 HE2 LYS 101 1HE LYS 101 17.043 -5.123 -7.892 743 HE3 LYS 101 2HE LYS 101 18.673 -5.781 -7.766 744 HZ1 LYS 101 3HZ LYS 101 16.530 -7.293 -7.608 745 HZ2 LYS 101 1HZ LYS 101 16.650 -6.878 -5.972 746 HZ3 LYS 101 2HZ LYS 101 17.941 -7.649 -6.745 747 H LEU 102 H LEU 102 13.708 -4.272 -3.409 748 HA LEU 102 HA LEU 102 14.651 -5.324 -0.824 749 HB2 LEU 102 1HB LEU 102 11.824 -5.242 -1.862 750 HB3 LEU 102 2HB LEU 102 12.344 -5.775 -0.265 751 HG LEU 102 HG LEU 102 12.668 -2.952 -1.270 752 HD11 LEU 102 1HD1 LEU 102 10.397 -4.296 0.133 753 HD12 LEU 102 2HD1 LEU 102 10.366 -3.141 -1.199 754 HD13 LEU 102 3HD1 LEU 102 10.749 -2.594 0.433 755 HD21 LEU 102 3HD2 LEU 102 13.907 -4.210 0.807 756 HD22 LEU 102 1HD2 LEU 102 12.490 -3.518 1.597 757 HD23 LEU 102 2HD2 LEU 102 13.602 -2.475 0.711 758 H THR 103 H THR 103 14.635 -7.525 -0.463 759 HA THR 103 HA THR 103 13.759 -9.287 -2.624 760 HB THR 103 HB THR 103 16.531 -9.511 -1.443 761 HG1 THR 103 1HG THR 103 15.561 -8.053 -3.577 762 HG21 THR 103 3HG2 THR 103 15.144 -10.954 -3.703 763 HG22 THR 103 1HG2 THR 103 15.645 -11.641 -2.159 764 HG23 THR 103 2HG2 THR 103 16.858 -11.105 -3.320 765 H VAL 104 H VAL 104 13.497 -11.494 -1.985 766 HA VAL 104 HA VAL 104 12.560 -11.776 0.697 767 HB VAL 104 HB VAL 104 12.914 -13.862 -1.460 768 HG11 VAL 104 1HG1 VAL 104 12.313 -15.409 0.014 769 HG12 VAL 104 2HG1 VAL 104 12.406 -14.194 1.291 770 HG13 VAL 104 3HG1 VAL 104 10.880 -14.480 0.453 771 HG21 VAL 104 3HG2 VAL 104 10.360 -13.597 -1.517 772 HG22 VAL 104 1HG2 VAL 104 10.639 -12.070 -0.679 773 HG23 VAL 104 2HG2 VAL 104 11.339 -12.341 -2.275 774 H VAL 105 H VAL 105 13.481 -12.744 2.422 775 HA VAL 105 HA VAL 105 16.262 -13.645 2.112 776 HB VAL 105 HB VAL 105 16.399 -13.327 4.596 777 HG11 VAL 105 1HG1 VAL 105 15.588 -10.672 3.651 778 HG12 VAL 105 2HG1 VAL 105 17.144 -11.235 4.266 779 HG13 VAL 105 3HG1 VAL 105 16.703 -11.523 2.583 780 HG21 VAL 105 3HG2 VAL 105 13.633 -13.169 4.414 781 HG22 VAL 105 1HG2 VAL 105 14.618 -12.820 5.835 782 HG23 VAL 105 2HG2 VAL 105 14.146 -11.515 4.747 783 H GLU 106 H GLU 106 16.958 -15.594 2.955 784 HA GLU 106 HA GLU 106 14.825 -17.531 3.491 785 HB2 GLU 106 1HB GLU 106 16.498 -19.244 2.974 786 HB3 GLU 106 2HB GLU 106 16.352 -18.081 1.664 787 HG2 GLU 106 1HG GLU 106 18.352 -16.908 2.821 788 HG3 GLU 106 2HG GLU 106 18.585 -18.470 3.604 789 H ASP 107 H ASP 107 14.388 -17.299 5.645 790 HA ASP 107 HA ASP 107 16.635 -17.650 7.514 791 HB2 ASP 107 1HB ASP 107 14.808 -16.833 9.197 792 HB3 ASP 107 2HB ASP 107 15.625 -15.664 8.163 793 H VAL 108 H VAL 108 13.271 -18.631 6.922 794 HA VAL 108 HA VAL 108 13.712 -20.978 8.640 795 HB VAL 108 HB VAL 108 11.787 -19.516 9.220 796 HG11 VAL 108 1HG1 VAL 108 10.840 -20.349 6.487 797 HG12 VAL 108 2HG1 VAL 108 9.766 -19.703 7.729 798 HG13 VAL 108 3HG1 VAL 108 11.084 -18.714 7.099 799 HG21 VAL 108 3HG2 VAL 108 10.549 -22.054 8.312 800 HG22 VAL 108 1HG2 VAL 108 11.948 -22.164 9.381 801 HG23 VAL 108 2HG2 VAL 108 10.512 -21.278 9.895 802 H THR 109 H THR 109 12.898 -23.038 7.931 803 HA THR 109 HA THR 109 13.785 -24.048 5.635 804 HB THR 109 HB THR 109 11.875 -25.705 5.654 805 HG1 THR 109 1HG THR 109 11.024 -23.938 7.705 806 HG21 THR 109 3HG2 THR 109 14.010 -25.851 7.034 807 HG22 THR 109 1HG2 THR 109 12.639 -26.803 7.602 808 HG23 THR 109 2HG2 THR 109 13.044 -25.282 8.396 809 H VAL 110 H VAL 110 10.584 -22.536 5.956 810 HA VAL 110 HA VAL 110 10.671 -21.679 3.203 811 HB VAL 110 HB VAL 110 9.808 -23.912 2.858 812 HG11 VAL 110 1HG1 VAL 110 7.919 -24.810 3.959 813 HG12 VAL 110 2HG1 VAL 110 8.940 -24.129 5.226 814 HG13 VAL 110 3HG1 VAL 110 7.508 -23.256 4.682 815 HG21 VAL 110 3HG2 VAL 110 8.881 -22.147 1.468 816 HG22 VAL 110 1HG2 VAL 110 7.654 -23.369 1.805 817 HG23 VAL 110 2HG2 VAL 110 7.629 -21.832 2.670 818 H GLY 111 H GLY 111 9.903 -19.676 3.200 819 HA2 GLY 111 1HA GLY 111 7.422 -19.010 4.498 820 HA3 GLY 111 2HA GLY 111 8.822 -18.300 5.288 821 H ARG 112 H ARG 112 8.387 -18.841 1.825 822 HA ARG 112 HA ARG 112 9.089 -16.109 1.273 823 HB2 ARG 112 1HB ARG 112 9.641 -18.246 -0.105 824 HB3 ARG 112 2HB ARG 112 8.033 -18.025 -0.781 825 HG2 ARG 112 1HG ARG 112 8.620 -16.153 -1.934 826 HG3 ARG 112 2HG ARG 112 9.860 -15.689 -0.767 827 HD2 ARG 112 1HD ARG 112 11.306 -17.477 -1.578 828 HD3 ARG 112 2HD ARG 112 10.060 -17.978 -2.721 829 HE ARG 112 HE ARG 112 10.878 -15.232 -3.002 830 HH11 ARG 112 1HH1 ARG 112 11.502 -18.530 -3.926 831 HH12 ARG 112 2HH1 ARG 112 12.312 -18.103 -5.397 832 HH21 ARG 112 1HH2 ARG 112 11.942 -14.656 -4.936 833 HH22 ARG 112 2HH2 ARG 112 12.562 -15.899 -5.970 834 H ARG 113 H ARG 113 6.181 -18.109 0.896 835 HA ARG 113 HA ARG 113 4.450 -16.534 -0.419 836 HB2 ARG 113 1HB ARG 113 4.082 -18.272 1.985 837 HB3 ARG 113 2HB ARG 113 2.726 -17.306 1.419 838 HG2 ARG 113 1HG ARG 113 2.450 -19.379 0.388 839 HG3 ARG 113 2HG ARG 113 3.150 -18.352 -0.865 840 HD2 ARG 113 1HD ARG 113 5.227 -19.382 -0.725 841 HD3 ARG 113 2HD ARG 113 4.912 -20.015 0.890 842 HE ARG 113 HE ARG 113 4.179 -21.218 -1.624 843 HH11 ARG 113 1HH1 ARG 113 3.541 -21.064 1.795 844 HH12 ARG 113 2HH1 ARG 113 2.826 -22.641 1.865 845 HH21 ARG 113 1HH2 ARG 113 3.240 -23.295 -1.545 846 HH22 ARG 113 2HH2 ARG 113 2.656 -23.909 -0.035 847 H GLN 114 H GLN 114 5.315 -16.124 2.999 848 HA GLN 114 HA GLN 114 3.623 -14.029 3.644 849 HB2 GLN 114 1HB GLN 114 5.110 -15.287 5.224 850 HB3 GLN 114 2HB GLN 114 6.465 -14.341 4.621 851 HG2 GLN 114 1HG GLN 114 5.422 -13.568 6.782 852 HG3 GLN 114 2HG GLN 114 5.618 -12.349 5.524 853 HE21 GLN 114 1HE2 GLN 114 3.772 -11.664 4.360 854 HE22 GLN 114 2HE2 GLN 114 2.188 -11.829 5.031 855 H ALA 115 H ALA 115 7.058 -13.677 2.735 856 HA ALA 115 HA ALA 115 7.057 -10.918 2.435 857 HB1 ALA 115 1HB ALA 115 8.730 -12.698 0.696 858 HB2 ALA 115 2HB ALA 115 9.139 -11.134 1.403 859 HB3 ALA 115 3HB ALA 115 9.026 -12.564 2.430 860 H VAL 116 H VAL 116 6.838 -13.329 -0.191 861 HA VAL 116 HA VAL 116 6.430 -11.700 -2.334 862 HB VAL 116 HB VAL 116 4.880 -14.249 -1.865 863 HG11 VAL 116 1HG1 VAL 116 4.174 -12.862 -3.796 864 HG12 VAL 116 2HG1 VAL 116 5.811 -12.990 -4.441 865 HG13 VAL 116 3HG1 VAL 116 4.818 -14.436 -4.262 866 HG21 VAL 116 3HG2 VAL 116 7.090 -14.884 -1.480 867 HG22 VAL 116 1HG2 VAL 116 6.858 -15.220 -3.196 868 HG23 VAL 116 2HG2 VAL 116 7.722 -13.768 -2.690 869 H ALA 117 H ALA 117 3.910 -12.874 -0.116 870 HA ALA 117 HA ALA 117 1.690 -11.745 -1.317 871 HB1 ALA 117 1HB ALA 117 0.843 -12.895 0.390 872 HB2 ALA 117 2HB ALA 117 2.354 -12.803 1.296 873 HB3 ALA 117 3HB ALA 117 1.186 -11.485 1.393 874 H TRP 118 H TRP 118 3.775 -10.297 1.182 875 HA TRP 118 HA TRP 118 2.463 -7.852 1.400 876 HB2 TRP 118 1HB TRP 118 4.313 -8.739 2.883 877 HB3 TRP 118 2HB TRP 118 5.451 -8.228 1.640 878 HD1 TRP 118 HD TRP 118 3.391 -6.914 4.509 879 HE1 TRP 118 1HE TRP 118 3.866 -4.404 4.828 880 HE3 TRP 118 3HE TRP 118 6.058 -6.045 0.235 881 HZ2 TRP 118 2HZ TRP 118 5.196 -2.331 3.449 882 HZ3 TRP 118 3HZ TRP 118 6.896 -3.771 -0.190 883 HH2 TRP 118 HH TRP 118 6.472 -1.953 1.384 884 H LEU 119 H LEU 119 5.047 -8.851 -0.806 885 HA LEU 119 HA LEU 119 5.521 -6.368 -2.004 886 HB2 LEU 119 1HB LEU 119 5.706 -9.086 -3.292 887 HB3 LEU 119 2HB LEU 119 6.505 -7.613 -3.837 888 HG LEU 119 HG LEU 119 7.070 -8.913 -1.179 889 HD11 LEU 119 1HD1 LEU 119 9.153 -9.177 -3.160 890 HD12 LEU 119 2HD1 LEU 119 7.670 -9.981 -3.674 891 HD13 LEU 119 3HD1 LEU 119 8.413 -10.404 -2.131 892 HD21 LEU 119 3HD2 LEU 119 8.330 -6.712 -2.784 893 HD22 LEU 119 1HD2 LEU 119 9.225 -7.586 -1.541 894 HD23 LEU 119 2HD2 LEU 119 7.773 -6.681 -1.111 895 H VAL 120 H VAL 120 3.412 -9.027 -3.094 896 HA VAL 120 HA VAL 120 2.347 -7.672 -5.318 897 HB VAL 120 HB VAL 120 2.134 -10.069 -5.151 898 HG11 VAL 120 1HG1 VAL 120 0.574 -11.093 -3.515 899 HG12 VAL 120 2HG1 VAL 120 1.984 -10.341 -2.765 900 HG13 VAL 120 3HG1 VAL 120 0.423 -9.521 -2.730 901 HG21 VAL 120 3HG2 VAL 120 -0.509 -8.623 -5.080 902 HG22 VAL 120 1HG2 VAL 120 0.458 -9.034 -6.497 903 HG23 VAL 120 2HG2 VAL 120 -0.326 -10.309 -5.564 904 H ALA 121 H ALA 121 1.270 -7.904 -1.960 905 HA ALA 121 HA ALA 121 -1.194 -6.559 -2.315 906 HB1 ALA 121 1HB ALA 121 -1.467 -7.209 -0.213 907 HB2 ALA 121 2HB ALA 121 0.206 -7.768 -0.182 908 HB3 ALA 121 3HB ALA 121 -0.184 -6.121 0.316 909 H MET 122 H MET 122 2.061 -5.448 -1.509 910 HA MET 122 HA MET 122 1.414 -2.790 -0.876 911 HB2 MET 122 1HB MET 122 3.589 -3.776 -0.350 912 HB3 MET 122 2HB MET 122 3.958 -3.913 -2.064 913 HG2 MET 122 1HG MET 122 5.102 -2.013 -1.505 914 HG3 MET 122 2HG MET 122 3.575 -1.342 -2.075 915 HE1 MET 122 3HE MET 122 2.678 0.973 0.527 916 HE2 MET 122 1HE MET 122 4.106 1.131 -0.498 917 HE3 MET 122 2HE MET 122 2.636 0.397 -1.140 918 H HIS 123 H HIS 123 2.623 -4.160 -3.940 919 HA HIS 123 HA HIS 123 2.464 -1.805 -5.440 920 HB2 HIS 123 1HB HIS 123 3.704 -3.726 -6.247 921 HB3 HIS 123 2HB HIS 123 2.230 -4.687 -6.328 922 HD2 HIS 123 2HD HIS 123 4.122 -1.989 -8.387 923 HE1 HIS 123 1HE HIS 123 0.719 -3.213 -10.606 924 HE2 HIS 123 2HE HIS 123 2.896 -1.946 -10.664 925 H LYS 124 H LYS 124 0.213 -4.570 -5.616 926 HA LYS 124 HA LYS 124 -1.757 -3.504 -7.150 927 HB2 LYS 124 1HB LYS 124 -1.892 -5.361 -4.794 928 HB3 LYS 124 2HB LYS 124 -3.359 -4.876 -5.633 929 HG2 LYS 124 1HG LYS 124 -2.011 -5.645 -7.754 930 HG3 LYS 124 2HG LYS 124 -1.119 -6.594 -6.563 931 HD2 LYS 124 1HD LYS 124 -3.566 -7.218 -5.767 932 HD3 LYS 124 2HD LYS 124 -3.953 -6.814 -7.441 933 HE2 LYS 124 1HE LYS 124 -2.137 -8.388 -8.146 934 HE3 LYS 124 2HE LYS 124 -1.992 -8.882 -6.460 935 HZ1 LYS 124 3HZ LYS 124 -3.403 -10.416 -7.602 936 HZ2 LYS 124 1HZ LYS 124 -4.383 -9.171 -8.196 937 HZ3 LYS 124 2HZ LYS 124 -4.364 -9.515 -6.540 938 H ALA 125 H ALA 125 -1.773 -3.335 -3.584 939 HA ALA 125 HA ALA 125 -3.949 -1.630 -3.315 940 HB1 ALA 125 1HB ALA 125 -1.524 -1.869 -1.537 941 HB2 ALA 125 2HB ALA 125 -3.043 -1.092 -1.091 942 HB3 ALA 125 3HB ALA 125 -3.004 -2.822 -1.429 943 H ALA 126 H ALA 126 -0.490 -0.795 -3.463 944 HA ALA 126 HA ALA 126 -0.391 1.841 -3.092 945 HB1 ALA 126 1HB ALA 126 1.388 2.010 -4.703 946 HB2 ALA 126 2HB ALA 126 1.496 0.449 -3.887 947 HB3 ALA 126 3HB ALA 126 0.838 0.547 -5.520 948 H LYS 127 H LYS 127 -1.534 0.371 -6.122 949 HA LYS 127 HA LYS 127 -2.008 2.512 -7.700 950 HB2 LYS 127 1HB LYS 127 -3.884 0.187 -7.235 951 HB3 LYS 127 2HB LYS 127 -3.992 1.299 -8.593 952 HG2 LYS 127 1HG LYS 127 -1.670 0.608 -9.227 953 HG3 LYS 127 2HG LYS 127 -1.776 -0.641 -7.985 954 HD2 LYS 127 1HD LYS 127 -3.744 -1.580 -9.108 955 HD3 LYS 127 2HD LYS 127 -3.621 -0.336 -10.355 956 HE2 LYS 127 1HE LYS 127 -1.401 -1.182 -10.963 957 HE3 LYS 127 2HE LYS 127 -1.541 -2.430 -9.726 958 HZ1 LYS 127 3HZ LYS 127 -3.657 -2.245 -11.740 959 HZ2 LYS 127 1HZ LYS 127 -3.037 -3.605 -10.947 960 HZ3 LYS 127 2HZ LYS 127 -2.170 -2.897 -12.214 961 H LEU 128 H LEU 128 -4.299 1.334 -5.235 962 HA LEU 128 HA LEU 128 -6.359 3.047 -5.439 963 HB2 LEU 128 1HB LEU 128 -4.944 2.033 -3.002 964 HB3 LEU 128 2HB LEU 128 -6.351 3.084 -2.856 965 HG LEU 128 HG LEU 128 -6.435 0.498 -4.388 966 HD11 LEU 128 1HD1 LEU 128 -6.034 -0.492 -2.407 967 HD12 LEU 128 2HD1 LEU 128 -7.719 -0.079 -2.092 968 HD13 LEU 128 3HD1 LEU 128 -6.428 0.956 -1.480 969 HD21 LEU 128 3HD2 LEU 128 -8.546 2.252 -3.138 970 HD22 LEU 128 1HD2 LEU 128 -8.846 0.697 -3.914 971 HD23 LEU 128 2HD2 LEU 128 -8.227 2.051 -4.861 972 H LEU 129 H LEU 129 -3.376 3.811 -3.643 973 HA LEU 129 HA LEU 129 -3.850 6.302 -2.729 974 HB2 LEU 129 1HB LEU 129 -1.381 5.243 -4.079 975 HB3 LEU 129 2HB LEU 129 -1.434 6.825 -3.302 976 HG LEU 129 HG LEU 129 -2.211 4.426 -1.713 977 HD11 LEU 129 1HD1 LEU 129 -0.241 3.432 -1.900 978 HD12 LEU 129 2HD1 LEU 129 0.538 4.892 -1.290 979 HD13 LEU 129 3HD1 LEU 129 0.309 4.674 -3.025 980 HD21 LEU 129 3HD2 LEU 129 -0.778 5.920 -0.076 981 HD22 LEU 129 1HD2 LEU 129 -2.466 6.293 -0.424 982 HD23 LEU 129 2HD2 LEU 129 -1.180 7.176 -1.248 983 H TYR 130 H TYR 130 -2.544 5.698 -5.996 984 HA TYR 130 HA TYR 130 -3.366 8.388 -6.786 985 HB2 TYR 130 1HB TYR 130 -2.147 7.549 -8.978 986 HB3 TYR 130 2HB TYR 130 -1.228 8.103 -7.583 987 HD1 TYR 130 2HD TYR 130 -0.386 6.325 -5.941 988 HD2 TYR 130 1HD TYR 130 -1.813 5.401 -9.841 989 HE1 TYR 130 2HE TYR 130 0.791 4.168 -5.854 990 HE2 TYR 130 1HE TYR 130 -0.640 3.240 -9.764 991 HH TYR 130 HH TYR 130 1.113 2.204 -6.863 992 H GLU 131 H GLU 131 -3.484 5.152 -8.291 993 HA GLU 131 HA GLU 131 -5.315 5.634 -10.260 994 HB2 GLU 131 1HB GLU 131 -4.966 3.163 -8.561 995 HB3 GLU 131 2HB GLU 131 -5.996 3.215 -9.985 996 HG2 GLU 131 1HG GLU 131 -3.900 4.018 -11.226 997 HG3 GLU 131 2HG GLU 131 -3.017 3.439 -9.815 998 H SER 132 H SER 132 -5.871 5.523 -6.858 999 HA SER 132 HA SER 132 -8.734 5.989 -7.338 1000 HB2 SER 132 1HB SER 132 -8.182 3.646 -6.443 1001 HB3 SER 132 2HB SER 132 -7.741 4.455 -4.939 1002 HG SER 132 HG SER 132 -10.065 3.665 -5.430 1003 H ARG 133 H ARG 133 -7.204 8.124 -7.174 1004 HA ARG 133 HA ARG 133 -6.331 9.187 -4.827 1005 HB2 ARG 133 1HB ARG 133 -7.151 11.420 -5.733 1006 HB3 ARG 133 2HB ARG 133 -6.082 10.493 -6.778 1007 HG2 ARG 133 1HG ARG 133 -7.712 11.217 -8.238 1008 HG3 ARG 133 2HG ARG 133 -8.269 9.595 -7.822 1009 HD2 ARG 133 1HD ARG 133 -10.032 10.368 -6.591 1010 HD3 ARG 133 2HD ARG 133 -9.205 11.860 -6.144 1011 HE ARG 133 HE ARG 133 -9.740 11.863 -8.910 1012 HH11 ARG 133 1HH1 ARG 133 -11.356 12.130 -5.839 1013 HH12 ARG 133 2HH1 ARG 133 -12.651 13.101 -6.457 1014 HH21 ARG 133 1HH2 ARG 133 -11.439 13.141 -9.737 1015 HH22 ARG 133 2HH2 ARG 133 -12.698 13.674 -8.675 1016 H ASP 134 H ASP 134 -7.293 10.647 -3.271 1017 HA ASP 134 HA ASP 134 -9.748 9.618 -2.226 1018 HB2 ASP 134 1HB ASP 134 -7.801 11.733 -1.375 1019 HB3 ASP 134 2HB ASP 134 -9.378 11.634 -0.596 1020 H GLN 135 H GLN 135 -11.628 10.922 -1.693 1021 HA GLN 135 HA GLN 135 -12.290 12.730 -3.887 1022 HB2 GLN 135 1HB GLN 135 -14.611 12.449 -3.161 1023 HB3 GLN 135 2HB GLN 135 -13.837 10.892 -3.421 1024 HG2 GLN 135 1HG GLN 135 -13.376 10.948 -0.887 1025 HG3 GLN 135 2HG GLN 135 -14.616 12.201 -0.850 1026 HE21 GLN 135 1HE2 GLN 135 -14.953 9.867 0.527 1027 HE22 GLN 135 2HE2 GLN 135 -16.202 8.928 -0.209 1028 H SER 136 H SER 136 -12.472 12.638 -0.336 1029 HA SER 136 HA SER 136 -12.324 15.577 -0.346 1030 HB2 SER 136 1HB SER 136 -14.205 13.809 1.204 1031 HB3 SER 136 2HB SER 136 -13.784 15.421 1.781 1032 HG SER 136 HG SER 136 -14.402 15.640 -0.777 1033 H GLY 137 H GLY 137 -11.451 16.506 1.634 1034 HA2 GLY 137 1HA GLY 137 -10.142 14.774 3.532 1035 HA3 GLY 137 2HA GLY 137 -9.030 15.551 2.415 1036 HA PRO 138 HA PRO 138 -9.407 18.400 5.989 1037 HB2 PRO 138 1HB PRO 138 -6.816 19.205 5.888 1038 HB3 PRO 138 2HB PRO 138 -7.335 17.740 6.731 1039 HG2 PRO 138 1HG PRO 138 -6.123 18.032 4.009 1040 HG3 PRO 138 2HG PRO 138 -5.770 16.834 5.268 1041 HD2 PRO 138 1HD PRO 138 -7.353 16.287 3.141 1042 HD3 PRO 138 2HD PRO 138 -7.605 15.546 4.734 1043 H SER 139 H SER 139 -8.425 20.760 6.064 1044 HA SER 139 HA SER 139 -9.340 22.053 3.618 1045 HB2 SER 139 1HB SER 139 -9.456 24.082 4.928 1046 HB3 SER 139 2HB SER 139 -10.192 22.777 5.857 1047 HG SER 139 HG SER 139 -8.825 23.298 7.354 1048 H SER 140 H SER 140 -6.917 20.762 3.290 1049 HA SER 140 HA SER 140 -4.647 22.368 3.726 1050 HB2 SER 140 1HB SER 140 -4.338 20.046 3.211 1051 HB3 SER 140 2HB SER 140 -5.209 20.208 1.686 1052 HG SER 140 HG SER 140 -2.808 20.210 1.631 1053 H GLY 141 H GLY 141 -3.418 23.617 2.219 1054 HA2 GLY 141 1HA GLY 141 -3.867 24.339 -0.326 1055 HA3 GLY 141 2HA GLY 141 -5.118 25.241 0.516 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -16.354 10.998 -3.959 2 HA2 GLY 1 1HA GLY 1 -18.631 11.783 -3.803 3 HA3 GLY 1 2HA GLY 1 -19.072 10.603 -5.028 4 H SER 2 H SER 2 -18.023 8.287 -4.117 5 HA SER 2 HA SER 2 -19.250 7.949 -1.458 6 HB2 SER 2 1HB SER 2 -19.348 5.973 -3.751 7 HB3 SER 2 2HB SER 2 -20.092 5.770 -2.164 8 HG SER 2 HG SER 2 -21.094 7.964 -2.883 9 H SER 3 H SER 3 -18.399 6.238 -0.155 10 HA SER 3 HA SER 3 -15.892 5.020 -0.989 11 HB2 SER 3 1HB SER 3 -15.368 7.284 0.045 12 HB3 SER 3 2HB SER 3 -15.979 6.631 1.565 13 HG SER 3 HG SER 3 -14.291 5.306 1.700 14 H GLY 4 H GLY 4 -15.568 3.056 -0.085 15 HA2 GLY 4 1HA GLY 4 -15.741 1.597 1.867 16 HA3 GLY 4 2HA GLY 4 -17.324 2.300 2.166 17 H SER 5 H SER 5 -15.484 0.149 0.089 18 HA SER 5 HA SER 5 -17.614 -0.658 -1.577 19 HB2 SER 5 1HB SER 5 -15.017 -2.003 -0.821 20 HB3 SER 5 2HB SER 5 -16.145 -2.690 -1.989 21 HG SER 5 HG SER 5 -15.271 -0.034 -2.279 22 H SER 6 H SER 6 -18.595 -2.828 -1.614 23 HA SER 6 HA SER 6 -19.423 -3.591 1.089 24 HB2 SER 6 1HB SER 6 -20.658 -3.806 -1.624 25 HB3 SER 6 2HB SER 6 -21.127 -4.979 -0.394 26 HG SER 6 HG SER 6 -21.249 -2.155 -0.122 27 H GLY 7 H GLY 7 -18.687 -5.385 2.009 28 HA2 GLY 7 1HA GLY 7 -17.563 -7.370 2.292 29 HA3 GLY 7 2HA GLY 7 -18.456 -7.889 0.870 30 H ALA 8 H ALA 8 -15.596 -5.965 1.763 31 HA ALA 8 HA ALA 8 -14.326 -6.769 -0.754 32 HB1 ALA 8 1HB ALA 8 -12.835 -4.947 0.979 33 HB2 ALA 8 2HB ALA 8 -13.238 -4.813 -0.733 34 HB3 ALA 8 3HB ALA 8 -14.416 -4.338 0.490 35 H GLU 9 H GLU 9 -13.808 -8.913 -0.208 36 HA GLU 9 HA GLU 9 -12.209 -9.470 2.129 37 HB2 GLU 9 1HB GLU 9 -13.098 -11.184 -0.192 38 HB3 GLU 9 2HB GLU 9 -12.109 -11.786 1.130 39 HG2 GLU 9 1HG GLU 9 -14.741 -10.461 1.651 40 HG3 GLU 9 2HG GLU 9 -14.644 -12.166 1.213 41 H PHE 10 H PHE 10 -11.700 -8.967 -1.295 42 HA PHE 10 HA PHE 10 -9.110 -9.996 -1.536 43 HB2 PHE 10 1HB PHE 10 -10.779 -9.054 -3.331 44 HB3 PHE 10 2HB PHE 10 -9.928 -7.540 -3.043 45 HD1 PHE 10 2HD PHE 10 -8.890 -11.109 -3.404 46 HD2 PHE 10 1HD PHE 10 -8.408 -7.080 -4.687 47 HE1 PHE 10 2HE PHE 10 -7.115 -11.819 -4.953 48 HE2 PHE 10 1HE PHE 10 -6.633 -7.783 -6.239 49 HZ PHE 10 HZ PHE 10 -5.983 -10.155 -6.373 50 H TYR 11 H TYR 11 -10.003 -6.553 -1.235 51 HA TYR 11 HA TYR 11 -7.414 -5.629 -0.721 52 HB2 TYR 11 1HB TYR 11 -9.317 -4.187 -1.395 53 HB3 TYR 11 2HB TYR 11 -10.020 -4.401 0.204 54 HD1 TYR 11 2HD TYR 11 -6.828 -3.283 -1.385 55 HD2 TYR 11 1HD TYR 11 -9.596 -2.794 1.809 56 HE1 TYR 11 2HE TYR 11 -5.533 -1.359 -0.565 57 HE2 TYR 11 1HE TYR 11 -8.309 -0.868 2.637 58 HH TYR 11 HH TYR 11 -5.841 -0.085 2.449 59 H ASP 12 H ASP 12 -9.505 -7.420 1.247 60 HA ASP 12 HA ASP 12 -8.354 -6.473 3.750 61 HB2 ASP 12 1HB ASP 12 -10.642 -8.216 2.987 62 HB3 ASP 12 2HB ASP 12 -9.879 -8.520 4.545 63 H LYS 13 H LYS 13 -7.895 -8.959 1.433 64 HA LYS 13 HA LYS 13 -6.460 -10.699 3.270 65 HB2 LYS 13 1HB LYS 13 -7.100 -10.883 0.328 66 HB3 LYS 13 2HB LYS 13 -6.067 -12.046 1.148 67 HG2 LYS 13 1HG LYS 13 -8.789 -11.477 2.226 68 HG3 LYS 13 2HG LYS 13 -8.599 -12.539 0.829 69 HD2 LYS 13 1HD LYS 13 -6.983 -12.951 3.322 70 HD3 LYS 13 2HD LYS 13 -8.622 -13.592 3.181 71 HE2 LYS 13 1HE LYS 13 -6.631 -14.116 1.016 72 HE3 LYS 13 2HE LYS 13 -6.568 -15.059 2.505 73 HZ1 LYS 13 3HZ LYS 13 -8.521 -15.112 0.359 74 HZ2 LYS 13 1HZ LYS 13 -9.160 -15.216 1.923 75 HZ3 LYS 13 2HZ LYS 13 -8.018 -16.348 1.399 76 H GLN 14 H GLN 14 -5.818 -8.200 0.975 77 HA GLN 14 HA GLN 14 -3.000 -8.876 0.749 78 HB2 GLN 14 1HB GLN 14 -2.852 -7.013 -0.786 79 HB3 GLN 14 2HB GLN 14 -4.248 -7.999 -1.203 80 HG2 GLN 14 1HG GLN 14 -5.021 -5.821 -1.396 81 HG3 GLN 14 2HG GLN 14 -5.606 -6.339 0.185 82 HE21 GLN 14 1HE2 GLN 14 -5.792 -4.092 0.690 83 HE22 GLN 14 2HE2 GLN 14 -4.400 -3.193 1.179 84 H LEU 15 H LEU 15 -5.048 -6.419 2.243 85 HA LEU 15 HA LEU 15 -2.954 -4.778 3.198 86 HB2 LEU 15 1HB LEU 15 -4.575 -3.551 4.231 87 HB3 LEU 15 2HB LEU 15 -5.535 -4.379 3.007 88 HG LEU 15 HG LEU 15 -6.089 -6.079 4.822 89 HD11 LEU 15 1HD1 LEU 15 -4.263 -4.460 6.262 90 HD12 LEU 15 2HD1 LEU 15 -5.150 -5.879 6.817 91 HD13 LEU 15 3HD1 LEU 15 -5.855 -4.273 6.999 92 HD21 LEU 15 3HD2 LEU 15 -7.703 -4.463 4.015 93 HD22 LEU 15 1HD2 LEU 15 -7.041 -3.230 5.087 94 HD23 LEU 15 2HD2 LEU 15 -7.851 -4.643 5.763 95 H LYS 16 H LYS 16 -4.764 -7.447 4.664 96 HA LYS 16 HA LYS 16 -3.753 -7.335 7.241 97 HB2 LYS 16 1HB LYS 16 -4.468 -9.576 7.503 98 HB3 LYS 16 2HB LYS 16 -5.571 -8.860 6.335 99 HG2 LYS 16 1HG LYS 16 -4.427 -9.941 4.517 100 HG3 LYS 16 2HG LYS 16 -3.190 -10.557 5.615 101 HD2 LYS 16 1HD LYS 16 -4.917 -11.858 6.794 102 HD3 LYS 16 2HD LYS 16 -6.124 -11.270 5.647 103 HE2 LYS 16 1HE LYS 16 -5.463 -13.440 4.928 104 HE3 LYS 16 2HE LYS 16 -4.738 -12.278 3.818 105 HZ1 LYS 16 3HZ LYS 16 -2.858 -12.593 5.761 106 HZ2 LYS 16 1HZ LYS 16 -2.837 -13.324 4.236 107 HZ3 LYS 16 2HZ LYS 16 -3.471 -14.157 5.564 108 H VAL 17 H VAL 17 -2.285 -8.575 4.314 109 HA VAL 17 HA VAL 17 -0.104 -9.881 5.632 110 HB VAL 17 HB VAL 17 -0.386 -9.013 2.751 111 HG11 VAL 17 1HG1 VAL 17 1.391 -11.247 3.365 112 HG12 VAL 17 2HG1 VAL 17 1.639 -9.856 2.307 113 HG13 VAL 17 3HG1 VAL 17 1.930 -9.710 4.041 114 HG21 VAL 17 3HG2 VAL 17 -1.504 -10.914 2.325 115 HG22 VAL 17 1HG2 VAL 17 -0.518 -11.860 3.440 116 HG23 VAL 17 2HG2 VAL 17 -1.861 -10.895 4.052 117 H LEU 18 H LEU 18 -0.587 -6.745 4.077 118 HA LEU 18 HA LEU 18 2.074 -5.859 4.155 119 HB2 LEU 18 1HB LEU 18 -0.580 -4.491 4.047 120 HB3 LEU 18 2HB LEU 18 0.889 -3.541 4.263 121 HG LEU 18 HG LEU 18 0.505 -5.430 1.952 122 HD11 LEU 18 1HD1 LEU 18 -0.216 -2.514 2.163 123 HD12 LEU 18 2HD1 LEU 18 -1.286 -3.862 1.779 124 HD13 LEU 18 3HD1 LEU 18 -0.032 -3.380 0.637 125 HD21 LEU 18 3HD2 LEU 18 2.381 -4.441 1.032 126 HD22 LEU 18 1HD2 LEU 18 2.794 -4.494 2.746 127 HD23 LEU 18 2HD2 LEU 18 2.230 -2.988 2.021 128 H LEU 19 H LEU 19 -0.596 -5.007 6.368 129 HA LEU 19 HA LEU 19 0.808 -3.576 8.236 130 HB2 LEU 19 1HB LEU 19 -1.450 -5.517 8.704 131 HB3 LEU 19 2HB LEU 19 -0.886 -4.334 9.883 132 HG LEU 19 HG LEU 19 -2.126 -3.698 7.206 133 HD11 LEU 19 1HD1 LEU 19 -3.999 -4.229 8.330 134 HD12 LEU 19 2HD1 LEU 19 -3.768 -2.645 9.069 135 HD13 LEU 19 3HD1 LEU 19 -3.220 -4.096 9.907 136 HD21 LEU 19 3HD2 LEU 19 -1.360 -1.631 7.451 137 HD22 LEU 19 1HD2 LEU 19 -0.449 -2.152 8.869 138 HD23 LEU 19 2HD2 LEU 19 -2.088 -1.525 9.055 139 H SER 20 H SER 20 0.084 -7.061 8.518 140 HA SER 20 HA SER 20 1.384 -7.803 10.722 141 HB2 SER 20 1HB SER 20 0.339 -9.292 8.900 142 HB3 SER 20 2HB SER 20 1.948 -9.320 8.178 143 HG SER 20 HG SER 20 2.687 -10.486 9.818 144 H GLY 21 H GLY 21 2.998 -7.025 7.665 145 HA2 GLY 21 1HA GLY 21 5.124 -6.128 7.377 146 HA3 GLY 21 2HA GLY 21 5.400 -6.301 9.104 147 H ALA 22 H ALA 22 6.890 -7.084 6.529 148 HA ALA 22 HA ALA 22 7.602 -9.775 7.470 149 HB1 ALA 22 1HB ALA 22 8.025 -9.838 4.717 150 HB2 ALA 22 2HB ALA 22 6.769 -10.684 5.621 151 HB3 ALA 22 3HB ALA 22 6.436 -9.100 4.920 152 H THR 23 H THR 23 9.719 -10.486 6.324 153 HA THR 23 HA THR 23 11.646 -8.363 6.784 154 HB THR 23 HB THR 23 12.264 -11.220 6.037 155 HG1 THR 23 1HG THR 23 12.539 -11.246 8.503 156 HG21 THR 23 3HG2 THR 23 14.410 -10.804 6.737 157 HG22 THR 23 1HG2 THR 23 13.918 -9.530 7.851 158 HG23 THR 23 2HG2 THR 23 13.979 -9.211 6.117 159 H PHE 24 H PHE 24 13.200 -7.680 5.296 160 HA PHE 24 HA PHE 24 13.146 -8.663 2.580 161 HB2 PHE 24 1HB PHE 24 12.495 -5.752 3.027 162 HB3 PHE 24 2HB PHE 24 12.455 -6.650 1.513 163 HD1 PHE 24 2HD PHE 24 10.660 -8.301 1.107 164 HD2 PHE 24 1HD PHE 24 10.652 -5.749 4.513 165 HE1 PHE 24 2HE PHE 24 8.269 -8.771 1.448 166 HE2 PHE 24 1HE PHE 24 8.261 -6.215 4.861 167 HZ PHE 24 HZ PHE 24 7.066 -7.726 3.327 168 H LEU 25 H LEU 25 14.857 -7.779 1.267 169 HA LEU 25 HA LEU 25 17.126 -6.924 2.901 170 HB2 LEU 25 1HB LEU 25 16.860 -8.163 0.185 171 HB3 LEU 25 2HB LEU 25 18.366 -7.400 0.692 172 HG LEU 25 HG LEU 25 17.039 -9.732 2.074 173 HD11 LEU 25 1HD1 LEU 25 18.658 -9.627 -0.262 174 HD12 LEU 25 2HD1 LEU 25 18.029 -11.039 0.586 175 HD13 LEU 25 3HD1 LEU 25 19.593 -10.363 1.039 176 HD21 LEU 25 3HD2 LEU 25 19.383 -9.828 3.129 177 HD22 LEU 25 1HD2 LEU 25 18.244 -8.621 3.727 178 HD23 LEU 25 2HD2 LEU 25 19.526 -8.147 2.612 179 H VAL 26 H VAL 26 17.239 -4.776 3.112 180 HA VAL 26 HA VAL 26 16.549 -3.048 0.862 181 HB VAL 26 HB VAL 26 17.342 -2.267 3.670 182 HG11 VAL 26 1HG1 VAL 26 17.379 -0.184 2.908 183 HG12 VAL 26 2HG1 VAL 26 17.008 -0.758 1.281 184 HG13 VAL 26 3HG1 VAL 26 15.701 -0.346 2.392 185 HG21 VAL 26 3HG2 VAL 26 15.240 -3.660 3.451 186 HG22 VAL 26 1HG2 VAL 26 15.047 -2.078 4.207 187 HG23 VAL 26 2HG2 VAL 26 14.557 -2.319 2.530 188 H THR 27 H THR 27 18.004 -2.030 -0.365 189 HA THR 27 HA THR 27 20.820 -2.055 0.509 190 HB THR 27 HB THR 27 20.137 -2.044 -2.401 191 HG1 THR 27 1HG THR 27 20.420 -4.472 -2.111 192 HG21 THR 27 3HG2 THR 27 22.391 -3.333 -0.861 193 HG22 THR 27 1HG2 THR 27 22.463 -1.720 -1.568 194 HG23 THR 27 2HG2 THR 27 22.278 -3.132 -2.609 195 H PHE 28 H PHE 28 21.315 -0.030 1.061 196 HA PHE 28 HA PHE 28 20.049 2.246 -0.150 197 HB2 PHE 28 1HB PHE 28 22.370 2.083 1.784 198 HB3 PHE 28 2HB PHE 28 21.532 3.563 1.327 199 HD1 PHE 28 2HD PHE 28 18.854 3.327 1.602 200 HD2 PHE 28 1HD PHE 28 21.797 1.179 3.801 201 HE1 PHE 28 2HE PHE 28 17.231 2.968 3.416 202 HE2 PHE 28 1HE PHE 28 20.179 0.815 5.618 203 HZ PHE 28 HZ PHE 28 17.893 1.711 5.428 204 H GLY 29 H GLY 29 20.874 3.672 -1.618 205 HA2 GLY 29 1HA GLY 29 22.440 2.979 -3.674 206 HA3 GLY 29 2HA GLY 29 22.418 4.628 -3.069 207 H ASN 30 H ASN 30 23.681 4.178 -0.585 208 HA ASN 30 HA ASN 30 26.414 4.127 -1.459 209 HB2 ASN 30 1HB ASN 30 25.487 5.646 0.338 210 HB3 ASN 30 2HB ASN 30 25.409 4.234 1.388 211 HD21 ASN 30 1HD2 ASN 30 27.238 3.463 2.314 212 HD22 ASN 30 2HD2 ASN 30 28.784 4.220 2.165 213 H SER 31 H SER 31 24.342 2.050 0.517 214 HA SER 31 HA SER 31 26.415 0.200 1.173 215 HB2 SER 31 1HB SER 31 23.429 -0.284 1.232 216 HB3 SER 31 2HB SER 31 24.668 -1.155 2.136 217 HG SER 31 HG SER 31 24.638 0.362 3.586 218 H GLU 32 H GLU 32 27.308 -1.231 -0.143 219 HA GLU 32 HA GLU 32 26.074 -1.864 -2.683 220 HB2 GLU 32 1HB GLU 32 28.153 -2.975 -3.218 221 HB3 GLU 32 2HB GLU 32 28.502 -1.407 -2.504 222 HG2 GLU 32 1HG GLU 32 29.109 -2.403 -0.427 223 HG3 GLU 32 2HG GLU 32 28.538 -3.984 -0.957 224 H LYS 33 H LYS 33 26.331 -3.259 0.442 225 HA LYS 33 HA LYS 33 25.391 -5.853 -0.585 226 HB2 LYS 33 1HB LYS 33 27.296 -6.333 0.661 227 HB3 LYS 33 2HB LYS 33 26.963 -5.074 1.843 228 HG2 LYS 33 1HG LYS 33 25.556 -6.387 3.057 229 HG3 LYS 33 2HG LYS 33 25.054 -7.337 1.657 230 HD2 LYS 33 1HD LYS 33 27.554 -8.139 1.704 231 HD3 LYS 33 2HD LYS 33 27.464 -7.630 3.392 232 HE2 LYS 33 1HE LYS 33 25.649 -9.130 3.814 233 HE3 LYS 33 2HE LYS 33 25.497 -9.512 2.100 234 HZ1 LYS 33 3HZ LYS 33 27.847 -10.158 3.798 235 HZ2 LYS 33 1HZ LYS 33 27.663 -10.557 2.164 236 HZ3 LYS 33 2HZ LYS 33 26.651 -11.257 3.325 237 HA PRO 34 HA PRO 34 21.417 -4.882 1.093 238 HB2 PRO 34 1HB PRO 34 20.359 -7.379 0.962 239 HB3 PRO 34 2HB PRO 34 20.582 -6.354 -0.461 240 HG2 PRO 34 1HG PRO 34 22.294 -8.593 0.546 241 HG3 PRO 34 2HG PRO 34 21.797 -8.225 -1.116 242 HD2 PRO 34 1HD PRO 34 24.242 -7.579 -0.149 243 HD3 PRO 34 2HD PRO 34 23.408 -6.597 -1.370 244 H GLU 35 H GLU 35 20.397 -4.958 3.052 245 HA GLU 35 HA GLU 35 21.511 -6.790 5.072 246 HB2 GLU 35 1HB GLU 35 21.135 -3.848 5.142 247 HB3 GLU 35 2HB GLU 35 20.738 -4.728 6.611 248 HG2 GLU 35 1HG GLU 35 22.894 -5.302 7.022 249 HG3 GLU 35 2HG GLU 35 23.327 -5.342 5.314 250 H THR 36 H THR 36 20.090 -7.524 6.687 251 HA THR 36 HA THR 36 17.421 -7.952 5.813 252 HB THR 36 HB THR 36 18.486 -8.450 8.594 253 HG1 THR 36 1HG THR 36 18.576 -10.184 6.331 254 HG21 THR 36 3HG2 THR 36 16.804 -10.187 8.678 255 HG22 THR 36 1HG2 THR 36 16.337 -9.862 7.010 256 HG23 THR 36 2HG2 THR 36 16.038 -8.655 8.261 257 H MET 37 H MET 37 15.885 -6.451 5.862 258 HA MET 37 HA MET 37 15.610 -4.816 8.289 259 HB2 MET 37 1HB MET 37 15.555 -3.892 5.425 260 HB3 MET 37 2HB MET 37 14.773 -2.974 6.705 261 HG2 MET 37 1HG MET 37 16.979 -2.922 7.888 262 HG3 MET 37 2HG MET 37 17.694 -3.622 6.437 263 HE1 MET 37 3HE MET 37 16.901 0.707 7.272 264 HE2 MET 37 1HE MET 37 15.942 -0.553 8.049 265 HE3 MET 37 2HE MET 37 17.696 -0.541 8.234 266 H THR 38 H THR 38 13.476 -4.176 8.806 267 HA THR 38 HA THR 38 11.437 -5.931 7.631 268 HB THR 38 HB THR 38 11.285 -4.375 10.219 269 HG1 THR 38 1HG THR 38 11.437 -6.910 10.759 270 HG21 THR 38 3HG2 THR 38 9.510 -6.360 8.853 271 HG22 THR 38 1HG2 THR 38 9.087 -4.846 9.651 272 HG23 THR 38 2HG2 THR 38 9.525 -6.257 10.614 273 H CYS 39 H CYS 39 9.909 -5.117 6.361 274 HA CYS 39 HA CYS 39 9.437 -2.210 6.430 275 HB2 CYS 39 1HB CYS 39 10.457 -3.336 4.323 276 HB3 CYS 39 2HB CYS 39 8.826 -3.935 4.047 277 HG CYS 39 HG CYS 39 9.011 -1.784 2.395 278 H ARG 40 H ARG 40 7.532 -1.647 7.226 279 HA ARG 40 HA ARG 40 5.190 -3.308 6.640 280 HB2 ARG 40 1HB ARG 40 4.431 -3.316 8.896 281 HB3 ARG 40 2HB ARG 40 6.105 -3.854 8.925 282 HG2 ARG 40 1HG ARG 40 6.763 -1.525 9.533 283 HG3 ARG 40 2HG ARG 40 5.047 -1.144 9.685 284 HD2 ARG 40 1HD ARG 40 4.842 -2.947 11.369 285 HD3 ARG 40 2HD ARG 40 6.582 -3.208 11.259 286 HE ARG 40 HE ARG 40 6.049 -0.500 11.846 287 HH11 ARG 40 1HH1 ARG 40 5.973 -3.664 13.296 288 HH12 ARG 40 2HH1 ARG 40 6.235 -3.076 14.904 289 HH21 ARG 40 1HH2 ARG 40 6.394 0.286 13.959 290 HH22 ARG 40 2HH2 ARG 40 6.473 -0.829 15.281 291 H LEU 41 H LEU 41 3.137 -2.163 7.041 292 HA LEU 41 HA LEU 41 3.442 0.696 6.440 293 HB2 LEU 41 1HB LEU 41 1.462 -1.386 5.698 294 HB3 LEU 41 2HB LEU 41 0.877 0.267 5.880 295 HG LEU 41 HG LEU 41 3.194 -0.393 4.087 296 HD11 LEU 41 1HD1 LEU 41 1.615 -0.502 2.224 297 HD12 LEU 41 2HD1 LEU 41 0.269 -0.401 3.358 298 HD13 LEU 41 3HD1 LEU 41 1.339 -1.803 3.383 299 HD21 LEU 41 3HD2 LEU 41 3.199 1.814 3.850 300 HD22 LEU 41 1HD2 LEU 41 1.748 1.972 4.841 301 HD23 LEU 41 2HD2 LEU 41 1.604 1.693 3.105 302 H SER 42 H SER 42 2.673 2.220 7.774 303 HA SER 42 HA SER 42 1.932 1.588 10.413 304 HB2 SER 42 1HB SER 42 2.960 3.768 9.476 305 HB3 SER 42 2HB SER 42 1.296 4.230 9.115 306 HG SER 42 HG SER 42 1.998 4.956 11.184 307 H ASN 43 H ASN 43 -0.123 2.642 11.403 308 HA ASN 43 HA ASN 43 -2.339 1.180 10.640 309 HB2 ASN 43 1HB ASN 43 -2.589 3.867 11.978 310 HB3 ASN 43 2HB ASN 43 -3.575 2.427 12.218 311 HD21 ASN 43 1HD2 ASN 43 -0.464 3.899 12.833 312 HD22 ASN 43 2HD2 ASN 43 -0.038 2.892 14.171 313 H ASN 44 H ASN 44 -1.404 4.451 9.695 314 HA ASN 44 HA ASN 44 -3.798 4.955 8.211 315 HB2 ASN 44 1HB ASN 44 -1.151 6.378 7.910 316 HB3 ASN 44 2HB ASN 44 -2.755 6.998 7.531 317 HD21 ASN 44 1HD2 ASN 44 -0.380 6.547 9.938 318 HD22 ASN 44 2HD2 ASN 44 -1.236 7.284 11.246 319 H GLN 45 H GLN 45 -0.924 3.229 7.601 320 HA GLN 45 HA GLN 45 -0.050 2.215 5.760 321 HB2 GLN 45 1HB GLN 45 -2.907 2.445 4.799 322 HB3 GLN 45 2HB GLN 45 -1.677 1.413 4.082 323 HG2 GLN 45 1HG GLN 45 -1.554 0.071 6.050 324 HG3 GLN 45 2HG GLN 45 -2.593 1.186 6.936 325 HE21 GLN 45 1HE2 GLN 45 -3.182 -1.481 6.813 326 HE22 GLN 45 2HE2 GLN 45 -4.598 -1.722 5.853 327 H ARG 46 H ARG 46 0.293 4.994 5.845 328 HA ARG 46 HA ARG 46 0.195 5.674 2.979 329 HB2 ARG 46 1HB ARG 46 -0.415 7.296 5.396 330 HB3 ARG 46 2HB ARG 46 0.404 8.105 4.067 331 HG2 ARG 46 1HG ARG 46 -1.463 7.123 2.596 332 HG3 ARG 46 2HG ARG 46 -2.313 6.856 4.120 333 HD2 ARG 46 1HD ARG 46 -1.832 9.322 4.604 334 HD3 ARG 46 2HD ARG 46 -1.426 9.450 2.893 335 HE ARG 46 HE ARG 46 -3.965 8.232 3.253 336 HH11 ARG 46 1HH1 ARG 46 -2.335 11.307 3.336 337 HH12 ARG 46 2HH1 ARG 46 -3.756 12.217 2.941 338 HH21 ARG 46 1HH2 ARG 46 -5.842 9.419 2.733 339 HH22 ARG 46 2HH2 ARG 46 -5.750 11.143 2.600 340 H TYR 47 H TYR 47 2.104 5.269 5.790 341 HA TYR 47 HA TYR 47 4.458 6.290 4.342 342 HB2 TYR 47 1HB TYR 47 4.066 6.306 7.340 343 HB3 TYR 47 2HB TYR 47 5.447 6.949 6.460 344 HD1 TYR 47 1HD TYR 47 5.131 8.960 4.992 345 HD2 TYR 47 2HD TYR 47 2.109 7.599 7.661 346 HE1 TYR 47 1HE TYR 47 4.023 11.151 4.846 347 HE2 TYR 47 2HE TYR 47 0.993 9.786 7.521 348 HH TYR 47 HH TYR 47 0.870 11.709 6.180 349 H LEU 48 H LEU 48 6.272 5.029 4.323 350 HA LEU 48 HA LEU 48 5.935 2.299 5.341 351 HB2 LEU 48 1HB LEU 48 7.632 3.492 3.172 352 HB3 LEU 48 2HB LEU 48 7.944 1.878 3.808 353 HG LEU 48 HG LEU 48 5.326 2.712 2.567 354 HD11 LEU 48 1HD1 LEU 48 7.866 1.971 1.342 355 HD12 LEU 48 2HD1 LEU 48 6.431 2.704 0.628 356 HD13 LEU 48 3HD1 LEU 48 6.517 0.955 0.835 357 HD21 LEU 48 3HD2 LEU 48 6.189 -0.097 2.623 358 HD22 LEU 48 1HD2 LEU 48 4.605 0.614 2.934 359 HD23 LEU 48 2HD2 LEU 48 5.834 0.611 4.199 360 H PHE 49 H PHE 49 7.225 1.467 6.873 361 HA PHE 49 HA PHE 49 9.428 3.160 7.851 362 HB2 PHE 49 1HB PHE 49 7.861 1.099 9.413 363 HB3 PHE 49 2HB PHE 49 9.063 2.215 10.052 364 HD1 PHE 49 1HD PHE 49 8.132 4.640 8.445 365 HD2 PHE 49 2HD PHE 49 6.047 1.760 10.785 366 HE1 PHE 49 1HE PHE 49 6.362 6.290 8.893 367 HE2 PHE 49 2HE PHE 49 4.274 3.404 11.235 368 HZ PHE 49 HZ PHE 49 4.429 5.673 10.289 369 H LEU 50 H LEU 50 11.337 2.115 8.625 370 HA LEU 50 HA LEU 50 11.712 -0.649 7.705 371 HB2 LEU 50 1HB LEU 50 13.729 1.545 7.280 372 HB3 LEU 50 2HB LEU 50 13.829 -0.122 6.716 373 HG LEU 50 HG LEU 50 11.720 1.802 5.759 374 HD11 LEU 50 1HD1 LEU 50 13.747 1.282 3.812 375 HD12 LEU 50 2HD1 LEU 50 14.484 1.963 5.262 376 HD13 LEU 50 3HD1 LEU 50 13.181 2.827 4.447 377 HD21 LEU 50 3HD2 LEU 50 10.931 -0.174 5.022 378 HD22 LEU 50 1HD2 LEU 50 12.490 -0.981 5.191 379 HD23 LEU 50 2HD2 LEU 50 12.164 0.021 3.776 380 H ASP 51 H ASP 51 12.819 -1.923 9.074 381 HA ASP 51 HA ASP 51 14.088 -0.631 11.400 382 HB2 ASP 51 1HB ASP 51 11.924 -2.115 11.642 383 HB3 ASP 51 2HB ASP 51 13.075 -3.444 11.523 384 H GLY 52 H GLY 52 16.156 -1.121 11.844 385 HA2 GLY 52 1HA GLY 52 17.566 -3.405 11.598 386 HA3 GLY 52 2HA GLY 52 17.595 -2.779 9.956 387 H ASP 53 H ASP 53 19.602 -2.052 9.647 388 HA ASP 53 HA ASP 53 21.529 -1.265 11.321 389 HB2 ASP 53 1HB ASP 53 22.567 -0.165 9.562 390 HB3 ASP 53 2HB ASP 53 21.423 -1.198 8.709 391 H SER 54 H SER 54 18.891 0.845 10.240 392 HA SER 54 HA SER 54 19.135 2.400 12.674 393 HB2 SER 54 1HB SER 54 19.606 3.603 9.942 394 HB3 SER 54 2HB SER 54 19.189 4.565 11.359 395 HG SER 54 HG SER 54 21.553 4.026 10.703 396 H HIS 55 H HIS 55 17.462 4.372 12.393 397 HA HIS 55 HA HIS 55 14.929 3.069 11.829 398 HB2 HIS 55 1HB HIS 55 15.736 5.593 13.240 399 HB3 HIS 55 2HB HIS 55 14.061 5.347 12.752 400 HD2 HIS 55 2HD HIS 55 16.598 4.040 15.392 401 HE1 HIS 55 1HE HIS 55 12.825 2.263 16.173 402 HE2 HIS 55 2HE HIS 55 15.151 2.678 17.048 403 H TYR 56 H TYR 56 15.030 2.999 9.541 404 HA TYR 56 HA TYR 56 15.039 5.556 8.128 405 HB2 TYR 56 1HB TYR 56 15.438 2.711 7.351 406 HB3 TYR 56 2HB TYR 56 14.767 3.796 6.138 407 HD1 TYR 56 2HD TYR 56 17.716 3.002 8.163 408 HD2 TYR 56 1HD TYR 56 16.101 5.586 5.193 409 HE1 TYR 56 2HE TYR 56 19.980 3.807 7.640 410 HE2 TYR 56 1HE TYR 56 18.361 6.397 4.661 411 HH TYR 56 HH TYR 56 21.223 5.009 6.209 412 H GLU 57 H GLU 57 13.334 6.284 6.868 413 HA GLU 57 HA GLU 57 10.848 4.766 6.850 414 HB2 GLU 57 1HB GLU 57 11.068 7.539 8.036 415 HB3 GLU 57 2HB GLU 57 9.554 6.717 7.683 416 HG2 GLU 57 1HG GLU 57 9.793 6.299 9.921 417 HG3 GLU 57 2HG GLU 57 10.516 4.853 9.216 418 H ILE 58 H ILE 58 10.000 4.867 4.885 419 HA ILE 58 HA ILE 58 10.695 7.161 3.174 420 HB ILE 58 HB ILE 58 9.985 4.335 2.382 421 HG12 ILE 58 1HG1 ILE 58 12.541 5.708 1.667 422 HG13 ILE 58 2HG1 ILE 58 12.352 5.082 3.301 423 HG21 ILE 58 1HG2 ILE 58 9.575 5.019 0.304 424 HG22 ILE 58 2HG2 ILE 58 9.517 6.661 0.943 425 HG23 ILE 58 3HG2 ILE 58 11.022 6.026 0.277 426 HD11 ILE 58 3HD1 ILE 58 12.490 3.614 0.714 427 HD12 ILE 58 1HD1 ILE 58 13.361 3.327 2.220 428 HD13 ILE 58 2HD1 ILE 58 11.655 2.894 2.090 429 H GLU 59 H GLU 59 9.020 8.548 3.442 430 HA GLU 59 HA GLU 59 6.317 7.763 3.750 431 HB2 GLU 59 1HB GLU 59 5.873 10.212 3.184 432 HB3 GLU 59 2HB GLU 59 6.870 9.888 4.595 433 HG2 GLU 59 1HG GLU 59 8.214 10.321 1.981 434 HG3 GLU 59 2HG GLU 59 7.536 11.712 2.825 435 H ILE 60 H ILE 60 4.836 7.205 2.293 436 HA ILE 60 HA ILE 60 5.450 6.727 -0.390 437 HB ILE 60 HB ILE 60 2.692 7.133 0.769 438 HG12 ILE 60 1HG1 ILE 60 4.320 4.592 0.538 439 HG13 ILE 60 2HG1 ILE 60 4.034 5.475 2.034 440 HG21 ILE 60 1HG2 ILE 60 3.402 5.332 -1.514 441 HG22 ILE 60 2HG2 ILE 60 1.838 6.020 -1.081 442 HG23 ILE 60 3HG2 ILE 60 3.090 7.047 -1.780 443 HD11 ILE 60 3HD1 ILE 60 2.334 4.057 2.290 444 HD12 ILE 60 1HD1 ILE 60 1.499 5.092 1.131 445 HD13 ILE 60 2HD1 ILE 60 2.308 3.624 0.580 446 H VAL 61 H VAL 61 4.149 9.552 1.196 447 HA VAL 61 HA VAL 61 3.004 10.930 -0.904 448 HB VAL 61 HB VAL 61 3.649 13.015 0.284 449 HG11 VAL 61 1HG1 VAL 61 2.792 11.346 2.529 450 HG12 VAL 61 2HG1 VAL 61 1.979 12.702 1.746 451 HG13 VAL 61 3HG1 VAL 61 1.874 11.086 1.047 452 HG21 VAL 61 3HG2 VAL 61 4.695 12.035 2.681 453 HG22 VAL 61 1HG2 VAL 61 5.638 11.260 1.408 454 HG23 VAL 61 2HG2 VAL 61 5.528 13.019 1.478 455 H HIS 62 H HIS 62 6.363 10.300 -0.268 456 HA HIS 62 HA HIS 62 7.245 12.214 -2.282 457 HB2 HIS 62 1HB HIS 62 8.574 10.578 -0.180 458 HB3 HIS 62 2HB HIS 62 9.523 10.995 -1.603 459 HD2 HIS 62 2HD HIS 62 9.267 12.354 1.727 460 HE1 HIS 62 1HE HIS 62 9.362 15.838 -0.692 461 HE2 HIS 62 2HE HIS 62 9.694 14.903 1.623 462 H ILE 63 H ILE 63 7.270 8.712 -1.713 463 HA ILE 63 HA ILE 63 8.648 7.763 -3.849 464 HB ILE 63 HB ILE 63 5.998 6.645 -2.927 465 HG12 ILE 63 1HG1 ILE 63 8.809 6.156 -1.919 466 HG13 ILE 63 2HG1 ILE 63 7.507 6.950 -1.039 467 HG21 ILE 63 1HG2 ILE 63 8.269 5.034 -4.009 468 HG22 ILE 63 2HG2 ILE 63 6.549 4.651 -3.954 469 HG23 ILE 63 3HG2 ILE 63 7.152 5.838 -5.111 470 HD11 ILE 63 3HD1 ILE 63 7.977 4.081 -1.559 471 HD12 ILE 63 1HD1 ILE 63 7.344 4.890 -0.126 472 HD13 ILE 63 2HD1 ILE 63 6.303 4.634 -1.527 473 H SER 64 H SER 64 8.498 7.822 -5.997 474 HA SER 64 HA SER 64 6.033 8.911 -7.177 475 HB2 SER 64 1HB SER 64 8.925 9.121 -7.912 476 HB3 SER 64 2HB SER 64 7.716 9.227 -9.191 477 HG SER 64 HG SER 64 8.488 11.185 -7.754 478 H THR 65 H THR 65 8.612 6.542 -7.812 479 HA THR 65 HA THR 65 6.770 5.093 -9.585 480 HB THR 65 HB THR 65 9.750 4.677 -9.301 481 HG1 THR 65 1HG THR 65 8.476 6.002 -11.457 482 HG21 THR 65 3HG2 THR 65 7.841 3.049 -10.435 483 HG22 THR 65 1HG2 THR 65 9.561 3.039 -10.822 484 HG23 THR 65 2HG2 THR 65 8.440 3.973 -11.812 485 H VAL 66 H VAL 66 5.998 3.144 -9.046 486 HA VAL 66 HA VAL 66 7.271 1.676 -6.840 487 HB VAL 66 HB VAL 66 4.294 2.115 -7.116 488 HG11 VAL 66 1HG1 VAL 66 5.643 0.813 -4.784 489 HG12 VAL 66 2HG1 VAL 66 3.963 0.699 -5.312 490 HG13 VAL 66 3HG1 VAL 66 5.231 -0.129 -6.217 491 HG21 VAL 66 3HG2 VAL 66 6.169 3.824 -6.030 492 HG22 VAL 66 1HG2 VAL 66 4.441 3.816 -5.678 493 HG23 VAL 66 2HG2 VAL 66 5.558 2.940 -4.631 494 H GLN 67 H GLN 67 8.057 -0.020 -7.963 495 HA GLN 67 HA GLN 67 6.111 -1.657 -9.438 496 HB2 GLN 67 1HB GLN 67 7.563 -2.030 -11.227 497 HB3 GLN 67 2HB GLN 67 7.762 -0.314 -10.895 498 HG2 GLN 67 1HG GLN 67 9.838 -0.670 -9.817 499 HG3 GLN 67 2HG GLN 67 9.597 -2.416 -9.786 500 HE21 GLN 67 1HE2 GLN 67 11.765 -0.774 -10.917 501 HE22 GLN 67 2HE2 GLN 67 11.871 -1.230 -12.580 502 H ILE 68 H ILE 68 6.705 -3.935 -9.598 503 HA ILE 68 HA ILE 68 8.187 -4.796 -7.211 504 HB ILE 68 HB ILE 68 6.052 -6.188 -8.823 505 HG12 ILE 68 1HG1 ILE 68 6.059 -5.566 -5.876 506 HG13 ILE 68 2HG1 ILE 68 5.499 -4.395 -7.064 507 HG21 ILE 68 1HG2 ILE 68 6.441 -7.799 -6.684 508 HG22 ILE 68 2HG2 ILE 68 7.155 -8.069 -8.273 509 HG23 ILE 68 3HG2 ILE 68 8.093 -7.274 -7.008 510 HD11 ILE 68 3HD1 ILE 68 4.374 -7.165 -6.974 511 HD12 ILE 68 1HD1 ILE 68 3.773 -5.891 -5.913 512 HD13 ILE 68 2HD1 ILE 68 3.674 -5.701 -7.663 513 H LEU 69 H LEU 69 9.904 -6.146 -7.346 514 HA LEU 69 HA LEU 69 11.001 -6.618 -10.002 515 HB2 LEU 69 1HB LEU 69 12.157 -6.992 -7.245 516 HB3 LEU 69 2HB LEU 69 13.022 -7.345 -8.739 517 HG LEU 69 HG LEU 69 11.985 -4.611 -8.008 518 HD11 LEU 69 1HD1 LEU 69 14.060 -5.966 -6.766 519 HD12 LEU 69 2HD1 LEU 69 13.782 -4.225 -6.760 520 HD13 LEU 69 3HD1 LEU 69 14.857 -4.942 -7.960 521 HD21 LEU 69 3HD2 LEU 69 13.240 -5.782 -10.355 522 HD22 LEU 69 1HD2 LEU 69 14.117 -4.382 -9.738 523 HD23 LEU 69 2HD2 LEU 69 12.412 -4.236 -10.165 524 H THR 70 H THR 70 10.959 -8.520 -11.003 525 HA THR 70 HA THR 70 10.511 -10.953 -9.413 526 HB THR 70 HB THR 70 9.028 -11.821 -11.208 527 HG1 THR 70 1HG THR 70 9.578 -9.282 -12.261 528 HG21 THR 70 3HG2 THR 70 7.295 -9.716 -10.679 529 HG22 THR 70 1HG2 THR 70 8.410 -9.714 -9.313 530 HG23 THR 70 2HG2 THR 70 7.502 -11.174 -9.709 531 H GLU 71 H GLU 71 12.093 -12.358 -9.752 532 HA GLU 71 HA GLU 71 13.956 -12.050 -11.897 533 HB2 GLU 71 1HB GLU 71 14.521 -12.904 -9.601 534 HB3 GLU 71 2HB GLU 71 13.684 -14.394 -10.011 535 HG2 GLU 71 1HG GLU 71 15.809 -15.004 -10.513 536 HG3 GLU 71 2HG GLU 71 15.321 -14.345 -12.073 537 H GLY 72 H GLY 72 13.834 -12.857 -13.883 538 HA2 GLY 72 1HA GLY 72 13.246 -14.188 -15.660 539 HA3 GLY 72 2HA GLY 72 12.910 -15.458 -14.493 540 H PHE 73 H PHE 73 11.568 -13.640 -16.867 541 HA PHE 73 HA PHE 73 8.889 -13.672 -15.656 542 HB2 PHE 73 1HB PHE 73 8.279 -11.909 -17.020 543 HB3 PHE 73 2HB PHE 73 9.987 -11.560 -16.776 544 HD1 PHE 73 1HD PHE 73 11.625 -12.280 -18.562 545 HD2 PHE 73 2HD PHE 73 7.412 -12.237 -19.162 546 HE1 PHE 73 1HE PHE 73 11.976 -12.287 -20.997 547 HE2 PHE 73 2HE PHE 73 7.755 -12.245 -21.598 548 HZ PHE 73 HZ PHE 73 10.039 -12.270 -22.519 549 HA PRO 74 HA PRO 74 7.760 -17.100 -18.182 550 HB2 PRO 74 1HB PRO 74 5.064 -16.784 -18.121 551 HB3 PRO 74 2HB PRO 74 5.993 -17.380 -16.740 552 HG2 PRO 74 1HG PRO 74 4.951 -14.625 -17.274 553 HG3 PRO 74 2HG PRO 74 4.941 -15.551 -15.762 554 HD2 PRO 74 1HD PRO 74 6.762 -13.613 -16.272 555 HD3 PRO 74 2HD PRO 74 7.140 -15.044 -15.291 556 HA PRO 75 HA PRO 75 7.151 -15.671 -22.301 557 HB2 PRO 75 1HB PRO 75 5.939 -17.832 -23.411 558 HB3 PRO 75 2HB PRO 75 7.653 -17.808 -22.981 559 HG2 PRO 75 1HG PRO 75 5.340 -18.971 -21.478 560 HG3 PRO 75 2HG PRO 75 6.953 -19.654 -21.752 561 HD2 PRO 75 1HD PRO 75 6.255 -18.453 -19.428 562 HD3 PRO 75 2HD PRO 75 7.908 -18.397 -20.072 563 H GLY 76 H GLY 76 4.408 -16.837 -20.464 564 HA2 GLY 76 1HA GLY 76 2.639 -15.213 -22.187 565 HA3 GLY 76 2HA GLY 76 2.120 -16.708 -21.424 566 H GLY 77 H GLY 77 2.656 -16.623 -18.904 567 HA2 GLY 77 1HA GLY 77 2.790 -14.759 -17.144 568 HA3 GLY 77 2HA GLY 77 1.357 -14.152 -17.960 569 H GLY 78 H GLY 78 1.258 -14.696 -15.283 570 HA2 GLY 78 1HA GLY 78 -0.965 -15.890 -14.653 571 HA3 GLY 78 2HA GLY 78 -0.031 -17.325 -15.048 572 H ASN 79 H ASN 79 2.400 -16.830 -13.963 573 HA ASN 79 HA ASN 79 1.819 -16.391 -11.108 574 HB2 ASN 79 1HB ASN 79 3.615 -18.477 -12.363 575 HB3 ASN 79 2HB ASN 79 3.562 -18.130 -10.637 576 HD21 ASN 79 1HD2 ASN 79 3.077 -20.625 -11.282 577 HD22 ASN 79 2HD2 ASN 79 1.396 -21.011 -11.168 578 H ALA 80 H ALA 80 2.600 -14.316 -10.994 579 HA ALA 80 HA ALA 80 5.333 -13.802 -11.908 580 HB1 ALA 80 1HB ALA 80 4.153 -11.497 -10.727 581 HB2 ALA 80 2HB ALA 80 4.565 -11.785 -12.418 582 HB3 ALA 80 3HB ALA 80 2.975 -12.242 -11.808 583 H ARG 81 H ARG 81 6.395 -15.023 -10.273 584 HA ARG 81 HA ARG 81 6.008 -14.640 -7.511 585 HB2 ARG 81 1HB ARG 81 8.132 -15.844 -9.215 586 HB3 ARG 81 2HB ARG 81 8.544 -15.463 -7.548 587 HG2 ARG 81 1HG ARG 81 7.847 -17.668 -7.439 588 HG3 ARG 81 2HG ARG 81 6.411 -16.768 -6.945 589 HD2 ARG 81 1HD ARG 81 5.771 -18.496 -8.496 590 HD3 ARG 81 2HD ARG 81 5.567 -16.923 -9.264 591 HE ARG 81 HE ARG 81 8.007 -17.602 -10.098 592 HH11 ARG 81 1HH1 ARG 81 5.039 -19.417 -9.988 593 HH12 ARG 81 2HH1 ARG 81 5.431 -20.392 -11.366 594 HH21 ARG 81 1HH2 ARG 81 8.536 -18.880 -11.912 595 HH22 ARG 81 2HH2 ARG 81 7.421 -20.086 -12.459 596 H ALA 82 H ALA 82 6.090 -12.629 -6.691 597 HA ALA 82 HA ALA 82 7.948 -10.647 -7.592 598 HB1 ALA 82 1HB ALA 82 5.958 -10.755 -5.347 599 HB2 ALA 82 2HB ALA 82 7.055 -9.390 -5.557 600 HB3 ALA 82 3HB ALA 82 5.903 -9.799 -6.828 601 H THR 83 H THR 83 9.982 -11.662 -7.280 602 HA THR 83 HA THR 83 10.809 -12.394 -4.607 603 HB THR 83 HB THR 83 12.816 -13.169 -5.543 604 HG1 THR 83 1HG THR 83 13.393 -12.520 -7.753 605 HG21 THR 83 3HG2 THR 83 11.929 -14.811 -6.775 606 HG22 THR 83 1HG2 THR 83 11.446 -13.694 -8.051 607 HG23 THR 83 2HG2 THR 83 10.399 -13.943 -6.654 608 H GLY 84 H GLY 84 10.008 -9.638 -5.009 609 HA2 GLY 84 1HA GLY 84 11.694 -8.229 -3.453 610 HA3 GLY 84 2HA GLY 84 12.446 -8.074 -5.033 611 H MET 85 H MET 85 11.962 -5.745 -4.352 612 HA MET 85 HA MET 85 9.649 -4.891 -5.849 613 HB2 MET 85 1HB MET 85 8.586 -5.194 -3.710 614 HB3 MET 85 2HB MET 85 9.876 -4.323 -2.892 615 HG2 MET 85 1HG MET 85 9.189 -2.259 -3.777 616 HG3 MET 85 2HG MET 85 8.148 -3.029 -4.972 617 HE1 MET 85 3HE MET 85 6.022 -2.046 -4.718 618 HE2 MET 85 1HE MET 85 5.572 -3.731 -4.453 619 HE3 MET 85 2HE MET 85 4.884 -2.464 -3.437 620 H PHE 86 H PHE 86 10.143 -3.103 -6.947 621 HA PHE 86 HA PHE 86 12.490 -1.558 -6.076 622 HB2 PHE 86 1HB PHE 86 12.622 -2.726 -8.296 623 HB3 PHE 86 2HB PHE 86 11.312 -1.693 -8.856 624 HD1 PHE 86 1HD PHE 86 11.676 0.798 -8.908 625 HD2 PHE 86 2HD PHE 86 14.841 -1.985 -8.312 626 HE1 PHE 86 1HE PHE 86 13.310 2.524 -9.544 627 HE2 PHE 86 2HE PHE 86 16.480 -0.263 -8.947 628 HZ PHE 86 HZ PHE 86 15.715 1.995 -9.563 629 H LEU 87 H LEU 87 12.146 0.423 -5.338 630 HA LEU 87 HA LEU 87 9.778 1.894 -6.284 631 HB2 LEU 87 1HB LEU 87 10.845 2.121 -3.487 632 HB3 LEU 87 2HB LEU 87 9.304 2.694 -4.121 633 HG LEU 87 HG LEU 87 9.953 -0.234 -3.938 634 HD11 LEU 87 1HD1 LEU 87 8.211 0.798 -1.858 635 HD12 LEU 87 2HD1 LEU 87 9.853 1.429 -1.742 636 HD13 LEU 87 3HD1 LEU 87 9.577 -0.312 -1.745 637 HD21 LEU 87 3HD2 LEU 87 8.029 -0.281 -5.077 638 HD22 LEU 87 1HD2 LEU 87 7.665 1.406 -4.713 639 HD23 LEU 87 2HD2 LEU 87 7.269 0.146 -3.544 640 H GLN 88 H GLN 88 9.972 4.290 -5.773 641 HA GLN 88 HA GLN 88 12.718 5.266 -5.722 642 HB2 GLN 88 1HB GLN 88 10.795 5.773 -7.994 643 HB3 GLN 88 2HB GLN 88 12.242 6.733 -7.715 644 HG2 GLN 88 1HG GLN 88 13.522 4.535 -7.839 645 HG3 GLN 88 2HG GLN 88 12.039 3.849 -8.500 646 HE21 GLN 88 1HE2 GLN 88 14.018 6.765 -8.947 647 HE22 GLN 88 2HE2 GLN 88 14.009 6.712 -10.674 648 H TYR 89 H TYR 89 12.903 7.115 -4.612 649 HA TYR 89 HA TYR 89 10.558 8.835 -4.279 650 HB2 TYR 89 1HB TYR 89 11.043 9.001 -1.825 651 HB3 TYR 89 2HB TYR 89 10.446 7.426 -2.336 652 HD1 TYR 89 1HD TYR 89 13.573 9.271 -1.527 653 HD2 TYR 89 2HD TYR 89 11.656 5.486 -1.841 654 HE1 TYR 89 1HE TYR 89 15.529 8.201 -0.488 655 HE2 TYR 89 2HE TYR 89 13.606 4.406 -0.802 656 HH TYR 89 HH TYR 89 15.487 5.064 0.712 657 H THR 90 H THR 90 11.167 10.918 -3.168 658 HA THR 90 HA THR 90 13.908 11.706 -3.916 659 HB THR 90 HB THR 90 12.930 14.012 -4.312 660 HG1 THR 90 1HG THR 90 10.579 13.764 -4.928 661 HG21 THR 90 3HG2 THR 90 11.672 12.114 -6.238 662 HG22 THR 90 1HG2 THR 90 13.425 12.091 -6.047 663 HG23 THR 90 2HG2 THR 90 12.611 13.575 -6.547 664 H VAL 91 H VAL 91 15.091 12.745 -2.420 665 HA VAL 91 HA VAL 91 13.829 13.264 0.176 666 HB VAL 91 HB VAL 91 16.788 13.241 -0.391 667 HG11 VAL 91 1HG1 VAL 91 15.493 12.500 2.194 668 HG12 VAL 91 2HG1 VAL 91 17.091 13.184 1.891 669 HG13 VAL 91 3HG1 VAL 91 15.656 14.201 1.760 670 HG21 VAL 91 3HG2 VAL 91 15.544 11.096 -1.043 671 HG22 VAL 91 1HG2 VAL 91 16.915 10.949 0.057 672 HG23 VAL 91 2HG2 VAL 91 15.268 10.887 0.687 673 HA PRO 92 HA PRO 92 14.024 17.619 -0.633 674 HB2 PRO 92 1HB PRO 92 13.383 18.438 1.874 675 HB3 PRO 92 2HB PRO 92 12.191 17.791 0.741 676 HG2 PRO 92 1HG PRO 92 13.594 16.421 3.002 677 HG3 PRO 92 2HG PRO 92 11.889 16.331 2.525 678 HD2 PRO 92 1HD PRO 92 13.683 14.406 1.888 679 HD3 PRO 92 2HD PRO 92 12.309 14.816 0.840 680 H GLY 93 H GLY 93 16.251 15.809 0.966 681 HA2 GLY 93 1HA GLY 93 17.873 18.194 1.608 682 HA3 GLY 93 2HA GLY 93 17.874 16.771 2.639 683 H THR 94 H THR 94 17.654 16.180 -0.726 684 HA THR 94 HA THR 94 20.548 15.827 -0.990 685 HB THR 94 HB THR 94 19.328 13.664 -0.219 686 HG1 THR 94 1HG THR 94 20.950 13.603 -2.564 687 HG21 THR 94 3HG2 THR 94 18.819 13.284 -3.138 688 HG22 THR 94 1HG2 THR 94 17.600 14.082 -2.145 689 HG23 THR 94 2HG2 THR 94 18.117 12.441 -1.757 690 H GLU 95 H GLU 95 21.219 15.415 -3.231 691 HA GLU 95 HA GLU 95 19.435 16.808 -5.100 692 HB2 GLU 95 1HB GLU 95 22.413 16.307 -5.237 693 HB3 GLU 95 2HB GLU 95 21.479 17.166 -6.455 694 HG2 GLU 95 1HG GLU 95 22.407 18.874 -5.213 695 HG3 GLU 95 2HG GLU 95 20.793 18.718 -4.521 696 H GLY 96 H GLY 96 18.247 15.492 -6.318 697 HA2 GLY 96 1HA GLY 96 18.347 14.046 -8.296 698 HA3 GLY 96 2HA GLY 96 19.565 13.102 -7.450 699 H VAL 97 H VAL 97 18.081 11.323 -8.052 700 HA VAL 97 HA VAL 97 15.867 11.086 -6.118 701 HB VAL 97 HB VAL 97 16.118 9.638 -8.757 702 HG11 VAL 97 1HG1 VAL 97 14.843 8.360 -7.185 703 HG12 VAL 97 2HG1 VAL 97 13.912 9.781 -6.707 704 HG13 VAL 97 3HG1 VAL 97 13.721 9.102 -8.325 705 HG21 VAL 97 3HG2 VAL 97 14.684 11.167 -9.740 706 HG22 VAL 97 1HG2 VAL 97 14.097 11.769 -8.190 707 HG23 VAL 97 2HG2 VAL 97 15.711 12.204 -8.751 708 H THR 98 H THR 98 15.524 9.036 -5.140 709 HA THR 98 HA THR 98 17.883 7.269 -5.188 710 HB THR 98 HB THR 98 16.155 7.891 -2.785 711 HG1 THR 98 1HG THR 98 17.440 9.620 -2.907 712 HG21 THR 98 3HG2 THR 98 17.034 6.068 -1.858 713 HG22 THR 98 1HG2 THR 98 18.653 6.717 -2.115 714 HG23 THR 98 2HG2 THR 98 17.898 5.713 -3.354 715 H GLN 99 H GLN 99 17.535 5.117 -5.364 716 HA GLN 99 HA GLN 99 14.730 4.237 -5.527 717 HB2 GLN 99 1HB GLN 99 15.431 2.556 -7.107 718 HB3 GLN 99 2HB GLN 99 16.024 4.121 -7.645 719 HG2 GLN 99 1HG GLN 99 17.756 2.288 -6.036 720 HG3 GLN 99 2HG GLN 99 17.589 2.092 -7.780 721 HE21 GLN 99 1HE2 GLN 99 19.758 3.045 -5.812 722 HE22 GLN 99 2HE2 GLN 99 20.373 4.472 -6.568 723 H LEU 100 H LEU 100 14.136 2.249 -4.625 724 HA LEU 100 HA LEU 100 16.066 1.150 -2.687 725 HB2 LEU 100 1HB LEU 100 14.053 2.447 -1.799 726 HB3 LEU 100 2HB LEU 100 13.081 1.086 -2.354 727 HG LEU 100 HG LEU 100 14.629 -0.343 -0.864 728 HD11 LEU 100 1HD1 LEU 100 15.610 2.327 -0.327 729 HD12 LEU 100 2HD1 LEU 100 16.295 0.762 0.109 730 HD13 LEU 100 3HD1 LEU 100 15.078 1.509 1.143 731 HD21 LEU 100 3HD2 LEU 100 13.066 1.322 0.954 732 HD22 LEU 100 1HD2 LEU 100 12.912 -0.392 0.566 733 HD23 LEU 100 2HD2 LEU 100 12.176 0.819 -0.485 734 H LYS 101 H LYS 101 16.300 -1.034 -2.562 735 HA LYS 101 HA LYS 101 14.675 -2.653 -4.414 736 HB2 LYS 101 1HB LYS 101 17.169 -2.203 -4.983 737 HB3 LYS 101 2HB LYS 101 17.506 -3.351 -3.693 738 HG2 LYS 101 1HG LYS 101 16.481 -5.116 -4.844 739 HG3 LYS 101 2HG LYS 101 15.674 -4.023 -5.971 740 HD2 LYS 101 1HD LYS 101 18.656 -4.049 -5.853 741 HD3 LYS 101 2HD LYS 101 17.817 -5.354 -6.696 742 HE2 LYS 101 1HE LYS 101 18.111 -3.858 -8.410 743 HE3 LYS 101 2HE LYS 101 16.521 -3.372 -7.822 744 HZ1 LYS 101 3HZ LYS 101 17.297 -1.410 -7.113 745 HZ2 LYS 101 1HZ LYS 101 18.587 -1.700 -8.169 746 HZ3 LYS 101 2HZ LYS 101 18.745 -2.058 -6.524 747 H LEU 102 H LEU 102 13.695 -4.394 -3.584 748 HA LEU 102 HA LEU 102 14.511 -5.287 -0.897 749 HB2 LEU 102 1HB LEU 102 11.711 -5.291 -2.011 750 HB3 LEU 102 2HB LEU 102 12.202 -5.751 -0.382 751 HG LEU 102 HG LEU 102 12.531 -2.962 -1.467 752 HD11 LEU 102 1HD1 LEU 102 10.456 -3.032 0.419 753 HD12 LEU 102 2HD1 LEU 102 10.116 -4.319 -0.737 754 HD13 LEU 102 3HD1 LEU 102 10.342 -2.664 -1.302 755 HD21 LEU 102 3HD2 LEU 102 13.940 -3.464 0.425 756 HD22 LEU 102 1HD2 LEU 102 12.569 -4.129 1.313 757 HD23 LEU 102 2HD2 LEU 102 12.627 -2.406 0.941 758 H THR 103 H THR 103 14.391 -7.498 -0.451 759 HA THR 103 HA THR 103 13.703 -9.298 -2.651 760 HB THR 103 HB THR 103 16.292 -9.729 -1.188 761 HG1 THR 103 1HG THR 103 17.043 -8.047 -2.230 762 HG21 THR 103 3HG2 THR 103 15.049 -10.735 -3.735 763 HG22 THR 103 1HG2 THR 103 15.597 -11.661 -2.338 764 HG23 THR 103 2HG2 THR 103 16.774 -10.903 -3.410 765 H VAL 104 H VAL 104 13.684 -11.602 -1.939 766 HA VAL 104 HA VAL 104 12.591 -11.760 0.772 767 HB VAL 104 HB VAL 104 12.475 -13.898 -1.350 768 HG11 VAL 104 1HG1 VAL 104 11.842 -14.956 0.571 769 HG12 VAL 104 2HG1 VAL 104 11.246 -13.474 1.322 770 HG13 VAL 104 3HG1 VAL 104 10.286 -14.284 0.084 771 HG21 VAL 104 3HG2 VAL 104 11.390 -11.435 -1.691 772 HG22 VAL 104 1HG2 VAL 104 10.732 -12.919 -2.380 773 HG23 VAL 104 2HG2 VAL 104 10.072 -12.276 -0.876 774 H VAL 105 H VAL 105 13.485 -12.949 2.363 775 HA VAL 105 HA VAL 105 15.834 -14.598 1.691 776 HB VAL 105 HB VAL 105 15.551 -12.949 4.204 777 HG11 VAL 105 1HG1 VAL 105 16.976 -14.736 4.678 778 HG12 VAL 105 2HG1 VAL 105 17.707 -14.701 3.073 779 HG13 VAL 105 3HG1 VAL 105 18.073 -13.428 4.238 780 HG21 VAL 105 3HG2 VAL 105 15.818 -11.329 2.544 781 HG22 VAL 105 1HG2 VAL 105 17.463 -11.631 3.101 782 HG23 VAL 105 2HG2 VAL 105 16.898 -12.347 1.592 783 H GLU 106 H GLU 106 16.238 -16.395 3.061 784 HA GLU 106 HA GLU 106 13.988 -17.174 4.789 785 HB2 GLU 106 1HB GLU 106 14.564 -19.572 3.925 786 HB3 GLU 106 2HB GLU 106 13.528 -18.521 2.970 787 HG2 GLU 106 1HG GLU 106 14.920 -19.224 1.333 788 HG3 GLU 106 2HG GLU 106 15.844 -17.831 1.892 789 H ASP 107 H ASP 107 17.397 -17.324 4.064 790 HA ASP 107 HA ASP 107 18.278 -19.162 5.945 791 HB2 ASP 107 1HB ASP 107 19.658 -18.000 4.171 792 HB3 ASP 107 2HB ASP 107 19.731 -16.607 5.248 793 H VAL 108 H VAL 108 17.641 -15.696 6.334 794 HA VAL 108 HA VAL 108 18.421 -15.637 9.084 795 HB VAL 108 HB VAL 108 18.468 -13.627 7.637 796 HG11 VAL 108 1HG1 VAL 108 16.494 -12.495 6.972 797 HG12 VAL 108 2HG1 VAL 108 16.291 -14.180 6.490 798 HG13 VAL 108 3HG1 VAL 108 15.473 -13.568 7.928 799 HG21 VAL 108 3HG2 VAL 108 16.875 -12.310 9.438 800 HG22 VAL 108 1HG2 VAL 108 17.271 -13.800 10.294 801 HG23 VAL 108 2HG2 VAL 108 18.561 -12.756 9.699 802 H THR 109 H THR 109 15.288 -15.638 7.403 803 HA THR 109 HA THR 109 14.062 -16.992 9.646 804 HB THR 109 HB THR 109 12.162 -15.274 9.689 805 HG1 THR 109 1HG THR 109 13.151 -13.087 9.222 806 HG21 THR 109 3HG2 THR 109 13.191 -14.024 11.437 807 HG22 THR 109 1HG2 THR 109 14.801 -14.297 10.772 808 HG23 THR 109 2HG2 THR 109 13.901 -15.638 11.480 809 H VAL 110 H VAL 110 12.551 -18.373 8.950 810 HA VAL 110 HA VAL 110 12.005 -18.622 6.167 811 HB VAL 110 HB VAL 110 10.708 -20.015 8.514 812 HG11 VAL 110 1HG1 VAL 110 9.711 -19.907 5.996 813 HG12 VAL 110 2HG1 VAL 110 10.761 -21.321 5.883 814 HG13 VAL 110 3HG1 VAL 110 9.485 -21.264 7.099 815 HG21 VAL 110 3HG2 VAL 110 12.757 -21.200 6.677 816 HG22 VAL 110 1HG2 VAL 110 13.241 -20.247 8.080 817 HG23 VAL 110 2HG2 VAL 110 12.284 -21.712 8.298 818 H GLY 111 H GLY 111 10.985 -16.719 5.496 819 HA2 GLY 111 1HA GLY 111 8.129 -16.637 6.131 820 HA3 GLY 111 2HA GLY 111 9.061 -15.173 6.408 821 H ARG 112 H ARG 112 9.181 -17.567 3.780 822 HA ARG 112 HA ARG 112 9.434 -15.555 1.789 823 HB2 ARG 112 1HB ARG 112 10.115 -18.114 1.809 824 HB3 ARG 112 2HB ARG 112 8.522 -18.309 1.093 825 HG2 ARG 112 1HG ARG 112 10.448 -16.324 -0.037 826 HG3 ARG 112 2HG ARG 112 10.583 -18.037 -0.440 827 HD2 ARG 112 1HD ARG 112 7.923 -16.719 -0.670 828 HD3 ARG 112 2HD ARG 112 9.138 -16.389 -1.905 829 HE ARG 112 HE ARG 112 7.697 -18.848 -1.497 830 HH11 ARG 112 1HH1 ARG 112 10.548 -17.373 -2.846 831 HH12 ARG 112 2HH1 ARG 112 10.813 -18.636 -4.001 832 HH21 ARG 112 1HH2 ARG 112 8.036 -20.517 -3.014 833 HH22 ARG 112 2HH2 ARG 112 9.383 -20.424 -4.097 834 H ARG 113 H ARG 113 6.747 -17.493 2.987 835 HA ARG 113 HA ARG 113 4.869 -16.809 1.009 836 HB2 ARG 113 1HB ARG 113 4.696 -17.839 3.811 837 HB3 ARG 113 2HB ARG 113 3.230 -17.282 3.015 838 HG2 ARG 113 1HG ARG 113 3.183 -19.503 2.490 839 HG3 ARG 113 2HG ARG 113 4.044 -18.860 1.090 840 HD2 ARG 113 1HD ARG 113 5.430 -20.591 1.631 841 HD3 ARG 113 2HD ARG 113 6.148 -19.317 2.616 842 HE ARG 113 HE ARG 113 5.494 -20.450 4.493 843 HH11 ARG 113 1HH1 ARG 113 3.759 -21.700 1.745 844 HH12 ARG 113 2HH1 ARG 113 3.057 -23.018 2.623 845 HH21 ARG 113 1HH2 ARG 113 4.575 -22.181 5.660 846 HH22 ARG 113 2HH2 ARG 113 3.521 -23.290 4.850 847 H GLN 114 H GLN 114 5.679 -15.302 4.108 848 HA GLN 114 HA GLN 114 3.654 -13.310 3.967 849 HB2 GLN 114 1HB GLN 114 6.025 -13.843 5.676 850 HB3 GLN 114 2HB GLN 114 5.421 -12.191 5.643 851 HG2 GLN 114 1HG GLN 114 4.026 -14.677 6.561 852 HG3 GLN 114 2HG GLN 114 4.350 -13.194 7.457 853 HE21 GLN 114 1HE2 GLN 114 3.134 -11.313 6.936 854 HE22 GLN 114 2HE2 GLN 114 1.568 -11.451 6.220 855 H ALA 115 H ALA 115 7.184 -13.138 3.482 856 HA ALA 115 HA ALA 115 7.424 -10.512 2.725 857 HB1 ALA 115 1HB ALA 115 9.298 -12.108 3.052 858 HB2 ALA 115 2HB ALA 115 8.938 -12.794 1.466 859 HB3 ALA 115 3HB ALA 115 9.459 -11.114 1.604 860 H VAL 116 H VAL 116 7.280 -13.175 0.353 861 HA VAL 116 HA VAL 116 6.893 -11.690 -1.919 862 HB VAL 116 HB VAL 116 5.654 -14.375 -1.298 863 HG11 VAL 116 1HG1 VAL 116 5.887 -12.783 -3.817 864 HG12 VAL 116 2HG1 VAL 116 5.902 -14.547 -3.881 865 HG13 VAL 116 3HG1 VAL 116 4.516 -13.700 -3.193 866 HG21 VAL 116 3HG2 VAL 116 7.623 -15.246 -2.546 867 HG22 VAL 116 1HG2 VAL 116 8.287 -13.612 -2.553 868 HG23 VAL 116 2HG2 VAL 116 8.040 -14.457 -1.025 869 H ALA 117 H ALA 117 4.439 -12.795 0.379 870 HA ALA 117 HA ALA 117 2.198 -11.876 -1.083 871 HB1 ALA 117 1HB ALA 117 2.671 -12.701 1.746 872 HB2 ALA 117 2HB ALA 117 1.153 -11.914 1.311 873 HB3 ALA 117 3HB ALA 117 1.622 -13.420 0.523 874 H TRP 118 H TRP 118 4.359 -10.347 1.215 875 HA TRP 118 HA TRP 118 2.777 -8.046 1.705 876 HB2 TRP 118 1HB TRP 118 4.648 -8.768 3.164 877 HB3 TRP 118 2HB TRP 118 5.783 -8.341 1.886 878 HD1 TRP 118 HD TRP 118 3.929 -6.882 4.785 879 HE1 TRP 118 1HE TRP 118 4.393 -4.355 4.941 880 HE3 TRP 118 3HE TRP 118 6.202 -6.193 0.257 881 HZ2 TRP 118 2HZ TRP 118 5.566 -2.337 3.354 882 HZ3 TRP 118 3HZ TRP 118 6.965 -3.933 -0.347 883 HH2 TRP 118 HH TRP 118 6.652 -2.046 1.170 884 H LEU 119 H LEU 119 5.404 -8.726 -0.579 885 HA LEU 119 HA LEU 119 5.617 -6.164 -1.684 886 HB2 LEU 119 1HB LEU 119 6.049 -8.790 -3.097 887 HB3 LEU 119 2HB LEU 119 6.715 -7.224 -3.556 888 HG LEU 119 HG LEU 119 7.389 -8.579 -0.954 889 HD11 LEU 119 1HD1 LEU 119 8.751 -8.807 -3.630 890 HD12 LEU 119 2HD1 LEU 119 8.080 -10.109 -2.647 891 HD13 LEU 119 3HD1 LEU 119 9.510 -9.236 -2.097 892 HD21 LEU 119 3HD2 LEU 119 8.737 -6.838 -0.576 893 HD22 LEU 119 1HD2 LEU 119 7.814 -6.011 -1.830 894 HD23 LEU 119 2HD2 LEU 119 9.327 -6.819 -2.239 895 H VAL 120 H VAL 120 3.956 -8.988 -3.103 896 HA VAL 120 HA VAL 120 2.716 -7.767 -5.218 897 HB VAL 120 HB VAL 120 2.604 -10.173 -4.869 898 HG11 VAL 120 1HG1 VAL 120 0.656 -9.552 -2.651 899 HG12 VAL 120 2HG1 VAL 120 1.082 -11.160 -3.240 900 HG13 VAL 120 3HG1 VAL 120 2.297 -10.162 -2.440 901 HG21 VAL 120 3HG2 VAL 120 0.904 -8.973 -6.276 902 HG22 VAL 120 1HG2 VAL 120 0.392 -10.547 -5.667 903 HG23 VAL 120 2HG2 VAL 120 -0.200 -9.071 -4.904 904 H ALA 121 H ALA 121 1.530 -7.975 -1.879 905 HA ALA 121 HA ALA 121 -0.922 -6.650 -2.340 906 HB1 ALA 121 1HB ALA 121 -0.436 -8.057 -0.361 907 HB2 ALA 121 2HB ALA 121 0.630 -6.786 0.241 908 HB3 ALA 121 3HB ALA 121 -1.096 -6.474 0.054 909 H MET 122 H MET 122 2.265 -5.495 -1.315 910 HA MET 122 HA MET 122 1.678 -2.886 -0.656 911 HB2 MET 122 1HB MET 122 3.909 -3.945 -0.436 912 HB3 MET 122 2HB MET 122 4.114 -3.830 -2.178 913 HG2 MET 122 1HG MET 122 5.309 -2.043 -1.138 914 HG3 MET 122 2HG MET 122 3.924 -1.375 -1.999 915 HE1 MET 122 3HE MET 122 2.594 0.947 0.473 916 HE2 MET 122 1HE MET 122 4.068 1.022 -0.493 917 HE3 MET 122 2HE MET 122 2.607 0.304 -1.170 918 H HIS 123 H HIS 123 2.508 -4.140 -3.885 919 HA HIS 123 HA HIS 123 2.166 -1.677 -5.226 920 HB2 HIS 123 1HB HIS 123 3.443 -3.594 -6.147 921 HB3 HIS 123 2HB HIS 123 1.931 -4.472 -6.359 922 HD2 HIS 123 2HD HIS 123 4.206 -2.651 -8.549 923 HE1 HIS 123 1HE HIS 123 0.371 -1.668 -10.074 924 HE2 HIS 123 2HE HIS 123 2.842 -1.745 -10.552 925 H LYS 124 H LYS 124 0.073 -4.569 -5.276 926 HA LYS 124 HA LYS 124 -2.068 -3.683 -6.654 927 HB2 LYS 124 1HB LYS 124 -1.769 -5.507 -4.336 928 HB3 LYS 124 2HB LYS 124 -3.403 -4.966 -4.696 929 HG2 LYS 124 1HG LYS 124 -3.521 -6.147 -6.620 930 HG3 LYS 124 2HG LYS 124 -1.804 -5.947 -6.978 931 HD2 LYS 124 1HD LYS 124 -1.814 -8.167 -6.454 932 HD3 LYS 124 2HD LYS 124 -1.560 -7.498 -4.840 933 HE2 LYS 124 1HE LYS 124 -4.349 -7.907 -5.808 934 HE3 LYS 124 2HE LYS 124 -3.415 -9.311 -5.292 935 HZ1 LYS 124 3HZ LYS 124 -4.660 -7.296 -3.711 936 HZ2 LYS 124 1HZ LYS 124 -3.016 -7.434 -3.334 937 HZ3 LYS 124 2HZ LYS 124 -4.023 -8.790 -3.237 938 H ALA 125 H ALA 125 -1.497 -3.038 -3.205 939 HA ALA 125 HA ALA 125 -3.828 -1.431 -2.887 940 HB1 ALA 125 1HB ALA 125 -1.381 -1.897 -1.219 941 HB2 ALA 125 2HB ALA 125 -2.593 -0.701 -0.760 942 HB3 ALA 125 3HB ALA 125 -3.044 -2.398 -0.915 943 H ALA 126 H ALA 126 -0.414 -0.733 -3.492 944 HA ALA 126 HA ALA 126 -0.385 2.007 -3.174 945 HB1 ALA 126 1HB ALA 126 1.367 1.899 -5.089 946 HB2 ALA 126 2HB ALA 126 1.694 1.080 -3.561 947 HB3 ALA 126 3HB ALA 126 1.139 0.155 -4.956 948 H LYS 127 H LYS 127 -1.523 0.111 -5.920 949 HA LYS 127 HA LYS 127 -1.897 2.262 -7.709 950 HB2 LYS 127 1HB LYS 127 -3.116 -0.488 -7.529 951 HB3 LYS 127 2HB LYS 127 -3.551 0.643 -8.804 952 HG2 LYS 127 1HG LYS 127 -0.728 -0.238 -8.258 953 HG3 LYS 127 2HG LYS 127 -1.800 -1.034 -9.413 954 HD2 LYS 127 1HD LYS 127 -1.465 1.911 -9.628 955 HD3 LYS 127 2HD LYS 127 -0.121 0.889 -10.142 956 HE2 LYS 127 1HE LYS 127 -1.261 0.979 -12.107 957 HE3 LYS 127 2HE LYS 127 -2.085 -0.400 -11.382 958 HZ1 LYS 127 3HZ LYS 127 -3.900 0.805 -11.881 959 HZ2 LYS 127 1HZ LYS 127 -3.069 2.279 -11.910 960 HZ3 LYS 127 2HZ LYS 127 -3.549 1.607 -10.434 961 H LEU 128 H LEU 128 -3.810 1.003 -5.086 962 HA LEU 128 HA LEU 128 -6.215 2.392 -5.842 963 HB2 LEU 128 1HB LEU 128 -5.337 0.685 -3.582 964 HB3 LEU 128 2HB LEU 128 -6.678 1.791 -3.290 965 HG LEU 128 HG LEU 128 -6.660 -0.229 -5.525 966 HD11 LEU 128 1HD1 LEU 128 -7.822 -0.483 -2.755 967 HD12 LEU 128 2HD1 LEU 128 -6.482 -1.418 -3.417 968 HD13 LEU 128 3HD1 LEU 128 -8.102 -1.599 -4.092 969 HD21 LEU 128 3HD2 LEU 128 -8.184 1.645 -5.822 970 HD22 LEU 128 1HD2 LEU 128 -8.865 1.363 -4.220 971 HD23 LEU 128 2HD2 LEU 128 -9.078 0.160 -5.492 972 H LEU 129 H LEU 129 -3.460 2.985 -3.769 973 HA LEU 129 HA LEU 129 -4.481 5.094 -2.238 974 HB2 LEU 129 1HB LEU 129 -1.778 4.170 -3.038 975 HB3 LEU 129 2HB LEU 129 -1.920 5.800 -2.384 976 HG LEU 129 HG LEU 129 -2.782 3.274 -0.975 977 HD11 LEU 129 1HD1 LEU 129 -0.796 4.314 0.522 978 HD12 LEU 129 2HD1 LEU 129 -0.236 4.746 -1.093 979 HD13 LEU 129 3HD1 LEU 129 -0.559 3.059 -0.695 980 HD21 LEU 129 3HD2 LEU 129 -2.594 5.133 0.944 981 HD22 LEU 129 1HD2 LEU 129 -4.091 4.791 0.075 982 HD23 LEU 129 2HD2 LEU 129 -3.085 6.159 -0.405 983 H TYR 130 H TYR 130 -2.385 5.325 -5.119 984 HA TYR 130 HA TYR 130 -2.925 8.120 -5.436 985 HB2 TYR 130 1HB TYR 130 -1.765 6.427 -7.620 986 HB3 TYR 130 2HB TYR 130 -1.373 8.082 -7.168 987 HD1 TYR 130 2HD TYR 130 -0.969 7.653 -4.213 988 HD2 TYR 130 1HD TYR 130 0.370 5.433 -7.587 989 HE1 TYR 130 2HE TYR 130 0.955 6.845 -2.911 990 HE2 TYR 130 1HE TYR 130 2.297 4.618 -6.294 991 HH TYR 130 HH TYR 130 3.583 5.149 -4.373 992 H GLU 131 H GLU 131 -3.697 5.252 -7.414 993 HA GLU 131 HA GLU 131 -5.789 6.808 -8.756 994 HB2 GLU 131 1HB GLU 131 -4.565 4.138 -9.471 995 HB3 GLU 131 2HB GLU 131 -5.818 4.952 -10.397 996 HG2 GLU 131 1HG GLU 131 -3.293 6.414 -9.834 997 HG3 GLU 131 2HG GLU 131 -3.283 5.140 -11.052 998 H SER 132 H SER 132 -7.817 5.585 -9.294 999 HA SER 132 HA SER 132 -8.590 3.401 -7.613 1000 HB2 SER 132 1HB SER 132 -10.134 4.483 -6.177 1001 HB3 SER 132 2HB SER 132 -8.667 5.458 -6.091 1002 HG SER 132 HG SER 132 -10.314 6.878 -6.403 1003 H ARG 133 H ARG 133 -10.894 2.816 -7.934 1004 HA ARG 133 HA ARG 133 -12.123 3.975 -10.319 1005 HB2 ARG 133 1HB ARG 133 -11.254 1.108 -10.025 1006 HB3 ARG 133 2HB ARG 133 -12.556 1.567 -11.114 1007 HG2 ARG 133 1HG ARG 133 -11.155 2.634 -12.570 1008 HG3 ARG 133 2HG ARG 133 -9.965 3.008 -11.321 1009 HD2 ARG 133 1HD ARG 133 -9.145 1.317 -12.900 1010 HD3 ARG 133 2HD ARG 133 -9.264 0.687 -11.257 1011 HE ARG 133 HE ARG 133 -11.641 0.023 -12.436 1012 HH11 ARG 133 1HH1 ARG 133 -8.279 -0.549 -13.137 1013 HH12 ARG 133 2HH1 ARG 133 -8.566 -2.071 -13.915 1014 HH21 ARG 133 1HH2 ARG 133 -12.031 -1.979 -13.457 1015 HH22 ARG 133 2HH2 ARG 133 -10.700 -2.883 -14.097 1016 H ASP 134 H ASP 134 -14.362 3.475 -10.553 1017 HA ASP 134 HA ASP 134 -15.632 2.857 -7.990 1018 HB2 ASP 134 1HB ASP 134 -16.674 4.163 -10.508 1019 HB3 ASP 134 2HB ASP 134 -17.692 3.774 -9.124 1020 H GLN 135 H GLN 135 -15.970 2.023 -11.436 1021 HA GLN 135 HA GLN 135 -16.843 -0.653 -10.642 1022 HB2 GLN 135 1HB GLN 135 -18.719 -0.636 -12.180 1023 HB3 GLN 135 2HB GLN 135 -18.892 0.672 -11.018 1024 HG2 GLN 135 1HG GLN 135 -18.510 2.304 -12.585 1025 HG3 GLN 135 2HG GLN 135 -17.603 1.224 -13.644 1026 HE21 GLN 135 1HE2 GLN 135 -18.946 2.106 -15.333 1027 HE22 GLN 135 2HE2 GLN 135 -20.526 1.458 -15.594 1028 H SER 136 H SER 136 -16.652 -2.240 -12.339 1029 HA SER 136 HA SER 136 -14.677 -1.452 -14.380 1030 HB2 SER 136 1HB SER 136 -15.074 -4.171 -13.106 1031 HB3 SER 136 2HB SER 136 -13.838 -3.752 -14.293 1032 HG SER 136 HG SER 136 -14.059 -2.349 -11.856 1033 H GLY 137 H GLY 137 -17.365 -1.073 -14.926 1034 HA2 GLY 137 1HA GLY 137 -18.882 -1.475 -16.602 1035 HA3 GLY 137 2HA GLY 137 -17.654 -2.481 -17.355 1036 HA PRO 138 HA PRO 138 -20.377 -5.235 -14.404 1037 HB2 PRO 138 1HB PRO 138 -22.855 -4.235 -13.928 1038 HB3 PRO 138 2HB PRO 138 -21.475 -3.927 -12.867 1039 HG2 PRO 138 1HG PRO 138 -22.653 -2.184 -14.997 1040 HG3 PRO 138 2HG PRO 138 -22.093 -1.743 -13.374 1041 HD2 PRO 138 1HD PRO 138 -20.602 -1.320 -15.595 1042 HD3 PRO 138 2HD PRO 138 -19.879 -1.689 -14.016 1043 H SER 139 H SER 139 -21.050 -3.630 -17.278 1044 HA SER 139 HA SER 139 -23.377 -4.544 -18.303 1045 HB2 SER 139 1HB SER 139 -20.798 -4.755 -19.862 1046 HB3 SER 139 2HB SER 139 -22.413 -4.421 -20.486 1047 HG SER 139 HG SER 139 -22.183 -2.390 -19.979 1048 H SER 140 H SER 140 -23.948 -6.376 -19.660 1049 HA SER 140 HA SER 140 -24.289 -8.609 -19.938 1050 HB2 SER 140 1HB SER 140 -21.278 -8.706 -19.626 1051 HB3 SER 140 2HB SER 140 -22.280 -9.994 -20.295 1052 HG SER 140 HG SER 140 -21.612 -8.889 -22.043 1053 H GLY 141 H GLY 141 -24.975 -7.903 -17.470 1054 HA2 GLY 141 1HA GLY 141 -25.289 -10.028 -15.938 1055 HA3 GLY 141 2HA GLY 141 -23.614 -9.651 -15.561 Start of MODEL 10 1 H1 GLY 1 H GLY 1 -13.884 5.831 10.705 2 HA2 GLY 1 1HA GLY 1 -13.789 3.231 9.860 3 HA3 GLY 1 2HA GLY 1 -14.695 3.752 11.273 4 H SER 2 H SER 2 -16.454 2.450 11.093 5 HA SER 2 HA SER 2 -18.413 3.171 9.117 6 HB2 SER 2 1HB SER 2 -16.819 1.324 8.130 7 HB3 SER 2 2HB SER 2 -17.770 0.245 9.151 8 HG SER 2 HG SER 2 -19.085 2.071 7.474 9 H SER 3 H SER 3 -20.511 2.341 9.591 10 HA SER 3 HA SER 3 -21.062 2.132 12.346 11 HB2 SER 3 1HB SER 3 -22.743 1.635 9.889 12 HB3 SER 3 2HB SER 3 -23.390 1.470 11.521 13 HG SER 3 HG SER 3 -22.325 3.736 11.677 14 H GLY 4 H GLY 4 -22.166 0.348 13.440 15 HA2 GLY 4 1HA GLY 4 -21.866 -1.792 14.290 16 HA3 GLY 4 2HA GLY 4 -22.556 -2.210 12.728 17 H SER 5 H SER 5 -21.428 -4.100 12.437 18 HA SER 5 HA SER 5 -18.572 -4.209 12.742 19 HB2 SER 5 1HB SER 5 -20.597 -6.167 11.649 20 HB3 SER 5 2HB SER 5 -18.868 -6.508 11.710 21 HG SER 5 HG SER 5 -20.445 -5.795 13.959 22 H SER 6 H SER 6 -17.338 -5.290 10.813 23 HA SER 6 HA SER 6 -18.111 -4.082 8.261 24 HB2 SER 6 1HB SER 6 -15.573 -3.530 9.780 25 HB3 SER 6 2HB SER 6 -15.622 -3.400 8.022 26 HG SER 6 HG SER 6 -16.682 -1.596 8.206 27 H GLY 7 H GLY 7 -17.274 -5.113 6.435 28 HA2 GLY 7 1HA GLY 7 -16.145 -7.778 6.992 29 HA3 GLY 7 2HA GLY 7 -17.100 -7.361 5.577 30 H ALA 8 H ALA 8 -16.077 -6.763 3.758 31 HA ALA 8 HA ALA 8 -14.404 -6.270 2.294 32 HB1 ALA 8 1HB ALA 8 -12.307 -5.158 3.557 33 HB2 ALA 8 2HB ALA 8 -13.764 -4.267 3.115 34 HB3 ALA 8 3HB ALA 8 -13.570 -4.880 4.757 35 H GLU 9 H GLU 9 -14.507 -8.854 3.021 36 HA GLU 9 HA GLU 9 -12.036 -9.850 4.051 37 HB2 GLU 9 1HB GLU 9 -14.508 -11.024 2.892 38 HB3 GLU 9 2HB GLU 9 -13.054 -12.009 2.837 39 HG2 GLU 9 1HG GLU 9 -12.815 -11.651 5.297 40 HG3 GLU 9 2HG GLU 9 -14.396 -10.872 5.274 41 H PHE 10 H PHE 10 -12.818 -8.462 1.142 42 HA PHE 10 HA PHE 10 -11.299 -10.120 -0.626 43 HB2 PHE 10 1HB PHE 10 -13.180 -8.535 -1.282 44 HB3 PHE 10 2HB PHE 10 -12.021 -7.225 -1.074 45 HD1 PHE 10 1HD PHE 10 -10.098 -7.019 -2.577 46 HD2 PHE 10 2HD PHE 10 -13.085 -9.994 -3.167 47 HE1 PHE 10 1HE PHE 10 -9.297 -7.362 -4.878 48 HE2 PHE 10 2HE PHE 10 -12.288 -10.342 -5.469 49 HZ PHE 10 HZ PHE 10 -10.391 -9.026 -6.326 50 H TYR 11 H TYR 11 -10.699 -7.054 1.049 51 HA TYR 11 HA TYR 11 -7.920 -7.087 0.144 52 HB2 TYR 11 1HB TYR 11 -9.625 -5.013 1.511 53 HB3 TYR 11 2HB TYR 11 -7.880 -4.835 1.374 54 HD1 TYR 11 2HD TYR 11 -10.787 -5.670 -0.831 55 HD2 TYR 11 1HD TYR 11 -7.107 -3.580 -0.394 56 HE1 TYR 11 2HE TYR 11 -11.068 -4.717 -3.081 57 HE2 TYR 11 1HE TYR 11 -7.378 -2.620 -2.643 58 HH TYR 11 HH TYR 11 -9.680 -2.162 -4.181 59 H ASP 12 H ASP 12 -9.853 -7.271 3.082 60 HA ASP 12 HA ASP 12 -8.039 -7.035 5.083 61 HB2 ASP 12 1HB ASP 12 -10.434 -8.758 4.707 62 HB3 ASP 12 2HB ASP 12 -9.378 -9.136 6.065 63 H LYS 13 H LYS 13 -8.085 -9.463 2.643 64 HA LYS 13 HA LYS 13 -6.555 -11.445 3.977 65 HB2 LYS 13 1HB LYS 13 -5.990 -12.014 1.454 66 HB3 LYS 13 2HB LYS 13 -7.579 -12.340 2.132 67 HG2 LYS 13 1HG LYS 13 -8.588 -10.696 0.928 68 HG3 LYS 13 2HG LYS 13 -7.137 -9.692 0.873 69 HD2 LYS 13 1HD LYS 13 -7.463 -10.471 -1.332 70 HD3 LYS 13 2HD LYS 13 -6.150 -11.448 -0.669 71 HE2 LYS 13 1HE LYS 13 -7.602 -13.299 -0.313 72 HE3 LYS 13 2HE LYS 13 -9.031 -12.324 -0.653 73 HZ1 LYS 13 3HZ LYS 13 -8.281 -13.824 -2.493 74 HZ2 LYS 13 1HZ LYS 13 -6.918 -12.837 -2.666 75 HZ3 LYS 13 2HZ LYS 13 -8.462 -12.199 -2.926 76 H GLN 14 H GLN 14 -5.670 -8.857 1.703 77 HA GLN 14 HA GLN 14 -2.845 -9.408 2.093 78 HB2 GLN 14 1HB GLN 14 -2.487 -7.643 0.428 79 HB3 GLN 14 2HB GLN 14 -3.632 -8.846 -0.150 80 HG2 GLN 14 1HG GLN 14 -4.609 -6.859 -0.790 81 HG3 GLN 14 2HG GLN 14 -5.434 -7.226 0.724 82 HE21 GLN 14 1HE2 GLN 14 -5.674 -4.745 0.053 83 HE22 GLN 14 2HE2 GLN 14 -4.613 -3.700 0.928 84 H LEU 15 H LEU 15 -5.146 -6.786 2.736 85 HA LEU 15 HA LEU 15 -3.595 -4.810 3.727 86 HB2 LEU 15 1HB LEU 15 -6.093 -5.818 5.079 87 HB3 LEU 15 2HB LEU 15 -5.409 -4.200 5.218 88 HG LEU 15 HG LEU 15 -6.382 -5.314 2.599 89 HD11 LEU 15 1HD1 LEU 15 -8.248 -3.469 3.518 90 HD12 LEU 15 2HD1 LEU 15 -7.937 -4.523 4.897 91 HD13 LEU 15 3HD1 LEU 15 -8.464 -5.213 3.362 92 HD21 LEU 15 3HD2 LEU 15 -4.824 -3.295 2.768 93 HD22 LEU 15 1HD2 LEU 15 -6.200 -2.450 3.478 94 HD23 LEU 15 2HD2 LEU 15 -6.313 -3.099 1.842 95 H LYS 16 H LYS 16 -4.751 -7.564 5.672 96 HA LYS 16 HA LYS 16 -3.425 -6.936 8.036 97 HB2 LYS 16 1HB LYS 16 -3.860 -9.152 8.733 98 HB3 LYS 16 2HB LYS 16 -5.178 -8.738 7.645 99 HG2 LYS 16 1HG LYS 16 -3.932 -9.917 5.825 100 HG3 LYS 16 2HG LYS 16 -2.790 -10.469 7.053 101 HD2 LYS 16 1HD LYS 16 -5.755 -10.954 7.243 102 HD3 LYS 16 2HD LYS 16 -4.651 -12.078 6.447 103 HE2 LYS 16 1HE LYS 16 -3.524 -12.559 8.442 104 HE3 LYS 16 2HE LYS 16 -4.171 -11.135 9.255 105 HZ1 LYS 16 3HZ LYS 16 -5.389 -13.746 8.833 106 HZ2 LYS 16 1HZ LYS 16 -6.420 -12.409 8.719 107 HZ3 LYS 16 2HZ LYS 16 -5.539 -12.679 10.137 108 H VAL 17 H VAL 17 -2.288 -8.660 5.181 109 HA VAL 17 HA VAL 17 0.164 -9.555 6.268 110 HB VAL 17 HB VAL 17 -0.743 -9.089 3.435 111 HG11 VAL 17 1HG1 VAL 17 1.371 -10.475 2.900 112 HG12 VAL 17 2HG1 VAL 17 1.541 -8.742 3.188 113 HG13 VAL 17 3HG1 VAL 17 1.954 -9.894 4.459 114 HG21 VAL 17 3HG2 VAL 17 -1.303 -11.100 5.198 115 HG22 VAL 17 1HG2 VAL 17 -1.366 -11.242 3.441 116 HG23 VAL 17 2HG2 VAL 17 0.076 -11.757 4.317 117 H LEU 18 H LEU 18 -0.697 -6.678 4.375 118 HA LEU 18 HA LEU 18 1.894 -5.612 4.170 119 HB2 LEU 18 1HB LEU 18 -0.866 -4.525 3.932 120 HB3 LEU 18 2HB LEU 18 0.476 -3.389 4.047 121 HG LEU 18 HG LEU 18 0.172 -5.521 1.933 122 HD11 LEU 18 1HD1 LEU 18 -0.620 -2.660 2.071 123 HD12 LEU 18 2HD1 LEU 18 -1.415 -4.019 1.278 124 HD13 LEU 18 3HD1 LEU 18 0.012 -3.284 0.547 125 HD21 LEU 18 3HD2 LEU 18 1.991 -3.334 1.394 126 HD22 LEU 18 1HD2 LEU 18 2.253 -5.074 1.284 127 HD23 LEU 18 2HD2 LEU 18 2.467 -4.246 2.827 128 H LEU 19 H LEU 19 -0.717 -4.870 6.476 129 HA LEU 19 HA LEU 19 0.592 -2.972 8.004 130 HB2 LEU 19 1HB LEU 19 -1.334 -5.080 8.969 131 HB3 LEU 19 2HB LEU 19 -0.923 -3.592 9.820 132 HG LEU 19 HG LEU 19 -2.135 -3.477 7.085 133 HD11 LEU 19 1HD1 LEU 19 -3.381 -4.847 9.107 134 HD12 LEU 19 2HD1 LEU 19 -4.183 -4.065 7.745 135 HD13 LEU 19 3HD1 LEU 19 -4.028 -3.216 9.284 136 HD21 LEU 19 3HD2 LEU 19 -2.730 -1.609 9.317 137 HD22 LEU 19 1HD2 LEU 19 -2.579 -1.298 7.587 138 HD23 LEU 19 2HD2 LEU 19 -1.134 -1.531 8.570 139 H SER 20 H SER 20 0.322 -6.444 8.790 140 HA SER 20 HA SER 20 1.919 -6.607 10.974 141 HB2 SER 20 1HB SER 20 0.787 -8.560 10.069 142 HB3 SER 20 2HB SER 20 1.838 -8.550 8.653 143 HG SER 20 HG SER 20 2.440 -9.236 11.314 144 H GLY 21 H GLY 21 3.025 -6.544 7.603 145 HA2 GLY 21 1HA GLY 21 5.019 -5.542 6.860 146 HA3 GLY 21 2HA GLY 21 5.606 -5.534 8.517 147 H ALA 22 H ALA 22 6.526 -6.622 5.745 148 HA ALA 22 HA ALA 22 7.175 -9.348 6.648 149 HB1 ALA 22 1HB ALA 22 6.014 -9.387 4.559 150 HB2 ALA 22 2HB ALA 22 7.094 -8.171 3.876 151 HB3 ALA 22 3HB ALA 22 7.704 -9.783 4.248 152 H THR 23 H THR 23 9.351 -10.042 5.396 153 HA THR 23 HA THR 23 11.364 -8.074 6.251 154 HB THR 23 HB THR 23 11.838 -11.023 5.824 155 HG1 THR 23 1HG THR 23 10.357 -10.901 7.485 156 HG21 THR 23 3HG2 THR 23 13.847 -10.695 7.028 157 HG22 THR 23 1HG2 THR 23 13.353 -9.090 7.565 158 HG23 THR 23 2HG2 THR 23 13.764 -9.366 5.872 159 H PHE 24 H PHE 24 13.177 -7.662 4.958 160 HA PHE 24 HA PHE 24 13.414 -8.867 2.348 161 HB2 PHE 24 1HB PHE 24 12.838 -5.904 2.521 162 HB3 PHE 24 2HB PHE 24 13.106 -6.845 1.058 163 HD1 PHE 24 2HD PHE 24 11.415 -8.565 0.391 164 HD2 PHE 24 1HD PHE 24 10.709 -5.744 3.499 165 HE1 PHE 24 2HE PHE 24 8.998 -8.987 0.220 166 HE2 PHE 24 1HE PHE 24 8.290 -6.163 3.334 167 HZ PHE 24 HZ PHE 24 7.431 -7.785 1.692 168 H LEU 25 H LEU 25 15.255 -7.818 1.101 169 HA LEU 25 HA LEU 25 17.376 -7.114 3.011 170 HB2 LEU 25 1HB LEU 25 17.384 -8.520 0.367 171 HB3 LEU 25 2HB LEU 25 18.854 -7.778 0.997 172 HG LEU 25 HG LEU 25 17.284 -9.881 2.479 173 HD11 LEU 25 1HD1 LEU 25 17.991 -11.124 0.688 174 HD12 LEU 25 2HD1 LEU 25 19.395 -11.251 1.747 175 HD13 LEU 25 3HD1 LEU 25 19.406 -10.112 0.401 176 HD21 LEU 25 3HD2 LEU 25 19.547 -8.197 3.103 177 HD22 LEU 25 1HD2 LEU 25 19.967 -9.907 3.208 178 HD23 LEU 25 2HD2 LEU 25 18.618 -9.272 4.150 179 H VAL 26 H VAL 26 17.499 -4.950 3.119 180 HA VAL 26 HA VAL 26 17.235 -3.348 0.695 181 HB VAL 26 HB VAL 26 17.582 -2.490 3.572 182 HG11 VAL 26 1HG1 VAL 26 16.998 -0.256 2.785 183 HG12 VAL 26 2HG1 VAL 26 18.466 -0.838 1.999 184 HG13 VAL 26 3HG1 VAL 26 16.934 -0.848 1.126 185 HG21 VAL 26 3HG2 VAL 26 15.250 -3.182 1.928 186 HG22 VAL 26 1HG2 VAL 26 15.435 -3.148 3.682 187 HG23 VAL 26 2HG2 VAL 26 15.114 -1.655 2.800 188 H THR 27 H THR 27 18.878 -2.341 -0.311 189 HA THR 27 HA THR 27 21.560 -2.582 0.892 190 HB THR 27 HB THR 27 21.009 -2.463 -2.072 191 HG1 THR 27 1HG THR 27 21.544 -4.815 -1.852 192 HG21 THR 27 3HG2 THR 27 23.282 -3.363 -2.237 193 HG22 THR 27 1HG2 THR 27 23.418 -3.352 -0.479 194 HG23 THR 27 2HG2 THR 27 23.266 -1.832 -1.362 195 H PHE 28 H PHE 28 22.465 -0.710 1.405 196 HA PHE 28 HA PHE 28 21.396 1.763 0.305 197 HB2 PHE 28 1HB PHE 28 23.325 1.169 2.549 198 HB3 PHE 28 2HB PHE 28 22.984 2.806 2.000 199 HD1 PHE 28 2HD PHE 28 20.511 3.535 1.999 200 HD2 PHE 28 1HD PHE 28 21.997 0.186 4.166 201 HE1 PHE 28 2HE PHE 28 18.542 3.619 3.472 202 HE2 PHE 28 1HE PHE 28 20.029 0.264 5.642 203 HZ PHE 28 HZ PHE 28 18.300 1.983 5.297 204 H GLY 29 H GLY 29 22.526 3.214 -0.930 205 HA2 GLY 29 1HA GLY 29 24.263 2.470 -2.845 206 HA3 GLY 29 2HA GLY 29 24.286 4.088 -2.161 207 H ASN 30 H ASN 30 25.213 3.479 0.416 208 HA ASN 30 HA ASN 30 28.018 3.211 -0.137 209 HB2 ASN 30 1HB ASN 30 28.136 3.397 2.441 210 HB3 ASN 30 2HB ASN 30 27.556 4.789 1.531 211 HD21 ASN 30 1HD2 ASN 30 25.455 5.435 1.734 212 HD22 ASN 30 2HD2 ASN 30 24.369 4.774 2.903 213 H SER 31 H SER 31 25.641 1.351 1.746 214 HA SER 31 HA SER 31 27.511 -0.734 2.360 215 HB2 SER 31 1HB SER 31 24.495 -0.844 2.565 216 HB3 SER 31 2HB SER 31 25.662 -1.845 3.429 217 HG SER 31 HG SER 31 25.139 -0.288 4.855 218 H GLU 32 H GLU 32 28.308 -1.748 0.590 219 HA GLU 32 HA GLU 32 26.819 -2.386 -1.722 220 HB2 GLU 32 1HB GLU 32 29.291 -3.838 -0.791 221 HB3 GLU 32 2HB GLU 32 28.727 -3.615 -2.441 222 HG2 GLU 32 1HG GLU 32 29.169 -1.214 -2.261 223 HG3 GLU 32 2HG GLU 32 29.758 -1.454 -0.618 224 H LYS 33 H LYS 33 27.147 -3.928 1.344 225 HA LYS 33 HA LYS 33 26.030 -6.440 0.345 226 HB2 LYS 33 1HB LYS 33 27.700 -6.991 1.836 227 HB3 LYS 33 2HB LYS 33 27.399 -5.590 2.856 228 HG2 LYS 33 1HG LYS 33 25.564 -6.610 3.904 229 HG3 LYS 33 2HG LYS 33 25.457 -7.870 2.671 230 HD2 LYS 33 1HD LYS 33 27.905 -7.572 4.381 231 HD3 LYS 33 2HD LYS 33 26.496 -8.469 4.952 232 HE2 LYS 33 1HE LYS 33 26.727 -9.626 2.585 233 HE3 LYS 33 2HE LYS 33 28.402 -9.104 2.758 234 HZ1 LYS 33 3HZ LYS 33 28.417 -11.185 3.713 235 HZ2 LYS 33 1HZ LYS 33 26.880 -11.016 4.400 236 HZ3 LYS 33 2HZ LYS 33 28.200 -10.198 5.070 237 HA PRO 34 HA PRO 34 21.929 -5.259 1.485 238 HB2 PRO 34 1HB PRO 34 20.809 -7.731 1.443 239 HB3 PRO 34 2HB PRO 34 21.227 -6.841 -0.026 240 HG2 PRO 34 1HG PRO 34 22.736 -9.024 1.360 241 HG3 PRO 34 2HG PRO 34 22.445 -8.791 -0.373 242 HD2 PRO 34 1HD PRO 34 24.784 -8.121 0.813 243 HD3 PRO 34 2HD PRO 34 24.129 -7.231 -0.575 244 H GLU 35 H GLU 35 20.603 -5.233 3.281 245 HA GLU 35 HA GLU 35 21.514 -6.812 5.597 246 HB2 GLU 35 1HB GLU 35 22.130 -4.416 5.780 247 HB3 GLU 35 2HB GLU 35 20.429 -3.991 5.649 248 HG2 GLU 35 1HG GLU 35 20.990 -3.905 7.941 249 HG3 GLU 35 2HG GLU 35 20.022 -5.360 7.705 250 H THR 36 H THR 36 19.955 -7.636 6.967 251 HA THR 36 HA THR 36 17.377 -8.081 5.793 252 HB THR 36 HB THR 36 18.288 -8.844 8.572 253 HG1 THR 36 1HG THR 36 19.658 -9.640 6.823 254 HG21 THR 36 3HG2 THR 36 15.809 -9.097 7.255 255 HG22 THR 36 1HG2 THR 36 16.296 -9.819 8.788 256 HG23 THR 36 2HG2 THR 36 16.531 -10.706 7.282 257 H MET 37 H MET 37 15.985 -6.415 5.788 258 HA MET 37 HA MET 37 15.521 -5.016 8.340 259 HB2 MET 37 1HB MET 37 15.355 -3.998 5.507 260 HB3 MET 37 2HB MET 37 14.632 -3.143 6.863 261 HG2 MET 37 1HG MET 37 17.012 -3.314 7.891 262 HG3 MET 37 2HG MET 37 17.509 -3.589 6.223 263 HE1 MET 37 3HE MET 37 15.453 -1.497 8.567 264 HE2 MET 37 1HE MET 37 16.962 -0.613 8.796 265 HE3 MET 37 2HE MET 37 15.599 0.164 7.991 266 H THR 38 H THR 38 13.231 -3.961 8.305 267 HA THR 38 HA THR 38 11.304 -5.927 7.251 268 HB THR 38 HB THR 38 11.091 -4.513 9.916 269 HG1 THR 38 1HG THR 38 11.492 -6.635 10.753 270 HG21 THR 38 3HG2 THR 38 9.018 -5.364 10.127 271 HG22 THR 38 1HG2 THR 38 9.463 -6.893 9.370 272 HG23 THR 38 2HG2 THR 38 9.068 -5.495 8.369 273 H CYS 39 H CYS 39 9.707 -5.100 6.066 274 HA CYS 39 HA CYS 39 9.286 -2.187 6.154 275 HB2 CYS 39 1HB CYS 39 8.916 -4.158 3.892 276 HB3 CYS 39 2HB CYS 39 8.380 -2.483 3.823 277 HG CYS 39 HG CYS 39 11.646 -3.260 4.430 278 H ARG 40 H ARG 40 7.243 -1.365 6.349 279 HA ARG 40 HA ARG 40 4.927 -3.088 6.239 280 HB2 ARG 40 1HB ARG 40 4.272 -2.984 8.477 281 HB3 ARG 40 2HB ARG 40 6.000 -3.296 8.576 282 HG2 ARG 40 1HG ARG 40 6.243 -0.748 8.779 283 HG3 ARG 40 2HG ARG 40 4.514 -0.760 9.134 284 HD2 ARG 40 1HD ARG 40 4.853 -2.190 11.029 285 HD3 ARG 40 2HD ARG 40 6.553 -2.410 10.616 286 HE ARG 40 HE ARG 40 7.023 -0.382 11.582 287 HH11 ARG 40 1HH1 ARG 40 3.581 -0.704 11.171 288 HH12 ARG 40 2HH1 ARG 40 3.206 0.706 12.105 289 HH21 ARG 40 1HH2 ARG 40 6.542 1.477 12.814 290 HH22 ARG 40 2HH2 ARG 40 4.891 1.946 13.038 291 H LEU 41 H LEU 41 2.899 -1.846 6.662 292 HA LEU 41 HA LEU 41 3.228 0.914 5.705 293 HB2 LEU 41 1HB LEU 41 1.200 -1.201 5.262 294 HB3 LEU 41 2HB LEU 41 0.629 0.466 5.305 295 HG LEU 41 HG LEU 41 2.889 -0.324 3.503 296 HD11 LEU 41 1HD1 LEU 41 1.598 -1.466 2.104 297 HD12 LEU 41 2HD1 LEU 41 0.340 -0.232 2.158 298 HD13 LEU 41 3HD1 LEU 41 0.373 -1.510 3.372 299 HD21 LEU 41 3HD2 LEU 41 2.726 1.940 3.384 300 HD22 LEU 41 1HD2 LEU 41 1.018 1.953 3.824 301 HD23 LEU 41 2HD2 LEU 41 1.502 1.523 2.183 302 H SER 42 H SER 42 1.604 2.494 6.461 303 HA SER 42 HA SER 42 1.476 2.491 9.312 304 HB2 SER 42 1HB SER 42 1.690 4.501 7.660 305 HB3 SER 42 2HB SER 42 -0.071 4.416 7.604 306 HG SER 42 HG SER 42 1.310 4.488 10.062 307 H ASN 43 H ASN 43 -0.682 3.197 10.372 308 HA ASN 43 HA ASN 43 -2.429 1.076 10.412 309 HB2 ASN 43 1HB ASN 43 -4.025 2.600 11.549 310 HB3 ASN 43 2HB ASN 43 -2.390 2.732 12.187 311 HD21 ASN 43 1HD2 ASN 43 -5.023 4.412 11.058 312 HD22 ASN 43 2HD2 ASN 43 -4.270 5.943 10.784 313 H ASN 44 H ASN 44 -2.682 4.064 8.527 314 HA ASN 44 HA ASN 44 -5.009 2.947 7.126 315 HB2 ASN 44 1HB ASN 44 -5.042 5.292 8.183 316 HB3 ASN 44 2HB ASN 44 -3.992 5.769 6.853 317 HD21 ASN 44 1HD2 ASN 44 -5.350 7.074 5.764 318 HD22 ASN 44 2HD2 ASN 44 -6.835 6.556 5.048 319 H GLN 45 H GLN 45 -2.100 2.271 6.726 320 HA GLN 45 HA GLN 45 -0.560 2.047 5.041 321 HB2 GLN 45 1HB GLN 45 -2.870 1.824 3.151 322 HB3 GLN 45 2HB GLN 45 -1.401 0.862 3.230 323 HG2 GLN 45 1HG GLN 45 -3.421 0.747 5.431 324 HG3 GLN 45 2HG GLN 45 -3.633 -0.193 3.955 325 HE21 GLN 45 1HE2 GLN 45 -2.732 -2.127 3.885 326 HE22 GLN 45 2HE2 GLN 45 -1.492 -2.705 4.940 327 H ARG 46 H ARG 46 -1.030 4.741 5.568 328 HA ARG 46 HA ARG 46 -1.210 6.010 2.932 329 HB2 ARG 46 1HB ARG 46 -1.498 6.998 5.745 330 HB3 ARG 46 2HB ARG 46 -1.080 8.130 4.466 331 HG2 ARG 46 1HG ARG 46 -3.145 7.043 3.266 332 HG3 ARG 46 2HG ARG 46 -3.602 6.625 4.918 333 HD2 ARG 46 1HD ARG 46 -3.621 8.906 5.579 334 HD3 ARG 46 2HD ARG 46 -2.848 9.414 4.079 335 HE ARG 46 HE ARG 46 -5.324 8.127 3.564 336 HH11 ARG 46 1HH1 ARG 46 -3.944 11.118 4.689 337 HH12 ARG 46 2HH1 ARG 46 -5.291 12.082 4.180 338 HH21 ARG 46 1HH2 ARG 46 -7.103 9.385 2.889 339 HH22 ARG 46 2HH2 ARG 46 -7.087 11.095 3.157 340 H TYR 47 H TYR 47 1.050 5.041 5.294 341 HA TYR 47 HA TYR 47 3.201 6.280 3.764 342 HB2 TYR 47 1HB TYR 47 2.940 6.604 6.760 343 HB3 TYR 47 2HB TYR 47 4.318 7.114 5.792 344 HD1 TYR 47 1HD TYR 47 4.051 8.977 4.157 345 HD2 TYR 47 2HD TYR 47 0.979 7.941 6.913 346 HE1 TYR 47 1HE TYR 47 2.983 11.160 3.779 347 HE2 TYR 47 2HE TYR 47 -0.097 10.121 6.542 348 HH TYR 47 HH TYR 47 0.167 12.176 5.646 349 H LEU 48 H LEU 48 5.197 5.220 3.949 350 HA LEU 48 HA LEU 48 4.986 2.496 5.010 351 HB2 LEU 48 1HB LEU 48 6.759 3.773 2.951 352 HB3 LEU 48 2HB LEU 48 7.118 2.187 3.632 353 HG LEU 48 HG LEU 48 4.527 2.816 2.233 354 HD11 LEU 48 1HD1 LEU 48 7.136 2.574 1.092 355 HD12 LEU 48 2HD1 LEU 48 5.587 2.824 0.288 356 HD13 LEU 48 3HD1 LEU 48 6.155 1.187 0.617 357 HD21 LEU 48 3HD2 LEU 48 5.913 0.193 2.765 358 HD22 LEU 48 1HD2 LEU 48 4.305 0.432 2.083 359 HD23 LEU 48 2HD2 LEU 48 4.621 0.860 3.764 360 H PHE 49 H PHE 49 6.575 1.603 6.339 361 HA PHE 49 HA PHE 49 8.584 3.440 7.430 362 HB2 PHE 49 1HB PHE 49 6.548 1.869 9.007 363 HB3 PHE 49 2HB PHE 49 8.036 2.474 9.727 364 HD1 PHE 49 2HD PHE 49 4.800 3.399 8.281 365 HD2 PHE 49 1HD PHE 49 8.344 4.813 10.168 366 HE1 PHE 49 2HE PHE 49 3.714 5.569 8.688 367 HE2 PHE 49 1HE PHE 49 7.263 6.985 10.578 368 HZ PHE 49 HZ PHE 49 4.946 7.365 9.837 369 H LEU 50 H LEU 50 10.495 2.500 8.033 370 HA LEU 50 HA LEU 50 10.765 -0.356 7.388 371 HB2 LEU 50 1HB LEU 50 12.947 1.713 7.557 372 HB3 LEU 50 2HB LEU 50 13.081 0.071 6.930 373 HG LEU 50 HG LEU 50 11.380 2.208 5.655 374 HD11 LEU 50 1HD1 LEU 50 13.285 3.161 5.007 375 HD12 LEU 50 2HD1 LEU 50 13.532 1.737 3.998 376 HD13 LEU 50 3HD1 LEU 50 14.258 1.816 5.603 377 HD21 LEU 50 3HD2 LEU 50 12.126 -0.602 5.000 378 HD22 LEU 50 1HD2 LEU 50 11.883 0.547 3.684 379 HD23 LEU 50 2HD2 LEU 50 10.578 0.226 4.827 380 H ASP 51 H ASP 51 12.307 -1.609 8.666 381 HA ASP 51 HA ASP 51 13.058 -0.608 11.268 382 HB2 ASP 51 1HB ASP 51 11.328 -3.055 11.311 383 HB3 ASP 51 2HB ASP 51 11.692 -1.924 12.611 384 H GLY 52 H GLY 52 15.041 -1.356 11.580 385 HA2 GLY 52 1HA GLY 52 15.757 -4.053 11.625 386 HA3 GLY 52 2HA GLY 52 16.184 -3.431 10.038 387 H ASP 53 H ASP 53 18.343 -3.288 10.080 388 HA ASP 53 HA ASP 53 20.097 -2.990 12.090 389 HB2 ASP 53 1HB ASP 53 21.526 -1.620 10.464 390 HB3 ASP 53 2HB ASP 53 20.996 -3.210 9.921 391 H SER 54 H SER 54 18.251 -0.356 10.624 392 HA SER 54 HA SER 54 18.643 1.231 13.027 393 HB2 SER 54 1HB SER 54 20.445 1.709 11.135 394 HB3 SER 54 2HB SER 54 19.132 2.674 10.459 395 HG SER 54 HG SER 54 19.130 3.354 12.925 396 H HIS 55 H HIS 55 17.246 3.169 13.049 397 HA HIS 55 HA HIS 55 14.626 2.510 12.133 398 HB2 HIS 55 1HB HIS 55 15.709 5.004 13.457 399 HB3 HIS 55 2HB HIS 55 14.001 4.711 13.141 400 HD2 HIS 55 2HD HIS 55 15.639 4.830 16.193 401 HE1 HIS 55 1HE HIS 55 13.982 0.931 16.422 402 HE2 HIS 55 2HE HIS 55 14.926 2.870 17.723 403 H TYR 56 H TYR 56 13.657 3.045 10.291 404 HA TYR 56 HA TYR 56 14.426 5.451 8.855 405 HB2 TYR 56 1HB TYR 56 14.920 2.675 7.850 406 HB3 TYR 56 2HB TYR 56 14.488 3.940 6.705 407 HD1 TYR 56 1HD TYR 56 15.897 6.197 7.056 408 HD2 TYR 56 2HD TYR 56 17.164 2.302 8.208 409 HE1 TYR 56 1HE TYR 56 18.239 6.948 6.996 410 HE2 TYR 56 2HE TYR 56 19.509 3.042 8.153 411 HH TYR 56 HH TYR 56 20.904 4.690 7.499 412 H GLU 57 H GLU 57 12.908 6.063 7.216 413 HA GLU 57 HA GLU 57 10.480 4.533 6.903 414 HB2 GLU 57 1HB GLU 57 8.995 6.304 7.740 415 HB3 GLU 57 2HB GLU 57 10.020 5.657 9.013 416 HG2 GLU 57 1HG GLU 57 10.466 8.239 7.531 417 HG3 GLU 57 2HG GLU 57 9.825 8.076 9.165 418 H ILE 58 H ILE 58 9.476 4.976 5.011 419 HA ILE 58 HA ILE 58 10.454 7.302 3.485 420 HB ILE 58 HB ILE 58 9.600 4.656 2.311 421 HG12 ILE 58 1HG1 ILE 58 12.427 5.620 2.260 422 HG13 ILE 58 2HG1 ILE 58 11.826 4.863 3.731 423 HG21 ILE 58 1HG2 ILE 58 9.695 7.123 1.134 424 HG22 ILE 58 2HG2 ILE 58 11.280 6.457 0.742 425 HG23 ILE 58 3HG2 ILE 58 9.819 5.582 0.285 426 HD11 ILE 58 3HD1 ILE 58 12.051 3.665 0.990 427 HD12 ILE 58 1HD1 ILE 58 12.860 3.164 2.475 428 HD13 ILE 58 2HD1 ILE 58 11.123 2.918 2.291 429 H GLU 59 H GLU 59 8.863 8.756 3.461 430 HA GLU 59 HA GLU 59 6.115 8.129 3.730 431 HB2 GLU 59 1HB GLU 59 7.433 10.660 2.729 432 HB3 GLU 59 2HB GLU 59 5.739 10.510 3.176 433 HG2 GLU 59 1HG GLU 59 8.150 10.656 4.883 434 HG3 GLU 59 2HG GLU 59 6.555 11.375 5.104 435 H ILE 60 H ILE 60 4.568 7.728 2.261 436 HA ILE 60 HA ILE 60 5.256 6.971 -0.366 437 HB ILE 60 HB ILE 60 2.548 7.534 0.846 438 HG12 ILE 60 1HG1 ILE 60 4.039 4.954 0.315 439 HG13 ILE 60 2HG1 ILE 60 3.757 5.680 1.894 440 HG21 ILE 60 1HG2 ILE 60 3.362 6.735 -1.884 441 HG22 ILE 60 2HG2 ILE 60 1.984 5.890 -1.180 442 HG23 ILE 60 3HG2 ILE 60 1.953 7.646 -1.339 443 HD11 ILE 60 3HD1 ILE 60 1.229 5.484 1.021 444 HD12 ILE 60 1HD1 ILE 60 1.954 4.118 0.174 445 HD13 ILE 60 2HD1 ILE 60 2.052 4.219 1.932 446 H VAL 61 H VAL 61 4.722 10.019 0.968 447 HA VAL 61 HA VAL 61 3.579 11.293 -1.335 448 HB VAL 61 HB VAL 61 3.837 13.351 -0.180 449 HG11 VAL 61 1HG1 VAL 61 3.048 12.702 2.185 450 HG12 VAL 61 2HG1 VAL 61 2.068 12.200 0.806 451 HG13 VAL 61 3HG1 VAL 61 3.137 11.042 1.598 452 HG21 VAL 61 3HG2 VAL 61 5.684 11.960 1.758 453 HG22 VAL 61 1HG2 VAL 61 6.208 13.018 0.448 454 HG23 VAL 61 2HG2 VAL 61 5.231 13.664 1.766 455 H HIS 62 H HIS 62 6.810 10.748 -0.087 456 HA HIS 62 HA HIS 62 8.064 12.500 -2.004 457 HB2 HIS 62 1HB HIS 62 9.023 10.662 0.152 458 HB3 HIS 62 2HB HIS 62 10.158 11.183 -1.090 459 HD2 HIS 62 2HD HIS 62 9.745 12.202 2.269 460 HE1 HIS 62 1HE HIS 62 9.759 15.945 0.272 461 HE2 HIS 62 2HE HIS 62 10.082 14.758 2.470 462 H ILE 63 H ILE 63 7.223 9.136 -1.779 463 HA ILE 63 HA ILE 63 8.971 8.101 -3.728 464 HB ILE 63 HB ILE 63 6.194 7.099 -3.097 465 HG12 ILE 63 1HG1 ILE 63 8.837 6.508 -1.749 466 HG13 ILE 63 2HG1 ILE 63 7.454 7.327 -1.031 467 HG21 ILE 63 1HG2 ILE 63 7.940 6.279 -5.045 468 HG22 ILE 63 2HG2 ILE 63 8.298 5.177 -3.716 469 HG23 ILE 63 3HG2 ILE 63 6.653 5.300 -4.342 470 HD11 ILE 63 3HD1 ILE 63 8.047 4.628 -0.902 471 HD12 ILE 63 1HD1 ILE 63 6.532 5.402 -0.442 472 HD13 ILE 63 2HD1 ILE 63 6.724 4.734 -2.063 473 H SER 64 H SER 64 8.906 8.041 -5.902 474 HA SER 64 HA SER 64 6.638 9.385 -7.216 475 HB2 SER 64 1HB SER 64 9.492 9.140 -8.195 476 HB3 SER 64 2HB SER 64 8.191 10.022 -8.994 477 HG SER 64 HG SER 64 9.832 10.864 -7.067 478 H THR 65 H THR 65 9.133 6.919 -7.854 479 HA THR 65 HA THR 65 7.250 5.576 -9.666 480 HB THR 65 HB THR 65 10.246 5.262 -9.403 481 HG1 THR 65 1HG THR 65 8.796 6.204 -11.651 482 HG21 THR 65 3HG2 THR 65 9.157 3.148 -10.023 483 HG22 THR 65 1HG2 THR 65 10.098 3.810 -11.359 484 HG23 THR 65 2HG2 THR 65 8.341 3.965 -11.356 485 H VAL 66 H VAL 66 6.658 3.463 -9.377 486 HA VAL 66 HA VAL 66 7.800 1.971 -7.136 487 HB VAL 66 HB VAL 66 4.845 2.518 -7.441 488 HG11 VAL 66 1HG1 VAL 66 4.556 0.497 -6.542 489 HG12 VAL 66 2HG1 VAL 66 6.277 0.319 -6.195 490 HG13 VAL 66 3HG1 VAL 66 5.232 1.174 -5.061 491 HG21 VAL 66 3HG2 VAL 66 5.029 3.536 -5.236 492 HG22 VAL 66 1HG2 VAL 66 6.757 3.181 -5.203 493 HG23 VAL 66 2HG2 VAL 66 6.115 4.329 -6.378 494 H GLN 67 H GLN 67 8.494 0.171 -8.090 495 HA GLN 67 HA GLN 67 6.604 -1.353 -9.728 496 HB2 GLN 67 1HB GLN 67 8.205 -1.801 -11.440 497 HB3 GLN 67 2HB GLN 67 8.163 -0.058 -11.213 498 HG2 GLN 67 1HG GLN 67 10.186 -0.248 -9.791 499 HG3 GLN 67 2HG GLN 67 10.254 -1.963 -10.193 500 HE21 GLN 67 1HE2 GLN 67 11.908 -2.228 -11.515 501 HE22 GLN 67 2HE2 GLN 67 12.240 -1.284 -12.923 502 H ILE 68 H ILE 68 7.206 -3.633 -9.952 503 HA ILE 68 HA ILE 68 8.627 -4.566 -7.553 504 HB ILE 68 HB ILE 68 6.445 -5.807 -9.208 505 HG12 ILE 68 1HG1 ILE 68 6.710 -5.349 -6.229 506 HG13 ILE 68 2HG1 ILE 68 5.870 -4.266 -7.333 507 HG21 ILE 68 1HG2 ILE 68 8.218 -7.171 -7.189 508 HG22 ILE 68 2HG2 ILE 68 6.703 -7.834 -7.798 509 HG23 ILE 68 3HG2 ILE 68 8.053 -7.564 -8.900 510 HD11 ILE 68 3HD1 ILE 68 4.755 -6.757 -7.821 511 HD12 ILE 68 1HD1 ILE 68 4.952 -6.686 -6.070 512 HD13 ILE 68 2HD1 ILE 68 4.038 -5.431 -6.907 513 H LEU 69 H LEU 69 10.310 -5.970 -7.686 514 HA LEU 69 HA LEU 69 11.466 -6.365 -10.333 515 HB2 LEU 69 1HB LEU 69 12.599 -6.920 -7.595 516 HB3 LEU 69 2HB LEU 69 13.477 -7.059 -9.116 517 HG LEU 69 HG LEU 69 12.352 -4.486 -8.014 518 HD11 LEU 69 1HD1 LEU 69 14.887 -4.026 -7.780 519 HD12 LEU 69 2HD1 LEU 69 15.034 -5.783 -7.767 520 HD13 LEU 69 3HD1 LEU 69 14.065 -4.970 -6.538 521 HD21 LEU 69 3HD2 LEU 69 14.085 -3.618 -9.738 522 HD22 LEU 69 1HD2 LEU 69 12.504 -4.163 -10.299 523 HD23 LEU 69 2HD2 LEU 69 13.909 -5.218 -10.461 524 H THR 70 H THR 70 11.319 -8.219 -11.397 525 HA THR 70 HA THR 70 10.897 -10.703 -9.879 526 HB THR 70 HB THR 70 9.409 -11.473 -11.780 527 HG1 THR 70 1HG THR 70 9.224 -10.124 -13.390 528 HG21 THR 70 3HG2 THR 70 8.077 -11.110 -9.987 529 HG22 THR 70 1HG2 THR 70 7.530 -9.727 -10.934 530 HG23 THR 70 2HG2 THR 70 8.749 -9.509 -9.678 531 H GLU 71 H GLU 71 12.444 -12.122 -10.311 532 HA GLU 71 HA GLU 71 14.488 -11.817 -12.122 533 HB2 GLU 71 1HB GLU 71 15.151 -14.002 -11.608 534 HB3 GLU 71 2HB GLU 71 14.254 -13.490 -10.186 535 HG2 GLU 71 1HG GLU 71 13.438 -15.607 -10.529 536 HG3 GLU 71 2HG GLU 71 12.239 -14.618 -11.360 537 H GLY 72 H GLY 72 14.939 -13.693 -13.842 538 HA2 GLY 72 1HA GLY 72 14.164 -14.887 -15.723 539 HA3 GLY 72 2HA GLY 72 12.578 -14.162 -15.501 540 H PHE 73 H PHE 73 15.889 -13.470 -16.539 541 HA PHE 73 HA PHE 73 15.637 -10.930 -17.520 542 HB2 PHE 73 1HB PHE 73 17.298 -13.273 -18.238 543 HB3 PHE 73 2HB PHE 73 17.204 -11.996 -19.446 544 HD1 PHE 73 1HD PHE 73 17.174 -9.559 -17.946 545 HD2 PHE 73 2HD PHE 73 19.331 -13.148 -17.180 546 HE1 PHE 73 1HE PHE 73 18.874 -8.272 -16.718 547 HE2 PHE 73 2HE PHE 73 21.033 -11.866 -15.950 548 HZ PHE 73 HZ PHE 73 20.805 -9.425 -15.717 549 HA PRO 74 HA PRO 74 14.002 -12.570 -21.755 550 HB2 PRO 74 1HB PRO 74 13.315 -15.192 -21.903 551 HB3 PRO 74 2HB PRO 74 14.944 -14.604 -22.256 552 HG2 PRO 74 1HG PRO 74 13.885 -15.859 -19.754 553 HG3 PRO 74 2HG PRO 74 15.424 -16.148 -20.585 554 HD2 PRO 74 1HD PRO 74 15.226 -14.570 -18.394 555 HD3 PRO 74 2HD PRO 74 16.408 -14.269 -19.683 556 HA PRO 75 HA PRO 75 9.708 -12.344 -20.836 557 HB2 PRO 75 1HB PRO 75 8.554 -13.320 -23.091 558 HB3 PRO 75 2HB PRO 75 9.356 -11.746 -23.026 559 HG2 PRO 75 1HG PRO 75 10.397 -14.361 -24.045 560 HG3 PRO 75 2HG PRO 75 10.558 -12.742 -24.750 561 HD2 PRO 75 1HD PRO 75 12.545 -13.921 -23.338 562 HD3 PRO 75 2HD PRO 75 12.288 -12.164 -23.342 563 H GLY 76 H GLY 76 10.814 -15.471 -22.066 564 HA2 GLY 76 1HA GLY 76 9.952 -17.602 -21.771 565 HA3 GLY 76 2HA GLY 76 9.979 -17.098 -20.088 566 H GLY 77 H GLY 77 8.164 -18.266 -19.494 567 HA2 GLY 77 1HA GLY 77 5.689 -18.027 -20.939 568 HA3 GLY 77 2HA GLY 77 5.925 -18.842 -19.400 569 H GLY 78 H GLY 78 6.599 -17.094 -17.612 570 HA2 GLY 78 1HA GLY 78 6.083 -14.656 -17.135 571 HA3 GLY 78 2HA GLY 78 4.481 -15.041 -17.747 572 H ASN 79 H ASN 79 6.796 -16.353 -15.368 573 HA ASN 79 HA ASN 79 4.849 -17.553 -13.738 574 HB2 ASN 79 1HB ASN 79 6.589 -17.853 -12.123 575 HB3 ASN 79 2HB ASN 79 7.327 -18.025 -13.712 576 HD21 ASN 79 1HD2 ASN 79 7.356 -16.368 -10.761 577 HD22 ASN 79 2HD2 ASN 79 8.577 -15.208 -11.147 578 H ALA 80 H ALA 80 3.799 -16.887 -11.893 579 HA ALA 80 HA ALA 80 3.654 -13.983 -11.521 580 HB1 ALA 80 1HB ALA 80 1.764 -16.232 -11.094 581 HB2 ALA 80 2HB ALA 80 1.613 -14.816 -10.054 582 HB3 ALA 80 3HB ALA 80 1.491 -14.641 -11.804 583 H ARG 81 H ARG 81 5.871 -14.430 -10.432 584 HA ARG 81 HA ARG 81 5.365 -14.577 -7.552 585 HB2 ARG 81 1HB ARG 81 7.664 -16.017 -8.886 586 HB3 ARG 81 2HB ARG 81 7.294 -15.993 -7.167 587 HG2 ARG 81 1HG ARG 81 5.294 -17.263 -7.516 588 HG3 ARG 81 2HG ARG 81 5.479 -17.153 -9.267 589 HD2 ARG 81 1HD ARG 81 7.689 -18.348 -8.976 590 HD3 ARG 81 2HD ARG 81 7.201 -18.655 -7.310 591 HE ARG 81 HE ARG 81 5.159 -19.507 -9.041 592 HH11 ARG 81 1HH1 ARG 81 8.400 -20.350 -8.089 593 HH12 ARG 81 2HH1 ARG 81 8.198 -22.038 -8.423 594 HH21 ARG 81 1HH2 ARG 81 4.882 -21.727 -9.485 595 HH22 ARG 81 2HH2 ARG 81 6.197 -22.820 -9.218 596 H ALA 82 H ALA 82 6.282 -12.940 -6.497 597 HA ALA 82 HA ALA 82 8.140 -11.214 -7.944 598 HB1 ALA 82 1HB ALA 82 6.464 -9.901 -7.059 599 HB2 ALA 82 2HB ALA 82 6.361 -10.846 -5.573 600 HB3 ALA 82 3HB ALA 82 7.721 -9.753 -5.831 601 H THR 83 H THR 83 10.246 -11.104 -7.505 602 HA THR 83 HA THR 83 11.268 -12.645 -5.230 603 HB THR 83 HB THR 83 13.392 -12.704 -6.343 604 HG1 THR 83 1HG THR 83 13.603 -11.596 -8.407 605 HG21 THR 83 3HG2 THR 83 11.819 -14.342 -7.158 606 HG22 THR 83 1HG2 THR 83 12.781 -13.755 -8.513 607 HG23 THR 83 2HG2 THR 83 11.130 -13.176 -8.287 608 H GLY 84 H GLY 84 11.061 -9.418 -6.508 609 HA2 GLY 84 1HA GLY 84 12.063 -8.356 -4.003 610 HA3 GLY 84 2HA GLY 84 13.056 -7.989 -5.406 611 H MET 85 H MET 85 12.317 -5.800 -4.368 612 HA MET 85 HA MET 85 10.143 -4.827 -6.064 613 HB2 MET 85 1HB MET 85 8.983 -5.149 -4.018 614 HB3 MET 85 2HB MET 85 10.310 -4.484 -3.075 615 HG2 MET 85 1HG MET 85 9.857 -2.282 -3.831 616 HG3 MET 85 2HG MET 85 8.719 -2.867 -5.042 617 HE1 MET 85 3HE MET 85 6.669 -2.912 -4.974 618 HE2 MET 85 1HE MET 85 5.583 -3.377 -3.664 619 HE3 MET 85 2HE MET 85 5.986 -1.678 -3.913 620 H PHE 86 H PHE 86 10.343 -2.684 -6.701 621 HA PHE 86 HA PHE 86 12.828 -1.334 -5.878 622 HB2 PHE 86 1HB PHE 86 12.858 -2.342 -8.211 623 HB3 PHE 86 2HB PHE 86 11.626 -1.160 -8.641 624 HD1 PHE 86 2HD PHE 86 15.133 -1.635 -7.680 625 HD2 PHE 86 1HD PHE 86 12.170 1.153 -8.931 626 HE1 PHE 86 2HE PHE 86 16.892 0.020 -8.148 627 HE2 PHE 86 1HE PHE 86 13.925 2.812 -9.402 628 HZ PHE 86 HZ PHE 86 16.289 2.247 -9.009 629 H LEU 87 H LEU 87 12.612 0.695 -5.176 630 HA LEU 87 HA LEU 87 10.200 2.203 -5.899 631 HB2 LEU 87 1HB LEU 87 11.322 2.099 -3.107 632 HB3 LEU 87 2HB LEU 87 9.857 2.923 -3.641 633 HG LEU 87 HG LEU 87 10.104 -0.056 -3.869 634 HD11 LEU 87 1HD1 LEU 87 10.511 0.032 -1.620 635 HD12 LEU 87 2HD1 LEU 87 8.748 0.083 -1.624 636 HD13 LEU 87 3HD1 LEU 87 9.672 1.570 -1.414 637 HD21 LEU 87 3HD2 LEU 87 8.062 1.967 -4.261 638 HD22 LEU 87 1HD2 LEU 87 7.535 0.687 -3.168 639 HD23 LEU 87 2HD2 LEU 87 8.104 0.284 -4.788 640 H GLN 88 H GLN 88 10.418 4.477 -5.821 641 HA GLN 88 HA GLN 88 13.182 5.455 -5.557 642 HB2 GLN 88 1HB GLN 88 11.191 6.063 -7.741 643 HB3 GLN 88 2HB GLN 88 12.623 7.042 -7.452 644 HG2 GLN 88 1HG GLN 88 14.060 5.177 -7.932 645 HG3 GLN 88 2HG GLN 88 12.672 4.099 -8.072 646 HE21 GLN 88 1HE2 GLN 88 14.010 7.077 -9.444 647 HE22 GLN 88 2HE2 GLN 88 13.484 6.774 -11.062 648 H TYR 89 H TYR 89 13.444 7.325 -4.465 649 HA TYR 89 HA TYR 89 11.211 9.115 -4.016 650 HB2 TYR 89 1HB TYR 89 11.567 9.028 -1.511 651 HB3 TYR 89 2HB TYR 89 10.779 7.620 -2.214 652 HD1 TYR 89 1HD TYR 89 14.199 8.827 -1.313 653 HD2 TYR 89 2HD TYR 89 11.535 5.523 -1.604 654 HE1 TYR 89 1HE TYR 89 15.900 7.373 -0.291 655 HE2 TYR 89 2HE TYR 89 13.227 4.060 -0.582 656 HH TYR 89 HH TYR 89 16.491 5.134 -0.030 657 H THR 90 H THR 90 11.831 11.175 -3.375 658 HA THR 90 HA THR 90 14.696 11.717 -3.658 659 HB THR 90 HB THR 90 14.034 14.066 -4.012 660 HG1 THR 90 1HG THR 90 11.930 13.574 -2.754 661 HG21 THR 90 3HG2 THR 90 13.840 13.587 -6.180 662 HG22 THR 90 1HG2 THR 90 12.212 12.954 -5.942 663 HG23 THR 90 2HG2 THR 90 13.608 11.895 -5.740 664 H VAL 91 H VAL 91 15.892 12.748 -2.117 665 HA VAL 91 HA VAL 91 14.719 12.864 0.552 666 HB VAL 91 HB VAL 91 17.594 13.131 -0.340 667 HG11 VAL 91 1HG1 VAL 91 16.688 12.696 2.483 668 HG12 VAL 91 2HG1 VAL 91 18.248 13.268 1.889 669 HG13 VAL 91 3HG1 VAL 91 16.835 14.322 1.817 670 HG21 VAL 91 3HG2 VAL 91 17.648 10.897 1.022 671 HG22 VAL 91 1HG2 VAL 91 15.928 10.856 0.635 672 HG23 VAL 91 2HG2 VAL 91 17.123 10.900 -0.662 673 HA PRO 92 HA PRO 92 14.296 17.255 0.493 674 HB2 PRO 92 1HB PRO 92 14.163 17.668 3.173 675 HB3 PRO 92 2HB PRO 92 12.830 16.977 2.240 676 HG2 PRO 92 1HG PRO 92 14.887 15.592 3.917 677 HG3 PRO 92 2HG PRO 92 13.142 15.292 3.811 678 HD2 PRO 92 1HD PRO 92 14.965 13.758 2.524 679 HD3 PRO 92 2HD PRO 92 13.344 14.066 1.870 680 H GLY 93 H GLY 93 15.822 18.743 0.172 681 HA2 GLY 93 1HA GLY 93 17.583 20.160 0.814 682 HA3 GLY 93 2HA GLY 93 17.999 19.028 2.092 683 H THR 94 H THR 94 17.969 16.733 0.245 684 HA THR 94 HA THR 94 20.669 17.093 -0.785 685 HB THR 94 HB THR 94 18.948 14.622 -0.519 686 HG1 THR 94 1HG THR 94 19.965 15.666 1.394 687 HG21 THR 94 3HG2 THR 94 20.316 13.570 -1.924 688 HG22 THR 94 1HG2 THR 94 21.691 13.994 -0.905 689 HG23 THR 94 2HG2 THR 94 21.194 15.072 -2.209 690 H GLU 95 H GLU 95 21.239 17.050 -2.901 691 HA GLU 95 HA GLU 95 19.078 17.265 -4.842 692 HB2 GLU 95 1HB GLU 95 22.042 17.813 -5.020 693 HB3 GLU 95 2HB GLU 95 20.953 17.936 -6.395 694 HG2 GLU 95 1HG GLU 95 19.956 19.832 -5.621 695 HG3 GLU 95 2HG GLU 95 20.265 19.439 -3.931 696 H GLY 96 H GLY 96 18.391 15.483 -5.819 697 HA2 GLY 96 1HA GLY 96 19.280 13.875 -7.589 698 HA3 GLY 96 2HA GLY 96 20.326 13.308 -6.296 699 H VAL 97 H VAL 97 18.690 11.542 -7.589 700 HA VAL 97 HA VAL 97 16.471 11.087 -5.709 701 HB VAL 97 HB VAL 97 16.872 9.827 -8.424 702 HG11 VAL 97 1HG1 VAL 97 15.132 8.519 -7.963 703 HG12 VAL 97 2HG1 VAL 97 15.275 9.046 -6.284 704 HG13 VAL 97 3HG1 VAL 97 14.178 9.884 -7.383 705 HG21 VAL 97 3HG2 VAL 97 16.262 12.441 -8.005 706 HG22 VAL 97 1HG2 VAL 97 15.746 11.505 -9.408 707 HG23 VAL 97 2HG2 VAL 97 14.656 11.713 -8.038 708 H THR 98 H THR 98 16.367 9.253 -4.518 709 HA THR 98 HA THR 98 18.657 7.412 -4.728 710 HB THR 98 HB THR 98 16.912 7.961 -2.319 711 HG1 THR 98 1HG THR 98 18.413 9.668 -2.963 712 HG21 THR 98 3HG2 THR 98 19.544 6.540 -2.256 713 HG22 THR 98 1HG2 THR 98 18.078 5.652 -2.672 714 HG23 THR 98 2HG2 THR 98 18.205 6.466 -1.112 715 H GLN 99 H GLN 99 18.329 5.268 -4.985 716 HA GLN 99 HA GLN 99 15.545 4.383 -5.294 717 HB2 GLN 99 1HB GLN 99 16.413 2.610 -6.718 718 HB3 GLN 99 2HB GLN 99 16.972 4.177 -7.288 719 HG2 GLN 99 1HG GLN 99 18.754 2.560 -7.411 720 HG3 GLN 99 2HG GLN 99 19.134 3.792 -6.208 721 HE21 GLN 99 1HE2 GLN 99 17.444 0.671 -6.365 722 HE22 GLN 99 2HE2 GLN 99 18.145 0.027 -4.923 723 H LEU 100 H LEU 100 15.009 2.189 -4.622 724 HA LEU 100 HA LEU 100 16.721 1.116 -2.497 725 HB2 LEU 100 1HB LEU 100 14.774 2.631 -1.700 726 HB3 LEU 100 2HB LEU 100 13.755 1.256 -2.121 727 HG LEU 100 HG LEU 100 15.477 -0.020 -0.556 728 HD11 LEU 100 1HD1 LEU 100 15.386 2.364 1.123 729 HD12 LEU 100 2HD1 LEU 100 16.437 2.527 -0.283 730 HD13 LEU 100 3HD1 LEU 100 16.691 1.208 0.860 731 HD21 LEU 100 3HD2 LEU 100 12.956 1.428 -0.053 732 HD22 LEU 100 1HD2 LEU 100 13.854 0.908 1.373 733 HD23 LEU 100 2HD2 LEU 100 13.353 -0.277 0.167 734 H LYS 101 H LYS 101 17.046 -0.987 -2.756 735 HA LYS 101 HA LYS 101 15.196 -2.492 -4.472 736 HB2 LYS 101 1HB LYS 101 17.811 -2.263 -4.831 737 HB3 LYS 101 2HB LYS 101 17.857 -3.575 -3.660 738 HG2 LYS 101 1HG LYS 101 16.759 -5.048 -5.077 739 HG3 LYS 101 2HG LYS 101 16.105 -3.750 -6.079 740 HD2 LYS 101 1HD LYS 101 19.063 -4.120 -5.900 741 HD3 LYS 101 2HD LYS 101 18.115 -5.197 -6.928 742 HE2 LYS 101 1HE LYS 101 17.114 -3.079 -7.933 743 HE3 LYS 101 2HE LYS 101 18.412 -2.211 -7.114 744 HZ1 LYS 101 3HZ LYS 101 18.510 -3.580 -9.557 745 HZ2 LYS 101 1HZ LYS 101 19.541 -4.373 -8.475 746 HZ3 LYS 101 2HZ LYS 101 19.748 -2.723 -8.784 747 H LEU 102 H LEU 102 14.359 -4.471 -3.831 748 HA LEU 102 HA LEU 102 14.826 -5.258 -1.037 749 HB2 LEU 102 1HB LEU 102 12.139 -5.157 -2.400 750 HB3 LEU 102 2HB LEU 102 12.452 -5.706 -0.754 751 HG LEU 102 HG LEU 102 12.909 -2.885 -1.720 752 HD11 LEU 102 1HD1 LEU 102 10.475 -4.249 -1.018 753 HD12 LEU 102 2HD1 LEU 102 10.712 -2.602 -1.603 754 HD13 LEU 102 3HD1 LEU 102 10.816 -2.948 0.124 755 HD21 LEU 102 3HD2 LEU 102 12.497 -3.378 1.120 756 HD22 LEU 102 1HD2 LEU 102 13.743 -2.436 0.301 757 HD23 LEU 102 2HD2 LEU 102 13.932 -4.181 0.480 758 H THR 103 H THR 103 15.231 -7.358 -0.770 759 HA THR 103 HA THR 103 14.318 -9.263 -2.807 760 HB THR 103 HB THR 103 17.143 -9.166 -1.731 761 HG1 THR 103 1HG THR 103 16.502 -7.609 -3.430 762 HG21 THR 103 3HG2 THR 103 15.612 -11.311 -2.821 763 HG22 THR 103 1HG2 THR 103 17.303 -11.307 -2.322 764 HG23 THR 103 2HG2 THR 103 16.870 -10.874 -3.976 765 H VAL 104 H VAL 104 13.846 -11.304 -2.058 766 HA VAL 104 HA VAL 104 13.337 -11.537 0.754 767 HB VAL 104 HB VAL 104 13.017 -13.557 -1.469 768 HG11 VAL 104 1HG1 VAL 104 11.886 -14.968 0.011 769 HG12 VAL 104 2HG1 VAL 104 13.295 -14.430 0.927 770 HG13 VAL 104 3HG1 VAL 104 11.715 -13.705 1.229 771 HG21 VAL 104 3HG2 VAL 104 10.817 -12.883 -1.674 772 HG22 VAL 104 1HG2 VAL 104 10.779 -12.160 -0.065 773 HG23 VAL 104 2HG2 VAL 104 11.636 -11.350 -1.377 774 H VAL 105 H VAL 105 14.483 -12.573 2.275 775 HA VAL 105 HA VAL 105 17.019 -13.797 1.463 776 HB VAL 105 HB VAL 105 16.974 -11.950 3.186 777 HG11 VAL 105 1HG1 VAL 105 14.901 -12.975 4.305 778 HG12 VAL 105 2HG1 VAL 105 16.043 -14.051 5.112 779 HG13 VAL 105 3HG1 VAL 105 16.161 -12.306 5.343 780 HG21 VAL 105 3HG2 VAL 105 18.894 -13.417 2.940 781 HG22 VAL 105 1HG2 VAL 105 18.625 -13.047 4.644 782 HG23 VAL 105 2HG2 VAL 105 18.141 -14.614 3.994 783 H GLU 106 H GLU 106 17.741 -15.755 2.530 784 HA GLU 106 HA GLU 106 15.495 -17.573 3.062 785 HB2 GLU 106 1HB GLU 106 16.796 -19.342 2.246 786 HB3 GLU 106 2HB GLU 106 17.169 -18.007 1.165 787 HG2 GLU 106 1HG GLU 106 18.881 -18.623 3.544 788 HG3 GLU 106 2HG GLU 106 19.098 -19.451 2.003 789 H ASP 107 H ASP 107 15.375 -18.753 4.913 790 HA ASP 107 HA ASP 107 17.550 -19.049 6.733 791 HB2 ASP 107 1HB ASP 107 16.667 -16.612 7.017 792 HB3 ASP 107 2HB ASP 107 15.316 -17.380 7.846 793 H VAL 108 H VAL 108 16.405 -19.663 9.043 794 HA VAL 108 HA VAL 108 15.127 -22.125 8.548 795 HB VAL 108 HB VAL 108 16.487 -21.496 10.598 796 HG11 VAL 108 1HG1 VAL 108 15.488 -19.445 11.248 797 HG12 VAL 108 2HG1 VAL 108 13.880 -20.170 11.309 798 HG13 VAL 108 3HG1 VAL 108 15.098 -20.618 12.504 799 HG21 VAL 108 3HG2 VAL 108 13.822 -22.744 11.231 800 HG22 VAL 108 1HG2 VAL 108 15.077 -23.567 10.306 801 HG23 VAL 108 2HG2 VAL 108 15.385 -23.083 11.974 802 H THR 109 H THR 109 13.905 -18.943 8.789 803 HA THR 109 HA THR 109 11.290 -19.531 9.732 804 HB THR 109 HB THR 109 11.853 -17.207 7.923 805 HG1 THR 109 1HG THR 109 12.433 -17.045 10.675 806 HG21 THR 109 3HG2 THR 109 9.606 -17.339 8.689 807 HG22 THR 109 1HG2 THR 109 10.388 -16.086 9.652 808 HG23 THR 109 2HG2 THR 109 10.118 -17.688 10.340 809 H VAL 110 H VAL 110 12.787 -19.478 6.560 810 HA VAL 110 HA VAL 110 11.893 -19.777 4.449 811 HB VAL 110 HB VAL 110 10.984 -21.995 4.153 812 HG11 VAL 110 1HG1 VAL 110 12.688 -23.320 5.435 813 HG12 VAL 110 2HG1 VAL 110 13.336 -21.957 4.520 814 HG13 VAL 110 3HG1 VAL 110 13.123 -21.827 6.266 815 HG21 VAL 110 3HG2 VAL 110 10.003 -23.286 5.787 816 HG22 VAL 110 1HG2 VAL 110 10.844 -22.457 7.097 817 HG23 VAL 110 2HG2 VAL 110 9.492 -21.672 6.281 818 H GLY 111 H GLY 111 10.313 -17.925 5.894 819 HA2 GLY 111 1HA GLY 111 7.544 -18.694 5.323 820 HA3 GLY 111 2HA GLY 111 8.058 -17.286 6.241 821 H ARG 112 H ARG 112 9.040 -18.400 3.015 822 HA ARG 112 HA ARG 112 9.164 -15.915 1.830 823 HB2 ARG 112 1HB ARG 112 8.791 -18.686 0.802 824 HB3 ARG 112 2HB ARG 112 8.519 -17.355 -0.314 825 HG2 ARG 112 1HG ARG 112 10.859 -16.563 0.639 826 HG3 ARG 112 2HG ARG 112 11.029 -18.292 0.951 827 HD2 ARG 112 1HD ARG 112 10.059 -17.413 -1.722 828 HD3 ARG 112 2HD ARG 112 11.771 -17.223 -1.345 829 HE ARG 112 HE ARG 112 11.224 -19.797 -0.653 830 HH11 ARG 112 1HH1 ARG 112 10.801 -17.907 -3.546 831 HH12 ARG 112 2HH1 ARG 112 10.983 -19.260 -4.613 832 HH21 ARG 112 1HH2 ARG 112 11.465 -21.586 -2.047 833 HH22 ARG 112 2HH2 ARG 112 11.360 -21.352 -3.759 834 H ARG 113 H ARG 113 6.410 -18.170 1.829 835 HA ARG 113 HA ARG 113 4.591 -16.923 0.280 836 HB2 ARG 113 1HB ARG 113 4.221 -18.264 2.948 837 HB3 ARG 113 2HB ARG 113 2.851 -17.654 2.030 838 HG2 ARG 113 1HG ARG 113 3.615 -19.082 0.117 839 HG3 ARG 113 2HG ARG 113 4.792 -19.801 1.219 840 HD2 ARG 113 1HD ARG 113 2.930 -20.450 2.715 841 HD3 ARG 113 2HD ARG 113 1.792 -19.816 1.526 842 HE ARG 113 HE ARG 113 3.248 -21.587 0.096 843 HH11 ARG 113 1HH1 ARG 113 1.530 -21.795 3.117 844 HH12 ARG 113 2HH1 ARG 113 1.152 -23.477 2.936 845 HH21 ARG 113 1HH2 ARG 113 2.757 -23.801 -0.153 846 HH22 ARG 113 2HH2 ARG 113 1.852 -24.617 1.076 847 H GLN 114 H GLN 114 5.841 -15.748 3.293 848 HA GLN 114 HA GLN 114 3.804 -13.790 3.743 849 HB2 GLN 114 1HB GLN 114 5.379 -14.799 5.482 850 HB3 GLN 114 2HB GLN 114 6.608 -13.714 4.846 851 HG2 GLN 114 1HG GLN 114 5.690 -12.653 6.735 852 HG3 GLN 114 2HG GLN 114 5.033 -11.818 5.328 853 HE21 GLN 114 1HE2 GLN 114 2.875 -11.818 4.980 854 HE22 GLN 114 2HE2 GLN 114 1.723 -12.545 6.042 855 H ALA 115 H ALA 115 7.261 -13.372 2.956 856 HA ALA 115 HA ALA 115 7.110 -10.691 2.237 857 HB1 ALA 115 1HB ALA 115 9.205 -11.937 2.663 858 HB2 ALA 115 2HB ALA 115 9.015 -12.732 1.100 859 HB3 ALA 115 3HB ALA 115 9.253 -10.986 1.179 860 H VAL 116 H VAL 116 7.211 -13.500 0.034 861 HA VAL 116 HA VAL 116 6.916 -12.303 -2.380 862 HB VAL 116 HB VAL 116 5.441 -14.786 -1.489 863 HG11 VAL 116 1HG1 VAL 116 6.191 -13.883 -4.268 864 HG12 VAL 116 2HG1 VAL 116 5.370 -15.386 -3.840 865 HG13 VAL 116 3HG1 VAL 116 4.567 -13.836 -3.583 866 HG21 VAL 116 3HG2 VAL 116 7.698 -15.222 -1.092 867 HG22 VAL 116 1HG2 VAL 116 7.432 -15.864 -2.714 868 HG23 VAL 116 2HG2 VAL 116 8.222 -14.301 -2.502 869 H ALA 117 H ALA 117 4.380 -12.823 0.013 870 HA ALA 117 HA ALA 117 2.252 -11.909 -1.661 871 HB1 ALA 117 1HB ALA 117 1.126 -12.962 -0.063 872 HB2 ALA 117 2HB ALA 117 2.537 -12.981 0.995 873 HB3 ALA 117 3HB ALA 117 1.454 -11.590 0.996 874 H TRP 118 H TRP 118 3.678 -10.460 1.276 875 HA TRP 118 HA TRP 118 2.515 -8.024 1.289 876 HB2 TRP 118 1HB TRP 118 4.202 -8.773 2.935 877 HB3 TRP 118 2HB TRP 118 5.469 -8.501 1.742 878 HD1 TRP 118 HD TRP 118 3.557 -6.768 4.424 879 HE1 TRP 118 1HE TRP 118 4.171 -4.269 4.477 880 HE3 TRP 118 3HE TRP 118 6.097 -6.463 -0.002 881 HZ2 TRP 118 2HZ TRP 118 5.549 -2.414 2.856 882 HZ3 TRP 118 3HZ TRP 118 7.031 -4.289 -0.678 883 HH2 TRP 118 HH TRP 118 6.761 -2.308 0.722 884 H LEU 119 H LEU 119 4.893 -9.151 -0.998 885 HA LEU 119 HA LEU 119 5.618 -6.650 -2.094 886 HB2 LEU 119 1HB LEU 119 5.651 -9.437 -3.225 887 HB3 LEU 119 2HB LEU 119 6.275 -8.038 -4.097 888 HG LEU 119 HG LEU 119 7.324 -9.105 -1.475 889 HD11 LEU 119 1HD1 LEU 119 8.994 -9.013 -3.904 890 HD12 LEU 119 2HD1 LEU 119 7.712 -10.223 -3.884 891 HD13 LEU 119 3HD1 LEU 119 8.931 -10.209 -2.609 892 HD21 LEU 119 3HD2 LEU 119 8.153 -6.768 -3.183 893 HD22 LEU 119 1HD2 LEU 119 9.180 -7.480 -1.939 894 HD23 LEU 119 2HD2 LEU 119 7.637 -6.748 -1.496 895 H VAL 120 H VAL 120 3.521 -9.154 -3.536 896 HA VAL 120 HA VAL 120 2.459 -7.529 -5.546 897 HB VAL 120 HB VAL 120 2.226 -9.910 -5.710 898 HG11 VAL 120 1HG1 VAL 120 0.650 -11.134 -4.198 899 HG12 VAL 120 2HG1 VAL 120 2.123 -10.558 -3.415 900 HG13 VAL 120 3HG1 VAL 120 0.602 -9.694 -3.182 901 HG21 VAL 120 3HG2 VAL 120 0.520 -8.716 -6.874 902 HG22 VAL 120 1HG2 VAL 120 -0.242 -10.109 -6.106 903 HG23 VAL 120 2HG2 VAL 120 -0.421 -8.503 -5.398 904 H ALA 121 H ALA 121 1.404 -8.088 -2.233 905 HA ALA 121 HA ALA 121 -1.095 -6.785 -2.428 906 HB1 ALA 121 1HB ALA 121 0.701 -7.450 -0.118 907 HB2 ALA 121 2HB ALA 121 -0.811 -6.569 0.104 908 HB3 ALA 121 3HB ALA 121 -0.830 -8.195 -0.580 909 H MET 122 H MET 122 2.162 -5.637 -1.797 910 HA MET 122 HA MET 122 1.464 -3.051 -0.890 911 HB2 MET 122 1HB MET 122 3.672 -3.915 -0.465 912 HB3 MET 122 2HB MET 122 3.982 -4.101 -2.186 913 HG2 MET 122 1HG MET 122 5.154 -2.181 -1.532 914 HG3 MET 122 2HG MET 122 3.720 -1.599 -2.374 915 HE1 MET 122 3HE MET 122 4.224 0.979 -1.022 916 HE2 MET 122 1HE MET 122 2.754 0.315 -1.736 917 HE3 MET 122 2HE MET 122 2.696 1.074 -0.145 918 H HIS 123 H HIS 123 2.582 -4.178 -4.084 919 HA HIS 123 HA HIS 123 2.245 -1.702 -5.385 920 HB2 HIS 123 1HB HIS 123 3.647 -3.407 -6.364 921 HB3 HIS 123 2HB HIS 123 2.288 -4.520 -6.479 922 HD2 HIS 123 2HD HIS 123 4.013 -1.816 -8.549 923 HE1 HIS 123 1HE HIS 123 0.354 -2.716 -10.499 924 HE2 HIS 123 2HE HIS 123 2.605 -1.604 -10.708 925 H LYS 124 H LYS 124 0.148 -4.568 -5.231 926 HA LYS 124 HA LYS 124 -1.910 -3.721 -6.865 927 HB2 LYS 124 1HB LYS 124 -1.896 -5.452 -4.403 928 HB3 LYS 124 2HB LYS 124 -3.379 -5.139 -5.296 929 HG2 LYS 124 1HG LYS 124 -0.988 -6.141 -6.764 930 HG3 LYS 124 2HG LYS 124 -1.943 -7.262 -5.791 931 HD2 LYS 124 1HD LYS 124 -3.974 -6.356 -7.038 932 HD3 LYS 124 2HD LYS 124 -2.820 -5.621 -8.154 933 HE2 LYS 124 1HE LYS 124 -3.495 -7.719 -9.073 934 HE3 LYS 124 2HE LYS 124 -1.834 -7.887 -8.506 935 HZ1 LYS 124 3HZ LYS 124 -4.274 -8.829 -7.100 936 HZ2 LYS 124 1HZ LYS 124 -2.705 -8.921 -6.475 937 HZ3 LYS 124 2HZ LYS 124 -3.116 -9.798 -7.861 938 H ALA 125 H ALA 125 -1.363 -3.000 -3.447 939 HA ALA 125 HA ALA 125 -3.790 -1.489 -3.175 940 HB1 ALA 125 1HB ALA 125 -2.344 -0.725 -1.039 941 HB2 ALA 125 2HB ALA 125 -3.263 -2.229 -1.111 942 HB3 ALA 125 3HB ALA 125 -1.530 -2.238 -1.437 943 H ALA 126 H ALA 126 -0.362 -0.733 -3.618 944 HA ALA 126 HA ALA 126 -0.378 1.998 -3.261 945 HB1 ALA 126 1HB ALA 126 1.442 1.950 -5.110 946 HB2 ALA 126 2HB ALA 126 1.723 1.091 -3.595 947 HB3 ALA 126 3HB ALA 126 1.224 0.201 -5.033 948 H LYS 127 H LYS 127 -1.719 0.139 -5.868 949 HA LYS 127 HA LYS 127 -1.878 2.117 -7.850 950 HB2 LYS 127 1HB LYS 127 -3.511 -0.340 -7.264 951 HB3 LYS 127 2HB LYS 127 -3.915 0.723 -8.606 952 HG2 LYS 127 1HG LYS 127 -1.830 0.305 -9.671 953 HG3 LYS 127 2HG LYS 127 -1.210 -0.543 -8.252 954 HD2 LYS 127 1HD LYS 127 -1.815 -2.321 -9.569 955 HD3 LYS 127 2HD LYS 127 -3.307 -2.079 -8.658 956 HE2 LYS 127 1HE LYS 127 -2.933 -0.624 -11.232 957 HE3 LYS 127 2HE LYS 127 -3.336 -2.339 -11.276 958 HZ1 LYS 127 3HZ LYS 127 -5.438 -1.777 -10.955 959 HZ2 LYS 127 1HZ LYS 127 -5.033 -0.143 -10.791 960 HZ3 LYS 127 2HZ LYS 127 -5.040 -1.152 -9.434 961 H LEU 128 H LEU 128 -4.382 1.070 -5.533 962 HA LEU 128 HA LEU 128 -6.330 2.921 -6.160 963 HB2 LEU 128 1HB LEU 128 -5.594 1.608 -3.563 964 HB3 LEU 128 2HB LEU 128 -6.973 2.698 -3.694 965 HG LEU 128 HG LEU 128 -6.779 0.353 -5.533 966 HD11 LEU 128 1HD1 LEU 128 -8.063 0.109 -2.839 967 HD12 LEU 128 2HD1 LEU 128 -6.372 -0.323 -3.086 968 HD13 LEU 128 3HD1 LEU 128 -7.636 -1.158 -3.989 969 HD21 LEU 128 3HD2 LEU 128 -8.998 0.702 -5.868 970 HD22 LEU 128 1HD2 LEU 128 -8.541 2.344 -5.415 971 HD23 LEU 128 2HD2 LEU 128 -9.273 1.272 -4.221 972 H LEU 129 H LEU 129 -3.387 3.354 -4.347 973 HA LEU 129 HA LEU 129 -4.064 5.822 -3.121 974 HB2 LEU 129 1HB LEU 129 -1.579 4.274 -3.593 975 HB3 LEU 129 2HB LEU 129 -1.410 5.988 -3.221 976 HG LEU 129 HG LEU 129 -2.773 3.933 -1.481 977 HD11 LEU 129 1HD1 LEU 129 -0.018 5.009 -1.607 978 HD12 LEU 129 2HD1 LEU 129 -0.597 3.424 -1.097 979 HD13 LEU 129 3HD1 LEU 129 -0.735 4.805 -0.009 980 HD21 LEU 129 3HD2 LEU 129 -2.408 5.994 0.143 981 HD22 LEU 129 1HD2 LEU 129 -3.857 5.836 -0.851 982 HD23 LEU 129 2HD2 LEU 129 -2.543 6.892 -1.370 983 H TYR 130 H TYR 130 -2.476 4.970 -6.160 984 HA TYR 130 HA TYR 130 -2.363 7.811 -6.885 985 HB2 TYR 130 1HB TYR 130 -1.200 5.695 -8.634 986 HB3 TYR 130 2HB TYR 130 -0.624 7.327 -8.312 987 HD1 TYR 130 2HD TYR 130 -0.474 7.333 -5.369 988 HD2 TYR 130 1HD TYR 130 0.618 4.316 -8.164 989 HE1 TYR 130 2HE TYR 130 1.160 6.443 -3.761 990 HE2 TYR 130 1HE TYR 130 2.255 3.417 -6.563 991 HH TYR 130 HH TYR 130 3.476 4.965 -4.117 992 H GLU 131 H GLU 131 -3.059 4.734 -8.557 993 HA GLU 131 HA GLU 131 -4.385 5.723 -10.743 994 HB2 GLU 131 1HB GLU 131 -5.049 3.198 -9.219 995 HB3 GLU 131 2HB GLU 131 -5.548 3.551 -10.867 996 HG2 GLU 131 1HG GLU 131 -2.651 3.649 -10.234 997 HG3 GLU 131 2HG GLU 131 -3.433 2.073 -10.335 998 H SER 132 H SER 132 -5.487 5.574 -7.468 999 HA SER 132 HA SER 132 -8.032 6.786 -8.305 1000 HB2 SER 132 1HB SER 132 -8.146 4.299 -7.538 1001 HB3 SER 132 2HB SER 132 -7.915 4.960 -5.920 1002 HG SER 132 HG SER 132 -10.135 4.749 -6.489 1003 H ARG 133 H ARG 133 -9.147 7.830 -6.351 1004 HA ARG 133 HA ARG 133 -7.110 9.132 -4.666 1005 HB2 ARG 133 1HB ARG 133 -9.631 10.355 -5.805 1006 HB3 ARG 133 2HB ARG 133 -8.499 11.165 -4.731 1007 HG2 ARG 133 1HG ARG 133 -6.911 11.414 -6.363 1008 HG3 ARG 133 2HG ARG 133 -7.486 10.023 -7.284 1009 HD2 ARG 133 1HD ARG 133 -9.187 11.216 -8.281 1010 HD3 ARG 133 2HD ARG 133 -9.254 12.405 -6.981 1011 HE ARG 133 HE ARG 133 -6.834 12.865 -8.053 1012 HH11 ARG 133 1HH1 ARG 133 -9.997 12.526 -9.468 1013 HH12 ARG 133 2HH1 ARG 133 -9.660 13.588 -10.795 1014 HH21 ARG 133 1HH2 ARG 133 -6.379 14.266 -9.795 1015 HH22 ARG 133 2HH2 ARG 133 -7.602 14.576 -10.980 1016 H ASP 134 H ASP 134 -8.432 10.403 -2.822 1017 HA ASP 134 HA ASP 134 -9.153 8.675 -0.888 1018 HB2 ASP 134 1HB ASP 134 -10.539 11.329 -1.319 1019 HB3 ASP 134 2HB ASP 134 -10.366 10.471 0.209 1020 H GLN 135 H GLN 135 -11.521 10.243 -3.047 1021 HA GLN 135 HA GLN 135 -13.720 8.720 -2.122 1022 HB2 GLN 135 1HB GLN 135 -13.905 10.913 -3.287 1023 HB3 GLN 135 2HB GLN 135 -13.417 10.124 -4.781 1024 HG2 GLN 135 1HG GLN 135 -15.798 10.380 -4.762 1025 HG3 GLN 135 2HG GLN 135 -15.398 8.669 -4.626 1026 HE21 GLN 135 1HE2 GLN 135 -16.497 11.496 -2.876 1027 HE22 GLN 135 2HE2 GLN 135 -17.243 10.638 -1.576 1028 H SER 136 H SER 136 -13.831 6.582 -2.314 1029 HA SER 136 HA SER 136 -13.381 5.396 -4.955 1030 HB2 SER 136 1HB SER 136 -12.226 4.324 -2.370 1031 HB3 SER 136 2HB SER 136 -12.203 3.473 -3.914 1032 HG SER 136 HG SER 136 -10.281 4.788 -3.279 1033 H GLY 137 H GLY 137 -14.158 3.021 -4.920 1034 HA2 GLY 137 1HA GLY 137 -15.725 1.606 -3.442 1035 HA3 GLY 137 2HA GLY 137 -16.771 3.013 -3.565 1036 HA PRO 138 HA PRO 138 -16.493 1.177 -8.032 1037 HB2 PRO 138 1HB PRO 138 -15.246 -1.221 -8.286 1038 HB3 PRO 138 2HB PRO 138 -14.400 0.323 -8.440 1039 HG2 PRO 138 1HG PRO 138 -14.553 -1.528 -6.092 1040 HG3 PRO 138 2HG PRO 138 -13.151 -0.656 -6.741 1041 HD2 PRO 138 1HD PRO 138 -14.524 0.204 -4.571 1042 HD3 PRO 138 2HD PRO 138 -13.743 1.319 -5.711 1043 H SER 139 H SER 139 -17.931 -0.280 -9.039 1044 HA SER 139 HA SER 139 -19.925 -1.361 -7.365 1045 HB2 SER 139 1HB SER 139 -20.969 -2.161 -9.403 1046 HB3 SER 139 2HB SER 139 -20.309 -0.552 -9.694 1047 HG SER 139 HG SER 139 -19.296 -3.052 -10.536 1048 H SER 140 H SER 140 -20.246 -3.345 -6.548 1049 HA SER 140 HA SER 140 -18.438 -5.507 -7.401 1050 HB2 SER 140 1HB SER 140 -18.047 -6.181 -5.164 1051 HB3 SER 140 2HB SER 140 -17.853 -4.428 -5.154 1052 HG SER 140 HG SER 140 -19.488 -5.875 -3.680 1053 H GLY 141 H GLY 141 -19.426 -7.344 -7.947 1054 HA2 GLY 141 1HA GLY 141 -21.577 -8.551 -6.691 1055 HA3 GLY 141 2HA GLY 141 -22.266 -7.523 -7.939 Start of MODEL 11 1 H1 GLY 1 H GLY 1 -10.592 4.162 5.615 2 HA2 GLY 1 1HA GLY 1 -11.615 5.468 7.201 3 HA3 GLY 1 2HA GLY 1 -12.335 6.320 5.842 4 H SER 2 H SER 2 -13.899 4.252 4.780 5 HA SER 2 HA SER 2 -15.731 3.583 6.979 6 HB2 SER 2 1HB SER 2 -16.374 5.041 4.426 7 HB3 SER 2 2HB SER 2 -17.609 4.117 5.281 8 HG SER 2 HG SER 2 -16.343 6.488 5.990 9 H SER 3 H SER 3 -15.994 1.461 7.019 10 HA SER 3 HA SER 3 -16.545 0.012 4.564 11 HB2 SER 3 1HB SER 3 -14.806 -1.603 4.798 12 HB3 SER 3 2HB SER 3 -14.030 -0.025 4.925 13 HG SER 3 HG SER 3 -14.357 -0.365 7.296 14 H GLY 4 H GLY 4 -17.692 -1.897 4.880 15 HA2 GLY 4 1HA GLY 4 -18.142 -2.893 7.563 16 HA3 GLY 4 2HA GLY 4 -19.533 -2.106 6.832 17 H SER 5 H SER 5 -19.196 -2.944 4.180 18 HA SER 5 HA SER 5 -20.114 -5.687 4.435 19 HB2 SER 5 1HB SER 5 -20.230 -3.593 2.302 20 HB3 SER 5 2HB SER 5 -20.407 -5.285 1.838 21 HG SER 5 HG SER 5 -22.357 -5.226 2.592 22 H SER 6 H SER 6 -18.859 -7.391 4.122 23 HA SER 6 HA SER 6 -16.174 -7.058 3.107 24 HB2 SER 6 1HB SER 6 -16.555 -8.508 5.041 25 HB3 SER 6 2HB SER 6 -17.628 -9.529 4.084 26 HG SER 6 HG SER 6 -15.859 -10.080 2.785 27 H GLY 7 H GLY 7 -16.165 -6.729 0.936 28 HA2 GLY 7 1HA GLY 7 -17.448 -8.817 -0.718 29 HA3 GLY 7 2HA GLY 7 -17.322 -7.137 -1.218 30 H ALA 8 H ALA 8 -14.741 -6.506 -0.659 31 HA ALA 8 HA ALA 8 -13.341 -7.993 -2.712 32 HB1 ALA 8 1HB ALA 8 -11.603 -6.094 -1.614 33 HB2 ALA 8 2HB ALA 8 -12.529 -5.966 -3.110 34 HB3 ALA 8 3HB ALA 8 -13.201 -5.347 -1.601 35 H GLU 9 H GLU 9 -13.274 -9.986 -1.400 36 HA GLU 9 HA GLU 9 -12.035 -10.353 1.013 37 HB2 GLU 9 1HB GLU 9 -11.315 -12.612 0.068 38 HB3 GLU 9 2HB GLU 9 -13.033 -12.242 0.026 39 HG2 GLU 9 1HG GLU 9 -12.413 -11.346 -2.381 40 HG3 GLU 9 2HG GLU 9 -11.090 -12.496 -2.197 41 H PHE 10 H PHE 10 -10.401 -10.582 -2.151 42 HA PHE 10 HA PHE 10 -7.842 -11.013 -1.490 43 HB2 PHE 10 1HB PHE 10 -8.974 -10.262 -3.767 44 HB3 PHE 10 2HB PHE 10 -8.285 -8.702 -3.328 45 HD1 PHE 10 1HD PHE 10 -5.795 -8.577 -2.881 46 HD2 PHE 10 2HD PHE 10 -7.658 -11.923 -4.739 47 HE1 PHE 10 1HE PHE 10 -3.618 -9.282 -3.787 48 HE2 PHE 10 2HE PHE 10 -5.484 -12.634 -5.646 49 HZ PHE 10 HZ PHE 10 -3.460 -11.314 -5.170 50 H TYR 11 H TYR 11 -9.210 -7.718 -1.566 51 HA TYR 11 HA TYR 11 -7.007 -6.402 -0.491 52 HB2 TYR 11 1HB TYR 11 -9.944 -5.782 -0.550 53 HB3 TYR 11 2HB TYR 11 -8.833 -4.729 0.318 54 HD1 TYR 11 1HD TYR 11 -6.959 -3.626 -0.950 55 HD2 TYR 11 2HD TYR 11 -10.131 -5.683 -2.904 56 HE1 TYR 11 1HE TYR 11 -6.407 -2.471 -3.050 57 HE2 TYR 11 2HE TYR 11 -9.587 -4.534 -5.009 58 HH TYR 11 HH TYR 11 -8.283 -2.074 -5.478 59 H ASP 12 H ASP 12 -9.971 -7.393 1.231 60 HA ASP 12 HA ASP 12 -9.436 -6.714 3.775 61 HB2 ASP 12 1HB ASP 12 -10.746 -9.125 2.604 62 HB3 ASP 12 2HB ASP 12 -10.441 -9.106 4.339 63 H LYS 13 H LYS 13 -7.767 -9.154 1.941 64 HA LYS 13 HA LYS 13 -6.365 -10.194 4.257 65 HB2 LYS 13 1HB LYS 13 -6.236 -10.801 1.307 66 HB3 LYS 13 2HB LYS 13 -5.112 -11.509 2.460 67 HG2 LYS 13 1HG LYS 13 -8.083 -11.755 2.788 68 HG3 LYS 13 2HG LYS 13 -7.147 -12.885 1.806 69 HD2 LYS 13 1HD LYS 13 -5.787 -13.471 3.727 70 HD3 LYS 13 2HD LYS 13 -6.629 -12.278 4.718 71 HE2 LYS 13 1HE LYS 13 -7.792 -14.142 5.321 72 HE3 LYS 13 2HE LYS 13 -8.745 -13.656 3.921 73 HZ1 LYS 13 3HZ LYS 13 -8.160 -16.046 3.963 74 HZ2 LYS 13 1HZ LYS 13 -6.528 -15.625 3.814 75 HZ3 LYS 13 2HZ LYS 13 -7.615 -15.248 2.574 76 H GLN 14 H GLN 14 -5.611 -8.290 1.361 77 HA GLN 14 HA GLN 14 -2.867 -7.989 1.804 78 HB2 GLN 14 1HB GLN 14 -4.827 -6.140 0.436 79 HB3 GLN 14 2HB GLN 14 -3.080 -5.951 0.371 80 HG2 GLN 14 1HG GLN 14 -2.925 -8.199 -0.659 81 HG3 GLN 14 2HG GLN 14 -4.686 -8.258 -0.698 82 HE21 GLN 14 1HE2 GLN 14 -5.463 -5.879 -1.537 83 HE22 GLN 14 2HE2 GLN 14 -4.820 -5.507 -3.097 84 H LEU 15 H LEU 15 -5.533 -6.659 3.469 85 HA LEU 15 HA LEU 15 -4.166 -4.329 4.467 86 HB2 LEU 15 1HB LEU 15 -6.142 -3.743 5.424 87 HB3 LEU 15 2HB LEU 15 -6.737 -4.826 4.166 88 HG LEU 15 HG LEU 15 -6.723 -6.643 5.958 89 HD11 LEU 15 1HD1 LEU 15 -5.779 -4.367 7.489 90 HD12 LEU 15 2HD1 LEU 15 -5.768 -6.084 7.889 91 HD13 LEU 15 3HD1 LEU 15 -7.207 -5.115 8.205 92 HD21 LEU 15 3HD2 LEU 15 -8.924 -6.288 6.158 93 HD22 LEU 15 1HD2 LEU 15 -8.643 -4.892 5.118 94 HD23 LEU 15 2HD2 LEU 15 -8.699 -4.689 6.869 95 H LYS 16 H LYS 16 -5.053 -7.518 5.729 96 HA LYS 16 HA LYS 16 -3.889 -7.045 8.304 97 HB2 LYS 16 1HB LYS 16 -4.385 -9.363 8.758 98 HB3 LYS 16 2HB LYS 16 -5.755 -8.642 7.923 99 HG2 LYS 16 1HG LYS 16 -5.180 -9.720 5.882 100 HG3 LYS 16 2HG LYS 16 -3.632 -10.260 6.537 101 HD2 LYS 16 1HD LYS 16 -5.099 -12.133 6.579 102 HD3 LYS 16 2HD LYS 16 -4.928 -11.574 8.244 103 HE2 LYS 16 1HE LYS 16 -7.064 -10.147 7.579 104 HE3 LYS 16 2HE LYS 16 -7.274 -11.462 6.423 105 HZ1 LYS 16 3HZ LYS 16 -6.722 -12.139 9.220 106 HZ2 LYS 16 1HZ LYS 16 -7.635 -12.977 8.069 107 HZ3 LYS 16 2HZ LYS 16 -8.275 -11.603 8.819 108 H VAL 17 H VAL 17 -2.881 -8.675 5.339 109 HA VAL 17 HA VAL 17 -0.478 -9.763 6.384 110 HB VAL 17 HB VAL 17 -1.209 -9.112 3.526 111 HG11 VAL 17 1HG1 VAL 17 1.288 -9.467 4.269 112 HG12 VAL 17 2HG1 VAL 17 0.813 -11.167 4.272 113 HG13 VAL 17 3HG1 VAL 17 0.665 -10.212 2.797 114 HG21 VAL 17 3HG2 VAL 17 -1.547 -11.636 3.460 115 HG22 VAL 17 1HG2 VAL 17 -1.542 -11.569 5.223 116 HG23 VAL 17 2HG2 VAL 17 -2.768 -10.689 4.310 117 H LEU 18 H LEU 18 -1.247 -6.758 4.687 118 HA LEU 18 HA LEU 18 1.383 -5.841 4.333 119 HB2 LEU 18 1HB LEU 18 -1.299 -4.538 4.446 120 HB3 LEU 18 2HB LEU 18 0.149 -3.533 4.438 121 HG LEU 18 HG LEU 18 -0.486 -5.567 2.306 122 HD11 LEU 18 1HD1 LEU 18 -1.852 -4.135 1.304 123 HD12 LEU 18 2HD1 LEU 18 -0.697 -2.815 1.485 124 HD13 LEU 18 3HD1 LEU 18 -1.835 -3.174 2.783 125 HD21 LEU 18 3HD2 LEU 18 1.254 -4.546 1.066 126 HD22 LEU 18 1HD2 LEU 18 1.900 -4.844 2.680 127 HD23 LEU 18 2HD2 LEU 18 1.393 -3.218 2.219 128 H LEU 19 H LEU 19 -0.987 -4.760 6.776 129 HA LEU 19 HA LEU 19 0.623 -3.194 8.326 130 HB2 LEU 19 1HB LEU 19 -1.487 -5.112 9.303 131 HB3 LEU 19 2HB LEU 19 -0.835 -3.757 10.223 132 HG LEU 19 HG LEU 19 -2.259 -3.372 7.603 133 HD11 LEU 19 1HD1 LEU 19 -3.469 -4.500 9.776 134 HD12 LEU 19 2HD1 LEU 19 -4.283 -3.549 8.534 135 HD13 LEU 19 3HD1 LEU 19 -3.766 -2.781 10.035 136 HD21 LEU 19 3HD2 LEU 19 -2.009 -1.481 9.923 137 HD22 LEU 19 1HD2 LEU 19 -2.430 -1.124 8.247 138 HD23 LEU 19 2HD2 LEU 19 -0.779 -1.586 8.662 139 H SER 20 H SER 20 0.159 -6.704 8.706 140 HA SER 20 HA SER 20 1.664 -7.282 10.869 141 HB2 SER 20 1HB SER 20 0.519 -8.858 9.129 142 HB3 SER 20 2HB SER 20 2.119 -8.914 8.390 143 HG SER 20 HG SER 20 1.371 -10.450 10.253 144 H GLY 21 H GLY 21 3.016 -6.985 7.578 145 HA2 GLY 21 1HA GLY 21 5.033 -5.828 7.090 146 HA3 GLY 21 2HA GLY 21 5.511 -6.007 8.771 147 H ALA 22 H ALA 22 6.887 -6.674 6.202 148 HA ALA 22 HA ALA 22 7.558 -9.449 6.902 149 HB1 ALA 22 1HB ALA 22 6.772 -8.365 4.247 150 HB2 ALA 22 2HB ALA 22 8.012 -9.619 4.309 151 HB3 ALA 22 3HB ALA 22 6.412 -9.927 4.984 152 H THR 23 H THR 23 9.715 -10.097 6.333 153 HA THR 23 HA THR 23 11.596 -7.896 6.567 154 HB THR 23 HB THR 23 12.192 -10.858 6.509 155 HG1 THR 23 1HG THR 23 11.604 -10.913 8.545 156 HG21 THR 23 3HG2 THR 23 14.303 -10.306 7.423 157 HG22 THR 23 1HG2 THR 23 13.813 -8.644 7.749 158 HG23 THR 23 2HG2 THR 23 14.057 -9.182 6.087 159 H PHE 24 H PHE 24 13.231 -7.422 5.117 160 HA PHE 24 HA PHE 24 13.499 -8.941 2.669 161 HB2 PHE 24 1HB PHE 24 12.602 -6.053 2.578 162 HB3 PHE 24 2HB PHE 24 13.017 -7.050 1.188 163 HD1 PHE 24 2HD PHE 24 11.600 -9.092 0.713 164 HD2 PHE 24 1HD PHE 24 10.439 -6.047 3.451 165 HE1 PHE 24 2HE PHE 24 9.264 -9.848 0.557 166 HE2 PHE 24 1HE PHE 24 8.101 -6.799 3.301 167 HZ PHE 24 HZ PHE 24 7.510 -8.700 1.852 168 H LEU 25 H LEU 25 15.105 -7.680 1.161 169 HA LEU 25 HA LEU 25 17.317 -6.804 2.884 170 HB2 LEU 25 1HB LEU 25 17.180 -8.170 0.230 171 HB3 LEU 25 2HB LEU 25 18.620 -7.256 0.673 172 HG LEU 25 HG LEU 25 17.497 -9.614 2.185 173 HD11 LEU 25 1HD1 LEU 25 19.955 -9.382 0.454 174 HD12 LEU 25 2HD1 LEU 25 18.472 -10.239 0.031 175 HD13 LEU 25 3HD1 LEU 25 19.461 -10.801 1.379 176 HD21 LEU 25 3HD2 LEU 25 19.417 -7.554 2.882 177 HD22 LEU 25 1HD2 LEU 25 20.115 -9.172 2.959 178 HD23 LEU 25 2HD2 LEU 25 18.667 -8.790 3.892 179 H VAL 26 H VAL 26 17.544 -4.674 2.998 180 HA VAL 26 HA VAL 26 16.829 -3.028 0.674 181 HB VAL 26 HB VAL 26 17.306 -2.205 3.543 182 HG11 VAL 26 1HG1 VAL 26 16.864 -0.016 2.965 183 HG12 VAL 26 2HG1 VAL 26 17.798 -0.568 1.573 184 HG13 VAL 26 3HG1 VAL 26 16.040 -0.464 1.472 185 HG21 VAL 26 3HG2 VAL 26 14.809 -1.664 3.360 186 HG22 VAL 26 1HG2 VAL 26 14.818 -2.712 1.942 187 HG23 VAL 26 2HG2 VAL 26 15.268 -3.360 3.519 188 H THR 27 H THR 27 18.300 -1.835 -0.398 189 HA THR 27 HA THR 27 21.053 -1.781 0.655 190 HB THR 27 HB THR 27 20.492 -1.833 -2.295 191 HG1 THR 27 1HG THR 27 21.119 -4.214 -1.866 192 HG21 THR 27 3HG2 THR 27 22.730 -1.206 -1.605 193 HG22 THR 27 1HG2 THR 27 22.767 -2.806 -2.344 194 HG23 THR 27 2HG2 THR 27 22.851 -2.643 -0.590 195 H PHE 28 H PHE 28 21.424 0.259 1.249 196 HA PHE 28 HA PHE 28 20.195 2.476 -0.148 197 HB2 PHE 28 1HB PHE 28 22.215 2.616 2.092 198 HB3 PHE 28 2HB PHE 28 21.074 3.861 1.594 199 HD1 PHE 28 2HD PHE 28 18.667 3.591 2.069 200 HD2 PHE 28 1HD PHE 28 21.577 0.865 3.557 201 HE1 PHE 28 2HE PHE 28 17.037 2.753 3.711 202 HE2 PHE 28 1HE PHE 28 19.951 0.022 5.201 203 HZ PHE 28 HZ PHE 28 17.679 0.967 5.280 204 H GLY 29 H GLY 29 21.642 4.421 -0.634 205 HA2 GLY 29 1HA GLY 29 23.438 3.727 -2.681 206 HA3 GLY 29 2HA GLY 29 23.264 5.329 -1.980 207 H ASN 30 H ASN 30 23.990 4.581 0.694 208 HA ASN 30 HA ASN 30 26.846 4.693 0.398 209 HB2 ASN 30 1HB ASN 30 25.173 4.519 2.915 210 HB3 ASN 30 2HB ASN 30 26.880 4.947 2.833 211 HD21 ASN 30 1HD2 ASN 30 24.311 6.354 3.666 212 HD22 ASN 30 2HD2 ASN 30 24.409 7.885 2.871 213 H SER 31 H SER 31 24.509 2.367 1.687 214 HA SER 31 HA SER 31 26.556 0.471 2.404 215 HB2 SER 31 1HB SER 31 23.566 0.037 2.222 216 HB3 SER 31 2HB SER 31 24.730 -0.970 3.083 217 HG SER 31 HG SER 31 24.653 1.730 3.751 218 H GLU 32 H GLU 32 27.542 -0.824 1.016 219 HA GLU 32 HA GLU 32 26.528 -1.178 -1.661 220 HB2 GLU 32 1HB GLU 32 28.951 -2.441 -0.368 221 HB3 GLU 32 2HB GLU 32 28.604 -2.360 -2.090 222 HG2 GLU 32 1HG GLU 32 28.736 0.110 -1.950 223 HG3 GLU 32 2HG GLU 32 29.224 -0.051 -0.264 224 H LYS 33 H LYS 33 26.708 -3.030 1.289 225 HA LYS 33 HA LYS 33 25.650 -5.398 -0.086 226 HB2 LYS 33 1HB LYS 33 27.350 -6.224 1.202 227 HB3 LYS 33 2HB LYS 33 27.195 -4.957 2.411 228 HG2 LYS 33 1HG LYS 33 25.627 -6.093 3.608 229 HG3 LYS 33 2HG LYS 33 24.997 -6.938 2.192 230 HD2 LYS 33 1HD LYS 33 26.203 -8.423 3.773 231 HD3 LYS 33 2HD LYS 33 26.906 -8.405 2.154 232 HE2 LYS 33 1HE LYS 33 28.484 -6.609 3.054 233 HE3 LYS 33 2HE LYS 33 27.925 -7.088 4.656 234 HZ1 LYS 33 3HZ LYS 33 29.787 -8.388 2.927 235 HZ2 LYS 33 1HZ LYS 33 28.557 -9.441 3.417 236 HZ3 LYS 33 2HZ LYS 33 29.494 -8.638 4.574 237 HA PRO 34 HA PRO 34 21.597 -4.567 1.441 238 HB2 PRO 34 1HB PRO 34 20.557 -7.060 1.172 239 HB3 PRO 34 2HB PRO 34 20.857 -5.991 -0.203 240 HG2 PRO 34 1HG PRO 34 22.516 -8.259 0.831 241 HG3 PRO 34 2HG PRO 34 22.114 -7.840 -0.844 242 HD2 PRO 34 1HD PRO 34 24.498 -7.220 0.281 243 HD3 PRO 34 2HD PRO 34 23.732 -6.202 -0.955 244 H GLU 35 H GLU 35 20.504 -4.670 3.349 245 HA GLU 35 HA GLU 35 21.521 -6.550 5.378 246 HB2 GLU 35 1HB GLU 35 22.199 -4.189 5.783 247 HB3 GLU 35 2HB GLU 35 20.499 -3.747 5.862 248 HG2 GLU 35 1HG GLU 35 20.985 -3.965 8.079 249 HG3 GLU 35 2HG GLU 35 20.414 -5.591 7.712 250 H THR 36 H THR 36 20.040 -7.453 6.811 251 HA THR 36 HA THR 36 17.431 -7.883 5.772 252 HB THR 36 HB THR 36 18.423 -8.568 8.544 253 HG1 THR 36 1HG THR 36 19.517 -9.373 6.394 254 HG21 THR 36 3HG2 THR 36 16.225 -9.731 6.830 255 HG22 THR 36 1HG2 THR 36 16.014 -8.780 8.299 256 HG23 THR 36 2HG2 THR 36 16.753 -10.380 8.382 257 H MET 37 H MET 37 15.971 -6.287 5.780 258 HA MET 37 HA MET 37 15.552 -4.825 8.305 259 HB2 MET 37 1HB MET 37 15.430 -3.862 5.458 260 HB3 MET 37 2HB MET 37 14.579 -3.015 6.743 261 HG2 MET 37 1HG MET 37 16.938 -3.101 7.903 262 HG3 MET 37 2HG MET 37 17.493 -3.267 6.239 263 HE1 MET 37 3HE MET 37 16.464 -1.174 9.020 264 HE2 MET 37 1HE MET 37 18.005 -0.554 8.427 265 HE3 MET 37 2HE MET 37 16.574 0.476 8.403 266 H THR 38 H THR 38 13.240 -3.748 8.200 267 HA THR 38 HA THR 38 11.329 -5.780 7.251 268 HB THR 38 HB THR 38 11.148 -4.265 9.863 269 HG1 THR 38 1HG THR 38 12.670 -6.218 9.476 270 HG21 THR 38 3HG2 THR 38 9.221 -5.783 8.292 271 HG22 THR 38 1HG2 THR 38 8.961 -4.709 9.665 272 HG23 THR 38 2HG2 THR 38 9.396 -6.397 9.936 273 H CYS 39 H CYS 39 9.732 -5.016 6.025 274 HA CYS 39 HA CYS 39 9.200 -2.118 6.083 275 HB2 CYS 39 1HB CYS 39 9.044 -4.018 3.734 276 HB3 CYS 39 2HB CYS 39 8.572 -2.324 3.692 277 HG CYS 39 HG CYS 39 11.542 -3.663 3.265 278 H ARG 40 H ARG 40 7.276 -1.643 6.889 279 HA ARG 40 HA ARG 40 4.979 -3.317 6.192 280 HB2 ARG 40 1HB ARG 40 4.183 -3.433 8.457 281 HB3 ARG 40 2HB ARG 40 5.831 -4.048 8.420 282 HG2 ARG 40 1HG ARG 40 6.543 -1.706 9.130 283 HG3 ARG 40 2HG ARG 40 4.838 -1.432 9.494 284 HD2 ARG 40 1HD ARG 40 5.013 -3.618 10.854 285 HD3 ARG 40 2HD ARG 40 6.754 -3.356 10.760 286 HE ARG 40 HE ARG 40 5.515 -0.999 11.653 287 HH11 ARG 40 1HH1 ARG 40 6.205 -4.240 12.720 288 HH12 ARG 40 2HH1 ARG 40 6.265 -3.815 14.399 289 HH21 ARG 40 1HH2 ARG 40 5.591 -0.426 13.860 290 HH22 ARG 40 2HH2 ARG 40 5.914 -1.645 15.046 291 H LEU 41 H LEU 41 2.896 -2.237 6.710 292 HA LEU 41 HA LEU 41 3.147 0.652 6.250 293 HB2 LEU 41 1HB LEU 41 1.120 -1.405 5.518 294 HB3 LEU 41 2HB LEU 41 0.600 0.268 5.708 295 HG LEU 41 HG LEU 41 2.898 -0.370 3.906 296 HD11 LEU 41 1HD1 LEU 41 0.134 -0.330 2.802 297 HD12 LEU 41 2HD1 LEU 41 0.752 -1.826 3.502 298 HD13 LEU 41 3HD1 LEU 41 1.601 -1.067 2.155 299 HD21 LEU 41 3HD2 LEU 41 2.532 1.940 4.265 300 HD22 LEU 41 1HD2 LEU 41 0.788 1.769 4.066 301 HD23 LEU 41 2HD2 LEU 41 1.856 1.575 2.676 302 H SER 42 H SER 42 2.480 2.080 7.722 303 HA SER 42 HA SER 42 1.877 1.393 10.339 304 HB2 SER 42 1HB SER 42 2.539 3.698 9.192 305 HB3 SER 42 2HB SER 42 0.797 3.962 9.268 306 HG SER 42 HG SER 42 1.476 3.023 11.610 307 H ASN 43 H ASN 43 -0.163 2.075 11.523 308 HA ASN 43 HA ASN 43 -2.287 0.466 10.814 309 HB2 ASN 43 1HB ASN 43 -1.848 1.557 13.062 310 HB3 ASN 43 2HB ASN 43 -2.586 3.015 12.405 311 HD21 ASN 43 1HD2 ASN 43 -4.388 3.111 13.612 312 HD22 ASN 43 2HD2 ASN 43 -5.621 1.901 13.626 313 H ASN 44 H ASN 44 -1.647 3.799 9.925 314 HA ASN 44 HA ASN 44 -4.227 4.234 8.746 315 HB2 ASN 44 1HB ASN 44 -1.640 5.784 8.494 316 HB3 ASN 44 2HB ASN 44 -3.197 6.320 7.868 317 HD21 ASN 44 1HD2 ASN 44 -1.926 7.948 9.552 318 HD22 ASN 44 2HD2 ASN 44 -2.692 7.964 11.101 319 H GLN 45 H GLN 45 -1.294 2.777 7.743 320 HA GLN 45 HA GLN 45 -0.578 1.881 5.778 321 HB2 GLN 45 1HB GLN 45 -3.547 1.929 5.220 322 HB3 GLN 45 2HB GLN 45 -2.368 1.104 4.209 323 HG2 GLN 45 1HG GLN 45 -1.772 -0.360 6.035 324 HG3 GLN 45 2HG GLN 45 -2.862 0.506 7.116 325 HE21 GLN 45 1HE2 GLN 45 -2.710 -2.323 6.047 326 HE22 GLN 45 2HE2 GLN 45 -4.311 -2.643 5.481 327 H ARG 46 H ARG 46 -0.404 4.670 5.960 328 HA ARG 46 HA ARG 46 -0.781 5.430 3.139 329 HB2 ARG 46 1HB ARG 46 -1.318 7.012 5.633 330 HB3 ARG 46 2HB ARG 46 -0.905 7.831 4.133 331 HG2 ARG 46 1HG ARG 46 -2.822 6.387 3.131 332 HG3 ARG 46 2HG ARG 46 -3.332 6.238 4.814 333 HD2 ARG 46 1HD ARG 46 -3.261 8.735 4.966 334 HD3 ARG 46 2HD ARG 46 -2.971 8.774 3.227 335 HE ARG 46 HE ARG 46 -5.298 7.264 3.906 336 HH11 ARG 46 1HH1 ARG 46 -4.079 10.488 3.415 337 HH12 ARG 46 2HH1 ARG 46 -5.625 11.147 2.992 338 HH21 ARG 46 1HH2 ARG 46 -7.337 8.120 3.350 339 HH22 ARG 46 2HH2 ARG 46 -7.477 9.800 2.955 340 H TYR 47 H TYR 47 1.406 4.729 5.482 341 HA TYR 47 HA TYR 47 3.528 6.118 4.048 342 HB2 TYR 47 1HB TYR 47 3.013 6.427 7.006 343 HB3 TYR 47 2HB TYR 47 4.568 6.787 6.264 344 HD1 TYR 47 1HD TYR 47 4.825 8.710 4.781 345 HD2 TYR 47 2HD TYR 47 1.103 7.872 6.665 346 HE1 TYR 47 1HE TYR 47 4.045 10.977 4.235 347 HE2 TYR 47 2HE TYR 47 0.312 10.137 6.123 348 HH TYR 47 HH TYR 47 2.441 12.512 4.603 349 H LEU 48 H LEU 48 5.516 5.090 4.138 350 HA LEU 48 HA LEU 48 5.434 2.367 5.223 351 HB2 LEU 48 1HB LEU 48 6.823 3.677 2.954 352 HB3 LEU 48 2HB LEU 48 7.652 2.341 3.749 353 HG LEU 48 HG LEU 48 4.900 2.172 2.525 354 HD11 LEU 48 1HD1 LEU 48 7.038 2.517 1.036 355 HD12 LEU 48 2HD1 LEU 48 5.805 1.335 0.599 356 HD13 LEU 48 3HD1 LEU 48 7.289 0.807 1.392 357 HD21 LEU 48 3HD2 LEU 48 4.767 0.069 3.288 358 HD22 LEU 48 1HD2 LEU 48 5.977 0.589 4.460 359 HD23 LEU 48 2HD2 LEU 48 6.476 -0.253 2.992 360 H PHE 49 H PHE 49 7.047 1.559 6.545 361 HA PHE 49 HA PHE 49 9.055 3.471 7.516 362 HB2 PHE 49 1HB PHE 49 7.195 1.783 9.192 363 HB3 PHE 49 2HB PHE 49 8.657 2.526 9.833 364 HD1 PHE 49 1HD PHE 49 8.857 5.007 9.866 365 HD2 PHE 49 2HD PHE 49 5.220 3.030 8.878 366 HE1 PHE 49 1HE PHE 49 7.615 7.088 10.290 367 HE2 PHE 49 2HE PHE 49 3.972 5.108 9.300 368 HZ PHE 49 HZ PHE 49 5.170 7.141 10.006 369 H LEU 50 H LEU 50 11.003 2.583 8.198 370 HA LEU 50 HA LEU 50 11.352 -0.281 7.600 371 HB2 LEU 50 1HB LEU 50 13.422 1.886 7.302 372 HB3 LEU 50 2HB LEU 50 13.581 0.195 6.831 373 HG LEU 50 HG LEU 50 11.510 1.959 5.568 374 HD11 LEU 50 1HD1 LEU 50 13.208 3.266 4.874 375 HD12 LEU 50 2HD1 LEU 50 13.478 1.951 3.731 376 HD13 LEU 50 3HD1 LEU 50 14.433 2.042 5.212 377 HD21 LEU 50 3HD2 LEU 50 12.222 0.312 3.655 378 HD22 LEU 50 1HD2 LEU 50 11.101 -0.202 4.917 379 HD23 LEU 50 2HD2 LEU 50 12.800 -0.668 5.004 380 H ASP 51 H ASP 51 12.976 -1.406 8.823 381 HA ASP 51 HA ASP 51 13.993 -0.118 11.222 382 HB2 ASP 51 1HB ASP 51 11.614 -1.136 11.602 383 HB3 ASP 51 2HB ASP 51 12.472 -2.674 11.606 384 H GLY 52 H GLY 52 15.933 -0.911 11.806 385 HA2 GLY 52 1HA GLY 52 16.914 -3.428 11.838 386 HA3 GLY 52 2HA GLY 52 17.105 -2.973 10.151 387 H ASP 53 H ASP 53 19.199 -2.587 9.841 388 HA ASP 53 HA ASP 53 21.204 -2.029 11.515 389 HB2 ASP 53 1HB ASP 53 21.592 -2.248 9.136 390 HB3 ASP 53 2HB ASP 53 20.758 -0.728 8.822 391 H SER 54 H SER 54 19.050 0.460 10.171 392 HA SER 54 HA SER 54 19.487 2.094 12.533 393 HB2 SER 54 1HB SER 54 20.012 4.116 11.169 394 HB3 SER 54 2HB SER 54 21.272 2.884 11.092 395 HG SER 54 HG SER 54 20.874 2.602 9.036 396 H HIS 55 H HIS 55 18.077 4.108 12.428 397 HA HIS 55 HA HIS 55 15.411 3.297 11.824 398 HB2 HIS 55 1HB HIS 55 14.719 5.295 12.864 399 HB3 HIS 55 2HB HIS 55 16.188 4.836 13.721 400 HD2 HIS 55 2HD HIS 55 18.526 6.368 12.796 401 HE1 HIS 55 1HE HIS 55 16.096 9.632 11.597 402 HE2 HIS 55 2HE HIS 55 18.447 8.835 12.022 403 H TYR 56 H TYR 56 14.371 3.472 9.960 404 HA TYR 56 HA TYR 56 15.028 5.678 8.147 405 HB2 TYR 56 1HB TYR 56 15.276 2.766 7.583 406 HB3 TYR 56 2HB TYR 56 14.637 3.789 6.301 407 HD1 TYR 56 1HD TYR 56 16.058 5.983 5.848 408 HD2 TYR 56 2HD TYR 56 17.561 2.456 7.694 409 HE1 TYR 56 1HE TYR 56 18.345 6.639 5.226 410 HE2 TYR 56 2HE TYR 56 19.853 3.104 7.078 411 HH TYR 56 HH TYR 56 20.520 6.186 5.464 412 H GLU 57 H GLU 57 13.348 6.280 6.728 413 HA GLU 57 HA GLU 57 10.787 4.925 6.945 414 HB2 GLU 57 1HB GLU 57 11.068 7.836 7.712 415 HB3 GLU 57 2HB GLU 57 9.574 6.911 7.656 416 HG2 GLU 57 1HG GLU 57 10.039 6.893 9.897 417 HG3 GLU 57 2HG GLU 57 10.774 5.378 9.378 418 H ILE 58 H ILE 58 9.825 4.907 5.025 419 HA ILE 58 HA ILE 58 10.692 6.877 3.017 420 HB ILE 58 HB ILE 58 9.542 4.116 2.601 421 HG12 ILE 58 1HG1 ILE 58 12.310 5.153 1.967 422 HG13 ILE 58 2HG1 ILE 58 11.915 4.258 3.430 423 HG21 ILE 58 1HG2 ILE 58 8.987 5.956 0.900 424 HG22 ILE 58 2HG2 ILE 58 10.694 5.875 0.465 425 HG23 ILE 58 3HG2 ILE 58 9.672 4.448 0.295 426 HD11 ILE 58 3HD1 ILE 58 11.180 2.368 2.010 427 HD12 ILE 58 1HD1 ILE 58 11.738 3.265 0.597 428 HD13 ILE 58 2HD1 ILE 58 12.889 2.766 1.837 429 H GLU 59 H GLU 59 9.235 8.505 3.167 430 HA GLU 59 HA GLU 59 6.479 8.160 3.696 431 HB2 GLU 59 1HB GLU 59 8.160 10.426 2.687 432 HB3 GLU 59 2HB GLU 59 6.407 10.558 2.648 433 HG2 GLU 59 1HG GLU 59 6.261 10.317 5.013 434 HG3 GLU 59 2HG GLU 59 7.973 9.913 5.132 435 H ILE 60 H ILE 60 5.089 7.171 2.398 436 HA ILE 60 HA ILE 60 5.462 6.516 -0.264 437 HB ILE 60 HB ILE 60 2.866 6.933 1.219 438 HG12 ILE 60 1HG1 ILE 60 4.548 4.486 0.647 439 HG13 ILE 60 2HG1 ILE 60 4.220 5.203 2.221 440 HG21 ILE 60 1HG2 ILE 60 3.381 6.369 -1.572 441 HG22 ILE 60 2HG2 ILE 60 2.442 5.089 -0.807 442 HG23 ILE 60 3HG2 ILE 60 1.864 6.754 -0.761 443 HD11 ILE 60 3HD1 ILE 60 2.636 3.342 0.637 444 HD12 ILE 60 1HD1 ILE 60 2.630 3.653 2.373 445 HD13 ILE 60 2HD1 ILE 60 1.708 4.693 1.287 446 H VAL 61 H VAL 61 4.299 9.480 1.144 447 HA VAL 61 HA VAL 61 3.018 10.601 -1.084 448 HB VAL 61 HB VAL 61 3.428 12.786 -0.027 449 HG11 VAL 61 1HG1 VAL 61 1.812 10.825 0.855 450 HG12 VAL 61 2HG1 VAL 61 2.761 11.120 2.313 451 HG13 VAL 61 3HG1 VAL 61 1.862 12.439 1.562 452 HG21 VAL 61 3HG2 VAL 61 5.688 11.513 1.027 453 HG22 VAL 61 1HG2 VAL 61 5.144 13.162 1.336 454 HG23 VAL 61 2HG2 VAL 61 4.645 11.853 2.408 455 H HIS 62 H HIS 62 6.388 10.264 -0.281 456 HA HIS 62 HA HIS 62 7.259 12.126 -2.323 457 HB2 HIS 62 1HB HIS 62 8.632 10.409 -0.289 458 HB3 HIS 62 2HB HIS 62 9.554 11.042 -1.649 459 HD2 HIS 62 2HD HIS 62 6.875 13.222 0.215 460 HE1 HIS 62 1HE HIS 62 10.726 14.851 0.929 461 HE2 HIS 62 2HE HIS 62 8.251 15.117 1.311 462 H ILE 63 H ILE 63 7.200 8.627 -1.808 463 HA ILE 63 HA ILE 63 8.654 7.696 -3.920 464 HB ILE 63 HB ILE 63 5.986 6.576 -3.051 465 HG12 ILE 63 1HG1 ILE 63 8.780 6.023 -2.027 466 HG13 ILE 63 2HG1 ILE 63 7.506 6.867 -1.152 467 HG21 ILE 63 1HG2 ILE 63 7.670 5.812 -5.145 468 HG22 ILE 63 2HG2 ILE 63 7.965 4.649 -3.854 469 HG23 ILE 63 3HG2 ILE 63 6.328 4.894 -4.462 470 HD11 ILE 63 3HD1 ILE 63 7.586 4.673 -0.298 471 HD12 ILE 63 1HD1 ILE 63 6.153 4.755 -1.322 472 HD13 ILE 63 2HD1 ILE 63 7.616 3.966 -1.913 473 H SER 64 H SER 64 8.616 8.086 -6.023 474 HA SER 64 HA SER 64 6.206 9.181 -7.247 475 HB2 SER 64 1HB SER 64 9.103 9.091 -7.996 476 HB3 SER 64 2HB SER 64 7.899 9.314 -9.266 477 HG SER 64 HG SER 64 7.079 11.057 -7.826 478 H THR 65 H THR 65 8.625 6.705 -8.114 479 HA THR 65 HA THR 65 6.548 5.320 -9.664 480 HB THR 65 HB THR 65 9.555 5.004 -9.757 481 HG1 THR 65 1HG THR 65 9.268 6.744 -10.957 482 HG21 THR 65 3HG2 THR 65 7.424 3.750 -11.492 483 HG22 THR 65 1HG2 THR 65 8.371 2.908 -10.266 484 HG23 THR 65 2HG2 THR 65 9.167 3.573 -11.693 485 H VAL 66 H VAL 66 6.137 3.129 -9.379 486 HA VAL 66 HA VAL 66 7.478 1.756 -7.170 487 HB VAL 66 HB VAL 66 4.474 2.021 -7.364 488 HG11 VAL 66 1HG1 VAL 66 5.430 0.896 -4.909 489 HG12 VAL 66 2HG1 VAL 66 4.304 0.214 -6.084 490 HG13 VAL 66 3HG1 VAL 66 6.040 -0.043 -6.271 491 HG21 VAL 66 3HG2 VAL 66 5.827 3.996 -6.476 492 HG22 VAL 66 1HG2 VAL 66 4.542 3.368 -5.444 493 HG23 VAL 66 2HG2 VAL 66 6.223 2.956 -5.107 494 H GLN 67 H GLN 67 8.312 0.075 -8.253 495 HA GLN 67 HA GLN 67 6.448 -1.646 -9.727 496 HB2 GLN 67 1HB GLN 67 8.008 -1.996 -11.515 497 HB3 GLN 67 2HB GLN 67 7.776 -0.263 -11.328 498 HG2 GLN 67 1HG GLN 67 9.883 -0.265 -9.933 499 HG3 GLN 67 2HG GLN 67 10.138 -1.916 -10.496 500 HE21 GLN 67 1HE2 GLN 67 11.541 -2.004 -12.082 501 HE22 GLN 67 2HE2 GLN 67 11.726 -0.848 -13.353 502 H ILE 68 H ILE 68 6.886 -3.849 -9.632 503 HA ILE 68 HA ILE 68 8.788 -4.612 -7.530 504 HB ILE 68 HB ILE 68 6.441 -6.137 -8.666 505 HG12 ILE 68 1HG1 ILE 68 6.827 -4.911 -5.927 506 HG13 ILE 68 2HG1 ILE 68 5.886 -4.177 -7.221 507 HG21 ILE 68 1HG2 ILE 68 6.900 -7.883 -7.180 508 HG22 ILE 68 2HG2 ILE 68 8.473 -7.467 -7.860 509 HG23 ILE 68 3HG2 ILE 68 8.035 -6.910 -6.245 510 HD11 ILE 68 3HD1 ILE 68 4.136 -5.244 -6.385 511 HD12 ILE 68 1HD1 ILE 68 4.852 -6.732 -7.003 512 HD13 ILE 68 2HD1 ILE 68 5.151 -6.234 -5.337 513 H LEU 69 H LEU 69 10.448 -5.979 -7.902 514 HA LEU 69 HA LEU 69 11.079 -6.594 -10.662 515 HB2 LEU 69 1HB LEU 69 12.669 -7.237 -8.187 516 HB3 LEU 69 2HB LEU 69 13.248 -7.227 -9.851 517 HG LEU 69 HG LEU 69 12.260 -4.742 -8.473 518 HD11 LEU 69 1HD1 LEU 69 14.384 -6.137 -7.542 519 HD12 LEU 69 2HD1 LEU 69 14.228 -4.382 -7.456 520 HD13 LEU 69 3HD1 LEU 69 15.157 -5.122 -8.760 521 HD21 LEU 69 3HD2 LEU 69 14.286 -4.271 -10.376 522 HD22 LEU 69 1HD2 LEU 69 12.577 -3.845 -10.476 523 HD23 LEU 69 2HD2 LEU 69 13.139 -5.392 -11.112 524 H THR 70 H THR 70 10.629 -8.459 -11.611 525 HA THR 70 HA THR 70 10.170 -10.826 -9.913 526 HB THR 70 HB THR 70 8.659 -11.657 -11.710 527 HG1 THR 70 1HG THR 70 8.841 -9.000 -12.725 528 HG21 THR 70 3HG2 THR 70 6.886 -10.706 -10.697 529 HG22 THR 70 1HG2 THR 70 7.426 -9.070 -11.071 530 HG23 THR 70 2HG2 THR 70 8.097 -9.924 -9.681 531 H GLU 71 H GLU 71 11.794 -12.218 -10.096 532 HA GLU 71 HA GLU 71 13.465 -12.260 -12.460 533 HB2 GLU 71 1HB GLU 71 14.262 -12.491 -10.026 534 HB3 GLU 71 2HB GLU 71 13.671 -14.144 -10.121 535 HG2 GLU 71 1HG GLU 71 15.152 -14.240 -12.269 536 HG3 GLU 71 2HG GLU 71 15.969 -12.869 -11.521 537 H GLY 72 H GLY 72 11.604 -14.713 -10.646 538 HA2 GLY 72 1HA GLY 72 10.096 -16.232 -11.699 539 HA3 GLY 72 2HA GLY 72 10.967 -16.002 -13.208 540 H PHE 73 H PHE 73 13.292 -16.785 -13.162 541 HA PHE 73 HA PHE 73 13.452 -19.478 -12.885 542 HB2 PHE 73 1HB PHE 73 15.495 -17.313 -12.861 543 HB3 PHE 73 2HB PHE 73 16.020 -18.927 -12.394 544 HD1 PHE 73 2HD PHE 73 13.982 -17.299 -15.065 545 HD2 PHE 73 1HD PHE 73 16.852 -20.274 -14.048 546 HE1 PHE 73 2HE PHE 73 14.180 -17.915 -17.439 547 HE2 PHE 73 1HE PHE 73 17.055 -20.894 -16.420 548 HZ PHE 73 HZ PHE 73 15.717 -19.715 -18.119 549 HA PRO 74 HA PRO 74 13.167 -20.046 -8.469 550 HB2 PRO 74 1HB PRO 74 13.273 -22.758 -8.544 551 HB3 PRO 74 2HB PRO 74 11.814 -21.842 -8.940 552 HG2 PRO 74 1HG PRO 74 13.844 -23.057 -10.775 553 HG3 PRO 74 2HG PRO 74 12.075 -23.058 -10.905 554 HD2 PRO 74 1HD PRO 74 13.640 -21.362 -12.322 555 HD3 PRO 74 2HD PRO 74 12.013 -20.921 -11.766 556 HA PRO 75 HA PRO 75 17.554 -20.343 -7.689 557 HB2 PRO 75 1HB PRO 75 17.385 -19.975 -5.005 558 HB3 PRO 75 2HB PRO 75 17.242 -18.651 -6.167 559 HG2 PRO 75 1HG PRO 75 15.086 -20.156 -4.737 560 HG3 PRO 75 2HG PRO 75 15.226 -18.414 -5.033 561 HD2 PRO 75 1HD PRO 75 13.637 -20.022 -6.524 562 HD3 PRO 75 2HD PRO 75 14.446 -18.591 -7.195 563 H GLY 76 H GLY 76 15.047 -22.378 -6.497 564 HA2 GLY 76 1HA GLY 76 15.474 -24.765 -6.433 565 HA3 GLY 76 2HA GLY 76 17.072 -24.405 -5.795 566 H GLY 77 H GLY 77 13.627 -23.949 -5.001 567 HA2 GLY 77 1HA GLY 77 13.427 -25.288 -2.682 568 HA3 GLY 77 2HA GLY 77 14.248 -23.821 -2.170 569 H GLY 78 H GLY 78 11.612 -24.416 -4.496 570 HA2 GLY 78 1HA GLY 78 9.311 -23.904 -3.970 571 HA3 GLY 78 2HA GLY 78 9.890 -22.697 -2.832 572 H ASN 79 H ASN 79 8.543 -23.140 -5.819 573 HA ASN 79 HA ASN 79 9.827 -20.943 -7.180 574 HB2 ASN 79 1HB ASN 79 7.540 -22.781 -7.831 575 HB3 ASN 79 2HB ASN 79 7.844 -21.348 -8.807 576 HD21 ASN 79 1HD2 ASN 79 8.654 -22.105 -10.641 577 HD22 ASN 79 2HD2 ASN 79 10.013 -23.163 -10.774 578 H ALA 80 H ALA 80 9.466 -18.955 -6.421 579 HA ALA 80 HA ALA 80 6.766 -18.243 -5.514 580 HB1 ALA 80 1HB ALA 80 7.684 -16.795 -4.046 581 HB2 ALA 80 2HB ALA 80 9.100 -17.827 -4.252 582 HB3 ALA 80 3HB ALA 80 8.971 -16.318 -5.155 583 H ARG 81 H ARG 81 5.841 -16.214 -6.172 584 HA ARG 81 HA ARG 81 6.263 -15.696 -8.973 585 HB2 ARG 81 1HB ARG 81 4.004 -15.765 -7.864 586 HB3 ARG 81 2HB ARG 81 4.414 -14.248 -7.075 587 HG2 ARG 81 1HG ARG 81 4.841 -13.391 -9.477 588 HG3 ARG 81 2HG ARG 81 3.881 -14.790 -9.964 589 HD2 ARG 81 1HD ARG 81 2.835 -13.007 -7.819 590 HD3 ARG 81 2HD ARG 81 2.758 -12.453 -9.492 591 HE ARG 81 HE ARG 81 1.738 -15.072 -9.315 592 HH11 ARG 81 1HH1 ARG 81 0.948 -11.796 -8.441 593 HH12 ARG 81 2HH1 ARG 81 -0.764 -12.053 -8.504 594 HH21 ARG 81 1HH2 ARG 81 -0.514 -15.423 -9.402 595 HH22 ARG 81 2HH2 ARG 81 -1.595 -14.117 -9.051 596 H ALA 82 H ALA 82 6.289 -13.649 -6.050 597 HA ALA 82 HA ALA 82 7.821 -11.629 -7.505 598 HB1 ALA 82 1HB ALA 82 6.533 -11.551 -4.780 599 HB2 ALA 82 2HB ALA 82 7.399 -10.209 -5.530 600 HB3 ALA 82 3HB ALA 82 5.915 -10.821 -6.262 601 H THR 83 H THR 83 9.960 -11.731 -7.449 602 HA THR 83 HA THR 83 11.295 -13.132 -5.262 603 HB THR 83 HB THR 83 12.418 -12.052 -7.855 604 HG1 THR 83 1HG THR 83 11.789 -13.905 -8.643 605 HG21 THR 83 3HG2 THR 83 14.370 -12.199 -6.744 606 HG22 THR 83 1HG2 THR 83 14.172 -13.938 -6.955 607 HG23 THR 83 2HG2 THR 83 13.672 -13.170 -5.448 608 H GLY 84 H GLY 84 11.116 -9.941 -6.752 609 HA2 GLY 84 1HA GLY 84 12.284 -8.805 -4.323 610 HA3 GLY 84 2HA GLY 84 13.089 -8.451 -5.844 611 H MET 85 H MET 85 12.378 -6.281 -4.640 612 HA MET 85 HA MET 85 10.040 -5.353 -6.137 613 HB2 MET 85 1HB MET 85 9.143 -5.769 -3.946 614 HB3 MET 85 2HB MET 85 10.490 -4.939 -3.180 615 HG2 MET 85 1HG MET 85 9.752 -2.827 -4.114 616 HG3 MET 85 2HG MET 85 8.435 -3.642 -4.954 617 HE1 MET 85 3HE MET 85 6.318 -4.216 -4.111 618 HE2 MET 85 1HE MET 85 5.629 -3.574 -2.619 619 HE3 MET 85 2HE MET 85 6.224 -2.472 -3.861 620 H PHE 86 H PHE 86 10.002 -3.055 -6.491 621 HA PHE 86 HA PHE 86 12.556 -1.693 -5.985 622 HB2 PHE 86 1HB PHE 86 12.343 -2.665 -8.348 623 HB3 PHE 86 2HB PHE 86 11.104 -1.443 -8.613 624 HD1 PHE 86 2HD PHE 86 14.670 -1.945 -7.787 625 HD2 PHE 86 1HD PHE 86 11.676 0.788 -9.083 626 HE1 PHE 86 2HE PHE 86 16.416 -0.308 -8.356 627 HE2 PHE 86 1HE PHE 86 13.417 2.430 -9.654 628 HZ PHE 86 HZ PHE 86 15.790 1.884 -9.289 629 H LEU 87 H LEU 87 12.444 0.535 -5.729 630 HA LEU 87 HA LEU 87 9.893 1.887 -6.018 631 HB2 LEU 87 1HB LEU 87 11.268 1.724 -3.341 632 HB3 LEU 87 2HB LEU 87 9.818 2.654 -3.714 633 HG LEU 87 HG LEU 87 9.818 -0.316 -4.070 634 HD11 LEU 87 1HD1 LEU 87 10.668 -0.063 -1.845 635 HD12 LEU 87 2HD1 LEU 87 8.963 -0.500 -1.745 636 HD13 LEU 87 3HD1 LEU 87 9.463 1.170 -1.474 637 HD21 LEU 87 3HD2 LEU 87 7.980 1.523 -4.682 638 HD22 LEU 87 1HD2 LEU 87 7.539 1.235 -2.999 639 HD23 LEU 87 2HD2 LEU 87 7.563 -0.105 -4.145 640 H GLN 88 H GLN 88 10.095 4.068 -6.309 641 HA GLN 88 HA GLN 88 12.817 5.179 -6.105 642 HB2 GLN 88 1HB GLN 88 10.748 5.595 -8.262 643 HB3 GLN 88 2HB GLN 88 12.162 6.624 -8.076 644 HG2 GLN 88 1HG GLN 88 13.490 4.410 -8.206 645 HG3 GLN 88 2HG GLN 88 12.008 3.759 -8.903 646 HE21 GLN 88 1HE2 GLN 88 14.034 6.659 -9.219 647 HE22 GLN 88 2HE2 GLN 88 14.022 6.686 -10.946 648 H TYR 89 H TYR 89 13.019 6.980 -4.941 649 HA TYR 89 HA TYR 89 10.731 8.756 -4.586 650 HB2 TYR 89 1HB TYR 89 11.190 8.824 -2.098 651 HB3 TYR 89 2HB TYR 89 10.443 7.344 -2.691 652 HD1 TYR 89 1HD TYR 89 13.814 8.771 -1.946 653 HD2 TYR 89 2HD TYR 89 11.345 5.307 -2.057 654 HE1 TYR 89 1HE TYR 89 15.622 7.457 -0.921 655 HE2 TYR 89 2HE TYR 89 13.146 3.984 -1.031 656 HH TYR 89 HH TYR 89 16.074 4.553 -1.029 657 H THR 90 H THR 90 11.480 10.686 -3.133 658 HA THR 90 HA THR 90 14.201 11.445 -3.979 659 HB THR 90 HB THR 90 13.436 13.768 -4.153 660 HG1 THR 90 1HG THR 90 11.694 14.073 -2.933 661 HG21 THR 90 3HG2 THR 90 13.265 13.021 -6.275 662 HG22 THR 90 1HG2 THR 90 11.531 13.142 -5.984 663 HG23 THR 90 2HG2 THR 90 12.349 11.590 -5.805 664 H VAL 91 H VAL 91 15.489 12.541 -2.532 665 HA VAL 91 HA VAL 91 14.673 12.347 0.257 666 HB VAL 91 HB VAL 91 17.348 13.055 -0.956 667 HG11 VAL 91 1HG1 VAL 91 18.265 13.168 1.159 668 HG12 VAL 91 2HG1 VAL 91 16.694 13.933 1.407 669 HG13 VAL 91 3HG1 VAL 91 16.947 12.256 1.894 670 HG21 VAL 91 3HG2 VAL 91 17.398 10.847 -1.352 671 HG22 VAL 91 1HG2 VAL 91 17.655 10.699 0.387 672 HG23 VAL 91 2HG2 VAL 91 16.032 10.527 -0.283 673 HA PRO 92 HA PRO 92 13.720 16.639 0.626 674 HB2 PRO 92 1HB PRO 92 13.897 16.844 3.327 675 HB3 PRO 92 2HB PRO 92 12.544 16.052 2.511 676 HG2 PRO 92 1HG PRO 92 14.957 14.833 3.796 677 HG3 PRO 92 2HG PRO 92 13.263 14.316 3.881 678 HD2 PRO 92 1HD PRO 92 15.069 13.127 2.252 679 HD3 PRO 92 2HD PRO 92 13.350 13.265 1.832 680 H GLY 93 H GLY 93 15.154 18.133 0.000 681 HA2 GLY 93 1HA GLY 93 16.820 19.726 0.335 682 HA3 GLY 93 2HA GLY 93 17.302 18.878 1.797 683 H THR 94 H THR 94 16.963 17.291 -1.303 684 HA THR 94 HA THR 94 19.851 17.321 -1.727 685 HB THR 94 HB THR 94 18.299 14.734 -1.510 686 HG1 THR 94 1HG THR 94 19.834 16.191 0.287 687 HG21 THR 94 3HG2 THR 94 20.457 15.205 -3.088 688 HG22 THR 94 1HG2 THR 94 20.082 13.643 -2.361 689 HG23 THR 94 2HG2 THR 94 21.241 14.721 -1.584 690 H GLU 95 H GLU 95 20.442 17.147 -3.844 691 HA GLU 95 HA GLU 95 18.283 17.255 -5.793 692 HB2 GLU 95 1HB GLU 95 19.996 17.997 -7.365 693 HB3 GLU 95 2HB GLU 95 20.053 18.951 -5.889 694 HG2 GLU 95 1HG GLU 95 21.895 17.354 -5.136 695 HG3 GLU 95 2HG GLU 95 21.955 16.831 -6.818 696 H GLY 96 H GLY 96 17.591 15.434 -6.690 697 HA2 GLY 96 1HA GLY 96 18.481 13.732 -8.370 698 HA3 GLY 96 2HA GLY 96 19.513 13.224 -7.042 699 H VAL 97 H VAL 97 18.057 11.290 -8.071 700 HA VAL 97 HA VAL 97 15.803 10.960 -6.199 701 HB VAL 97 HB VAL 97 16.071 9.720 -8.941 702 HG11 VAL 97 1HG1 VAL 97 14.718 8.709 -6.817 703 HG12 VAL 97 2HG1 VAL 97 13.478 9.717 -7.566 704 HG13 VAL 97 3HG1 VAL 97 14.270 8.449 -8.502 705 HG21 VAL 97 3HG2 VAL 97 14.967 11.453 -9.812 706 HG22 VAL 97 1HG2 VAL 97 13.794 11.462 -8.495 707 HG23 VAL 97 2HG2 VAL 97 15.329 12.313 -8.316 708 H THR 98 H THR 98 15.814 9.212 -4.911 709 HA THR 98 HA THR 98 18.042 7.319 -5.227 710 HB THR 98 HB THR 98 16.444 8.113 -2.792 711 HG1 THR 98 1HG THR 98 18.100 9.523 -3.087 712 HG21 THR 98 3HG2 THR 98 18.067 6.544 -1.603 713 HG22 THR 98 1HG2 THR 98 18.372 5.837 -3.189 714 HG23 THR 98 2HG2 THR 98 16.749 5.792 -2.502 715 H GLN 99 H GLN 99 17.691 5.181 -5.475 716 HA GLN 99 HA GLN 99 14.887 4.279 -5.499 717 HB2 GLN 99 1HB GLN 99 15.433 2.744 -7.240 718 HB3 GLN 99 2HB GLN 99 16.098 4.305 -7.704 719 HG2 GLN 99 1HG GLN 99 17.685 2.094 -6.422 720 HG3 GLN 99 2HG GLN 99 17.600 2.391 -8.157 721 HE21 GLN 99 1HE2 GLN 99 18.603 4.212 -9.016 722 HE22 GLN 99 2HE2 GLN 99 19.792 5.106 -8.137 723 H LEU 100 H LEU 100 14.342 2.353 -4.525 724 HA LEU 100 HA LEU 100 16.432 1.159 -2.827 725 HB2 LEU 100 1HB LEU 100 14.293 2.382 -1.891 726 HB3 LEU 100 2HB LEU 100 13.533 0.829 -2.232 727 HG LEU 100 HG LEU 100 15.604 -0.057 -0.818 728 HD11 LEU 100 1HD1 LEU 100 16.252 2.486 -0.622 729 HD12 LEU 100 2HD1 LEU 100 16.473 1.379 0.733 730 HD13 LEU 100 3HD1 LEU 100 15.074 2.451 0.690 731 HD21 LEU 100 3HD2 LEU 100 13.400 1.140 0.782 732 HD22 LEU 100 1HD2 LEU 100 14.099 -0.478 0.850 733 HD23 LEU 100 2HD2 LEU 100 12.993 -0.050 -0.456 734 H LYS 101 H LYS 101 16.233 -1.139 -2.377 735 HA LYS 101 HA LYS 101 14.701 -2.658 -4.362 736 HB2 LYS 101 1HB LYS 101 17.258 -2.211 -4.899 737 HB3 LYS 101 2HB LYS 101 17.491 -3.539 -3.770 738 HG2 LYS 101 1HG LYS 101 16.251 -5.031 -5.134 739 HG3 LYS 101 2HG LYS 101 15.682 -3.716 -6.165 740 HD2 LYS 101 1HD LYS 101 18.614 -4.239 -5.877 741 HD3 LYS 101 2HD LYS 101 17.641 -5.228 -6.968 742 HE2 LYS 101 1HE LYS 101 17.590 -2.227 -7.068 743 HE3 LYS 101 2HE LYS 101 18.797 -3.166 -7.944 744 HZ1 LYS 101 3HZ LYS 101 17.024 -4.303 -9.114 745 HZ2 LYS 101 1HZ LYS 101 16.890 -2.631 -9.333 746 HZ3 LYS 101 2HZ LYS 101 15.856 -3.428 -8.259 747 H LEU 102 H LEU 102 13.828 -4.507 -3.598 748 HA LEU 102 HA LEU 102 14.696 -5.439 -0.944 749 HB2 LEU 102 1HB LEU 102 11.839 -5.584 -1.827 750 HB3 LEU 102 2HB LEU 102 12.503 -5.690 -0.197 751 HG LEU 102 HG LEU 102 12.590 -3.141 -1.788 752 HD11 LEU 102 1HD1 LEU 102 10.244 -4.392 -1.078 753 HD12 LEU 102 2HD1 LEU 102 10.451 -2.668 -1.383 754 HD13 LEU 102 3HD1 LEU 102 10.538 -3.288 0.266 755 HD21 LEU 102 3HD2 LEU 102 13.920 -2.697 -0.023 756 HD22 LEU 102 1HD2 LEU 102 13.246 -4.004 0.951 757 HD23 LEU 102 2HD2 LEU 102 12.385 -2.471 0.816 758 H THR 103 H THR 103 15.056 -7.566 -0.768 759 HA THR 103 HA THR 103 13.871 -9.406 -2.705 760 HB THR 103 HB THR 103 16.850 -9.286 -2.193 761 HG1 THR 103 1HG THR 103 15.204 -8.457 -4.336 762 HG21 THR 103 3HG2 THR 103 15.101 -11.203 -3.707 763 HG22 THR 103 1HG2 THR 103 16.346 -11.553 -2.509 764 HG23 THR 103 2HG2 THR 103 16.803 -10.992 -4.117 765 H VAL 104 H VAL 104 13.818 -11.583 -2.021 766 HA VAL 104 HA VAL 104 13.673 -11.900 0.827 767 HB VAL 104 HB VAL 104 13.311 -13.914 -1.395 768 HG11 VAL 104 1HG1 VAL 104 13.989 -14.870 0.833 769 HG12 VAL 104 2HG1 VAL 104 12.488 -14.210 1.486 770 HG13 VAL 104 3HG1 VAL 104 12.437 -15.428 0.211 771 HG21 VAL 104 3HG2 VAL 104 11.519 -12.001 -0.015 772 HG22 VAL 104 1HG2 VAL 104 11.487 -12.590 -1.676 773 HG23 VAL 104 2HG2 VAL 104 10.869 -13.601 -0.370 774 H VAL 105 H VAL 105 15.259 -12.513 2.131 775 HA VAL 105 HA VAL 105 17.869 -13.019 1.348 776 HB VAL 105 HB VAL 105 18.110 -14.090 3.658 777 HG11 VAL 105 1HG1 VAL 105 16.845 -11.380 3.807 778 HG12 VAL 105 2HG1 VAL 105 18.246 -12.007 4.676 779 HG13 VAL 105 3HG1 VAL 105 18.374 -11.615 2.961 780 HG21 VAL 105 3HG2 VAL 105 16.321 -14.080 5.155 781 HG22 VAL 105 1HG2 VAL 105 15.356 -13.009 4.141 782 HG23 VAL 105 2HG2 VAL 105 15.607 -14.687 3.662 783 H GLU 106 H GLU 106 19.112 -14.865 1.101 784 HA GLU 106 HA GLU 106 17.659 -17.205 0.208 785 HB2 GLU 106 1HB GLU 106 20.543 -16.364 0.117 786 HB3 GLU 106 2HB GLU 106 20.067 -18.010 -0.276 787 HG2 GLU 106 1HG GLU 106 18.389 -16.820 -1.889 788 HG3 GLU 106 2HG GLU 106 19.523 -15.478 -1.741 789 H ASP 107 H ASP 107 17.373 -16.774 2.950 790 HA ASP 107 HA ASP 107 19.124 -18.755 4.216 791 HB2 ASP 107 1HB ASP 107 17.202 -16.724 5.361 792 HB3 ASP 107 2HB ASP 107 18.015 -17.943 6.339 793 H VAL 108 H VAL 108 18.159 -20.378 5.630 794 HA VAL 108 HA VAL 108 16.521 -22.159 4.514 795 HB VAL 108 HB VAL 108 17.602 -22.417 6.750 796 HG11 VAL 108 1HG1 VAL 108 16.893 -21.373 8.617 797 HG12 VAL 108 2HG1 VAL 108 16.230 -20.205 7.471 798 HG13 VAL 108 3HG1 VAL 108 15.195 -21.463 8.150 799 HG21 VAL 108 3HG2 VAL 108 14.765 -23.258 6.273 800 HG22 VAL 108 1HG2 VAL 108 16.245 -24.209 6.149 801 HG23 VAL 108 2HG2 VAL 108 15.623 -23.749 7.734 802 H THR 109 H THR 109 14.335 -22.634 4.362 803 HA THR 109 HA THR 109 12.581 -20.516 3.898 804 HB THR 109 HB THR 109 10.774 -22.238 3.891 805 HG1 THR 109 1HG THR 109 12.809 -24.151 4.370 806 HG21 THR 109 3HG2 THR 109 11.786 -23.627 2.056 807 HG22 THR 109 1HG2 THR 109 13.326 -22.842 2.400 808 HG23 THR 109 2HG2 THR 109 11.953 -21.885 1.844 809 H VAL 110 H VAL 110 11.488 -19.235 5.226 810 HA VAL 110 HA VAL 110 10.790 -20.238 7.907 811 HB VAL 110 HB VAL 110 11.086 -17.856 8.710 812 HG11 VAL 110 1HG1 VAL 110 12.673 -19.461 9.408 813 HG12 VAL 110 2HG1 VAL 110 13.433 -19.512 7.817 814 HG13 VAL 110 3HG1 VAL 110 13.603 -18.079 8.831 815 HG21 VAL 110 3HG2 VAL 110 12.256 -17.634 5.967 816 HG22 VAL 110 1HG2 VAL 110 11.188 -16.522 6.823 817 HG23 VAL 110 2HG2 VAL 110 12.887 -16.642 7.281 818 H GLY 111 H GLY 111 10.043 -17.963 5.302 819 HA2 GLY 111 1HA GLY 111 7.242 -18.374 5.582 820 HA3 GLY 111 2HA GLY 111 7.713 -16.833 6.284 821 H ARG 112 H ARG 112 8.621 -18.638 3.343 822 HA ARG 112 HA ARG 112 9.099 -16.426 1.741 823 HB2 ARG 112 1HB ARG 112 9.661 -18.828 1.224 824 HB3 ARG 112 2HB ARG 112 7.978 -19.055 0.767 825 HG2 ARG 112 1HG ARG 112 8.905 -18.645 -1.274 826 HG3 ARG 112 2HG ARG 112 8.465 -17.003 -0.800 827 HD2 ARG 112 1HD ARG 112 10.704 -16.524 -0.122 828 HD3 ARG 112 2HD ARG 112 11.179 -18.211 -0.308 829 HE ARG 112 HE ARG 112 10.208 -16.985 -2.726 830 HH11 ARG 112 1HH1 ARG 112 12.986 -17.588 -0.716 831 HH12 ARG 112 2HH1 ARG 112 14.124 -17.401 -2.009 832 HH21 ARG 112 1HH2 ARG 112 11.697 -16.736 -4.436 833 HH22 ARG 112 2HH2 ARG 112 13.390 -16.915 -4.124 834 H ARG 113 H ARG 113 6.118 -18.372 1.928 835 HA ARG 113 HA ARG 113 4.555 -16.992 0.136 836 HB2 ARG 113 1HB ARG 113 3.732 -18.256 2.755 837 HB3 ARG 113 2HB ARG 113 2.606 -17.741 1.506 838 HG2 ARG 113 1HG ARG 113 3.653 -19.322 -0.060 839 HG3 ARG 113 2HG ARG 113 4.722 -19.866 1.235 840 HD2 ARG 113 1HD ARG 113 1.723 -19.939 1.460 841 HD3 ARG 113 2HD ARG 113 2.659 -21.276 0.792 842 HE ARG 113 HE ARG 113 3.622 -20.465 3.352 843 HH11 ARG 113 1HH1 ARG 113 1.157 -22.322 1.741 844 HH12 ARG 113 2HH1 ARG 113 0.903 -23.391 3.081 845 HH21 ARG 113 1HH2 ARG 113 3.297 -21.865 5.123 846 HH22 ARG 113 2HH2 ARG 113 2.120 -23.129 5.004 847 H GLN 114 H GLN 114 5.173 -16.222 3.533 848 HA GLN 114 HA GLN 114 3.369 -14.121 3.833 849 HB2 GLN 114 1HB GLN 114 4.655 -15.173 5.679 850 HB3 GLN 114 2HB GLN 114 6.103 -14.361 5.098 851 HG2 GLN 114 1HG GLN 114 5.114 -13.201 6.998 852 HG3 GLN 114 2HG GLN 114 5.107 -12.200 5.546 853 HE21 GLN 114 1HE2 GLN 114 3.487 -11.068 6.941 854 HE22 GLN 114 2HE2 GLN 114 1.838 -11.558 6.792 855 H ALA 115 H ALA 115 6.868 -13.818 3.195 856 HA ALA 115 HA ALA 115 6.936 -11.106 2.683 857 HB1 ALA 115 1HB ALA 115 8.809 -12.993 2.764 858 HB2 ALA 115 2HB ALA 115 8.680 -12.823 1.013 859 HB3 ALA 115 3HB ALA 115 9.081 -11.423 2.008 860 H VAL 116 H VAL 116 7.052 -13.571 0.105 861 HA VAL 116 HA VAL 116 6.664 -12.058 -2.091 862 HB VAL 116 HB VAL 116 5.289 -14.694 -1.551 863 HG11 VAL 116 1HG1 VAL 116 4.320 -13.454 -3.456 864 HG12 VAL 116 2HG1 VAL 116 5.921 -13.387 -4.196 865 HG13 VAL 116 3HG1 VAL 116 5.127 -14.943 -3.948 866 HG21 VAL 116 3HG2 VAL 116 7.647 -14.643 -3.276 867 HG22 VAL 116 1HG2 VAL 116 7.976 -14.169 -1.610 868 HG23 VAL 116 2HG2 VAL 116 7.234 -15.732 -1.952 869 H ALA 117 H ALA 117 4.137 -13.063 0.166 870 HA ALA 117 HA ALA 117 1.931 -12.089 -1.279 871 HB1 ALA 117 1HB ALA 117 2.450 -13.002 1.460 872 HB2 ALA 117 2HB ALA 117 1.119 -11.854 1.302 873 HB3 ALA 117 3HB ALA 117 1.102 -13.356 0.378 874 H TRP 118 H TRP 118 3.791 -10.587 1.364 875 HA TRP 118 HA TRP 118 2.395 -8.147 1.367 876 HB2 TRP 118 1HB TRP 118 3.895 -8.945 3.195 877 HB3 TRP 118 2HB TRP 118 5.278 -8.605 2.158 878 HD1 TRP 118 HD TRP 118 3.075 -7.011 4.681 879 HE1 TRP 118 1HE TRP 118 3.579 -4.492 4.845 880 HE3 TRP 118 3HE TRP 118 5.960 -6.487 0.493 881 HZ2 TRP 118 2HZ TRP 118 5.009 -2.541 3.390 882 HZ3 TRP 118 3HZ TRP 118 6.857 -4.261 -0.050 883 HH2 TRP 118 HH TRP 118 6.390 -2.330 1.369 884 H LEU 119 H LEU 119 4.978 -9.356 -0.628 885 HA LEU 119 HA LEU 119 5.968 -6.935 -1.638 886 HB2 LEU 119 1HB LEU 119 5.838 -9.712 -2.772 887 HB3 LEU 119 2HB LEU 119 6.576 -8.377 -3.655 888 HG LEU 119 HG LEU 119 7.478 -9.340 -0.942 889 HD11 LEU 119 1HD1 LEU 119 8.665 -10.930 -1.929 890 HD12 LEU 119 2HD1 LEU 119 9.362 -9.767 -3.055 891 HD13 LEU 119 3HD1 LEU 119 7.838 -10.564 -3.443 892 HD21 LEU 119 3HD2 LEU 119 9.322 -7.839 -2.631 893 HD22 LEU 119 1HD2 LEU 119 8.934 -7.645 -0.921 894 HD23 LEU 119 2HD2 LEU 119 7.900 -6.913 -2.148 895 H VAL 120 H VAL 120 3.671 -9.177 -3.204 896 HA VAL 120 HA VAL 120 2.930 -7.327 -5.223 897 HB VAL 120 HB VAL 120 2.689 -9.784 -5.460 898 HG11 VAL 120 1HG1 VAL 120 1.342 -11.063 -4.179 899 HG12 VAL 120 2HG1 VAL 120 1.549 -9.751 -3.017 900 HG13 VAL 120 3HG1 VAL 120 0.110 -9.810 -4.035 901 HG21 VAL 120 3HG2 VAL 120 0.426 -7.905 -5.948 902 HG22 VAL 120 1HG2 VAL 120 1.502 -8.697 -7.099 903 HG23 VAL 120 2HG2 VAL 120 0.215 -9.616 -6.320 904 H ALA 121 H ALA 121 1.648 -8.102 -2.051 905 HA ALA 121 HA ALA 121 -0.854 -6.883 -2.230 906 HB1 ALA 121 1HB ALA 121 -0.368 -8.256 -0.352 907 HB2 ALA 121 2HB ALA 121 0.993 -7.238 0.120 908 HB3 ALA 121 3HB ALA 121 -0.655 -6.626 0.258 909 H MET 122 H MET 122 2.098 -5.482 -0.783 910 HA MET 122 HA MET 122 1.259 -2.946 -0.292 911 HB2 MET 122 1HB MET 122 3.551 -3.901 0.137 912 HB3 MET 122 2HB MET 122 3.936 -3.564 -1.545 913 HG2 MET 122 1HG MET 122 2.936 -1.392 0.245 914 HG3 MET 122 2HG MET 122 4.629 -1.879 0.279 915 HE1 MET 122 3HE MET 122 3.549 0.741 -0.032 916 HE2 MET 122 1HE MET 122 4.755 1.386 -1.146 917 HE3 MET 122 2HE MET 122 3.055 1.348 -1.613 918 H HIS 123 H HIS 123 3.039 -3.705 -3.288 919 HA HIS 123 HA HIS 123 2.621 -1.432 -4.697 920 HB2 HIS 123 1HB HIS 123 3.935 -3.335 -5.536 921 HB3 HIS 123 2HB HIS 123 2.449 -4.234 -5.828 922 HD2 HIS 123 2HD HIS 123 4.127 -3.820 -8.453 923 HE1 HIS 123 1HE HIS 123 1.637 -0.486 -9.282 924 HE2 HIS 123 2HE HIS 123 3.207 -2.202 -10.249 925 H LYS 124 H LYS 124 0.465 -4.260 -5.010 926 HA LYS 124 HA LYS 124 -1.508 -3.271 -6.563 927 HB2 LYS 124 1HB LYS 124 -1.509 -5.158 -4.265 928 HB3 LYS 124 2HB LYS 124 -3.072 -4.591 -4.839 929 HG2 LYS 124 1HG LYS 124 -2.035 -5.272 -7.182 930 HG3 LYS 124 2HG LYS 124 -1.086 -6.350 -6.157 931 HD2 LYS 124 1HD LYS 124 -3.316 -7.043 -5.121 932 HD3 LYS 124 2HD LYS 124 -4.071 -6.232 -6.496 933 HE2 LYS 124 1HE LYS 124 -3.913 -8.408 -7.251 934 HE3 LYS 124 2HE LYS 124 -2.443 -7.689 -7.906 935 HZ1 LYS 124 3HZ LYS 124 -1.578 -9.550 -6.971 936 HZ2 LYS 124 1HZ LYS 124 -2.757 -9.648 -5.761 937 HZ3 LYS 124 2HZ LYS 124 -1.491 -8.536 -5.620 938 H ALA 125 H ALA 125 -1.062 -2.587 -3.128 939 HA ALA 125 HA ALA 125 -3.446 -0.995 -2.931 940 HB1 ALA 125 1HB ALA 125 -1.448 -2.033 -1.129 941 HB2 ALA 125 2HB ALA 125 -1.793 -0.337 -0.787 942 HB3 ALA 125 3HB ALA 125 -3.103 -1.518 -0.799 943 H ALA 126 H ALA 126 0.021 -0.359 -3.242 944 HA ALA 126 HA ALA 126 0.225 2.310 -2.834 945 HB1 ALA 126 1HB ALA 126 1.520 0.514 -4.836 946 HB2 ALA 126 2HB ALA 126 1.847 2.247 -4.876 947 HB3 ALA 126 3HB ALA 126 2.215 1.313 -3.426 948 H LYS 127 H LYS 127 -1.417 0.738 -5.479 949 HA LYS 127 HA LYS 127 -1.731 3.160 -7.016 950 HB2 LYS 127 1HB LYS 127 -2.873 0.381 -7.294 951 HB3 LYS 127 2HB LYS 127 -3.295 1.698 -8.381 952 HG2 LYS 127 1HG LYS 127 -0.426 1.006 -7.940 953 HG3 LYS 127 2HG LYS 127 -1.415 0.027 -9.025 954 HD2 LYS 127 1HD LYS 127 -2.077 2.418 -9.966 955 HD3 LYS 127 2HD LYS 127 -0.498 2.841 -9.298 956 HE2 LYS 127 1HE LYS 127 0.246 0.659 -10.570 957 HE3 LYS 127 2HE LYS 127 -1.192 0.994 -11.532 958 HZ1 LYS 127 3HZ LYS 127 1.197 2.704 -11.170 959 HZ2 LYS 127 1HZ LYS 127 -0.255 3.305 -11.797 960 HZ3 LYS 127 2HZ LYS 127 0.571 2.073 -12.610 961 H LEU 128 H LEU 128 -3.594 1.299 -4.708 962 HA LEU 128 HA LEU 128 -6.128 2.363 -5.118 963 HB2 LEU 128 1HB LEU 128 -4.702 1.213 -2.772 964 HB3 LEU 128 2HB LEU 128 -6.251 2.011 -2.508 965 HG LEU 128 HG LEU 128 -6.326 -0.494 -2.767 966 HD11 LEU 128 1HD1 LEU 128 -8.453 -0.032 -3.176 967 HD12 LEU 128 2HD1 LEU 128 -8.074 0.112 -4.892 968 HD13 LEU 128 3HD1 LEU 128 -8.014 1.536 -3.854 969 HD21 LEU 128 3HD2 LEU 128 -5.869 -1.539 -4.756 970 HD22 LEU 128 1HD2 LEU 128 -4.635 -0.279 -4.763 971 HD23 LEU 128 2HD2 LEU 128 -6.109 -0.074 -5.709 972 H LEU 129 H LEU 129 -3.410 3.639 -3.264 973 HA LEU 129 HA LEU 129 -4.747 5.779 -2.036 974 HB2 LEU 129 1HB LEU 129 -1.928 5.105 -2.654 975 HB3 LEU 129 2HB LEU 129 -2.288 6.784 -2.260 976 HG LEU 129 HG LEU 129 -3.025 4.478 -0.468 977 HD11 LEU 129 1HD1 LEU 129 -0.788 4.252 -0.252 978 HD12 LEU 129 2HD1 LEU 129 -0.985 5.640 0.816 979 HD13 LEU 129 3HD1 LEU 129 -0.453 5.878 -0.848 980 HD21 LEU 129 3HD2 LEU 129 -4.260 6.171 0.374 981 HD22 LEU 129 1HD2 LEU 129 -3.258 7.418 -0.368 982 HD23 LEU 129 2HD2 LEU 129 -2.726 6.628 1.116 983 H TYR 130 H TYR 130 -2.693 5.807 -4.954 984 HA TYR 130 HA TYR 130 -3.370 8.476 -5.651 985 HB2 TYR 130 1HB TYR 130 -2.446 6.551 -7.733 986 HB3 TYR 130 2HB TYR 130 -1.947 8.213 -7.442 987 HD1 TYR 130 2HD TYR 130 -1.182 8.095 -4.591 988 HD2 TYR 130 1HD TYR 130 -0.456 5.336 -7.748 989 HE1 TYR 130 2HE TYR 130 0.824 7.289 -3.418 990 HE2 TYR 130 1HE TYR 130 1.551 4.522 -6.583 991 HH TYR 130 HH TYR 130 2.852 4.717 -4.799 992 H GLU 131 H GLU 131 -4.198 5.410 -7.284 993 HA GLU 131 HA GLU 131 -6.056 6.433 -9.064 994 HB2 GLU 131 1HB GLU 131 -6.105 3.717 -7.736 995 HB3 GLU 131 2HB GLU 131 -6.955 4.154 -9.212 996 HG2 GLU 131 1HG GLU 131 -4.017 4.552 -9.124 997 HG3 GLU 131 2HG GLU 131 -4.634 2.906 -9.252 998 H SER 132 H SER 132 -6.497 5.387 -5.724 999 HA SER 132 HA SER 132 -8.177 5.722 -4.226 1000 HB2 SER 132 1HB SER 132 -8.572 7.954 -6.164 1001 HB3 SER 132 2HB SER 132 -9.862 7.632 -5.006 1002 HG SER 132 HG SER 132 -8.438 9.086 -4.088 1003 H ARG 133 H ARG 133 -8.459 3.764 -6.354 1004 HA ARG 133 HA ARG 133 -11.400 3.626 -6.476 1005 HB2 ARG 133 1HB ARG 133 -9.512 2.400 -8.487 1006 HB3 ARG 133 2HB ARG 133 -11.263 2.517 -8.597 1007 HG2 ARG 133 1HG ARG 133 -9.311 4.807 -8.694 1008 HG3 ARG 133 2HG ARG 133 -10.215 4.135 -10.052 1009 HD2 ARG 133 1HD ARG 133 -11.390 5.481 -7.622 1010 HD3 ARG 133 2HD ARG 133 -11.254 6.183 -9.234 1011 HE ARG 133 HE ARG 133 -12.722 3.709 -9.153 1012 HH11 ARG 133 1HH1 ARG 133 -12.904 7.172 -8.841 1013 HH12 ARG 133 2HH1 ARG 133 -14.591 7.249 -9.230 1014 HH21 ARG 133 1HH2 ARG 133 -14.943 3.797 -9.666 1015 HH22 ARG 133 2HH2 ARG 133 -15.750 5.329 -9.698 1016 H ASP 134 H ASP 134 -12.028 2.188 -5.003 1017 HA ASP 134 HA ASP 134 -10.354 -0.101 -4.360 1018 HB2 ASP 134 1HB ASP 134 -13.061 0.479 -3.176 1019 HB3 ASP 134 2HB ASP 134 -11.720 -0.413 -2.464 1020 H GLN 135 H GLN 135 -11.306 -0.192 -6.964 1021 HA GLN 135 HA GLN 135 -13.703 -1.590 -7.332 1022 HB2 GLN 135 1HB GLN 135 -12.749 -2.267 -9.513 1023 HB3 GLN 135 2HB GLN 135 -12.561 -0.547 -9.195 1024 HG2 GLN 135 1HG GLN 135 -10.229 -1.057 -8.411 1025 HG3 GLN 135 2HG GLN 135 -10.461 -2.688 -9.039 1026 HE21 GLN 135 1HE2 GLN 135 -8.526 -1.934 -10.286 1027 HE22 GLN 135 2HE2 GLN 135 -8.821 -1.151 -11.798 1028 H SER 136 H SER 136 -13.718 -3.885 -8.308 1029 HA SER 136 HA SER 136 -12.589 -5.644 -6.298 1030 HB2 SER 136 1HB SER 136 -14.995 -5.711 -7.339 1031 HB3 SER 136 2HB SER 136 -14.206 -6.616 -8.630 1032 HG SER 136 HG SER 136 -13.323 -7.709 -6.463 1033 H GLY 137 H GLY 137 -10.603 -4.521 -7.870 1034 HA2 GLY 137 1HA GLY 137 -8.727 -5.111 -9.053 1035 HA3 GLY 137 2HA GLY 137 -9.136 -6.775 -8.663 1036 HA PRO 138 HA PRO 138 -9.740 -5.701 -13.273 1037 HB2 PRO 138 1HB PRO 138 -7.478 -6.830 -14.262 1038 HB3 PRO 138 2HB PRO 138 -7.571 -5.133 -13.775 1039 HG2 PRO 138 1HG PRO 138 -6.471 -7.478 -12.272 1040 HG3 PRO 138 2HG PRO 138 -5.805 -5.843 -12.438 1041 HD2 PRO 138 1HD PRO 138 -7.157 -6.649 -10.235 1042 HD3 PRO 138 2HD PRO 138 -7.202 -4.975 -10.823 1043 H SER 139 H SER 139 -9.576 -7.423 -15.100 1044 HA SER 139 HA SER 139 -11.234 -9.480 -14.726 1045 HB2 SER 139 1HB SER 139 -8.823 -9.283 -16.506 1046 HB3 SER 139 2HB SER 139 -9.806 -10.746 -16.502 1047 HG SER 139 HG SER 139 -11.235 -9.728 -17.643 1048 H SER 140 H SER 140 -11.316 -11.401 -13.728 1049 HA SER 140 HA SER 140 -9.864 -12.177 -11.632 1050 HB2 SER 140 1HB SER 140 -11.847 -13.404 -12.440 1051 HB3 SER 140 2HB SER 140 -10.879 -14.104 -13.737 1052 HG SER 140 HG SER 140 -10.573 -14.495 -10.945 1053 H GLY 141 H GLY 141 -9.104 -13.293 -14.937 1054 HA2 GLY 141 1HA GLY 141 -6.580 -12.950 -15.358 1055 HA3 GLY 141 2HA GLY 141 -6.420 -14.034 -13.984 Start of MODEL 12 1 H1 GLY 1 H GLY 1 -15.331 11.052 4.962 2 HA2 GLY 1 1HA GLY 1 -17.946 10.103 5.623 3 HA3 GLY 1 2HA GLY 1 -17.268 9.229 4.257 4 H SER 2 H SER 2 -17.215 7.292 5.439 5 HA SER 2 HA SER 2 -15.136 7.208 7.528 6 HB2 SER 2 1HB SER 2 -16.329 5.467 8.649 7 HB3 SER 2 2HB SER 2 -17.503 6.736 8.302 8 HG SER 2 HG SER 2 -18.402 5.508 6.755 9 H SER 3 H SER 3 -13.550 5.701 7.356 10 HA SER 3 HA SER 3 -13.176 4.465 4.795 11 HB2 SER 3 1HB SER 3 -11.554 4.402 7.346 12 HB3 SER 3 2HB SER 3 -11.062 3.584 5.863 13 HG SER 3 HG SER 3 -10.253 5.434 5.313 14 H GLY 4 H GLY 4 -13.589 3.244 8.116 15 HA2 GLY 4 1HA GLY 4 -13.396 0.588 7.910 16 HA3 GLY 4 2HA GLY 4 -14.726 1.327 8.788 17 H SER 5 H SER 5 -13.933 -0.781 6.350 18 HA SER 5 HA SER 5 -16.704 -0.890 5.462 19 HB2 SER 5 1HB SER 5 -15.165 0.564 3.890 20 HB3 SER 5 2HB SER 5 -14.619 -1.012 3.318 21 HG SER 5 HG SER 5 -16.611 -1.451 2.573 22 H SER 6 H SER 6 -17.298 -2.921 5.772 23 HA SER 6 HA SER 6 -15.293 -5.050 5.542 24 HB2 SER 6 1HB SER 6 -18.024 -5.050 6.847 25 HB3 SER 6 2HB SER 6 -16.933 -6.434 6.794 26 HG SER 6 HG SER 6 -15.412 -5.156 7.954 27 H GLY 7 H GLY 7 -15.748 -6.974 4.386 28 HA2 GLY 7 1HA GLY 7 -17.541 -8.148 3.054 29 HA3 GLY 7 2HA GLY 7 -17.767 -6.595 2.263 30 H ALA 8 H ALA 8 -15.069 -5.847 1.993 31 HA ALA 8 HA ALA 8 -14.370 -7.440 -0.307 32 HB1 ALA 8 1HB ALA 8 -13.751 -5.392 -0.936 33 HB2 ALA 8 2HB ALA 8 -13.711 -4.803 0.726 34 HB3 ALA 8 3HB ALA 8 -12.313 -5.644 0.055 35 H GLU 9 H GLU 9 -13.897 -9.441 0.790 36 HA GLU 9 HA GLU 9 -11.999 -9.804 2.784 37 HB2 GLU 9 1HB GLU 9 -12.700 -11.650 0.494 38 HB3 GLU 9 2HB GLU 9 -11.797 -12.123 1.926 39 HG2 GLU 9 1HG GLU 9 -14.587 -11.010 2.015 40 HG3 GLU 9 2HG GLU 9 -14.221 -12.732 1.937 41 H PHE 10 H PHE 10 -11.567 -9.803 -0.740 42 HA PHE 10 HA PHE 10 -8.925 -10.491 -0.950 43 HB2 PHE 10 1HB PHE 10 -10.383 -10.050 -2.883 44 HB3 PHE 10 2HB PHE 10 -10.340 -8.327 -2.523 45 HD1 PHE 10 2HD PHE 10 -8.204 -11.206 -3.464 46 HD2 PHE 10 1HD PHE 10 -8.639 -6.973 -3.365 47 HE1 PHE 10 2HE PHE 10 -6.191 -10.969 -4.859 48 HE2 PHE 10 1HE PHE 10 -6.627 -6.730 -4.760 49 HZ PHE 10 HZ PHE 10 -5.399 -8.729 -5.508 50 H TYR 11 H TYR 11 -10.214 -7.227 -0.369 51 HA TYR 11 HA TYR 11 -7.657 -6.005 -0.146 52 HB2 TYR 11 1HB TYR 11 -9.771 -4.793 -0.708 53 HB3 TYR 11 2HB TYR 11 -10.291 -5.011 0.959 54 HD1 TYR 11 2HD TYR 11 -7.732 -3.404 -1.179 55 HD2 TYR 11 1HD TYR 11 -9.529 -3.570 2.674 56 HE1 TYR 11 2HE TYR 11 -6.556 -1.338 -0.548 57 HE2 TYR 11 1HE TYR 11 -8.358 -1.504 3.315 58 HH TYR 11 HH TYR 11 -7.372 0.523 2.044 59 H ASP 12 H ASP 12 -9.764 -7.647 2.077 60 HA ASP 12 HA ASP 12 -8.553 -6.662 4.468 61 HB2 ASP 12 1HB ASP 12 -10.523 -8.788 3.782 62 HB3 ASP 12 2HB ASP 12 -9.697 -8.910 5.333 63 H LYS 13 H LYS 13 -7.769 -9.114 2.187 64 HA LYS 13 HA LYS 13 -6.022 -10.556 4.001 65 HB2 LYS 13 1HB LYS 13 -6.759 -10.869 1.102 66 HB3 LYS 13 2HB LYS 13 -5.417 -11.767 1.799 67 HG2 LYS 13 1HG LYS 13 -7.103 -12.547 3.561 68 HG3 LYS 13 2HG LYS 13 -8.336 -11.951 2.447 69 HD2 LYS 13 1HD LYS 13 -8.168 -14.149 1.787 70 HD3 LYS 13 2HD LYS 13 -7.012 -13.381 0.696 71 HE2 LYS 13 1HE LYS 13 -5.961 -15.328 1.561 72 HE3 LYS 13 2HE LYS 13 -5.220 -13.945 2.364 73 HZ1 LYS 13 3HZ LYS 13 -7.393 -15.597 3.531 74 HZ2 LYS 13 1HZ LYS 13 -6.546 -14.352 4.302 75 HZ3 LYS 13 2HZ LYS 13 -5.750 -15.785 3.887 76 H GLN 14 H GLN 14 -5.823 -8.038 1.628 77 HA GLN 14 HA GLN 14 -2.965 -8.239 1.296 78 HB2 GLN 14 1HB GLN 14 -4.824 -5.999 0.484 79 HB3 GLN 14 2HB GLN 14 -3.177 -6.247 -0.080 80 HG2 GLN 14 1HG GLN 14 -5.283 -8.328 -0.509 81 HG3 GLN 14 2HG GLN 14 -5.125 -6.949 -1.596 82 HE21 GLN 14 1HE2 GLN 14 -3.646 -9.868 -0.427 83 HE22 GLN 14 2HE2 GLN 14 -2.449 -9.999 -1.666 84 H LEU 15 H LEU 15 -5.227 -6.147 3.033 85 HA LEU 15 HA LEU 15 -3.294 -4.335 4.018 86 HB2 LEU 15 1HB LEU 15 -4.998 -3.537 5.475 87 HB3 LEU 15 2HB LEU 15 -5.744 -3.926 3.927 88 HG LEU 15 HG LEU 15 -6.392 -6.157 5.045 89 HD11 LEU 15 1HD1 LEU 15 -6.635 -4.953 7.634 90 HD12 LEU 15 2HD1 LEU 15 -4.941 -5.004 7.150 91 HD13 LEU 15 3HD1 LEU 15 -5.894 -6.487 7.179 92 HD21 LEU 15 3HD2 LEU 15 -8.417 -5.144 5.984 93 HD22 LEU 15 1HD2 LEU 15 -7.992 -4.434 4.426 94 HD23 LEU 15 2HD2 LEU 15 -7.649 -3.556 5.918 95 H LYS 16 H LYS 16 -4.772 -7.242 5.416 96 HA LYS 16 HA LYS 16 -3.524 -7.120 7.922 97 HB2 LYS 16 1HB LYS 16 -4.355 -9.247 8.290 98 HB3 LYS 16 2HB LYS 16 -5.430 -8.667 7.025 99 HG2 LYS 16 1HG LYS 16 -4.114 -9.865 5.352 100 HG3 LYS 16 2HG LYS 16 -3.032 -10.445 6.621 101 HD2 LYS 16 1HD LYS 16 -4.941 -11.577 7.695 102 HD3 LYS 16 2HD LYS 16 -5.982 -11.037 6.375 103 HE2 LYS 16 1HE LYS 16 -5.376 -13.255 5.850 104 HE3 LYS 16 2HE LYS 16 -4.387 -12.230 4.812 105 HZ1 LYS 16 3HZ LYS 16 -3.302 -14.181 6.083 106 HZ2 LYS 16 1HZ LYS 16 -3.333 -13.129 7.408 107 HZ3 LYS 16 2HZ LYS 16 -2.493 -12.697 6.004 108 H VAL 17 H VAL 17 -2.514 -8.674 4.900 109 HA VAL 17 HA VAL 17 -0.178 -9.885 5.919 110 HB VAL 17 HB VAL 17 -0.845 -9.020 3.103 111 HG11 VAL 17 1HG1 VAL 17 1.656 -9.721 4.117 112 HG12 VAL 17 2HG1 VAL 17 1.060 -11.175 3.315 113 HG13 VAL 17 3HG1 VAL 17 1.173 -9.658 2.422 114 HG21 VAL 17 3HG2 VAL 17 -2.218 -10.816 4.388 115 HG22 VAL 17 1HG2 VAL 17 -1.682 -11.146 2.741 116 HG23 VAL 17 2HG2 VAL 17 -0.808 -11.838 4.107 117 H LEU 18 H LEU 18 -0.749 -6.754 4.365 118 HA LEU 18 HA LEU 18 1.942 -5.940 4.224 119 HB2 LEU 18 1HB LEU 18 -0.638 -4.401 4.337 120 HB3 LEU 18 2HB LEU 18 0.930 -3.614 4.164 121 HG LEU 18 HG LEU 18 -0.136 -5.653 2.217 122 HD11 LEU 18 1HD1 LEU 18 -0.953 -2.944 2.613 123 HD12 LEU 18 2HD1 LEU 18 -1.494 -4.105 1.401 124 HD13 LEU 18 3HD1 LEU 18 -0.096 -3.080 1.077 125 HD21 LEU 18 3HD2 LEU 18 1.624 -4.962 0.801 126 HD22 LEU 18 1HD2 LEU 18 2.350 -5.226 2.386 127 HD23 LEU 18 2HD2 LEU 18 2.015 -3.585 1.832 128 H LEU 19 H LEU 19 -0.557 -4.790 6.500 129 HA LEU 19 HA LEU 19 1.016 -3.378 8.228 130 HB2 LEU 19 1HB LEU 19 -1.312 -5.158 8.934 131 HB3 LEU 19 2HB LEU 19 -0.636 -3.915 9.984 132 HG LEU 19 HG LEU 19 -1.831 -3.315 7.286 133 HD11 LEU 19 1HD1 LEU 19 -3.908 -3.189 8.138 134 HD12 LEU 19 2HD1 LEU 19 -3.345 -2.637 9.715 135 HD13 LEU 19 3HD1 LEU 19 -3.286 -4.352 9.309 136 HD21 LEU 19 3HD2 LEU 19 -0.207 -1.725 8.485 137 HD22 LEU 19 1HD2 LEU 19 -1.527 -1.465 9.625 138 HD23 LEU 19 2HD2 LEU 19 -1.747 -1.074 7.920 139 H SER 20 H SER 20 0.337 -6.864 8.385 140 HA SER 20 HA SER 20 1.575 -7.614 10.672 141 HB2 SER 20 1HB SER 20 0.487 -9.150 9.016 142 HB3 SER 20 2HB SER 20 1.958 -9.069 8.046 143 HG SER 20 HG SER 20 1.633 -10.134 10.649 144 H GLY 21 H GLY 21 3.149 -6.656 7.673 145 HA2 GLY 21 1HA GLY 21 5.285 -5.767 7.430 146 HA3 GLY 21 2HA GLY 21 5.604 -6.143 9.117 147 H ALA 22 H ALA 22 6.934 -6.678 6.360 148 HA ALA 22 HA ALA 22 7.581 -9.490 6.952 149 HB1 ALA 22 1HB ALA 22 8.045 -9.504 4.346 150 HB2 ALA 22 2HB ALA 22 6.447 -9.850 5.009 151 HB3 ALA 22 3HB ALA 22 6.808 -8.247 4.369 152 H THR 23 H THR 23 9.723 -10.161 6.292 153 HA THR 23 HA THR 23 11.660 -8.026 6.676 154 HB THR 23 HB THR 23 12.176 -10.995 6.435 155 HG1 THR 23 1HG THR 23 12.322 -10.746 8.817 156 HG21 THR 23 3HG2 THR 23 14.267 -10.111 6.224 157 HG22 THR 23 1HG2 THR 23 14.148 -10.084 7.982 158 HG23 THR 23 2HG2 THR 23 13.839 -8.616 7.055 159 H PHE 24 H PHE 24 13.244 -7.445 5.235 160 HA PHE 24 HA PHE 24 13.541 -8.844 2.721 161 HB2 PHE 24 1HB PHE 24 12.656 -5.953 2.692 162 HB3 PHE 24 2HB PHE 24 12.947 -6.988 1.298 163 HD1 PHE 24 2HD PHE 24 11.402 -8.883 0.835 164 HD2 PHE 24 1HD PHE 24 10.584 -5.956 3.815 165 HE1 PHE 24 2HE PHE 24 9.035 -9.555 0.841 166 HE2 PHE 24 1HE PHE 24 8.216 -6.625 3.827 167 HZ PHE 24 HZ PHE 24 7.439 -8.425 2.338 168 H LEU 25 H LEU 25 15.284 -7.908 1.387 169 HA LEU 25 HA LEU 25 17.371 -6.804 3.116 170 HB2 LEU 25 1HB LEU 25 17.334 -8.427 0.628 171 HB3 LEU 25 2HB LEU 25 18.718 -7.371 0.905 172 HG LEU 25 HG LEU 25 17.793 -9.538 2.791 173 HD11 LEU 25 1HD1 LEU 25 18.620 -10.699 0.951 174 HD12 LEU 25 2HD1 LEU 25 20.018 -10.559 2.016 175 HD13 LEU 25 3HD1 LEU 25 19.862 -9.489 0.623 176 HD21 LEU 25 3HD2 LEU 25 19.305 -7.313 3.337 177 HD22 LEU 25 1HD2 LEU 25 20.524 -8.538 2.986 178 HD23 LEU 25 2HD2 LEU 25 19.327 -8.823 4.249 179 H VAL 26 H VAL 26 17.812 -4.712 3.034 180 HA VAL 26 HA VAL 26 17.045 -3.191 0.638 181 HB VAL 26 HB VAL 26 17.645 -2.188 3.425 182 HG11 VAL 26 1HG1 VAL 26 16.432 -0.124 2.347 183 HG12 VAL 26 2HG1 VAL 26 18.166 -0.369 2.125 184 HG13 VAL 26 3HG1 VAL 26 17.039 -0.823 0.846 185 HG21 VAL 26 3HG2 VAL 26 15.102 -2.827 1.981 186 HG22 VAL 26 1HG2 VAL 26 15.590 -3.243 3.624 187 HG23 VAL 26 2HG2 VAL 26 15.132 -1.585 3.232 188 H THR 27 H THR 27 18.588 -2.543 -0.696 189 HA THR 27 HA THR 27 21.365 -2.497 0.265 190 HB THR 27 HB THR 27 20.686 -2.302 -2.639 191 HG1 THR 27 1HG THR 27 20.831 -4.740 -2.505 192 HG21 THR 27 3HG2 THR 27 22.862 -3.840 -1.231 193 HG22 THR 27 1HG2 THR 27 23.028 -2.150 -1.707 194 HG23 THR 27 2HG2 THR 27 22.781 -3.392 -2.935 195 H PHE 28 H PHE 28 22.161 -0.570 0.753 196 HA PHE 28 HA PHE 28 20.978 1.830 -0.408 197 HB2 PHE 28 1HB PHE 28 23.014 1.496 1.805 198 HB3 PHE 28 2HB PHE 28 22.334 3.034 1.283 199 HD1 PHE 28 2HD PHE 28 19.616 2.905 1.161 200 HD2 PHE 28 1HD PHE 28 22.141 0.642 3.733 201 HE1 PHE 28 2HE PHE 28 17.746 2.610 2.732 202 HE2 PHE 28 1HE PHE 28 20.275 0.342 5.308 203 HZ PHE 28 HZ PHE 28 18.074 1.328 4.809 204 H GLY 29 H GLY 29 21.990 3.164 -1.811 205 HA2 GLY 29 1HA GLY 29 23.907 2.359 -3.554 206 HA3 GLY 29 2HA GLY 29 23.661 4.049 -3.138 207 H ASN 30 H ASN 30 24.465 3.704 -0.360 208 HA ASN 30 HA ASN 30 27.277 4.067 -0.718 209 HB2 ASN 30 1HB ASN 30 26.109 5.388 0.943 210 HB3 ASN 30 2HB ASN 30 25.577 3.933 1.781 211 HD21 ASN 30 1HD2 ASN 30 27.003 6.059 2.955 212 HD22 ASN 30 2HD2 ASN 30 28.534 5.451 3.475 213 H SER 31 H SER 31 25.279 1.609 0.889 214 HA SER 31 HA SER 31 27.621 -0.033 1.412 215 HB2 SER 31 1HB SER 31 26.057 -1.524 2.579 216 HB3 SER 31 2HB SER 31 25.864 0.140 3.130 217 HG SER 31 HG SER 31 23.830 -0.485 2.745 218 H GLU 32 H GLU 32 28.252 -1.727 0.227 219 HA GLU 32 HA GLU 32 26.921 -2.255 -2.272 220 HB2 GLU 32 1HB GLU 32 29.353 -3.545 -1.021 221 HB3 GLU 32 2HB GLU 32 28.792 -3.825 -2.664 222 HG2 GLU 32 1HG GLU 32 29.023 -1.261 -2.920 223 HG3 GLU 32 2HG GLU 32 30.043 -1.383 -1.488 224 H LYS 33 H LYS 33 27.056 -3.685 0.874 225 HA LYS 33 HA LYS 33 25.683 -6.093 -0.105 226 HB2 LYS 33 1HB LYS 33 27.370 -6.936 1.190 227 HB3 LYS 33 2HB LYS 33 27.435 -5.514 2.223 228 HG2 LYS 33 1HG LYS 33 25.846 -6.300 3.647 229 HG3 LYS 33 2HG LYS 33 25.022 -7.229 2.393 230 HD2 LYS 33 1HD LYS 33 27.305 -8.588 2.443 231 HD3 LYS 33 2HD LYS 33 27.346 -7.962 4.093 232 HE2 LYS 33 1HE LYS 33 25.265 -8.989 4.618 233 HE3 LYS 33 2HE LYS 33 24.965 -9.390 2.928 234 HZ1 LYS 33 3HZ LYS 33 25.687 -11.352 4.014 235 HZ2 LYS 33 1HZ LYS 33 27.011 -10.571 4.720 236 HZ3 LYS 33 2HZ LYS 33 26.977 -10.834 3.050 237 HA PRO 34 HA PRO 34 21.864 -4.591 1.511 238 HB2 PRO 34 1HB PRO 34 20.536 -6.956 1.644 239 HB3 PRO 34 2HB PRO 34 20.857 -6.119 0.120 240 HG2 PRO 34 1HG PRO 34 22.322 -8.414 1.365 241 HG3 PRO 34 2HG PRO 34 21.853 -8.171 -0.328 242 HD2 PRO 34 1HD PRO 34 24.363 -7.700 0.570 243 HD3 PRO 34 2HD PRO 34 23.631 -6.767 -0.751 244 H GLU 35 H GLU 35 20.330 -5.040 3.331 245 HA GLU 35 HA GLU 35 21.539 -6.445 5.593 246 HB2 GLU 35 1HB GLU 35 22.318 -4.185 5.893 247 HB3 GLU 35 2HB GLU 35 20.705 -3.543 5.617 248 HG2 GLU 35 1HG GLU 35 21.136 -3.451 7.948 249 HG3 GLU 35 2HG GLU 35 19.954 -4.729 7.672 250 H THR 36 H THR 36 20.083 -7.259 7.064 251 HA THR 36 HA THR 36 17.450 -7.732 6.148 252 HB THR 36 HB THR 36 18.572 -8.156 8.924 253 HG1 THR 36 1HG THR 36 19.080 -10.206 8.184 254 HG21 THR 36 3HG2 THR 36 16.685 -10.090 8.482 255 HG22 THR 36 1HG2 THR 36 15.962 -8.682 7.706 256 HG23 THR 36 2HG2 THR 36 16.425 -8.611 9.406 257 H MET 37 H MET 37 15.897 -6.247 6.089 258 HA MET 37 HA MET 37 15.511 -4.543 8.454 259 HB2 MET 37 1HB MET 37 15.353 -3.693 5.560 260 HB3 MET 37 2HB MET 37 14.772 -2.718 6.903 261 HG2 MET 37 1HG MET 37 17.188 -3.015 7.812 262 HG3 MET 37 2HG MET 37 17.568 -3.411 6.138 263 HE1 MET 37 3HE MET 37 16.203 0.655 7.777 264 HE2 MET 37 1HE MET 37 15.067 -0.694 7.768 265 HE3 MET 37 2HE MET 37 16.555 -0.801 8.709 266 H THR 38 H THR 38 13.362 -3.984 8.931 267 HA THR 38 HA THR 38 11.394 -5.817 7.766 268 HB THR 38 HB THR 38 11.114 -4.135 10.262 269 HG1 THR 38 1HG THR 38 12.251 -6.658 9.801 270 HG21 THR 38 3HG2 THR 38 8.960 -4.743 9.558 271 HG22 THR 38 1HG2 THR 38 9.389 -5.974 10.745 272 HG23 THR 38 2HG2 THR 38 9.488 -6.338 9.022 273 H CYS 39 H CYS 39 9.907 -5.102 6.394 274 HA CYS 39 HA CYS 39 9.410 -2.205 6.252 275 HB2 CYS 39 1HB CYS 39 9.380 -4.372 4.173 276 HB3 CYS 39 2HB CYS 39 8.485 -2.879 3.917 277 HG CYS 39 HG CYS 39 10.643 -2.214 2.553 278 H ARG 40 H ARG 40 7.528 -1.539 7.022 279 HA ARG 40 HA ARG 40 5.156 -3.220 6.660 280 HB2 ARG 40 1HB ARG 40 4.438 -2.930 8.934 281 HB3 ARG 40 2HB ARG 40 6.068 -3.592 8.953 282 HG2 ARG 40 1HG ARG 40 6.861 -1.187 9.234 283 HG3 ARG 40 2HG ARG 40 5.177 -0.803 9.596 284 HD2 ARG 40 1HD ARG 40 5.169 -2.250 11.483 285 HD3 ARG 40 2HD ARG 40 6.726 -2.945 11.035 286 HE ARG 40 HE ARG 40 6.261 -0.447 12.408 287 HH11 ARG 40 1HH1 ARG 40 8.501 -2.368 10.560 288 HH12 ARG 40 2HH1 ARG 40 9.902 -1.539 11.153 289 HH21 ARG 40 1HH2 ARG 40 8.098 0.651 13.195 290 HH22 ARG 40 2HH2 ARG 40 9.672 0.177 12.652 291 H LEU 41 H LEU 41 3.125 -2.014 6.996 292 HA LEU 41 HA LEU 41 3.448 0.773 6.122 293 HB2 LEU 41 1HB LEU 41 1.451 -1.352 5.584 294 HB3 LEU 41 2HB LEU 41 0.870 0.311 5.635 295 HG LEU 41 HG LEU 41 3.185 -0.443 3.888 296 HD11 LEU 41 1HD1 LEU 41 0.775 -0.336 2.383 297 HD12 LEU 41 2HD1 LEU 41 0.587 -1.536 3.660 298 HD13 LEU 41 3HD1 LEU 41 1.932 -1.659 2.527 299 HD21 LEU 41 3HD2 LEU 41 3.043 1.802 3.720 300 HD22 LEU 41 1HD2 LEU 41 1.361 1.845 4.249 301 HD23 LEU 41 2HD2 LEU 41 1.750 1.424 2.581 302 H SER 42 H SER 42 1.701 2.285 6.834 303 HA SER 42 HA SER 42 1.517 2.229 9.693 304 HB2 SER 42 1HB SER 42 1.816 4.301 8.225 305 HB3 SER 42 2HB SER 42 0.094 4.167 7.867 306 HG SER 42 HG SER 42 1.257 5.246 10.002 307 H ASN 43 H ASN 43 -0.715 2.953 10.650 308 HA ASN 43 HA ASN 43 -2.417 0.837 10.740 309 HB2 ASN 43 1HB ASN 43 -3.388 3.691 10.939 310 HB3 ASN 43 2HB ASN 43 -4.049 2.273 11.748 311 HD21 ASN 43 1HD2 ASN 43 -3.369 1.833 13.728 312 HD22 ASN 43 2HD2 ASN 43 -2.001 2.549 14.503 313 H ASN 44 H ASN 44 -2.962 3.744 8.743 314 HA ASN 44 HA ASN 44 -4.911 2.232 7.161 315 HB2 ASN 44 1HB ASN 44 -4.417 5.139 7.649 316 HB3 ASN 44 2HB ASN 44 -5.191 4.657 6.142 317 HD21 ASN 44 1HD2 ASN 44 -5.976 5.954 8.859 318 HD22 ASN 44 2HD2 ASN 44 -7.477 5.180 9.222 319 H GLN 45 H GLN 45 -1.861 2.135 7.035 320 HA GLN 45 HA GLN 45 -0.218 1.984 5.466 321 HB2 GLN 45 1HB GLN 45 -2.433 1.687 3.447 322 HB3 GLN 45 2HB GLN 45 -0.821 0.985 3.401 323 HG2 GLN 45 1HG GLN 45 -1.338 -0.621 4.998 324 HG3 GLN 45 2HG GLN 45 -2.748 0.268 5.573 325 HE21 GLN 45 1HE2 GLN 45 -4.293 -1.236 5.276 326 HE22 GLN 45 2HE2 GLN 45 -4.725 -1.903 3.742 327 H ARG 46 H ARG 46 -0.694 4.566 6.095 328 HA ARG 46 HA ARG 46 -0.924 6.045 3.579 329 HB2 ARG 46 1HB ARG 46 -1.102 6.796 6.474 330 HB3 ARG 46 2HB ARG 46 -0.720 8.029 5.279 331 HG2 ARG 46 1HG ARG 46 -2.811 7.278 4.052 332 HG3 ARG 46 2HG ARG 46 -3.213 6.378 5.516 333 HD2 ARG 46 1HD ARG 46 -4.327 8.457 5.689 334 HD3 ARG 46 2HD ARG 46 -2.944 8.545 6.778 335 HE ARG 46 HE ARG 46 -2.117 9.589 4.348 336 HH11 ARG 46 1HH1 ARG 46 -4.480 10.319 6.799 337 HH12 ARG 46 2HH1 ARG 46 -4.449 12.026 6.504 338 HH21 ARG 46 1HH2 ARG 46 -2.069 11.834 3.951 339 HH22 ARG 46 2HH2 ARG 46 -3.078 12.887 4.883 340 H TYR 47 H TYR 47 1.430 4.712 5.556 341 HA TYR 47 HA TYR 47 3.536 6.009 4.087 342 HB2 TYR 47 1HB TYR 47 3.620 6.309 7.085 343 HB3 TYR 47 2HB TYR 47 4.669 7.059 5.887 344 HD1 TYR 47 2HD TYR 47 1.324 7.136 7.420 345 HD2 TYR 47 1HD TYR 47 4.011 9.064 4.743 346 HE1 TYR 47 2HE TYR 47 -0.127 9.121 7.402 347 HE2 TYR 47 1HE TYR 47 2.568 11.055 4.719 348 HH TYR 47 HH TYR 47 0.246 11.669 6.940 349 H LEU 48 H LEU 48 5.586 4.988 4.368 350 HA LEU 48 HA LEU 48 5.334 2.247 5.374 351 HB2 LEU 48 1HB LEU 48 7.184 3.558 3.407 352 HB3 LEU 48 2HB LEU 48 7.520 1.963 4.077 353 HG LEU 48 HG LEU 48 4.968 2.587 2.612 354 HD11 LEU 48 1HD1 LEU 48 6.717 1.056 1.003 355 HD12 LEU 48 2HD1 LEU 48 7.593 2.496 1.521 356 HD13 LEU 48 3HD1 LEU 48 6.050 2.657 0.682 357 HD21 LEU 48 3HD2 LEU 48 4.710 0.255 2.464 358 HD22 LEU 48 1HD2 LEU 48 5.216 0.560 4.126 359 HD23 LEU 48 2HD2 LEU 48 6.380 -0.045 2.947 360 H PHE 49 H PHE 49 6.922 1.316 6.705 361 HA PHE 49 HA PHE 49 8.797 3.186 7.977 362 HB2 PHE 49 1HB PHE 49 7.139 1.169 9.500 363 HB3 PHE 49 2HB PHE 49 8.241 2.364 10.177 364 HD1 PHE 49 1HD PHE 49 7.535 4.790 8.743 365 HD2 PHE 49 2HD PHE 49 5.034 1.706 10.273 366 HE1 PHE 49 1HE PHE 49 5.679 6.395 8.934 367 HE2 PHE 49 2HE PHE 49 3.174 3.305 10.467 368 HZ PHE 49 HZ PHE 49 3.495 5.652 9.796 369 H LEU 50 H LEU 50 10.792 2.392 8.327 370 HA LEU 50 HA LEU 50 11.225 -0.463 7.745 371 HB2 LEU 50 1HB LEU 50 13.249 1.749 7.493 372 HB3 LEU 50 2HB LEU 50 13.391 0.091 6.914 373 HG LEU 50 HG LEU 50 11.496 2.169 5.821 374 HD11 LEU 50 1HD1 LEU 50 12.945 2.232 3.893 375 HD12 LEU 50 2HD1 LEU 50 14.017 1.035 4.620 376 HD13 LEU 50 3HD1 LEU 50 13.868 2.638 5.340 377 HD21 LEU 50 3HD2 LEU 50 11.375 -0.622 5.694 378 HD22 LEU 50 1HD2 LEU 50 12.015 -0.102 4.135 379 HD23 LEU 50 2HD2 LEU 50 10.476 0.537 4.713 380 H ASP 51 H ASP 51 12.972 -1.522 8.894 381 HA ASP 51 HA ASP 51 13.746 -0.259 11.422 382 HB2 ASP 51 1HB ASP 51 11.751 -1.618 11.899 383 HB3 ASP 51 2HB ASP 51 12.547 -3.029 11.208 384 H GLY 52 H GLY 52 15.719 -0.915 12.244 385 HA2 GLY 52 1HA GLY 52 17.280 -3.027 11.945 386 HA3 GLY 52 2HA GLY 52 17.413 -2.336 10.334 387 H ASP 53 H ASP 53 19.394 -1.495 10.207 388 HA ASP 53 HA ASP 53 21.144 -0.698 12.066 389 HB2 ASP 53 1HB ASP 53 20.546 0.577 9.402 390 HB3 ASP 53 2HB ASP 53 21.888 1.116 10.407 391 H SER 54 H SER 54 18.613 1.432 10.753 392 HA SER 54 HA SER 54 18.549 2.874 13.280 393 HB2 SER 54 1HB SER 54 19.442 4.057 10.682 394 HB3 SER 54 2HB SER 54 18.503 5.056 11.790 395 HG SER 54 HG SER 54 20.072 4.726 13.362 396 H HIS 55 H HIS 55 16.813 4.753 12.981 397 HA HIS 55 HA HIS 55 14.391 3.390 12.184 398 HB2 HIS 55 1HB HIS 55 14.818 6.116 13.423 399 HB3 HIS 55 2HB HIS 55 13.249 5.360 13.164 400 HD2 HIS 55 2HD HIS 55 16.511 4.428 15.218 401 HE1 HIS 55 1HE HIS 55 13.067 3.055 17.279 402 HE2 HIS 55 2HE HIS 55 15.568 3.339 17.367 403 H TYR 56 H TYR 56 14.180 3.333 10.003 404 HA TYR 56 HA TYR 56 14.325 5.894 8.557 405 HB2 TYR 56 1HB TYR 56 14.934 3.079 7.769 406 HB3 TYR 56 2HB TYR 56 14.341 4.184 6.534 407 HD1 TYR 56 2HD TYR 56 17.038 3.678 9.026 408 HD2 TYR 56 1HD TYR 56 15.771 5.784 5.554 409 HE1 TYR 56 2HE TYR 56 19.312 4.572 8.747 410 HE2 TYR 56 1HE TYR 56 18.042 6.684 5.264 411 HH TYR 56 HH TYR 56 20.407 5.967 5.950 412 H GLU 57 H GLU 57 12.709 6.373 6.998 413 HA GLU 57 HA GLU 57 10.344 4.719 6.850 414 HB2 GLU 57 1HB GLU 57 8.802 6.371 7.716 415 HB3 GLU 57 2HB GLU 57 10.000 5.988 8.945 416 HG2 GLU 57 1HG GLU 57 9.979 8.245 9.140 417 HG3 GLU 57 2HG GLU 57 11.225 8.079 7.904 418 H ILE 58 H ILE 58 9.671 4.797 4.819 419 HA ILE 58 HA ILE 58 10.415 7.107 3.170 420 HB ILE 58 HB ILE 58 9.477 4.364 2.321 421 HG12 ILE 58 1HG1 ILE 58 12.226 5.542 1.956 422 HG13 ILE 58 2HG1 ILE 58 11.796 4.630 3.398 423 HG21 ILE 58 1HG2 ILE 58 10.810 6.190 0.421 424 HG22 ILE 58 2HG2 ILE 58 9.508 5.030 0.160 425 HG23 ILE 58 3HG2 ILE 58 9.158 6.601 0.880 426 HD11 ILE 58 3HD1 ILE 58 11.211 2.713 1.953 427 HD12 ILE 58 1HD1 ILE 58 11.785 3.632 0.562 428 HD13 ILE 58 2HD1 ILE 58 12.906 3.184 1.848 429 H GLU 59 H GLU 59 8.836 8.606 3.415 430 HA GLU 59 HA GLU 59 6.090 8.041 3.714 431 HB2 GLU 59 1HB GLU 59 7.638 10.508 2.983 432 HB3 GLU 59 2HB GLU 59 5.881 10.512 2.945 433 HG2 GLU 59 1HG GLU 59 5.784 9.956 5.287 434 HG3 GLU 59 2HG GLU 59 7.538 9.800 5.353 435 H ILE 60 H ILE 60 4.719 7.268 2.266 436 HA ILE 60 HA ILE 60 5.279 6.774 -0.402 437 HB ILE 60 HB ILE 60 2.574 7.166 0.881 438 HG12 ILE 60 1HG1 ILE 60 4.053 4.605 0.255 439 HG13 ILE 60 2HG1 ILE 60 4.066 5.378 1.837 440 HG21 ILE 60 1HG2 ILE 60 1.794 7.099 -1.208 441 HG22 ILE 60 2HG2 ILE 60 3.359 6.624 -1.865 442 HG23 ILE 60 3HG2 ILE 60 2.271 5.401 -1.209 443 HD11 ILE 60 3HD1 ILE 60 2.461 3.508 1.638 444 HD12 ILE 60 1HD1 ILE 60 1.711 5.040 2.083 445 HD13 ILE 60 2HD1 ILE 60 1.580 4.442 0.429 446 H VAL 61 H VAL 61 4.141 9.676 1.118 447 HA VAL 61 HA VAL 61 3.002 10.972 -1.098 448 HB VAL 61 HB VAL 61 3.518 13.089 0.125 449 HG11 VAL 61 1HG1 VAL 61 1.859 12.768 1.709 450 HG12 VAL 61 2HG1 VAL 61 1.544 11.465 0.562 451 HG13 VAL 61 3HG1 VAL 61 2.383 11.125 2.076 452 HG21 VAL 61 3HG2 VAL 61 4.350 11.793 2.578 453 HG22 VAL 61 1HG2 VAL 61 5.530 11.575 1.286 454 HG23 VAL 61 2HG2 VAL 61 5.030 13.199 1.759 455 H HIS 62 H HIS 62 6.248 10.194 -0.388 456 HA HIS 62 HA HIS 62 7.286 12.216 -2.236 457 HB2 HIS 62 1HB HIS 62 8.607 10.384 -0.241 458 HB3 HIS 62 2HB HIS 62 9.534 11.260 -1.456 459 HD2 HIS 62 2HD HIS 62 9.740 11.899 1.829 460 HE1 HIS 62 1HE HIS 62 7.932 15.561 0.679 461 HE2 HIS 62 2HE HIS 62 9.298 14.375 2.432 462 H ILE 63 H ILE 63 6.950 8.746 -1.819 463 HA ILE 63 HA ILE 63 8.575 7.807 -3.851 464 HB ILE 63 HB ILE 63 5.876 6.696 -3.074 465 HG12 ILE 63 1HG1 ILE 63 8.628 6.046 -1.994 466 HG13 ILE 63 2HG1 ILE 63 7.406 6.991 -1.150 467 HG21 ILE 63 1HG2 ILE 63 6.280 4.922 -4.374 468 HG22 ILE 63 2HG2 ILE 63 7.460 5.955 -5.179 469 HG23 ILE 63 3HG2 ILE 63 7.979 4.850 -3.906 470 HD11 ILE 63 3HD1 ILE 63 7.108 4.940 -0.198 471 HD12 ILE 63 1HD1 ILE 63 5.945 4.853 -1.521 472 HD13 ILE 63 2HD1 ILE 63 7.518 4.070 -1.676 473 H SER 64 H SER 64 8.478 7.734 -6.021 474 HA SER 64 HA SER 64 6.171 9.026 -7.304 475 HB2 SER 64 1HB SER 64 8.929 8.574 -8.464 476 HB3 SER 64 2HB SER 64 7.642 9.569 -9.145 477 HG SER 64 HG SER 64 7.841 10.947 -7.351 478 H THR 65 H THR 65 8.582 6.540 -8.163 479 HA THR 65 HA THR 65 6.477 5.116 -9.638 480 HB THR 65 HB THR 65 9.475 4.755 -9.810 481 HG1 THR 65 1HG THR 65 7.641 6.362 -11.202 482 HG21 THR 65 3HG2 THR 65 8.893 2.802 -10.750 483 HG22 THR 65 1HG2 THR 65 8.351 3.774 -12.117 484 HG23 THR 65 2HG2 THR 65 7.198 3.270 -10.881 485 H VAL 66 H VAL 66 5.939 3.030 -9.181 486 HA VAL 66 HA VAL 66 7.412 1.659 -7.041 487 HB VAL 66 HB VAL 66 4.406 1.933 -7.170 488 HG11 VAL 66 1HG1 VAL 66 4.197 0.204 -5.774 489 HG12 VAL 66 2HG1 VAL 66 5.850 -0.217 -6.225 490 HG13 VAL 66 3HG1 VAL 66 5.546 0.742 -4.775 491 HG21 VAL 66 3HG2 VAL 66 6.078 2.770 -4.846 492 HG22 VAL 66 1HG2 VAL 66 5.968 3.828 -6.253 493 HG23 VAL 66 2HG2 VAL 66 4.507 3.370 -5.377 494 H GLN 67 H GLN 67 8.273 0.048 -8.243 495 HA GLN 67 HA GLN 67 6.380 -1.694 -9.675 496 HB2 GLN 67 1HB GLN 67 7.891 -2.038 -11.440 497 HB3 GLN 67 2HB GLN 67 7.948 -0.306 -11.145 498 HG2 GLN 67 1HG GLN 67 10.026 -0.497 -9.990 499 HG3 GLN 67 2HG GLN 67 9.935 -2.258 -10.015 500 HE21 GLN 67 1HE2 GLN 67 11.887 -2.478 -11.078 501 HE22 GLN 67 2HE2 GLN 67 12.090 -2.069 -12.744 502 H ILE 68 H ILE 68 7.064 -3.948 -9.841 503 HA ILE 68 HA ILE 68 8.620 -4.753 -7.475 504 HB ILE 68 HB ILE 68 6.492 -6.275 -8.984 505 HG12 ILE 68 1HG1 ILE 68 6.443 -5.325 -6.120 506 HG13 ILE 68 2HG1 ILE 68 5.806 -4.359 -7.447 507 HG21 ILE 68 1HG2 ILE 68 7.021 -7.537 -6.552 508 HG22 ILE 68 2HG2 ILE 68 7.420 -8.120 -8.167 509 HG23 ILE 68 3HG2 ILE 68 8.602 -7.187 -7.250 510 HD11 ILE 68 3HD1 ILE 68 3.905 -5.487 -7.430 511 HD12 ILE 68 1HD1 ILE 68 4.752 -7.030 -7.543 512 HD13 ILE 68 2HD1 ILE 68 4.466 -6.294 -5.966 513 H LEU 69 H LEU 69 10.249 -6.251 -7.642 514 HA LEU 69 HA LEU 69 11.345 -6.623 -10.309 515 HB2 LEU 69 1HB LEU 69 12.457 -7.317 -7.595 516 HB3 LEU 69 2HB LEU 69 13.321 -7.488 -9.122 517 HG LEU 69 HG LEU 69 12.353 -4.863 -7.994 518 HD11 LEU 69 1HD1 LEU 69 14.944 -6.330 -7.722 519 HD12 LEU 69 2HD1 LEU 69 14.011 -5.468 -6.499 520 HD13 LEU 69 3HD1 LEU 69 14.909 -4.566 -7.719 521 HD21 LEU 69 3HD2 LEU 69 12.702 -4.188 -10.092 522 HD22 LEU 69 1HD2 LEU 69 13.500 -5.697 -10.535 523 HD23 LEU 69 2HD2 LEU 69 14.420 -4.409 -9.755 524 H THR 70 H THR 70 10.348 -8.245 -11.369 525 HA THR 70 HA THR 70 10.049 -10.825 -9.982 526 HB THR 70 HB THR 70 8.479 -11.404 -11.857 527 HG1 THR 70 1HG THR 70 8.342 -8.638 -12.408 528 HG21 THR 70 3HG2 THR 70 7.653 -10.644 -9.675 529 HG22 THR 70 1HG2 THR 70 6.611 -10.091 -10.985 530 HG23 THR 70 2HG2 THR 70 7.742 -8.971 -10.225 531 H GLU 71 H GLU 71 10.749 -12.732 -10.974 532 HA GLU 71 HA GLU 71 13.159 -12.590 -12.388 533 HB2 GLU 71 1HB GLU 71 13.154 -14.927 -12.392 534 HB3 GLU 71 2HB GLU 71 12.202 -14.516 -10.972 535 HG2 GLU 71 1HG GLU 71 10.152 -14.938 -12.183 536 HG3 GLU 71 2HG GLU 71 11.063 -15.259 -13.657 537 H GLY 72 H GLY 72 9.843 -13.074 -13.494 538 HA2 GLY 72 1HA GLY 72 10.711 -13.412 -16.251 539 HA3 GLY 72 2HA GLY 72 9.056 -13.475 -15.662 540 H PHE 73 H PHE 73 11.483 -11.546 -17.098 541 HA PHE 73 HA PHE 73 10.552 -8.967 -16.535 542 HB2 PHE 73 1HB PHE 73 12.659 -9.939 -17.911 543 HB3 PHE 73 2HB PHE 73 11.626 -9.460 -19.253 544 HD1 PHE 73 1HD PHE 73 10.785 -7.072 -19.322 545 HD2 PHE 73 2HD PHE 73 13.914 -8.360 -16.741 546 HE1 PHE 73 1HE PHE 73 11.526 -4.740 -19.062 547 HE2 PHE 73 2HE PHE 73 14.660 -6.031 -16.476 548 HZ PHE 73 HZ PHE 73 13.466 -4.217 -17.637 549 HA PRO 74 HA PRO 74 7.899 -9.374 -20.574 550 HB2 PRO 74 1HB PRO 74 7.460 -11.895 -21.481 551 HB3 PRO 74 2HB PRO 74 8.828 -10.908 -22.009 552 HG2 PRO 74 1HG PRO 74 8.742 -13.081 -19.952 553 HG3 PRO 74 2HG PRO 74 9.960 -12.773 -21.204 554 HD2 PRO 74 1HD PRO 74 10.312 -12.048 -18.619 555 HD3 PRO 74 2HD PRO 74 10.991 -11.120 -19.971 556 HA PRO 75 HA PRO 75 4.271 -10.219 -18.206 557 HB2 PRO 75 1HB PRO 75 2.400 -9.771 -20.121 558 HB3 PRO 75 2HB PRO 75 3.306 -8.470 -19.341 559 HG2 PRO 75 1HG PRO 75 3.766 -9.768 -21.998 560 HG3 PRO 75 2HG PRO 75 3.829 -8.050 -21.567 561 HD2 PRO 75 1HD PRO 75 6.055 -9.567 -21.838 562 HD3 PRO 75 2HD PRO 75 5.952 -8.220 -20.686 563 H GLY 76 H GLY 76 2.062 -11.429 -18.607 564 HA2 GLY 76 1HA GLY 76 1.163 -13.554 -18.661 565 HA3 GLY 76 2HA GLY 76 1.652 -13.479 -20.348 566 H GLY 77 H GLY 77 1.955 -15.777 -20.255 567 HA2 GLY 77 1HA GLY 77 3.768 -17.313 -20.482 568 HA3 GLY 77 2HA GLY 77 4.611 -16.457 -19.199 569 H GLY 78 H GLY 78 4.142 -16.921 -17.045 570 HA2 GLY 78 1HA GLY 78 2.159 -19.004 -16.503 571 HA3 GLY 78 2HA GLY 78 3.836 -19.365 -16.121 572 H ASN 79 H ASN 79 3.920 -19.373 -13.959 573 HA ASN 79 HA ASN 79 2.464 -17.392 -12.416 574 HB2 ASN 79 1HB ASN 79 4.223 -19.706 -11.580 575 HB3 ASN 79 2HB ASN 79 3.385 -18.643 -10.454 576 HD21 ASN 79 1HD2 ASN 79 2.215 -20.375 -9.616 577 HD22 ASN 79 2HD2 ASN 79 0.902 -21.092 -10.482 578 H ALA 80 H ALA 80 3.298 -15.517 -11.798 579 HA ALA 80 HA ALA 80 6.121 -14.986 -12.197 580 HB1 ALA 80 1HB ALA 80 4.040 -13.077 -11.157 581 HB2 ALA 80 2HB ALA 80 5.591 -12.692 -11.905 582 HB3 ALA 80 3HB ALA 80 4.295 -13.393 -12.874 583 H ARG 81 H ARG 81 7.616 -15.040 -10.653 584 HA ARG 81 HA ARG 81 6.719 -15.112 -7.848 585 HB2 ARG 81 1HB ARG 81 7.726 -17.205 -8.435 586 HB3 ARG 81 2HB ARG 81 9.096 -16.400 -9.188 587 HG2 ARG 81 1HG ARG 81 9.830 -17.252 -7.102 588 HG3 ARG 81 2HG ARG 81 9.696 -15.500 -6.932 589 HD2 ARG 81 1HD ARG 81 8.690 -16.244 -4.993 590 HD3 ARG 81 2HD ARG 81 7.305 -16.036 -6.064 591 HE ARG 81 HE ARG 81 8.461 -18.688 -6.036 592 HH11 ARG 81 1HH1 ARG 81 6.071 -16.534 -4.708 593 HH12 ARG 81 2HH1 ARG 81 5.043 -17.810 -4.145 594 HH21 ARG 81 1HH2 ARG 81 7.117 -20.378 -5.300 595 HH22 ARG 81 2HH2 ARG 81 5.640 -19.996 -4.481 596 H ALA 82 H ALA 82 6.815 -12.908 -7.455 597 HA ALA 82 HA ALA 82 8.927 -11.207 -8.182 598 HB1 ALA 82 1HB ALA 82 8.033 -9.685 -6.457 599 HB2 ALA 82 2HB ALA 82 6.779 -10.324 -7.521 600 HB3 ALA 82 3HB ALA 82 6.975 -10.980 -5.896 601 H THR 83 H THR 83 10.978 -11.667 -7.663 602 HA THR 83 HA THR 83 11.620 -12.728 -5.023 603 HB THR 83 HB THR 83 12.682 -13.735 -7.024 604 HG1 THR 83 1HG THR 83 14.727 -12.467 -5.546 605 HG21 THR 83 3HG2 THR 83 13.562 -12.469 -8.629 606 HG22 THR 83 1HG2 THR 83 14.718 -11.791 -7.484 607 HG23 THR 83 2HG2 THR 83 13.145 -11.024 -7.708 608 H GLY 84 H GLY 84 10.727 -9.906 -5.512 609 HA2 GLY 84 1HA GLY 84 12.100 -8.556 -3.593 610 HA3 GLY 84 2HA GLY 84 13.053 -8.271 -5.042 611 H MET 85 H MET 85 12.406 -6.006 -4.372 612 HA MET 85 HA MET 85 10.128 -5.225 -6.002 613 HB2 MET 85 1HB MET 85 9.083 -5.434 -3.843 614 HB3 MET 85 2HB MET 85 10.377 -4.524 -3.075 615 HG2 MET 85 1HG MET 85 9.691 -2.506 -4.116 616 HG3 MET 85 2HG MET 85 8.569 -3.361 -5.171 617 HE1 MET 85 3HE MET 85 6.322 -2.142 -4.650 618 HE2 MET 85 1HE MET 85 6.225 -3.903 -4.666 619 HE3 MET 85 2HE MET 85 5.366 -2.985 -3.430 620 H PHE 86 H PHE 86 10.194 -3.044 -6.688 621 HA PHE 86 HA PHE 86 12.694 -1.617 -6.086 622 HB2 PHE 86 1HB PHE 86 12.670 -2.836 -8.339 623 HB3 PHE 86 2HB PHE 86 11.462 -1.656 -8.836 624 HD1 PHE 86 2HD PHE 86 14.956 -2.086 -7.747 625 HD2 PHE 86 1HD PHE 86 12.069 0.552 -9.427 626 HE1 PHE 86 2HE PHE 86 16.749 -0.513 -8.348 627 HE2 PHE 86 1HE PHE 86 13.858 2.130 -10.031 628 HZ PHE 86 HZ PHE 86 16.201 1.599 -9.491 629 H LEU 87 H LEU 87 12.174 0.224 -5.120 630 HA LEU 87 HA LEU 87 9.802 1.689 -6.074 631 HB2 LEU 87 1HB LEU 87 10.973 1.707 -3.296 632 HB3 LEU 87 2HB LEU 87 9.541 2.585 -3.831 633 HG LEU 87 HG LEU 87 9.558 -0.383 -4.079 634 HD11 LEU 87 1HD1 LEU 87 8.687 0.825 -1.501 635 HD12 LEU 87 2HD1 LEU 87 10.396 0.465 -1.741 636 HD13 LEU 87 3HD1 LEU 87 9.199 -0.824 -1.862 637 HD21 LEU 87 3HD2 LEU 87 7.475 1.703 -3.444 638 HD22 LEU 87 1HD2 LEU 87 7.170 -0.033 -3.511 639 HD23 LEU 87 2HD2 LEU 87 7.678 0.829 -4.963 640 H GLN 88 H GLN 88 9.925 3.985 -6.087 641 HA GLN 88 HA GLN 88 12.663 5.062 -5.995 642 HB2 GLN 88 1HB GLN 88 10.551 5.432 -8.105 643 HB3 GLN 88 2HB GLN 88 11.851 6.597 -7.895 644 HG2 GLN 88 1HG GLN 88 13.351 4.439 -8.049 645 HG3 GLN 88 2HG GLN 88 11.945 3.807 -8.904 646 HE21 GLN 88 1HE2 GLN 88 11.036 5.649 -10.457 647 HE22 GLN 88 2HE2 GLN 88 12.229 6.287 -11.531 648 H TYR 89 H TYR 89 12.919 7.078 -5.126 649 HA TYR 89 HA TYR 89 10.626 8.739 -4.532 650 HB2 TYR 89 1HB TYR 89 11.085 8.812 -2.101 651 HB3 TYR 89 2HB TYR 89 10.566 7.218 -2.636 652 HD1 TYR 89 1HD TYR 89 13.634 9.190 -1.874 653 HD2 TYR 89 2HD TYR 89 11.834 5.341 -2.092 654 HE1 TYR 89 1HE TYR 89 15.639 8.200 -0.850 655 HE2 TYR 89 2HE TYR 89 13.833 4.341 -1.068 656 HH TYR 89 HH TYR 89 16.231 4.868 -0.815 657 H THR 90 H THR 90 11.339 10.760 -3.338 658 HA THR 90 HA THR 90 14.045 11.515 -4.233 659 HB THR 90 HB THR 90 13.241 13.800 -4.527 660 HG1 THR 90 1HG THR 90 11.552 14.164 -3.248 661 HG21 THR 90 3HG2 THR 90 13.099 12.298 -6.443 662 HG22 THR 90 1HG2 THR 90 11.753 13.436 -6.452 663 HG23 THR 90 2HG2 THR 90 11.497 11.771 -5.930 664 H VAL 91 H VAL 91 15.343 12.695 -2.866 665 HA VAL 91 HA VAL 91 14.331 13.060 -0.120 666 HB VAL 91 HB VAL 91 17.129 12.325 -0.992 667 HG11 VAL 91 1HG1 VAL 91 16.182 12.513 1.846 668 HG12 VAL 91 2HG1 VAL 91 17.834 12.471 1.226 669 HG13 VAL 91 3HG1 VAL 91 16.845 13.915 1.008 670 HG21 VAL 91 3HG2 VAL 91 15.191 10.587 -0.917 671 HG22 VAL 91 1HG2 VAL 91 16.748 10.193 -0.188 672 HG23 VAL 91 2HG2 VAL 91 15.402 10.703 0.830 673 HA PRO 92 HA PRO 92 15.292 17.338 -0.613 674 HB2 PRO 92 1HB PRO 92 15.338 18.031 2.012 675 HB3 PRO 92 2HB PRO 92 13.841 17.700 1.132 676 HG2 PRO 92 1HG PRO 92 15.394 15.915 2.966 677 HG3 PRO 92 2HG PRO 92 13.641 16.163 2.865 678 HD2 PRO 92 1HD PRO 92 14.876 14.022 1.760 679 HD3 PRO 92 2HD PRO 92 13.420 14.752 1.055 680 H GLY 93 H GLY 93 17.170 18.344 -0.970 681 HA2 GLY 93 1HA GLY 93 19.255 19.229 -0.150 682 HA3 GLY 93 2HA GLY 93 19.437 17.778 0.824 683 H THR 94 H THR 94 19.024 15.770 -0.954 684 HA THR 94 HA THR 94 21.484 15.795 -2.426 685 HB THR 94 HB THR 94 20.315 13.784 -1.246 686 HG1 THR 94 1HG THR 94 21.620 12.506 -2.444 687 HG21 THR 94 3HG2 THR 94 18.207 14.007 -2.542 688 HG22 THR 94 1HG2 THR 94 18.944 12.412 -2.687 689 HG23 THR 94 2HG2 THR 94 19.098 13.577 -4.002 690 H GLU 95 H GLU 95 21.450 14.871 -4.737 691 HA GLU 95 HA GLU 95 19.382 16.290 -6.286 692 HB2 GLU 95 1HB GLU 95 21.161 16.492 -8.069 693 HB3 GLU 95 2HB GLU 95 21.423 17.456 -6.622 694 HG2 GLU 95 1HG GLU 95 22.675 14.756 -6.961 695 HG3 GLU 95 2HG GLU 95 23.418 16.216 -7.610 696 H GLY 96 H GLY 96 18.168 15.070 -7.573 697 HA2 GLY 96 1HA GLY 96 18.018 13.422 -9.342 698 HA3 GLY 96 2HA GLY 96 19.269 12.502 -8.520 699 H VAL 97 H VAL 97 17.769 10.702 -8.753 700 HA VAL 97 HA VAL 97 15.742 10.709 -6.613 701 HB VAL 97 HB VAL 97 15.576 9.274 -9.267 702 HG11 VAL 97 1HG1 VAL 97 14.454 8.567 -6.793 703 HG12 VAL 97 2HG1 VAL 97 13.146 9.273 -7.744 704 HG13 VAL 97 3HG1 VAL 97 14.064 7.909 -8.382 705 HG21 VAL 97 3HG2 VAL 97 14.225 10.907 -10.019 706 HG22 VAL 97 1HG2 VAL 97 13.447 11.122 -8.451 707 HG23 VAL 97 2HG2 VAL 97 15.004 11.885 -8.775 708 H THR 98 H THR 98 15.732 9.006 -5.232 709 HA THR 98 HA THR 98 17.925 7.080 -5.520 710 HB THR 98 HB THR 98 16.267 7.777 -3.088 711 HG1 THR 98 1HG THR 98 17.717 9.429 -3.613 712 HG21 THR 98 3HG2 THR 98 16.951 5.548 -2.776 713 HG22 THR 98 1HG2 THR 98 18.162 6.508 -1.927 714 HG23 THR 98 2HG2 THR 98 18.524 5.837 -3.517 715 H GLN 99 H GLN 99 17.590 4.845 -5.123 716 HA GLN 99 HA GLN 99 14.796 3.960 -5.410 717 HB2 GLN 99 1HB GLN 99 15.546 2.158 -6.872 718 HB3 GLN 99 2HB GLN 99 15.995 3.721 -7.541 719 HG2 GLN 99 1HG GLN 99 18.242 3.219 -6.238 720 HG3 GLN 99 2HG GLN 99 17.701 1.555 -6.456 721 HE21 GLN 99 1HE2 GLN 99 19.002 0.802 -7.997 722 HE22 GLN 99 2HE2 GLN 99 19.209 1.509 -9.560 723 H LEU 100 H LEU 100 14.262 1.946 -4.467 724 HA LEU 100 HA LEU 100 16.223 0.956 -2.504 725 HB2 LEU 100 1HB LEU 100 14.232 2.347 -1.641 726 HB3 LEU 100 2HB LEU 100 13.264 0.924 -2.020 727 HG LEU 100 HG LEU 100 15.057 -0.281 -0.506 728 HD11 LEU 100 1HD1 LEU 100 15.323 2.614 0.167 729 HD12 LEU 100 2HD1 LEU 100 16.564 1.367 0.055 730 HD13 LEU 100 3HD1 LEU 100 15.470 1.401 1.438 731 HD21 LEU 100 3HD2 LEU 100 12.551 0.037 -0.184 732 HD22 LEU 100 1HD2 LEU 100 12.971 1.422 0.826 733 HD23 LEU 100 2HD2 LEU 100 13.524 -0.193 1.271 734 H LYS 101 H LYS 101 16.780 -1.065 -2.927 735 HA LYS 101 HA LYS 101 14.946 -2.778 -4.437 736 HB2 LYS 101 1HB LYS 101 17.435 -2.376 -5.047 737 HB3 LYS 101 2HB LYS 101 17.778 -3.489 -3.729 738 HG2 LYS 101 1HG LYS 101 16.412 -5.200 -4.837 739 HG3 LYS 101 2HG LYS 101 16.120 -4.083 -6.172 740 HD2 LYS 101 1HD LYS 101 18.550 -3.985 -6.585 741 HD3 LYS 101 2HD LYS 101 18.799 -5.161 -5.292 742 HE2 LYS 101 1HE LYS 101 17.824 -6.884 -6.502 743 HE3 LYS 101 2HE LYS 101 16.943 -5.779 -7.556 744 HZ1 LYS 101 3HZ LYS 101 19.155 -7.042 -8.293 745 HZ2 LYS 101 1HZ LYS 101 19.843 -5.624 -7.677 746 HZ3 LYS 101 2HZ LYS 101 18.701 -5.539 -8.922 747 H LEU 102 H LEU 102 13.985 -4.523 -3.579 748 HA LEU 102 HA LEU 102 14.755 -5.300 -0.842 749 HB2 LEU 102 1HB LEU 102 12.013 -5.421 -2.088 750 HB3 LEU 102 2HB LEU 102 12.430 -5.893 -0.442 751 HG LEU 102 HG LEU 102 12.591 -3.087 -1.541 752 HD11 LEU 102 1HD1 LEU 102 10.720 -3.059 0.427 753 HD12 LEU 102 2HD1 LEU 102 10.420 -4.629 -0.318 754 HD13 LEU 102 3HD1 LEU 102 10.365 -3.164 -1.298 755 HD21 LEU 102 3HD2 LEU 102 13.743 -2.562 0.280 756 HD22 LEU 102 1HD2 LEU 102 13.830 -4.274 0.693 757 HD23 LEU 102 2HD2 LEU 102 12.506 -3.286 1.309 758 H THR 103 H THR 103 15.054 -7.427 -0.408 759 HA THR 103 HA THR 103 14.317 -9.409 -2.431 760 HB THR 103 HB THR 103 17.100 -9.285 -1.257 761 HG1 THR 103 1HG THR 103 17.409 -8.916 -3.732 762 HG21 THR 103 3HG2 THR 103 17.402 -10.895 -3.305 763 HG22 THR 103 1HG2 THR 103 15.670 -11.150 -3.101 764 HG23 THR 103 2HG2 THR 103 16.777 -11.509 -1.775 765 H VAL 104 H VAL 104 13.564 -11.251 -1.573 766 HA VAL 104 HA VAL 104 13.148 -11.467 1.223 767 HB VAL 104 HB VAL 104 12.832 -13.583 -0.912 768 HG11 VAL 104 1HG1 VAL 104 12.711 -13.799 1.895 769 HG12 VAL 104 2HG1 VAL 104 11.050 -13.865 1.305 770 HG13 VAL 104 3HG1 VAL 104 12.251 -15.002 0.692 771 HG21 VAL 104 3HG2 VAL 104 11.423 -11.781 -1.494 772 HG22 VAL 104 1HG2 VAL 104 10.389 -12.942 -0.661 773 HG23 VAL 104 2HG2 VAL 104 10.957 -11.502 0.184 774 H VAL 105 H VAL 105 14.322 -12.409 2.771 775 HA VAL 105 HA VAL 105 16.758 -13.846 1.964 776 HB VAL 105 HB VAL 105 17.178 -11.862 3.316 777 HG11 VAL 105 1HG1 VAL 105 14.857 -12.623 4.664 778 HG12 VAL 105 2HG1 VAL 105 16.159 -12.806 5.841 779 HG13 VAL 105 3HG1 VAL 105 15.907 -11.256 5.037 780 HG21 VAL 105 3HG2 VAL 105 18.459 -14.098 3.580 781 HG22 VAL 105 1HG2 VAL 105 18.721 -12.816 4.763 782 HG23 VAL 105 2HG2 VAL 105 17.667 -14.175 5.154 783 H GLU 106 H GLU 106 17.221 -15.861 2.744 784 HA GLU 106 HA GLU 106 15.025 -17.460 3.613 785 HB2 GLU 106 1HB GLU 106 16.631 -19.304 3.629 786 HB3 GLU 106 2HB GLU 106 16.771 -18.360 2.152 787 HG2 GLU 106 1HG GLU 106 18.688 -17.149 3.233 788 HG3 GLU 106 2HG GLU 106 18.612 -18.346 4.525 789 H ASP 107 H ASP 107 14.272 -17.450 5.619 790 HA ASP 107 HA ASP 107 16.201 -17.452 7.840 791 HB2 ASP 107 1HB ASP 107 14.700 -16.039 9.155 792 HB3 ASP 107 2HB ASP 107 15.176 -15.220 7.670 793 H VAL 108 H VAL 108 12.914 -18.223 6.774 794 HA VAL 108 HA VAL 108 12.957 -20.546 8.572 795 HB VAL 108 HB VAL 108 11.583 -18.796 9.634 796 HG11 VAL 108 1HG1 VAL 108 10.100 -18.918 7.026 797 HG12 VAL 108 2HG1 VAL 108 9.343 -18.324 8.505 798 HG13 VAL 108 3HG1 VAL 108 10.764 -17.508 7.851 799 HG21 VAL 108 3HG2 VAL 108 11.020 -21.419 9.414 800 HG22 VAL 108 1HG2 VAL 108 10.074 -20.296 10.391 801 HG23 VAL 108 2HG2 VAL 108 9.529 -20.730 8.771 802 H THR 109 H THR 109 11.800 -22.351 7.854 803 HA THR 109 HA THR 109 11.887 -23.053 5.244 804 HB THR 109 HB THR 109 9.689 -23.939 7.124 805 HG1 THR 109 1HG THR 109 11.350 -24.680 8.216 806 HG21 THR 109 3HG2 THR 109 10.971 -25.467 4.864 807 HG22 THR 109 1HG2 THR 109 9.479 -24.546 4.682 808 HG23 THR 109 2HG2 THR 109 9.542 -25.910 5.797 809 H VAL 110 H VAL 110 8.748 -22.251 6.734 810 HA VAL 110 HA VAL 110 7.730 -21.476 4.116 811 HB VAL 110 HB VAL 110 5.536 -21.329 5.235 812 HG11 VAL 110 1HG1 VAL 110 5.497 -23.810 5.984 813 HG12 VAL 110 2HG1 VAL 110 5.890 -23.424 4.308 814 HG13 VAL 110 3HG1 VAL 110 7.176 -23.823 5.447 815 HG21 VAL 110 3HG2 VAL 110 5.977 -22.615 7.673 816 HG22 VAL 110 1HG2 VAL 110 7.191 -21.338 7.596 817 HG23 VAL 110 2HG2 VAL 110 5.481 -20.941 7.426 818 H GLY 111 H GLY 111 8.576 -19.481 3.651 819 HA2 GLY 111 1HA GLY 111 7.594 -17.283 5.339 820 HA3 GLY 111 2HA GLY 111 9.298 -17.330 4.908 821 H ARG 112 H ARG 112 9.171 -18.147 2.274 822 HA ARG 112 HA ARG 112 8.988 -15.886 0.819 823 HB2 ARG 112 1HB ARG 112 8.490 -18.744 0.079 824 HB3 ARG 112 2HB ARG 112 8.240 -17.486 -1.124 825 HG2 ARG 112 1HG ARG 112 10.805 -17.594 0.398 826 HG3 ARG 112 2HG ARG 112 10.532 -18.690 -0.958 827 HD2 ARG 112 1HD ARG 112 9.806 -16.479 -2.177 828 HD3 ARG 112 2HD ARG 112 10.797 -15.721 -0.931 829 HE ARG 112 HE ARG 112 12.274 -17.798 -2.073 830 HH11 ARG 112 1HH1 ARG 112 10.943 -14.704 -2.957 831 HH12 ARG 112 2HH1 ARG 112 12.162 -14.373 -4.143 832 HH21 ARG 112 1HH2 ARG 112 13.884 -17.372 -3.632 833 HH22 ARG 112 2HH2 ARG 112 13.834 -15.891 -4.527 834 H ARG 113 H ARG 113 6.293 -18.051 1.571 835 HA ARG 113 HA ARG 113 4.302 -16.993 -0.000 836 HB2 ARG 113 1HB ARG 113 4.241 -18.155 2.773 837 HB3 ARG 113 2HB ARG 113 2.769 -17.609 1.981 838 HG2 ARG 113 1HG ARG 113 4.640 -19.625 0.769 839 HG3 ARG 113 2HG ARG 113 3.264 -20.058 1.785 840 HD2 ARG 113 1HD ARG 113 1.747 -18.973 0.226 841 HD3 ARG 113 2HD ARG 113 3.109 -18.460 -0.768 842 HE ARG 113 HE ARG 113 3.206 -21.243 -0.505 843 HH11 ARG 113 1HH1 ARG 113 1.220 -18.783 -1.963 844 HH12 ARG 113 2HH1 ARG 113 0.668 -19.806 -3.248 845 HH21 ARG 113 1HH2 ARG 113 2.486 -22.600 -2.191 846 HH22 ARG 113 2HH2 ARG 113 1.388 -21.977 -3.376 847 H GLN 114 H GLN 114 5.138 -15.951 3.306 848 HA GLN 114 HA GLN 114 3.335 -13.809 3.425 849 HB2 GLN 114 1HB GLN 114 4.489 -14.787 5.388 850 HB3 GLN 114 2HB GLN 114 5.995 -14.066 4.837 851 HG2 GLN 114 1HG GLN 114 5.283 -12.565 6.426 852 HG3 GLN 114 2HG GLN 114 4.688 -11.840 4.934 853 HE21 GLN 114 1HE2 GLN 114 3.009 -10.732 5.826 854 HE22 GLN 114 2HE2 GLN 114 1.629 -11.493 6.534 855 H ALA 115 H ALA 115 6.876 -13.548 3.068 856 HA ALA 115 HA ALA 115 7.103 -10.919 2.427 857 HB1 ALA 115 1HB ALA 115 8.919 -12.077 0.698 858 HB2 ALA 115 2HB ALA 115 9.200 -11.674 2.392 859 HB3 ALA 115 3HB ALA 115 8.689 -13.302 1.947 860 H VAL 116 H VAL 116 6.781 -13.499 -0.022 861 HA VAL 116 HA VAL 116 6.577 -11.971 -2.284 862 HB VAL 116 HB VAL 116 4.988 -14.469 -1.676 863 HG11 VAL 116 1HG1 VAL 116 4.364 -12.932 -3.690 864 HG12 VAL 116 2HG1 VAL 116 5.815 -13.625 -4.419 865 HG13 VAL 116 3HG1 VAL 116 4.490 -14.676 -3.917 866 HG21 VAL 116 3HG2 VAL 116 6.835 -15.682 -2.040 867 HG22 VAL 116 1HG2 VAL 116 7.334 -14.676 -3.400 868 HG23 VAL 116 2HG2 VAL 116 7.715 -14.182 -1.751 869 H ALA 117 H ALA 117 3.870 -12.980 -0.198 870 HA ALA 117 HA ALA 117 1.807 -11.737 -1.576 871 HB1 ALA 117 1HB ALA 117 0.506 -12.349 0.158 872 HB2 ALA 117 2HB ALA 117 1.943 -13.241 0.658 873 HB3 ALA 117 3HB ALA 117 1.597 -11.660 1.360 874 H TRP 118 H TRP 118 3.773 -10.439 1.094 875 HA TRP 118 HA TRP 118 2.570 -7.950 1.321 876 HB2 TRP 118 1HB TRP 118 4.279 -8.860 2.880 877 HB3 TRP 118 2HB TRP 118 5.514 -8.557 1.661 878 HD1 TRP 118 HD TRP 118 3.722 -6.917 4.485 879 HE1 TRP 118 1HE TRP 118 4.406 -4.441 4.649 880 HE3 TRP 118 3HE TRP 118 6.156 -6.451 0.014 881 HZ2 TRP 118 2HZ TRP 118 5.794 -2.542 3.088 882 HZ3 TRP 118 3HZ TRP 118 7.133 -4.271 -0.575 883 HH2 TRP 118 HH TRP 118 6.955 -2.358 0.931 884 H LEU 119 H LEU 119 5.124 -9.017 -0.878 885 HA LEU 119 HA LEU 119 5.740 -6.512 -1.985 886 HB2 LEU 119 1HB LEU 119 5.888 -9.251 -3.236 887 HB3 LEU 119 2HB LEU 119 6.644 -7.798 -3.886 888 HG LEU 119 HG LEU 119 7.324 -8.958 -1.189 889 HD11 LEU 119 1HD1 LEU 119 9.475 -9.546 -2.622 890 HD12 LEU 119 2HD1 LEU 119 8.276 -9.655 -3.910 891 HD13 LEU 119 3HD1 LEU 119 8.116 -10.661 -2.470 892 HD21 LEU 119 3HD2 LEU 119 8.984 -7.396 -1.065 893 HD22 LEU 119 1HD2 LEU 119 7.786 -6.481 -1.981 894 HD23 LEU 119 2HD2 LEU 119 9.135 -7.252 -2.817 895 H VAL 120 H VAL 120 3.833 -9.108 -3.525 896 HA VAL 120 HA VAL 120 2.792 -7.590 -5.599 897 HB VAL 120 HB VAL 120 2.615 -10.028 -5.534 898 HG11 VAL 120 1HG1 VAL 120 0.508 -9.600 -3.417 899 HG12 VAL 120 2HG1 VAL 120 0.962 -11.144 -4.142 900 HG13 VAL 120 3HG1 VAL 120 2.118 -10.264 -3.141 901 HG21 VAL 120 3HG2 VAL 120 1.107 -9.482 -7.104 902 HG22 VAL 120 1HG2 VAL 120 -0.087 -9.942 -5.891 903 HG23 VAL 120 2HG2 VAL 120 0.357 -8.248 -6.093 904 H ALA 121 H ALA 121 1.604 -8.013 -2.306 905 HA ALA 121 HA ALA 121 -0.886 -6.733 -2.649 906 HB1 ALA 121 1HB ALA 121 0.703 -6.789 -0.095 907 HB2 ALA 121 2HB ALA 121 -1.049 -6.710 -0.287 908 HB3 ALA 121 3HB ALA 121 -0.181 -8.185 -0.712 909 H MET 122 H MET 122 2.180 -5.492 -1.310 910 HA MET 122 HA MET 122 1.463 -2.902 -0.787 911 HB2 MET 122 1HB MET 122 3.663 -3.789 -0.239 912 HB3 MET 122 2HB MET 122 4.076 -3.889 -1.945 913 HG2 MET 122 1HG MET 122 5.145 -1.970 -1.054 914 HG3 MET 122 2HG MET 122 3.821 -1.416 -2.078 915 HE1 MET 122 3HE MET 122 4.436 1.178 0.374 916 HE2 MET 122 1HE MET 122 4.216 0.677 -1.303 917 HE3 MET 122 2HE MET 122 2.840 1.271 -0.373 918 H HIS 123 H HIS 123 2.505 -4.243 -3.902 919 HA HIS 123 HA HIS 123 2.391 -1.796 -5.321 920 HB2 HIS 123 1HB HIS 123 3.662 -3.728 -6.139 921 HB3 HIS 123 2HB HIS 123 2.165 -4.632 -6.351 922 HD2 HIS 123 2HD HIS 123 4.230 -3.784 -8.875 923 HE1 HIS 123 1HE HIS 123 0.909 -1.414 -10.039 924 HE2 HIS 123 2HE HIS 123 3.033 -2.535 -10.798 925 H LYS 124 H LYS 124 0.093 -4.486 -5.005 926 HA LYS 124 HA LYS 124 -1.893 -3.590 -6.710 927 HB2 LYS 124 1HB LYS 124 -1.919 -5.250 -4.217 928 HB3 LYS 124 2HB LYS 124 -3.443 -4.779 -4.958 929 HG2 LYS 124 1HG LYS 124 -1.321 -6.052 -6.624 930 HG3 LYS 124 2HG LYS 124 -2.337 -7.046 -5.577 931 HD2 LYS 124 1HD LYS 124 -4.281 -6.492 -6.736 932 HD3 LYS 124 2HD LYS 124 -3.556 -5.052 -7.455 933 HE2 LYS 124 1HE LYS 124 -2.652 -7.853 -8.087 934 HE3 LYS 124 2HE LYS 124 -3.891 -7.006 -9.012 935 HZ1 LYS 124 3HZ LYS 124 -1.013 -6.416 -8.800 936 HZ2 LYS 124 1HZ LYS 124 -2.101 -5.184 -9.203 937 HZ3 LYS 124 2HZ LYS 124 -1.975 -6.555 -10.184 938 H ALA 125 H ALA 125 -1.665 -2.999 -3.199 939 HA ALA 125 HA ALA 125 -3.860 -1.241 -3.067 940 HB1 ALA 125 1HB ALA 125 -1.526 -1.788 -1.277 941 HB2 ALA 125 2HB ALA 125 -2.642 -0.470 -0.916 942 HB3 ALA 125 3HB ALA 125 -3.238 -2.127 -1.019 943 H ALA 126 H ALA 126 -0.362 -0.550 -3.139 944 HA ALA 126 HA ALA 126 -0.235 2.124 -3.010 945 HB1 ALA 126 1HB ALA 126 1.194 0.468 -5.088 946 HB2 ALA 126 2HB ALA 126 1.670 2.075 -4.538 947 HB3 ALA 126 3HB ALA 126 1.713 0.713 -3.420 948 H LYS 127 H LYS 127 -1.543 0.296 -5.701 949 HA LYS 127 HA LYS 127 -1.699 2.348 -7.602 950 HB2 LYS 127 1HB LYS 127 -3.552 -0.010 -7.210 951 HB3 LYS 127 2HB LYS 127 -3.454 0.977 -8.662 952 HG2 LYS 127 1HG LYS 127 -0.967 -0.313 -7.678 953 HG3 LYS 127 2HG LYS 127 -2.186 -1.322 -8.459 954 HD2 LYS 127 1HD LYS 127 -0.969 -0.704 -10.292 955 HD3 LYS 127 2HD LYS 127 -2.132 0.623 -10.251 956 HE2 LYS 127 1HE LYS 127 -0.577 2.111 -9.345 957 HE3 LYS 127 2HE LYS 127 0.492 0.814 -8.812 958 HZ1 LYS 127 3HZ LYS 127 0.537 0.383 -11.412 959 HZ2 LYS 127 1HZ LYS 127 1.609 1.451 -10.653 960 HZ3 LYS 127 2HZ LYS 127 0.236 2.048 -11.439 961 H LEU 128 H LEU 128 -4.207 1.179 -5.351 962 HA LEU 128 HA LEU 128 -6.173 3.038 -5.978 963 HB2 LEU 128 1HB LEU 128 -5.539 1.577 -3.431 964 HB3 LEU 128 2HB LEU 128 -6.936 2.641 -3.579 965 HG LEU 128 HG LEU 128 -6.497 0.286 -5.400 966 HD11 LEU 128 1HD1 LEU 128 -7.980 0.384 -2.778 967 HD12 LEU 128 2HD1 LEU 128 -6.563 -0.594 -3.159 968 HD13 LEU 128 3HD1 LEU 128 -8.100 -0.921 -3.958 969 HD21 LEU 128 3HD2 LEU 128 -8.212 2.387 -5.605 970 HD22 LEU 128 1HD2 LEU 128 -9.191 1.219 -4.718 971 HD23 LEU 128 2HD2 LEU 128 -8.500 0.783 -6.281 972 H LEU 129 H LEU 129 -3.578 3.240 -3.567 973 HA LEU 129 HA LEU 129 -4.209 5.581 -2.294 974 HB2 LEU 129 1HB LEU 129 -1.649 4.257 -3.013 975 HB3 LEU 129 2HB LEU 129 -1.579 5.907 -2.399 976 HG LEU 129 HG LEU 129 -2.746 3.523 -0.963 977 HD11 LEU 129 1HD1 LEU 129 -0.094 4.794 -1.003 978 HD12 LEU 129 2HD1 LEU 129 -0.563 3.150 -0.574 979 HD13 LEU 129 3HD1 LEU 129 -0.753 4.455 0.597 980 HD21 LEU 129 3HD2 LEU 129 -3.988 5.184 -0.038 981 HD22 LEU 129 1HD2 LEU 129 -2.821 6.440 -0.450 982 HD23 LEU 129 2HD2 LEU 129 -2.526 5.383 0.930 983 H TYR 130 H TYR 130 -2.271 5.291 -5.272 984 HA TYR 130 HA TYR 130 -2.263 8.140 -5.678 985 HB2 TYR 130 1HB TYR 130 -1.501 6.124 -7.772 986 HB3 TYR 130 2HB TYR 130 -0.852 7.739 -7.506 987 HD1 TYR 130 2HD TYR 130 -0.482 7.402 -4.468 988 HD2 TYR 130 1HD TYR 130 0.590 4.970 -7.791 989 HE1 TYR 130 2HE TYR 130 1.371 6.445 -3.163 990 HE2 TYR 130 1HE TYR 130 2.445 4.006 -6.494 991 HH TYR 130 HH TYR 130 2.884 3.700 -3.859 992 H GLU 131 H GLU 131 -3.466 5.444 -7.687 993 HA GLU 131 HA GLU 131 -5.033 7.069 -9.366 994 HB2 GLU 131 1HB GLU 131 -5.472 4.145 -8.744 995 HB3 GLU 131 2HB GLU 131 -6.022 5.012 -10.171 996 HG2 GLU 131 1HG GLU 131 -3.557 5.462 -10.637 997 HG3 GLU 131 2HG GLU 131 -3.229 4.226 -9.425 998 H SER 132 H SER 132 -7.509 6.472 -9.580 999 HA SER 132 HA SER 132 -8.737 7.487 -7.184 1000 HB2 SER 132 1HB SER 132 -9.389 8.142 -9.546 1001 HB3 SER 132 2HB SER 132 -10.143 6.554 -9.691 1002 HG SER 132 HG SER 132 -11.536 8.343 -8.988 1003 H ARG 133 H ARG 133 -10.711 6.489 -6.272 1004 HA ARG 133 HA ARG 133 -10.368 3.574 -6.082 1005 HB2 ARG 133 1HB ARG 133 -11.480 5.603 -4.148 1006 HB3 ARG 133 2HB ARG 133 -11.701 3.871 -3.931 1007 HG2 ARG 133 1HG ARG 133 -9.854 4.275 -2.631 1008 HG3 ARG 133 2HG ARG 133 -9.112 3.786 -4.155 1009 HD2 ARG 133 1HD ARG 133 -7.925 5.698 -3.489 1010 HD3 ARG 133 2HD ARG 133 -9.043 6.264 -4.730 1011 HE ARG 133 HE ARG 133 -10.391 6.660 -2.402 1012 HH11 ARG 133 1HH1 ARG 133 -7.261 7.609 -3.595 1013 HH12 ARG 133 2HH1 ARG 133 -7.214 9.080 -2.681 1014 HH21 ARG 133 1HH2 ARG 133 -10.341 8.594 -1.194 1015 HH22 ARG 133 2HH2 ARG 133 -8.966 9.639 -1.315 1016 H ASP 134 H ASP 134 -11.902 2.282 -6.853 1017 HA ASP 134 HA ASP 134 -14.469 3.479 -7.631 1018 HB2 ASP 134 1HB ASP 134 -14.625 1.250 -8.968 1019 HB3 ASP 134 2HB ASP 134 -13.563 2.528 -9.552 1020 H GLN 135 H GLN 135 -16.264 2.956 -6.573 1021 HA GLN 135 HA GLN 135 -16.295 1.411 -4.260 1022 HB2 GLN 135 1HB GLN 135 -17.995 3.077 -4.675 1023 HB3 GLN 135 2HB GLN 135 -18.568 2.199 -6.087 1024 HG2 GLN 135 1HG GLN 135 -20.062 1.878 -4.213 1025 HG3 GLN 135 2HG GLN 135 -19.285 0.358 -4.655 1026 HE21 GLN 135 1HE2 GLN 135 -18.034 -0.678 -3.196 1027 HE22 GLN 135 2HE2 GLN 135 -17.769 -0.129 -1.580 1028 H SER 136 H SER 136 -16.069 -0.702 -4.017 1029 HA SER 136 HA SER 136 -16.688 -2.488 -6.243 1030 HB2 SER 136 1HB SER 136 -14.510 -2.497 -4.765 1031 HB3 SER 136 2HB SER 136 -15.509 -3.439 -3.658 1032 HG SER 136 HG SER 136 -15.982 -4.713 -5.689 1033 H GLY 137 H GLY 137 -17.961 -4.386 -5.969 1034 HA2 GLY 137 1HA GLY 137 -19.547 -4.669 -3.556 1035 HA3 GLY 137 2HA GLY 137 -20.446 -4.155 -4.976 1036 HA PRO 138 HA PRO 138 -18.747 -8.656 -5.720 1037 HB2 PRO 138 1HB PRO 138 -18.213 -10.035 -3.444 1038 HB3 PRO 138 2HB PRO 138 -16.989 -9.099 -4.310 1039 HG2 PRO 138 1HG PRO 138 -18.577 -8.355 -1.884 1040 HG3 PRO 138 2HG PRO 138 -16.853 -8.103 -2.213 1041 HD2 PRO 138 1HD PRO 138 -18.691 -6.135 -2.490 1042 HD3 PRO 138 2HD PRO 138 -17.244 -6.240 -3.513 1043 H SER 139 H SER 139 -19.695 -10.884 -5.067 1044 HA SER 139 HA SER 139 -22.310 -10.570 -3.769 1045 HB2 SER 139 1HB SER 139 -22.514 -10.411 -6.284 1046 HB3 SER 139 2HB SER 139 -21.939 -12.076 -6.365 1047 HG SER 139 HG SER 139 -23.742 -12.625 -5.000 1048 H SER 140 H SER 140 -22.182 -11.878 -2.066 1049 HA SER 140 HA SER 140 -20.615 -14.309 -2.148 1050 HB2 SER 140 1HB SER 140 -20.618 -12.883 -0.131 1051 HB3 SER 140 2HB SER 140 -22.344 -13.184 0.070 1052 HG SER 140 HG SER 140 -21.310 -14.642 1.357 1053 H GLY 141 H GLY 141 -21.484 -15.982 -3.207 1054 HA2 GLY 141 1HA GLY 141 -23.093 -17.840 -2.686 1055 HA3 GLY 141 2HA GLY 141 -24.331 -16.594 -2.705 Start of MODEL 13 1 H1 GLY 1 H GLY 1 -19.896 16.815 3.514 2 HA2 GLY 1 1HA GLY 1 -22.569 15.590 3.572 3 HA3 GLY 1 2HA GLY 1 -21.262 15.141 2.487 4 H SER 2 H SER 2 -21.051 13.012 2.932 5 HA SER 2 HA SER 2 -19.731 12.268 5.352 6 HB2 SER 2 1HB SER 2 -21.417 10.650 6.148 7 HB3 SER 2 2HB SER 2 -22.027 12.303 6.208 8 HG SER 2 HG SER 2 -22.944 11.776 4.051 9 H SER 3 H SER 3 -19.108 9.986 5.362 10 HA SER 3 HA SER 3 -19.073 8.863 2.637 11 HB2 SER 3 1HB SER 3 -16.947 8.926 4.771 12 HB3 SER 3 2HB SER 3 -16.893 7.758 3.451 13 HG SER 3 HG SER 3 -16.708 9.410 1.999 14 H GLY 4 H GLY 4 -19.151 6.583 2.417 15 HA2 GLY 4 1HA GLY 4 -20.399 5.252 4.738 16 HA3 GLY 4 2HA GLY 4 -20.752 4.867 3.060 17 H SER 5 H SER 5 -19.490 3.500 5.600 18 HA SER 5 HA SER 5 -16.917 2.712 5.210 19 HB2 SER 5 1HB SER 5 -17.550 0.535 6.253 20 HB3 SER 5 2HB SER 5 -18.201 1.930 7.113 21 HG SER 5 HG SER 5 -19.958 0.729 6.917 22 H SER 6 H SER 6 -16.051 0.637 4.351 23 HA SER 6 HA SER 6 -17.311 -0.011 1.766 24 HB2 SER 6 1HB SER 6 -14.429 0.354 2.533 25 HB3 SER 6 2HB SER 6 -14.861 -0.658 1.154 26 HG SER 6 HG SER 6 -15.758 1.092 0.153 27 H GLY 7 H GLY 7 -17.351 -2.153 1.089 28 HA2 GLY 7 1HA GLY 7 -16.726 -4.118 3.207 29 HA3 GLY 7 2HA GLY 7 -18.087 -4.268 2.105 30 H ALA 8 H ALA 8 -14.539 -4.081 2.137 31 HA ALA 8 HA ALA 8 -14.519 -5.831 -0.235 32 HB1 ALA 8 1HB ALA 8 -12.005 -4.491 0.400 33 HB2 ALA 8 2HB ALA 8 -12.871 -4.615 -1.132 34 HB3 ALA 8 3HB ALA 8 -13.328 -3.381 0.042 35 H GLU 9 H GLU 9 -14.566 -7.806 0.809 36 HA GLU 9 HA GLU 9 -12.817 -8.418 2.995 37 HB2 GLU 9 1HB GLU 9 -15.109 -9.480 2.392 38 HB3 GLU 9 2HB GLU 9 -14.175 -10.486 1.294 39 HG2 GLU 9 1HG GLU 9 -12.829 -11.288 3.163 40 HG3 GLU 9 2HG GLU 9 -13.756 -10.274 4.267 41 H PHE 10 H PHE 10 -12.826 -9.022 -0.479 42 HA PHE 10 HA PHE 10 -10.764 -10.842 -0.700 43 HB2 PHE 10 1HB PHE 10 -12.219 -9.944 -2.561 44 HB3 PHE 10 2HB PHE 10 -11.180 -8.523 -2.590 45 HD1 PHE 10 1HD PHE 10 -8.785 -8.766 -3.209 46 HD2 PHE 10 2HD PHE 10 -11.566 -11.966 -3.586 47 HE1 PHE 10 1HE PHE 10 -7.239 -9.925 -4.732 48 HE2 PHE 10 2HE PHE 10 -10.024 -13.131 -5.108 49 HZ PHE 10 HZ PHE 10 -7.857 -12.112 -5.682 50 H TYR 11 H TYR 11 -10.565 -7.315 -0.447 51 HA TYR 11 HA TYR 11 -7.698 -7.285 -0.613 52 HB2 TYR 11 1HB TYR 11 -9.848 -5.266 -0.220 53 HB3 TYR 11 2HB TYR 11 -8.237 -4.850 0.355 54 HD1 TYR 11 1HD TYR 11 -6.303 -5.033 -1.321 55 HD2 TYR 11 2HD TYR 11 -10.397 -5.021 -2.479 56 HE1 TYR 11 1HE TYR 11 -5.649 -4.391 -3.604 57 HE2 TYR 11 2HE TYR 11 -9.755 -4.380 -4.765 58 HH TYR 11 HH TYR 11 -6.459 -4.392 -5.820 59 H ASP 12 H ASP 12 -10.097 -6.996 1.972 60 HA ASP 12 HA ASP 12 -8.626 -6.284 4.131 61 HB2 ASP 12 1HB ASP 12 -10.893 -8.187 3.777 62 HB3 ASP 12 2HB ASP 12 -10.075 -8.165 5.337 63 H LYS 13 H LYS 13 -8.485 -9.341 2.437 64 HA LYS 13 HA LYS 13 -6.983 -10.758 4.381 65 HB2 LYS 13 1HB LYS 13 -7.527 -11.134 1.455 66 HB3 LYS 13 2HB LYS 13 -6.337 -12.145 2.265 67 HG2 LYS 13 1HG LYS 13 -7.997 -12.980 3.784 68 HG3 LYS 13 2HG LYS 13 -9.202 -11.860 3.144 69 HD2 LYS 13 1HD LYS 13 -7.832 -13.875 1.388 70 HD3 LYS 13 2HD LYS 13 -9.270 -14.289 2.325 71 HE2 LYS 13 1HE LYS 13 -9.308 -11.840 0.626 72 HE3 LYS 13 2HE LYS 13 -9.460 -13.416 -0.151 73 HZ1 LYS 13 3HZ LYS 13 -11.293 -13.846 1.516 74 HZ2 LYS 13 1HZ LYS 13 -11.634 -12.723 0.297 75 HZ3 LYS 13 2HZ LYS 13 -11.254 -12.190 1.857 76 H GLN 14 H GLN 14 -6.100 -8.761 1.609 77 HA GLN 14 HA GLN 14 -3.287 -9.290 1.888 78 HB2 GLN 14 1HB GLN 14 -4.915 -7.425 0.185 79 HB3 GLN 14 2HB GLN 14 -3.162 -7.300 0.242 80 HG2 GLN 14 1HG GLN 14 -2.978 -9.622 -0.507 81 HG3 GLN 14 2HG GLN 14 -4.736 -9.727 -0.587 82 HE21 GLN 14 1HE2 GLN 14 -5.217 -9.854 -2.668 83 HE22 GLN 14 2HE2 GLN 14 -4.655 -8.780 -3.899 84 H LEU 15 H LEU 15 -5.516 -6.720 2.802 85 HA LEU 15 HA LEU 15 -3.782 -4.721 3.549 86 HB2 LEU 15 1HB LEU 15 -6.260 -5.558 5.045 87 HB3 LEU 15 2HB LEU 15 -5.486 -3.976 5.109 88 HG LEU 15 HG LEU 15 -6.892 -5.189 2.731 89 HD11 LEU 15 1HD1 LEU 15 -7.773 -2.633 3.872 90 HD12 LEU 15 2HD1 LEU 15 -8.029 -4.039 4.904 91 HD13 LEU 15 3HD1 LEU 15 -8.715 -4.001 3.280 92 HD21 LEU 15 3HD2 LEU 15 -5.065 -3.875 1.927 93 HD22 LEU 15 1HD2 LEU 15 -5.430 -2.575 3.062 94 HD23 LEU 15 2HD2 LEU 15 -6.539 -2.925 1.736 95 H LYS 16 H LYS 16 -5.067 -7.235 5.732 96 HA LYS 16 HA LYS 16 -3.555 -6.638 7.965 97 HB2 LYS 16 1HB LYS 16 -4.119 -8.768 8.793 98 HB3 LYS 16 2HB LYS 16 -5.441 -8.345 7.712 99 HG2 LYS 16 1HG LYS 16 -4.678 -9.818 6.038 100 HG3 LYS 16 2HG LYS 16 -3.117 -10.033 6.835 101 HD2 LYS 16 1HD LYS 16 -4.396 -11.040 8.774 102 HD3 LYS 16 2HD LYS 16 -5.809 -11.055 7.716 103 HE2 LYS 16 1HE LYS 16 -4.973 -13.169 7.374 104 HE3 LYS 16 2HE LYS 16 -4.193 -12.279 6.067 105 HZ1 LYS 16 3HZ LYS 16 -3.025 -13.285 8.575 106 HZ2 LYS 16 1HZ LYS 16 -2.319 -11.963 7.790 107 HZ3 LYS 16 2HZ LYS 16 -2.455 -13.447 6.991 108 H VAL 17 H VAL 17 -2.681 -8.562 5.144 109 HA VAL 17 HA VAL 17 -0.214 -9.519 6.179 110 HB VAL 17 HB VAL 17 -1.226 -9.254 3.349 111 HG11 VAL 17 1HG1 VAL 17 0.828 -11.124 3.366 112 HG12 VAL 17 2HG1 VAL 17 0.878 -9.506 2.663 113 HG13 VAL 17 3HG1 VAL 17 1.454 -9.771 4.309 114 HG21 VAL 17 3HG2 VAL 17 -2.129 -11.283 3.614 115 HG22 VAL 17 1HG2 VAL 17 -0.699 -11.906 4.437 116 HG23 VAL 17 2HG2 VAL 17 -1.921 -11.015 5.345 117 H LEU 18 H LEU 18 -1.143 -6.691 4.291 118 HA LEU 18 HA LEU 18 1.510 -5.821 3.744 119 HB2 LEU 18 1HB LEU 18 -1.217 -4.685 3.498 120 HB3 LEU 18 2HB LEU 18 0.132 -3.551 3.522 121 HG LEU 18 HG LEU 18 -0.178 -5.823 1.560 122 HD11 LEU 18 1HD1 LEU 18 -0.521 -2.888 1.014 123 HD12 LEU 18 2HD1 LEU 18 -1.874 -3.952 1.398 124 HD13 LEU 18 3HD1 LEU 18 -0.898 -4.251 -0.040 125 HD21 LEU 18 3HD2 LEU 18 1.587 -3.566 0.954 126 HD22 LEU 18 1HD2 LEU 18 1.838 -5.298 0.736 127 HD23 LEU 18 2HD2 LEU 18 2.115 -4.559 2.313 128 H LEU 19 H LEU 19 -0.941 -4.284 5.833 129 HA LEU 19 HA LEU 19 0.696 -2.541 7.174 130 HB2 LEU 19 1HB LEU 19 -1.575 -4.060 8.442 131 HB3 LEU 19 2HB LEU 19 -0.947 -2.487 8.929 132 HG LEU 19 HG LEU 19 -2.250 -2.971 6.258 133 HD11 LEU 19 1HD1 LEU 19 -3.599 -3.320 8.550 134 HD12 LEU 19 2HD1 LEU 19 -4.316 -2.625 7.096 135 HD13 LEU 19 3HD1 LEU 19 -3.738 -1.569 8.384 136 HD21 LEU 19 3HD2 LEU 19 -2.235 -0.680 5.997 137 HD22 LEU 19 1HD2 LEU 19 -0.703 -0.952 6.827 138 HD23 LEU 19 2HD2 LEU 19 -2.105 -0.375 7.730 139 H SER 20 H SER 20 0.054 -5.934 7.960 140 HA SER 20 HA SER 20 1.273 -6.200 10.387 141 HB2 SER 20 1HB SER 20 0.968 -8.010 8.040 142 HB3 SER 20 2HB SER 20 2.078 -8.511 9.316 143 HG SER 20 HG SER 20 0.298 -9.214 10.205 144 H GLY 21 H GLY 21 2.905 -6.453 7.226 145 HA2 GLY 21 1HA GLY 21 5.031 -5.454 6.803 146 HA3 GLY 21 2HA GLY 21 5.372 -5.526 8.525 147 H ALA 22 H ALA 22 7.061 -6.435 6.380 148 HA ALA 22 HA ALA 22 7.396 -9.201 7.269 149 HB1 ALA 22 1HB ALA 22 6.546 -8.425 4.622 150 HB2 ALA 22 2HB ALA 22 8.075 -9.303 4.573 151 HB3 ALA 22 3HB ALA 22 6.665 -10.031 5.341 152 H THR 23 H THR 23 9.543 -10.047 6.095 153 HA THR 23 HA THR 23 11.572 -7.995 6.658 154 HB THR 23 HB THR 23 12.016 -10.979 6.542 155 HG1 THR 23 1HG THR 23 11.228 -11.088 8.499 156 HG21 THR 23 3HG2 THR 23 14.161 -10.474 6.860 157 HG22 THR 23 1HG2 THR 23 13.753 -9.547 8.302 158 HG23 THR 23 2HG2 THR 23 13.763 -8.762 6.723 159 H PHE 24 H PHE 24 13.048 -7.410 5.161 160 HA PHE 24 HA PHE 24 13.390 -8.992 2.744 161 HB2 PHE 24 1HB PHE 24 12.714 -6.068 2.479 162 HB3 PHE 24 2HB PHE 24 12.785 -7.291 1.214 163 HD1 PHE 24 1HD PHE 24 10.836 -6.052 4.081 164 HD2 PHE 24 2HD PHE 24 10.920 -8.672 0.728 165 HE1 PHE 24 1HE PHE 24 8.417 -6.433 4.322 166 HE2 PHE 24 2HE PHE 24 8.501 -9.056 0.963 167 HZ PHE 24 HZ PHE 24 7.246 -7.935 2.761 168 H LEU 25 H LEU 25 15.062 -7.850 1.273 169 HA LEU 25 HA LEU 25 17.235 -6.919 3.015 170 HB2 LEU 25 1HB LEU 25 17.116 -8.472 0.484 171 HB3 LEU 25 2HB LEU 25 18.528 -7.455 0.764 172 HG LEU 25 HG LEU 25 17.594 -9.626 2.639 173 HD11 LEU 25 1HD1 LEU 25 19.748 -10.721 1.743 174 HD12 LEU 25 2HD1 LEU 25 19.536 -9.646 0.361 175 HD13 LEU 25 3HD1 LEU 25 18.280 -10.815 0.768 176 HD21 LEU 25 3HD2 LEU 25 19.116 -8.858 4.059 177 HD22 LEU 25 1HD2 LEU 25 19.351 -7.466 3.002 178 HD23 LEU 25 2HD2 LEU 25 20.362 -8.899 2.811 179 H VAL 26 H VAL 26 17.528 -4.797 3.040 180 HA VAL 26 HA VAL 26 16.834 -3.219 0.666 181 HB VAL 26 HB VAL 26 17.446 -2.263 3.466 182 HG11 VAL 26 1HG1 VAL 26 16.523 -0.854 0.976 183 HG12 VAL 26 2HG1 VAL 26 16.317 -0.168 2.589 184 HG13 VAL 26 3HG1 VAL 26 17.935 -0.504 1.972 185 HG21 VAL 26 3HG2 VAL 26 15.367 -2.826 4.006 186 HG22 VAL 26 1HG2 VAL 26 14.762 -1.771 2.728 187 HG23 VAL 26 2HG2 VAL 26 15.098 -3.468 2.386 188 H THR 27 H THR 27 18.343 -2.289 -0.562 189 HA THR 27 HA THR 27 21.127 -2.332 0.403 190 HB THR 27 HB THR 27 20.474 -2.118 -2.508 191 HG1 THR 27 1HG THR 27 19.859 -4.150 -2.630 192 HG21 THR 27 3HG2 THR 27 22.774 -1.882 -1.976 193 HG22 THR 27 1HG2 THR 27 22.583 -3.518 -2.606 194 HG23 THR 27 2HG2 THR 27 22.732 -3.253 -0.869 195 H PHE 28 H PHE 28 22.127 -0.447 0.668 196 HA PHE 28 HA PHE 28 20.810 1.980 -0.299 197 HB2 PHE 28 1HB PHE 28 23.014 1.589 1.736 198 HB3 PHE 28 2HB PHE 28 22.339 3.150 1.281 199 HD1 PHE 28 2HD PHE 28 19.592 3.033 1.330 200 HD2 PHE 28 1HD PHE 28 22.291 0.805 3.753 201 HE1 PHE 28 2HE PHE 28 17.839 2.773 3.036 202 HE2 PHE 28 1HE PHE 28 20.542 0.541 5.464 203 HZ PHE 28 HZ PHE 28 18.313 1.527 5.107 204 H GLY 29 H GLY 29 21.773 3.439 -1.652 205 HA2 GLY 29 1HA GLY 29 23.486 2.648 -3.624 206 HA3 GLY 29 2HA GLY 29 23.318 4.323 -3.117 207 H ASN 30 H ASN 30 24.347 3.665 -0.403 208 HA ASN 30 HA ASN 30 27.137 4.029 -1.019 209 HB2 ASN 30 1HB ASN 30 25.477 4.108 1.473 210 HB3 ASN 30 2HB ASN 30 27.228 3.971 1.608 211 HD21 ASN 30 1HD2 ASN 30 26.170 6.118 2.702 212 HD22 ASN 30 2HD2 ASN 30 26.450 7.532 1.749 213 H SER 31 H SER 31 25.186 1.584 0.658 214 HA SER 31 HA SER 31 27.511 -0.163 0.880 215 HB2 SER 31 1HB SER 31 26.074 -1.591 2.246 216 HB3 SER 31 2HB SER 31 25.988 0.075 2.818 217 HG SER 31 HG SER 31 23.956 -1.312 2.369 218 H GLU 32 H GLU 32 27.880 -1.877 -0.389 219 HA GLU 32 HA GLU 32 26.061 -2.344 -2.613 220 HB2 GLU 32 1HB GLU 32 27.840 -3.364 -3.719 221 HB3 GLU 32 2HB GLU 32 28.628 -2.105 -2.780 222 HG2 GLU 32 1HG GLU 32 28.402 -4.957 -1.863 223 HG3 GLU 32 2HG GLU 32 29.772 -4.329 -2.776 224 H LYS 33 H LYS 33 26.699 -3.639 0.436 225 HA LYS 33 HA LYS 33 25.694 -6.295 -0.303 226 HB2 LYS 33 1HB LYS 33 27.543 -6.679 1.016 227 HB3 LYS 33 2HB LYS 33 27.291 -5.228 1.978 228 HG2 LYS 33 1HG LYS 33 25.865 -6.261 3.421 229 HG3 LYS 33 2HG LYS 33 25.289 -7.407 2.207 230 HD2 LYS 33 1HD LYS 33 28.047 -7.476 3.426 231 HD3 LYS 33 2HD LYS 33 26.681 -8.428 4.013 232 HE2 LYS 33 1HE LYS 33 26.543 -9.170 1.494 233 HE3 LYS 33 2HE LYS 33 28.237 -8.683 1.483 234 HZ1 LYS 33 3HZ LYS 33 28.669 -10.210 3.287 235 HZ2 LYS 33 1HZ LYS 33 27.959 -11.040 1.994 236 HZ3 LYS 33 2HZ LYS 33 27.037 -10.650 3.357 237 HA PRO 34 HA PRO 34 21.691 -5.129 1.198 238 HB2 PRO 34 1HB PRO 34 20.593 -7.612 1.156 239 HB3 PRO 34 2HB PRO 34 20.862 -6.655 -0.306 240 HG2 PRO 34 1HG PRO 34 22.515 -8.875 0.836 241 HG3 PRO 34 2HG PRO 34 22.058 -8.574 -0.850 242 HD2 PRO 34 1HD PRO 34 24.494 -7.925 0.138 243 HD3 PRO 34 2HD PRO 34 23.702 -6.985 -1.143 244 H GLU 35 H GLU 35 20.498 -5.247 3.098 245 HA GLU 35 HA GLU 35 21.608 -6.935 5.239 246 HB2 GLU 35 1HB GLU 35 22.384 -4.625 5.534 247 HB3 GLU 35 2HB GLU 35 20.721 -4.056 5.495 248 HG2 GLU 35 1HG GLU 35 20.266 -4.795 7.599 249 HG3 GLU 35 2HG GLU 35 21.438 -6.109 7.511 250 H THR 36 H THR 36 20.158 -7.826 6.660 251 HA THR 36 HA THR 36 17.479 -8.128 5.753 252 HB THR 36 HB THR 36 18.623 -8.929 8.435 253 HG1 THR 36 1HG THR 36 19.432 -10.657 7.455 254 HG21 THR 36 3HG2 THR 36 16.688 -9.983 8.857 255 HG22 THR 36 1HG2 THR 36 16.561 -10.594 7.208 256 HG23 THR 36 2HG2 THR 36 16.006 -8.964 7.589 257 H MET 37 H MET 37 16.132 -6.430 5.860 258 HA MET 37 HA MET 37 15.894 -5.041 8.448 259 HB2 MET 37 1HB MET 37 15.433 -3.918 5.679 260 HB3 MET 37 2HB MET 37 15.135 -3.055 7.182 261 HG2 MET 37 1HG MET 37 17.602 -3.479 7.698 262 HG3 MET 37 2HG MET 37 17.750 -3.896 5.993 263 HE1 MET 37 3HE MET 37 16.535 -1.263 8.520 264 HE2 MET 37 1HE MET 37 18.281 -1.036 8.417 265 HE3 MET 37 2HE MET 37 17.192 0.229 7.848 266 H THR 38 H THR 38 13.646 -3.864 8.517 267 HA THR 38 HA THR 38 11.602 -5.808 7.658 268 HB THR 38 HB THR 38 11.509 -4.115 10.162 269 HG1 THR 38 1HG THR 38 13.043 -6.091 9.883 270 HG21 THR 38 3HG2 THR 38 9.761 -6.386 9.205 271 HG22 THR 38 1HG2 THR 38 9.307 -4.683 9.269 272 HG23 THR 38 2HG2 THR 38 9.622 -5.568 10.761 273 H CYS 39 H CYS 39 10.002 -5.042 6.437 274 HA CYS 39 HA CYS 39 9.589 -2.125 6.355 275 HB2 CYS 39 1HB CYS 39 9.361 -4.125 4.096 276 HB3 CYS 39 2HB CYS 39 8.914 -2.427 3.979 277 HG CYS 39 HG CYS 39 12.055 -3.010 5.025 278 H ARG 40 H ARG 40 7.647 -1.475 6.983 279 HA ARG 40 HA ARG 40 5.347 -3.257 6.588 280 HB2 ARG 40 1HB ARG 40 4.493 -2.603 8.830 281 HB3 ARG 40 2HB ARG 40 5.973 -3.551 8.897 282 HG2 ARG 40 1HG ARG 40 6.230 -0.598 8.896 283 HG3 ARG 40 2HG ARG 40 5.623 -1.377 10.359 284 HD2 ARG 40 1HD ARG 40 7.612 -2.869 10.315 285 HD3 ARG 40 2HD ARG 40 8.229 -1.939 8.950 286 HE ARG 40 HE ARG 40 7.861 -0.021 10.766 287 HH11 ARG 40 1HH1 ARG 40 9.346 -3.159 11.027 288 HH12 ARG 40 2HH1 ARG 40 10.452 -2.676 12.270 289 HH21 ARG 40 1HH2 ARG 40 9.313 0.627 12.401 290 HH22 ARG 40 2HH2 ARG 40 10.432 -0.522 13.051 291 H LEU 41 H LEU 41 3.259 -2.120 6.731 292 HA LEU 41 HA LEU 41 3.510 0.597 5.649 293 HB2 LEU 41 1HB LEU 41 1.646 -1.652 5.220 294 HB3 LEU 41 2HB LEU 41 0.936 -0.039 5.195 295 HG LEU 41 HG LEU 41 3.277 -0.809 3.467 296 HD11 LEU 41 1HD1 LEU 41 1.552 -1.000 1.648 297 HD12 LEU 41 2HD1 LEU 41 0.329 -1.060 2.917 298 HD13 LEU 41 3HD1 LEU 41 1.564 -2.316 2.823 299 HD21 LEU 41 3HD2 LEU 41 1.352 1.490 3.578 300 HD22 LEU 41 1HD2 LEU 41 2.239 1.099 2.105 301 HD23 LEU 41 2HD2 LEU 41 3.116 1.519 3.576 302 H SER 42 H SER 42 2.985 2.257 6.893 303 HA SER 42 HA SER 42 2.054 2.035 9.513 304 HB2 SER 42 1HB SER 42 2.262 4.318 7.576 305 HB3 SER 42 2HB SER 42 1.472 4.558 9.135 306 HG SER 42 HG SER 42 3.473 3.606 10.033 307 H ASN 43 H ASN 43 0.030 3.458 10.191 308 HA ASN 43 HA ASN 43 -2.244 2.034 9.804 309 HB2 ASN 43 1HB ASN 43 -1.934 3.910 11.437 310 HB3 ASN 43 2HB ASN 43 -2.211 5.042 10.117 311 HD21 ASN 43 1HD2 ASN 43 -3.628 2.898 12.377 312 HD22 ASN 43 2HD2 ASN 43 -5.280 3.195 11.963 313 H ASN 44 H ASN 44 -3.819 1.828 8.311 314 HA ASN 44 HA ASN 44 -4.791 1.869 6.250 315 HB2 ASN 44 1HB ASN 44 -5.290 4.218 7.367 316 HB3 ASN 44 2HB ASN 44 -4.287 4.806 6.044 317 HD21 ASN 44 1HD2 ASN 44 -7.113 2.817 6.758 318 HD22 ASN 44 2HD2 ASN 44 -7.948 3.160 5.286 319 H GLN 45 H GLN 45 -1.819 1.646 6.427 320 HA GLN 45 HA GLN 45 0.044 1.727 5.097 321 HB2 GLN 45 1HB GLN 45 -0.395 0.980 2.762 322 HB3 GLN 45 2HB GLN 45 -1.181 -0.017 3.980 323 HG2 GLN 45 1HG GLN 45 -3.299 1.027 3.546 324 HG3 GLN 45 2HG GLN 45 -2.548 2.176 2.441 325 HE21 GLN 45 1HE2 GLN 45 -4.552 -0.221 2.348 326 HE22 GLN 45 2HE2 GLN 45 -4.074 -1.045 0.907 327 H ARG 46 H ARG 46 -0.735 4.282 5.692 328 HA ARG 46 HA ARG 46 -0.747 5.794 3.197 329 HB2 ARG 46 1HB ARG 46 -1.025 6.626 6.086 330 HB3 ARG 46 2HB ARG 46 -0.950 7.771 4.754 331 HG2 ARG 46 1HG ARG 46 -2.962 5.611 4.557 332 HG3 ARG 46 2HG ARG 46 -3.242 6.874 5.757 333 HD2 ARG 46 1HD ARG 46 -2.775 7.275 2.805 334 HD3 ARG 46 2HD ARG 46 -4.311 7.447 3.653 335 HE ARG 46 HE ARG 46 -2.671 9.189 4.934 336 HH11 ARG 46 1HH1 ARG 46 -3.545 8.692 1.601 337 HH12 ARG 46 2HH1 ARG 46 -3.355 10.359 1.167 338 HH21 ARG 46 1HH2 ARG 46 -2.417 11.386 4.374 339 HH22 ARG 46 2HH2 ARG 46 -2.712 11.890 2.745 340 H TYR 47 H TYR 47 1.514 4.430 5.172 341 HA TYR 47 HA TYR 47 3.635 6.011 4.030 342 HB2 TYR 47 1HB TYR 47 3.235 5.966 7.027 343 HB3 TYR 47 2HB TYR 47 4.673 6.570 6.213 344 HD1 TYR 47 2HD TYR 47 1.093 7.180 6.830 345 HD2 TYR 47 1HD TYR 47 4.693 8.728 5.174 346 HE1 TYR 47 2HE TYR 47 0.048 9.399 6.647 347 HE2 TYR 47 1HE TYR 47 3.659 10.952 4.988 348 HH TYR 47 HH TYR 47 0.254 11.464 5.749 349 H LEU 48 H LEU 48 5.782 5.113 4.540 350 HA LEU 48 HA LEU 48 5.618 2.257 5.246 351 HB2 LEU 48 1HB LEU 48 7.245 3.648 3.137 352 HB3 LEU 48 2HB LEU 48 7.633 2.028 3.712 353 HG LEU 48 HG LEU 48 4.986 2.762 2.473 354 HD11 LEU 48 1HD1 LEU 48 6.469 1.129 0.740 355 HD12 LEU 48 2HD1 LEU 48 7.542 2.443 1.220 356 HD13 LEU 48 3HD1 LEU 48 5.977 2.805 0.492 357 HD21 LEU 48 3HD2 LEU 48 5.095 0.760 3.955 358 HD22 LEU 48 1HD2 LEU 48 6.299 0.077 2.862 359 HD23 LEU 48 2HD2 LEU 48 4.664 0.398 2.283 360 H PHE 49 H PHE 49 6.985 1.513 6.759 361 HA PHE 49 HA PHE 49 9.086 3.346 7.716 362 HB2 PHE 49 1HB PHE 49 7.090 1.689 9.195 363 HB3 PHE 49 2HB PHE 49 8.676 1.931 9.919 364 HD1 PHE 49 1HD PHE 49 9.489 4.467 9.865 365 HD2 PHE 49 2HD PHE 49 5.436 3.174 9.742 366 HE1 PHE 49 1HE PHE 49 8.767 6.660 10.717 367 HE2 PHE 49 2HE PHE 49 4.707 5.365 10.592 368 HZ PHE 49 HZ PHE 49 6.374 7.111 11.081 369 H LEU 50 H LEU 50 11.024 2.407 8.500 370 HA LEU 50 HA LEU 50 11.463 -0.380 7.655 371 HB2 LEU 50 1HB LEU 50 13.530 1.795 7.472 372 HB3 LEU 50 2HB LEU 50 13.608 0.168 6.801 373 HG LEU 50 HG LEU 50 11.648 2.251 5.856 374 HD11 LEU 50 1HD1 LEU 50 14.503 1.906 5.267 375 HD12 LEU 50 2HD1 LEU 50 13.458 3.311 5.057 376 HD13 LEU 50 3HD1 LEU 50 13.454 2.022 3.853 377 HD21 LEU 50 3HD2 LEU 50 10.823 0.614 4.608 378 HD22 LEU 50 1HD2 LEU 50 11.916 -0.522 5.398 379 HD23 LEU 50 2HD2 LEU 50 12.418 0.302 3.921 380 H ASP 51 H ASP 51 13.238 -1.470 8.755 381 HA ASP 51 HA ASP 51 14.050 -0.287 11.304 382 HB2 ASP 51 1HB ASP 51 11.933 -1.743 11.530 383 HB3 ASP 51 2HB ASP 51 13.004 -3.108 11.229 384 H GLY 52 H GLY 52 16.077 -0.833 11.933 385 HA2 GLY 52 1HA GLY 52 17.536 -3.077 11.599 386 HA3 GLY 52 2HA GLY 52 17.689 -2.301 10.030 387 H ASP 53 H ASP 53 19.922 -2.020 10.298 388 HA ASP 53 HA ASP 53 21.410 -1.094 12.319 389 HB2 ASP 53 1HB ASP 53 21.512 -0.325 9.409 390 HB3 ASP 53 2HB ASP 53 22.708 0.268 10.558 391 H SER 54 H SER 54 19.070 0.786 10.530 392 HA SER 54 HA SER 54 19.157 2.844 12.570 393 HB2 SER 54 1HB SER 54 19.590 3.570 9.663 394 HB3 SER 54 2HB SER 54 19.479 4.692 11.019 395 HG SER 54 HG SER 54 21.507 4.348 11.406 396 H HIS 55 H HIS 55 17.245 3.971 12.769 397 HA HIS 55 HA HIS 55 14.944 2.754 11.556 398 HB2 HIS 55 1HB HIS 55 15.424 4.808 13.662 399 HB3 HIS 55 2HB HIS 55 13.848 4.791 12.876 400 HD2 HIS 55 2HD HIS 55 15.798 2.874 15.569 401 HE1 HIS 55 1HE HIS 55 12.174 0.772 14.895 402 HE2 HIS 55 2HE HIS 55 14.162 1.058 16.415 403 H TYR 56 H TYR 56 14.473 3.224 9.506 404 HA TYR 56 HA TYR 56 14.794 5.990 8.572 405 HB2 TYR 56 1HB TYR 56 14.868 3.330 7.234 406 HB3 TYR 56 2HB TYR 56 14.279 4.700 6.299 407 HD1 TYR 56 1HD TYR 56 15.795 6.765 6.150 408 HD2 TYR 56 2HD TYR 56 17.164 2.959 7.471 409 HE1 TYR 56 1HE TYR 56 18.111 7.437 5.669 410 HE2 TYR 56 2HE TYR 56 19.484 3.621 6.995 411 HH TYR 56 HH TYR 56 20.253 6.864 5.766 412 H GLU 57 H GLU 57 13.122 6.666 6.899 413 HA GLU 57 HA GLU 57 10.468 5.561 7.343 414 HB2 GLU 57 1HB GLU 57 10.171 7.083 9.019 415 HB3 GLU 57 2HB GLU 57 11.387 8.182 8.383 416 HG2 GLU 57 1HG GLU 57 9.831 8.923 6.661 417 HG3 GLU 57 2HG GLU 57 8.612 7.809 7.278 418 H ILE 58 H ILE 58 9.653 5.304 5.381 419 HA ILE 58 HA ILE 58 10.315 7.289 3.306 420 HB ILE 58 HB ILE 58 9.533 4.394 2.940 421 HG12 ILE 58 1HG1 ILE 58 12.179 5.631 2.222 422 HG13 ILE 58 2HG1 ILE 58 11.882 5.011 3.843 423 HG21 ILE 58 1HG2 ILE 58 9.078 4.879 0.825 424 HG22 ILE 58 2HG2 ILE 58 9.346 6.587 1.169 425 HG23 ILE 58 3HG2 ILE 58 10.684 5.578 0.620 426 HD11 ILE 58 3HD1 ILE 58 11.528 3.361 1.359 427 HD12 ILE 58 1HD1 ILE 58 13.036 3.442 2.271 428 HD13 ILE 58 2HD1 ILE 58 11.576 2.809 3.033 429 H GLU 59 H GLU 59 8.646 8.704 3.401 430 HA GLU 59 HA GLU 59 5.927 7.841 3.761 431 HB2 GLU 59 1HB GLU 59 5.552 10.357 3.089 432 HB3 GLU 59 2HB GLU 59 6.204 9.936 4.666 433 HG2 GLU 59 1HG GLU 59 8.075 10.456 2.408 434 HG3 GLU 59 2HG GLU 59 7.302 11.812 3.227 435 H ILE 60 H ILE 60 4.612 7.138 2.224 436 HA ILE 60 HA ILE 60 5.268 6.751 -0.419 437 HB ILE 60 HB ILE 60 2.529 7.135 0.787 438 HG12 ILE 60 1HG1 ILE 60 4.009 4.617 -0.000 439 HG13 ILE 60 2HG1 ILE 60 3.906 5.239 1.643 440 HG21 ILE 60 1HG2 ILE 60 3.391 6.559 -1.989 441 HG22 ILE 60 2HG2 ILE 60 2.014 5.654 -1.361 442 HG23 ILE 60 3HG2 ILE 60 1.968 7.416 -1.397 443 HD11 ILE 60 3HD1 ILE 60 1.312 5.130 1.107 444 HD12 ILE 60 1HD1 ILE 60 1.865 3.878 -0.006 445 HD13 ILE 60 2HD1 ILE 60 2.213 3.743 1.718 446 H VAL 61 H VAL 61 3.888 9.593 1.096 447 HA VAL 61 HA VAL 61 2.939 10.989 -1.091 448 HB VAL 61 HB VAL 61 3.288 13.026 0.159 449 HG11 VAL 61 1HG1 VAL 61 2.564 11.936 2.540 450 HG12 VAL 61 2HG1 VAL 61 1.469 12.190 1.180 451 HG13 VAL 61 3HG1 VAL 61 2.214 10.611 1.432 452 HG21 VAL 61 3HG2 VAL 61 4.500 12.436 2.522 453 HG22 VAL 61 1HG2 VAL 61 5.437 11.459 1.392 454 HG23 VAL 61 2HG2 VAL 61 5.298 13.200 1.148 455 H HIS 62 H HIS 62 6.224 10.361 -0.137 456 HA HIS 62 HA HIS 62 7.303 12.294 -2.025 457 HB2 HIS 62 1HB HIS 62 8.420 10.575 0.134 458 HB3 HIS 62 2HB HIS 62 9.497 11.026 -1.185 459 HD2 HIS 62 2HD HIS 62 9.174 12.251 2.127 460 HE1 HIS 62 1HE HIS 62 9.142 15.857 -0.107 461 HE2 HIS 62 2HE HIS 62 9.518 14.815 2.154 462 H ILE 63 H ILE 63 7.352 8.772 -1.528 463 HA ILE 63 HA ILE 63 8.862 7.848 -3.545 464 HB ILE 63 HB ILE 63 6.092 6.788 -2.972 465 HG12 ILE 63 1HG1 ILE 63 8.752 6.209 -1.652 466 HG13 ILE 63 2HG1 ILE 63 7.355 6.979 -0.908 467 HG21 ILE 63 1HG2 ILE 63 8.148 4.855 -3.616 468 HG22 ILE 63 2HG2 ILE 63 6.548 5.076 -4.320 469 HG23 ILE 63 3HG2 ILE 63 7.911 6.021 -4.917 470 HD11 ILE 63 3HD1 ILE 63 7.850 4.124 -1.521 471 HD12 ILE 63 1HD1 ILE 63 7.115 4.871 -0.103 472 HD13 ILE 63 2HD1 ILE 63 6.190 4.715 -1.597 473 H SER 64 H SER 64 8.969 8.001 -5.689 474 HA SER 64 HA SER 64 6.744 9.291 -7.099 475 HB2 SER 64 1HB SER 64 8.923 10.383 -7.325 476 HB3 SER 64 2HB SER 64 9.627 8.886 -7.937 477 HG SER 64 HG SER 64 8.542 10.760 -9.357 478 H THR 65 H THR 65 9.167 6.768 -7.811 479 HA THR 65 HA THR 65 7.174 5.438 -9.511 480 HB THR 65 HB THR 65 10.157 4.951 -9.404 481 HG1 THR 65 1HG THR 65 10.339 6.391 -11.002 482 HG21 THR 65 3HG2 THR 65 9.731 3.845 -11.600 483 HG22 THR 65 1HG2 THR 65 8.002 4.018 -11.301 484 HG23 THR 65 2HG2 THR 65 8.987 3.019 -10.231 485 H VAL 66 H VAL 66 6.783 3.212 -9.326 486 HA VAL 66 HA VAL 66 7.958 1.768 -7.088 487 HB VAL 66 HB VAL 66 4.987 2.269 -7.296 488 HG11 VAL 66 1HG1 VAL 66 5.236 0.913 -5.007 489 HG12 VAL 66 2HG1 VAL 66 4.916 0.126 -6.554 490 HG13 VAL 66 3HG1 VAL 66 6.559 0.177 -5.912 491 HG21 VAL 66 3HG2 VAL 66 6.447 4.039 -6.240 492 HG22 VAL 66 1HG2 VAL 66 5.166 3.390 -5.216 493 HG23 VAL 66 2HG2 VAL 66 6.832 2.857 -4.990 494 H GLN 67 H GLN 67 8.718 0.071 -8.200 495 HA GLN 67 HA GLN 67 6.785 -1.518 -9.733 496 HB2 GLN 67 1HB GLN 67 8.399 -1.943 -11.483 497 HB3 GLN 67 2HB GLN 67 8.176 -0.207 -11.310 498 HG2 GLN 67 1HG GLN 67 10.251 -0.329 -9.780 499 HG3 GLN 67 2HG GLN 67 10.521 -1.892 -10.549 500 HE21 GLN 67 1HE2 GLN 67 12.262 -1.467 -11.768 501 HE22 GLN 67 2HE2 GLN 67 12.324 -0.271 -13.013 502 H ILE 68 H ILE 68 7.417 -3.777 -9.990 503 HA ILE 68 HA ILE 68 9.034 -4.687 -7.705 504 HB ILE 68 HB ILE 68 6.708 -5.950 -9.133 505 HG12 ILE 68 1HG1 ILE 68 7.256 -5.401 -6.208 506 HG13 ILE 68 2HG1 ILE 68 6.262 -4.396 -7.257 507 HG21 ILE 68 1HG2 ILE 68 7.815 -7.899 -8.938 508 HG22 ILE 68 2HG2 ILE 68 8.947 -7.256 -7.749 509 HG23 ILE 68 3HG2 ILE 68 7.341 -7.779 -7.243 510 HD11 ILE 68 3HD1 ILE 68 5.584 -6.798 -5.814 511 HD12 ILE 68 1HD1 ILE 68 4.536 -5.603 -6.579 512 HD13 ILE 68 2HD1 ILE 68 5.194 -6.936 -7.529 513 H LEU 69 H LEU 69 10.756 -5.986 -8.008 514 HA LEU 69 HA LEU 69 11.666 -6.401 -10.728 515 HB2 LEU 69 1HB LEU 69 13.055 -7.259 -8.204 516 HB3 LEU 69 2HB LEU 69 13.766 -6.968 -9.790 517 HG LEU 69 HG LEU 69 12.474 -4.711 -8.318 518 HD11 LEU 69 1HD1 LEU 69 14.753 -4.225 -7.362 519 HD12 LEU 69 2HD1 LEU 69 15.185 -5.888 -7.758 520 HD13 LEU 69 3HD1 LEU 69 13.880 -5.564 -6.617 521 HD21 LEU 69 3HD2 LEU 69 13.439 -3.460 -9.893 522 HD22 LEU 69 1HD2 LEU 69 13.730 -4.969 -10.758 523 HD23 LEU 69 2HD2 LEU 69 14.986 -4.290 -9.722 524 H THR 70 H THR 70 11.551 -8.248 -11.827 525 HA THR 70 HA THR 70 11.102 -10.754 -10.358 526 HB THR 70 HB THR 70 9.488 -11.476 -12.103 527 HG1 THR 70 1HG THR 70 10.337 -9.584 -13.515 528 HG21 THR 70 3HG2 THR 70 7.596 -10.266 -11.239 529 HG22 THR 70 1HG2 THR 70 8.627 -8.930 -10.728 530 HG23 THR 70 2HG2 THR 70 8.754 -10.497 -9.929 531 H GLU 71 H GLU 71 12.671 -12.127 -10.850 532 HA GLU 71 HA GLU 71 13.629 -12.247 -13.625 533 HB2 GLU 71 1HB GLU 71 15.247 -10.978 -12.234 534 HB3 GLU 71 2HB GLU 71 15.406 -12.379 -11.184 535 HG2 GLU 71 1HG GLU 71 17.228 -12.641 -12.531 536 HG3 GLU 71 2HG GLU 71 16.036 -13.604 -13.401 537 H GLY 72 H GLY 72 12.787 -14.161 -14.235 538 HA2 GLY 72 1HA GLY 72 13.795 -16.546 -12.913 539 HA3 GLY 72 2HA GLY 72 12.048 -16.354 -12.897 540 H PHE 73 H PHE 73 14.869 -16.763 -14.956 541 HA PHE 73 HA PHE 73 13.760 -16.795 -17.460 542 HB2 PHE 73 1HB PHE 73 16.062 -18.151 -16.190 543 HB3 PHE 73 2HB PHE 73 15.502 -18.849 -17.706 544 HD1 PHE 73 2HD PHE 73 16.283 -15.502 -16.254 545 HD2 PHE 73 1HD PHE 73 16.440 -18.069 -19.645 546 HE1 PHE 73 2HE PHE 73 17.519 -13.777 -17.499 547 HE2 PHE 73 1HE PHE 73 17.677 -16.349 -20.895 548 HZ PHE 73 HZ PHE 73 18.217 -14.198 -19.823 549 HA PRO 74 HA PRO 74 12.564 -21.448 -17.032 550 HB2 PRO 74 1HB PRO 74 12.800 -22.588 -14.580 551 HB3 PRO 74 2HB PRO 74 14.115 -22.570 -15.761 552 HG2 PRO 74 1HG PRO 74 13.664 -20.785 -13.401 553 HG3 PRO 74 2HG PRO 74 15.169 -21.534 -13.966 554 HD2 PRO 74 1HD PRO 74 14.553 -18.946 -14.468 555 HD3 PRO 74 2HD PRO 74 15.500 -19.938 -15.595 556 HA PRO 75 HA PRO 75 8.514 -20.511 -15.554 557 HB2 PRO 75 1HB PRO 75 7.343 -22.931 -15.931 558 HB3 PRO 75 2HB PRO 75 7.744 -21.840 -17.263 559 HG2 PRO 75 1HG PRO 75 9.241 -24.229 -16.255 560 HG3 PRO 75 2HG PRO 75 8.913 -23.737 -17.927 561 HD2 PRO 75 1HD PRO 75 11.294 -23.289 -16.717 562 HD3 PRO 75 2HD PRO 75 10.623 -22.192 -17.941 563 H GLY 76 H GLY 76 7.037 -20.972 -13.843 564 HA2 GLY 76 1HA GLY 76 8.053 -22.823 -11.785 565 HA3 GLY 76 2HA GLY 76 7.635 -21.169 -11.364 566 H GLY 77 H GLY 77 5.528 -20.625 -11.011 567 HA2 GLY 77 1HA GLY 77 3.161 -21.277 -11.710 568 HA3 GLY 77 2HA GLY 77 3.614 -22.868 -11.116 569 H GLY 78 H GLY 78 4.832 -22.470 -8.788 570 HA2 GLY 78 1HA GLY 78 2.755 -21.966 -6.991 571 HA3 GLY 78 2HA GLY 78 4.458 -22.044 -6.565 572 H ASN 79 H ASN 79 5.465 -20.226 -5.949 573 HA ASN 79 HA ASN 79 4.141 -17.958 -5.182 574 HB2 ASN 79 1HB ASN 79 7.018 -18.111 -6.111 575 HB3 ASN 79 2HB ASN 79 6.330 -16.842 -5.103 576 HD21 ASN 79 1HD2 ASN 79 8.476 -18.902 -4.693 577 HD22 ASN 79 2HD2 ASN 79 8.058 -19.667 -3.202 578 H ALA 80 H ALA 80 4.467 -15.694 -6.023 579 HA ALA 80 HA ALA 80 3.574 -15.604 -8.769 580 HB1 ALA 80 1HB ALA 80 4.092 -13.052 -7.423 581 HB2 ALA 80 2HB ALA 80 2.638 -13.637 -8.233 582 HB3 ALA 80 3HB ALA 80 2.974 -14.118 -6.570 583 H ARG 81 H ARG 81 6.243 -16.504 -8.498 584 HA ARG 81 HA ARG 81 8.407 -16.082 -9.135 585 HB2 ARG 81 1HB ARG 81 6.766 -14.679 -11.243 586 HB3 ARG 81 2HB ARG 81 8.504 -14.910 -11.380 587 HG2 ARG 81 1HG ARG 81 8.297 -17.236 -11.542 588 HG3 ARG 81 2HG ARG 81 6.637 -17.214 -10.945 589 HD2 ARG 81 1HD ARG 81 6.289 -17.503 -13.198 590 HD3 ARG 81 2HD ARG 81 6.209 -15.747 -13.066 591 HE ARG 81 HE ARG 81 8.251 -17.306 -14.385 592 HH11 ARG 81 1HH1 ARG 81 7.393 -14.231 -12.995 593 HH12 ARG 81 2HH1 ARG 81 8.579 -13.346 -13.896 594 HH21 ARG 81 1HH2 ARG 81 9.817 -16.152 -15.576 595 HH22 ARG 81 2HH2 ARG 81 9.957 -14.439 -15.364 596 H ALA 82 H ALA 82 7.468 -14.255 -7.143 597 HA ALA 82 HA ALA 82 8.664 -11.698 -7.932 598 HB1 ALA 82 1HB ALA 82 7.643 -10.764 -5.964 599 HB2 ALA 82 2HB ALA 82 6.433 -11.688 -6.855 600 HB3 ALA 82 3HB ALA 82 7.168 -12.367 -5.402 601 H THR 83 H THR 83 10.828 -11.810 -7.748 602 HA THR 83 HA THR 83 12.071 -13.230 -5.547 603 HB THR 83 HB THR 83 14.152 -12.852 -6.615 604 HG1 THR 83 1HG THR 83 12.804 -10.684 -7.758 605 HG21 THR 83 3HG2 THR 83 11.920 -13.850 -8.096 606 HG22 THR 83 1HG2 THR 83 13.608 -14.354 -8.168 607 HG23 THR 83 2HG2 THR 83 13.033 -13.048 -9.205 608 H GLY 84 H GLY 84 11.234 -9.975 -6.400 609 HA2 GLY 84 1HA GLY 84 11.801 -9.020 -3.780 610 HA3 GLY 84 2HA GLY 84 13.028 -8.477 -4.916 611 H MET 85 H MET 85 12.290 -6.317 -4.386 612 HA MET 85 HA MET 85 10.199 -5.467 -6.211 613 HB2 MET 85 1HB MET 85 8.821 -5.738 -4.316 614 HB3 MET 85 2HB MET 85 10.045 -5.096 -3.229 615 HG2 MET 85 1HG MET 85 9.728 -2.878 -4.103 616 HG3 MET 85 2HG MET 85 8.608 -3.483 -5.321 617 HE1 MET 85 3HE MET 85 5.308 -3.222 -3.773 618 HE2 MET 85 1HE MET 85 6.371 -2.989 -5.161 619 HE3 MET 85 2HE MET 85 6.085 -4.612 -4.534 620 H PHE 86 H PHE 86 10.204 -3.151 -6.579 621 HA PHE 86 HA PHE 86 12.697 -1.835 -5.735 622 HB2 PHE 86 1HB PHE 86 12.746 -2.715 -8.118 623 HB3 PHE 86 2HB PHE 86 11.491 -1.536 -8.486 624 HD1 PHE 86 2HD PHE 86 14.769 -1.564 -6.693 625 HD2 PHE 86 1HD PHE 86 12.228 0.370 -9.507 626 HE1 PHE 86 2HE PHE 86 16.496 0.146 -7.071 627 HE2 PHE 86 1HE PHE 86 13.952 2.083 -9.890 628 HZ PHE 86 HZ PHE 86 16.088 1.974 -8.671 629 H LEU 87 H LEU 87 12.583 0.344 -5.312 630 HA LEU 87 HA LEU 87 10.109 1.781 -5.836 631 HB2 LEU 87 1HB LEU 87 11.194 1.676 -3.037 632 HB3 LEU 87 2HB LEU 87 9.668 2.363 -3.588 633 HG LEU 87 HG LEU 87 10.147 -0.571 -3.882 634 HD11 LEU 87 1HD1 LEU 87 9.283 0.802 -1.341 635 HD12 LEU 87 2HD1 LEU 87 10.772 -0.111 -1.582 636 HD13 LEU 87 3HD1 LEU 87 9.214 -0.934 -1.645 637 HD21 LEU 87 3HD2 LEU 87 7.601 0.748 -3.064 638 HD22 LEU 87 1HD2 LEU 87 7.859 -0.714 -4.016 639 HD23 LEU 87 2HD2 LEU 87 8.136 0.870 -4.741 640 H GLN 88 H GLN 88 10.364 3.986 -5.951 641 HA GLN 88 HA GLN 88 13.079 5.017 -5.460 642 HB2 GLN 88 1HB GLN 88 11.238 5.589 -7.783 643 HB3 GLN 88 2HB GLN 88 12.664 6.552 -7.419 644 HG2 GLN 88 1HG GLN 88 13.912 4.285 -7.522 645 HG3 GLN 88 2HG GLN 88 12.484 3.740 -8.399 646 HE21 GLN 88 1HE2 GLN 88 15.279 5.783 -8.454 647 HE22 GLN 88 2HE2 GLN 88 15.204 6.194 -10.130 648 H TYR 89 H TYR 89 13.220 6.821 -4.274 649 HA TYR 89 HA TYR 89 10.917 8.592 -4.026 650 HB2 TYR 89 1HB TYR 89 11.085 8.575 -1.543 651 HB3 TYR 89 2HB TYR 89 10.552 7.037 -2.211 652 HD1 TYR 89 1HD TYR 89 13.474 8.813 -0.785 653 HD2 TYR 89 2HD TYR 89 11.770 5.052 -1.813 654 HE1 TYR 89 1HE TYR 89 15.282 7.668 0.428 655 HE2 TYR 89 2HE TYR 89 13.573 3.897 -0.602 656 HH TYR 89 HH TYR 89 16.386 5.250 0.233 657 H THR 90 H THR 90 11.530 10.519 -2.578 658 HA THR 90 HA THR 90 14.335 11.253 -3.119 659 HB THR 90 HB THR 90 13.585 13.592 -3.347 660 HG1 THR 90 1HG THR 90 11.147 13.679 -3.740 661 HG21 THR 90 3HG2 THR 90 13.835 12.470 -5.405 662 HG22 THR 90 1HG2 THR 90 12.258 13.252 -5.502 663 HG23 THR 90 2HG2 THR 90 12.366 11.525 -5.162 664 H VAL 91 H VAL 91 15.448 12.420 -1.564 665 HA VAL 91 HA VAL 91 14.221 12.389 1.107 666 HB VAL 91 HB VAL 91 17.146 12.531 0.362 667 HG11 VAL 91 1HG1 VAL 91 16.160 13.522 2.609 668 HG12 VAL 91 2HG1 VAL 91 16.197 11.823 3.087 669 HG13 VAL 91 3HG1 VAL 91 17.681 12.630 2.578 670 HG21 VAL 91 3HG2 VAL 91 15.354 10.323 0.471 671 HG22 VAL 91 1HG2 VAL 91 17.089 10.322 0.155 672 HG23 VAL 91 2HG2 VAL 91 16.494 10.184 1.809 673 HA PRO 92 HA PRO 92 14.074 16.808 1.042 674 HB2 PRO 92 1HB PRO 92 13.647 17.185 3.696 675 HB3 PRO 92 2HB PRO 92 12.391 16.612 2.593 676 HG2 PRO 92 1HG PRO 92 14.122 15.048 4.468 677 HG3 PRO 92 2HG PRO 92 12.386 14.882 4.146 678 HD2 PRO 92 1HD PRO 92 14.236 13.238 3.048 679 HD3 PRO 92 2HD PRO 92 12.733 13.677 2.212 680 H GLY 93 H GLY 93 16.225 17.314 0.506 681 HA2 GLY 93 1HA GLY 93 17.834 18.899 1.614 682 HA3 GLY 93 2HA GLY 93 18.043 17.632 2.814 683 H THR 94 H THR 94 17.610 16.347 -0.265 684 HA THR 94 HA THR 94 20.523 16.145 -0.670 685 HB THR 94 HB THR 94 19.246 14.034 0.173 686 HG1 THR 94 1HG THR 94 20.668 12.758 -1.163 687 HG21 THR 94 3HG2 THR 94 18.702 13.733 -2.770 688 HG22 THR 94 1HG2 THR 94 17.482 14.337 -1.649 689 HG23 THR 94 2HG2 THR 94 18.145 12.716 -1.441 690 H GLU 95 H GLU 95 21.140 15.585 -2.917 691 HA GLU 95 HA GLU 95 19.359 16.952 -4.815 692 HB2 GLU 95 1HB GLU 95 22.328 16.437 -5.057 693 HB3 GLU 95 2HB GLU 95 21.343 17.396 -6.153 694 HG2 GLU 95 1HG GLU 95 20.887 18.978 -4.328 695 HG3 GLU 95 2HG GLU 95 21.934 18.032 -3.271 696 H GLY 96 H GLY 96 18.178 15.575 -5.973 697 HA2 GLY 96 1HA GLY 96 18.272 14.069 -7.903 698 HA3 GLY 96 2HA GLY 96 19.529 13.180 -7.055 699 H VAL 97 H VAL 97 17.961 11.411 -7.686 700 HA VAL 97 HA VAL 97 15.857 11.143 -5.638 701 HB VAL 97 HB VAL 97 16.025 9.810 -8.345 702 HG11 VAL 97 1HG1 VAL 97 14.934 8.239 -7.047 703 HG12 VAL 97 2HG1 VAL 97 14.181 9.458 -6.017 704 HG13 VAL 97 3HG1 VAL 97 13.592 9.204 -7.660 705 HG21 VAL 97 3HG2 VAL 97 13.749 11.545 -7.626 706 HG22 VAL 97 1HG2 VAL 97 15.293 12.358 -7.888 707 HG23 VAL 97 2HG2 VAL 97 14.594 11.358 -9.163 708 H THR 98 H THR 98 15.724 9.271 -4.442 709 HA THR 98 HA THR 98 18.072 7.502 -4.607 710 HB THR 98 HB THR 98 16.282 8.040 -2.229 711 HG1 THR 98 1HG THR 98 18.425 8.952 -1.497 712 HG21 THR 98 3HG2 THR 98 17.415 6.469 -1.053 713 HG22 THR 98 1HG2 THR 98 18.928 6.765 -1.909 714 HG23 THR 98 2HG2 THR 98 17.674 5.772 -2.652 715 H GLN 99 H GLN 99 17.809 5.384 -4.980 716 HA GLN 99 HA GLN 99 15.060 4.377 -5.203 717 HB2 GLN 99 1HB GLN 99 16.052 2.602 -6.628 718 HB3 GLN 99 2HB GLN 99 16.304 4.222 -7.265 719 HG2 GLN 99 1HG GLN 99 18.582 4.222 -6.455 720 HG3 GLN 99 2HG GLN 99 18.342 2.639 -5.717 721 HE21 GLN 99 1HE2 GLN 99 19.091 1.005 -6.843 722 HE22 GLN 99 2HE2 GLN 99 19.283 0.945 -8.559 723 H LEU 100 H LEU 100 14.766 2.034 -4.687 724 HA LEU 100 HA LEU 100 16.545 1.061 -2.578 725 HB2 LEU 100 1HB LEU 100 14.448 2.400 -1.762 726 HB3 LEU 100 2HB LEU 100 13.596 0.905 -2.145 727 HG LEU 100 HG LEU 100 15.299 -0.233 -0.599 728 HD11 LEU 100 1HD1 LEU 100 16.942 1.092 0.117 729 HD12 LEU 100 2HD1 LEU 100 15.744 1.799 1.200 730 HD13 LEU 100 3HD1 LEU 100 16.082 2.558 -0.356 731 HD21 LEU 100 3HD2 LEU 100 13.978 0.406 1.408 732 HD22 LEU 100 1HD2 LEU 100 12.988 -0.020 0.011 733 HD23 LEU 100 2HD2 LEU 100 13.212 1.674 0.449 734 H LYS 101 H LYS 101 16.750 -1.124 -2.503 735 HA LYS 101 HA LYS 101 15.095 -2.676 -4.385 736 HB2 LYS 101 1HB LYS 101 17.604 -2.319 -4.897 737 HB3 LYS 101 2HB LYS 101 17.888 -3.451 -3.582 738 HG2 LYS 101 1HG LYS 101 16.606 -5.156 -4.744 739 HG3 LYS 101 2HG LYS 101 16.256 -4.020 -6.049 740 HD2 LYS 101 1HD LYS 101 18.902 -3.825 -6.080 741 HD3 LYS 101 2HD LYS 101 18.780 -5.443 -5.384 742 HE2 LYS 101 1HE LYS 101 17.800 -6.326 -7.275 743 HE3 LYS 101 2HE LYS 101 17.172 -4.766 -7.805 744 HZ1 LYS 101 3HZ LYS 101 20.073 -5.066 -7.704 745 HZ2 LYS 101 1HZ LYS 101 19.109 -4.221 -8.809 746 HZ3 LYS 101 2HZ LYS 101 19.260 -5.901 -8.930 747 H LEU 102 H LEU 102 13.956 -4.303 -3.556 748 HA LEU 102 HA LEU 102 14.664 -5.262 -0.861 749 HB2 LEU 102 1HB LEU 102 11.943 -5.048 -2.141 750 HB3 LEU 102 2HB LEU 102 12.266 -5.762 -0.563 751 HG LEU 102 HG LEU 102 12.754 -2.871 -1.277 752 HD11 LEU 102 1HD1 LEU 102 10.771 -2.344 -0.065 753 HD12 LEU 102 2HD1 LEU 102 10.545 -4.027 0.410 754 HD13 LEU 102 3HD1 LEU 102 10.351 -3.554 -1.278 755 HD21 LEU 102 3HD2 LEU 102 13.328 -4.551 1.075 756 HD22 LEU 102 1HD2 LEU 102 12.603 -2.978 1.409 757 HD23 LEU 102 2HD2 LEU 102 14.116 -3.078 0.508 758 H THR 103 H THR 103 14.838 -7.416 -0.526 759 HA THR 103 HA THR 103 13.974 -9.256 -2.635 760 HB THR 103 HB THR 103 16.746 -9.356 -1.435 761 HG1 THR 103 1HG THR 103 17.451 -8.557 -3.392 762 HG21 THR 103 3HG2 THR 103 16.515 -11.513 -2.057 763 HG22 THR 103 1HG2 THR 103 16.798 -10.882 -3.678 764 HG23 THR 103 2HG2 THR 103 15.151 -11.168 -3.118 765 H VAL 104 H VAL 104 13.476 -11.327 -1.937 766 HA VAL 104 HA VAL 104 12.718 -11.575 0.798 767 HB VAL 104 HB VAL 104 12.826 -13.761 -1.283 768 HG11 VAL 104 1HG1 VAL 104 12.560 -14.408 1.134 769 HG12 VAL 104 2HG1 VAL 104 11.032 -13.526 1.124 770 HG13 VAL 104 3HG1 VAL 104 11.254 -14.921 0.067 771 HG21 VAL 104 3HG2 VAL 104 10.448 -13.219 -1.686 772 HG22 VAL 104 1HG2 VAL 104 10.620 -11.806 -0.645 773 HG23 VAL 104 2HG2 VAL 104 11.534 -11.909 -2.149 774 H VAL 105 H VAL 105 13.493 -13.003 2.371 775 HA VAL 105 HA VAL 105 16.033 -14.357 1.843 776 HB VAL 105 HB VAL 105 16.954 -13.486 4.004 777 HG11 VAL 105 1HG1 VAL 105 16.433 -11.211 2.120 778 HG12 VAL 105 2HG1 VAL 105 17.898 -11.586 3.030 779 HG13 VAL 105 3HG1 VAL 105 17.437 -12.582 1.649 780 HG21 VAL 105 3HG2 VAL 105 14.710 -11.483 3.763 781 HG22 VAL 105 1HG2 VAL 105 14.823 -12.755 4.980 782 HG23 VAL 105 2HG2 VAL 105 16.013 -11.454 4.952 783 H GLU 106 H GLU 106 16.416 -16.150 3.117 784 HA GLU 106 HA GLU 106 14.296 -16.862 5.033 785 HB2 GLU 106 1HB GLU 106 14.560 -19.223 4.289 786 HB3 GLU 106 2HB GLU 106 13.922 -18.161 3.042 787 HG2 GLU 106 1HG GLU 106 15.930 -18.166 1.845 788 HG3 GLU 106 2HG GLU 106 16.843 -18.802 3.212 789 H ASP 107 H ASP 107 16.477 -15.633 5.994 790 HA ASP 107 HA ASP 107 18.323 -17.717 6.909 791 HB2 ASP 107 1HB ASP 107 19.801 -15.956 7.574 792 HB3 ASP 107 2HB ASP 107 19.206 -15.555 5.965 793 H VAL 108 H VAL 108 15.972 -15.378 8.075 794 HA VAL 108 HA VAL 108 16.366 -16.310 10.827 795 HB VAL 108 HB VAL 108 16.311 -13.879 10.484 796 HG11 VAL 108 1HG1 VAL 108 13.630 -14.494 9.292 797 HG12 VAL 108 2HG1 VAL 108 13.982 -12.908 9.982 798 HG13 VAL 108 3HG1 VAL 108 14.941 -13.517 8.632 799 HG21 VAL 108 3HG2 VAL 108 15.094 -15.286 12.454 800 HG22 VAL 108 1HG2 VAL 108 15.271 -13.532 12.449 801 HG23 VAL 108 2HG2 VAL 108 13.764 -14.267 11.902 802 H THR 109 H THR 109 14.106 -16.381 8.185 803 HA THR 109 HA THR 109 12.496 -18.334 9.615 804 HB THR 109 HB THR 109 11.176 -15.905 8.392 805 HG1 THR 109 1HG THR 109 11.354 -16.565 11.155 806 HG21 THR 109 3HG2 THR 109 9.181 -16.825 9.613 807 HG22 THR 109 1HG2 THR 109 10.122 -18.285 9.918 808 HG23 THR 109 2HG2 THR 109 9.740 -17.812 8.263 809 H VAL 110 H VAL 110 11.446 -19.771 8.279 810 HA VAL 110 HA VAL 110 12.133 -19.563 5.431 811 HB VAL 110 HB VAL 110 11.323 -21.972 7.065 812 HG11 VAL 110 1HG1 VAL 110 11.709 -23.302 5.110 813 HG12 VAL 110 2HG1 VAL 110 10.553 -22.035 4.694 814 HG13 VAL 110 3HG1 VAL 110 12.239 -21.891 4.195 815 HG21 VAL 110 3HG2 VAL 110 13.794 -22.494 6.074 816 HG22 VAL 110 1HG2 VAL 110 13.897 -20.754 6.345 817 HG23 VAL 110 2HG2 VAL 110 13.484 -21.831 7.679 818 H GLY 111 H GLY 111 10.509 -18.468 4.451 819 HA2 GLY 111 1HA GLY 111 8.114 -19.736 3.818 820 HA3 GLY 111 2HA GLY 111 7.774 -18.663 5.167 821 H ARG 112 H ARG 112 9.527 -18.566 2.060 822 HA ARG 112 HA ARG 112 9.582 -15.896 1.581 823 HB2 ARG 112 1HB ARG 112 8.958 -18.091 -0.400 824 HB3 ARG 112 2HB ARG 112 9.391 -16.447 -0.850 825 HG2 ARG 112 1HG ARG 112 11.486 -16.943 0.665 826 HG3 ARG 112 2HG ARG 112 11.078 -18.615 0.276 827 HD2 ARG 112 1HD ARG 112 10.955 -17.724 -2.169 828 HD3 ARG 112 2HD ARG 112 11.927 -16.396 -1.537 829 HE ARG 112 HE ARG 112 13.723 -17.800 -1.506 830 HH11 ARG 112 1HH1 ARG 112 10.816 -19.714 -1.584 831 HH12 ARG 112 2HH1 ARG 112 11.657 -21.220 -1.752 832 HH21 ARG 112 1HH2 ARG 112 14.841 -19.776 -1.727 833 HH22 ARG 112 2HH2 ARG 112 13.946 -21.254 -1.832 834 H ARG 113 H ARG 113 6.818 -18.047 1.059 835 HA ARG 113 HA ARG 113 5.021 -16.566 -0.267 836 HB2 ARG 113 1HB ARG 113 4.665 -18.279 2.172 837 HB3 ARG 113 2HB ARG 113 3.285 -17.464 1.450 838 HG2 ARG 113 1HG ARG 113 4.198 -18.585 -0.749 839 HG3 ARG 113 2HG ARG 113 4.930 -19.704 0.403 840 HD2 ARG 113 1HD ARG 113 2.606 -19.879 1.443 841 HD3 ARG 113 2HD ARG 113 2.020 -19.088 -0.019 842 HE ARG 113 HE ARG 113 3.618 -21.284 -0.736 843 HH11 ARG 113 1HH1 ARG 113 0.533 -20.562 0.707 844 HH12 ARG 113 2HH1 ARG 113 -0.210 -22.031 0.166 845 HH21 ARG 113 1HH2 ARG 113 2.652 -23.222 -1.453 846 HH22 ARG 113 2HH2 ARG 113 0.996 -23.544 -1.061 847 H GLN 114 H GLN 114 5.688 -16.181 3.207 848 HA GLN 114 HA GLN 114 3.904 -14.189 3.830 849 HB2 GLN 114 1HB GLN 114 5.456 -15.344 5.419 850 HB3 GLN 114 2HB GLN 114 6.753 -14.314 4.828 851 HG2 GLN 114 1HG GLN 114 5.833 -13.493 6.927 852 HG3 GLN 114 2HG GLN 114 5.585 -12.343 5.614 853 HE21 GLN 114 1HE2 GLN 114 3.798 -11.308 6.254 854 HE22 GLN 114 2HE2 GLN 114 2.278 -12.064 6.573 855 H ALA 115 H ALA 115 7.330 -13.503 3.114 856 HA ALA 115 HA ALA 115 7.029 -10.766 2.731 857 HB1 ALA 115 1HB ALA 115 9.143 -12.430 2.801 858 HB2 ALA 115 2HB ALA 115 9.079 -12.083 1.072 859 HB3 ALA 115 3HB ALA 115 9.228 -10.762 2.232 860 H VAL 116 H VAL 116 7.317 -13.268 0.198 861 HA VAL 116 HA VAL 116 6.982 -11.800 -2.054 862 HB VAL 116 HB VAL 116 5.630 -14.446 -1.504 863 HG11 VAL 116 1HG1 VAL 116 6.209 -14.489 -4.131 864 HG12 VAL 116 2HG1 VAL 116 4.655 -13.960 -3.483 865 HG13 VAL 116 3HG1 VAL 116 5.882 -12.769 -3.918 866 HG21 VAL 116 3HG2 VAL 116 8.350 -13.811 -1.556 867 HG22 VAL 116 1HG2 VAL 116 7.627 -15.417 -1.632 868 HG23 VAL 116 2HG2 VAL 116 8.014 -14.553 -3.120 869 H ALA 117 H ALA 117 4.353 -12.981 0.026 870 HA ALA 117 HA ALA 117 2.198 -12.033 -1.458 871 HB1 ALA 117 1HB ALA 117 0.879 -12.475 0.387 872 HB2 ALA 117 2HB ALA 117 2.273 -13.518 0.671 873 HB3 ALA 117 3HB ALA 117 2.130 -11.984 1.529 874 H TRP 118 H TRP 118 4.056 -10.416 1.101 875 HA TRP 118 HA TRP 118 2.544 -8.029 1.096 876 HB2 TRP 118 1HB TRP 118 4.049 -8.713 2.945 877 HB3 TRP 118 2HB TRP 118 5.436 -8.415 1.901 878 HD1 TRP 118 HD TRP 118 3.260 -6.729 4.374 879 HE1 TRP 118 1HE TRP 118 3.746 -4.202 4.426 880 HE3 TRP 118 3HE TRP 118 6.069 -6.355 0.118 881 HZ2 TRP 118 2HZ TRP 118 5.135 -2.302 2.869 882 HZ3 TRP 118 3HZ TRP 118 6.938 -4.146 -0.530 883 HH2 TRP 118 HH TRP 118 6.479 -2.163 0.817 884 H LEU 119 H LEU 119 5.208 -9.169 -0.848 885 HA LEU 119 HA LEU 119 5.996 -6.680 -1.935 886 HB2 LEU 119 1HB LEU 119 6.218 -9.445 -3.117 887 HB3 LEU 119 2HB LEU 119 7.077 -8.015 -3.685 888 HG LEU 119 HG LEU 119 7.428 -9.209 -0.939 889 HD11 LEU 119 1HD1 LEU 119 9.120 -10.526 -1.677 890 HD12 LEU 119 2HD1 LEU 119 9.529 -9.449 -3.011 891 HD13 LEU 119 3HD1 LEU 119 8.139 -10.526 -3.142 892 HD21 LEU 119 3HD2 LEU 119 8.594 -7.373 -0.510 893 HD22 LEU 119 1HD2 LEU 119 8.218 -6.745 -2.114 894 HD23 LEU 119 2HD2 LEU 119 9.660 -7.730 -1.870 895 H VAL 120 H VAL 120 3.813 -9.213 -3.146 896 HA VAL 120 HA VAL 120 3.058 -7.691 -5.458 897 HB VAL 120 HB VAL 120 2.971 -10.070 -5.658 898 HG11 VAL 120 1HG1 VAL 120 1.381 -9.907 -3.140 899 HG12 VAL 120 2HG1 VAL 120 1.119 -11.259 -4.243 900 HG13 VAL 120 3HG1 VAL 120 2.720 -10.975 -3.558 901 HG21 VAL 120 3HG2 VAL 120 0.152 -9.006 -5.498 902 HG22 VAL 120 1HG2 VAL 120 1.247 -8.816 -6.867 903 HG23 VAL 120 2HG2 VAL 120 0.679 -10.422 -6.408 904 H ALA 121 H ALA 121 1.729 -8.263 -2.256 905 HA ALA 121 HA ALA 121 -0.838 -7.204 -2.672 906 HB1 ALA 121 1HB ALA 121 0.722 -7.089 -0.099 907 HB2 ALA 121 2HB ALA 121 -1.031 -7.095 -0.298 908 HB3 ALA 121 3HB ALA 121 -0.094 -8.536 -0.690 909 H MET 122 H MET 122 2.155 -5.659 -1.534 910 HA MET 122 HA MET 122 1.222 -3.137 -0.962 911 HB2 MET 122 1HB MET 122 3.575 -4.000 -0.675 912 HB3 MET 122 2HB MET 122 3.827 -3.685 -2.387 913 HG2 MET 122 1HG MET 122 2.879 -1.520 -0.555 914 HG3 MET 122 2HG MET 122 4.589 -1.934 -0.665 915 HE1 MET 122 3HE MET 122 3.426 0.636 -0.905 916 HE2 MET 122 1HE MET 122 4.409 1.331 -2.194 917 HE3 MET 122 2HE MET 122 2.667 1.160 -2.409 918 H HIS 123 H HIS 123 2.822 -3.910 -4.054 919 HA HIS 123 HA HIS 123 2.281 -1.724 -5.514 920 HB2 HIS 123 1HB HIS 123 3.423 -3.823 -6.316 921 HB3 HIS 123 2HB HIS 123 1.826 -4.500 -6.620 922 HD2 HIS 123 2HD HIS 123 3.182 -4.409 -9.324 923 HE1 HIS 123 1HE HIS 123 1.779 -0.447 -9.896 924 HE2 HIS 123 2HE HIS 123 2.663 -2.523 -11.016 925 H LYS 124 H LYS 124 0.076 -4.512 -5.773 926 HA LYS 124 HA LYS 124 -2.017 -3.348 -7.045 927 HB2 LYS 124 1HB LYS 124 -1.808 -5.534 -5.047 928 HB3 LYS 124 2HB LYS 124 -3.420 -4.905 -5.364 929 HG2 LYS 124 1HG LYS 124 -3.230 -6.666 -6.853 930 HG3 LYS 124 2HG LYS 124 -2.839 -5.259 -7.845 931 HD2 LYS 124 1HD LYS 124 -0.615 -6.665 -6.456 932 HD3 LYS 124 2HD LYS 124 -1.338 -7.439 -7.869 933 HE2 LYS 124 1HE LYS 124 -1.014 -5.157 -9.015 934 HE3 LYS 124 2HE LYS 124 0.082 -4.803 -7.681 935 HZ1 LYS 124 3HZ LYS 124 0.550 -7.356 -8.927 936 HZ2 LYS 124 1HZ LYS 124 1.646 -6.133 -8.521 937 HZ3 LYS 124 2HZ LYS 124 0.779 -6.044 -9.970 938 H ALA 125 H ALA 125 -1.193 -3.017 -3.646 939 HA ALA 125 HA ALA 125 -3.584 -1.637 -2.914 940 HB1 ALA 125 1HB ALA 125 -0.967 -1.511 -1.441 941 HB2 ALA 125 2HB ALA 125 -2.600 -1.341 -0.794 942 HB3 ALA 125 3HB ALA 125 -2.036 -2.912 -1.363 943 H ALA 126 H ALA 126 -0.309 -0.640 -3.811 944 HA ALA 126 HA ALA 126 -0.432 2.061 -3.258 945 HB1 ALA 126 1HB ALA 126 0.908 1.699 -5.757 946 HB2 ALA 126 2HB ALA 126 1.593 2.000 -4.160 947 HB3 ALA 126 3HB ALA 126 1.281 0.346 -4.688 948 H LYS 127 H LYS 127 -1.790 0.293 -5.975 949 HA LYS 127 HA LYS 127 -2.453 2.509 -7.586 950 HB2 LYS 127 1HB LYS 127 -3.603 -0.272 -7.390 951 HB3 LYS 127 2HB LYS 127 -4.168 0.904 -8.569 952 HG2 LYS 127 1HG LYS 127 -1.833 1.065 -9.424 953 HG3 LYS 127 2HG LYS 127 -1.404 -0.261 -8.341 954 HD2 LYS 127 1HD LYS 127 -3.203 -1.617 -9.456 955 HD3 LYS 127 2HD LYS 127 -3.354 -0.316 -10.639 956 HE2 LYS 127 1HE LYS 127 -1.865 -1.654 -11.734 957 HE3 LYS 127 2HE LYS 127 -0.739 -0.657 -10.814 958 HZ1 LYS 127 3HZ LYS 127 -1.385 -2.743 -9.149 959 HZ2 LYS 127 1HZ LYS 127 0.064 -2.541 -9.999 960 HZ3 LYS 127 2HZ LYS 127 -1.188 -3.461 -10.668 961 H LEU 128 H LEU 128 -4.020 1.031 -4.840 962 HA LEU 128 HA LEU 128 -6.555 2.279 -5.193 963 HB2 LEU 128 1HB LEU 128 -5.185 0.906 -2.912 964 HB3 LEU 128 2HB LEU 128 -6.718 1.741 -2.666 965 HG LEU 128 HG LEU 128 -6.305 -0.506 -4.636 966 HD11 LEU 128 1HD1 LEU 128 -6.377 -0.678 -1.854 967 HD12 LEU 128 2HD1 LEU 128 -6.599 -1.988 -3.012 968 HD13 LEU 128 3HD1 LEU 128 -7.999 -1.114 -2.390 969 HD21 LEU 128 3HD2 LEU 128 -8.501 1.323 -4.015 970 HD22 LEU 128 1HD2 LEU 128 -8.958 -0.380 -4.001 971 HD23 LEU 128 2HD2 LEU 128 -8.222 0.323 -5.442 972 H LEU 129 H LEU 129 -3.582 3.159 -3.549 973 HA LEU 129 HA LEU 129 -4.591 5.321 -2.050 974 HB2 LEU 129 1HB LEU 129 -1.915 4.415 -2.952 975 HB3 LEU 129 2HB LEU 129 -2.067 6.085 -2.410 976 HG LEU 129 HG LEU 129 -2.808 3.671 -0.758 977 HD11 LEU 129 1HD1 LEU 129 -0.697 4.740 0.503 978 HD12 LEU 129 2HD1 LEU 129 -0.258 5.098 -1.167 979 HD13 LEU 129 3HD1 LEU 129 -0.565 3.433 -0.674 980 HD21 LEU 129 3HD2 LEU 129 -3.883 5.172 0.483 981 HD22 LEU 129 1HD2 LEU 129 -3.257 6.514 -0.476 982 HD23 LEU 129 2HD2 LEU 129 -2.308 5.871 0.865 983 H TYR 130 H TYR 130 -2.983 5.226 -5.223 984 HA TYR 130 HA TYR 130 -3.482 8.040 -5.660 985 HB2 TYR 130 1HB TYR 130 -2.567 6.202 -7.835 986 HB3 TYR 130 2HB TYR 130 -2.103 7.869 -7.512 987 HD1 TYR 130 2HD TYR 130 -1.370 7.611 -4.616 988 HD2 TYR 130 1HD TYR 130 -0.480 5.132 -7.958 989 HE1 TYR 130 2HE TYR 130 0.668 6.828 -3.485 990 HE2 TYR 130 1HE TYR 130 1.560 4.341 -6.835 991 HH TYR 130 HH TYR 130 2.361 5.371 -3.541 992 H GLU 131 H GLU 131 -4.473 5.005 -7.246 993 HA GLU 131 HA GLU 131 -6.729 6.453 -8.453 994 HB2 GLU 131 1HB GLU 131 -5.503 3.790 -9.191 995 HB3 GLU 131 2HB GLU 131 -6.887 4.519 -9.994 996 HG2 GLU 131 1HG GLU 131 -4.296 5.993 -9.805 997 HG3 GLU 131 2HG GLU 131 -4.542 4.759 -11.040 998 H SER 132 H SER 132 -8.756 5.123 -8.706 999 HA SER 132 HA SER 132 -9.219 3.068 -6.735 1000 HB2 SER 132 1HB SER 132 -10.863 4.237 -5.430 1001 HB3 SER 132 2HB SER 132 -9.405 5.230 -5.451 1002 HG SER 132 HG SER 132 -11.120 6.565 -5.890 1003 H ARG 133 H ARG 133 -11.234 2.007 -6.998 1004 HA ARG 133 HA ARG 133 -12.529 2.593 -9.578 1005 HB2 ARG 133 1HB ARG 133 -12.408 -0.058 -8.131 1006 HB3 ARG 133 2HB ARG 133 -13.066 0.233 -9.736 1007 HG2 ARG 133 1HG ARG 133 -10.185 0.709 -9.020 1008 HG3 ARG 133 2HG ARG 133 -10.793 -0.812 -9.677 1009 HD2 ARG 133 1HD ARG 133 -11.037 1.884 -11.007 1010 HD3 ARG 133 2HD ARG 133 -9.836 0.658 -11.409 1011 HE ARG 133 HE ARG 133 -12.563 0.725 -12.243 1012 HH11 ARG 133 1HH1 ARG 133 -9.927 -1.403 -11.439 1013 HH12 ARG 133 2HH1 ARG 133 -10.511 -2.708 -12.418 1014 HH21 ARG 133 1HH2 ARG 133 -13.341 -0.986 -13.536 1015 HH22 ARG 133 2HH2 ARG 133 -12.452 -2.470 -13.611 1016 H ASP 134 H ASP 134 -14.768 2.537 -9.732 1017 HA ASP 134 HA ASP 134 -16.161 3.002 -7.216 1018 HB2 ASP 134 1HB ASP 134 -17.133 3.306 -10.066 1019 HB3 ASP 134 2HB ASP 134 -17.999 3.822 -8.622 1020 H GLN 135 H GLN 135 -16.688 1.062 -10.163 1021 HA GLN 135 HA GLN 135 -18.503 -0.668 -8.656 1022 HB2 GLN 135 1HB GLN 135 -19.338 0.133 -10.788 1023 HB3 GLN 135 2HB GLN 135 -17.915 -0.487 -11.614 1024 HG2 GLN 135 1HG GLN 135 -19.578 -2.050 -12.065 1025 HG3 GLN 135 2HG GLN 135 -18.629 -2.781 -10.771 1026 HE21 GLN 135 1HE2 GLN 135 -21.649 -1.291 -11.627 1027 HE22 GLN 135 2HE2 GLN 135 -22.515 -1.759 -10.208 1028 H SER 136 H SER 136 -17.647 -2.373 -7.684 1029 HA SER 136 HA SER 136 -15.094 -3.350 -7.936 1030 HB2 SER 136 1HB SER 136 -17.654 -4.641 -7.031 1031 HB3 SER 136 2HB SER 136 -16.150 -5.561 -7.066 1032 HG SER 136 HG SER 136 -16.593 -4.506 -5.035 1033 H GLY 137 H GLY 137 -17.956 -5.028 -9.262 1034 HA2 GLY 137 1HA GLY 137 -17.299 -5.345 -11.857 1035 HA3 GLY 137 2HA GLY 137 -16.272 -6.534 -11.071 1036 HA PRO 138 HA PRO 138 -20.874 -7.861 -10.291 1037 HB2 PRO 138 1HB PRO 138 -22.729 -6.639 -11.853 1038 HB3 PRO 138 2HB PRO 138 -22.261 -6.029 -10.262 1039 HG2 PRO 138 1HG PRO 138 -21.357 -5.138 -12.973 1040 HG3 PRO 138 2HG PRO 138 -21.804 -4.158 -11.565 1041 HD2 PRO 138 1HD PRO 138 -19.228 -4.652 -12.238 1042 HD3 PRO 138 2HD PRO 138 -19.752 -4.448 -10.554 1043 H SER 139 H SER 139 -19.153 -7.432 -13.129 1044 HA SER 139 HA SER 139 -20.430 -8.465 -15.235 1045 HB2 SER 139 1HB SER 139 -17.744 -9.489 -14.281 1046 HB3 SER 139 2HB SER 139 -18.356 -9.563 -15.933 1047 HG SER 139 HG SER 139 -17.200 -7.751 -15.968 1048 H SER 140 H SER 140 -19.284 -10.397 -12.492 1049 HA SER 140 HA SER 140 -19.754 -12.942 -13.270 1050 HB2 SER 140 1HB SER 140 -20.422 -13.434 -10.910 1051 HB3 SER 140 2HB SER 140 -18.963 -12.452 -11.037 1052 HG SER 140 HG SER 140 -20.063 -11.272 -9.652 1053 H GLY 141 H GLY 141 -21.474 -14.341 -13.494 1054 HA2 GLY 141 1HA GLY 141 -24.174 -13.496 -12.929 1055 HA3 GLY 141 2HA GLY 141 -23.798 -13.540 -14.645 Start of MODEL 14 1 H1 GLY 1 H GLY 1 -25.751 9.083 -9.951 2 HA2 GLY 1 1HA GLY 1 -25.340 8.094 -7.650 3 HA3 GLY 1 2HA GLY 1 -26.132 7.006 -8.780 4 H SER 2 H SER 2 -24.594 6.184 -6.551 5 HA SER 2 HA SER 2 -22.748 4.424 -7.896 6 HB2 SER 2 1HB SER 2 -21.529 6.654 -7.260 7 HB3 SER 2 2HB SER 2 -21.560 5.987 -5.627 8 HG SER 2 HG SER 2 -20.118 4.543 -6.183 9 H SER 3 H SER 3 -22.814 2.485 -6.963 10 HA SER 3 HA SER 3 -23.874 2.308 -4.219 11 HB2 SER 3 1HB SER 3 -24.694 0.046 -4.866 12 HB3 SER 3 2HB SER 3 -25.420 1.338 -5.821 13 HG SER 3 HG SER 3 -23.092 0.198 -6.822 14 H GLY 4 H GLY 4 -21.818 2.429 -3.250 15 HA2 GLY 4 1HA GLY 4 -19.594 0.871 -3.950 16 HA3 GLY 4 2HA GLY 4 -19.887 1.564 -2.362 17 H SER 5 H SER 5 -18.805 -1.084 -3.265 18 HA SER 5 HA SER 5 -20.655 -3.126 -2.725 19 HB2 SER 5 1HB SER 5 -18.744 -4.591 -2.514 20 HB3 SER 5 2HB SER 5 -18.422 -3.443 -3.812 21 HG SER 5 HG SER 5 -17.590 -2.528 -1.387 22 H SER 6 H SER 6 -21.111 -4.307 -0.876 23 HA SER 6 HA SER 6 -21.536 -3.046 1.483 24 HB2 SER 6 1HB SER 6 -21.745 -5.213 2.537 25 HB3 SER 6 2HB SER 6 -22.349 -5.335 0.884 26 HG SER 6 HG SER 6 -21.030 -7.057 1.121 27 H GLY 7 H GLY 7 -18.597 -4.822 0.592 28 HA2 GLY 7 1HA GLY 7 -17.018 -3.177 2.352 29 HA3 GLY 7 2HA GLY 7 -17.174 -4.835 2.912 30 H ALA 8 H ALA 8 -14.707 -4.293 2.552 31 HA ALA 8 HA ALA 8 -13.994 -5.144 -0.178 32 HB1 ALA 8 1HB ALA 8 -12.133 -3.832 -0.139 33 HB2 ALA 8 2HB ALA 8 -13.168 -2.883 0.929 34 HB3 ALA 8 3HB ALA 8 -11.945 -3.955 1.610 35 H GLU 9 H GLU 9 -14.821 -7.070 1.637 36 HA GLU 9 HA GLU 9 -13.094 -8.305 3.311 37 HB2 GLU 9 1HB GLU 9 -15.401 -9.085 2.507 38 HB3 GLU 9 2HB GLU 9 -14.543 -9.889 1.200 39 HG2 GLU 9 1HG GLU 9 -13.162 -11.003 3.042 40 HG3 GLU 9 2HG GLU 9 -14.424 -10.445 4.139 41 H PHE 10 H PHE 10 -12.985 -8.450 -0.224 42 HA PHE 10 HA PHE 10 -10.951 -10.313 -0.535 43 HB2 PHE 10 1HB PHE 10 -12.288 -9.444 -2.406 44 HB3 PHE 10 2HB PHE 10 -11.507 -7.875 -2.239 45 HD1 PHE 10 1HD PHE 10 -8.963 -7.796 -2.539 46 HD2 PHE 10 2HD PHE 10 -11.384 -11.063 -3.796 47 HE1 PHE 10 1HE PHE 10 -7.186 -8.516 -4.082 48 HE2 PHE 10 2HE PHE 10 -9.611 -11.789 -5.340 49 HZ PHE 10 HZ PHE 10 -7.508 -10.515 -5.484 50 H TYR 11 H TYR 11 -10.655 -6.766 -0.376 51 HA TYR 11 HA TYR 11 -7.853 -6.683 -0.469 52 HB2 TYR 11 1HB TYR 11 -10.002 -4.794 0.356 53 HB3 TYR 11 2HB TYR 11 -8.355 -4.425 0.857 54 HD1 TYR 11 1HD TYR 11 -6.557 -4.381 -0.996 55 HD2 TYR 11 2HD TYR 11 -10.736 -4.193 -1.772 56 HE1 TYR 11 1HE TYR 11 -6.097 -3.410 -3.209 57 HE2 TYR 11 2HE TYR 11 -10.288 -3.223 -3.987 58 HH TYR 11 HH TYR 11 -7.348 -1.943 -4.871 59 H ASP 12 H ASP 12 -10.081 -6.692 2.294 60 HA ASP 12 HA ASP 12 -8.438 -6.323 4.412 61 HB2 ASP 12 1HB ASP 12 -10.769 -8.162 4.013 62 HB3 ASP 12 2HB ASP 12 -9.878 -8.209 5.532 63 H LYS 13 H LYS 13 -8.828 -9.366 2.629 64 HA LYS 13 HA LYS 13 -7.261 -11.045 4.140 65 HB2 LYS 13 1HB LYS 13 -7.915 -10.878 1.240 66 HB3 LYS 13 2HB LYS 13 -6.622 -11.968 1.721 67 HG2 LYS 13 1HG LYS 13 -8.183 -13.064 3.294 68 HG3 LYS 13 2HG LYS 13 -9.473 -12.021 2.689 69 HD2 LYS 13 1HD LYS 13 -7.848 -13.775 0.867 70 HD3 LYS 13 2HD LYS 13 -9.296 -14.363 1.688 71 HE2 LYS 13 1HE LYS 13 -9.426 -11.814 0.143 72 HE3 LYS 13 2HE LYS 13 -9.436 -13.347 -0.727 73 HZ1 LYS 13 3HZ LYS 13 -11.560 -12.087 0.599 74 HZ2 LYS 13 1HZ LYS 13 -11.244 -13.548 1.391 75 HZ3 LYS 13 2HZ LYS 13 -11.577 -13.540 -0.267 76 H GLN 14 H GLN 14 -6.232 -8.640 1.774 77 HA GLN 14 HA GLN 14 -3.443 -9.355 2.061 78 HB2 GLN 14 1HB GLN 14 -4.789 -7.094 0.576 79 HB3 GLN 14 2HB GLN 14 -3.062 -7.422 0.536 80 HG2 GLN 14 1HG GLN 14 -4.023 -8.329 -1.435 81 HG3 GLN 14 2HG GLN 14 -3.577 -9.674 -0.385 82 HE21 GLN 14 1HE2 GLN 14 -6.239 -7.755 -1.602 83 HE22 GLN 14 2HE2 GLN 14 -7.476 -8.916 -1.278 84 H LEU 15 H LEU 15 -5.487 -6.555 2.855 85 HA LEU 15 HA LEU 15 -3.836 -4.755 3.913 86 HB2 LEU 15 1HB LEU 15 -6.275 -5.776 5.359 87 HB3 LEU 15 2HB LEU 15 -5.512 -4.205 5.595 88 HG LEU 15 HG LEU 15 -6.898 -5.136 3.080 89 HD11 LEU 15 1HD1 LEU 15 -8.787 -4.253 3.855 90 HD12 LEU 15 2HD1 LEU 15 -7.964 -2.810 4.447 91 HD13 LEU 15 3HD1 LEU 15 -8.025 -4.263 5.445 92 HD21 LEU 15 3HD2 LEU 15 -5.664 -3.561 2.094 93 HD22 LEU 15 1HD2 LEU 15 -5.069 -2.947 3.636 94 HD23 LEU 15 2HD2 LEU 15 -6.620 -2.392 3.006 95 H LYS 16 H LYS 16 -5.074 -7.418 5.943 96 HA LYS 16 HA LYS 16 -3.502 -7.023 8.162 97 HB2 LYS 16 1HB LYS 16 -3.794 -9.437 8.626 98 HB3 LYS 16 2HB LYS 16 -5.293 -8.652 8.146 99 HG2 LYS 16 1HG LYS 16 -4.535 -9.502 5.753 100 HG3 LYS 16 2HG LYS 16 -3.680 -10.697 6.732 101 HD2 LYS 16 1HD LYS 16 -6.545 -10.125 7.330 102 HD3 LYS 16 2HD LYS 16 -6.149 -11.120 5.927 103 HE2 LYS 16 1HE LYS 16 -6.495 -12.596 7.758 104 HE3 LYS 16 2HE LYS 16 -4.760 -12.546 7.455 105 HZ1 LYS 16 3HZ LYS 16 -5.365 -12.411 9.833 106 HZ2 LYS 16 1HZ LYS 16 -6.130 -10.932 9.534 107 HZ3 LYS 16 2HZ LYS 16 -4.462 -11.083 9.300 108 H VAL 17 H VAL 17 -2.721 -8.993 5.307 109 HA VAL 17 HA VAL 17 -0.271 -9.996 6.089 110 HB VAL 17 HB VAL 17 -1.072 -9.087 3.320 111 HG11 VAL 17 1HG1 VAL 17 0.845 -11.295 3.660 112 HG12 VAL 17 2HG1 VAL 17 0.810 -9.991 2.471 113 HG13 VAL 17 3HG1 VAL 17 1.447 -9.694 4.089 114 HG21 VAL 17 3HG2 VAL 17 -1.547 -11.533 3.015 115 HG22 VAL 17 1HG2 VAL 17 -1.358 -11.718 4.759 116 HG23 VAL 17 2HG2 VAL 17 -2.642 -10.695 4.113 117 H LEU 18 H LEU 18 -0.984 -6.871 4.570 118 HA LEU 18 HA LEU 18 1.689 -6.009 4.331 119 HB2 LEU 18 1HB LEU 18 -0.975 -4.673 4.321 120 HB3 LEU 18 2HB LEU 18 0.476 -3.679 4.445 121 HG LEU 18 HG LEU 18 -0.070 -5.622 2.203 122 HD11 LEU 18 1HD1 LEU 18 -1.056 -2.940 2.683 123 HD12 LEU 18 2HD1 LEU 18 -1.509 -4.107 1.441 124 HD13 LEU 18 3HD1 LEU 18 -0.121 -3.049 1.192 125 HD21 LEU 18 3HD2 LEU 18 2.161 -5.364 2.004 126 HD22 LEU 18 1HD2 LEU 18 2.184 -3.881 2.958 127 HD23 LEU 18 2HD2 LEU 18 1.708 -3.829 1.261 128 H LEU 19 H LEU 19 -0.770 -4.866 6.653 129 HA LEU 19 HA LEU 19 0.826 -3.405 8.319 130 HB2 LEU 19 1HB LEU 19 -1.433 -5.213 9.167 131 HB3 LEU 19 2HB LEU 19 -0.781 -3.870 10.103 132 HG LEU 19 HG LEU 19 -2.018 -3.464 7.394 133 HD11 LEU 19 1HD1 LEU 19 -4.107 -3.557 8.186 134 HD12 LEU 19 2HD1 LEU 19 -3.664 -2.805 9.718 135 HD13 LEU 19 3HD1 LEU 19 -3.415 -4.535 9.480 136 HD21 LEU 19 3HD2 LEU 19 -0.671 -1.637 8.216 137 HD22 LEU 19 1HD2 LEU 19 -1.519 -1.664 9.762 138 HD23 LEU 19 2HD2 LEU 19 -2.376 -1.192 8.294 139 H SER 20 H SER 20 0.259 -6.904 8.461 140 HA SER 20 HA SER 20 1.518 -7.626 10.753 141 HB2 SER 20 1HB SER 20 0.479 -9.116 8.927 142 HB3 SER 20 2HB SER 20 2.085 -9.120 8.198 143 HG SER 20 HG SER 20 2.185 -9.646 10.858 144 H GLY 21 H GLY 21 3.107 -6.896 7.662 145 HA2 GLY 21 1HA GLY 21 5.205 -5.873 7.418 146 HA3 GLY 21 2HA GLY 21 5.530 -6.184 9.117 147 H ALA 22 H ALA 22 6.775 -6.823 6.293 148 HA ALA 22 HA ALA 22 7.461 -9.611 6.964 149 HB1 ALA 22 1HB ALA 22 6.707 -8.367 4.408 150 HB2 ALA 22 2HB ALA 22 8.087 -9.464 4.340 151 HB3 ALA 22 3HB ALA 22 6.537 -10.035 4.957 152 H THR 23 H THR 23 9.635 -10.282 6.174 153 HA THR 23 HA THR 23 11.566 -8.173 6.778 154 HB THR 23 HB THR 23 12.036 -11.148 6.507 155 HG1 THR 23 1HG THR 23 10.631 -10.302 8.304 156 HG21 THR 23 3HG2 THR 23 13.752 -8.830 7.312 157 HG22 THR 23 1HG2 THR 23 14.128 -10.178 6.239 158 HG23 THR 23 2HG2 THR 23 14.056 -10.432 7.983 159 H PHE 24 H PHE 24 13.318 -7.682 5.453 160 HA PHE 24 HA PHE 24 13.688 -8.985 2.919 161 HB2 PHE 24 1HB PHE 24 12.814 -6.093 2.869 162 HB3 PHE 24 2HB PHE 24 13.132 -7.139 1.488 163 HD1 PHE 24 2HD PHE 24 11.558 -8.938 0.909 164 HD2 PHE 24 1HD PHE 24 10.729 -6.144 4.011 165 HE1 PHE 24 2HE PHE 24 9.185 -9.582 0.850 166 HE2 PHE 24 1HE PHE 24 8.354 -6.783 3.957 167 HZ PHE 24 HZ PHE 24 7.579 -8.504 2.374 168 H LEU 25 H LEU 25 15.365 -7.706 1.583 169 HA LEU 25 HA LEU 25 17.391 -6.681 3.456 170 HB2 LEU 25 1HB LEU 25 17.536 -8.332 0.985 171 HB3 LEU 25 2HB LEU 25 18.884 -7.260 1.357 172 HG LEU 25 HG LEU 25 17.855 -9.366 3.251 173 HD11 LEU 25 1HD1 LEU 25 19.794 -10.697 2.560 174 HD12 LEU 25 2HD1 LEU 25 20.153 -9.512 1.305 175 HD13 LEU 25 3HD1 LEU 25 18.660 -10.447 1.232 176 HD21 LEU 25 3HD2 LEU 25 19.111 -8.156 4.658 177 HD22 LEU 25 1HD2 LEU 25 19.911 -7.285 3.349 178 HD23 LEU 25 2HD2 LEU 25 20.480 -8.887 3.819 179 H VAL 26 H VAL 26 17.915 -4.608 3.317 180 HA VAL 26 HA VAL 26 17.208 -3.140 0.865 181 HB VAL 26 HB VAL 26 17.633 -2.067 3.658 182 HG11 VAL 26 1HG1 VAL 26 17.569 0.013 2.841 183 HG12 VAL 26 2HG1 VAL 26 17.947 -0.725 1.283 184 HG13 VAL 26 3HG1 VAL 26 16.272 -0.375 1.712 185 HG21 VAL 26 3HG2 VAL 26 15.354 -3.260 2.398 186 HG22 VAL 26 1HG2 VAL 26 15.520 -2.635 4.039 187 HG23 VAL 26 2HG2 VAL 26 15.025 -1.560 2.732 188 H THR 27 H THR 27 18.774 -2.302 -0.348 189 HA THR 27 HA THR 27 21.503 -2.237 0.758 190 HB THR 27 HB THR 27 20.859 -2.241 -2.182 191 HG1 THR 27 1HG THR 27 20.182 -4.225 -1.902 192 HG21 THR 27 3HG2 THR 27 23.105 -2.996 -2.444 193 HG22 THR 27 1HG2 THR 27 23.280 -3.275 -0.712 194 HG23 THR 27 2HG2 THR 27 23.151 -1.628 -1.332 195 H PHE 28 H PHE 28 22.010 -0.236 1.378 196 HA PHE 28 HA PHE 28 20.909 2.072 0.005 197 HB2 PHE 28 1HB PHE 28 22.736 1.855 2.406 198 HB3 PHE 28 2HB PHE 28 22.092 3.366 1.773 199 HD1 PHE 28 2HD PHE 28 19.396 3.170 1.372 200 HD2 PHE 28 1HD PHE 28 21.691 1.069 4.276 201 HE1 PHE 28 2HE PHE 28 17.382 2.894 2.759 202 HE2 PHE 28 1HE PHE 28 19.681 0.788 5.667 203 HZ PHE 28 HZ PHE 28 17.523 1.702 4.909 204 H GLY 29 H GLY 29 22.030 3.510 -1.238 205 HA2 GLY 29 1HA GLY 29 23.976 2.850 -2.937 206 HA3 GLY 29 2HA GLY 29 23.867 4.481 -2.292 207 H ASN 30 H ASN 30 24.583 3.904 0.385 208 HA ASN 30 HA ASN 30 27.440 3.783 0.072 209 HB2 ASN 30 1HB ASN 30 25.958 3.860 2.696 210 HB3 ASN 30 2HB ASN 30 27.570 4.469 2.335 211 HD21 ASN 30 1HD2 ASN 30 24.558 5.412 3.007 212 HD22 ASN 30 2HD2 ASN 30 24.513 6.932 2.187 213 H SER 31 H SER 31 25.143 1.959 2.107 214 HA SER 31 HA SER 31 26.949 -0.024 2.899 215 HB2 SER 31 1HB SER 31 23.961 -0.366 2.567 216 HB3 SER 31 2HB SER 31 25.023 -1.282 3.636 217 HG SER 31 HG SER 31 25.031 1.478 3.942 218 H GLU 32 H GLU 32 28.141 -0.935 1.285 219 HA GLU 32 HA GLU 32 27.141 -1.765 -1.213 220 HB2 GLU 32 1HB GLU 32 29.250 -2.959 -1.468 221 HB3 GLU 32 2HB GLU 32 29.528 -1.362 -0.787 222 HG2 GLU 32 1HG GLU 32 30.055 -2.203 1.306 223 HG3 GLU 32 2HG GLU 32 29.259 -3.744 0.996 224 H LYS 33 H LYS 33 26.966 -3.180 1.903 225 HA LYS 33 HA LYS 33 26.140 -5.759 0.748 226 HB2 LYS 33 1HB LYS 33 27.823 -6.291 2.249 227 HB3 LYS 33 2HB LYS 33 27.387 -4.996 3.357 228 HG2 LYS 33 1HG LYS 33 25.575 -6.213 4.233 229 HG3 LYS 33 2HG LYS 33 25.628 -7.388 2.916 230 HD2 LYS 33 1HD LYS 33 27.928 -7.018 4.815 231 HD3 LYS 33 2HD LYS 33 26.586 -8.107 5.173 232 HE2 LYS 33 1HE LYS 33 28.095 -8.277 2.586 233 HE3 LYS 33 2HE LYS 33 28.680 -9.080 4.042 234 HZ1 LYS 33 3HZ LYS 33 27.404 -10.747 3.281 235 HZ2 LYS 33 1HZ LYS 33 26.421 -9.737 2.346 236 HZ3 LYS 33 2HZ LYS 33 26.143 -9.885 4.008 237 HA PRO 34 HA PRO 34 21.979 -4.752 1.847 238 HB2 PRO 34 1HB PRO 34 20.930 -7.244 1.602 239 HB3 PRO 34 2HB PRO 34 21.359 -6.242 0.211 240 HG2 PRO 34 1HG PRO 34 22.894 -8.476 1.479 241 HG3 PRO 34 2HG PRO 34 22.639 -8.130 -0.241 242 HD2 PRO 34 1HD PRO 34 24.929 -7.484 1.051 243 HD3 PRO 34 2HD PRO 34 24.283 -6.515 -0.288 244 H GLU 35 H GLU 35 20.964 -4.559 3.749 245 HA GLU 35 HA GLU 35 21.747 -6.381 5.923 246 HB2 GLU 35 1HB GLU 35 22.095 -3.769 5.977 247 HB3 GLU 35 2HB GLU 35 20.396 -3.763 6.428 248 HG2 GLU 35 1HG GLU 35 22.261 -5.555 7.896 249 HG3 GLU 35 2HG GLU 35 22.284 -3.826 8.242 250 H THR 36 H THR 36 20.154 -7.132 7.384 251 HA THR 36 HA THR 36 17.628 -7.694 6.122 252 HB THR 36 HB THR 36 18.438 -8.411 8.941 253 HG1 THR 36 1HG THR 36 18.972 -10.483 7.735 254 HG21 THR 36 3HG2 THR 36 16.457 -9.424 9.012 255 HG22 THR 36 1HG2 THR 36 16.911 -10.407 7.621 256 HG23 THR 36 2HG2 THR 36 16.099 -8.860 7.380 257 H MET 37 H MET 37 16.143 -6.121 6.095 258 HA MET 37 HA MET 37 15.572 -4.733 8.631 259 HB2 MET 37 1HB MET 37 15.326 -3.626 5.828 260 HB3 MET 37 2HB MET 37 14.849 -2.786 7.297 261 HG2 MET 37 1HG MET 37 17.319 -3.188 8.004 262 HG3 MET 37 2HG MET 37 17.578 -3.412 6.275 263 HE1 MET 37 3HE MET 37 16.943 -0.587 9.108 264 HE2 MET 37 1HE MET 37 15.823 0.391 8.158 265 HE3 MET 37 2HE MET 37 15.415 -1.278 8.559 266 H THR 38 H THR 38 13.349 -4.115 8.967 267 HA THR 38 HA THR 38 11.497 -6.009 7.700 268 HB THR 38 HB THR 38 11.079 -4.436 10.248 269 HG1 THR 38 1HG THR 38 12.795 -6.274 10.007 270 HG21 THR 38 3HG2 THR 38 9.640 -6.888 9.236 271 HG22 THR 38 1HG2 THR 38 9.045 -5.242 9.023 272 HG23 THR 38 2HG2 THR 38 9.231 -5.909 10.645 273 H CYS 39 H CYS 39 10.043 -5.289 6.297 274 HA CYS 39 HA CYS 39 9.516 -2.402 6.179 275 HB2 CYS 39 1HB CYS 39 10.409 -3.764 4.161 276 HB3 CYS 39 2HB CYS 39 8.761 -4.367 4.033 277 HG CYS 39 HG CYS 39 9.809 -1.918 2.463 278 H ARG 40 H ARG 40 7.627 -1.663 6.868 279 HA ARG 40 HA ARG 40 5.240 -3.332 6.621 280 HB2 ARG 40 1HB ARG 40 4.567 -2.992 8.906 281 HB3 ARG 40 2HB ARG 40 6.179 -3.694 8.900 282 HG2 ARG 40 1HG ARG 40 7.096 -1.392 9.214 283 HG3 ARG 40 2HG ARG 40 5.437 -0.828 9.427 284 HD2 ARG 40 1HD ARG 40 5.195 -2.468 11.289 285 HD3 ARG 40 2HD ARG 40 6.911 -2.837 11.124 286 HE ARG 40 HE ARG 40 6.513 -0.052 11.460 287 HH11 ARG 40 1HH1 ARG 40 6.492 -3.065 13.204 288 HH12 ARG 40 2HH1 ARG 40 6.903 -2.340 14.722 289 HH21 ARG 40 1HH2 ARG 40 7.055 0.915 13.453 290 HH22 ARG 40 2HH2 ARG 40 7.222 -0.075 14.863 291 H LEU 41 H LEU 41 3.235 -2.044 7.162 292 HA LEU 41 HA LEU 41 3.574 0.703 6.164 293 HB2 LEU 41 1HB LEU 41 1.519 -1.391 5.748 294 HB3 LEU 41 2HB LEU 41 0.965 0.281 5.803 295 HG LEU 41 HG LEU 41 3.205 -0.476 3.974 296 HD11 LEU 41 1HD1 LEU 41 1.420 -2.125 3.585 297 HD12 LEU 41 2HD1 LEU 41 1.635 -1.028 2.222 298 HD13 LEU 41 3HD1 LEU 41 0.279 -0.805 3.328 299 HD21 LEU 41 3HD2 LEU 41 2.950 1.775 3.824 300 HD22 LEU 41 1HD2 LEU 41 1.252 1.728 4.295 301 HD23 LEU 41 2HD2 LEU 41 1.722 1.296 2.651 302 H SER 42 H SER 42 2.135 2.347 7.002 303 HA SER 42 HA SER 42 1.998 2.311 9.834 304 HB2 SER 42 1HB SER 42 2.120 4.300 8.035 305 HB3 SER 42 2HB SER 42 0.382 4.306 8.334 306 HG SER 42 HG SER 42 0.956 4.411 10.618 307 H ASN 43 H ASN 43 -0.046 2.893 11.031 308 HA ASN 43 HA ASN 43 -1.865 0.855 11.010 309 HB2 ASN 43 1HB ASN 43 -1.979 3.670 12.012 310 HB3 ASN 43 2HB ASN 43 -3.448 2.699 12.051 311 HD21 ASN 43 1HD2 ASN 43 -0.317 3.209 13.389 312 HD22 ASN 43 2HD2 ASN 43 -0.443 2.063 14.675 313 H ASN 44 H ASN 44 -2.132 3.958 9.315 314 HA ASN 44 HA ASN 44 -4.566 3.019 7.984 315 HB2 ASN 44 1HB ASN 44 -3.257 5.738 8.136 316 HB3 ASN 44 2HB ASN 44 -4.652 5.393 7.118 317 HD21 ASN 44 1HD2 ASN 44 -4.509 7.272 9.258 318 HD22 ASN 44 2HD2 ASN 44 -5.663 6.784 10.448 319 H GLN 45 H GLN 45 -1.422 2.614 7.498 320 HA GLN 45 HA GLN 45 -0.076 2.191 5.713 321 HB2 GLN 45 1HB GLN 45 -2.674 1.889 4.201 322 HB3 GLN 45 2HB GLN 45 -1.115 1.206 3.761 323 HG2 GLN 45 1HG GLN 45 -1.157 -0.274 5.636 324 HG3 GLN 45 2HG GLN 45 -2.601 0.507 6.279 325 HE21 GLN 45 1HE2 GLN 45 -1.703 -2.236 5.013 326 HE22 GLN 45 2HE2 GLN 45 -3.078 -2.650 4.052 327 H ARG 46 H ARG 46 -0.140 4.801 6.166 328 HA ARG 46 HA ARG 46 -0.616 6.087 3.563 329 HB2 ARG 46 1HB ARG 46 -0.538 7.146 6.373 330 HB3 ARG 46 2HB ARG 46 -0.303 8.220 5.001 331 HG2 ARG 46 1HG ARG 46 -2.671 6.427 4.993 332 HG3 ARG 46 2HG ARG 46 -2.678 7.832 6.061 333 HD2 ARG 46 1HD ARG 46 -2.205 7.874 3.082 334 HD3 ARG 46 2HD ARG 46 -3.698 8.341 3.896 335 HE ARG 46 HE ARG 46 -1.333 9.785 4.728 336 HH11 ARG 46 1HH1 ARG 46 -4.083 9.676 2.596 337 HH12 ARG 46 2HH1 ARG 46 -4.082 11.382 2.295 338 HH21 ARG 46 1HH2 ARG 46 -1.321 12.032 4.340 339 HH22 ARG 46 2HH2 ARG 46 -2.510 12.721 3.287 340 H TYR 47 H TYR 47 1.807 4.800 5.446 341 HA TYR 47 HA TYR 47 3.852 6.005 3.801 342 HB2 TYR 47 1HB TYR 47 4.178 6.251 6.787 343 HB3 TYR 47 2HB TYR 47 5.149 6.991 5.519 344 HD1 TYR 47 2HD TYR 47 1.980 7.163 7.367 345 HD2 TYR 47 1HD TYR 47 4.429 9.016 4.422 346 HE1 TYR 47 2HE TYR 47 0.597 9.192 7.502 347 HE2 TYR 47 1HE TYR 47 3.053 11.051 4.550 348 HH TYR 47 HH TYR 47 0.861 11.634 7.028 349 H LEU 48 H LEU 48 6.062 5.081 4.425 350 HA LEU 48 HA LEU 48 5.713 2.276 5.259 351 HB2 LEU 48 1HB LEU 48 7.459 3.513 3.156 352 HB3 LEU 48 2HB LEU 48 7.810 1.922 3.828 353 HG LEU 48 HG LEU 48 5.185 2.586 2.514 354 HD11 LEU 48 1HD1 LEU 48 6.512 1.031 0.721 355 HD12 LEU 48 2HD1 LEU 48 7.806 2.073 1.312 356 HD13 LEU 48 3HD1 LEU 48 6.352 2.784 0.613 357 HD21 LEU 48 3HD2 LEU 48 6.209 -0.133 2.398 358 HD22 LEU 48 1HD2 LEU 48 4.632 0.463 2.916 359 HD23 LEU 48 2HD2 LEU 48 5.982 0.441 4.051 360 H PHE 49 H PHE 49 7.147 1.396 6.693 361 HA PHE 49 HA PHE 49 9.223 3.193 7.759 362 HB2 PHE 49 1HB PHE 49 7.646 1.222 9.416 363 HB3 PHE 49 2HB PHE 49 8.745 2.472 9.990 364 HD1 PHE 49 1HD PHE 49 7.920 4.833 8.549 365 HD2 PHE 49 2HD PHE 49 5.548 1.719 10.219 366 HE1 PHE 49 1HE PHE 49 6.031 6.394 8.768 367 HE2 PHE 49 2HE PHE 49 3.655 3.275 10.440 368 HZ PHE 49 HZ PHE 49 3.895 5.615 9.713 369 H LEU 50 H LEU 50 11.120 2.210 8.557 370 HA LEU 50 HA LEU 50 11.480 -0.612 7.799 371 HB2 LEU 50 1HB LEU 50 13.515 1.581 7.434 372 HB3 LEU 50 2HB LEU 50 13.703 -0.114 6.989 373 HG LEU 50 HG LEU 50 11.588 1.619 5.744 374 HD11 LEU 50 1HD1 LEU 50 13.901 1.208 4.075 375 HD12 LEU 50 2HD1 LEU 50 14.324 2.100 5.536 376 HD13 LEU 50 3HD1 LEU 50 13.051 2.701 4.474 377 HD21 LEU 50 3HD2 LEU 50 12.766 -1.066 5.271 378 HD22 LEU 50 1HD2 LEU 50 12.265 -0.123 3.868 379 HD23 LEU 50 2HD2 LEU 50 11.095 -0.519 5.127 380 H ASP 51 H ASP 51 12.882 -1.828 9.074 381 HA ASP 51 HA ASP 51 13.911 -0.519 11.498 382 HB2 ASP 51 1HB ASP 51 12.683 -3.268 11.570 383 HB3 ASP 51 2HB ASP 51 13.060 -2.201 12.919 384 H GLY 52 H GLY 52 16.032 -0.798 11.624 385 HA2 GLY 52 1HA GLY 52 17.357 -3.233 11.641 386 HA3 GLY 52 2HA GLY 52 17.444 -2.644 9.988 387 H ASP 53 H ASP 53 19.336 -1.732 9.592 388 HA ASP 53 HA ASP 53 21.313 -1.040 11.304 389 HB2 ASP 53 1HB ASP 53 22.155 0.517 9.571 390 HB3 ASP 53 2HB ASP 53 21.635 -1.024 8.895 391 H SER 54 H SER 54 18.748 1.151 10.180 392 HA SER 54 HA SER 54 18.929 2.641 12.659 393 HB2 SER 54 1HB SER 54 19.845 3.723 10.036 394 HB3 SER 54 2HB SER 54 18.953 4.805 11.104 395 HG SER 54 HG SER 54 21.507 3.896 11.300 396 H HIS 55 H HIS 55 17.207 4.328 12.788 397 HA HIS 55 HA HIS 55 14.717 3.226 11.984 398 HB2 HIS 55 1HB HIS 55 13.750 5.285 12.994 399 HB3 HIS 55 2HB HIS 55 14.877 4.454 14.062 400 HD2 HIS 55 2HD HIS 55 17.444 5.776 14.279 401 HE1 HIS 55 1HE HIS 55 15.904 9.500 12.954 402 HE2 HIS 55 2HE HIS 55 17.873 8.309 13.978 403 H TYR 56 H TYR 56 14.453 3.151 9.796 404 HA TYR 56 HA TYR 56 14.615 5.699 8.331 405 HB2 TYR 56 1HB TYR 56 15.114 2.867 7.563 406 HB3 TYR 56 2HB TYR 56 14.429 3.930 6.338 407 HD1 TYR 56 1HD TYR 56 15.706 5.847 5.499 408 HD2 TYR 56 2HD TYR 56 17.383 3.142 8.323 409 HE1 TYR 56 1HE TYR 56 17.949 6.727 5.002 410 HE2 TYR 56 2HE TYR 56 19.630 4.016 7.835 411 HH TYR 56 HH TYR 56 20.463 5.603 5.249 412 H GLU 57 H GLU 57 12.931 6.297 6.929 413 HA GLU 57 HA GLU 57 10.485 4.730 6.927 414 HB2 GLU 57 1HB GLU 57 10.576 7.539 8.042 415 HB3 GLU 57 2HB GLU 57 9.109 6.627 7.714 416 HG2 GLU 57 1HG GLU 57 9.383 6.326 9.977 417 HG3 GLU 57 2HG GLU 57 10.124 4.871 9.313 418 H ILE 58 H ILE 58 9.849 4.692 4.885 419 HA ILE 58 HA ILE 58 10.537 6.936 3.128 420 HB ILE 58 HB ILE 58 9.565 4.166 2.415 421 HG12 ILE 58 1HG1 ILE 58 12.305 5.262 1.861 422 HG13 ILE 58 2HG1 ILE 58 11.937 4.543 3.425 423 HG21 ILE 58 1HG2 ILE 58 9.726 4.713 0.183 424 HG22 ILE 58 2HG2 ILE 58 9.098 6.210 0.869 425 HG23 ILE 58 3HG2 ILE 58 10.813 6.068 0.484 426 HD11 ILE 58 3HD1 ILE 58 11.941 3.241 0.727 427 HD12 ILE 58 1HD1 ILE 58 12.889 2.827 2.156 428 HD13 ILE 58 2HD1 ILE 58 11.154 2.508 2.125 429 H GLU 59 H GLU 59 8.987 8.455 3.221 430 HA GLU 59 HA GLU 59 6.233 7.898 3.643 431 HB2 GLU 59 1HB GLU 59 7.797 10.337 2.874 432 HB3 GLU 59 2HB GLU 59 6.042 10.359 2.783 433 HG2 GLU 59 1HG GLU 59 6.304 11.146 4.889 434 HG3 GLU 59 2HG GLU 59 6.262 9.420 5.243 435 H ILE 60 H ILE 60 4.770 7.212 2.238 436 HA ILE 60 HA ILE 60 5.315 6.614 -0.431 437 HB ILE 60 HB ILE 60 2.631 7.054 0.883 438 HG12 ILE 60 1HG1 ILE 60 4.027 4.448 0.270 439 HG13 ILE 60 2HG1 ILE 60 4.177 5.267 1.821 440 HG21 ILE 60 1HG2 ILE 60 2.726 7.171 -1.659 441 HG22 ILE 60 2HG2 ILE 60 3.150 5.461 -1.609 442 HG23 ILE 60 3HG2 ILE 60 1.607 6.006 -0.952 443 HD11 ILE 60 3HD1 ILE 60 2.514 3.503 1.908 444 HD12 ILE 60 1HD1 ILE 60 1.770 5.083 2.151 445 HD13 ILE 60 2HD1 ILE 60 1.618 4.266 0.595 446 H VAL 61 H VAL 61 3.753 9.438 1.011 447 HA VAL 61 HA VAL 61 2.738 10.721 -1.183 448 HB VAL 61 HB VAL 61 3.042 12.820 -0.034 449 HG11 VAL 61 1HG1 VAL 61 2.655 11.243 2.381 450 HG12 VAL 61 2HG1 VAL 61 1.531 12.302 1.527 451 HG13 VAL 61 3HG1 VAL 61 1.736 10.629 1.006 452 HG21 VAL 61 3HG2 VAL 61 4.372 12.476 2.277 453 HG22 VAL 61 1HG2 VAL 61 5.278 11.375 1.238 454 HG23 VAL 61 2HG2 VAL 61 5.128 13.077 0.801 455 H HIS 62 H HIS 62 6.076 10.237 -0.354 456 HA HIS 62 HA HIS 62 7.019 12.153 -2.324 457 HB2 HIS 62 1HB HIS 62 8.346 10.382 -0.297 458 HB3 HIS 62 2HB HIS 62 9.291 11.089 -1.605 459 HD2 HIS 62 2HD HIS 62 7.142 12.351 1.451 460 HE1 HIS 62 1HE HIS 62 9.871 15.387 0.295 461 HE2 HIS 62 2HE HIS 62 8.185 14.649 2.016 462 H ILE 63 H ILE 63 7.102 8.640 -1.805 463 HA ILE 63 HA ILE 63 8.548 7.746 -3.910 464 HB ILE 63 HB ILE 63 5.881 6.576 -3.112 465 HG12 ILE 63 1HG1 ILE 63 8.652 6.143 -1.979 466 HG13 ILE 63 2HG1 ILE 63 7.278 6.866 -1.149 467 HG21 ILE 63 1HG2 ILE 63 7.986 4.735 -3.878 468 HG22 ILE 63 2HG2 ILE 63 6.321 4.847 -4.447 469 HG23 ILE 63 3HG2 ILE 63 7.572 5.854 -5.177 470 HD11 ILE 63 3HD1 ILE 63 6.920 4.130 -2.208 471 HD12 ILE 63 1HD1 ILE 63 7.990 4.331 -0.821 472 HD13 ILE 63 2HD1 ILE 63 6.312 4.867 -0.725 473 H SER 64 H SER 64 8.446 7.751 -6.070 474 HA SER 64 HA SER 64 6.059 8.930 -7.317 475 HB2 SER 64 1HB SER 64 8.958 8.853 -8.134 476 HB3 SER 64 2HB SER 64 7.686 9.242 -9.292 477 HG SER 64 HG SER 64 7.834 11.185 -8.524 478 H THR 65 H THR 65 8.571 6.504 -8.051 479 HA THR 65 HA THR 65 6.606 5.063 -9.692 480 HB THR 65 HB THR 65 9.607 4.703 -9.606 481 HG1 THR 65 1HG THR 65 7.958 6.030 -11.518 482 HG21 THR 65 3HG2 THR 65 7.616 3.686 -11.632 483 HG22 THR 65 1HG2 THR 65 8.252 2.715 -10.305 484 HG23 THR 65 2HG2 THR 65 9.341 3.327 -11.550 485 H VAL 66 H VAL 66 6.201 2.878 -9.387 486 HA VAL 66 HA VAL 66 7.490 1.497 -7.169 487 HB VAL 66 HB VAL 66 4.503 1.938 -7.269 488 HG11 VAL 66 1HG1 VAL 66 5.393 -0.373 -6.571 489 HG12 VAL 66 2HG1 VAL 66 5.969 0.450 -5.120 490 HG13 VAL 66 3HG1 VAL 66 4.247 0.440 -5.505 491 HG21 VAL 66 3HG2 VAL 66 5.604 3.861 -6.360 492 HG22 VAL 66 1HG2 VAL 66 4.892 2.957 -5.024 493 HG23 VAL 66 2HG2 VAL 66 6.625 2.854 -5.333 494 H GLN 67 H GLN 67 8.195 -0.258 -8.213 495 HA GLN 67 HA GLN 67 6.219 -1.900 -9.622 496 HB2 GLN 67 1HB GLN 67 7.647 -2.298 -11.485 497 HB3 GLN 67 2HB GLN 67 7.572 -0.555 -11.266 498 HG2 GLN 67 1HG GLN 67 9.740 -0.473 -10.352 499 HG3 GLN 67 2HG GLN 67 9.798 -2.222 -10.141 500 HE21 GLN 67 1HE2 GLN 67 11.024 -3.219 -11.552 501 HE22 GLN 67 2HE2 GLN 67 11.328 -2.724 -13.179 502 H ILE 68 H ILE 68 6.917 -4.155 -9.888 503 HA ILE 68 HA ILE 68 8.527 -4.994 -7.584 504 HB ILE 68 HB ILE 68 6.613 -6.610 -9.274 505 HG12 ILE 68 1HG1 ILE 68 6.270 -5.643 -6.431 506 HG13 ILE 68 2HG1 ILE 68 5.602 -4.805 -7.827 507 HG21 ILE 68 1HG2 ILE 68 8.693 -7.576 -7.824 508 HG22 ILE 68 2HG2 ILE 68 7.404 -7.582 -6.621 509 HG23 ILE 68 3HG2 ILE 68 7.198 -8.457 -8.137 510 HD11 ILE 68 3HD1 ILE 68 3.789 -6.033 -7.369 511 HD12 ILE 68 1HD1 ILE 68 4.655 -7.295 -8.244 512 HD13 ILE 68 2HD1 ILE 68 4.707 -7.249 -6.481 513 H LEU 69 H LEU 69 10.336 -6.213 -7.785 514 HA LEU 69 HA LEU 69 11.521 -6.393 -10.419 515 HB2 LEU 69 1HB LEU 69 12.601 -7.209 -7.725 516 HB3 LEU 69 2HB LEU 69 13.521 -7.148 -9.227 517 HG LEU 69 HG LEU 69 12.273 -4.751 -7.887 518 HD11 LEU 69 1HD1 LEU 69 13.991 -5.549 -6.447 519 HD12 LEU 69 2HD1 LEU 69 14.651 -4.183 -7.346 520 HD13 LEU 69 3HD1 LEU 69 15.082 -5.831 -7.803 521 HD21 LEU 69 3HD2 LEU 69 12.501 -4.112 -10.079 522 HD22 LEU 69 1HD2 LEU 69 13.875 -5.180 -10.363 523 HD23 LEU 69 2HD2 LEU 69 14.094 -3.688 -9.448 524 H THR 70 H THR 70 11.859 -8.205 -11.589 525 HA THR 70 HA THR 70 11.278 -10.809 -10.378 526 HB THR 70 HB THR 70 10.110 -11.345 -12.662 527 HG1 THR 70 1HG THR 70 10.606 -8.919 -13.165 528 HG21 THR 70 3HG2 THR 70 8.344 -11.554 -11.320 529 HG22 THR 70 1HG2 THR 70 8.144 -9.804 -11.253 530 HG23 THR 70 2HG2 THR 70 9.200 -10.615 -10.097 531 H GLU 71 H GLU 71 12.827 -12.221 -10.841 532 HA GLU 71 HA GLU 71 14.968 -11.592 -12.585 533 HB2 GLU 71 1HB GLU 71 14.911 -13.146 -10.502 534 HB3 GLU 71 2HB GLU 71 14.387 -14.381 -11.639 535 HG2 GLU 71 1HG GLU 71 16.735 -14.585 -11.380 536 HG3 GLU 71 2HG GLU 71 16.431 -13.914 -12.982 537 H GLY 72 H GLY 72 12.225 -13.828 -12.847 538 HA2 GLY 72 1HA GLY 72 12.995 -14.417 -15.619 539 HA3 GLY 72 2HA GLY 72 11.824 -15.314 -14.664 540 H PHE 73 H PHE 73 9.904 -15.154 -15.604 541 HA PHE 73 HA PHE 73 9.113 -13.126 -17.361 542 HB2 PHE 73 1HB PHE 73 7.567 -15.181 -15.794 543 HB3 PHE 73 2HB PHE 73 6.758 -14.030 -16.852 544 HD1 PHE 73 2HD PHE 73 9.213 -16.785 -16.758 545 HD2 PHE 73 1HD PHE 73 6.728 -14.328 -19.188 546 HE1 PHE 73 2HE PHE 73 9.643 -18.258 -18.681 547 HE2 PHE 73 1HE PHE 73 7.153 -15.799 -21.115 548 HZ PHE 73 HZ PHE 73 8.613 -17.766 -20.863 549 HA PRO 74 HA PRO 74 8.174 -9.828 -14.566 550 HB2 PRO 74 1HB PRO 74 6.850 -8.249 -16.333 551 HB3 PRO 74 2HB PRO 74 8.608 -8.426 -16.334 552 HG2 PRO 74 1HG PRO 74 6.569 -9.766 -18.068 553 HG3 PRO 74 2HG PRO 74 8.135 -9.068 -18.519 554 HD2 PRO 74 1HD PRO 74 7.771 -11.729 -18.175 555 HD3 PRO 74 2HD PRO 74 9.308 -10.920 -17.806 556 HA PRO 75 HA PRO 75 4.052 -10.356 -13.129 557 HB2 PRO 75 1HB PRO 75 3.415 -7.855 -12.288 558 HB3 PRO 75 2HB PRO 75 4.562 -8.893 -11.433 559 HG2 PRO 75 1HG PRO 75 5.097 -6.654 -13.347 560 HG3 PRO 75 2HG PRO 75 5.905 -7.034 -11.815 561 HD2 PRO 75 1HD PRO 75 6.963 -7.686 -14.221 562 HD3 PRO 75 2HD PRO 75 7.216 -8.673 -12.768 563 H GLY 76 H GLY 76 2.202 -10.607 -14.209 564 HA2 GLY 76 1HA GLY 76 0.968 -8.417 -15.618 565 HA3 GLY 76 2HA GLY 76 1.576 -9.674 -16.684 566 H GLY 77 H GLY 77 0.871 -11.956 -16.028 567 HA2 GLY 77 1HA GLY 77 -1.619 -12.171 -14.602 568 HA3 GLY 77 2HA GLY 77 -1.814 -12.288 -16.345 569 H GLY 78 H GLY 78 -0.256 -13.748 -13.536 570 HA2 GLY 78 1HA GLY 78 -0.787 -16.320 -13.823 571 HA3 GLY 78 2HA GLY 78 0.414 -16.129 -15.092 572 H ASN 79 H ASN 79 1.769 -17.626 -14.001 573 HA ASN 79 HA ASN 79 2.621 -17.465 -11.366 574 HB2 ASN 79 1HB ASN 79 4.162 -18.403 -13.796 575 HB3 ASN 79 2HB ASN 79 4.631 -18.716 -12.127 576 HD21 ASN 79 1HD2 ASN 79 3.270 -20.087 -14.710 577 HD22 ASN 79 2HD2 ASN 79 2.230 -21.237 -13.947 578 H ALA 80 H ALA 80 3.604 -15.878 -10.320 579 HA ALA 80 HA ALA 80 5.657 -14.310 -11.727 580 HB1 ALA 80 1HB ALA 80 4.432 -12.635 -9.799 581 HB2 ALA 80 2HB ALA 80 4.468 -12.447 -11.552 582 HB3 ALA 80 3HB ALA 80 3.155 -13.342 -10.788 583 H ARG 81 H ARG 81 7.231 -15.611 -10.693 584 HA ARG 81 HA ARG 81 7.333 -15.866 -7.847 585 HB2 ARG 81 1HB ARG 81 9.380 -16.393 -10.004 586 HB3 ARG 81 2HB ARG 81 9.657 -16.725 -8.299 587 HG2 ARG 81 1HG ARG 81 7.244 -17.882 -9.593 588 HG3 ARG 81 2HG ARG 81 8.820 -18.594 -9.942 589 HD2 ARG 81 1HD ARG 81 9.155 -18.658 -7.412 590 HD3 ARG 81 2HD ARG 81 7.425 -18.338 -7.295 591 HE ARG 81 HE ARG 81 6.996 -20.485 -8.023 592 HH11 ARG 81 1HH1 ARG 81 10.385 -19.759 -8.354 593 HH12 ARG 81 2HH1 ARG 81 10.839 -21.400 -8.675 594 HH21 ARG 81 1HH2 ARG 81 7.581 -22.649 -8.444 595 HH22 ARG 81 2HH2 ARG 81 9.243 -23.043 -8.727 596 H ALA 82 H ALA 82 7.134 -13.637 -7.221 597 HA ALA 82 HA ALA 82 8.850 -11.573 -7.944 598 HB1 ALA 82 1HB ALA 82 8.293 -10.770 -5.508 599 HB2 ALA 82 2HB ALA 82 7.040 -10.828 -6.749 600 HB3 ALA 82 3HB ALA 82 7.157 -12.120 -5.554 601 H THR 83 H THR 83 10.919 -11.132 -7.544 602 HA THR 83 HA THR 83 12.347 -12.825 -5.611 603 HB THR 83 HB THR 83 13.494 -11.186 -7.880 604 HG1 THR 83 1HG THR 83 13.607 -13.115 -8.983 605 HG21 THR 83 3HG2 THR 83 14.877 -13.390 -6.384 606 HG22 THR 83 1HG2 THR 83 14.921 -11.727 -5.801 607 HG23 THR 83 2HG2 THR 83 15.579 -12.123 -7.389 608 H GLY 84 H GLY 84 11.879 -9.475 -6.635 609 HA2 GLY 84 1HA GLY 84 12.668 -8.595 -3.968 610 HA3 GLY 84 2HA GLY 84 13.622 -7.978 -5.308 611 H MET 85 H MET 85 12.895 -5.870 -4.545 612 HA MET 85 HA MET 85 10.406 -5.118 -5.868 613 HB2 MET 85 1HB MET 85 10.103 -5.566 -3.319 614 HB3 MET 85 2HB MET 85 10.938 -4.031 -3.123 615 HG2 MET 85 1HG MET 85 8.803 -3.282 -3.132 616 HG3 MET 85 2HG MET 85 9.124 -3.228 -4.863 617 HE1 MET 85 3HE MET 85 5.868 -4.086 -2.975 618 HE2 MET 85 1HE MET 85 6.569 -2.873 -4.047 619 HE3 MET 85 2HE MET 85 5.462 -4.085 -4.692 620 H PHE 86 H PHE 86 10.275 -2.880 -6.398 621 HA PHE 86 HA PHE 86 12.772 -1.367 -6.072 622 HB2 PHE 86 1HB PHE 86 12.628 -2.487 -8.336 623 HB3 PHE 86 2HB PHE 86 11.230 -1.470 -8.666 624 HD1 PHE 86 2HD PHE 86 14.789 -1.225 -7.598 625 HD2 PHE 86 1HD PHE 86 11.542 0.574 -9.680 626 HE1 PHE 86 2HE PHE 86 16.284 0.570 -8.371 627 HE2 PHE 86 1HE PHE 86 13.031 2.371 -10.457 628 HZ PHE 86 HZ PHE 86 15.405 2.372 -9.802 629 H LEU 87 H LEU 87 12.173 0.302 -4.844 630 HA LEU 87 HA LEU 87 9.736 1.774 -5.607 631 HB2 LEU 87 1HB LEU 87 10.943 1.562 -2.854 632 HB3 LEU 87 2HB LEU 87 9.466 2.419 -3.288 633 HG LEU 87 HG LEU 87 9.620 -0.509 -3.818 634 HD11 LEU 87 1HD1 LEU 87 9.184 -1.146 -1.629 635 HD12 LEU 87 2HD1 LEU 87 8.801 0.498 -1.120 636 HD13 LEU 87 3HD1 LEU 87 10.473 0.044 -1.451 637 HD21 LEU 87 3HD2 LEU 87 7.709 1.188 -4.368 638 HD22 LEU 87 1HD2 LEU 87 7.312 0.988 -2.661 639 HD23 LEU 87 2HD2 LEU 87 7.323 -0.412 -3.734 640 H GLN 88 H GLN 88 10.060 3.784 -6.282 641 HA GLN 88 HA GLN 88 12.666 5.030 -5.775 642 HB2 GLN 88 1HB GLN 88 10.583 5.391 -7.907 643 HB3 GLN 88 2HB GLN 88 11.790 6.637 -7.615 644 HG2 GLN 88 1HG GLN 88 13.548 4.894 -7.959 645 HG3 GLN 88 2HG GLN 88 12.267 3.792 -8.460 646 HE21 GLN 88 1HE2 GLN 88 14.234 6.471 -9.329 647 HE22 GLN 88 2HE2 GLN 88 13.694 6.620 -10.963 648 H TYR 89 H TYR 89 12.787 7.269 -5.208 649 HA TYR 89 HA TYR 89 10.504 8.786 -4.478 650 HB2 TYR 89 1HB TYR 89 10.928 8.798 -2.011 651 HB3 TYR 89 2HB TYR 89 10.312 7.268 -2.624 652 HD1 TYR 89 1HD TYR 89 13.535 8.970 -1.815 653 HD2 TYR 89 2HD TYR 89 11.390 5.302 -2.032 654 HE1 TYR 89 1HE TYR 89 15.441 7.802 -0.791 655 HE2 TYR 89 2HE TYR 89 13.290 4.124 -1.007 656 HH TYR 89 HH TYR 89 16.277 5.210 -0.886 657 H THR 90 H THR 90 11.110 10.818 -3.357 658 HA THR 90 HA THR 90 13.854 11.597 -4.089 659 HB THR 90 HB THR 90 13.031 13.897 -4.267 660 HG1 THR 90 1HG THR 90 11.315 13.902 -2.831 661 HG21 THR 90 3HG2 THR 90 11.013 12.967 -5.997 662 HG22 THR 90 1HG2 THR 90 12.250 11.711 -5.954 663 HG23 THR 90 2HG2 THR 90 12.684 13.360 -6.402 664 H VAL 91 H VAL 91 14.854 13.288 -2.747 665 HA VAL 91 HA VAL 91 13.980 13.144 0.064 666 HB VAL 91 HB VAL 91 16.815 13.062 -0.976 667 HG11 VAL 91 1HG1 VAL 91 17.591 13.649 1.035 668 HG12 VAL 91 2HG1 VAL 91 15.965 14.259 1.352 669 HG13 VAL 91 3HG1 VAL 91 16.419 12.637 1.877 670 HG21 VAL 91 3HG2 VAL 91 15.823 10.908 -1.155 671 HG22 VAL 91 1HG2 VAL 91 16.836 10.888 0.288 672 HG23 VAL 91 2HG2 VAL 91 15.086 11.043 0.441 673 HA PRO 92 HA PRO 92 13.969 17.562 -0.238 674 HB2 PRO 92 1HB PRO 92 13.654 18.077 2.408 675 HB3 PRO 92 2HB PRO 92 12.337 17.505 1.378 676 HG2 PRO 92 1HG PRO 92 14.074 15.960 3.263 677 HG3 PRO 92 2HG PRO 92 12.323 15.849 3.010 678 HD2 PRO 92 1HD PRO 92 14.066 14.083 1.926 679 HD3 PRO 92 2HD PRO 92 12.551 14.544 1.123 680 H GLY 93 H GLY 93 15.955 18.332 -0.778 681 HA2 GLY 93 1HA GLY 93 17.651 19.789 0.387 682 HA3 GLY 93 2HA GLY 93 18.013 18.357 1.341 683 H THR 94 H THR 94 17.933 16.429 -0.697 684 HA THR 94 HA THR 94 20.495 16.970 -1.953 685 HB THR 94 HB THR 94 19.881 14.767 -0.803 686 HG1 THR 94 1HG THR 94 21.727 14.771 -2.008 687 HG21 THR 94 3HG2 THR 94 18.610 14.128 -3.454 688 HG22 THR 94 1HG2 THR 94 17.664 14.629 -2.053 689 HG23 THR 94 2HG2 THR 94 18.628 13.153 -1.985 690 H GLU 95 H GLU 95 20.811 16.217 -4.248 691 HA GLU 95 HA GLU 95 18.545 17.137 -5.888 692 HB2 GLU 95 1HB GLU 95 20.245 17.727 -7.593 693 HB3 GLU 95 2HB GLU 95 20.452 18.609 -6.086 694 HG2 GLU 95 1HG GLU 95 22.218 17.005 -5.438 695 HG3 GLU 95 2HG GLU 95 22.054 16.238 -7.017 696 H GLY 96 H GLY 96 17.538 15.610 -7.003 697 HA2 GLY 96 1HA GLY 96 17.864 13.982 -8.856 698 HA3 GLY 96 2HA GLY 96 19.099 13.245 -7.846 699 H VAL 97 H VAL 97 17.746 11.308 -8.302 700 HA VAL 97 HA VAL 97 15.594 11.099 -6.300 701 HB VAL 97 HB VAL 97 15.668 9.779 -9.016 702 HG11 VAL 97 1HG1 VAL 97 14.379 8.200 -8.129 703 HG12 VAL 97 2HG1 VAL 97 14.323 9.042 -6.579 704 HG13 VAL 97 3HG1 VAL 97 13.156 9.437 -7.841 705 HG21 VAL 97 3HG2 VAL 97 13.394 11.090 -9.084 706 HG22 VAL 97 1HG2 VAL 97 14.191 12.105 -7.882 707 HG23 VAL 97 2HG2 VAL 97 14.911 11.898 -9.478 708 H THR 98 H THR 98 15.528 9.250 -5.074 709 HA THR 98 HA THR 98 17.872 7.488 -5.317 710 HB THR 98 HB THR 98 16.136 8.030 -2.900 711 HG1 THR 98 1HG THR 98 17.721 9.683 -3.690 712 HG21 THR 98 3HG2 THR 98 16.983 5.781 -2.793 713 HG22 THR 98 1HG2 THR 98 17.922 6.781 -1.685 714 HG23 THR 98 2HG2 THR 98 18.599 6.320 -3.247 715 H GLN 99 H GLN 99 17.644 5.252 -5.174 716 HA GLN 99 HA GLN 99 14.890 4.251 -5.492 717 HB2 GLN 99 1HB GLN 99 15.694 2.592 -7.037 718 HB3 GLN 99 2HB GLN 99 16.243 4.171 -7.582 719 HG2 GLN 99 1HG GLN 99 17.966 2.332 -5.953 720 HG3 GLN 99 2HG GLN 99 17.910 2.281 -7.714 721 HE21 GLN 99 1HE2 GLN 99 18.164 4.539 -8.725 722 HE22 GLN 99 2HE2 GLN 99 19.453 5.496 -8.087 723 H LEU 100 H LEU 100 14.452 2.133 -4.688 724 HA LEU 100 HA LEU 100 16.389 1.174 -2.688 725 HB2 LEU 100 1HB LEU 100 14.247 2.440 -1.890 726 HB3 LEU 100 2HB LEU 100 13.446 0.912 -2.252 727 HG LEU 100 HG LEU 100 15.288 -0.094 -0.697 728 HD11 LEU 100 1HD1 LEU 100 15.411 2.831 -0.128 729 HD12 LEU 100 2HD1 LEU 100 16.712 1.644 -0.205 730 HD13 LEU 100 3HD1 LEU 100 15.629 1.675 1.186 731 HD21 LEU 100 3HD2 LEU 100 13.022 1.533 0.446 732 HD22 LEU 100 1HD2 LEU 100 13.803 0.137 1.189 733 HD23 LEU 100 2HD2 LEU 100 12.852 -0.065 -0.282 734 H LYS 101 H LYS 101 16.681 -1.000 -2.549 735 HA LYS 101 HA LYS 101 15.075 -2.676 -4.366 736 HB2 LYS 101 1HB LYS 101 17.624 -2.155 -4.845 737 HB3 LYS 101 2HB LYS 101 17.877 -3.426 -3.657 738 HG2 LYS 101 1HG LYS 101 16.711 -5.014 -4.995 739 HG3 LYS 101 2HG LYS 101 16.169 -3.759 -6.111 740 HD2 LYS 101 1HD LYS 101 18.699 -3.324 -6.463 741 HD3 LYS 101 2HD LYS 101 18.905 -4.931 -5.763 742 HE2 LYS 101 1HE LYS 101 17.624 -5.938 -7.492 743 HE3 LYS 101 2HE LYS 101 17.076 -4.371 -8.087 744 HZ1 LYS 101 3HZ LYS 101 18.822 -5.307 -9.479 745 HZ2 LYS 101 1HZ LYS 101 19.880 -5.348 -8.159 746 HZ3 LYS 101 2HZ LYS 101 19.332 -3.864 -8.758 747 H LEU 102 H LEU 102 14.066 -4.354 -3.469 748 HA LEU 102 HA LEU 102 14.884 -5.176 -0.761 749 HB2 LEU 102 1HB LEU 102 12.151 -5.251 -2.031 750 HB3 LEU 102 2HB LEU 102 12.542 -5.872 -0.429 751 HG LEU 102 HG LEU 102 12.791 -2.978 -1.243 752 HD11 LEU 102 1HD1 LEU 102 10.555 -4.527 0.002 753 HD12 LEU 102 2HD1 LEU 102 10.501 -3.320 -1.283 754 HD13 LEU 102 3HD1 LEU 102 10.789 -2.821 0.384 755 HD21 LEU 102 3HD2 LEU 102 14.260 -3.387 0.549 756 HD22 LEU 102 1HD2 LEU 102 13.111 -4.455 1.355 757 HD23 LEU 102 2HD2 LEU 102 12.802 -2.720 1.285 758 H THR 103 H THR 103 15.116 -7.326 -0.305 759 HA THR 103 HA THR 103 14.658 -9.226 -2.506 760 HB THR 103 HB THR 103 17.052 -9.354 -0.671 761 HG1 THR 103 1HG THR 103 18.086 -8.092 -2.028 762 HG21 THR 103 3HG2 THR 103 15.900 -11.275 -2.284 763 HG22 THR 103 1HG2 THR 103 17.561 -11.282 -1.693 764 HG23 THR 103 2HG2 THR 103 17.196 -10.625 -3.288 765 H VAL 104 H VAL 104 14.035 -11.297 -1.925 766 HA VAL 104 HA VAL 104 12.610 -11.556 0.507 767 HB VAL 104 HB VAL 104 13.354 -13.559 -1.617 768 HG11 VAL 104 1HG1 VAL 104 11.306 -14.694 -0.174 769 HG12 VAL 104 2HG1 VAL 104 13.005 -15.164 -0.101 770 HG13 VAL 104 3HG1 VAL 104 12.353 -14.026 1.078 771 HG21 VAL 104 3HG2 VAL 104 11.456 -11.584 -1.585 772 HG22 VAL 104 1HG2 VAL 104 11.409 -13.032 -2.590 773 HG23 VAL 104 2HG2 VAL 104 10.543 -12.996 -1.054 774 H VAL 105 H VAL 105 13.140 -12.450 2.419 775 HA VAL 105 HA VAL 105 15.808 -13.683 2.657 776 HB VAL 105 HB VAL 105 14.401 -11.948 4.691 777 HG11 VAL 105 1HG1 VAL 105 15.573 -13.283 6.097 778 HG12 VAL 105 2HG1 VAL 105 16.731 -13.763 4.855 779 HG13 VAL 105 3HG1 VAL 105 16.886 -12.195 5.649 780 HG21 VAL 105 3HG2 VAL 105 16.440 -11.431 2.628 781 HG22 VAL 105 1HG2 VAL 105 15.278 -10.337 3.378 782 HG23 VAL 105 2HG2 VAL 105 16.772 -10.749 4.220 783 H GLU 106 H GLU 106 16.023 -15.469 3.981 784 HA GLU 106 HA GLU 106 13.517 -16.828 4.625 785 HB2 GLU 106 1HB GLU 106 14.959 -18.837 4.896 786 HB3 GLU 106 2HB GLU 106 15.059 -18.115 3.296 787 HG2 GLU 106 1HG GLU 106 17.154 -16.996 3.972 788 HG3 GLU 106 2HG GLU 106 17.066 -17.834 5.520 789 H ASP 107 H ASP 107 12.762 -16.816 6.625 790 HA ASP 107 HA ASP 107 14.585 -16.996 8.884 791 HB2 ASP 107 1HB ASP 107 12.484 -14.838 8.909 792 HB3 ASP 107 2HB ASP 107 13.844 -15.057 10.007 793 H VAL 108 H VAL 108 13.150 -16.985 10.996 794 HA VAL 108 HA VAL 108 11.752 -19.262 11.218 795 HB VAL 108 HB VAL 108 10.483 -18.283 13.102 796 HG11 VAL 108 1HG1 VAL 108 12.464 -18.924 13.971 797 HG12 VAL 108 2HG1 VAL 108 13.401 -18.044 12.761 798 HG13 VAL 108 3HG1 VAL 108 12.713 -17.187 14.140 799 HG21 VAL 108 3HG2 VAL 108 10.051 -16.087 12.055 800 HG22 VAL 108 1HG2 VAL 108 10.727 -15.947 13.678 801 HG23 VAL 108 2HG2 VAL 108 11.753 -15.676 12.269 802 H THR 109 H THR 109 10.448 -16.208 10.035 803 HA THR 109 HA THR 109 7.748 -16.770 9.966 804 HB THR 109 HB THR 109 7.632 -15.245 7.980 805 HG1 THR 109 1HG THR 109 9.489 -15.462 6.882 806 HG21 THR 109 3HG2 THR 109 8.166 -14.656 10.595 807 HG22 THR 109 1HG2 THR 109 7.762 -13.469 9.355 808 HG23 THR 109 2HG2 THR 109 9.450 -13.785 9.757 809 H VAL 110 H VAL 110 6.345 -17.514 8.291 810 HA VAL 110 HA VAL 110 6.658 -19.965 7.302 811 HB VAL 110 HB VAL 110 4.598 -18.666 6.995 812 HG11 VAL 110 1HG1 VAL 110 5.657 -17.455 4.490 813 HG12 VAL 110 2HG1 VAL 110 4.349 -16.912 5.542 814 HG13 VAL 110 3HG1 VAL 110 6.028 -16.680 6.030 815 HG21 VAL 110 3HG2 VAL 110 5.176 -20.755 5.649 816 HG22 VAL 110 1HG2 VAL 110 3.875 -19.737 5.033 817 HG23 VAL 110 2HG2 VAL 110 5.476 -19.661 4.299 818 H GLY 111 H GLY 111 7.910 -17.047 5.738 819 HA2 GLY 111 1HA GLY 111 10.158 -17.421 4.692 820 HA3 GLY 111 2HA GLY 111 9.412 -18.793 3.886 821 H ARG 112 H ARG 112 9.840 -18.017 1.822 822 HA ARG 112 HA ARG 112 9.460 -15.497 0.811 823 HB2 ARG 112 1HB ARG 112 10.344 -17.637 -0.338 824 HB3 ARG 112 2HB ARG 112 8.664 -17.925 -0.773 825 HG2 ARG 112 1HG ARG 112 8.608 -16.206 -2.264 826 HG3 ARG 112 2HG ARG 112 9.813 -15.261 -1.388 827 HD2 ARG 112 1HD ARG 112 11.587 -16.421 -2.316 828 HD3 ARG 112 2HD ARG 112 10.598 -17.831 -2.693 829 HE ARG 112 HE ARG 112 9.569 -15.851 -4.258 830 HH11 ARG 112 1HH1 ARG 112 12.737 -17.221 -3.802 831 HH12 ARG 112 2HH1 ARG 112 13.248 -16.911 -5.429 832 HH21 ARG 112 1HH2 ARG 112 10.230 -15.438 -6.402 833 HH22 ARG 112 2HH2 ARG 112 11.821 -15.896 -6.906 834 H ARG 113 H ARG 113 7.039 -18.071 1.130 835 HA ARG 113 HA ARG 113 4.875 -17.124 -0.145 836 HB2 ARG 113 1HB ARG 113 5.129 -18.424 2.542 837 HB3 ARG 113 2HB ARG 113 3.548 -17.910 1.970 838 HG2 ARG 113 1HG ARG 113 3.857 -20.225 1.443 839 HG3 ARG 113 2HG ARG 113 3.877 -19.292 -0.055 840 HD2 ARG 113 1HD ARG 113 6.132 -19.617 -0.384 841 HD3 ARG 113 2HD ARG 113 6.453 -19.869 1.331 842 HE ARG 113 HE ARG 113 4.959 -22.013 0.711 843 HH11 ARG 113 1HH1 ARG 113 7.757 -20.594 -0.799 844 HH12 ARG 113 2HH1 ARG 113 8.350 -22.101 -1.416 845 HH21 ARG 113 1HH2 ARG 113 5.729 -24.003 -0.096 846 HH22 ARG 113 2HH2 ARG 113 7.195 -24.039 -1.016 847 H GLN 114 H GLN 114 5.933 -15.996 3.056 848 HA GLN 114 HA GLN 114 3.876 -14.079 3.364 849 HB2 GLN 114 1HB GLN 114 5.043 -14.842 5.310 850 HB3 GLN 114 2HB GLN 114 6.594 -14.348 4.646 851 HG2 GLN 114 1HG GLN 114 5.701 -12.856 6.423 852 HG3 GLN 114 2HG GLN 114 6.065 -12.048 4.899 853 HE21 GLN 114 1HE2 GLN 114 3.317 -13.827 6.281 854 HE22 GLN 114 2HE2 GLN 114 2.126 -12.647 5.865 855 H ALA 115 H ALA 115 7.342 -13.576 2.673 856 HA ALA 115 HA ALA 115 7.379 -10.907 2.173 857 HB1 ALA 115 1HB ALA 115 8.915 -13.191 1.065 858 HB2 ALA 115 2HB ALA 115 9.097 -11.619 0.286 859 HB3 ALA 115 3HB ALA 115 9.466 -11.802 2.001 860 H VAL 116 H VAL 116 7.046 -13.279 -0.475 861 HA VAL 116 HA VAL 116 6.416 -11.620 -2.533 862 HB VAL 116 HB VAL 116 5.131 -14.299 -1.984 863 HG11 VAL 116 1HG1 VAL 116 4.497 -14.403 -4.237 864 HG12 VAL 116 2HG1 VAL 116 4.048 -12.775 -3.726 865 HG13 VAL 116 3HG1 VAL 116 5.512 -13.029 -4.677 866 HG21 VAL 116 3HG2 VAL 116 7.737 -13.950 -2.159 867 HG22 VAL 116 1HG2 VAL 116 6.945 -15.319 -2.940 868 HG23 VAL 116 2HG2 VAL 116 7.387 -13.898 -3.886 869 H ALA 117 H ALA 117 4.057 -13.042 -0.273 870 HA ALA 117 HA ALA 117 1.733 -11.968 -1.277 871 HB1 ALA 117 1HB ALA 117 0.775 -12.771 0.584 872 HB2 ALA 117 2HB ALA 117 2.376 -13.426 0.928 873 HB3 ALA 117 3HB ALA 117 1.876 -11.896 1.648 874 H TRP 118 H TRP 118 4.132 -10.430 0.804 875 HA TRP 118 HA TRP 118 2.596 -8.031 1.155 876 HB2 TRP 118 1HB TRP 118 4.288 -8.844 2.804 877 HB3 TRP 118 2HB TRP 118 5.551 -8.463 1.636 878 HD1 TRP 118 HD TRP 118 3.477 -6.923 4.337 879 HE1 TRP 118 1HE TRP 118 4.005 -4.410 4.523 880 HE3 TRP 118 3HE TRP 118 6.194 -6.345 0.046 881 HZ2 TRP 118 2HZ TRP 118 5.390 -2.444 3.046 882 HZ3 TRP 118 3HZ TRP 118 7.084 -4.116 -0.495 883 HH2 TRP 118 HH TRP 118 6.689 -2.207 0.975 884 H LEU 119 H LEU 119 5.437 -8.936 -0.777 885 HA LEU 119 HA LEU 119 5.996 -6.498 -1.947 886 HB2 LEU 119 1HB LEU 119 6.161 -9.229 -3.211 887 HB3 LEU 119 2HB LEU 119 6.962 -7.778 -3.810 888 HG LEU 119 HG LEU 119 7.520 -9.027 -1.122 889 HD11 LEU 119 1HD1 LEU 119 8.428 -9.748 -3.793 890 HD12 LEU 119 2HD1 LEU 119 8.566 -10.627 -2.270 891 HD13 LEU 119 3HD1 LEU 119 9.749 -9.385 -2.682 892 HD21 LEU 119 3HD2 LEU 119 8.101 -6.499 -2.131 893 HD22 LEU 119 1HD2 LEU 119 9.596 -7.417 -2.320 894 HD23 LEU 119 2HD2 LEU 119 8.840 -7.280 -0.732 895 H VAL 120 H VAL 120 3.754 -9.006 -3.098 896 HA VAL 120 HA VAL 120 2.871 -7.493 -5.348 897 HB VAL 120 HB VAL 120 2.714 -9.949 -5.283 898 HG11 VAL 120 1HG1 VAL 120 2.107 -10.725 -3.246 899 HG12 VAL 120 2HG1 VAL 120 1.047 -9.353 -2.917 900 HG13 VAL 120 3HG1 VAL 120 0.496 -10.664 -3.961 901 HG21 VAL 120 3HG2 VAL 120 0.013 -8.627 -5.533 902 HG22 VAL 120 1HG2 VAL 120 1.265 -8.623 -6.775 903 HG23 VAL 120 2HG2 VAL 120 0.516 -10.142 -6.283 904 H ALA 121 H ALA 121 1.922 -7.696 -2.012 905 HA ALA 121 HA ALA 121 -0.688 -6.648 -2.230 906 HB1 ALA 121 1HB ALA 121 0.264 -5.816 0.239 907 HB2 ALA 121 2HB ALA 121 -0.590 -7.319 -0.111 908 HB3 ALA 121 3HB ALA 121 1.173 -7.287 -0.109 909 H MET 122 H MET 122 2.412 -5.056 -1.485 910 HA MET 122 HA MET 122 1.459 -2.458 -1.215 911 HB2 MET 122 1HB MET 122 3.771 -3.253 -0.669 912 HB3 MET 122 2HB MET 122 4.128 -3.249 -2.391 913 HG2 MET 122 1HG MET 122 4.949 -1.212 -1.843 914 HG3 MET 122 2HG MET 122 3.284 -0.758 -2.202 915 HE1 MET 122 3HE MET 122 3.387 1.651 0.633 916 HE2 MET 122 1HE MET 122 4.826 1.415 -0.360 917 HE3 MET 122 2HE MET 122 3.225 1.325 -1.093 918 H HIS 123 H HIS 123 2.780 -4.033 -4.126 919 HA HIS 123 HA HIS 123 2.446 -1.910 -5.893 920 HB2 HIS 123 1HB HIS 123 3.651 -4.133 -6.278 921 HB3 HIS 123 2HB HIS 123 2.070 -4.798 -6.677 922 HD2 HIS 123 2HD HIS 123 4.898 -2.819 -8.323 923 HE1 HIS 123 1HE HIS 123 1.614 -2.760 -11.008 924 HE2 HIS 123 2HE HIS 123 4.082 -2.341 -10.730 925 H LYS 124 H LYS 124 0.145 -4.293 -4.744 926 HA LYS 124 HA LYS 124 -1.903 -3.656 -6.626 927 HB2 LYS 124 1HB LYS 124 -1.696 -5.287 -4.146 928 HB3 LYS 124 2HB LYS 124 -3.303 -4.772 -4.639 929 HG2 LYS 124 1HG LYS 124 -2.481 -5.710 -6.976 930 HG3 LYS 124 2HG LYS 124 -1.437 -6.676 -5.932 931 HD2 LYS 124 1HD LYS 124 -3.625 -7.159 -4.621 932 HD3 LYS 124 2HD LYS 124 -4.426 -6.628 -6.101 933 HE2 LYS 124 1HE LYS 124 -4.256 -8.877 -6.503 934 HE3 LYS 124 2HE LYS 124 -2.752 -8.311 -7.226 935 HZ1 LYS 124 3HZ LYS 124 -2.323 -8.829 -4.497 936 HZ2 LYS 124 1HZ LYS 124 -1.625 -9.590 -5.837 937 HZ3 LYS 124 2HZ LYS 124 -3.070 -10.180 -5.188 938 H ALA 125 H ALA 125 -1.350 -2.794 -3.220 939 HA ALA 125 HA ALA 125 -3.635 -1.173 -2.931 940 HB1 ALA 125 1HB ALA 125 -2.532 -1.964 -0.975 941 HB2 ALA 125 2HB ALA 125 -1.015 -1.198 -1.447 942 HB3 ALA 125 3HB ALA 125 -2.396 -0.205 -0.980 943 H ALA 126 H ALA 126 -0.232 -0.236 -3.463 944 HA ALA 126 HA ALA 126 -0.297 2.427 -3.597 945 HB1 ALA 126 1HB ALA 126 1.643 2.305 -4.727 946 HB2 ALA 126 2HB ALA 126 1.459 0.567 -4.483 947 HB3 ALA 126 3HB ALA 126 0.956 1.301 -6.005 948 H LYS 127 H LYS 127 -1.621 0.293 -6.082 949 HA LYS 127 HA LYS 127 -2.229 2.162 -8.040 950 HB2 LYS 127 1HB LYS 127 -3.586 -0.402 -7.229 951 HB3 LYS 127 2HB LYS 127 -4.148 0.554 -8.594 952 HG2 LYS 127 1HG LYS 127 -1.905 0.343 -9.613 953 HG3 LYS 127 2HG LYS 127 -1.433 -0.710 -8.277 954 HD2 LYS 127 1HD LYS 127 -3.215 -2.278 -8.892 955 HD3 LYS 127 2HD LYS 127 -3.676 -1.225 -10.231 956 HE2 LYS 127 1HE LYS 127 -1.692 -1.656 -11.399 957 HE3 LYS 127 2HE LYS 127 -0.886 -2.296 -9.968 958 HZ1 LYS 127 3HZ LYS 127 -2.863 -4.021 -10.154 959 HZ2 LYS 127 1HZ LYS 127 -1.405 -4.233 -10.987 960 HZ3 LYS 127 2HZ LYS 127 -2.753 -3.602 -11.789 961 H LEU 128 H LEU 128 -4.247 1.081 -5.315 962 HA LEU 128 HA LEU 128 -6.493 2.632 -5.842 963 HB2 LEU 128 1HB LEU 128 -5.309 1.605 -3.282 964 HB3 LEU 128 2HB LEU 128 -6.811 2.526 -3.307 965 HG LEU 128 HG LEU 128 -6.456 -0.004 -4.893 966 HD11 LEU 128 1HD1 LEU 128 -6.611 -1.257 -3.072 967 HD12 LEU 128 2HD1 LEU 128 -8.045 -0.376 -2.546 968 HD13 LEU 128 3HD1 LEU 128 -6.441 0.196 -2.087 969 HD21 LEU 128 3HD2 LEU 128 -9.036 0.953 -3.782 970 HD22 LEU 128 1HD2 LEU 128 -8.694 0.108 -5.292 971 HD23 LEU 128 2HD2 LEU 128 -8.353 1.833 -5.150 972 H LEU 129 H LEU 129 -3.581 3.430 -3.986 973 HA LEU 129 HA LEU 129 -4.317 5.886 -2.962 974 HB2 LEU 129 1HB LEU 129 -1.746 4.639 -3.754 975 HB3 LEU 129 2HB LEU 129 -1.747 6.377 -3.461 976 HG LEU 129 HG LEU 129 -2.598 4.272 -1.473 977 HD11 LEU 129 1HD1 LEU 129 -0.365 3.980 -1.350 978 HD12 LEU 129 2HD1 LEU 129 -0.445 5.454 -0.386 979 HD13 LEU 129 3HD1 LEU 129 -0.008 5.539 -2.093 980 HD21 LEU 129 3HD2 LEU 129 -2.217 6.411 0.021 981 HD22 LEU 129 1HD2 LEU 129 -3.764 6.107 -0.770 982 HD23 LEU 129 2HD2 LEU 129 -2.620 7.247 -1.480 983 H TYR 130 H TYR 130 -2.636 5.293 -6.051 984 HA TYR 130 HA TYR 130 -3.041 8.026 -6.887 985 HB2 TYR 130 1HB TYR 130 -2.117 5.874 -8.751 986 HB3 TYR 130 2HB TYR 130 -1.620 7.560 -8.660 987 HD1 TYR 130 2HD TYR 130 -0.917 7.788 -5.794 988 HD2 TYR 130 1HD TYR 130 -0.118 4.681 -8.589 989 HE1 TYR 130 2HE TYR 130 1.067 7.136 -4.494 990 HE2 TYR 130 1HE TYR 130 1.867 4.019 -7.296 991 HH TYR 130 HH TYR 130 3.438 5.035 -5.686 992 H GLU 131 H GLU 131 -3.918 4.892 -8.358 993 HA GLU 131 HA GLU 131 -5.854 6.046 -10.087 994 HB2 GLU 131 1HB GLU 131 -5.481 3.168 -9.239 995 HB3 GLU 131 2HB GLU 131 -6.497 3.710 -10.567 996 HG2 GLU 131 1HG GLU 131 -4.328 4.781 -11.476 997 HG3 GLU 131 2HG GLU 131 -3.519 3.679 -10.363 998 H SER 132 H SER 132 -8.159 4.977 -10.071 999 HA SER 132 HA SER 132 -9.242 5.291 -7.347 1000 HB2 SER 132 1HB SER 132 -10.605 5.988 -9.960 1001 HB3 SER 132 2HB SER 132 -11.263 6.234 -8.342 1002 HG SER 132 HG SER 132 -9.349 7.594 -7.993 1003 H ARG 133 H ARG 133 -9.871 3.774 -10.505 1004 HA ARG 133 HA ARG 133 -10.990 1.464 -9.071 1005 HB2 ARG 133 1HB ARG 133 -12.106 2.656 -11.617 1006 HB3 ARG 133 2HB ARG 133 -12.699 1.212 -10.807 1007 HG2 ARG 133 1HG ARG 133 -12.709 3.985 -9.634 1008 HG3 ARG 133 2HG ARG 133 -14.095 3.181 -10.372 1009 HD2 ARG 133 1HD ARG 133 -13.526 1.299 -8.635 1010 HD3 ARG 133 2HD ARG 133 -12.722 2.617 -7.785 1011 HE ARG 133 HE ARG 133 -15.427 3.200 -8.587 1012 HH11 ARG 133 1HH1 ARG 133 -13.378 1.862 -6.111 1013 HH12 ARG 133 2HH1 ARG 133 -14.531 2.105 -4.841 1014 HH21 ARG 133 1HH2 ARG 133 -16.954 3.525 -6.924 1015 HH22 ARG 133 2HH2 ARG 133 -16.566 3.051 -5.305 1016 H ASP 134 H ASP 134 -10.396 -0.511 -9.824 1017 HA ASP 134 HA ASP 134 -8.720 -0.575 -12.247 1018 HB2 ASP 134 1HB ASP 134 -7.528 -2.515 -11.039 1019 HB3 ASP 134 2HB ASP 134 -7.167 -0.873 -10.513 1020 H GLN 135 H GLN 135 -9.245 -2.048 -13.741 1021 HA GLN 135 HA GLN 135 -11.634 -3.576 -13.442 1022 HB2 GLN 135 1HB GLN 135 -10.791 -2.550 -15.589 1023 HB3 GLN 135 2HB GLN 135 -9.581 -3.824 -15.641 1024 HG2 GLN 135 1HG GLN 135 -11.390 -5.498 -15.669 1025 HG3 GLN 135 2HG GLN 135 -12.567 -4.187 -15.714 1026 HE21 GLN 135 1HE2 GLN 135 -13.408 -4.124 -17.669 1027 HE22 GLN 135 2HE2 GLN 135 -12.532 -4.193 -19.156 1028 H SER 136 H SER 136 -11.145 -4.929 -11.646 1029 HA SER 136 HA SER 136 -9.166 -7.039 -12.146 1030 HB2 SER 136 1HB SER 136 -9.171 -7.470 -9.800 1031 HB3 SER 136 2HB SER 136 -9.135 -5.715 -9.976 1032 HG SER 136 HG SER 136 -10.684 -6.542 -8.417 1033 H GLY 137 H GLY 137 -9.816 -8.981 -12.789 1034 HA2 GLY 137 1HA GLY 137 -11.112 -10.891 -12.949 1035 HA3 GLY 137 2HA GLY 137 -12.243 -10.176 -11.810 1036 HA PRO 138 HA PRO 138 -13.365 -8.694 -16.310 1037 HB2 PRO 138 1HB PRO 138 -12.500 -10.358 -18.273 1038 HB3 PRO 138 2HB PRO 138 -11.569 -8.962 -17.718 1039 HG2 PRO 138 1HG PRO 138 -11.264 -11.850 -16.993 1040 HG3 PRO 138 2HG PRO 138 -10.011 -10.652 -17.367 1041 HD2 PRO 138 1HD PRO 138 -10.633 -11.366 -14.830 1042 HD3 PRO 138 2HD PRO 138 -10.082 -9.733 -15.255 1043 H SER 139 H SER 139 -15.375 -9.389 -15.500 1044 HA SER 139 HA SER 139 -17.274 -10.642 -15.375 1045 HB2 SER 139 1HB SER 139 -16.144 -11.243 -18.071 1046 HB3 SER 139 2HB SER 139 -17.512 -12.205 -17.512 1047 HG SER 139 HG SER 139 -17.710 -9.941 -18.657 1048 H SER 140 H SER 140 -15.307 -11.663 -13.796 1049 HA SER 140 HA SER 140 -14.657 -14.364 -14.229 1050 HB2 SER 140 1HB SER 140 -13.472 -12.986 -12.588 1051 HB3 SER 140 2HB SER 140 -14.939 -12.856 -11.617 1052 HG SER 140 HG SER 140 -14.776 -15.312 -11.703 1053 H GLY 141 H GLY 141 -17.094 -13.008 -11.994 1054 HA2 GLY 141 1HA GLY 141 -18.647 -15.493 -12.382 1055 HA3 GLY 141 2HA GLY 141 -18.492 -14.715 -10.814 Start of MODEL 15 1 H1 GLY 1 H GLY 1 -27.244 1.478 10.736 2 HA2 GLY 1 1HA GLY 1 -27.713 -1.427 10.599 3 HA3 GLY 1 2HA GLY 1 -28.600 -0.345 9.535 4 H SER 2 H SER 2 -26.477 -2.528 9.175 5 HA SER 2 HA SER 2 -24.196 -1.213 8.076 6 HB2 SER 2 1HB SER 2 -24.110 -3.533 8.929 7 HB3 SER 2 2HB SER 2 -25.180 -4.042 7.622 8 HG SER 2 HG SER 2 -23.463 -4.221 6.446 9 H SER 3 H SER 3 -25.204 0.332 6.673 10 HA SER 3 HA SER 3 -26.930 -0.228 4.575 11 HB2 SER 3 1HB SER 3 -26.022 2.048 5.459 12 HB3 SER 3 2HB SER 3 -24.742 1.809 4.269 13 HG SER 3 HG SER 3 -27.402 2.438 3.907 14 H GLY 4 H GLY 4 -26.633 -0.647 2.368 15 HA2 GLY 4 1HA GLY 4 -24.453 -2.424 1.790 16 HA3 GLY 4 2HA GLY 4 -25.743 -1.962 0.689 17 H SER 5 H SER 5 -22.972 -0.406 2.312 18 HA SER 5 HA SER 5 -22.574 1.336 0.035 19 HB2 SER 5 1HB SER 5 -20.739 2.297 1.391 20 HB3 SER 5 2HB SER 5 -22.259 2.241 2.284 21 HG SER 5 HG SER 5 -21.510 0.535 3.457 22 H SER 6 H SER 6 -20.173 1.634 -0.644 23 HA SER 6 HA SER 6 -19.316 -0.916 -1.704 24 HB2 SER 6 1HB SER 6 -18.372 1.921 -2.132 25 HB3 SER 6 2HB SER 6 -17.578 0.531 -2.871 26 HG SER 6 HG SER 6 -19.246 0.244 -4.171 27 H GLY 7 H GLY 7 -17.330 -1.908 -1.358 28 HA2 GLY 7 1HA GLY 7 -15.410 -0.765 0.473 29 HA3 GLY 7 2HA GLY 7 -16.310 -2.120 1.139 30 H ALA 8 H ALA 8 -13.430 -1.787 0.452 31 HA ALA 8 HA ALA 8 -13.094 -3.762 -1.678 32 HB1 ALA 8 1HB ALA 8 -10.679 -3.229 -1.461 33 HB2 ALA 8 2HB ALA 8 -11.680 -1.830 -1.854 34 HB3 ALA 8 3HB ALA 8 -11.090 -2.058 -0.208 35 H GLU 9 H GLU 9 -13.683 -5.694 -0.737 36 HA GLU 9 HA GLU 9 -12.653 -6.494 1.828 37 HB2 GLU 9 1HB GLU 9 -14.874 -7.191 0.561 38 HB3 GLU 9 2HB GLU 9 -13.837 -8.458 -0.081 39 HG2 GLU 9 1HG GLU 9 -13.984 -7.956 2.861 40 HG3 GLU 9 2HG GLU 9 -15.214 -8.918 2.044 41 H PHE 10 H PHE 10 -12.125 -7.517 -1.537 42 HA PHE 10 HA PHE 10 -10.269 -9.515 -1.123 43 HB2 PHE 10 1HB PHE 10 -11.346 -8.635 -3.320 44 HB3 PHE 10 2HB PHE 10 -9.942 -7.575 -3.393 45 HD1 PHE 10 1HD PHE 10 -7.684 -8.524 -3.626 46 HD2 PHE 10 2HD PHE 10 -11.172 -10.959 -3.789 47 HE1 PHE 10 1HE PHE 10 -6.369 -10.334 -4.651 48 HE2 PHE 10 2HE PHE 10 -9.862 -12.773 -4.813 49 HZ PHE 10 HZ PHE 10 -7.457 -12.462 -5.244 50 H TYR 11 H TYR 11 -9.764 -6.025 -1.251 51 HA TYR 11 HA TYR 11 -6.927 -6.138 -1.125 52 HB2 TYR 11 1HB TYR 11 -7.948 -4.146 -1.977 53 HB3 TYR 11 2HB TYR 11 -8.899 -3.934 -0.512 54 HD1 TYR 11 2HD TYR 11 -5.314 -4.215 -1.541 55 HD2 TYR 11 1HD TYR 11 -8.170 -2.364 1.012 56 HE1 TYR 11 2HE TYR 11 -3.544 -2.785 -0.608 57 HE2 TYR 11 1HE TYR 11 -6.409 -0.928 1.951 58 HH TYR 11 HH TYR 11 -4.281 -0.207 1.680 59 H ASP 12 H ASP 12 -9.481 -5.906 1.288 60 HA ASP 12 HA ASP 12 -8.010 -5.261 3.540 61 HB2 ASP 12 1HB ASP 12 -10.424 -7.048 3.224 62 HB3 ASP 12 2HB ASP 12 -9.765 -6.598 4.795 63 H LYS 13 H LYS 13 -8.665 -8.493 2.209 64 HA LYS 13 HA LYS 13 -7.493 -10.115 4.048 65 HB2 LYS 13 1HB LYS 13 -7.198 -10.344 1.047 66 HB3 LYS 13 2HB LYS 13 -6.928 -11.646 2.198 67 HG2 LYS 13 1HG LYS 13 -9.561 -10.281 2.249 68 HG3 LYS 13 2HG LYS 13 -9.213 -11.366 0.901 69 HD2 LYS 13 1HD LYS 13 -10.076 -12.893 2.347 70 HD3 LYS 13 2HD LYS 13 -8.400 -12.932 2.900 71 HE2 LYS 13 1HE LYS 13 -9.432 -12.635 4.907 72 HE3 LYS 13 2HE LYS 13 -9.258 -10.946 4.434 73 HZ1 LYS 13 3HZ LYS 13 -11.443 -10.745 4.574 74 HZ2 LYS 13 1HZ LYS 13 -11.616 -12.386 4.950 75 HZ3 LYS 13 2HZ LYS 13 -11.639 -11.880 3.336 76 H GLN 14 H GLN 14 -5.905 -7.844 1.968 77 HA GLN 14 HA GLN 14 -3.266 -8.936 2.453 78 HB2 GLN 14 1HB GLN 14 -4.106 -6.374 1.087 79 HB3 GLN 14 2HB GLN 14 -2.474 -7.028 1.116 80 HG2 GLN 14 1HG GLN 14 -4.894 -8.184 -0.237 81 HG3 GLN 14 2HG GLN 14 -3.425 -7.561 -0.988 82 HE21 GLN 14 1HE2 GLN 14 -1.393 -8.701 0.078 83 HE22 GLN 14 2HE2 GLN 14 -1.475 -10.426 0.052 84 H LEU 15 H LEU 15 -5.239 -6.227 3.530 85 HA LEU 15 HA LEU 15 -3.494 -4.608 4.824 86 HB2 LEU 15 1HB LEU 15 -5.261 -3.796 6.007 87 HB3 LEU 15 2HB LEU 15 -6.120 -4.684 4.751 88 HG LEU 15 HG LEU 15 -6.080 -6.613 6.540 89 HD11 LEU 15 1HD1 LEU 15 -5.673 -4.117 8.166 90 HD12 LEU 15 2HD1 LEU 15 -4.749 -5.617 8.219 91 HD13 LEU 15 3HD1 LEU 15 -6.407 -5.582 8.819 92 HD21 LEU 15 3HD2 LEU 15 -7.970 -4.359 7.083 93 HD22 LEU 15 1HD2 LEU 15 -8.280 -6.094 7.039 94 HD23 LEU 15 2HD2 LEU 15 -8.012 -5.208 5.538 95 H LYS 16 H LYS 16 -4.664 -7.739 5.965 96 HA LYS 16 HA LYS 16 -3.380 -7.610 8.501 97 HB2 LYS 16 1HB LYS 16 -4.028 -9.877 8.779 98 HB3 LYS 16 2HB LYS 16 -5.324 -9.103 7.876 99 HG2 LYS 16 1HG LYS 16 -4.873 -10.262 5.961 100 HG3 LYS 16 2HG LYS 16 -3.165 -10.468 6.356 101 HD2 LYS 16 1HD LYS 16 -3.858 -12.593 6.764 102 HD3 LYS 16 2HD LYS 16 -4.224 -11.899 8.345 103 HE2 LYS 16 1HE LYS 16 -6.199 -12.973 7.859 104 HE3 LYS 16 2HE LYS 16 -6.531 -11.355 7.243 105 HZ1 LYS 16 3HZ LYS 16 -5.462 -12.504 5.092 106 HZ2 LYS 16 1HZ LYS 16 -7.123 -12.490 5.414 107 HZ3 LYS 16 2HZ LYS 16 -6.197 -13.851 5.804 108 H VAL 17 H VAL 17 -2.408 -8.671 5.318 109 HA VAL 17 HA VAL 17 -0.037 -10.026 6.208 110 HB VAL 17 HB VAL 17 -0.747 -9.062 3.434 111 HG11 VAL 17 1HG1 VAL 17 1.673 -9.562 3.900 112 HG12 VAL 17 2HG1 VAL 17 1.190 -11.228 4.225 113 HG13 VAL 17 3HG1 VAL 17 0.936 -10.531 2.624 114 HG21 VAL 17 3HG2 VAL 17 -1.653 -11.210 3.005 115 HG22 VAL 17 1HG2 VAL 17 -1.061 -11.843 4.541 116 HG23 VAL 17 2HG2 VAL 17 -2.371 -10.662 4.520 117 H LEU 18 H LEU 18 -0.804 -6.844 4.885 118 HA LEU 18 HA LEU 18 1.833 -5.939 4.525 119 HB2 LEU 18 1HB LEU 18 -0.783 -4.541 4.969 120 HB3 LEU 18 2HB LEU 18 0.723 -3.639 4.818 121 HG LEU 18 HG LEU 18 -0.091 -5.569 2.680 122 HD11 LEU 18 1HD1 LEU 18 -1.362 -3.910 1.552 123 HD12 LEU 18 2HD1 LEU 18 -0.963 -2.690 2.761 124 HD13 LEU 18 3HD1 LEU 18 -2.014 -4.041 3.185 125 HD21 LEU 18 3HD2 LEU 18 1.047 -3.465 1.464 126 HD22 LEU 18 1HD2 LEU 18 1.963 -4.836 2.090 127 HD23 LEU 18 2HD2 LEU 18 1.830 -3.357 3.041 128 H LEU 19 H LEU 19 -0.412 -5.509 7.252 129 HA LEU 19 HA LEU 19 1.326 -4.027 8.881 130 HB2 LEU 19 1HB LEU 19 -0.886 -5.903 9.702 131 HB3 LEU 19 2HB LEU 19 -0.140 -4.681 10.730 132 HG LEU 19 HG LEU 19 -1.633 -4.010 8.202 133 HD11 LEU 19 1HD1 LEU 19 -3.604 -3.721 9.391 134 HD12 LEU 19 2HD1 LEU 19 -2.784 -3.741 10.952 135 HD13 LEU 19 3HD1 LEU 19 -2.969 -5.236 10.034 136 HD21 LEU 19 3HD2 LEU 19 -0.010 -2.523 9.977 137 HD22 LEU 19 1HD2 LEU 19 -1.679 -2.010 10.231 138 HD23 LEU 19 2HD2 LEU 19 -0.969 -1.935 8.617 139 H SER 20 H SER 20 0.695 -7.519 8.739 140 HA SER 20 HA SER 20 2.064 -8.549 10.793 141 HB2 SER 20 1HB SER 20 1.818 -9.408 7.953 142 HB3 SER 20 2HB SER 20 2.995 -10.256 8.956 143 HG SER 20 HG SER 20 0.206 -9.997 9.378 144 H GLY 21 H GLY 21 3.606 -7.388 7.804 145 HA2 GLY 21 1HA GLY 21 5.689 -6.387 7.568 146 HA3 GLY 21 2HA GLY 21 5.970 -6.634 9.285 147 H ALA 22 H ALA 22 7.375 -7.273 6.554 148 HA ALA 22 HA ALA 22 8.341 -9.899 7.446 149 HB1 ALA 22 1HB ALA 22 6.688 -9.796 5.363 150 HB2 ALA 22 2HB ALA 22 8.199 -9.449 4.522 151 HB3 ALA 22 3HB ALA 22 8.030 -10.938 5.452 152 H THR 23 H THR 23 10.514 -10.316 7.053 153 HA THR 23 HA THR 23 12.200 -8.022 6.897 154 HB THR 23 HB THR 23 13.064 -10.911 6.716 155 HG1 THR 23 1HG THR 23 13.349 -10.538 9.083 156 HG21 THR 23 3HG2 THR 23 14.724 -9.013 8.181 157 HG22 THR 23 1HG2 THR 23 14.531 -8.588 6.481 158 HG23 THR 23 2HG2 THR 23 15.169 -10.170 6.927 159 H PHE 24 H PHE 24 13.561 -7.349 5.279 160 HA PHE 24 HA PHE 24 13.681 -8.841 2.785 161 HB2 PHE 24 1HB PHE 24 12.556 -6.040 2.964 162 HB3 PHE 24 2HB PHE 24 13.036 -6.819 1.460 163 HD1 PHE 24 2HD PHE 24 11.828 -8.886 0.721 164 HD2 PHE 24 1HD PHE 24 10.463 -6.458 3.940 165 HE1 PHE 24 2HE PHE 24 9.592 -9.895 0.530 166 HE2 PHE 24 1HE PHE 24 8.226 -7.464 3.755 167 HZ PHE 24 HZ PHE 24 7.787 -9.184 2.047 168 H LEU 25 H LEU 25 15.265 -7.928 1.268 169 HA LEU 25 HA LEU 25 17.517 -6.795 2.737 170 HB2 LEU 25 1HB LEU 25 17.183 -8.347 0.228 171 HB3 LEU 25 2HB LEU 25 18.573 -7.271 0.348 172 HG LEU 25 HG LEU 25 17.930 -9.592 2.165 173 HD11 LEU 25 1HD1 LEU 25 20.218 -10.312 1.236 174 HD12 LEU 25 2HD1 LEU 25 19.897 -9.148 -0.049 175 HD13 LEU 25 3HD1 LEU 25 18.797 -10.502 0.209 176 HD21 LEU 25 3HD2 LEU 25 20.501 -8.802 2.696 177 HD22 LEU 25 1HD2 LEU 25 19.090 -8.445 3.693 178 HD23 LEU 25 2HD2 LEU 25 19.656 -7.265 2.511 179 H VAL 26 H VAL 26 17.662 -4.654 2.776 180 HA VAL 26 HA VAL 26 16.757 -3.114 0.444 181 HB VAL 26 HB VAL 26 17.318 -2.209 3.272 182 HG11 VAL 26 1HG1 VAL 26 17.480 -0.692 0.966 183 HG12 VAL 26 2HG1 VAL 26 15.853 -0.370 1.571 184 HG13 VAL 26 3HG1 VAL 26 17.252 -0.083 2.605 185 HG21 VAL 26 3HG2 VAL 26 15.230 -3.595 2.763 186 HG22 VAL 26 1HG2 VAL 26 14.998 -2.047 3.576 187 HG23 VAL 26 2HG2 VAL 26 14.672 -2.194 1.849 188 H THR 27 H THR 27 18.165 -2.092 -0.826 189 HA THR 27 HA THR 27 20.995 -2.117 -0.054 190 HB THR 27 HB THR 27 19.864 -1.528 -2.792 191 HG1 THR 27 1HG THR 27 19.329 -3.675 -2.002 192 HG21 THR 27 3HG2 THR 27 22.480 -1.419 -1.671 193 HG22 THR 27 1HG2 THR 27 21.984 -1.116 -3.335 194 HG23 THR 27 2HG2 THR 27 22.427 -2.747 -2.830 195 H PHE 28 H PHE 28 21.292 -0.304 1.164 196 HA PHE 28 HA PHE 28 20.160 2.231 0.466 197 HB2 PHE 28 1HB PHE 28 22.097 1.273 2.543 198 HB3 PHE 28 2HB PHE 28 21.915 3.000 2.251 199 HD1 PHE 28 2HD PHE 28 19.170 3.497 1.896 200 HD2 PHE 28 1HD PHE 28 21.009 0.630 4.448 201 HE1 PHE 28 2HE PHE 28 17.193 3.537 3.360 202 HE2 PHE 28 1HE PHE 28 19.034 0.664 5.915 203 HZ PHE 28 HZ PHE 28 17.123 2.120 5.373 204 H GLY 29 H GLY 29 21.365 4.147 -0.088 205 HA2 GLY 29 1HA GLY 29 22.662 5.171 -1.719 206 HA3 GLY 29 2HA GLY 29 23.949 4.528 -0.709 207 H ASN 30 H ASN 30 25.412 3.355 -1.738 208 HA ASN 30 HA ASN 30 24.571 1.843 -4.122 209 HB2 ASN 30 1HB ASN 30 25.993 3.982 -4.493 210 HB3 ASN 30 2HB ASN 30 27.326 3.019 -3.860 211 HD21 ASN 30 1HD2 ASN 30 26.405 4.146 -6.589 212 HD22 ASN 30 2HD2 ASN 30 26.675 2.819 -7.662 213 H SER 31 H SER 31 24.646 0.784 -1.524 214 HA SER 31 HA SER 31 27.126 -0.628 -1.141 215 HB2 SER 31 1HB SER 31 25.742 0.030 0.785 216 HB3 SER 31 2HB SER 31 24.436 -1.003 0.202 217 HG SER 31 HG SER 31 26.361 -2.636 0.280 218 H GLU 32 H GLU 32 27.603 -2.064 -2.706 219 HA GLU 32 HA GLU 32 26.081 -3.474 -4.407 220 HB2 GLU 32 1HB GLU 32 27.790 -5.243 -4.408 221 HB3 GLU 32 2HB GLU 32 28.510 -3.639 -4.391 222 HG2 GLU 32 1HG GLU 32 29.204 -3.836 -2.181 223 HG3 GLU 32 2HG GLU 32 28.086 -5.158 -1.849 224 H LYS 33 H LYS 33 26.544 -4.235 -1.003 225 HA LYS 33 HA LYS 33 24.649 -6.469 -1.258 226 HB2 LYS 33 1HB LYS 33 26.582 -7.280 -0.211 227 HB3 LYS 33 2HB LYS 33 26.792 -5.816 0.742 228 HG2 LYS 33 1HG LYS 33 25.173 -6.427 2.279 229 HG3 LYS 33 2HG LYS 33 24.405 -7.563 1.168 230 HD2 LYS 33 1HD LYS 33 27.210 -8.010 2.124 231 HD3 LYS 33 2HD LYS 33 25.831 -8.491 3.114 232 HE2 LYS 33 1HE LYS 33 24.992 -9.862 1.264 233 HE3 LYS 33 2HE LYS 33 26.376 -9.383 0.283 234 HZ1 LYS 33 3HZ LYS 33 27.217 -10.417 2.790 235 HZ2 LYS 33 1HZ LYS 33 27.615 -10.938 1.230 236 HZ3 LYS 33 2HZ LYS 33 26.228 -11.533 1.992 237 HA PRO 34 HA PRO 34 21.572 -3.905 0.631 238 HB2 PRO 34 1HB PRO 34 19.755 -5.864 1.110 239 HB3 PRO 34 2HB PRO 34 20.040 -5.191 -0.499 240 HG2 PRO 34 1HG PRO 34 21.083 -7.725 0.706 241 HG3 PRO 34 2HG PRO 34 20.444 -7.442 -0.923 242 HD2 PRO 34 1HD PRO 34 23.098 -7.566 -0.400 243 HD3 PRO 34 2HD PRO 34 22.424 -6.534 -1.678 244 H GLU 35 H GLU 35 19.972 -4.362 2.632 245 HA GLU 35 HA GLU 35 21.511 -5.548 4.830 246 HB2 GLU 35 1HB GLU 35 22.023 -3.182 4.908 247 HB3 GLU 35 2HB GLU 35 20.316 -2.773 4.814 248 HG2 GLU 35 1HG GLU 35 20.621 -2.534 7.043 249 HG3 GLU 35 2HG GLU 35 20.211 -4.248 7.003 250 H THR 36 H THR 36 20.308 -6.532 6.389 251 HA THR 36 HA THR 36 17.668 -7.300 5.774 252 HB THR 36 HB THR 36 18.993 -7.485 8.483 253 HG1 THR 36 1HG THR 36 20.049 -9.226 7.753 254 HG21 THR 36 3HG2 THR 36 16.949 -9.311 7.229 255 HG22 THR 36 1HG2 THR 36 16.523 -7.968 8.289 256 HG23 THR 36 2HG2 THR 36 17.507 -9.298 8.902 257 H MET 37 H MET 37 16.027 -5.895 5.761 258 HA MET 37 HA MET 37 15.616 -4.249 8.162 259 HB2 MET 37 1HB MET 37 15.196 -3.384 5.297 260 HB3 MET 37 2HB MET 37 14.689 -2.460 6.705 261 HG2 MET 37 1HG MET 37 17.216 -2.683 7.365 262 HG3 MET 37 2HG MET 37 17.419 -2.949 5.635 263 HE1 MET 37 3HE MET 37 15.145 -0.517 7.885 264 HE2 MET 37 1HE MET 37 16.806 -0.524 8.480 265 HE3 MET 37 2HE MET 37 16.145 0.927 7.725 266 H THR 38 H THR 38 13.351 -3.583 8.468 267 HA THR 38 HA THR 38 11.526 -5.688 7.521 268 HB THR 38 HB THR 38 11.148 -3.910 9.935 269 HG1 THR 38 1HG THR 38 11.662 -6.150 10.915 270 HG21 THR 38 3HG2 THR 38 9.278 -5.348 8.618 271 HG22 THR 38 1HG2 THR 38 9.237 -5.046 10.355 272 HG23 THR 38 2HG2 THR 38 9.882 -6.567 9.739 273 H CYS 39 H CYS 39 9.793 -5.178 6.331 274 HA CYS 39 HA CYS 39 9.129 -2.323 6.023 275 HB2 CYS 39 1HB CYS 39 9.441 -4.511 4.032 276 HB3 CYS 39 2HB CYS 39 8.169 -3.332 3.739 277 HG CYS 39 HG CYS 39 11.526 -2.740 3.954 278 H ARG 40 H ARG 40 7.279 -1.877 7.011 279 HA ARG 40 HA ARG 40 4.956 -3.560 6.507 280 HB2 ARG 40 1HB ARG 40 4.356 -3.814 8.808 281 HB3 ARG 40 2HB ARG 40 6.015 -4.370 8.633 282 HG2 ARG 40 1HG ARG 40 6.821 -2.238 9.520 283 HG3 ARG 40 2HG ARG 40 5.153 -1.693 9.708 284 HD2 ARG 40 1HD ARG 40 6.079 -2.513 11.820 285 HD3 ARG 40 2HD ARG 40 4.721 -3.498 11.279 286 HE ARG 40 HE ARG 40 6.791 -4.868 10.299 287 HH11 ARG 40 1HH1 ARG 40 6.241 -3.486 13.447 288 HH12 ARG 40 2HH1 ARG 40 7.182 -4.679 14.279 289 HH21 ARG 40 1HH2 ARG 40 8.032 -6.445 11.383 290 HH22 ARG 40 2HH2 ARG 40 8.201 -6.362 13.104 291 H LEU 41 H LEU 41 2.929 -2.503 7.327 292 HA LEU 41 HA LEU 41 3.138 0.396 6.915 293 HB2 LEU 41 1HB LEU 41 1.081 -1.653 6.311 294 HB3 LEU 41 2HB LEU 41 0.517 -0.031 6.710 295 HG LEU 41 HG LEU 41 2.539 -0.522 4.541 296 HD11 LEU 41 1HD1 LEU 41 0.526 -0.280 3.004 297 HD12 LEU 41 2HD1 LEU 41 -0.456 -0.686 4.411 298 HD13 LEU 41 3HD1 LEU 41 0.738 -1.835 3.809 299 HD21 LEU 41 3HD2 LEU 41 2.460 1.680 4.276 300 HD22 LEU 41 1HD2 LEU 41 1.485 1.777 5.743 301 HD23 LEU 41 2HD2 LEU 41 0.699 1.653 4.169 302 H SER 42 H SER 42 2.411 1.839 8.392 303 HA SER 42 HA SER 42 2.191 1.072 11.085 304 HB2 SER 42 1HB SER 42 2.743 3.398 9.942 305 HB3 SER 42 2HB SER 42 1.014 3.663 10.170 306 HG SER 42 HG SER 42 2.592 4.261 11.935 307 H ASN 43 H ASN 43 0.308 1.637 12.509 308 HA ASN 43 HA ASN 43 -1.874 0.063 12.021 309 HB2 ASN 43 1HB ASN 43 -3.055 1.386 13.762 310 HB3 ASN 43 2HB ASN 43 -1.413 0.954 14.231 311 HD21 ASN 43 1HD2 ASN 43 -3.519 3.302 14.543 312 HD22 ASN 43 2HD2 ASN 43 -2.492 4.692 14.510 313 H ASN 44 H ASN 44 -1.454 3.467 11.182 314 HA ASN 44 HA ASN 44 -4.110 3.847 10.231 315 HB2 ASN 44 1HB ASN 44 -2.354 5.619 10.942 316 HB3 ASN 44 2HB ASN 44 -1.753 5.462 9.294 317 HD21 ASN 44 1HD2 ASN 44 -2.409 7.828 9.534 318 HD22 ASN 44 2HD2 ASN 44 -4.007 8.224 9.009 319 H GLN 45 H GLN 45 -1.216 2.535 8.861 320 HA GLN 45 HA GLN 45 -0.760 1.563 6.856 321 HB2 GLN 45 1HB GLN 45 -3.760 1.511 6.867 322 HB3 GLN 45 2HB GLN 45 -2.868 0.971 5.450 323 HG2 GLN 45 1HG GLN 45 -1.576 -0.465 7.246 324 HG3 GLN 45 2HG GLN 45 -3.078 -0.252 8.144 325 HE21 GLN 45 1HE2 GLN 45 -5.002 -0.399 6.324 326 HE22 GLN 45 2HE2 GLN 45 -4.987 -1.921 5.508 327 H ARG 46 H ARG 46 -0.506 4.320 6.975 328 HA ARG 46 HA ARG 46 -1.286 5.105 4.244 329 HB2 ARG 46 1HB ARG 46 -1.423 6.623 6.809 330 HB3 ARG 46 2HB ARG 46 -1.033 7.507 5.339 331 HG2 ARG 46 1HG ARG 46 -3.129 6.379 4.360 332 HG3 ARG 46 2HG ARG 46 -3.542 6.040 6.042 333 HD2 ARG 46 1HD ARG 46 -4.582 8.111 5.274 334 HD3 ARG 46 2HD ARG 46 -3.417 8.420 6.561 335 HE ARG 46 HE ARG 46 -2.391 8.703 3.871 336 HH11 ARG 46 1HH1 ARG 46 -3.848 10.272 6.616 337 HH12 ARG 46 2HH1 ARG 46 -3.300 11.854 6.168 338 HH21 ARG 46 1HH2 ARG 46 -1.664 10.780 3.270 339 HH22 ARG 46 2HH2 ARG 46 -2.059 12.142 4.264 340 H TYR 47 H TYR 47 1.198 4.731 6.565 341 HA TYR 47 HA TYR 47 3.145 5.786 4.636 342 HB2 TYR 47 1HB TYR 47 3.092 6.339 7.607 343 HB3 TYR 47 2HB TYR 47 4.489 6.648 6.582 344 HD1 TYR 47 2HD TYR 47 0.841 7.441 6.759 345 HD2 TYR 47 1HD TYR 47 4.739 8.759 5.677 346 HE1 TYR 47 2HE TYR 47 -0.071 9.654 6.194 347 HE2 TYR 47 1HE TYR 47 3.838 10.977 5.110 348 HH TYR 47 HH TYR 47 0.736 11.983 6.004 349 H LEU 48 H LEU 48 5.161 4.758 4.630 350 HA LEU 48 HA LEU 48 5.132 2.097 5.857 351 HB2 LEU 48 1HB LEU 48 6.540 3.294 3.504 352 HB3 LEU 48 2HB LEU 48 7.158 1.824 4.256 353 HG LEU 48 HG LEU 48 4.351 2.069 3.192 354 HD11 LEU 48 1HD1 LEU 48 6.712 2.076 1.682 355 HD12 LEU 48 2HD1 LEU 48 5.066 1.804 1.111 356 HD13 LEU 48 3HD1 LEU 48 6.073 0.435 1.584 357 HD21 LEU 48 3HD2 LEU 48 6.088 -0.216 4.091 358 HD22 LEU 48 1HD2 LEU 48 4.630 -0.444 3.124 359 HD23 LEU 48 2HD2 LEU 48 4.520 0.283 4.728 360 H PHE 49 H PHE 49 6.761 1.355 7.167 361 HA PHE 49 HA PHE 49 8.814 3.316 7.954 362 HB2 PHE 49 1HB PHE 49 7.105 1.545 9.692 363 HB3 PHE 49 2HB PHE 49 8.628 2.216 10.265 364 HD1 PHE 49 1HD PHE 49 8.894 4.665 10.478 365 HD2 PHE 49 2HD PHE 49 5.151 2.873 9.532 366 HE1 PHE 49 1HE PHE 49 7.743 6.748 11.104 367 HE2 PHE 49 2HE PHE 49 3.994 4.952 10.156 368 HZ PHE 49 HZ PHE 49 5.290 6.894 10.943 369 H LEU 50 H LEU 50 10.786 2.405 8.810 370 HA LEU 50 HA LEU 50 11.262 -0.374 7.961 371 HB2 LEU 50 1HB LEU 50 13.234 1.889 7.711 372 HB3 LEU 50 2HB LEU 50 13.439 0.232 7.146 373 HG LEU 50 HG LEU 50 11.374 2.132 6.045 374 HD11 LEU 50 1HD1 LEU 50 13.505 1.541 4.231 375 HD12 LEU 50 2HD1 LEU 50 14.161 2.245 5.708 376 HD13 LEU 50 3HD1 LEU 50 12.922 3.107 4.796 377 HD21 LEU 50 3HD2 LEU 50 11.940 -0.677 5.705 378 HD22 LEU 50 1HD2 LEU 50 12.087 0.194 4.178 379 HD23 LEU 50 2HD2 LEU 50 10.587 0.280 5.101 380 H ASP 51 H ASP 51 12.928 -1.500 9.100 381 HA ASP 51 HA ASP 51 13.816 -0.271 11.609 382 HB2 ASP 51 1HB ASP 51 12.460 -2.967 11.394 383 HB3 ASP 51 2HB ASP 51 13.238 -2.342 12.846 384 H GLY 52 H GLY 52 15.963 -0.304 11.434 385 HA2 GLY 52 1HA GLY 52 17.362 -2.794 11.276 386 HA3 GLY 52 2HA GLY 52 17.525 -1.863 9.794 387 H ASP 53 H ASP 53 19.412 -0.857 9.737 388 HA ASP 53 HA ASP 53 21.212 -0.475 11.742 389 HB2 ASP 53 1HB ASP 53 20.826 1.591 9.579 390 HB3 ASP 53 2HB ASP 53 22.328 1.095 10.355 391 H SER 54 H SER 54 18.579 1.708 10.837 392 HA SER 54 HA SER 54 18.562 2.831 13.497 393 HB2 SER 54 1HB SER 54 19.440 4.424 11.104 394 HB3 SER 54 2HB SER 54 18.623 5.213 12.453 395 HG SER 54 HG SER 54 20.605 5.296 13.194 396 H HIS 55 H HIS 55 16.856 4.742 13.481 397 HA HIS 55 HA HIS 55 14.403 3.570 12.637 398 HB2 HIS 55 1HB HIS 55 15.181 6.110 14.015 399 HB3 HIS 55 2HB HIS 55 13.548 5.950 13.374 400 HD2 HIS 55 2HD HIS 55 14.646 5.832 16.681 401 HE1 HIS 55 1HE HIS 55 12.619 2.113 16.433 402 HE2 HIS 55 2HE HIS 55 13.499 3.904 17.969 403 H TYR 56 H TYR 56 13.997 3.463 10.509 404 HA TYR 56 HA TYR 56 14.161 5.971 8.969 405 HB2 TYR 56 1HB TYR 56 15.044 3.213 8.286 406 HB3 TYR 56 2HB TYR 56 14.324 4.171 6.997 407 HD1 TYR 56 2HD TYR 56 17.057 4.149 9.506 408 HD2 TYR 56 1HD TYR 56 15.566 5.841 5.898 409 HE1 TYR 56 2HE TYR 56 19.211 5.284 9.155 410 HE2 TYR 56 1HE TYR 56 17.715 6.980 5.537 411 HH TYR 56 HH TYR 56 20.149 7.127 7.969 412 H GLU 57 H GLU 57 12.603 6.179 7.227 413 HA GLU 57 HA GLU 57 10.338 4.394 7.167 414 HB2 GLU 57 1HB GLU 57 8.675 5.951 7.898 415 HB3 GLU 57 2HB GLU 57 9.908 5.866 9.148 416 HG2 GLU 57 1HG GLU 57 9.782 8.019 7.053 417 HG3 GLU 57 2HG GLU 57 9.078 8.157 8.663 418 H ILE 58 H ILE 58 9.238 4.515 5.269 419 HA ILE 58 HA ILE 58 10.213 6.498 3.330 420 HB ILE 58 HB ILE 58 8.900 3.818 2.870 421 HG12 ILE 58 1HG1 ILE 58 11.681 4.677 2.089 422 HG13 ILE 58 2HG1 ILE 58 11.339 3.949 3.655 423 HG21 ILE 58 1HG2 ILE 58 9.089 4.177 0.545 424 HG22 ILE 58 2HG2 ILE 58 8.347 5.636 1.200 425 HG23 ILE 58 3HG2 ILE 58 10.057 5.633 0.772 426 HD11 ILE 58 3HD1 ILE 58 10.148 2.222 1.873 427 HD12 ILE 58 1HD1 ILE 58 11.628 2.715 1.051 428 HD13 ILE 58 2HD1 ILE 58 11.709 2.001 2.662 429 H GLU 59 H GLU 59 8.874 8.222 3.505 430 HA GLU 59 HA GLU 59 6.106 8.088 4.022 431 HB2 GLU 59 1HB GLU 59 8.011 10.187 3.133 432 HB3 GLU 59 2HB GLU 59 6.304 10.480 2.831 433 HG2 GLU 59 1HG GLU 59 5.781 10.380 5.133 434 HG3 GLU 59 2HG GLU 59 7.370 9.733 5.536 435 H ILE 60 H ILE 60 4.880 6.869 2.691 436 HA ILE 60 HA ILE 60 5.135 6.304 0.049 437 HB ILE 60 HB ILE 60 2.535 6.858 1.482 438 HG12 ILE 60 1HG1 ILE 60 4.089 4.298 1.052 439 HG13 ILE 60 2HG1 ILE 60 3.885 5.144 2.582 440 HG21 ILE 60 1HG2 ILE 60 2.390 4.881 -0.600 441 HG22 ILE 60 2HG2 ILE 60 1.436 6.347 -0.378 442 HG23 ILE 60 3HG2 ILE 60 2.971 6.416 -1.243 443 HD11 ILE 60 3HD1 ILE 60 1.660 4.526 2.768 444 HD12 ILE 60 1HD1 ILE 60 1.515 4.164 1.048 445 HD13 ILE 60 2HD1 ILE 60 2.432 3.087 2.101 446 H VAL 61 H VAL 61 3.343 9.093 1.356 447 HA VAL 61 HA VAL 61 2.333 10.305 -0.804 448 HB VAL 61 HB VAL 61 2.638 12.443 0.211 449 HG11 VAL 61 1HG1 VAL 61 2.639 10.751 2.656 450 HG12 VAL 61 2HG1 VAL 61 1.551 12.059 2.184 451 HG13 VAL 61 3HG1 VAL 61 1.390 10.465 1.444 452 HG21 VAL 61 3HG2 VAL 61 4.877 12.727 0.663 453 HG22 VAL 61 1HG2 VAL 61 4.231 12.496 2.288 454 HG23 VAL 61 2HG2 VAL 61 5.027 11.159 1.457 455 H HIS 62 H HIS 62 5.763 10.190 0.000 456 HA HIS 62 HA HIS 62 6.564 11.896 -2.158 457 HB2 HIS 62 1HB HIS 62 8.004 10.158 -0.184 458 HB3 HIS 62 2HB HIS 62 8.870 10.809 -1.573 459 HD2 HIS 62 2HD HIS 62 7.757 11.878 1.915 460 HE1 HIS 62 1HE HIS 62 9.048 15.386 -0.093 461 HE2 HIS 62 2HE HIS 62 8.463 14.357 2.131 462 H ILE 63 H ILE 63 6.914 8.398 -1.555 463 HA ILE 63 HA ILE 63 8.121 7.453 -3.729 464 HB ILE 63 HB ILE 63 5.501 6.328 -2.733 465 HG12 ILE 63 1HG1 ILE 63 8.347 5.805 -1.850 466 HG13 ILE 63 2HG1 ILE 63 7.102 6.623 -0.913 467 HG21 ILE 63 1HG2 ILE 63 7.309 4.320 -3.566 468 HG22 ILE 63 2HG2 ILE 63 5.750 4.748 -4.269 469 HG23 ILE 63 3HG2 ILE 63 7.223 5.524 -4.852 470 HD11 ILE 63 3HD1 ILE 63 7.084 4.513 -0.011 471 HD12 ILE 63 1HD1 ILE 63 5.796 4.401 -1.210 472 HD13 ILE 63 2HD1 ILE 63 7.389 3.730 -1.561 473 H SER 64 H SER 64 7.991 7.740 -5.847 474 HA SER 64 HA SER 64 5.479 8.732 -6.991 475 HB2 SER 64 1HB SER 64 6.904 9.356 -8.951 476 HB3 SER 64 2HB SER 64 7.386 10.146 -7.450 477 HG SER 64 HG SER 64 9.276 9.346 -7.889 478 H THR 65 H THR 65 8.107 6.477 -7.844 479 HA THR 65 HA THR 65 6.196 4.974 -9.494 480 HB THR 65 HB THR 65 9.215 4.796 -9.461 481 HG1 THR 65 1HG THR 65 7.457 6.011 -11.352 482 HG21 THR 65 3HG2 THR 65 9.011 3.420 -11.409 483 HG22 THR 65 1HG2 THR 65 7.267 3.671 -11.472 484 HG23 THR 65 2HG2 THR 65 7.976 2.729 -10.160 485 H VAL 66 H VAL 66 5.798 2.822 -9.160 486 HA VAL 66 HA VAL 66 7.242 1.419 -7.045 487 HB VAL 66 HB VAL 66 4.251 1.830 -7.021 488 HG11 VAL 66 1HG1 VAL 66 4.371 -0.376 -6.394 489 HG12 VAL 66 2HG1 VAL 66 5.982 -0.203 -5.693 490 HG13 VAL 66 3HG1 VAL 66 4.573 0.422 -4.834 491 HG21 VAL 66 3HG2 VAL 66 5.983 3.516 -6.003 492 HG22 VAL 66 1HG2 VAL 66 4.523 3.081 -5.113 493 HG23 VAL 66 2HG2 VAL 66 6.064 2.325 -4.705 494 H GLN 67 H GLN 67 7.989 -0.242 -8.222 495 HA GLN 67 HA GLN 67 6.010 -1.908 -9.614 496 HB2 GLN 67 1HB GLN 67 7.433 -2.239 -11.490 497 HB3 GLN 67 2HB GLN 67 7.358 -0.503 -11.219 498 HG2 GLN 67 1HG GLN 67 9.523 -0.552 -10.131 499 HG3 GLN 67 2HG GLN 67 9.597 -2.303 -10.324 500 HE21 GLN 67 1HE2 GLN 67 11.477 -2.213 -11.533 501 HE22 GLN 67 2HE2 GLN 67 11.504 -1.640 -13.162 502 H ILE 68 H ILE 68 6.730 -4.148 -9.934 503 HA ILE 68 HA ILE 68 8.435 -5.009 -7.698 504 HB ILE 68 HB ILE 68 6.324 -6.558 -9.204 505 HG12 ILE 68 1HG1 ILE 68 6.320 -5.606 -6.335 506 HG13 ILE 68 2HG1 ILE 68 5.518 -4.753 -7.649 507 HG21 ILE 68 1HG2 ILE 68 8.530 -7.468 -7.669 508 HG22 ILE 68 2HG2 ILE 68 7.058 -7.782 -6.751 509 HG23 ILE 68 3HG2 ILE 68 7.227 -8.413 -8.389 510 HD11 ILE 68 3HD1 ILE 68 4.127 -6.742 -8.050 511 HD12 ILE 68 1HD1 ILE 68 4.894 -7.528 -6.670 512 HD13 ILE 68 2HD1 ILE 68 3.923 -6.075 -6.430 513 H LEU 69 H LEU 69 10.136 -6.384 -8.010 514 HA LEU 69 HA LEU 69 11.034 -6.690 -10.774 515 HB2 LEU 69 1HB LEU 69 12.502 -7.180 -8.187 516 HB3 LEU 69 2HB LEU 69 13.206 -7.235 -9.802 517 HG LEU 69 HG LEU 69 11.999 -4.750 -8.598 518 HD11 LEU 69 1HD1 LEU 69 14.025 -4.113 -7.747 519 HD12 LEU 69 2HD1 LEU 69 14.938 -5.150 -8.842 520 HD13 LEU 69 3HD1 LEU 69 14.096 -5.852 -7.461 521 HD21 LEU 69 3HD2 LEU 69 12.430 -3.776 -10.551 522 HD22 LEU 69 1HD2 LEU 69 12.711 -5.389 -11.207 523 HD23 LEU 69 2HD2 LEU 69 14.065 -4.438 -10.596 524 H THR 70 H THR 70 10.818 -8.548 -11.814 525 HA THR 70 HA THR 70 10.308 -10.988 -10.252 526 HB THR 70 HB THR 70 9.319 -11.919 -12.303 527 HG1 THR 70 1HG THR 70 9.993 -9.365 -13.364 528 HG21 THR 70 3HG2 THR 70 7.977 -10.567 -10.647 529 HG22 THR 70 1HG2 THR 70 7.292 -10.670 -12.269 530 HG23 THR 70 2HG2 THR 70 8.128 -9.204 -11.756 531 H GLU 71 H GLU 71 11.406 -12.900 -10.704 532 HA GLU 71 HA GLU 71 14.101 -12.605 -11.547 533 HB2 GLU 71 1HB GLU 71 14.196 -15.086 -11.276 534 HB3 GLU 71 2HB GLU 71 13.584 -14.235 -9.865 535 HG2 GLU 71 1HG GLU 71 11.475 -15.064 -10.101 536 HG3 GLU 71 2HG GLU 71 11.619 -15.241 -11.848 537 H GLY 72 H GLY 72 13.435 -11.654 -13.698 538 HA2 GLY 72 1HA GLY 72 14.226 -12.591 -15.900 539 HA3 GLY 72 2HA GLY 72 12.977 -13.806 -15.670 540 H PHE 73 H PHE 73 13.561 -11.442 -17.610 541 HA PHE 73 HA PHE 73 11.648 -9.483 -17.458 542 HB2 PHE 73 1HB PHE 73 13.178 -9.277 -19.222 543 HB3 PHE 73 2HB PHE 73 12.868 -10.909 -19.805 544 HD1 PHE 73 2HD PHE 73 11.681 -7.451 -19.764 545 HD2 PHE 73 1HD PHE 73 10.981 -11.388 -21.223 546 HE1 PHE 73 2HE PHE 73 10.080 -6.555 -21.403 547 HE2 PHE 73 1HE PHE 73 9.379 -10.498 -22.866 548 HZ PHE 73 HZ PHE 73 8.926 -8.079 -22.956 549 HA PRO 74 HA PRO 74 7.995 -12.121 -17.502 550 HB2 PRO 74 1HB PRO 74 6.292 -10.148 -16.743 551 HB3 PRO 74 2HB PRO 74 7.319 -11.022 -15.601 552 HG2 PRO 74 1HG PRO 74 7.736 -8.334 -16.849 553 HG3 PRO 74 2HG PRO 74 8.000 -8.841 -15.170 554 HD2 PRO 74 1HD PRO 74 10.023 -8.602 -16.955 555 HD3 PRO 74 2HD PRO 74 10.038 -9.805 -15.649 556 HA PRO 75 HA PRO 75 6.766 -10.971 -21.630 557 HB2 PRO 75 1HB PRO 75 4.912 -12.930 -21.937 558 HB3 PRO 75 2HB PRO 75 6.650 -13.226 -22.055 559 HG2 PRO 75 1HG PRO 75 4.800 -13.698 -19.750 560 HG3 PRO 75 2HG PRO 75 6.094 -14.736 -20.376 561 HD2 PRO 75 1HD PRO 75 6.411 -13.170 -18.190 562 HD3 PRO 75 2HD PRO 75 7.745 -13.539 -19.302 563 H GLY 76 H GLY 76 5.102 -10.530 -18.801 564 HA2 GLY 76 1HA GLY 76 3.540 -8.572 -18.968 565 HA3 GLY 76 2HA GLY 76 2.720 -9.500 -20.215 566 H GLY 77 H GLY 77 1.920 -11.696 -19.500 567 HA2 GLY 77 1HA GLY 77 1.014 -11.574 -16.691 568 HA3 GLY 77 2HA GLY 77 -0.088 -11.973 -18.001 569 H GLY 78 H GLY 78 1.741 -13.260 -15.586 570 HA2 GLY 78 1HA GLY 78 1.288 -15.934 -16.444 571 HA3 GLY 78 2HA GLY 78 2.982 -15.505 -16.633 572 H ASN 79 H ASN 79 0.808 -16.898 -14.595 573 HA ASN 79 HA ASN 79 1.137 -16.084 -12.060 574 HB2 ASN 79 1HB ASN 79 0.127 -18.307 -13.064 575 HB3 ASN 79 2HB ASN 79 1.674 -18.983 -12.562 576 HD21 ASN 79 1HD2 ASN 79 2.272 -18.747 -10.313 577 HD22 ASN 79 2HD2 ASN 79 1.034 -18.708 -9.109 578 H ALA 80 H ALA 80 2.905 -15.213 -11.182 579 HA ALA 80 HA ALA 80 5.299 -16.869 -10.969 580 HB1 ALA 80 1HB ALA 80 6.655 -14.710 -11.427 581 HB2 ALA 80 2HB ALA 80 6.027 -15.639 -12.790 582 HB3 ALA 80 3HB ALA 80 5.196 -14.175 -12.262 583 H ARG 81 H ARG 81 6.595 -16.403 -9.168 584 HA ARG 81 HA ARG 81 5.201 -14.911 -7.078 585 HB2 ARG 81 1HB ARG 81 7.284 -17.057 -7.106 586 HB3 ARG 81 2HB ARG 81 7.162 -16.007 -5.700 587 HG2 ARG 81 1HG ARG 81 5.136 -16.846 -5.071 588 HG3 ARG 81 2HG ARG 81 4.680 -17.278 -6.721 589 HD2 ARG 81 1HD ARG 81 6.675 -18.969 -6.485 590 HD3 ARG 81 2HD ARG 81 6.370 -18.760 -4.761 591 HE ARG 81 HE ARG 81 4.726 -20.163 -6.657 592 HH11 ARG 81 1HH1 ARG 81 4.792 -18.494 -3.603 593 HH12 ARG 81 2HH1 ARG 81 3.391 -19.302 -2.983 594 HH21 ARG 81 1HH2 ARG 81 2.881 -21.235 -5.852 595 HH22 ARG 81 2HH2 ARG 81 2.305 -20.862 -4.263 596 H ALA 82 H ALA 82 5.772 -12.895 -6.643 597 HA ALA 82 HA ALA 82 7.928 -11.554 -7.809 598 HB1 ALA 82 1HB ALA 82 5.910 -10.451 -6.915 599 HB2 ALA 82 2HB ALA 82 6.474 -10.793 -5.279 600 HB3 ALA 82 3HB ALA 82 7.404 -9.720 -6.325 601 H THR 83 H THR 83 10.015 -11.911 -7.472 602 HA THR 83 HA THR 83 10.932 -12.950 -4.907 603 HB THR 83 HB THR 83 11.793 -14.048 -6.902 604 HG1 THR 83 1HG THR 83 13.385 -12.794 -5.054 605 HG21 THR 83 3HG2 THR 83 13.370 -12.802 -8.390 606 HG22 THR 83 1HG2 THR 83 12.853 -11.311 -7.605 607 HG23 THR 83 2HG2 THR 83 11.692 -12.276 -8.518 608 H GLY 84 H GLY 84 11.335 -10.118 -6.980 609 HA2 GLY 84 1HA GLY 84 12.665 -8.772 -4.711 610 HA3 GLY 84 2HA GLY 84 13.165 -8.512 -6.375 611 H MET 85 H MET 85 12.680 -6.266 -5.228 612 HA MET 85 HA MET 85 10.160 -5.386 -6.386 613 HB2 MET 85 1HB MET 85 9.491 -5.841 -4.115 614 HB3 MET 85 2HB MET 85 10.878 -4.963 -3.483 615 HG2 MET 85 1HG MET 85 8.976 -3.577 -3.225 616 HG3 MET 85 2HG MET 85 9.953 -2.898 -4.524 617 HE1 MET 85 3HE MET 85 5.721 -3.019 -4.757 618 HE2 MET 85 1HE MET 85 6.303 -4.246 -3.631 619 HE3 MET 85 2HE MET 85 6.912 -2.594 -3.528 620 H PHE 86 H PHE 86 10.060 -3.097 -6.737 621 HA PHE 86 HA PHE 86 12.566 -1.632 -6.353 622 HB2 PHE 86 1HB PHE 86 12.331 -2.773 -8.690 623 HB3 PHE 86 2HB PHE 86 11.185 -1.476 -9.011 624 HD1 PHE 86 2HD PHE 86 14.615 -1.911 -7.605 625 HD2 PHE 86 1HD PHE 86 11.993 0.410 -10.025 626 HE1 PHE 86 2HE PHE 86 16.479 -0.412 -8.181 627 HE2 PHE 86 1HE PHE 86 13.854 1.912 -10.606 628 HZ PHE 86 HZ PHE 86 16.100 1.503 -9.682 629 H LEU 87 H LEU 87 12.229 0.381 -5.662 630 HA LEU 87 HA LEU 87 9.670 1.687 -6.266 631 HB2 LEU 87 1HB LEU 87 10.963 1.678 -3.544 632 HB3 LEU 87 2HB LEU 87 9.448 2.459 -3.990 633 HG LEU 87 HG LEU 87 9.860 -0.524 -4.077 634 HD11 LEU 87 1HD1 LEU 87 8.489 1.029 -1.896 635 HD12 LEU 87 2HD1 LEU 87 10.157 0.468 -1.784 636 HD13 LEU 87 3HD1 LEU 87 8.843 -0.698 -1.945 637 HD21 LEU 87 3HD2 LEU 87 7.183 0.478 -3.646 638 HD22 LEU 87 1HD2 LEU 87 7.788 -0.631 -4.876 639 HD23 LEU 87 2HD2 LEU 87 7.879 1.110 -5.139 640 H GLN 88 H GLN 88 9.737 4.055 -5.750 641 HA GLN 88 HA GLN 88 12.421 5.208 -5.826 642 HB2 GLN 88 1HB GLN 88 10.323 5.511 -7.952 643 HB3 GLN 88 2HB GLN 88 11.501 6.786 -7.670 644 HG2 GLN 88 1HG GLN 88 13.187 4.752 -7.861 645 HG3 GLN 88 2HG GLN 88 11.865 4.078 -8.813 646 HE21 GLN 88 1HE2 GLN 88 11.170 5.218 -10.682 647 HE22 GLN 88 2HE2 GLN 88 12.242 6.291 -11.509 648 H TYR 89 H TYR 89 12.592 7.091 -4.739 649 HA TYR 89 HA TYR 89 10.323 8.788 -4.246 650 HB2 TYR 89 1HB TYR 89 10.439 8.607 -1.775 651 HB3 TYR 89 2HB TYR 89 9.901 7.115 -2.539 652 HD1 TYR 89 1HD TYR 89 13.121 8.708 -1.488 653 HD2 TYR 89 2HD TYR 89 10.785 5.159 -1.709 654 HE1 TYR 89 1HE TYR 89 14.895 7.475 -0.312 655 HE2 TYR 89 2HE TYR 89 12.551 3.916 -0.532 656 HH TYR 89 HH TYR 89 15.652 5.399 0.219 657 H THR 90 H THR 90 10.901 10.767 -3.163 658 HA THR 90 HA THR 90 13.729 11.423 -3.555 659 HB THR 90 HB THR 90 12.943 13.804 -3.387 660 HG1 THR 90 1HG THR 90 11.011 13.892 -2.473 661 HG21 THR 90 3HG2 THR 90 11.796 11.997 -5.508 662 HG22 THR 90 1HG2 THR 90 13.292 12.927 -5.570 663 HG23 THR 90 2HG2 THR 90 11.736 13.757 -5.607 664 H VAL 91 H VAL 91 14.999 12.310 -1.965 665 HA VAL 91 HA VAL 91 13.893 12.188 0.762 666 HB VAL 91 HB VAL 91 16.759 11.889 -0.148 667 HG11 VAL 91 1HG1 VAL 91 17.424 11.702 2.062 668 HG12 VAL 91 2HG1 VAL 91 16.236 13.004 2.135 669 HG13 VAL 91 3HG1 VAL 91 15.789 11.372 2.634 670 HG21 VAL 91 3HG2 VAL 91 16.510 9.652 -0.057 671 HG22 VAL 91 1HG2 VAL 91 15.418 9.727 1.326 672 HG23 VAL 91 2HG2 VAL 91 14.803 10.021 -0.300 673 HA PRO 92 HA PRO 92 14.464 16.549 1.103 674 HB2 PRO 92 1HB PRO 92 14.420 16.737 3.811 675 HB3 PRO 92 2HB PRO 92 12.969 16.448 2.844 676 HG2 PRO 92 1HG PRO 92 14.659 14.492 4.354 677 HG3 PRO 92 2HG PRO 92 12.892 14.600 4.253 678 HD2 PRO 92 1HD PRO 92 14.328 12.822 2.802 679 HD3 PRO 92 2HD PRO 92 12.819 13.542 2.207 680 H GLY 93 H GLY 93 16.222 17.813 1.058 681 HA2 GLY 93 1HA GLY 93 18.223 18.699 2.000 682 HA3 GLY 93 2HA GLY 93 18.501 17.153 2.789 683 H THR 94 H THR 94 18.190 15.427 0.631 684 HA THR 94 HA THR 94 20.723 15.829 -0.693 685 HB THR 94 HB THR 94 20.012 13.592 0.148 686 HG1 THR 94 1HG THR 94 20.438 12.594 -2.105 687 HG21 THR 94 3HG2 THR 94 18.421 12.295 -1.238 688 HG22 THR 94 1HG2 THR 94 18.044 13.764 -2.137 689 HG23 THR 94 2HG2 THR 94 17.657 13.658 -0.419 690 H GLU 95 H GLU 95 20.858 15.292 -3.090 691 HA GLU 95 HA GLU 95 18.685 16.684 -4.513 692 HB2 GLU 95 1HB GLU 95 21.648 16.641 -5.103 693 HB3 GLU 95 2HB GLU 95 20.439 17.334 -6.174 694 HG2 GLU 95 1HG GLU 95 20.992 18.237 -3.357 695 HG3 GLU 95 2HG GLU 95 21.575 19.027 -4.820 696 H GLY 96 H GLY 96 17.627 15.554 -6.005 697 HA2 GLY 96 1HA GLY 96 17.747 14.154 -8.003 698 HA3 GLY 96 2HA GLY 96 18.967 13.196 -7.176 699 H VAL 97 H VAL 97 17.485 11.434 -7.867 700 HA VAL 97 HA VAL 97 15.278 11.103 -5.940 701 HB VAL 97 HB VAL 97 15.543 9.887 -8.694 702 HG11 VAL 97 1HG1 VAL 97 13.040 9.729 -7.103 703 HG12 VAL 97 2HG1 VAL 97 13.690 8.615 -8.307 704 HG13 VAL 97 3HG1 VAL 97 14.361 8.642 -6.676 705 HG21 VAL 97 3HG2 VAL 97 14.167 11.485 -9.499 706 HG22 VAL 97 1HG2 VAL 97 13.245 11.595 -8.000 707 HG23 VAL 97 2HG2 VAL 97 14.797 12.420 -8.143 708 H THR 98 H THR 98 15.280 9.354 -4.647 709 HA THR 98 HA THR 98 17.496 7.444 -4.975 710 HB THR 98 HB THR 98 15.971 8.182 -2.469 711 HG1 THR 98 1HG THR 98 18.729 8.576 -2.800 712 HG21 THR 98 3HG2 THR 98 16.662 6.201 -1.697 713 HG22 THR 98 1HG2 THR 98 18.301 6.847 -1.767 714 HG23 THR 98 2HG2 THR 98 17.662 5.914 -3.121 715 H GLN 99 H GLN 99 17.063 5.362 -5.343 716 HA GLN 99 HA GLN 99 14.265 4.478 -5.107 717 HB2 GLN 99 1HB GLN 99 14.596 3.026 -6.932 718 HB3 GLN 99 2HB GLN 99 15.381 4.528 -7.400 719 HG2 GLN 99 1HG GLN 99 16.817 2.151 -6.243 720 HG3 GLN 99 2HG GLN 99 16.668 2.489 -7.967 721 HE21 GLN 99 1HE2 GLN 99 18.558 2.889 -5.270 722 HE22 GLN 99 2HE2 GLN 99 19.573 4.169 -5.833 723 H LEU 100 H LEU 100 13.804 2.447 -4.231 724 HA LEU 100 HA LEU 100 16.003 1.254 -2.673 725 HB2 LEU 100 1HB LEU 100 13.999 2.457 -1.518 726 HB3 LEU 100 2HB LEU 100 13.129 0.973 -1.903 727 HG LEU 100 HG LEU 100 15.203 -0.132 -0.681 728 HD11 LEU 100 1HD1 LEU 100 15.429 1.604 1.374 729 HD12 LEU 100 2HD1 LEU 100 15.348 2.722 0.013 730 HD13 LEU 100 3HD1 LEU 100 16.593 1.474 0.055 731 HD21 LEU 100 3HD2 LEU 100 13.885 -0.030 1.422 732 HD22 LEU 100 1HD2 LEU 100 12.925 -0.457 0.005 733 HD23 LEU 100 2HD2 LEU 100 12.843 1.176 0.666 734 H LYS 101 H LYS 101 15.807 -1.057 -2.234 735 HA LYS 101 HA LYS 101 14.153 -2.531 -4.153 736 HB2 LYS 101 1HB LYS 101 16.400 -2.228 -5.153 737 HB3 LYS 101 2HB LYS 101 17.110 -3.018 -3.751 738 HG2 LYS 101 1HG LYS 101 15.894 -5.069 -4.292 739 HG3 LYS 101 2HG LYS 101 15.194 -4.276 -5.705 740 HD2 LYS 101 1HD LYS 101 18.165 -4.404 -5.339 741 HD3 LYS 101 2HD LYS 101 17.281 -5.776 -6.011 742 HE2 LYS 101 1HE LYS 101 17.776 -4.667 -7.941 743 HE3 LYS 101 2HE LYS 101 16.243 -3.890 -7.547 744 HZ1 LYS 101 3HZ LYS 101 18.593 -2.654 -6.387 745 HZ2 LYS 101 1HZ LYS 101 17.243 -1.943 -7.118 746 HZ3 LYS 101 2HZ LYS 101 18.494 -2.561 -8.073 747 H LEU 102 H LEU 102 13.549 -4.589 -3.503 748 HA LEU 102 HA LEU 102 14.432 -5.441 -0.832 749 HB2 LEU 102 1HB LEU 102 11.589 -5.701 -1.761 750 HB3 LEU 102 2HB LEU 102 12.232 -5.924 -0.135 751 HG LEU 102 HG LEU 102 12.307 -3.237 -1.466 752 HD11 LEU 102 1HD1 LEU 102 10.112 -3.552 0.377 753 HD12 LEU 102 2HD1 LEU 102 9.947 -4.637 -1.003 754 HD13 LEU 102 3HD1 LEU 102 10.122 -2.901 -1.262 755 HD21 LEU 102 3HD2 LEU 102 12.843 -4.364 1.182 756 HD22 LEU 102 1HD2 LEU 102 11.845 -2.909 1.201 757 HD23 LEU 102 2HD2 LEU 102 13.434 -2.878 0.436 758 H THR 103 H THR 103 14.837 -7.572 -0.612 759 HA THR 103 HA THR 103 13.911 -9.414 -2.697 760 HB THR 103 HB THR 103 16.780 -9.314 -1.745 761 HG1 THR 103 1HG THR 103 16.070 -8.848 -4.411 762 HG21 THR 103 3HG2 THR 103 15.266 -11.103 -3.618 763 HG22 THR 103 1HG2 THR 103 16.351 -11.541 -2.299 764 HG23 THR 103 2HG2 THR 103 17.005 -10.870 -3.793 765 H VAL 104 H VAL 104 13.716 -11.572 -2.051 766 HA VAL 104 HA VAL 104 13.094 -11.980 0.681 767 HB VAL 104 HB VAL 104 13.462 -14.015 -1.522 768 HG11 VAL 104 1HG1 VAL 104 11.705 -14.594 0.770 769 HG12 VAL 104 2HG1 VAL 104 12.792 -15.656 -0.127 770 HG13 VAL 104 3HG1 VAL 104 13.434 -14.580 1.116 771 HG21 VAL 104 3HG2 VAL 104 11.455 -13.431 -2.283 772 HG22 VAL 104 1HG2 VAL 104 10.753 -13.551 -0.669 773 HG23 VAL 104 2HG2 VAL 104 11.504 -12.044 -1.194 774 H VAL 105 H VAL 105 14.286 -12.708 2.330 775 HA VAL 105 HA VAL 105 17.100 -13.308 1.836 776 HB VAL 105 HB VAL 105 15.681 -12.950 4.479 777 HG11 VAL 105 1HG1 VAL 105 18.078 -14.125 4.056 778 HG12 VAL 105 2HG1 VAL 105 18.567 -12.438 4.227 779 HG13 VAL 105 3HG1 VAL 105 17.660 -13.229 5.516 780 HG21 VAL 105 3HG2 VAL 105 15.567 -10.790 3.926 781 HG22 VAL 105 1HG2 VAL 105 17.325 -10.767 4.071 782 HG23 VAL 105 2HG2 VAL 105 16.573 -11.023 2.497 783 H GLU 106 H GLU 106 18.061 -15.236 2.256 784 HA GLU 106 HA GLU 106 16.297 -17.513 2.643 785 HB2 GLU 106 1HB GLU 106 18.234 -18.869 2.041 786 HB3 GLU 106 2HB GLU 106 17.984 -17.589 0.862 787 HG2 GLU 106 1HG GLU 106 19.759 -16.277 1.921 788 HG3 GLU 106 2HG GLU 106 20.022 -17.582 3.076 789 H ASP 107 H ASP 107 16.576 -15.864 4.908 790 HA ASP 107 HA ASP 107 18.448 -17.162 6.703 791 HB2 ASP 107 1HB ASP 107 17.645 -15.565 8.371 792 HB3 ASP 107 2HB ASP 107 18.063 -14.736 6.874 793 H VAL 108 H VAL 108 17.550 -17.782 8.932 794 HA VAL 108 HA VAL 108 16.009 -20.051 8.744 795 HB VAL 108 HB VAL 108 15.670 -19.913 11.169 796 HG11 VAL 108 1HG1 VAL 108 18.203 -19.357 11.700 797 HG12 VAL 108 2HG1 VAL 108 17.739 -20.806 10.806 798 HG13 VAL 108 3HG1 VAL 108 18.323 -19.384 9.941 799 HG21 VAL 108 3HG2 VAL 108 16.790 -17.126 10.888 800 HG22 VAL 108 1HG2 VAL 108 15.151 -17.557 11.376 801 HG23 VAL 108 2HG2 VAL 108 16.517 -17.962 12.416 802 H THR 109 H THR 109 13.864 -20.451 9.823 803 HA THR 109 HA THR 109 11.606 -20.169 9.888 804 HB THR 109 HB THR 109 12.139 -17.197 9.958 805 HG1 THR 109 1HG THR 109 12.418 -17.412 12.148 806 HG21 THR 109 3HG2 THR 109 9.866 -17.322 9.828 807 HG22 THR 109 1HG2 THR 109 10.043 -17.565 11.565 808 HG23 THR 109 2HG2 THR 109 9.807 -18.951 10.501 809 H VAL 110 H VAL 110 13.029 -20.210 7.332 810 HA VAL 110 HA VAL 110 12.415 -18.540 5.355 811 HB VAL 110 HB VAL 110 11.989 -20.463 3.845 812 HG11 VAL 110 1HG1 VAL 110 14.285 -19.726 4.670 813 HG12 VAL 110 2HG1 VAL 110 14.234 -21.141 5.722 814 HG13 VAL 110 3HG1 VAL 110 14.163 -21.340 3.971 815 HG21 VAL 110 3HG2 VAL 110 12.536 -22.581 5.686 816 HG22 VAL 110 1HG2 VAL 110 11.111 -21.691 6.224 817 HG23 VAL 110 2HG2 VAL 110 11.160 -22.380 4.602 818 H GLY 111 H GLY 111 10.695 -17.635 4.394 819 HA2 GLY 111 1HA GLY 111 8.062 -18.862 4.636 820 HA3 GLY 111 2HA GLY 111 8.257 -17.292 5.402 821 H ARG 112 H ARG 112 9.124 -18.798 2.283 822 HA ARG 112 HA ARG 112 9.225 -16.572 0.709 823 HB2 ARG 112 1HB ARG 112 9.641 -18.986 0.039 824 HB3 ARG 112 2HB ARG 112 7.904 -19.128 -0.196 825 HG2 ARG 112 1HG ARG 112 8.729 -18.693 -2.324 826 HG3 ARG 112 2HG ARG 112 8.144 -17.122 -1.769 827 HD2 ARG 112 1HD ARG 112 10.266 -16.762 -2.777 828 HD3 ARG 112 2HD ARG 112 10.489 -16.618 -1.034 829 HE ARG 112 HE ARG 112 11.808 -18.504 -1.069 830 HH11 ARG 112 1HH1 ARG 112 10.202 -18.128 -4.134 831 HH12 ARG 112 2HH1 ARG 112 11.140 -19.352 -4.924 832 HH21 ARG 112 1HH2 ARG 112 13.050 -20.117 -2.097 833 HH22 ARG 112 2HH2 ARG 112 12.759 -20.483 -3.764 834 H ARG 113 H ARG 113 6.297 -18.533 1.265 835 HA ARG 113 HA ARG 113 4.469 -17.078 -0.162 836 HB2 ARG 113 1HB ARG 113 4.040 -18.368 2.539 837 HB3 ARG 113 2HB ARG 113 2.763 -17.893 1.427 838 HG2 ARG 113 1HG ARG 113 4.019 -19.451 -0.241 839 HG3 ARG 113 2HG ARG 113 4.707 -20.143 1.229 840 HD2 ARG 113 1HD ARG 113 2.637 -20.863 2.007 841 HD3 ARG 113 2HD ARG 113 1.752 -19.745 0.970 842 HE ARG 113 HE ARG 113 3.113 -21.496 -0.697 843 HH11 ARG 113 1HH1 ARG 113 0.611 -21.636 1.720 844 HH12 ARG 113 2HH1 ARG 113 -0.175 -23.009 1.014 845 HH21 ARG 113 1HH2 ARG 113 2.087 -23.305 -1.636 846 HH22 ARG 113 2HH2 ARG 113 0.666 -23.958 -0.894 847 H GLN 114 H GLN 114 5.632 -16.432 3.119 848 HA GLN 114 HA GLN 114 3.923 -14.262 3.666 849 HB2 GLN 114 1HB GLN 114 5.462 -15.621 5.254 850 HB3 GLN 114 2HB GLN 114 6.704 -14.468 4.782 851 HG2 GLN 114 1HG GLN 114 5.655 -13.807 6.861 852 HG3 GLN 114 2HG GLN 114 5.319 -12.633 5.590 853 HE21 GLN 114 1HE2 GLN 114 3.449 -11.815 6.368 854 HE22 GLN 114 2HE2 GLN 114 1.997 -12.731 6.565 855 H ALA 115 H ALA 115 7.400 -14.156 2.859 856 HA ALA 115 HA ALA 115 7.705 -11.466 2.496 857 HB1 ALA 115 1HB ALA 115 9.750 -12.131 1.962 858 HB2 ALA 115 2HB ALA 115 9.172 -13.793 1.832 859 HB3 ALA 115 3HB ALA 115 9.164 -12.743 0.415 860 H VAL 116 H VAL 116 7.097 -13.722 -0.206 861 HA VAL 116 HA VAL 116 6.653 -11.897 -2.203 862 HB VAL 116 HB VAL 116 5.208 -14.520 -1.802 863 HG11 VAL 116 1HG1 VAL 116 3.950 -13.769 -3.506 864 HG12 VAL 116 2HG1 VAL 116 5.102 -12.502 -3.933 865 HG13 VAL 116 3HG1 VAL 116 5.363 -14.157 -4.487 866 HG21 VAL 116 3HG2 VAL 116 7.091 -15.540 -2.404 867 HG22 VAL 116 1HG2 VAL 116 7.256 -14.503 -3.821 868 HG23 VAL 116 2HG2 VAL 116 7.917 -13.988 -2.269 869 H ALA 117 H ALA 117 4.294 -13.135 0.137 870 HA ALA 117 HA ALA 117 1.971 -12.025 -0.824 871 HB1 ALA 117 1HB ALA 117 2.153 -13.518 1.148 872 HB2 ALA 117 2HB ALA 117 2.740 -12.146 2.088 873 HB3 ALA 117 3HB ALA 117 1.109 -12.123 1.417 874 H TRP 118 H TRP 118 4.317 -10.483 1.368 875 HA TRP 118 HA TRP 118 2.971 -8.012 1.539 876 HB2 TRP 118 1HB TRP 118 4.850 -8.919 3.035 877 HB3 TRP 118 2HB TRP 118 5.956 -8.336 1.794 878 HD1 TRP 118 HD TRP 118 3.971 -7.187 4.754 879 HE1 TRP 118 1HE TRP 118 4.285 -4.654 5.085 880 HE3 TRP 118 3HE TRP 118 6.291 -6.073 0.337 881 HZ2 TRP 118 2HZ TRP 118 5.373 -2.473 3.662 882 HZ3 TRP 118 3HZ TRP 118 6.935 -3.739 -0.101 883 HH2 TRP 118 HH TRP 118 6.484 -1.978 1.528 884 H LEU 119 H LEU 119 5.684 -9.067 -0.504 885 HA LEU 119 HA LEU 119 6.229 -6.722 -1.833 886 HB2 LEU 119 1HB LEU 119 6.225 -9.540 -2.898 887 HB3 LEU 119 2HB LEU 119 6.932 -8.164 -3.743 888 HG LEU 119 HG LEU 119 7.836 -9.169 -1.046 889 HD11 LEU 119 1HD1 LEU 119 9.496 -9.440 -3.489 890 HD12 LEU 119 2HD1 LEU 119 8.173 -10.583 -3.260 891 HD13 LEU 119 3HD1 LEU 119 9.437 -10.442 -2.039 892 HD21 LEU 119 3HD2 LEU 119 8.473 -6.831 -2.694 893 HD22 LEU 119 1HD2 LEU 119 9.879 -7.740 -2.137 894 HD23 LEU 119 2HD2 LEU 119 8.718 -7.109 -0.969 895 H VAL 120 H VAL 120 3.771 -9.151 -2.649 896 HA VAL 120 HA VAL 120 2.799 -7.706 -4.918 897 HB VAL 120 HB VAL 120 2.538 -10.136 -4.764 898 HG11 VAL 120 1HG1 VAL 120 0.751 -9.477 -2.431 899 HG12 VAL 120 2HG1 VAL 120 0.762 -11.043 -3.244 900 HG13 VAL 120 3HG1 VAL 120 2.213 -10.463 -2.425 901 HG21 VAL 120 3HG2 VAL 120 -0.281 -9.569 -4.750 902 HG22 VAL 120 1HG2 VAL 120 0.601 -8.281 -5.571 903 HG23 VAL 120 2HG2 VAL 120 0.776 -9.952 -6.109 904 H ALA 121 H ALA 121 1.896 -7.945 -1.528 905 HA ALA 121 HA ALA 121 -0.604 -6.713 -1.619 906 HB1 ALA 121 1HB ALA 121 0.993 -6.003 0.724 907 HB2 ALA 121 2HB ALA 121 -0.534 -6.880 0.612 908 HB3 ALA 121 3HB ALA 121 0.991 -7.728 0.355 909 H MET 122 H MET 122 2.566 -5.216 -0.942 910 HA MET 122 HA MET 122 1.790 -2.595 -0.688 911 HB2 MET 122 1HB MET 122 4.115 -3.558 -0.416 912 HB3 MET 122 2HB MET 122 4.280 -3.449 -2.163 913 HG2 MET 122 1HG MET 122 5.296 -1.516 -1.409 914 HG3 MET 122 2HG MET 122 3.682 -0.974 -1.862 915 HE1 MET 122 3HE MET 122 2.316 0.446 -0.478 916 HE2 MET 122 1HE MET 122 2.887 1.105 1.055 917 HE3 MET 122 2HE MET 122 3.869 1.278 -0.399 918 H HIS 123 H HIS 123 2.961 -4.063 -3.726 919 HA HIS 123 HA HIS 123 2.503 -1.998 -5.453 920 HB2 HIS 123 1HB HIS 123 3.557 -4.078 -6.159 921 HB3 HIS 123 2HB HIS 123 2.035 -4.943 -5.966 922 HD2 HIS 123 2HD HIS 123 -0.016 -3.983 -7.861 923 HE1 HIS 123 1HE HIS 123 2.941 -2.800 -10.664 924 HE2 HIS 123 2HE HIS 123 0.485 -3.203 -10.276 925 H LYS 124 H LYS 124 0.143 -4.474 -4.481 926 HA LYS 124 HA LYS 124 -2.010 -3.662 -6.016 927 HB2 LYS 124 1HB LYS 124 -1.800 -4.988 -3.333 928 HB3 LYS 124 2HB LYS 124 -3.377 -4.550 -3.978 929 HG2 LYS 124 1HG LYS 124 -1.404 -6.242 -5.487 930 HG3 LYS 124 2HG LYS 124 -2.626 -6.911 -4.404 931 HD2 LYS 124 1HD LYS 124 -3.425 -5.012 -6.573 932 HD3 LYS 124 2HD LYS 124 -3.125 -6.710 -6.952 933 HE2 LYS 124 1HE LYS 124 -4.842 -7.431 -5.487 934 HE3 LYS 124 2HE LYS 124 -4.985 -5.834 -4.755 935 HZ1 LYS 124 3HZ LYS 124 -6.624 -6.706 -6.635 936 HZ2 LYS 124 1HZ LYS 124 -5.449 -5.997 -7.624 937 HZ3 LYS 124 2HZ LYS 124 -6.238 -5.069 -6.451 938 H ALA 125 H ALA 125 -1.081 -2.551 -2.770 939 HA ALA 125 HA ALA 125 -3.216 -0.750 -2.422 940 HB1 ALA 125 1HB ALA 125 -1.453 0.360 -0.824 941 HB2 ALA 125 2HB ALA 125 -2.160 -1.211 -0.442 942 HB3 ALA 125 3HB ALA 125 -0.548 -1.118 -1.151 943 H ALA 126 H ALA 126 0.094 -0.255 -3.618 944 HA ALA 126 HA ALA 126 0.094 2.477 -3.951 945 HB1 ALA 126 1HB ALA 126 1.372 0.343 -5.648 946 HB2 ALA 126 2HB ALA 126 1.704 2.066 -5.828 947 HB3 ALA 126 3HB ALA 126 2.098 1.246 -4.318 948 H LYS 127 H LYS 127 -1.132 0.014 -6.193 949 HA LYS 127 HA LYS 127 -1.791 1.626 -8.341 950 HB2 LYS 127 1HB LYS 127 -2.921 -0.925 -7.259 951 HB3 LYS 127 2HB LYS 127 -3.739 -0.120 -8.592 952 HG2 LYS 127 1HG LYS 127 -1.791 -0.293 -9.973 953 HG3 LYS 127 2HG LYS 127 -0.836 -0.912 -8.625 954 HD2 LYS 127 1HD LYS 127 -1.364 -2.857 -9.745 955 HD3 LYS 127 2HD LYS 127 -2.667 -2.773 -8.557 956 HE2 LYS 127 1HE LYS 127 -2.997 -1.552 -11.271 957 HE3 LYS 127 2HE LYS 127 -3.233 -3.283 -11.036 958 HZ1 LYS 127 3HZ LYS 127 -5.257 -2.863 -10.284 959 HZ2 LYS 127 1HZ LYS 127 -5.024 -1.200 -10.495 960 HZ3 LYS 127 2HZ LYS 127 -4.625 -1.930 -9.023 961 H LEU 128 H LEU 128 -3.825 0.782 -5.545 962 HA LEU 128 HA LEU 128 -6.068 2.284 -6.307 963 HB2 LEU 128 1HB LEU 128 -5.051 1.202 -3.719 964 HB3 LEU 128 2HB LEU 128 -6.427 2.302 -3.717 965 HG LEU 128 HG LEU 128 -6.430 -0.186 -5.394 966 HD11 LEU 128 1HD1 LEU 128 -7.862 -1.018 -3.348 967 HD12 LEU 128 2HD1 LEU 128 -6.807 0.078 -2.456 968 HD13 LEU 128 3HD1 LEU 128 -6.113 -1.244 -3.394 969 HD21 LEU 128 3HD2 LEU 128 -8.716 1.265 -4.086 970 HD22 LEU 128 1HD2 LEU 128 -8.771 0.086 -5.396 971 HD23 LEU 128 2HD2 LEU 128 -8.107 1.694 -5.685 972 H LEU 129 H LEU 129 -3.256 3.127 -4.328 973 HA LEU 129 HA LEU 129 -3.996 5.587 -3.364 974 HB2 LEU 129 1HB LEU 129 -1.409 4.378 -4.175 975 HB3 LEU 129 2HB LEU 129 -1.441 6.114 -3.870 976 HG LEU 129 HG LEU 129 -2.267 3.996 -1.886 977 HD11 LEU 129 1HD1 LEU 129 -0.099 5.097 -0.797 978 HD12 LEU 129 2HD1 LEU 129 0.329 5.280 -2.498 979 HD13 LEU 129 3HD1 LEU 129 -0.023 3.680 -1.845 980 HD21 LEU 129 3HD2 LEU 129 -2.634 6.850 -1.998 981 HD22 LEU 129 1HD2 LEU 129 -1.633 6.400 -0.617 982 HD23 LEU 129 2HD2 LEU 129 -3.233 5.686 -0.816 983 H TYR 130 H TYR 130 -2.185 5.076 -6.398 984 HA TYR 130 HA TYR 130 -2.741 7.767 -7.270 985 HB2 TYR 130 1HB TYR 130 -1.631 5.677 -9.099 986 HB3 TYR 130 2HB TYR 130 -1.227 7.386 -8.980 987 HD1 TYR 130 2HD TYR 130 -0.598 7.680 -6.131 988 HD2 TYR 130 1HD TYR 130 0.377 4.537 -8.827 989 HE1 TYR 130 2HE TYR 130 1.368 7.123 -4.762 990 HE2 TYR 130 1HE TYR 130 2.345 3.971 -7.465 991 HH TYR 130 HH TYR 130 2.788 4.785 -4.449 992 H GLU 131 H GLU 131 -3.379 4.582 -8.753 993 HA GLU 131 HA GLU 131 -5.610 5.761 -10.228 994 HB2 GLU 131 1HB GLU 131 -4.380 3.009 -10.462 995 HB3 GLU 131 2HB GLU 131 -5.595 3.692 -11.533 996 HG2 GLU 131 1HG GLU 131 -3.758 5.579 -11.802 997 HG3 GLU 131 2HG GLU 131 -2.692 4.249 -11.351 998 H SER 132 H SER 132 -7.485 4.075 -10.556 999 HA SER 132 HA SER 132 -8.149 2.770 -8.018 1000 HB2 SER 132 1HB SER 132 -9.110 5.217 -8.366 1001 HB3 SER 132 2HB SER 132 -10.297 4.363 -9.353 1002 HG SER 132 HG SER 132 -10.659 3.005 -7.493 1003 H ARG 133 H ARG 133 -9.944 1.259 -8.192 1004 HA ARG 133 HA ARG 133 -10.344 0.288 -10.946 1005 HB2 ARG 133 1HB ARG 133 -10.135 -1.437 -8.473 1006 HB3 ARG 133 2HB ARG 133 -10.276 -1.988 -10.137 1007 HG2 ARG 133 1HG ARG 133 -7.958 -0.339 -9.176 1008 HG3 ARG 133 2HG ARG 133 -7.978 -2.102 -9.090 1009 HD2 ARG 133 1HD ARG 133 -8.491 -0.603 -11.645 1010 HD3 ARG 133 2HD ARG 133 -6.868 -1.057 -11.127 1011 HE ARG 133 HE ARG 133 -7.378 -3.290 -11.540 1012 HH11 ARG 133 1HH1 ARG 133 -10.151 -1.247 -12.042 1013 HH12 ARG 133 2HH1 ARG 133 -11.058 -2.462 -12.881 1014 HH21 ARG 133 1HH2 ARG 133 -8.561 -4.898 -12.643 1015 HH22 ARG 133 2HH2 ARG 133 -10.152 -4.539 -13.221 1016 H ASP 134 H ASP 134 -12.395 0.329 -11.557 1017 HA ASP 134 HA ASP 134 -14.485 0.200 -9.484 1018 HB2 ASP 134 1HB ASP 134 -15.881 1.297 -11.405 1019 HB3 ASP 134 2HB ASP 134 -14.783 2.289 -10.449 1020 H GLN 135 H GLN 135 -14.549 -2.087 -9.529 1021 HA GLN 135 HA GLN 135 -15.632 -3.240 -12.013 1022 HB2 GLN 135 1HB GLN 135 -14.782 -5.377 -11.306 1023 HB3 GLN 135 2HB GLN 135 -13.480 -4.199 -11.205 1024 HG2 GLN 135 1HG GLN 135 -14.234 -3.993 -8.722 1025 HG3 GLN 135 2HG GLN 135 -14.969 -5.568 -9.018 1026 HE21 GLN 135 1HE2 GLN 135 -13.168 -5.612 -7.147 1027 HE22 GLN 135 2HE2 GLN 135 -11.664 -6.274 -7.682 1028 H SER 136 H SER 136 -17.141 -5.118 -11.633 1029 HA SER 136 HA SER 136 -18.827 -4.675 -9.262 1030 HB2 SER 136 1HB SER 136 -19.588 -4.599 -12.145 1031 HB3 SER 136 2HB SER 136 -20.734 -5.313 -11.010 1032 HG SER 136 HG SER 136 -19.558 -2.807 -10.485 1033 H GLY 137 H GLY 137 -20.099 -6.487 -8.601 1034 HA2 GLY 137 1HA GLY 137 -20.717 -8.757 -8.608 1035 HA3 GLY 137 2HA GLY 137 -19.539 -9.051 -9.878 1036 HA PRO 138 HA PRO 138 -17.965 -10.107 -5.474 1037 HB2 PRO 138 1HB PRO 138 -18.516 -12.765 -5.408 1038 HB3 PRO 138 2HB PRO 138 -19.631 -11.537 -4.796 1039 HG2 PRO 138 1HG PRO 138 -19.650 -12.971 -7.423 1040 HG3 PRO 138 2HG PRO 138 -21.006 -12.597 -6.343 1041 HD2 PRO 138 1HD PRO 138 -20.461 -11.137 -8.558 1042 HD3 PRO 138 2HD PRO 138 -21.167 -10.423 -7.093 1043 H SER 139 H SER 139 -16.127 -11.512 -5.024 1044 HA SER 139 HA SER 139 -14.831 -12.579 -7.441 1045 HB2 SER 139 1HB SER 139 -13.969 -10.282 -6.677 1046 HB3 SER 139 2HB SER 139 -13.291 -11.133 -5.289 1047 HG SER 139 HG SER 139 -12.623 -12.497 -7.448 1048 H SER 140 H SER 140 -14.352 -14.650 -7.203 1049 HA SER 140 HA SER 140 -13.907 -15.691 -4.484 1050 HB2 SER 140 1HB SER 140 -15.897 -16.627 -5.587 1051 HB3 SER 140 2HB SER 140 -14.900 -17.161 -6.939 1052 HG SER 140 HG SER 140 -14.127 -18.756 -5.761 1053 H GLY 141 H GLY 141 -11.692 -15.380 -4.379 1054 HA2 GLY 141 1HA GLY 141 -10.088 -17.411 -5.567 1055 HA3 GLY 141 2HA GLY 141 -9.803 -15.859 -6.340 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -13.822 13.000 0.351 2 HA2 GLY 1 1HA GLY 1 -15.438 13.611 2.702 3 HA3 GLY 1 2HA GLY 1 -15.869 12.514 1.399 4 H SER 2 H SER 2 -14.242 12.860 4.444 5 HA SER 2 HA SER 2 -13.182 10.190 4.487 6 HB2 SER 2 1HB SER 2 -12.040 11.897 5.762 7 HB3 SER 2 2HB SER 2 -13.510 12.267 6.664 8 HG SER 2 HG SER 2 -12.555 9.641 6.713 9 H SER 3 H SER 3 -14.044 8.383 5.362 10 HA SER 3 HA SER 3 -16.348 8.469 7.088 11 HB2 SER 3 1HB SER 3 -17.394 8.744 4.863 12 HB3 SER 3 2HB SER 3 -16.631 7.245 4.331 13 HG SER 3 HG SER 3 -18.184 7.198 6.656 14 H GLY 4 H GLY 4 -16.739 6.509 8.137 15 HA2 GLY 4 1HA GLY 4 -14.489 4.670 8.070 16 HA3 GLY 4 2HA GLY 4 -15.785 4.692 9.257 17 H SER 5 H SER 5 -15.690 4.335 5.711 18 HA SER 5 HA SER 5 -17.810 2.465 5.662 19 HB2 SER 5 1HB SER 5 -15.693 3.049 3.577 20 HB3 SER 5 2HB SER 5 -17.164 2.118 3.295 21 HG SER 5 HG SER 5 -18.375 3.935 3.614 22 H SER 6 H SER 6 -17.531 0.649 6.849 23 HA SER 6 HA SER 6 -15.051 -0.828 6.788 24 HB2 SER 6 1HB SER 6 -16.168 -2.360 8.342 25 HB3 SER 6 2HB SER 6 -16.385 -0.688 8.859 26 HG SER 6 HG SER 6 -18.415 -1.262 8.904 27 H GLY 7 H GLY 7 -14.764 -2.931 5.983 28 HA2 GLY 7 1HA GLY 7 -16.104 -4.848 4.937 29 HA3 GLY 7 2HA GLY 7 -16.634 -3.611 3.807 30 H ALA 8 H ALA 8 -15.729 -4.269 1.939 31 HA ALA 8 HA ALA 8 -14.142 -4.685 0.362 32 HB1 ALA 8 1HB ALA 8 -11.788 -3.745 0.993 33 HB2 ALA 8 2HB ALA 8 -13.130 -2.644 0.680 34 HB3 ALA 8 3HB ALA 8 -12.661 -3.014 2.340 35 H GLU 9 H GLU 9 -14.716 -6.785 2.127 36 HA GLU 9 HA GLU 9 -12.857 -8.127 3.490 37 HB2 GLU 9 1HB GLU 9 -14.796 -9.102 1.427 38 HB3 GLU 9 2HB GLU 9 -13.681 -10.239 2.173 39 HG2 GLU 9 1HG GLU 9 -15.742 -10.311 3.365 40 HG3 GLU 9 2HG GLU 9 -14.534 -9.540 4.392 41 H PHE 10 H PHE 10 -13.040 -8.375 -0.066 42 HA PHE 10 HA PHE 10 -10.858 -9.884 -0.609 43 HB2 PHE 10 1HB PHE 10 -12.522 -8.591 -2.187 44 HB3 PHE 10 2HB PHE 10 -11.229 -7.398 -2.234 45 HD1 PHE 10 1HD PHE 10 -8.956 -8.106 -3.034 46 HD2 PHE 10 2HD PHE 10 -12.411 -10.555 -3.460 47 HE1 PHE 10 1HE PHE 10 -7.808 -9.419 -4.770 48 HE2 PHE 10 2HE PHE 10 -11.268 -11.872 -5.196 49 HZ PHE 10 HZ PHE 10 -8.963 -11.305 -5.852 50 H TYR 11 H TYR 11 -10.765 -6.334 -0.286 51 HA TYR 11 HA TYR 11 -7.988 -6.066 -0.493 52 HB2 TYR 11 1HB TYR 11 -9.937 -4.286 -0.463 53 HB3 TYR 11 2HB TYR 11 -9.547 -4.204 1.251 54 HD1 TYR 11 2HD TYR 11 -7.461 -4.490 -1.841 55 HD2 TYR 11 1HD TYR 11 -8.327 -2.302 1.703 56 HE1 TYR 11 2HE TYR 11 -5.606 -2.956 -2.343 57 HE2 TYR 11 1HE TYR 11 -6.475 -0.760 1.211 58 HH TYR 11 HH TYR 11 -4.478 -0.626 -0.054 59 H ASP 12 H ASP 12 -10.030 -6.178 2.425 60 HA ASP 12 HA ASP 12 -8.275 -5.900 4.436 61 HB2 ASP 12 1HB ASP 12 -10.512 -7.893 4.140 62 HB3 ASP 12 2HB ASP 12 -9.580 -7.776 5.630 63 H LYS 13 H LYS 13 -8.325 -8.520 2.164 64 HA LYS 13 HA LYS 13 -6.782 -10.396 3.582 65 HB2 LYS 13 1HB LYS 13 -6.800 -9.993 0.589 66 HB3 LYS 13 2HB LYS 13 -6.412 -11.471 1.460 67 HG2 LYS 13 1HG LYS 13 -9.102 -10.242 1.818 68 HG3 LYS 13 2HG LYS 13 -8.751 -11.150 0.345 69 HD2 LYS 13 1HD LYS 13 -8.089 -12.340 3.004 70 HD3 LYS 13 2HD LYS 13 -9.759 -12.360 2.433 71 HE2 LYS 13 1HE LYS 13 -9.098 -13.541 0.430 72 HE3 LYS 13 2HE LYS 13 -7.399 -13.427 0.887 73 HZ1 LYS 13 3HZ LYS 13 -9.157 -15.455 1.517 74 HZ2 LYS 13 1HZ LYS 13 -8.917 -14.615 2.966 75 HZ3 LYS 13 2HZ LYS 13 -7.592 -15.241 2.121 76 H GLN 14 H GLN 14 -5.740 -8.164 0.998 77 HA GLN 14 HA GLN 14 -2.976 -8.617 1.458 78 HB2 GLN 14 1HB GLN 14 -2.715 -6.529 0.029 79 HB3 GLN 14 2HB GLN 14 -3.565 -7.882 -0.706 80 HG2 GLN 14 1HG GLN 14 -5.228 -5.892 0.701 81 HG3 GLN 14 2HG GLN 14 -4.449 -5.363 -0.789 82 HE21 GLN 14 1HE2 GLN 14 -5.486 -5.754 -2.607 83 HE22 GLN 14 2HE2 GLN 14 -6.744 -6.917 -2.831 84 H LEU 15 H LEU 15 -5.305 -6.682 3.024 85 HA LEU 15 HA LEU 15 -3.648 -4.579 3.945 86 HB2 LEU 15 1HB LEU 15 -6.164 -5.741 5.131 87 HB3 LEU 15 2HB LEU 15 -5.412 -4.231 5.639 88 HG LEU 15 HG LEU 15 -6.864 -4.840 3.083 89 HD11 LEU 15 1HD1 LEU 15 -7.129 -2.490 4.936 90 HD12 LEU 15 2HD1 LEU 15 -8.019 -3.993 5.175 91 HD13 LEU 15 3HD1 LEU 15 -8.259 -3.051 3.704 92 HD21 LEU 15 3HD2 LEU 15 -5.199 -3.693 2.062 93 HD22 LEU 15 1HD2 LEU 15 -4.673 -2.909 3.552 94 HD23 LEU 15 2HD2 LEU 15 -6.093 -2.309 2.694 95 H LYS 16 H LYS 16 -5.070 -7.145 5.963 96 HA LYS 16 HA LYS 16 -3.443 -6.900 8.148 97 HB2 LYS 16 1HB LYS 16 -3.972 -9.238 8.670 98 HB3 LYS 16 2HB LYS 16 -5.392 -8.373 8.096 99 HG2 LYS 16 1HG LYS 16 -5.100 -9.377 5.881 100 HG3 LYS 16 2HG LYS 16 -3.693 -10.261 6.476 101 HD2 LYS 16 1HD LYS 16 -5.303 -11.172 8.273 102 HD3 LYS 16 2HD LYS 16 -6.584 -10.604 7.200 103 HE2 LYS 16 1HE LYS 16 -5.906 -12.051 5.465 104 HE3 LYS 16 2HE LYS 16 -4.363 -12.391 6.246 105 HZ1 LYS 16 3HZ LYS 16 -5.975 -14.216 6.457 106 HZ2 LYS 16 1HZ LYS 16 -7.010 -13.196 7.325 107 HZ3 LYS 16 2HZ LYS 16 -5.496 -13.605 7.960 108 H VAL 17 H VAL 17 -2.782 -8.662 5.165 109 HA VAL 17 HA VAL 17 -0.435 -9.967 5.981 110 HB VAL 17 HB VAL 17 -1.387 -9.075 3.266 111 HG11 VAL 17 1HG1 VAL 17 0.487 -10.882 2.645 112 HG12 VAL 17 2HG1 VAL 17 0.808 -9.148 2.708 113 HG13 VAL 17 3HG1 VAL 17 1.235 -10.176 4.077 114 HG21 VAL 17 3HG2 VAL 17 -1.565 -11.585 2.983 115 HG22 VAL 17 1HG2 VAL 17 -1.279 -11.707 4.719 116 HG23 VAL 17 2HG2 VAL 17 -2.698 -10.850 4.117 117 H LEU 18 H LEU 18 -0.934 -6.797 4.474 118 HA LEU 18 HA LEU 18 1.807 -6.145 4.228 119 HB2 LEU 18 1HB LEU 18 -0.706 -4.502 4.288 120 HB3 LEU 18 2HB LEU 18 0.887 -3.761 4.142 121 HG LEU 18 HG LEU 18 -0.072 -5.842 2.199 122 HD11 LEU 18 1HD1 LEU 18 -0.280 -2.924 1.617 123 HD12 LEU 18 2HD1 LEU 18 -1.586 -3.738 2.477 124 HD13 LEU 18 3HD1 LEU 18 -1.116 -4.284 0.868 125 HD21 LEU 18 3HD2 LEU 18 1.751 -3.596 1.532 126 HD22 LEU 18 1HD2 LEU 18 1.725 -5.253 0.929 127 HD23 LEU 18 2HD2 LEU 18 2.385 -4.907 2.528 128 H LEU 19 H LEU 19 -0.612 -4.875 6.529 129 HA LEU 19 HA LEU 19 0.901 -3.387 8.181 130 HB2 LEU 19 1HB LEU 19 -1.220 -5.378 8.953 131 HB3 LEU 19 2HB LEU 19 -0.544 -4.195 10.071 132 HG LEU 19 HG LEU 19 -1.931 -3.418 7.515 133 HD11 LEU 19 1HD1 LEU 19 -3.202 -4.740 9.505 134 HD12 LEU 19 2HD1 LEU 19 -3.961 -3.536 8.465 135 HD13 LEU 19 3HD1 LEU 19 -3.360 -3.072 10.056 136 HD21 LEU 19 3HD2 LEU 19 -1.283 -1.904 10.042 137 HD22 LEU 19 1HD2 LEU 19 -2.156 -1.263 8.651 138 HD23 LEU 19 2HD2 LEU 19 -0.464 -1.734 8.488 139 H SER 20 H SER 20 0.513 -6.911 8.561 140 HA SER 20 HA SER 20 2.102 -7.397 10.711 141 HB2 SER 20 1HB SER 20 0.840 -9.068 9.217 142 HB3 SER 20 2HB SER 20 2.313 -9.124 8.249 143 HG SER 20 HG SER 20 1.983 -10.689 10.102 144 H GLY 21 H GLY 21 3.259 -7.214 7.341 145 HA2 GLY 21 1HA GLY 21 5.264 -6.164 6.668 146 HA3 GLY 21 2HA GLY 21 5.821 -6.212 8.335 147 H ALA 22 H ALA 22 7.294 -6.999 5.995 148 HA ALA 22 HA ALA 22 7.859 -9.772 6.766 149 HB1 ALA 22 1HB ALA 22 7.098 -10.557 4.834 150 HB2 ALA 22 2HB ALA 22 6.789 -8.927 4.235 151 HB3 ALA 22 3HB ALA 22 8.379 -9.659 4.020 152 H THR 23 H THR 23 9.994 -10.309 6.802 153 HA THR 23 HA THR 23 11.898 -8.202 6.869 154 HB THR 23 HB THR 23 12.591 -11.132 6.731 155 HG1 THR 23 1HG THR 23 11.358 -9.656 8.783 156 HG21 THR 23 3HG2 THR 23 14.601 -10.554 7.636 157 HG22 THR 23 1HG2 THR 23 13.928 -9.198 8.539 158 HG23 THR 23 2HG2 THR 23 14.244 -9.036 6.812 159 H PHE 24 H PHE 24 13.219 -7.436 5.340 160 HA PHE 24 HA PHE 24 13.716 -9.022 2.933 161 HB2 PHE 24 1HB PHE 24 12.711 -6.168 2.889 162 HB3 PHE 24 2HB PHE 24 13.248 -7.080 1.482 163 HD1 PHE 24 2HD PHE 24 12.020 -9.706 1.996 164 HD2 PHE 24 1HD PHE 24 10.460 -5.778 2.502 165 HE1 PHE 24 2HE PHE 24 9.739 -10.576 1.691 166 HE2 PHE 24 1HE PHE 24 8.176 -6.642 2.199 167 HZ PHE 24 HZ PHE 24 7.813 -9.044 1.791 168 H LEU 25 H LEU 25 15.357 -7.790 1.493 169 HA LEU 25 HA LEU 25 17.478 -6.803 3.271 170 HB2 LEU 25 1HB LEU 25 17.446 -8.378 0.755 171 HB3 LEU 25 2HB LEU 25 18.812 -7.297 1.026 172 HG LEU 25 HG LEU 25 17.980 -9.417 2.996 173 HD11 LEU 25 1HD1 LEU 25 19.538 -9.622 0.498 174 HD12 LEU 25 2HD1 LEU 25 18.612 -10.845 1.366 175 HD13 LEU 25 3HD1 LEU 25 20.227 -10.405 1.920 176 HD21 LEU 25 3HD2 LEU 25 19.806 -7.264 3.093 177 HD22 LEU 25 1HD2 LEU 25 20.752 -8.749 2.987 178 HD23 LEU 25 2HD2 LEU 25 19.568 -8.550 4.278 179 H VAL 26 H VAL 26 17.805 -4.688 3.267 180 HA VAL 26 HA VAL 26 17.020 -3.120 0.914 181 HB VAL 26 HB VAL 26 17.734 -2.113 3.670 182 HG11 VAL 26 1HG1 VAL 26 16.063 -0.585 1.752 183 HG12 VAL 26 2HG1 VAL 26 17.207 -0.011 2.967 184 HG13 VAL 26 3HG1 VAL 26 17.797 -0.672 1.442 185 HG21 VAL 26 3HG2 VAL 26 15.742 -3.551 3.722 186 HG22 VAL 26 1HG2 VAL 26 15.345 -1.864 4.048 187 HG23 VAL 26 2HG2 VAL 26 15.004 -2.561 2.464 188 H THR 27 H THR 27 18.466 -2.074 -0.315 189 HA THR 27 HA THR 27 21.277 -2.071 0.578 190 HB THR 27 HB THR 27 20.481 -2.071 -2.322 191 HG1 THR 27 1HG THR 27 20.647 -4.334 -2.279 192 HG21 THR 27 3HG2 THR 27 22.825 -1.508 -1.503 193 HG22 THR 27 1HG2 THR 27 22.699 -2.786 -2.711 194 HG23 THR 27 2HG2 THR 27 22.948 -3.197 -1.014 195 H PHE 28 H PHE 28 22.391 -0.198 0.482 196 HA PHE 28 HA PHE 28 20.972 2.146 -0.602 197 HB2 PHE 28 1HB PHE 28 22.844 1.872 1.746 198 HB3 PHE 28 2HB PHE 28 22.460 3.434 1.031 199 HD1 PHE 28 2HD PHE 28 19.859 3.866 0.733 200 HD2 PHE 28 1HD PHE 28 21.594 1.170 3.532 201 HE1 PHE 28 2HE PHE 28 17.828 4.000 2.115 202 HE2 PHE 28 1HE PHE 28 19.565 1.299 4.919 203 HZ PHE 28 HZ PHE 28 17.680 2.716 4.212 204 H GLY 29 H GLY 29 22.342 3.888 -1.448 205 HA2 GLY 29 1HA GLY 29 24.190 2.918 -3.354 206 HA3 GLY 29 2HA GLY 29 23.901 4.609 -2.972 207 H ASN 30 H ASN 30 24.603 3.574 -0.067 208 HA ASN 30 HA ASN 30 27.447 4.195 -0.359 209 HB2 ASN 30 1HB ASN 30 26.075 3.931 2.292 210 HB3 ASN 30 2HB ASN 30 27.420 4.971 1.833 211 HD21 ASN 30 1HD2 ASN 30 24.050 4.690 2.174 212 HD22 ASN 30 2HD2 ASN 30 23.623 6.261 1.596 213 H SER 31 H SER 31 25.277 1.714 0.863 214 HA SER 31 HA SER 31 27.549 0.059 1.671 215 HB2 SER 31 1HB SER 31 25.957 -1.343 2.800 216 HB3 SER 31 2HB SER 31 25.545 0.330 3.176 217 HG SER 31 HG SER 31 23.967 0.186 1.474 218 H GLU 32 H GLU 32 28.384 -1.348 0.293 219 HA GLU 32 HA GLU 32 27.055 -1.988 -2.175 220 HB2 GLU 32 1HB GLU 32 29.068 -3.052 -2.818 221 HB3 GLU 32 2HB GLU 32 29.552 -1.642 -1.886 222 HG2 GLU 32 1HG GLU 32 29.282 -4.324 -0.589 223 HG3 GLU 32 2HG GLU 32 30.745 -3.876 -1.465 224 H LYS 33 H LYS 33 26.869 -3.213 0.912 225 HA LYS 33 HA LYS 33 26.016 -5.854 -0.081 226 HB2 LYS 33 1HB LYS 33 27.714 -6.490 1.312 227 HB3 LYS 33 2HB LYS 33 27.576 -5.052 2.314 228 HG2 LYS 33 1HG LYS 33 25.858 -5.952 3.591 229 HG3 LYS 33 2HG LYS 33 25.461 -7.168 2.374 230 HD2 LYS 33 1HD LYS 33 28.159 -7.197 3.654 231 HD3 LYS 33 2HD LYS 33 26.773 -7.836 4.540 232 HE2 LYS 33 1HE LYS 33 27.855 -8.751 1.883 233 HE3 LYS 33 2HE LYS 33 27.785 -9.660 3.392 234 HZ1 LYS 33 3HZ LYS 33 25.205 -9.035 2.999 235 HZ2 LYS 33 1HZ LYS 33 25.918 -10.491 2.517 236 HZ3 LYS 33 2HZ LYS 33 25.736 -9.230 1.405 237 HA PRO 34 HA PRO 34 21.972 -4.777 1.314 238 HB2 PRO 34 1HB PRO 34 20.910 -7.274 1.390 239 HB3 PRO 34 2HB PRO 34 21.217 -6.406 -0.119 240 HG2 PRO 34 1HG PRO 34 22.858 -8.525 1.214 241 HG3 PRO 34 2HG PRO 34 22.456 -8.335 -0.503 242 HD2 PRO 34 1HD PRO 34 24.848 -7.589 0.525 243 HD3 PRO 34 2HD PRO 34 24.088 -6.742 -0.838 244 H GLU 35 H GLU 35 20.831 -4.660 3.207 245 HA GLU 35 HA GLU 35 21.890 -6.201 5.485 246 HB2 GLU 35 1HB GLU 35 22.535 -3.888 5.726 247 HB3 GLU 35 2HB GLU 35 20.890 -3.352 5.413 248 HG2 GLU 35 1HG GLU 35 21.162 -3.161 7.723 249 HG3 GLU 35 2HG GLU 35 20.230 -4.640 7.495 250 H THR 36 H THR 36 20.453 -7.120 6.886 251 HA THR 36 HA THR 36 17.822 -7.623 5.923 252 HB THR 36 HB THR 36 18.929 -8.243 8.667 253 HG1 THR 36 1HG THR 36 19.140 -9.578 6.177 254 HG21 THR 36 3HG2 THR 36 17.254 -10.215 8.277 255 HG22 THR 36 1HG2 THR 36 16.504 -9.095 7.141 256 HG23 THR 36 2HG2 THR 36 16.662 -8.653 8.841 257 H MET 37 H MET 37 16.282 -6.117 5.982 258 HA MET 37 HA MET 37 15.882 -4.650 8.501 259 HB2 MET 37 1HB MET 37 15.449 -3.506 5.738 260 HB3 MET 37 2HB MET 37 15.246 -2.663 7.267 261 HG2 MET 37 1HG MET 37 17.693 -3.064 7.685 262 HG3 MET 37 2HG MET 37 17.802 -3.620 6.017 263 HE1 MET 37 3HE MET 37 16.661 0.670 7.274 264 HE2 MET 37 1HE MET 37 15.573 -0.701 7.492 265 HE3 MET 37 2HE MET 37 17.082 -0.620 8.402 266 H THR 38 H THR 38 13.699 -4.049 8.962 267 HA THR 38 HA THR 38 11.781 -5.955 7.868 268 HB THR 38 HB THR 38 11.476 -4.062 10.207 269 HG1 THR 38 1HG THR 38 12.387 -5.585 11.367 270 HG21 THR 38 3HG2 THR 38 9.648 -5.893 8.836 271 HG22 THR 38 1HG2 THR 38 9.301 -4.560 9.937 272 HG23 THR 38 2HG2 THR 38 9.737 -6.144 10.579 273 H CYS 39 H CYS 39 9.785 -5.365 6.998 274 HA CYS 39 HA CYS 39 9.390 -2.520 6.398 275 HB2 CYS 39 1HB CYS 39 9.052 -4.716 4.349 276 HB3 CYS 39 2HB CYS 39 8.876 -2.985 4.085 277 HG CYS 39 HG CYS 39 11.883 -3.924 5.242 278 H ARG 40 H ARG 40 7.392 -1.858 6.834 279 HA ARG 40 HA ARG 40 5.111 -3.590 6.466 280 HB2 ARG 40 1HB ARG 40 4.357 -3.657 8.707 281 HB3 ARG 40 2HB ARG 40 6.052 -4.121 8.765 282 HG2 ARG 40 1HG ARG 40 6.421 -1.570 9.222 283 HG3 ARG 40 2HG ARG 40 4.731 -1.635 9.729 284 HD2 ARG 40 1HD ARG 40 5.182 -3.136 11.456 285 HD3 ARG 40 2HD ARG 40 6.725 -3.622 10.755 286 HE ARG 40 HE ARG 40 6.889 -0.910 11.380 287 HH11 ARG 40 1HH1 ARG 40 6.544 -3.966 13.012 288 HH12 ARG 40 2HH1 ARG 40 7.338 -3.432 14.457 289 HH21 ARG 40 1HH2 ARG 40 7.936 -0.196 13.277 290 HH22 ARG 40 2HH2 ARG 40 8.129 -1.287 14.606 291 H LEU 41 H LEU 41 3.050 -2.422 7.033 292 HA LEU 41 HA LEU 41 3.346 0.409 6.312 293 HB2 LEU 41 1HB LEU 41 1.283 -1.664 5.804 294 HB3 LEU 41 2HB LEU 41 0.745 0.007 5.954 295 HG LEU 41 HG LEU 41 2.965 -0.632 4.066 296 HD11 LEU 41 1HD1 LEU 41 1.703 -2.084 2.943 297 HD12 LEU 41 2HD1 LEU 41 0.691 -0.706 2.510 298 HD13 LEU 41 3HD1 LEU 41 0.271 -1.707 3.900 299 HD21 LEU 41 3HD2 LEU 41 2.464 1.375 3.148 300 HD22 LEU 41 1HD2 LEU 41 1.806 1.680 4.755 301 HD23 LEU 41 2HD2 LEU 41 0.733 1.203 3.440 302 H SER 42 H SER 42 2.124 2.012 7.378 303 HA SER 42 HA SER 42 1.925 1.675 10.180 304 HB2 SER 42 1HB SER 42 1.505 3.942 10.271 305 HB3 SER 42 2HB SER 42 2.262 3.835 8.682 306 HG SER 42 HG SER 42 -0.005 4.894 9.130 307 H ASN 43 H ASN 43 -0.123 2.353 11.385 308 HA ASN 43 HA ASN 43 -2.063 0.433 11.176 309 HB2 ASN 43 1HB ASN 43 -1.624 2.285 12.991 310 HB3 ASN 43 2HB ASN 43 -2.864 3.165 12.102 311 HD21 ASN 43 1HD2 ASN 43 -4.934 2.703 12.470 312 HD22 ASN 43 2HD2 ASN 43 -5.502 1.394 13.444 313 H ASN 44 H ASN 44 -2.003 3.608 9.629 314 HA ASN 44 HA ASN 44 -4.554 3.087 8.320 315 HB2 ASN 44 1HB ASN 44 -2.795 5.476 8.664 316 HB3 ASN 44 2HB ASN 44 -3.887 5.436 7.282 317 HD21 ASN 44 1HD2 ASN 44 -3.919 7.207 9.563 318 HD22 ASN 44 2HD2 ASN 44 -5.455 6.998 10.327 319 H GLN 45 H GLN 45 -1.258 2.628 7.742 320 HA GLN 45 HA GLN 45 -0.102 1.831 5.950 321 HB2 GLN 45 1HB GLN 45 -2.743 1.620 4.507 322 HB3 GLN 45 2HB GLN 45 -1.268 0.717 4.187 323 HG2 GLN 45 1HG GLN 45 -1.502 -0.538 6.188 324 HG3 GLN 45 2HG GLN 45 -2.806 0.501 6.759 325 HE21 GLN 45 1HE2 GLN 45 -3.443 -1.994 6.861 326 HE22 GLN 45 2HE2 GLN 45 -4.455 -2.493 5.553 327 H ARG 46 H ARG 46 -0.363 4.601 6.277 328 HA ARG 46 HA ARG 46 -0.633 5.611 3.531 329 HB2 ARG 46 1HB ARG 46 -0.532 7.099 6.162 330 HB3 ARG 46 2HB ARG 46 -0.678 7.855 4.581 331 HG2 ARG 46 1HG ARG 46 -2.680 5.792 5.302 332 HG3 ARG 46 2HG ARG 46 -2.777 7.356 6.114 333 HD2 ARG 46 1HD ARG 46 -4.058 7.832 4.299 334 HD3 ARG 46 2HD ARG 46 -2.478 8.229 3.623 335 HE ARG 46 HE ARG 46 -2.758 5.621 2.998 336 HH11 ARG 46 1HH1 ARG 46 -4.816 8.395 2.571 337 HH12 ARG 46 2HH1 ARG 46 -5.560 7.785 1.130 338 HH21 ARG 46 1HH2 ARG 46 -3.730 4.806 1.102 339 HH22 ARG 46 2HH2 ARG 46 -4.942 5.743 0.296 340 H TYR 47 H TYR 47 1.652 4.864 5.963 341 HA TYR 47 HA TYR 47 3.782 6.014 4.303 342 HB2 TYR 47 1HB TYR 47 3.830 6.124 7.320 343 HB3 TYR 47 2HB TYR 47 4.963 6.873 6.200 344 HD1 TYR 47 1HD TYR 47 4.239 8.829 4.841 345 HD2 TYR 47 2HD TYR 47 1.792 7.199 7.917 346 HE1 TYR 47 1HE TYR 47 2.908 10.897 4.871 347 HE2 TYR 47 2HE TYR 47 0.454 9.262 7.954 348 HH TYR 47 HH TYR 47 0.829 11.710 7.327 349 H LEU 48 H LEU 48 5.843 4.973 4.534 350 HA LEU 48 HA LEU 48 5.580 2.182 5.418 351 HB2 LEU 48 1HB LEU 48 7.256 3.516 3.322 352 HB3 LEU 48 2HB LEU 48 7.687 1.929 3.955 353 HG LEU 48 HG LEU 48 5.049 2.559 2.638 354 HD11 LEU 48 1HD1 LEU 48 7.669 2.052 1.494 355 HD12 LEU 48 2HD1 LEU 48 6.180 2.595 0.721 356 HD13 LEU 48 3HD1 LEU 48 6.463 0.873 0.976 357 HD21 LEU 48 3HD2 LEU 48 6.010 -0.183 2.636 358 HD22 LEU 48 1HD2 LEU 48 4.443 0.468 3.118 359 HD23 LEU 48 2HD2 LEU 48 5.783 0.454 4.266 360 H PHE 49 H PHE 49 7.020 1.280 6.824 361 HA PHE 49 HA PHE 49 9.040 3.091 7.974 362 HB2 PHE 49 1HB PHE 49 7.526 0.907 9.419 363 HB3 PHE 49 2HB PHE 49 8.678 2.031 10.132 364 HD1 PHE 49 1HD PHE 49 7.699 4.491 8.599 365 HD2 PHE 49 2HD PHE 49 5.667 1.455 10.783 366 HE1 PHE 49 1HE PHE 49 5.868 6.063 9.074 367 HE2 PHE 49 2HE PHE 49 3.832 3.022 11.261 368 HZ PHE 49 HZ PHE 49 3.930 5.329 10.406 369 H LEU 50 H LEU 50 11.051 2.254 8.487 370 HA LEU 50 HA LEU 50 11.568 -0.528 7.688 371 HB2 LEU 50 1HB LEU 50 13.403 1.775 7.063 372 HB3 LEU 50 2HB LEU 50 13.570 0.099 6.543 373 HG LEU 50 HG LEU 50 11.408 2.000 5.638 374 HD11 LEU 50 1HD1 LEU 50 12.847 1.369 3.435 375 HD12 LEU 50 2HD1 LEU 50 14.116 1.426 4.658 376 HD13 LEU 50 3HD1 LEU 50 13.082 2.830 4.394 377 HD21 LEU 50 3HD2 LEU 50 11.372 0.038 3.841 378 HD22 LEU 50 1HD2 LEU 50 10.394 -0.005 5.308 379 HD23 LEU 50 2HD2 LEU 50 11.917 -0.892 5.237 380 H ASP 51 H ASP 51 12.436 -1.624 9.307 381 HA ASP 51 HA ASP 51 13.993 -0.156 11.331 382 HB2 ASP 51 1HB ASP 51 11.910 -1.217 12.161 383 HB3 ASP 51 2HB ASP 51 12.526 -2.784 11.642 384 H GLY 52 H GLY 52 16.020 -0.822 11.863 385 HA2 GLY 52 1HA GLY 52 17.242 -3.227 11.660 386 HA3 GLY 52 2HA GLY 52 17.321 -2.620 10.012 387 H ASP 53 H ASP 53 19.389 -2.072 9.709 388 HA ASP 53 HA ASP 53 21.319 -1.366 11.463 389 HB2 ASP 53 1HB ASP 53 21.865 -1.636 9.146 390 HB3 ASP 53 2HB ASP 53 20.849 -0.272 8.688 391 H SER 54 H SER 54 19.018 0.891 9.969 392 HA SER 54 HA SER 54 19.334 2.671 12.257 393 HB2 SER 54 1HB SER 54 19.987 3.407 9.414 394 HB3 SER 54 2HB SER 54 19.434 4.630 10.558 395 HG SER 54 HG SER 54 21.653 4.570 10.654 396 H HIS 55 H HIS 55 17.641 4.291 12.395 397 HA HIS 55 HA HIS 55 15.100 3.223 11.645 398 HB2 HIS 55 1HB HIS 55 14.155 4.905 12.980 399 HB3 HIS 55 2HB HIS 55 15.696 4.565 13.761 400 HD2 HIS 55 2HD HIS 55 17.510 6.668 13.783 401 HE1 HIS 55 1HE HIS 55 14.993 9.460 11.816 402 HE2 HIS 55 2HE HIS 55 17.189 9.112 13.000 403 H TYR 56 H TYR 56 14.236 3.422 9.696 404 HA TYR 56 HA TYR 56 14.641 5.946 8.231 405 HB2 TYR 56 1HB TYR 56 14.898 3.122 7.316 406 HB3 TYR 56 2HB TYR 56 14.231 4.294 6.185 407 HD1 TYR 56 1HD TYR 56 15.627 6.479 5.862 408 HD2 TYR 56 2HD TYR 56 17.198 2.863 7.462 409 HE1 TYR 56 1HE TYR 56 17.900 7.216 5.280 410 HE2 TYR 56 2HE TYR 56 19.476 3.591 6.886 411 HH TYR 56 HH TYR 56 20.549 5.155 5.250 412 H GLU 57 H GLU 57 12.906 6.681 6.951 413 HA GLU 57 HA GLU 57 10.366 5.265 7.147 414 HB2 GLU 57 1HB GLU 57 10.793 8.067 8.192 415 HB3 GLU 57 2HB GLU 57 9.213 7.350 7.911 416 HG2 GLU 57 1HG GLU 57 9.424 5.868 9.668 417 HG3 GLU 57 2HG GLU 57 11.183 5.976 9.682 418 H ILE 58 H ILE 58 9.716 5.139 5.108 419 HA ILE 58 HA ILE 58 10.225 7.413 3.312 420 HB ILE 58 HB ILE 58 9.603 4.542 2.609 421 HG12 ILE 58 1HG1 ILE 58 12.183 5.963 2.034 422 HG13 ILE 58 2HG1 ILE 58 11.914 5.229 3.611 423 HG21 ILE 58 1HG2 ILE 58 9.523 5.104 0.417 424 HG22 ILE 58 2HG2 ILE 58 8.981 6.644 1.081 425 HG23 ILE 58 3HG2 ILE 58 10.665 6.434 0.603 426 HD11 ILE 58 3HD1 ILE 58 11.588 3.066 2.573 427 HD12 ILE 58 1HD1 ILE 58 11.783 3.785 0.975 428 HD13 ILE 58 2HD1 ILE 58 13.141 3.755 2.100 429 H GLU 59 H GLU 59 8.496 8.730 3.438 430 HA GLU 59 HA GLU 59 5.829 7.807 3.817 431 HB2 GLU 59 1HB GLU 59 6.763 10.504 2.823 432 HB3 GLU 59 2HB GLU 59 5.176 10.127 3.478 433 HG2 GLU 59 1HG GLU 59 6.124 11.037 5.322 434 HG3 GLU 59 2HG GLU 59 6.611 9.359 5.558 435 H ILE 60 H ILE 60 4.296 7.282 2.377 436 HA ILE 60 HA ILE 60 4.975 6.728 -0.303 437 HB ILE 60 HB ILE 60 2.221 6.963 0.917 438 HG12 ILE 60 1HG1 ILE 60 3.951 4.515 0.507 439 HG13 ILE 60 2HG1 ILE 60 3.727 5.333 2.049 440 HG21 ILE 60 1HG2 ILE 60 1.767 6.942 -1.329 441 HG22 ILE 60 2HG2 ILE 60 3.219 6.024 -1.726 442 HG23 ILE 60 3HG2 ILE 60 1.833 5.210 -1.001 443 HD11 ILE 60 3HD1 ILE 60 2.186 3.273 0.952 444 HD12 ILE 60 1HD1 ILE 60 1.882 4.183 2.431 445 HD13 ILE 60 2HD1 ILE 60 1.180 4.721 0.905 446 H VAL 61 H VAL 61 4.264 9.643 1.160 447 HA VAL 61 HA VAL 61 2.826 10.882 -0.998 448 HB VAL 61 HB VAL 61 3.050 12.940 0.214 449 HG11 VAL 61 1HG1 VAL 61 1.677 12.381 1.917 450 HG12 VAL 61 2HG1 VAL 61 1.735 10.789 1.158 451 HG13 VAL 61 3HG1 VAL 61 2.773 11.147 2.538 452 HG21 VAL 61 3HG2 VAL 61 4.461 12.401 2.530 453 HG22 VAL 61 1HG2 VAL 61 5.433 11.656 1.261 454 HG23 VAL 61 2HG2 VAL 61 5.023 13.368 1.166 455 H HIS 62 H HIS 62 6.157 10.408 -0.140 456 HA HIS 62 HA HIS 62 7.087 12.371 -2.080 457 HB2 HIS 62 1HB HIS 62 8.441 10.649 -0.024 458 HB3 HIS 62 2HB HIS 62 9.376 11.428 -1.296 459 HD2 HIS 62 2HD HIS 62 8.483 12.166 2.196 460 HE1 HIS 62 1HE HIS 62 8.637 15.978 0.339 461 HE2 HIS 62 2HE HIS 62 8.666 14.726 2.524 462 H ILE 63 H ILE 63 6.574 8.965 -1.785 463 HA ILE 63 HA ILE 63 8.336 8.021 -3.755 464 HB ILE 63 HB ILE 63 5.627 6.857 -3.118 465 HG12 ILE 63 1HG1 ILE 63 8.278 6.450 -1.719 466 HG13 ILE 63 2HG1 ILE 63 6.851 7.224 -1.040 467 HG21 ILE 63 1HG2 ILE 63 7.889 5.089 -3.675 468 HG22 ILE 63 2HG2 ILE 63 6.236 5.045 -4.285 469 HG23 ILE 63 3HG2 ILE 63 7.422 6.115 -5.031 470 HD11 ILE 63 3HD1 ILE 63 6.589 5.177 -0.132 471 HD12 ILE 63 1HD1 ILE 63 5.780 4.871 -1.669 472 HD13 ILE 63 2HD1 ILE 63 7.453 4.363 -1.436 473 H SER 64 H SER 64 8.242 7.908 -5.930 474 HA SER 64 HA SER 64 5.908 9.147 -7.231 475 HB2 SER 64 1HB SER 64 8.071 10.362 -7.488 476 HB3 SER 64 2HB SER 64 8.735 8.943 -8.297 477 HG SER 64 HG SER 64 7.976 9.941 -10.001 478 H THR 65 H THR 65 8.445 6.714 -7.820 479 HA THR 65 HA THR 65 6.543 5.263 -9.537 480 HB THR 65 HB THR 65 9.554 4.986 -9.463 481 HG1 THR 65 1HG THR 65 9.302 6.053 -11.580 482 HG21 THR 65 3HG2 THR 65 7.372 3.653 -10.995 483 HG22 THR 65 1HG2 THR 65 8.863 2.978 -10.340 484 HG23 THR 65 2HG2 THR 65 8.908 3.958 -11.806 485 H VAL 66 H VAL 66 6.096 3.125 -9.173 486 HA VAL 66 HA VAL 66 7.474 1.743 -6.996 487 HB VAL 66 HB VAL 66 4.491 2.192 -7.082 488 HG11 VAL 66 1HG1 VAL 66 5.278 0.749 -4.772 489 HG12 VAL 66 2HG1 VAL 66 4.189 0.243 -6.064 490 HG13 VAL 66 3HG1 VAL 66 5.916 -0.096 -6.181 491 HG21 VAL 66 3HG2 VAL 66 4.734 3.331 -5.048 492 HG22 VAL 66 1HG2 VAL 66 6.361 2.702 -4.790 493 HG23 VAL 66 2HG2 VAL 66 6.072 3.913 -6.039 494 H GLN 67 H GLN 67 8.233 0.025 -8.068 495 HA GLN 67 HA GLN 67 6.299 -1.672 -9.471 496 HB2 GLN 67 1HB GLN 67 7.714 -2.006 -11.352 497 HB3 GLN 67 2HB GLN 67 7.606 -0.267 -11.111 498 HG2 GLN 67 1HG GLN 67 9.781 -0.263 -10.029 499 HG3 GLN 67 2HG GLN 67 9.887 -2.013 -10.212 500 HE21 GLN 67 1HE2 GLN 67 11.410 -2.392 -11.659 501 HE22 GLN 67 2HE2 GLN 67 11.547 -1.635 -13.206 502 H ILE 68 H ILE 68 6.964 -3.903 -9.662 503 HA ILE 68 HA ILE 68 8.757 -4.681 -7.468 504 HB ILE 68 HB ILE 68 6.629 -6.302 -8.870 505 HG12 ILE 68 1HG1 ILE 68 6.648 -5.260 -6.035 506 HG13 ILE 68 2HG1 ILE 68 5.856 -4.422 -7.365 507 HG21 ILE 68 1HG2 ILE 68 8.639 -7.553 -7.981 508 HG22 ILE 68 2HG2 ILE 68 8.132 -7.038 -6.373 509 HG23 ILE 68 3HG2 ILE 68 7.071 -8.054 -7.348 510 HD11 ILE 68 3HD1 ILE 68 4.851 -6.970 -7.552 511 HD12 ILE 68 1HD1 ILE 68 4.977 -6.709 -5.812 512 HD13 ILE 68 2HD1 ILE 68 4.050 -5.586 -6.808 513 H LEU 69 H LEU 69 10.513 -5.945 -7.800 514 HA LEU 69 HA LEU 69 11.393 -6.291 -10.539 515 HB2 LEU 69 1HB LEU 69 12.773 -6.961 -7.944 516 HB3 LEU 69 2HB LEU 69 13.513 -6.990 -9.543 517 HG LEU 69 HG LEU 69 12.403 -4.494 -8.271 518 HD11 LEU 69 1HD1 LEU 69 14.265 -5.508 -6.952 519 HD12 LEU 69 2HD1 LEU 69 14.618 -3.912 -7.611 520 HD13 LEU 69 3HD1 LEU 69 15.288 -5.350 -8.380 521 HD21 LEU 69 3HD2 LEU 69 14.529 -4.449 -10.319 522 HD22 LEU 69 1HD2 LEU 69 13.155 -3.370 -10.081 523 HD23 LEU 69 2HD2 LEU 69 12.923 -4.933 -10.867 524 H THR 70 H THR 70 10.727 -8.020 -11.623 525 HA THR 70 HA THR 70 10.698 -10.616 -10.227 526 HB THR 70 HB THR 70 8.870 -11.331 -11.720 527 HG1 THR 70 1HG THR 70 8.902 -8.603 -12.553 528 HG21 THR 70 3HG2 THR 70 7.118 -9.660 -10.785 529 HG22 THR 70 1HG2 THR 70 8.491 -8.957 -9.931 530 HG23 THR 70 2HG2 THR 70 8.050 -10.642 -9.656 531 H GLU 71 H GLU 71 12.433 -11.694 -10.921 532 HA GLU 71 HA GLU 71 13.930 -11.290 -13.178 533 HB2 GLU 71 1HB GLU 71 14.246 -12.915 -11.140 534 HB3 GLU 71 2HB GLU 71 13.514 -14.095 -12.219 535 HG2 GLU 71 1HG GLU 71 15.960 -12.472 -12.879 536 HG3 GLU 71 2HG GLU 71 15.988 -14.112 -12.234 537 H GLY 72 H GLY 72 14.065 -12.275 -15.231 538 HA2 GLY 72 1HA GLY 72 13.002 -14.053 -16.682 539 HA3 GLY 72 2HA GLY 72 11.478 -13.328 -16.190 540 H PHE 73 H PHE 73 14.516 -12.656 -17.878 541 HA PHE 73 HA PHE 73 14.028 -10.176 -18.921 542 HB2 PHE 73 1HB PHE 73 15.565 -12.539 -19.832 543 HB3 PHE 73 2HB PHE 73 15.218 -11.322 -21.056 544 HD1 PHE 73 1HD PHE 73 15.484 -8.807 -19.827 545 HD2 PHE 73 2HD PHE 73 17.707 -12.354 -19.054 546 HE1 PHE 73 1HE PHE 73 17.363 -7.447 -19.007 547 HE2 PHE 73 2HE PHE 73 19.589 -10.999 -18.232 548 HZ PHE 73 HZ PHE 73 19.419 -8.542 -18.207 549 HA PRO 74 HA PRO 74 11.642 -12.060 -22.671 550 HB2 PRO 74 1HB PRO 74 10.986 -14.692 -22.544 551 HB3 PRO 74 2HB PRO 74 12.506 -14.113 -23.235 552 HG2 PRO 74 1HG PRO 74 11.969 -15.234 -20.512 553 HG3 PRO 74 2HG PRO 74 13.325 -15.558 -21.607 554 HD2 PRO 74 1HD PRO 74 13.523 -13.861 -19.506 555 HD3 PRO 74 2HD PRO 74 14.430 -13.625 -21.014 556 HA PRO 75 HA PRO 75 7.602 -11.812 -20.953 557 HB2 PRO 75 1HB PRO 75 6.053 -12.911 -22.893 558 HB3 PRO 75 2HB PRO 75 6.827 -11.331 -23.062 559 HG2 PRO 75 1HG PRO 75 7.695 -13.989 -24.129 560 HG3 PRO 75 2HG PRO 75 7.691 -12.408 -24.932 561 HD2 PRO 75 1HD PRO 75 9.932 -13.499 -23.872 562 HD3 PRO 75 2HD PRO 75 9.651 -11.746 -23.914 563 H GLY 76 H GLY 76 5.801 -13.004 -20.084 564 HA2 GLY 76 1HA GLY 76 6.151 -15.925 -20.018 565 HA3 GLY 76 2HA GLY 76 6.065 -15.032 -18.506 566 H GLY 77 H GLY 77 4.155 -15.387 -17.590 567 HA2 GLY 77 1HA GLY 77 1.758 -14.409 -18.354 568 HA3 GLY 77 2HA GLY 77 1.814 -15.952 -19.193 569 H GLY 78 H GLY 78 3.126 -17.500 -17.270 570 HA2 GLY 78 1HA GLY 78 1.181 -17.440 -15.045 571 HA3 GLY 78 2HA GLY 78 1.673 -18.932 -15.831 572 H ASN 79 H ASN 79 4.414 -18.508 -16.041 573 HA ASN 79 HA ASN 79 5.203 -19.030 -13.313 574 HB2 ASN 79 1HB ASN 79 7.387 -19.594 -14.275 575 HB3 ASN 79 2HB ASN 79 6.090 -20.403 -15.150 576 HD21 ASN 79 1HD2 ASN 79 5.424 -19.493 -17.185 577 HD22 ASN 79 2HD2 ASN 79 6.566 -18.623 -18.146 578 H ALA 80 H ALA 80 5.615 -17.398 -11.981 579 HA ALA 80 HA ALA 80 7.623 -15.468 -12.575 580 HB1 ALA 80 1HB ALA 80 6.440 -13.766 -13.357 581 HB2 ALA 80 2HB ALA 80 4.990 -14.770 -13.334 582 HB3 ALA 80 3HB ALA 80 5.412 -13.799 -11.924 583 H ARG 81 H ARG 81 8.667 -15.337 -10.709 584 HA ARG 81 HA ARG 81 7.095 -15.321 -8.215 585 HB2 ARG 81 1HB ARG 81 9.794 -16.554 -8.774 586 HB3 ARG 81 2HB ARG 81 9.152 -16.328 -7.153 587 HG2 ARG 81 1HG ARG 81 8.588 -18.511 -7.591 588 HG3 ARG 81 2HG ARG 81 7.114 -17.659 -8.055 589 HD2 ARG 81 1HD ARG 81 7.466 -19.117 -9.829 590 HD3 ARG 81 2HD ARG 81 8.150 -17.600 -10.411 591 HE ARG 81 HE ARG 81 10.182 -18.626 -10.514 592 HH11 ARG 81 1HH1 ARG 81 8.140 -20.426 -8.344 593 HH12 ARG 81 2HH1 ARG 81 9.290 -21.701 -8.111 594 HH21 ARG 81 1HH2 ARG 81 11.705 -20.297 -10.214 595 HH22 ARG 81 2HH2 ARG 81 11.318 -21.626 -9.174 596 H ALA 82 H ALA 82 7.302 -13.567 -6.991 597 HA ALA 82 HA ALA 82 8.854 -11.353 -7.768 598 HB1 ALA 82 1HB ALA 82 7.888 -10.225 -6.015 599 HB2 ALA 82 2HB ALA 82 6.722 -11.526 -6.261 600 HB3 ALA 82 3HB ALA 82 7.903 -11.635 -4.956 601 H THR 83 H THR 83 10.980 -11.135 -7.629 602 HA THR 83 HA THR 83 12.449 -12.622 -5.574 603 HB THR 83 HB THR 83 14.457 -12.172 -6.883 604 HG1 THR 83 1HG THR 83 13.755 -10.112 -7.721 605 HG21 THR 83 3HG2 THR 83 13.321 -14.154 -7.531 606 HG22 THR 83 1HG2 THR 83 13.766 -13.330 -9.025 607 HG23 THR 83 2HG2 THR 83 12.107 -13.247 -8.432 608 H GLY 84 H GLY 84 11.567 -9.414 -6.534 609 HA2 GLY 84 1HA GLY 84 12.484 -8.314 -4.067 610 HA3 GLY 84 2HA GLY 84 13.532 -7.845 -5.397 611 H MET 85 H MET 85 12.296 -5.874 -4.054 612 HA MET 85 HA MET 85 10.166 -5.025 -5.905 613 HB2 MET 85 1HB MET 85 9.068 -5.313 -3.843 614 HB3 MET 85 2HB MET 85 10.412 -4.636 -2.933 615 HG2 MET 85 1HG MET 85 8.703 -3.020 -2.899 616 HG3 MET 85 2HG MET 85 9.913 -2.437 -4.039 617 HE1 MET 85 3HE MET 85 5.562 -3.204 -4.688 618 HE2 MET 85 1HE MET 85 6.524 -3.448 -3.230 619 HE3 MET 85 2HE MET 85 6.300 -1.823 -3.876 620 H PHE 86 H PHE 86 10.175 -2.874 -6.582 621 HA PHE 86 HA PHE 86 12.607 -1.349 -5.924 622 HB2 PHE 86 1HB PHE 86 12.459 -2.460 -8.267 623 HB3 PHE 86 2HB PHE 86 11.295 -1.188 -8.622 624 HD1 PHE 86 2HD PHE 86 14.653 -1.464 -7.010 625 HD2 PHE 86 1HD PHE 86 12.132 0.628 -9.726 626 HE1 PHE 86 2HE PHE 86 16.501 0.073 -7.535 627 HE2 PHE 86 1HE PHE 86 13.976 2.168 -10.257 628 HZ PHE 86 HZ PHE 86 16.163 1.893 -9.160 629 H LEU 87 H LEU 87 12.184 0.550 -5.030 630 HA LEU 87 HA LEU 87 9.714 1.957 -5.786 631 HB2 LEU 87 1HB LEU 87 10.826 1.946 -2.993 632 HB3 LEU 87 2HB LEU 87 9.274 2.575 -3.540 633 HG LEU 87 HG LEU 87 9.821 -0.341 -3.832 634 HD11 LEU 87 1HD1 LEU 87 8.520 0.255 -1.331 635 HD12 LEU 87 2HD1 LEU 87 10.149 0.926 -1.374 636 HD13 LEU 87 3HD1 LEU 87 9.898 -0.795 -1.661 637 HD21 LEU 87 3HD2 LEU 87 7.486 1.484 -3.633 638 HD22 LEU 87 1HD2 LEU 87 7.308 -0.161 -3.022 639 HD23 LEU 87 2HD2 LEU 87 7.763 0.109 -4.704 640 H GLN 88 H GLN 88 9.871 4.149 -6.015 641 HA GLN 88 HA GLN 88 12.552 5.309 -5.634 642 HB2 GLN 88 1HB GLN 88 10.513 5.727 -7.804 643 HB3 GLN 88 2HB GLN 88 11.771 6.915 -7.492 644 HG2 GLN 88 1HG GLN 88 13.333 4.800 -7.682 645 HG3 GLN 88 2HG GLN 88 11.978 4.180 -8.624 646 HE21 GLN 88 1HE2 GLN 88 11.092 6.376 -9.928 647 HE22 GLN 88 2HE2 GLN 88 12.311 6.976 -10.995 648 H TYR 89 H TYR 89 12.738 7.260 -4.632 649 HA TYR 89 HA TYR 89 10.443 8.920 -4.111 650 HB2 TYR 89 1HB TYR 89 10.723 8.810 -1.622 651 HB3 TYR 89 2HB TYR 89 10.085 7.336 -2.341 652 HD1 TYR 89 1HD TYR 89 13.300 8.871 -1.234 653 HD2 TYR 89 2HD TYR 89 11.066 5.297 -1.818 654 HE1 TYR 89 1HE TYR 89 15.096 7.580 -0.159 655 HE2 TYR 89 2HE TYR 89 12.856 3.996 -0.744 656 HH TYR 89 HH TYR 89 15.828 5.563 0.409 657 H THR 90 H THR 90 10.991 10.992 -3.448 658 HA THR 90 HA THR 90 13.824 11.647 -3.751 659 HB THR 90 HB THR 90 13.013 14.011 -3.895 660 HG1 THR 90 1HG THR 90 10.734 14.282 -4.155 661 HG21 THR 90 3HG2 THR 90 11.610 13.493 -6.080 662 HG22 THR 90 1HG2 THR 90 12.204 11.860 -5.786 663 HG23 THR 90 2HG2 THR 90 13.344 13.186 -6.006 664 H VAL 91 H VAL 91 15.052 12.552 -2.179 665 HA VAL 91 HA VAL 91 14.008 12.477 0.525 666 HB VAL 91 HB VAL 91 16.779 13.011 -0.546 667 HG11 VAL 91 1HG1 VAL 91 15.985 12.690 2.342 668 HG12 VAL 91 2HG1 VAL 91 17.584 13.071 1.701 669 HG13 VAL 91 3HG1 VAL 91 16.276 14.248 1.571 670 HG21 VAL 91 3HG2 VAL 91 15.316 10.632 0.036 671 HG22 VAL 91 1HG2 VAL 91 16.968 10.799 -0.560 672 HG23 VAL 91 2HG2 VAL 91 16.654 10.773 1.176 673 HA PRO 92 HA PRO 92 13.128 16.806 0.706 674 HB2 PRO 92 1HB PRO 92 12.905 17.010 3.404 675 HB3 PRO 92 2HB PRO 92 11.660 16.270 2.391 676 HG2 PRO 92 1HG PRO 92 13.802 14.960 4.019 677 HG3 PRO 92 2HG PRO 92 12.096 14.511 3.847 678 HD2 PRO 92 1HD PRO 92 14.077 13.246 2.503 679 HD3 PRO 92 2HD PRO 92 12.447 13.452 1.830 680 H GLY 93 H GLY 93 14.920 17.952 0.109 681 HA2 GLY 93 1HA GLY 93 16.448 19.629 0.924 682 HA3 GLY 93 2HA GLY 93 16.831 18.563 2.267 683 H THR 94 H THR 94 16.577 17.157 -0.865 684 HA THR 94 HA THR 94 19.463 17.316 -1.309 685 HB THR 94 HB THR 94 17.930 14.764 -0.872 686 HG1 THR 94 1HG THR 94 19.355 16.016 0.735 687 HG21 THR 94 3HG2 THR 94 20.509 15.138 -2.391 688 HG22 THR 94 1HG2 THR 94 19.014 14.411 -2.978 689 HG23 THR 94 2HG2 THR 94 19.968 13.590 -1.743 690 H GLU 95 H GLU 95 20.096 17.041 -3.444 691 HA GLU 95 HA GLU 95 17.950 17.336 -5.389 692 HB2 GLU 95 1HB GLU 95 20.023 17.663 -6.942 693 HB3 GLU 95 2HB GLU 95 19.569 18.932 -5.813 694 HG2 GLU 95 1HG GLU 95 21.327 18.437 -4.362 695 HG3 GLU 95 2HG GLU 95 21.596 16.853 -5.087 696 H GLY 96 H GLY 96 17.231 15.717 -6.601 697 HA2 GLY 96 1HA GLY 96 17.777 13.937 -8.183 698 HA3 GLY 96 2HA GLY 96 19.023 13.415 -7.060 699 H VAL 97 H VAL 97 17.083 11.690 -8.099 700 HA VAL 97 HA VAL 97 15.258 11.246 -5.838 701 HB VAL 97 HB VAL 97 15.204 10.071 -8.621 702 HG11 VAL 97 1HG1 VAL 97 14.356 8.606 -6.728 703 HG12 VAL 97 2HG1 VAL 97 13.077 9.803 -6.514 704 HG13 VAL 97 3HG1 VAL 97 13.226 8.932 -8.041 705 HG21 VAL 97 3HG2 VAL 97 13.789 11.701 -9.229 706 HG22 VAL 97 1HG2 VAL 97 12.939 11.668 -7.685 707 HG23 VAL 97 2HG2 VAL 97 14.441 12.577 -7.845 708 H THR 98 H THR 98 15.284 9.373 -4.672 709 HA THR 98 HA THR 98 17.592 7.609 -5.128 710 HB THR 98 HB THR 98 15.971 8.015 -2.607 711 HG1 THR 98 1HG THR 98 18.199 8.859 -1.997 712 HG21 THR 98 3HG2 THR 98 17.748 6.699 -1.526 713 HG22 THR 98 1HG2 THR 98 18.480 6.407 -3.103 714 HG23 THR 98 2HG2 THR 98 16.881 5.758 -2.739 715 H GLN 99 H GLN 99 17.349 5.331 -4.864 716 HA GLN 99 HA GLN 99 14.593 4.380 -5.286 717 HB2 GLN 99 1HB GLN 99 17.057 3.039 -6.385 718 HB3 GLN 99 2HB GLN 99 15.378 2.740 -6.816 719 HG2 GLN 99 1HG GLN 99 16.289 3.946 -8.605 720 HG3 GLN 99 2HG GLN 99 15.318 5.104 -7.698 721 HE21 GLN 99 1HE2 GLN 99 16.236 6.962 -7.199 722 HE22 GLN 99 2HE2 GLN 99 17.932 7.287 -7.195 723 H LEU 100 H LEU 100 14.274 2.065 -4.693 724 HA LEU 100 HA LEU 100 16.037 1.177 -2.524 725 HB2 LEU 100 1HB LEU 100 13.832 2.456 -1.856 726 HB3 LEU 100 2HB LEU 100 13.092 0.890 -2.184 727 HG LEU 100 HG LEU 100 15.023 0.078 -0.538 728 HD11 LEU 100 1HD1 LEU 100 15.549 1.619 1.160 729 HD12 LEU 100 2HD1 LEU 100 14.369 2.791 0.576 730 HD13 LEU 100 3HD1 LEU 100 15.832 2.474 -0.356 731 HD21 LEU 100 3HD2 LEU 100 13.360 0.270 1.298 732 HD22 LEU 100 1HD2 LEU 100 12.692 -0.384 -0.198 733 HD23 LEU 100 2HD2 LEU 100 12.378 1.294 0.248 734 H LYS 101 H LYS 101 16.366 -0.980 -2.441 735 HA LYS 101 HA LYS 101 14.740 -2.672 -4.224 736 HB2 LYS 101 1HB LYS 101 17.243 -2.076 -4.837 737 HB3 LYS 101 2HB LYS 101 17.598 -3.347 -3.674 738 HG2 LYS 101 1HG LYS 101 15.646 -3.848 -5.877 739 HG3 LYS 101 2HG LYS 101 17.382 -3.922 -6.192 740 HD2 LYS 101 1HD LYS 101 17.448 -5.475 -4.123 741 HD3 LYS 101 2HD LYS 101 15.710 -5.635 -4.387 742 HE2 LYS 101 1HE LYS 101 16.235 -6.290 -6.754 743 HE3 LYS 101 2HE LYS 101 17.935 -6.340 -6.293 744 HZ1 LYS 101 3HZ LYS 101 17.006 -7.895 -4.426 745 HZ2 LYS 101 1HZ LYS 101 17.343 -8.503 -5.968 746 HZ3 LYS 101 2HZ LYS 101 15.750 -8.138 -5.532 747 H LEU 102 H LEU 102 13.960 -4.519 -3.383 748 HA LEU 102 HA LEU 102 14.924 -5.323 -0.717 749 HB2 LEU 102 1HB LEU 102 12.098 -5.430 -1.760 750 HB3 LEU 102 2HB LEU 102 12.636 -6.028 -0.192 751 HG LEU 102 HG LEU 102 12.772 -3.137 -1.040 752 HD11 LEU 102 1HD1 LEU 102 10.598 -2.993 -0.640 753 HD12 LEU 102 2HD1 LEU 102 10.896 -3.512 1.018 754 HD13 LEU 102 3HD1 LEU 102 10.523 -4.706 -0.225 755 HD21 LEU 102 3HD2 LEU 102 14.381 -3.632 0.658 756 HD22 LEU 102 1HD2 LEU 102 13.193 -4.545 1.590 757 HD23 LEU 102 2HD2 LEU 102 13.026 -2.797 1.419 758 H THR 103 H THR 103 14.852 -7.560 -0.228 759 HA THR 103 HA THR 103 14.333 -9.385 -2.457 760 HB THR 103 HB THR 103 16.912 -9.479 -0.882 761 HG1 THR 103 1HG THR 103 17.820 -8.843 -2.957 762 HG21 THR 103 3HG2 THR 103 17.572 -11.170 -2.501 763 HG22 THR 103 1HG2 THR 103 16.025 -11.009 -3.331 764 HG23 THR 103 2HG2 THR 103 16.083 -11.656 -1.691 765 H VAL 104 H VAL 104 13.829 -11.497 -1.849 766 HA VAL 104 HA VAL 104 12.680 -11.775 0.749 767 HB VAL 104 HB VAL 104 13.105 -13.888 -1.369 768 HG11 VAL 104 1HG1 VAL 104 11.049 -14.859 -0.144 769 HG12 VAL 104 2HG1 VAL 104 12.645 -15.064 0.582 770 HG13 VAL 104 3HG1 VAL 104 11.551 -13.821 1.190 771 HG21 VAL 104 3HG2 VAL 104 11.545 -11.621 -1.546 772 HG22 VAL 104 1HG2 VAL 104 11.340 -13.099 -2.487 773 HG23 VAL 104 2HG2 VAL 104 10.408 -12.857 -1.009 774 H VAL 105 H VAL 105 13.616 -12.462 2.552 775 HA VAL 105 HA VAL 105 16.126 -13.995 2.334 776 HB VAL 105 HB VAL 105 15.511 -12.519 4.840 777 HG11 VAL 105 1HG1 VAL 105 17.635 -13.974 3.897 778 HG12 VAL 105 2HG1 VAL 105 18.158 -12.311 3.628 779 HG13 VAL 105 3HG1 VAL 105 17.688 -12.838 5.244 780 HG21 VAL 105 3HG2 VAL 105 16.566 -11.133 2.376 781 HG22 VAL 105 1HG2 VAL 105 14.963 -10.896 3.071 782 HG23 VAL 105 2HG2 VAL 105 16.398 -10.430 3.985 783 H GLU 106 H GLU 106 13.042 -14.550 2.809 784 HA GLU 106 HA GLU 106 13.487 -16.450 5.018 785 HB2 GLU 106 1HB GLU 106 10.993 -14.927 4.262 786 HB3 GLU 106 2HB GLU 106 10.984 -16.296 5.365 787 HG2 GLU 106 1HG GLU 106 12.829 -14.901 6.603 788 HG3 GLU 106 2HG GLU 106 12.074 -13.558 5.747 789 H ASP 107 H ASP 107 14.124 -18.132 3.662 790 HA ASP 107 HA ASP 107 12.060 -19.129 1.811 791 HB2 ASP 107 1HB ASP 107 14.020 -20.472 0.844 792 HB3 ASP 107 2HB ASP 107 13.999 -18.738 0.531 793 H VAL 108 H VAL 108 11.089 -19.956 3.878 794 HA VAL 108 HA VAL 108 12.238 -22.594 4.517 795 HB VAL 108 HB VAL 108 11.459 -22.420 6.791 796 HG11 VAL 108 1HG1 VAL 108 12.968 -20.771 7.634 797 HG12 VAL 108 2HG1 VAL 108 13.677 -21.448 6.166 798 HG13 VAL 108 3HG1 VAL 108 12.905 -19.862 6.124 799 HG21 VAL 108 3HG2 VAL 108 10.310 -19.782 5.905 800 HG22 VAL 108 1HG2 VAL 108 9.458 -21.169 6.586 801 HG23 VAL 108 2HG2 VAL 108 10.537 -20.211 7.601 802 H THR 109 H THR 109 10.323 -23.786 5.891 803 HA THR 109 HA THR 109 8.555 -24.849 4.178 804 HB THR 109 HB THR 109 6.968 -25.175 6.146 805 HG1 THR 109 1HG THR 109 9.098 -23.955 7.592 806 HG21 THR 109 3HG2 THR 109 9.859 -25.973 6.169 807 HG22 THR 109 1HG2 THR 109 8.441 -26.942 5.768 808 HG23 THR 109 2HG2 THR 109 8.766 -26.505 7.446 809 H VAL 110 H VAL 110 7.725 -22.076 6.267 810 HA VAL 110 HA VAL 110 5.756 -21.260 4.233 811 HB VAL 110 HB VAL 110 5.425 -21.040 7.228 812 HG11 VAL 110 1HG1 VAL 110 3.001 -20.475 6.230 813 HG12 VAL 110 2HG1 VAL 110 4.210 -19.241 6.589 814 HG13 VAL 110 3HG1 VAL 110 4.009 -19.828 4.937 815 HG21 VAL 110 3HG2 VAL 110 3.931 -22.731 5.225 816 HG22 VAL 110 1HG2 VAL 110 5.124 -23.323 6.381 817 HG23 VAL 110 2HG2 VAL 110 3.606 -22.634 6.956 818 H GLY 111 H GLY 111 7.852 -20.069 3.632 819 HA2 GLY 111 1HA GLY 111 7.915 -17.506 5.106 820 HA3 GLY 111 2HA GLY 111 9.353 -18.236 4.408 821 H ARG 112 H ARG 112 8.918 -18.825 1.944 822 HA ARG 112 HA ARG 112 9.007 -16.554 0.465 823 HB2 ARG 112 1HB ARG 112 9.326 -19.036 -0.234 824 HB3 ARG 112 2HB ARG 112 7.623 -18.966 -0.666 825 HG2 ARG 112 1HG ARG 112 8.752 -18.509 -2.652 826 HG3 ARG 112 2HG ARG 112 8.239 -16.925 -2.066 827 HD2 ARG 112 1HD ARG 112 10.534 -16.837 -2.855 828 HD3 ARG 112 2HD ARG 112 10.470 -16.566 -1.114 829 HE ARG 112 HE ARG 112 10.917 -19.232 -1.328 830 HH11 ARG 112 1HH1 ARG 112 12.483 -16.409 -2.631 831 HH12 ARG 112 2HH1 ARG 112 14.052 -17.141 -2.678 832 HH21 ARG 112 1HH2 ARG 112 12.978 -20.207 -1.385 833 HH22 ARG 112 2HH2 ARG 112 14.333 -19.302 -1.970 834 H ARG 113 H ARG 113 6.068 -18.459 1.096 835 HA ARG 113 HA ARG 113 4.232 -17.022 -0.353 836 HB2 ARG 113 1HB ARG 113 3.851 -18.254 2.382 837 HB3 ARG 113 2HB ARG 113 2.549 -17.765 1.306 838 HG2 ARG 113 1HG ARG 113 4.624 -19.833 0.619 839 HG3 ARG 113 2HG ARG 113 3.030 -20.197 1.283 840 HD2 ARG 113 1HD ARG 113 1.953 -19.236 -0.641 841 HD3 ARG 113 2HD ARG 113 3.499 -18.673 -1.274 842 HE ARG 113 HE ARG 113 3.542 -21.479 -0.919 843 HH11 ARG 113 1HH1 ARG 113 2.233 -18.999 -2.983 844 HH12 ARG 113 2HH1 ARG 113 2.139 -20.025 -4.375 845 HH21 ARG 113 1HH2 ARG 113 3.424 -22.840 -2.746 846 HH22 ARG 113 2HH2 ARG 113 2.816 -22.210 -4.239 847 H GLN 114 H GLN 114 5.058 -16.456 3.072 848 HA GLN 114 HA GLN 114 3.521 -14.204 3.502 849 HB2 GLN 114 1HB GLN 114 4.591 -15.210 5.365 850 HB3 GLN 114 2HB GLN 114 6.185 -15.025 4.645 851 HG2 GLN 114 1HG GLN 114 5.774 -13.450 6.483 852 HG3 GLN 114 2HG GLN 114 6.105 -12.644 4.951 853 HE21 GLN 114 1HE2 GLN 114 5.107 -10.774 5.847 854 HE22 GLN 114 2HE2 GLN 114 3.386 -10.636 5.894 855 H ALA 115 H ALA 115 7.018 -14.129 2.790 856 HA ALA 115 HA ALA 115 7.375 -11.462 2.395 857 HB1 ALA 115 1HB ALA 115 9.087 -12.196 0.600 858 HB2 ALA 115 2HB ALA 115 9.308 -12.734 2.265 859 HB3 ALA 115 3HB ALA 115 8.626 -13.833 1.067 860 H VAL 116 H VAL 116 6.892 -13.651 -0.380 861 HA VAL 116 HA VAL 116 6.450 -11.843 -2.352 862 HB VAL 116 HB VAL 116 4.926 -14.423 -1.968 863 HG11 VAL 116 1HG1 VAL 116 5.452 -13.053 -4.586 864 HG12 VAL 116 2HG1 VAL 116 4.309 -14.348 -4.225 865 HG13 VAL 116 3HG1 VAL 116 4.007 -12.713 -3.635 866 HG21 VAL 116 3HG2 VAL 116 7.411 -14.606 -1.978 867 HG22 VAL 116 1HG2 VAL 116 6.627 -15.446 -3.316 868 HG23 VAL 116 2HG2 VAL 116 7.412 -13.891 -3.590 869 H ALA 117 H ALA 117 3.930 -13.145 -0.198 870 HA ALA 117 HA ALA 117 1.705 -11.894 -1.161 871 HB1 ALA 117 1HB ALA 117 0.695 -12.262 0.896 872 HB2 ALA 117 2HB ALA 117 1.994 -13.455 0.875 873 HB3 ALA 117 3HB ALA 117 2.183 -11.962 1.794 874 H TRP 118 H TRP 118 4.038 -10.512 1.144 875 HA TRP 118 HA TRP 118 2.748 -8.006 1.369 876 HB2 TRP 118 1HB TRP 118 4.455 -8.951 2.967 877 HB3 TRP 118 2HB TRP 118 5.692 -8.556 1.777 878 HD1 TRP 118 HD TRP 118 3.697 -7.056 4.565 879 HE1 TRP 118 1HE TRP 118 4.282 -4.562 4.815 880 HE3 TRP 118 3HE TRP 118 6.359 -6.411 0.249 881 HZ2 TRP 118 2HZ TRP 118 5.686 -2.583 3.372 882 HZ3 TRP 118 3HZ TRP 118 7.289 -4.187 -0.242 883 HH2 TRP 118 HH TRP 118 6.958 -2.314 1.288 884 H LEU 119 H LEU 119 5.473 -9.112 -0.624 885 HA LEU 119 HA LEU 119 6.162 -6.721 -1.827 886 HB2 LEU 119 1HB LEU 119 6.169 -9.522 -2.927 887 HB3 LEU 119 2HB LEU 119 6.883 -8.150 -3.771 888 HG LEU 119 HG LEU 119 7.795 -9.483 -1.241 889 HD11 LEU 119 1HD1 LEU 119 9.962 -8.967 -2.805 890 HD12 LEU 119 2HD1 LEU 119 8.708 -9.251 -4.012 891 HD13 LEU 119 3HD1 LEU 119 9.057 -10.480 -2.797 892 HD21 LEU 119 3HD2 LEU 119 8.086 -7.353 -0.484 893 HD22 LEU 119 1HD2 LEU 119 8.179 -6.668 -2.106 894 HD23 LEU 119 2HD2 LEU 119 9.566 -7.522 -1.429 895 H VAL 120 H VAL 120 3.876 -9.155 -3.083 896 HA VAL 120 HA VAL 120 2.995 -7.555 -5.248 897 HB VAL 120 HB VAL 120 2.768 -10.081 -5.014 898 HG11 VAL 120 1HG1 VAL 120 0.282 -9.311 -3.490 899 HG12 VAL 120 2HG1 VAL 120 0.780 -10.941 -3.948 900 HG13 VAL 120 3HG1 VAL 120 1.724 -10.026 -2.772 901 HG21 VAL 120 3HG2 VAL 120 0.557 -10.084 -6.237 902 HG22 VAL 120 1HG2 VAL 120 0.484 -8.348 -5.929 903 HG23 VAL 120 2HG2 VAL 120 1.798 -9.018 -6.897 904 H ALA 121 H ALA 121 1.673 -8.175 -2.018 905 HA ALA 121 HA ALA 121 -0.733 -6.795 -2.271 906 HB1 ALA 121 1HB ALA 121 -0.397 -8.176 -0.370 907 HB2 ALA 121 2HB ALA 121 1.025 -7.258 0.128 908 HB3 ALA 121 3HB ALA 121 -0.577 -6.525 0.224 909 H MET 122 H MET 122 2.514 -5.616 -1.866 910 HA MET 122 HA MET 122 1.861 -3.006 -0.963 911 HB2 MET 122 1HB MET 122 4.104 -3.993 -0.707 912 HB3 MET 122 2HB MET 122 4.313 -3.960 -2.453 913 HG2 MET 122 1HG MET 122 5.479 -2.099 -1.652 914 HG3 MET 122 2HG MET 122 3.975 -1.458 -2.308 915 HE1 MET 122 3HE MET 122 2.741 0.712 -0.014 916 HE2 MET 122 1HE MET 122 4.464 1.063 -0.154 917 HE3 MET 122 2HE MET 122 3.580 0.423 -1.539 918 H HIS 123 H HIS 123 3.028 -4.075 -4.164 919 HA HIS 123 HA HIS 123 2.514 -1.681 -5.501 920 HB2 HIS 123 1HB HIS 123 3.898 -3.581 -6.367 921 HB3 HIS 123 2HB HIS 123 2.406 -4.452 -6.708 922 HD2 HIS 123 2HD HIS 123 3.036 -0.670 -7.637 923 HE1 HIS 123 1HE HIS 123 2.397 -2.909 -11.184 924 HE2 HIS 123 2HE HIS 123 2.836 -0.626 -10.216 925 H LYS 124 H LYS 124 0.487 -4.584 -5.199 926 HA LYS 124 HA LYS 124 -1.648 -3.778 -6.780 927 HB2 LYS 124 1HB LYS 124 -1.367 -5.628 -4.450 928 HB3 LYS 124 2HB LYS 124 -2.982 -5.231 -5.022 929 HG2 LYS 124 1HG LYS 124 -0.886 -6.194 -6.926 930 HG3 LYS 124 2HG LYS 124 -1.808 -7.331 -5.940 931 HD2 LYS 124 1HD LYS 124 -3.864 -5.993 -6.854 932 HD3 LYS 124 2HD LYS 124 -2.737 -5.522 -8.128 933 HE2 LYS 124 1HE LYS 124 -3.099 -8.396 -7.350 934 HE3 LYS 124 2HE LYS 124 -4.197 -7.613 -8.486 935 HZ1 LYS 124 3HZ LYS 124 -2.054 -6.949 -9.698 936 HZ2 LYS 124 1HZ LYS 124 -2.589 -8.548 -9.839 937 HZ3 LYS 124 2HZ LYS 124 -1.317 -8.171 -8.790 938 H ALA 125 H ALA 125 -1.222 -3.341 -3.271 939 HA ALA 125 HA ALA 125 -3.594 -1.775 -2.987 940 HB1 ALA 125 1HB ALA 125 -1.251 -2.254 -1.158 941 HB2 ALA 125 2HB ALA 125 -2.654 -1.283 -0.711 942 HB3 ALA 125 3HB ALA 125 -2.850 -2.994 -1.087 943 H ALA 126 H ALA 126 -0.348 -1.100 -3.907 944 HA ALA 126 HA ALA 126 -0.295 1.654 -3.167 945 HB1 ALA 126 1HB ALA 126 1.387 -0.081 -4.930 946 HB2 ALA 126 2HB ALA 126 1.606 1.669 -4.929 947 HB3 ALA 126 3HB ALA 126 1.820 0.752 -3.437 948 H LYS 127 H LYS 127 -1.649 -0.109 -5.797 949 HA LYS 127 HA LYS 127 -1.714 2.003 -7.704 950 HB2 LYS 127 1HB LYS 127 -3.294 -0.555 -7.442 951 HB3 LYS 127 2HB LYS 127 -3.496 0.561 -8.787 952 HG2 LYS 127 1HG LYS 127 -1.068 0.281 -9.286 953 HG3 LYS 127 2HG LYS 127 -1.018 -0.978 -8.051 954 HD2 LYS 127 1HD LYS 127 -3.099 -1.177 -10.165 955 HD3 LYS 127 2HD LYS 127 -1.430 -1.539 -10.609 956 HE2 LYS 127 1HE LYS 127 -1.320 -3.171 -8.769 957 HE3 LYS 127 2HE LYS 127 -3.006 -2.829 -8.383 958 HZ1 LYS 127 3HZ LYS 127 -2.688 -3.476 -11.134 959 HZ2 LYS 127 1HZ LYS 127 -3.678 -4.203 -9.970 960 HZ3 LYS 127 2HZ LYS 127 -2.075 -4.710 -10.153 961 H LEU 128 H LEU 128 -4.295 0.572 -5.696 962 HA LEU 128 HA LEU 128 -6.415 2.122 -6.243 963 HB2 LEU 128 1HB LEU 128 -5.387 1.004 -3.688 964 HB3 LEU 128 2HB LEU 128 -6.749 2.120 -3.615 965 HG LEU 128 HG LEU 128 -6.742 -0.396 -5.274 966 HD11 LEU 128 1HD1 LEU 128 -6.835 -1.473 -3.315 967 HD12 LEU 128 2HD1 LEU 128 -8.477 -0.838 -3.218 968 HD13 LEU 128 3HD1 LEU 128 -7.157 0.004 -2.406 969 HD21 LEU 128 3HD2 LEU 128 -8.420 1.844 -5.249 970 HD22 LEU 128 1HD2 LEU 128 -9.295 0.579 -4.386 971 HD23 LEU 128 2HD2 LEU 128 -8.715 0.288 -6.026 972 H LEU 129 H LEU 129 -3.556 3.151 -4.500 973 HA LEU 129 HA LEU 129 -4.471 5.550 -3.422 974 HB2 LEU 129 1HB LEU 129 -1.833 4.469 -4.234 975 HB3 LEU 129 2HB LEU 129 -1.946 6.208 -3.969 976 HG LEU 129 HG LEU 129 -2.887 4.284 -1.874 977 HD11 LEU 129 1HD1 LEU 129 -0.505 4.784 -0.913 978 HD12 LEU 129 2HD1 LEU 129 -0.083 4.967 -2.615 979 HD13 LEU 129 3HD1 LEU 129 -0.759 3.445 -2.033 980 HD21 LEU 129 3HD2 LEU 129 -1.880 6.322 -0.536 981 HD22 LEU 129 1HD2 LEU 129 -3.506 6.383 -1.217 982 HD23 LEU 129 2HD2 LEU 129 -2.167 7.164 -2.059 983 H TYR 130 H TYR 130 -2.620 5.167 -6.451 984 HA TYR 130 HA TYR 130 -3.660 7.748 -7.354 985 HB2 TYR 130 1HB TYR 130 -1.951 7.378 -9.225 986 HB3 TYR 130 2HB TYR 130 -1.318 7.658 -7.607 987 HD1 TYR 130 2HD TYR 130 -0.406 5.755 -6.294 988 HD2 TYR 130 1HD TYR 130 -1.567 5.320 -10.364 989 HE1 TYR 130 2HE TYR 130 0.887 3.667 -6.434 990 HE2 TYR 130 1HE TYR 130 -0.279 3.230 -10.515 991 HH TYR 130 HH TYR 130 0.507 1.404 -8.492 992 H GLU 131 H GLU 131 -3.190 4.457 -8.645 993 HA GLU 131 HA GLU 131 -4.457 4.606 -11.033 994 HB2 GLU 131 1HB GLU 131 -4.388 2.438 -8.967 995 HB3 GLU 131 2HB GLU 131 -5.347 2.220 -10.424 996 HG2 GLU 131 1HG GLU 131 -3.081 2.978 -11.572 997 HG3 GLU 131 2HG GLU 131 -2.409 2.322 -10.081 998 H SER 132 H SER 132 -5.909 4.949 -7.924 999 HA SER 132 HA SER 132 -8.532 4.254 -8.306 1000 HB2 SER 132 1HB SER 132 -8.198 5.004 -6.164 1001 HB3 SER 132 2HB SER 132 -7.163 6.336 -6.677 1002 HG SER 132 HG SER 132 -9.978 6.222 -7.033 1003 H ARG 133 H ARG 133 -10.435 5.564 -8.784 1004 HA ARG 133 HA ARG 133 -9.917 7.372 -11.041 1005 HB2 ARG 133 1HB ARG 133 -12.439 6.925 -11.451 1006 HB3 ARG 133 2HB ARG 133 -11.277 5.664 -11.840 1007 HG2 ARG 133 1HG ARG 133 -12.538 5.680 -9.143 1008 HG3 ARG 133 2HG ARG 133 -13.470 5.113 -10.530 1009 HD2 ARG 133 1HD ARG 133 -10.706 4.076 -10.113 1010 HD3 ARG 133 2HD ARG 133 -12.015 3.451 -9.112 1011 HE ARG 133 HE ARG 133 -11.508 2.813 -11.827 1012 HH11 ARG 133 1HH1 ARG 133 -14.091 3.352 -9.557 1013 HH12 ARG 133 2HH1 ARG 133 -15.218 2.341 -10.400 1014 HH21 ARG 133 1HH2 ARG 133 -12.982 1.479 -12.946 1015 HH22 ARG 133 2HH2 ARG 133 -14.585 1.275 -12.326 1016 H ASP 134 H ASP 134 -10.907 9.377 -11.181 1017 HA ASP 134 HA ASP 134 -11.351 10.733 -8.738 1018 HB2 ASP 134 1HB ASP 134 -10.570 11.636 -11.065 1019 HB3 ASP 134 2HB ASP 134 -12.295 11.821 -11.369 1020 H GLN 135 H GLN 135 -13.194 11.365 -7.716 1021 HA GLN 135 HA GLN 135 -15.579 9.878 -8.276 1022 HB2 GLN 135 1HB GLN 135 -14.992 10.278 -5.977 1023 HB3 GLN 135 2HB GLN 135 -14.954 12.017 -6.239 1024 HG2 GLN 135 1HG GLN 135 -16.971 11.666 -5.156 1025 HG3 GLN 135 2HG GLN 135 -17.427 11.785 -6.855 1026 HE21 GLN 135 1HE2 GLN 135 -19.179 10.534 -6.974 1027 HE22 GLN 135 2HE2 GLN 135 -19.243 8.868 -6.522 1028 H SER 136 H SER 136 -14.755 13.340 -8.280 1029 HA SER 136 HA SER 136 -17.217 14.338 -9.090 1030 HB2 SER 136 1HB SER 136 -15.390 15.778 -8.317 1031 HB3 SER 136 2HB SER 136 -14.461 15.396 -9.767 1032 HG SER 136 HG SER 136 -15.911 17.412 -9.609 1033 H GLY 137 H GLY 137 -14.580 12.991 -11.002 1034 HA2 GLY 137 1HA GLY 137 -16.194 13.376 -13.438 1035 HA3 GLY 137 2HA GLY 137 -14.457 13.113 -13.409 1036 HA PRO 138 HA PRO 138 -16.734 8.885 -12.597 1037 HB2 PRO 138 1HB PRO 138 -19.256 8.782 -13.597 1038 HB3 PRO 138 2HB PRO 138 -18.901 9.253 -11.931 1039 HG2 PRO 138 1HG PRO 138 -19.477 10.981 -14.307 1040 HG3 PRO 138 2HG PRO 138 -20.073 11.132 -12.644 1041 HD2 PRO 138 1HD PRO 138 -18.037 12.638 -13.604 1042 HD3 PRO 138 2HD PRO 138 -18.131 12.131 -11.905 1043 H SER 139 H SER 139 -16.282 10.810 -15.242 1044 HA SER 139 HA SER 139 -17.004 8.914 -17.295 1045 HB2 SER 139 1HB SER 139 -17.191 11.160 -17.986 1046 HB3 SER 139 2HB SER 139 -15.622 11.591 -17.306 1047 HG SER 139 HG SER 139 -15.762 11.285 -19.672 1048 H SER 140 H SER 140 -15.826 7.185 -17.740 1049 HA SER 140 HA SER 140 -12.968 7.190 -17.082 1050 HB2 SER 140 1HB SER 140 -14.745 4.845 -17.796 1051 HB3 SER 140 2HB SER 140 -13.094 4.763 -17.181 1052 HG SER 140 HG SER 140 -13.828 5.039 -15.232 1053 H GLY 141 H GLY 141 -11.562 7.541 -18.659 1054 HA2 GLY 141 1HA GLY 141 -12.413 7.123 -21.438 1055 HA3 GLY 141 2HA GLY 141 -11.064 8.121 -20.916 Start of MODEL 17 1 H1 GLY 1 H GLY 1 -25.749 -22.797 5.581 2 HA2 GLY 1 1HA GLY 1 -26.199 -20.554 3.751 3 HA3 GLY 1 2HA GLY 1 -27.412 -21.323 4.763 4 H SER 2 H SER 2 -24.807 -18.998 4.659 5 HA SER 2 HA SER 2 -25.704 -17.961 7.268 6 HB2 SER 2 1HB SER 2 -22.937 -17.931 6.048 7 HB3 SER 2 2HB SER 2 -23.384 -17.010 7.484 8 HG SER 2 HG SER 2 -22.651 -19.557 7.327 9 H SER 3 H SER 3 -27.136 -16.428 6.612 10 HA SER 3 HA SER 3 -26.553 -14.643 4.427 11 HB2 SER 3 1HB SER 3 -28.864 -15.363 4.896 12 HB3 SER 3 2HB SER 3 -28.793 -14.561 6.465 13 HG SER 3 HG SER 3 -28.131 -12.679 4.916 14 H GLY 4 H GLY 4 -25.608 -12.704 4.521 15 HA2 GLY 4 1HA GLY 4 -25.364 -10.557 5.646 16 HA3 GLY 4 2HA GLY 4 -25.311 -11.433 7.169 17 H SER 5 H SER 5 -23.504 -13.417 6.655 18 HA SER 5 HA SER 5 -21.088 -12.456 7.272 19 HB2 SER 5 1HB SER 5 -21.789 -14.899 6.874 20 HB3 SER 5 2HB SER 5 -21.269 -14.646 5.208 21 HG SER 5 HG SER 5 -19.203 -14.147 5.984 22 H SER 6 H SER 6 -19.933 -10.849 6.457 23 HA SER 6 HA SER 6 -20.150 -10.060 3.702 24 HB2 SER 6 1HB SER 6 -18.305 -9.049 5.880 25 HB3 SER 6 2HB SER 6 -18.564 -8.280 4.314 26 HG SER 6 HG SER 6 -20.928 -8.716 5.487 27 H GLY 7 H GLY 7 -18.837 -10.549 2.050 28 HA2 GLY 7 1HA GLY 7 -16.617 -12.382 2.587 29 HA3 GLY 7 2HA GLY 7 -17.375 -12.103 1.026 30 H ALA 8 H ALA 8 -15.470 -10.378 3.493 31 HA ALA 8 HA ALA 8 -14.121 -8.941 1.302 32 HB1 ALA 8 1HB ALA 8 -14.170 -7.046 2.496 33 HB2 ALA 8 2HB ALA 8 -15.444 -7.848 3.416 34 HB3 ALA 8 3HB ALA 8 -13.782 -7.870 4.006 35 H GLU 9 H GLU 9 -12.502 -10.436 0.895 36 HA GLU 9 HA GLU 9 -10.485 -10.672 3.021 37 HB2 GLU 9 1HB GLU 9 -11.468 -12.861 1.189 38 HB3 GLU 9 2HB GLU 9 -9.974 -12.972 2.108 39 HG2 GLU 9 1HG GLU 9 -11.485 -14.095 3.440 40 HG3 GLU 9 2HG GLU 9 -11.452 -12.485 4.158 41 H PHE 10 H PHE 10 -11.187 -10.787 -0.440 42 HA PHE 10 HA PHE 10 -8.809 -11.055 -1.644 43 HB2 PHE 10 1HB PHE 10 -11.028 -10.406 -2.708 44 HB3 PHE 10 2HB PHE 10 -10.603 -8.735 -2.355 45 HD1 PHE 10 1HD PHE 10 -8.824 -7.622 -3.556 46 HD2 PHE 10 2HD PHE 10 -9.858 -11.662 -4.407 47 HE1 PHE 10 1HE PHE 10 -7.543 -7.505 -5.653 48 HE2 PHE 10 2HE PHE 10 -8.578 -11.552 -6.505 49 HZ PHE 10 HZ PHE 10 -7.418 -9.472 -7.130 50 H TYR 11 H TYR 11 -9.910 -8.039 -0.123 51 HA TYR 11 HA TYR 11 -7.247 -6.887 -0.461 52 HB2 TYR 11 1HB TYR 11 -9.244 -5.522 -1.016 53 HB3 TYR 11 2HB TYR 11 -9.759 -5.628 0.664 54 HD1 TYR 11 2HD TYR 11 -7.277 -4.188 -1.634 55 HD2 TYR 11 1HD TYR 11 -8.702 -4.305 2.373 56 HE1 TYR 11 2HE TYR 11 -5.940 -2.192 -1.107 57 HE2 TYR 11 1HE TYR 11 -7.369 -2.309 2.912 58 HH TYR 11 HH TYR 11 -6.048 -0.308 0.618 59 H ASP 12 H ASP 12 -9.612 -7.387 2.158 60 HA ASP 12 HA ASP 12 -8.253 -6.575 4.344 61 HB2 ASP 12 1HB ASP 12 -10.086 -8.889 3.886 62 HB3 ASP 12 2HB ASP 12 -9.275 -8.756 5.444 63 H LYS 13 H LYS 13 -7.867 -9.773 2.830 64 HA LYS 13 HA LYS 13 -5.893 -10.747 4.554 65 HB2 LYS 13 1HB LYS 13 -6.783 -11.396 1.784 66 HB3 LYS 13 2HB LYS 13 -5.250 -12.061 2.331 67 HG2 LYS 13 1HG LYS 13 -7.702 -12.366 4.010 68 HG3 LYS 13 2HG LYS 13 -7.420 -13.434 2.633 69 HD2 LYS 13 1HD LYS 13 -5.355 -12.981 4.773 70 HD3 LYS 13 2HD LYS 13 -6.589 -14.237 4.900 71 HE2 LYS 13 1HE LYS 13 -5.806 -15.147 2.727 72 HE3 LYS 13 2HE LYS 13 -4.508 -13.955 2.735 73 HZ1 LYS 13 3HZ LYS 13 -4.234 -16.399 3.713 74 HZ2 LYS 13 1HZ LYS 13 -4.754 -15.609 5.115 75 HZ3 LYS 13 2HZ LYS 13 -3.369 -15.073 4.307 76 H GLN 14 H GLN 14 -5.686 -8.631 1.775 77 HA GLN 14 HA GLN 14 -2.827 -8.777 1.566 78 HB2 GLN 14 1HB GLN 14 -4.888 -6.936 0.358 79 HB3 GLN 14 2HB GLN 14 -3.164 -6.759 0.058 80 HG2 GLN 14 1HG GLN 14 -3.192 -9.152 -0.750 81 HG3 GLN 14 2HG GLN 14 -4.951 -9.045 -0.706 82 HE21 GLN 14 1HE2 GLN 14 -5.954 -7.374 -2.011 83 HE22 GLN 14 2HE2 GLN 14 -5.203 -6.896 -3.492 84 H LEU 15 H LEU 15 -5.076 -6.200 2.582 85 HA LEU 15 HA LEU 15 -3.185 -4.375 3.468 86 HB2 LEU 15 1HB LEU 15 -4.920 -3.223 4.455 87 HB3 LEU 15 2HB LEU 15 -5.747 -4.170 3.221 88 HG LEU 15 HG LEU 15 -6.267 -5.839 5.071 89 HD11 LEU 15 1HD1 LEU 15 -4.640 -4.035 6.534 90 HD12 LEU 15 2HD1 LEU 15 -5.437 -5.504 7.096 91 HD13 LEU 15 3HD1 LEU 15 -6.275 -3.955 7.191 92 HD21 LEU 15 3HD2 LEU 15 -7.417 -3.074 4.909 93 HD22 LEU 15 1HD2 LEU 15 -8.080 -4.282 6.010 94 HD23 LEU 15 2HD2 LEU 15 -8.065 -4.587 4.273 95 H LYS 16 H LYS 16 -4.745 -7.020 5.234 96 HA LYS 16 HA LYS 16 -3.670 -6.493 7.762 97 HB2 LYS 16 1HB LYS 16 -4.285 -8.727 8.343 98 HB3 LYS 16 2HB LYS 16 -5.505 -8.125 7.229 99 HG2 LYS 16 1HG LYS 16 -4.688 -9.438 5.458 100 HG3 LYS 16 2HG LYS 16 -3.184 -9.792 6.311 101 HD2 LYS 16 1HD LYS 16 -5.785 -10.620 7.520 102 HD3 LYS 16 2HD LYS 16 -5.102 -11.573 6.201 103 HE2 LYS 16 1HE LYS 16 -3.347 -10.822 8.488 104 HE3 LYS 16 2HE LYS 16 -4.533 -12.106 8.719 105 HZ1 LYS 16 3HZ LYS 16 -3.000 -12.343 6.290 106 HZ2 LYS 16 1HZ LYS 16 -3.364 -13.510 7.459 107 HZ3 LYS 16 2HZ LYS 16 -2.067 -12.451 7.696 108 H VAL 17 H VAL 17 -2.356 -8.243 5.005 109 HA VAL 17 HA VAL 17 -0.108 -9.336 6.343 110 HB VAL 17 HB VAL 17 -0.593 -8.765 3.419 111 HG11 VAL 17 1HG1 VAL 17 1.417 -10.739 3.821 112 HG12 VAL 17 2HG1 VAL 17 1.540 -9.192 2.979 113 HG13 VAL 17 3HG1 VAL 17 1.873 -9.285 4.709 114 HG21 VAL 17 3HG2 VAL 17 -0.362 -11.507 4.506 115 HG22 VAL 17 1HG2 VAL 17 -1.811 -10.599 4.937 116 HG23 VAL 17 2HG2 VAL 17 -1.413 -10.873 3.240 117 H LEU 18 H LEU 18 -0.589 -6.379 4.449 118 HA LEU 18 HA LEU 18 2.053 -5.488 4.396 119 HB2 LEU 18 1HB LEU 18 -0.540 -3.961 4.435 120 HB3 LEU 18 2HB LEU 18 1.029 -3.201 4.178 121 HG LEU 18 HG LEU 18 0.004 -5.389 2.389 122 HD11 LEU 18 1HD1 LEU 18 -1.593 -3.999 1.697 123 HD12 LEU 18 2HD1 LEU 18 -0.295 -3.025 1.007 124 HD13 LEU 18 3HD1 LEU 18 -0.925 -2.645 2.609 125 HD21 LEU 18 3HD2 LEU 18 1.704 -3.276 1.316 126 HD22 LEU 18 1HD2 LEU 18 1.849 -5.029 1.182 127 HD23 LEU 18 2HD2 LEU 18 2.467 -4.200 2.611 128 H LEU 19 H LEU 19 -0.474 -5.008 6.825 129 HA LEU 19 HA LEU 19 1.010 -3.251 8.473 130 HB2 LEU 19 1HB LEU 19 -1.262 -5.108 9.162 131 HB3 LEU 19 2HB LEU 19 -0.645 -3.830 10.208 132 HG LEU 19 HG LEU 19 -1.868 -3.337 7.496 133 HD11 LEU 19 1HD1 LEU 19 -3.891 -3.541 8.375 134 HD12 LEU 19 2HD1 LEU 19 -3.476 -2.416 9.667 135 HD13 LEU 19 3HD1 LEU 19 -3.165 -4.140 9.867 136 HD21 LEU 19 3HD2 LEU 19 -0.750 -1.641 9.664 137 HD22 LEU 19 1HD2 LEU 19 -2.166 -1.049 8.793 138 HD23 LEU 19 2HD2 LEU 19 -0.686 -1.433 7.913 139 H SER 20 H SER 20 0.386 -6.749 8.712 140 HA SER 20 HA SER 20 1.651 -7.434 10.993 141 HB2 SER 20 1HB SER 20 0.611 -9.067 9.468 142 HB3 SER 20 2HB SER 20 1.968 -8.890 8.356 143 HG SER 20 HG SER 20 2.772 -10.470 9.492 144 H GLY 21 H GLY 21 3.266 -6.792 7.895 145 HA2 GLY 21 1HA GLY 21 5.373 -5.791 7.640 146 HA3 GLY 21 2HA GLY 21 5.684 -6.063 9.348 147 H ALA 22 H ALA 22 6.829 -6.834 6.463 148 HA ALA 22 HA ALA 22 7.597 -9.559 7.289 149 HB1 ALA 22 1HB ALA 22 8.031 -9.379 4.539 150 HB2 ALA 22 2HB ALA 22 6.754 -10.275 5.362 151 HB3 ALA 22 3HB ALA 22 6.459 -8.626 4.812 152 H THR 23 H THR 23 9.722 -10.260 6.366 153 HA THR 23 HA THR 23 11.654 -8.092 6.700 154 HB THR 23 HB THR 23 12.144 -11.074 6.592 155 HG1 THR 23 1HG THR 23 10.933 -9.851 8.462 156 HG21 THR 23 3HG2 THR 23 14.316 -10.473 7.621 157 HG22 THR 23 1HG2 THR 23 13.919 -8.769 7.402 158 HG23 THR 23 2HG2 THR 23 14.125 -9.815 5.996 159 H PHE 24 H PHE 24 13.296 -7.660 5.223 160 HA PHE 24 HA PHE 24 13.471 -9.115 2.741 161 HB2 PHE 24 1HB PHE 24 12.615 -6.217 2.642 162 HB3 PHE 24 2HB PHE 24 12.866 -7.296 1.273 163 HD1 PHE 24 1HD PHE 24 10.670 -6.500 4.109 164 HD2 PHE 24 2HD PHE 24 11.195 -8.859 0.605 165 HE1 PHE 24 1HE PHE 24 8.299 -7.149 4.195 166 HE2 PHE 24 2HE PHE 24 8.824 -9.511 0.685 167 HZ PHE 24 HZ PHE 24 7.372 -8.655 2.481 168 H LEU 25 H LEU 25 15.319 -8.583 1.521 169 HA LEU 25 HA LEU 25 17.425 -7.370 3.092 170 HB2 LEU 25 1HB LEU 25 17.283 -8.976 0.587 171 HB3 LEU 25 2HB LEU 25 18.721 -8.004 0.892 172 HG LEU 25 HG LEU 25 17.733 -9.960 2.938 173 HD11 LEU 25 1HD1 LEU 25 19.550 -11.466 1.850 174 HD12 LEU 25 2HD1 LEU 25 19.201 -10.527 0.399 175 HD13 LEU 25 3HD1 LEU 25 17.917 -11.447 1.184 176 HD21 LEU 25 3HD2 LEU 25 19.691 -8.096 3.026 177 HD22 LEU 25 1HD2 LEU 25 20.594 -9.493 2.440 178 HD23 LEU 25 2HD2 LEU 25 19.704 -9.593 3.960 179 H VAL 26 H VAL 26 17.410 -5.201 3.101 180 HA VAL 26 HA VAL 26 16.836 -3.730 0.648 181 HB VAL 26 HB VAL 26 17.352 -2.738 3.455 182 HG11 VAL 26 1HG1 VAL 26 16.782 -1.313 0.883 183 HG12 VAL 26 2HG1 VAL 26 16.299 -0.615 2.431 184 HG13 VAL 26 3HG1 VAL 26 17.999 -0.957 2.108 185 HG21 VAL 26 3HG2 VAL 26 14.917 -3.494 1.946 186 HG22 VAL 26 1HG2 VAL 26 15.267 -3.613 3.671 187 HG23 VAL 26 2HG2 VAL 26 14.819 -2.059 2.966 188 H THR 27 H THR 27 18.500 -3.534 -0.708 189 HA THR 27 HA THR 27 21.213 -3.255 0.330 190 HB THR 27 HB THR 27 20.349 -3.425 -2.561 191 HG1 THR 27 1HG THR 27 19.863 -5.418 -2.005 192 HG21 THR 27 3HG2 THR 27 22.717 -2.606 -1.713 193 HG22 THR 27 1HG2 THR 27 22.562 -3.672 -3.108 194 HG23 THR 27 2HG2 THR 27 22.990 -4.339 -1.533 195 H PHE 28 H PHE 28 22.152 -1.343 0.564 196 HA PHE 28 HA PHE 28 20.881 1.025 -0.550 197 HB2 PHE 28 1HB PHE 28 23.022 0.568 1.512 198 HB3 PHE 28 2HB PHE 28 22.751 2.169 0.830 199 HD1 PHE 28 2HD PHE 28 20.021 2.641 0.704 200 HD2 PHE 28 1HD PHE 28 22.107 0.303 3.586 201 HE1 PHE 28 2HE PHE 28 18.207 3.022 2.322 202 HE2 PHE 28 1HE PHE 28 20.295 0.680 5.208 203 HZ PHE 28 HZ PHE 28 18.342 2.042 4.577 204 H GLY 29 H GLY 29 21.824 2.436 -1.988 205 HA2 GLY 29 1HA GLY 29 23.649 1.349 -3.859 206 HA3 GLY 29 2HA GLY 29 23.101 3.018 -3.807 207 H ASN 30 H ASN 30 24.072 3.449 -1.083 208 HA ASN 30 HA ASN 30 26.730 4.251 -1.742 209 HB2 ASN 30 1HB ASN 30 26.759 4.862 0.769 210 HB3 ASN 30 2HB ASN 30 25.629 5.715 -0.279 211 HD21 ASN 30 1HD2 ASN 30 23.498 5.575 0.109 212 HD22 ASN 30 2HD2 ASN 30 22.794 4.639 1.380 213 H SER 31 H SER 31 25.333 1.744 0.326 214 HA SER 31 HA SER 31 27.998 0.745 0.978 215 HB2 SER 31 1HB SER 31 25.268 0.372 2.097 216 HB3 SER 31 2HB SER 31 26.391 -0.978 2.255 217 HG SER 31 HG SER 31 26.859 1.691 3.106 218 H GLU 32 H GLU 32 25.717 0.324 -1.403 219 HA GLU 32 HA GLU 32 25.157 -1.391 -2.834 220 HB2 GLU 32 1HB GLU 32 28.078 -2.073 -2.792 221 HB3 GLU 32 2HB GLU 32 26.973 -2.019 -4.159 222 HG2 GLU 32 1HG GLU 32 26.871 0.472 -3.838 223 HG3 GLU 32 2HG GLU 32 28.192 0.296 -2.685 224 H LYS 33 H LYS 33 25.250 -2.130 0.056 225 HA LYS 33 HA LYS 33 25.533 -5.036 -0.324 226 HB2 LYS 33 1HB LYS 33 27.316 -4.719 1.087 227 HB3 LYS 33 2HB LYS 33 26.611 -3.292 1.835 228 HG2 LYS 33 1HG LYS 33 25.364 -4.523 3.328 229 HG3 LYS 33 2HG LYS 33 25.378 -5.966 2.312 230 HD2 LYS 33 1HD LYS 33 27.898 -4.888 3.535 231 HD3 LYS 33 2HD LYS 33 26.827 -5.963 4.435 232 HE2 LYS 33 1HE LYS 33 27.150 -7.728 2.912 233 HE3 LYS 33 2HE LYS 33 27.852 -6.659 1.698 234 HZ1 LYS 33 3HZ LYS 33 29.299 -6.659 4.177 235 HZ2 LYS 33 1HZ LYS 33 29.865 -6.862 2.596 236 HZ3 LYS 33 2HZ LYS 33 29.247 -8.185 3.450 237 HA PRO 34 HA PRO 34 21.317 -5.142 0.978 238 HB2 PRO 34 1HB PRO 34 21.159 -7.795 1.532 239 HB3 PRO 34 2HB PRO 34 21.197 -7.158 -0.117 240 HG2 PRO 34 1HG PRO 34 23.419 -8.325 1.515 241 HG3 PRO 34 2HG PRO 34 23.026 -8.592 -0.194 242 HD2 PRO 34 1HD PRO 34 24.995 -6.912 0.603 243 HD3 PRO 34 2HD PRO 34 24.033 -6.630 -0.862 244 H GLU 35 H GLU 35 20.019 -5.553 2.852 245 HA GLU 35 HA GLU 35 21.375 -6.294 5.315 246 HB2 GLU 35 1HB GLU 35 21.834 -3.952 5.322 247 HB3 GLU 35 2HB GLU 35 20.191 -3.562 4.833 248 HG2 GLU 35 1HG GLU 35 19.365 -4.380 6.989 249 HG3 GLU 35 2HG GLU 35 21.020 -4.736 7.478 250 H THR 36 H THR 36 20.003 -7.052 6.900 251 HA THR 36 HA THR 36 17.392 -7.859 6.007 252 HB THR 36 HB THR 36 18.603 -8.236 8.750 253 HG1 THR 36 1HG THR 36 18.607 -10.280 6.840 254 HG21 THR 36 3HG2 THR 36 16.070 -8.912 7.607 255 HG22 THR 36 1HG2 THR 36 16.666 -9.220 9.237 256 HG23 THR 36 2HG2 THR 36 16.962 -10.393 7.953 257 H MET 37 H MET 37 15.863 -6.318 5.960 258 HA MET 37 HA MET 37 15.358 -4.846 8.456 259 HB2 MET 37 1HB MET 37 15.105 -3.715 5.663 260 HB3 MET 37 2HB MET 37 14.707 -2.874 7.156 261 HG2 MET 37 1HG MET 37 17.163 -3.318 7.795 262 HG3 MET 37 2HG MET 37 17.389 -3.629 6.076 263 HE1 MET 37 3HE MET 37 15.209 -1.113 8.142 264 HE2 MET 37 1HE MET 37 16.815 -0.925 8.846 265 HE3 MET 37 2HE MET 37 16.099 0.393 7.919 266 H THR 38 H THR 38 13.085 -3.903 8.460 267 HA THR 38 HA THR 38 11.233 -5.867 7.274 268 HB THR 38 HB THR 38 10.833 -4.299 9.828 269 HG1 THR 38 1HG THR 38 11.452 -6.116 10.883 270 HG21 THR 38 3HG2 THR 38 9.252 -6.717 9.312 271 HG22 THR 38 1HG2 THR 38 8.922 -5.381 8.210 272 HG23 THR 38 2HG2 THR 38 8.753 -5.151 9.951 273 H CYS 39 H CYS 39 9.650 -5.138 5.994 274 HA CYS 39 HA CYS 39 9.207 -2.227 5.882 275 HB2 CYS 39 1HB CYS 39 10.231 -3.605 3.865 276 HB3 CYS 39 2HB CYS 39 8.540 -3.988 3.564 277 HG CYS 39 HG CYS 39 8.049 -1.846 2.256 278 H ARG 40 H ARG 40 7.324 -1.677 6.744 279 HA ARG 40 HA ARG 40 4.964 -3.314 6.137 280 HB2 ARG 40 1HB ARG 40 4.161 -3.180 8.398 281 HB3 ARG 40 2HB ARG 40 5.790 -3.841 8.431 282 HG2 ARG 40 1HG ARG 40 6.609 -1.527 8.961 283 HG3 ARG 40 2HG ARG 40 4.920 -1.059 9.162 284 HD2 ARG 40 1HD ARG 40 6.286 -3.277 10.681 285 HD3 ARG 40 2HD ARG 40 6.046 -1.641 11.293 286 HE ARG 40 HE ARG 40 4.024 -3.703 10.971 287 HH11 ARG 40 1HH1 ARG 40 4.753 -0.364 11.630 288 HH12 ARG 40 2HH1 ARG 40 3.228 -0.044 12.386 289 HH21 ARG 40 1HH2 ARG 40 2.012 -3.295 11.964 290 HH22 ARG 40 2HH2 ARG 40 1.669 -1.713 12.576 291 H LEU 41 H LEU 41 2.909 -2.118 6.596 292 HA LEU 41 HA LEU 41 3.236 0.688 5.797 293 HB2 LEU 41 1HB LEU 41 1.197 -1.400 5.293 294 HB3 LEU 41 2HB LEU 41 0.625 0.262 5.428 295 HG LEU 41 HG LEU 41 2.818 -0.519 3.526 296 HD11 LEU 41 1HD1 LEU 41 0.839 -0.359 1.840 297 HD12 LEU 41 2HD1 LEU 41 -0.139 -0.802 3.239 298 HD13 LEU 41 3HD1 LEU 41 1.153 -1.871 2.692 299 HD21 LEU 41 3HD2 LEU 41 2.543 1.863 4.081 300 HD22 LEU 41 1HD2 LEU 41 0.864 1.779 3.548 301 HD23 LEU 41 2HD2 LEU 41 2.170 1.521 2.391 302 H SER 42 H SER 42 2.150 2.346 6.848 303 HA SER 42 HA SER 42 1.877 2.130 9.626 304 HB2 SER 42 1HB SER 42 2.299 4.248 8.326 305 HB3 SER 42 2HB SER 42 0.591 4.245 7.887 306 HG SER 42 HG SER 42 1.647 5.256 10.045 307 H ASN 43 H ASN 43 -0.279 3.049 10.671 308 HA ASN 43 HA ASN 43 -2.144 1.013 10.670 309 HB2 ASN 43 1HB ASN 43 -2.171 3.849 11.604 310 HB3 ASN 43 2HB ASN 43 -3.695 2.966 11.580 311 HD21 ASN 43 1HD2 ASN 43 -4.136 1.601 13.187 312 HD22 ASN 43 2HD2 ASN 43 -3.036 1.160 14.444 313 H ASN 44 H ASN 44 -2.220 4.071 8.879 314 HA ASN 44 HA ASN 44 -4.587 3.122 7.423 315 HB2 ASN 44 1HB ASN 44 -3.493 5.811 8.077 316 HB3 ASN 44 2HB ASN 44 -4.349 5.638 6.547 317 HD21 ASN 44 1HD2 ASN 44 -6.404 4.114 6.949 318 HD22 ASN 44 2HD2 ASN 44 -7.433 4.695 8.210 319 H GLN 45 H GLN 45 -1.705 2.323 7.023 320 HA GLN 45 HA GLN 45 -0.156 2.101 5.343 321 HB2 GLN 45 1HB GLN 45 -2.616 1.944 3.604 322 HB3 GLN 45 2HB GLN 45 -1.071 1.143 3.353 323 HG2 GLN 45 1HG GLN 45 -2.243 -0.603 4.186 324 HG3 GLN 45 2HG GLN 45 -1.658 0.079 5.702 325 HE21 GLN 45 1HE2 GLN 45 -3.551 -1.202 6.464 326 HE22 GLN 45 2HE2 GLN 45 -5.084 -0.409 6.509 327 H ARG 46 H ARG 46 -0.410 4.763 5.916 328 HA ARG 46 HA ARG 46 -0.524 6.080 3.288 329 HB2 ARG 46 1HB ARG 46 -0.920 7.093 6.090 330 HB3 ARG 46 2HB ARG 46 -0.530 8.197 4.777 331 HG2 ARG 46 1HG ARG 46 -2.527 7.571 3.590 332 HG3 ARG 46 2HG ARG 46 -2.892 6.331 4.792 333 HD2 ARG 46 1HD ARG 46 -2.792 8.346 6.459 334 HD3 ARG 46 2HD ARG 46 -3.082 9.302 5.006 335 HE ARG 46 HE ARG 46 -4.924 7.140 5.244 336 HH11 ARG 46 1HH1 ARG 46 -4.212 10.351 6.384 337 HH12 ARG 46 2HH1 ARG 46 -5.862 10.724 6.761 338 HH21 ARG 46 1HH2 ARG 46 -7.099 7.619 5.736 339 HH22 ARG 46 2HH2 ARG 46 -7.503 9.169 6.393 340 H TYR 47 H TYR 47 1.523 5.283 5.964 341 HA TYR 47 HA TYR 47 3.779 6.552 4.568 342 HB2 TYR 47 1HB TYR 47 3.294 6.568 7.554 343 HB3 TYR 47 2HB TYR 47 4.768 7.127 6.769 344 HD1 TYR 47 1HD TYR 47 4.779 9.203 5.475 345 HD2 TYR 47 2HD TYR 47 1.273 7.889 7.497 346 HE1 TYR 47 1HE TYR 47 3.800 11.445 5.223 347 HE2 TYR 47 2HE TYR 47 0.284 10.127 7.249 348 HH TYR 47 HH TYR 47 1.331 12.378 5.149 349 H LEU 48 H LEU 48 5.708 5.433 4.606 350 HA LEU 48 HA LEU 48 5.510 2.653 5.522 351 HB2 LEU 48 1HB LEU 48 7.135 4.023 3.412 352 HB3 LEU 48 2HB LEU 48 7.613 2.446 4.037 353 HG LEU 48 HG LEU 48 4.960 3.034 2.726 354 HD11 LEU 48 1HD1 LEU 48 6.909 1.300 1.379 355 HD12 LEU 48 2HD1 LEU 48 7.341 3.009 1.437 356 HD13 LEU 48 3HD1 LEU 48 5.811 2.511 0.716 357 HD21 LEU 48 3HD2 LEU 48 6.098 0.734 4.135 358 HD22 LEU 48 1HD2 LEU 48 5.425 0.353 2.549 359 HD23 LEU 48 2HD2 LEU 48 4.417 1.129 3.771 360 H PHE 49 H PHE 49 7.388 1.646 6.489 361 HA PHE 49 HA PHE 49 9.399 3.417 7.622 362 HB2 PHE 49 1HB PHE 49 7.449 1.831 9.295 363 HB3 PHE 49 2HB PHE 49 8.976 2.443 9.923 364 HD1 PHE 49 2HD PHE 49 5.629 3.330 8.754 365 HD2 PHE 49 1HD PHE 49 9.306 4.801 10.312 366 HE1 PHE 49 2HE PHE 49 4.552 5.485 9.252 367 HE2 PHE 49 1HE PHE 49 8.235 6.959 10.813 368 HZ PHE 49 HZ PHE 49 5.855 7.303 10.282 369 H LEU 50 H LEU 50 11.201 2.275 8.561 370 HA LEU 50 HA LEU 50 11.349 -0.563 7.801 371 HB2 LEU 50 1HB LEU 50 13.565 1.448 7.457 372 HB3 LEU 50 2HB LEU 50 13.606 -0.255 7.005 373 HG LEU 50 HG LEU 50 11.717 1.724 5.747 374 HD11 LEU 50 1HD1 LEU 50 13.302 2.497 4.390 375 HD12 LEU 50 2HD1 LEU 50 13.961 0.885 4.113 376 HD13 LEU 50 3HD1 LEU 50 14.469 1.815 5.523 377 HD21 LEU 50 3HD2 LEU 50 11.212 0.072 4.235 378 HD22 LEU 50 1HD2 LEU 50 11.464 -0.884 5.696 379 HD23 LEU 50 2HD2 LEU 50 12.740 -0.776 4.483 380 H ASP 51 H ASP 51 13.031 -1.774 8.938 381 HA ASP 51 HA ASP 51 13.869 -0.569 11.480 382 HB2 ASP 51 1HB ASP 51 12.224 -3.042 11.089 383 HB3 ASP 51 2HB ASP 51 13.337 -2.948 12.451 384 H GLY 52 H GLY 52 15.970 -0.849 11.823 385 HA2 GLY 52 1HA GLY 52 17.402 -3.207 11.623 386 HA3 GLY 52 2HA GLY 52 17.570 -2.415 10.063 387 H ASP 53 H ASP 53 19.600 -1.672 10.036 388 HA ASP 53 HA ASP 53 21.310 -1.014 11.996 389 HB2 ASP 53 1HB ASP 53 22.394 0.570 10.468 390 HB3 ASP 53 2HB ASP 53 21.886 -0.885 9.615 391 H SER 54 H SER 54 18.840 1.179 10.697 392 HA SER 54 HA SER 54 18.742 2.578 13.232 393 HB2 SER 54 1HB SER 54 19.522 3.998 10.675 394 HB3 SER 54 2HB SER 54 19.047 4.814 12.165 395 HG SER 54 HG SER 54 20.939 3.011 12.720 396 H HIS 55 H HIS 55 17.105 4.528 12.927 397 HA HIS 55 HA HIS 55 14.663 3.320 12.014 398 HB2 HIS 55 1HB HIS 55 13.704 5.589 12.754 399 HB3 HIS 55 2HB HIS 55 14.421 4.564 13.993 400 HD2 HIS 55 2HD HIS 55 16.870 5.509 15.051 401 HE1 HIS 55 1HE HIS 55 16.573 9.343 13.257 402 HE2 HIS 55 2HE HIS 55 17.844 7.900 14.884 403 H TYR 56 H TYR 56 13.902 3.431 10.017 404 HA TYR 56 HA TYR 56 14.485 5.826 8.411 405 HB2 TYR 56 1HB TYR 56 14.881 2.948 7.707 406 HB3 TYR 56 2HB TYR 56 14.406 4.073 6.439 407 HD1 TYR 56 2HD TYR 56 17.030 3.291 8.918 408 HD2 TYR 56 1HD TYR 56 15.960 5.626 5.526 409 HE1 TYR 56 2HE TYR 56 19.376 3.984 8.662 410 HE2 TYR 56 1HE TYR 56 18.303 6.325 5.260 411 HH TYR 56 HH TYR 56 20.511 5.630 5.865 412 H GLU 57 H GLU 57 12.913 6.363 6.826 413 HA GLU 57 HA GLU 57 10.438 4.873 6.723 414 HB2 GLU 57 1HB GLU 57 9.030 6.741 7.461 415 HB3 GLU 57 2HB GLU 57 10.102 6.197 8.745 416 HG2 GLU 57 1HG GLU 57 11.537 8.073 8.449 417 HG3 GLU 57 2HG GLU 57 10.690 8.558 6.980 418 H ILE 58 H ILE 58 9.492 5.089 4.785 419 HA ILE 58 HA ILE 58 10.485 7.229 3.021 420 HB ILE 58 HB ILE 58 9.416 4.506 2.267 421 HG12 ILE 58 1HG1 ILE 58 12.195 5.527 1.754 422 HG13 ILE 58 2HG1 ILE 58 11.786 4.789 3.299 423 HG21 ILE 58 1HG2 ILE 58 9.127 5.256 0.199 424 HG22 ILE 58 2HG2 ILE 58 9.473 6.886 0.774 425 HG23 ILE 58 3HG2 ILE 58 10.777 5.875 0.154 426 HD11 ILE 58 3HD1 ILE 58 10.807 2.996 1.454 427 HD12 ILE 58 1HD1 ILE 58 12.313 3.560 0.732 428 HD13 ILE 58 2HD1 ILE 58 12.320 2.857 2.350 429 H GLU 59 H GLU 59 8.987 8.814 3.225 430 HA GLU 59 HA GLU 59 6.220 8.415 3.555 431 HB2 GLU 59 1HB GLU 59 7.971 10.722 2.882 432 HB3 GLU 59 2HB GLU 59 6.257 10.881 2.528 433 HG2 GLU 59 1HG GLU 59 5.652 10.852 4.730 434 HG3 GLU 59 2HG GLU 59 7.065 9.920 5.220 435 H ILE 60 H ILE 60 4.912 7.480 2.137 436 HA ILE 60 HA ILE 60 5.385 6.899 -0.497 437 HB ILE 60 HB ILE 60 2.691 7.516 0.720 438 HG12 ILE 60 1HG1 ILE 60 4.090 4.854 0.399 439 HG13 ILE 60 2HG1 ILE 60 4.047 5.773 1.900 440 HG21 ILE 60 1HG2 ILE 60 1.991 7.312 -1.396 441 HG22 ILE 60 2HG2 ILE 60 3.520 6.617 -1.933 442 HG23 ILE 60 3HG2 ILE 60 2.302 5.589 -1.178 443 HD11 ILE 60 3HD1 ILE 60 1.582 5.612 1.872 444 HD12 ILE 60 1HD1 ILE 60 1.700 4.585 0.444 445 HD13 ILE 60 2HD1 ILE 60 2.389 4.048 1.976 446 H VAL 61 H VAL 61 3.928 9.831 0.833 447 HA VAL 61 HA VAL 61 3.022 11.072 -1.446 448 HB VAL 61 HB VAL 61 3.418 13.216 -0.332 449 HG11 VAL 61 1HG1 VAL 61 1.661 12.833 0.981 450 HG12 VAL 61 2HG1 VAL 61 1.839 11.122 0.584 451 HG13 VAL 61 3HG1 VAL 61 2.597 11.775 2.037 452 HG21 VAL 61 3HG2 VAL 61 5.134 13.522 1.045 453 HG22 VAL 61 1HG2 VAL 61 4.473 12.325 2.160 454 HG23 VAL 61 2HG2 VAL 61 5.565 11.821 0.871 455 H HIS 62 H HIS 62 6.312 10.610 -0.385 456 HA HIS 62 HA HIS 62 7.414 12.448 -2.324 457 HB2 HIS 62 1HB HIS 62 8.569 10.585 -0.276 458 HB3 HIS 62 2HB HIS 62 9.602 11.261 -1.533 459 HD2 HIS 62 2HD HIS 62 7.751 12.382 1.698 460 HE1 HIS 62 1HE HIS 62 10.047 15.652 0.272 461 HE2 HIS 62 2HE HIS 62 8.705 14.734 2.196 462 H ILE 63 H ILE 63 7.324 8.926 -1.869 463 HA ILE 63 HA ILE 63 8.811 8.010 -3.938 464 HB ILE 63 HB ILE 63 6.084 6.956 -3.178 465 HG12 ILE 63 1HG1 ILE 63 8.802 6.040 -2.229 466 HG13 ILE 63 2HG1 ILE 63 7.793 7.168 -1.332 467 HG21 ILE 63 1HG2 ILE 63 8.130 5.101 -4.163 468 HG22 ILE 63 2HG2 ILE 63 6.405 5.181 -4.514 469 HG23 ILE 63 3HG2 ILE 63 7.527 6.241 -5.366 470 HD11 ILE 63 3HD1 ILE 63 7.158 5.263 -0.308 471 HD12 ILE 63 1HD1 ILE 63 6.025 5.206 -1.658 472 HD13 ILE 63 2HD1 ILE 63 7.511 4.257 -1.712 473 H SER 64 H SER 64 8.748 7.962 -6.111 474 HA SER 64 HA SER 64 6.442 9.245 -7.418 475 HB2 SER 64 1HB SER 64 7.948 9.967 -9.170 476 HB3 SER 64 2HB SER 64 8.630 10.439 -7.614 477 HG SER 64 HG SER 64 9.640 8.126 -7.981 478 H THR 65 H THR 65 8.685 6.542 -7.538 479 HA THR 65 HA THR 65 6.934 5.260 -9.534 480 HB THR 65 HB THR 65 9.916 4.873 -9.207 481 HG1 THR 65 1HG THR 65 8.314 6.331 -11.015 482 HG21 THR 65 3HG2 THR 65 9.562 2.892 -10.180 483 HG22 THR 65 1HG2 THR 65 9.088 3.782 -11.626 484 HG23 THR 65 2HG2 THR 65 7.862 3.262 -10.470 485 H VAL 66 H VAL 66 6.381 3.123 -9.222 486 HA VAL 66 HA VAL 66 7.467 1.694 -6.925 487 HB VAL 66 HB VAL 66 4.516 2.270 -7.219 488 HG11 VAL 66 1HG1 VAL 66 5.759 0.751 -4.957 489 HG12 VAL 66 2HG1 VAL 66 4.075 0.789 -5.485 490 HG13 VAL 66 3HG1 VAL 66 5.281 -0.073 -6.441 491 HG21 VAL 66 3HG2 VAL 66 6.063 4.049 -6.230 492 HG22 VAL 66 1HG2 VAL 66 4.666 3.563 -5.270 493 HG23 VAL 66 2HG2 VAL 66 6.267 2.941 -4.873 494 H GLN 67 H GLN 67 8.185 -0.061 -7.975 495 HA GLN 67 HA GLN 67 6.220 -1.631 -9.486 496 HB2 GLN 67 1HB GLN 67 7.719 -2.079 -11.263 497 HB3 GLN 67 2HB GLN 67 7.775 -0.339 -11.015 498 HG2 GLN 67 1HG GLN 67 9.838 -0.663 -9.665 499 HG3 GLN 67 2HG GLN 67 9.806 -2.367 -10.117 500 HE21 GLN 67 1HE2 GLN 67 11.542 -2.538 -11.391 501 HE22 GLN 67 2HE2 GLN 67 11.808 -1.621 -12.831 502 H ILE 68 H ILE 68 6.722 -3.910 -9.618 503 HA ILE 68 HA ILE 68 8.259 -4.805 -7.281 504 HB ILE 68 HB ILE 68 6.170 -6.292 -8.879 505 HG12 ILE 68 1HG1 ILE 68 5.952 -5.243 -6.057 506 HG13 ILE 68 2HG1 ILE 68 5.406 -4.325 -7.456 507 HG21 ILE 68 1HG2 ILE 68 6.289 -7.767 -6.747 508 HG22 ILE 68 2HG2 ILE 68 7.503 -7.968 -8.009 509 HG23 ILE 68 3HG2 ILE 68 7.889 -7.050 -6.554 510 HD11 ILE 68 3HD1 ILE 68 4.398 -7.045 -6.657 511 HD12 ILE 68 1HD1 ILE 68 3.581 -5.513 -6.349 512 HD13 ILE 68 2HD1 ILE 68 3.819 -6.068 -8.006 513 H LEU 69 H LEU 69 9.831 -6.374 -7.433 514 HA LEU 69 HA LEU 69 10.996 -6.713 -10.077 515 HB2 LEU 69 1HB LEU 69 12.001 -7.483 -7.341 516 HB3 LEU 69 2HB LEU 69 12.903 -7.687 -8.842 517 HG LEU 69 HG LEU 69 12.022 -5.030 -7.715 518 HD11 LEU 69 1HD1 LEU 69 14.351 -6.723 -7.179 519 HD12 LEU 69 2HD1 LEU 69 13.679 -5.383 -6.250 520 HD13 LEU 69 3HD1 LEU 69 14.740 -5.060 -7.621 521 HD21 LEU 69 3HD2 LEU 69 12.307 -5.174 -10.189 522 HD22 LEU 69 1HD2 LEU 69 13.985 -5.643 -9.917 523 HD23 LEU 69 2HD2 LEU 69 13.418 -4.057 -9.396 524 H THR 70 H THR 70 10.249 -8.345 -11.260 525 HA THR 70 HA THR 70 9.813 -10.942 -9.934 526 HB THR 70 HB THR 70 8.124 -11.458 -11.645 527 HG1 THR 70 1HG THR 70 8.446 -10.242 -13.388 528 HG21 THR 70 3HG2 THR 70 6.422 -9.693 -10.924 529 HG22 THR 70 1HG2 THR 70 7.732 -8.979 -9.985 530 HG23 THR 70 2HG2 THR 70 7.199 -10.625 -9.645 531 H GLU 71 H GLU 71 11.013 -12.583 -10.647 532 HA GLU 71 HA GLU 71 12.320 -12.314 -13.275 533 HB2 GLU 71 1HB GLU 71 13.784 -12.110 -11.162 534 HB3 GLU 71 2HB GLU 71 13.516 -13.837 -10.974 535 HG2 GLU 71 1HG GLU 71 14.470 -14.201 -13.215 536 HG3 GLU 71 2HG GLU 71 14.801 -12.473 -13.329 537 H GLY 72 H GLY 72 11.748 -13.824 -14.685 538 HA2 GLY 72 1HA GLY 72 11.501 -16.057 -15.418 539 HA3 GLY 72 2HA GLY 72 11.240 -16.550 -13.752 540 H PHE 73 H PHE 73 9.178 -15.556 -12.762 541 HA PHE 73 HA PHE 73 7.014 -16.009 -14.691 542 HB2 PHE 73 1HB PHE 73 7.036 -17.502 -12.748 543 HB3 PHE 73 2HB PHE 73 6.985 -16.113 -11.667 544 HD1 PHE 73 2HD PHE 73 5.077 -18.031 -14.170 545 HD2 PHE 73 1HD PHE 73 4.949 -15.021 -11.163 546 HE1 PHE 73 2HE PHE 73 2.618 -18.087 -14.224 547 HE2 PHE 73 1HE PHE 73 2.490 -15.073 -11.211 548 HZ PHE 73 HZ PHE 73 1.321 -16.607 -12.743 549 HA PRO 74 HA PRO 74 6.625 -11.505 -14.248 550 HB2 PRO 74 1HB PRO 74 5.249 -11.190 -16.567 551 HB3 PRO 74 2HB PRO 74 7.011 -11.323 -16.505 552 HG2 PRO 74 1HG PRO 74 4.976 -13.420 -17.156 553 HG3 PRO 74 2HG PRO 74 6.524 -13.077 -17.951 554 HD2 PRO 74 1HD PRO 74 6.214 -15.098 -16.175 555 HD3 PRO 74 2HD PRO 74 7.739 -14.207 -16.351 556 HA PRO 75 HA PRO 75 2.540 -11.233 -12.635 557 HB2 PRO 75 1HB PRO 75 1.920 -8.646 -13.176 558 HB3 PRO 75 2HB PRO 75 3.082 -9.114 -11.930 559 HG2 PRO 75 1HG PRO 75 3.581 -8.169 -14.726 560 HG3 PRO 75 2HG PRO 75 4.419 -7.723 -13.228 561 HD2 PRO 75 1HD PRO 75 5.430 -9.519 -14.983 562 HD3 PRO 75 2HD PRO 75 5.711 -9.631 -13.234 563 H GLY 76 H GLY 76 0.633 -11.920 -13.377 564 HA2 GLY 76 1HA GLY 76 -0.487 -10.811 -15.821 565 HA3 GLY 76 2HA GLY 76 -0.103 -12.525 -15.874 566 H GLY 77 H GLY 77 -1.376 -13.989 -14.770 567 HA2 GLY 77 1HA GLY 77 -3.840 -12.847 -13.602 568 HA3 GLY 77 2HA GLY 77 -3.801 -14.340 -14.529 569 H GLY 78 H GLY 78 -4.564 -13.568 -11.664 570 HA2 GLY 78 1HA GLY 78 -4.612 -14.725 -9.675 571 HA3 GLY 78 2HA GLY 78 -3.708 -16.006 -10.468 572 H ASN 79 H ASN 79 -2.863 -15.930 -8.120 573 HA ASN 79 HA ASN 79 -1.323 -14.068 -6.953 574 HB2 ASN 79 1HB ASN 79 -0.503 -16.964 -7.276 575 HB3 ASN 79 2HB ASN 79 0.075 -15.861 -6.030 576 HD21 ASN 79 1HD2 ASN 79 -1.766 -18.398 -6.348 577 HD22 ASN 79 2HD2 ASN 79 -3.032 -18.060 -5.221 578 H ALA 80 H ALA 80 0.843 -13.378 -7.011 579 HA ALA 80 HA ALA 80 2.222 -13.870 -9.571 580 HB1 ALA 80 1HB ALA 80 1.424 -11.374 -8.305 581 HB2 ALA 80 2HB ALA 80 3.136 -11.415 -8.730 582 HB3 ALA 80 3HB ALA 80 1.912 -11.696 -9.969 583 H ARG 81 H ARG 81 4.266 -14.562 -9.452 584 HA ARG 81 HA ARG 81 5.448 -14.958 -6.835 585 HB2 ARG 81 1HB ARG 81 6.154 -15.871 -9.613 586 HB3 ARG 81 2HB ARG 81 7.269 -16.085 -8.270 587 HG2 ARG 81 1HG ARG 81 5.587 -17.400 -7.081 588 HG3 ARG 81 2HG ARG 81 4.471 -17.186 -8.432 589 HD2 ARG 81 1HD ARG 81 6.087 -18.322 -9.907 590 HD3 ARG 81 2HD ARG 81 7.144 -18.581 -8.520 591 HE ARG 81 HE ARG 81 4.469 -19.626 -8.219 592 HH11 ARG 81 1HH1 ARG 81 7.732 -20.259 -9.253 593 HH12 ARG 81 2HH1 ARG 81 7.589 -21.978 -9.091 594 HH21 ARG 81 1HH2 ARG 81 4.268 -21.887 -8.002 595 HH22 ARG 81 2HH2 ARG 81 5.617 -22.903 -8.380 596 H ALA 82 H ALA 82 5.970 -12.830 -6.229 597 HA ALA 82 HA ALA 82 7.869 -11.360 -7.885 598 HB1 ALA 82 1HB ALA 82 6.010 -10.685 -5.716 599 HB2 ALA 82 2HB ALA 82 7.550 -9.827 -5.670 600 HB3 ALA 82 3HB ALA 82 6.531 -9.733 -7.106 601 H THR 83 H THR 83 9.985 -11.540 -7.605 602 HA THR 83 HA THR 83 10.990 -12.694 -5.098 603 HB THR 83 HB THR 83 13.032 -13.236 -6.311 604 HG1 THR 83 1HG THR 83 12.873 -11.399 -7.785 605 HG21 THR 83 3HG2 THR 83 11.276 -14.273 -8.350 606 HG22 THR 83 1HG2 THR 83 10.514 -14.369 -6.763 607 HG23 THR 83 2HG2 THR 83 12.086 -15.122 -7.034 608 H GLY 84 H GLY 84 10.224 -9.969 -5.116 609 HA2 GLY 84 1HA GLY 84 11.999 -8.625 -3.703 610 HA3 GLY 84 2HA GLY 84 12.723 -8.461 -5.296 611 H MET 85 H MET 85 12.202 -6.158 -4.198 612 HA MET 85 HA MET 85 9.877 -5.187 -5.684 613 HB2 MET 85 1HB MET 85 9.104 -5.477 -3.378 614 HB3 MET 85 2HB MET 85 10.442 -4.496 -2.795 615 HG2 MET 85 1HG MET 85 8.398 -3.211 -2.837 616 HG3 MET 85 2HG MET 85 9.557 -2.567 -3.997 617 HE1 MET 85 3HE MET 85 5.377 -2.996 -4.840 618 HE2 MET 85 1HE MET 85 5.891 -4.181 -3.639 619 HE3 MET 85 2HE MET 85 6.322 -2.483 -3.442 620 H PHE 86 H PHE 86 9.990 -2.970 -6.270 621 HA PHE 86 HA PHE 86 12.578 -1.662 -5.813 622 HB2 PHE 86 1HB PHE 86 12.625 -2.813 -8.016 623 HB3 PHE 86 2HB PHE 86 11.230 -1.862 -8.513 624 HD1 PHE 86 1HD PHE 86 11.450 0.608 -8.739 625 HD2 PHE 86 2HD PHE 86 14.807 -1.929 -8.102 626 HE1 PHE 86 1HE PHE 86 12.947 2.398 -9.521 627 HE2 PHE 86 2HE PHE 86 16.309 -0.143 -8.881 628 HZ PHE 86 HZ PHE 86 15.380 2.024 -9.592 629 H LEU 87 H LEU 87 12.130 0.184 -4.818 630 HA LEU 87 HA LEU 87 9.847 1.776 -5.782 631 HB2 LEU 87 1HB LEU 87 10.836 1.776 -2.944 632 HB3 LEU 87 2HB LEU 87 9.352 2.485 -3.577 633 HG LEU 87 HG LEU 87 9.860 -0.483 -3.529 634 HD11 LEU 87 1HD1 LEU 87 7.949 0.356 -1.586 635 HD12 LEU 87 2HD1 LEU 87 9.467 1.208 -1.307 636 HD13 LEU 87 3HD1 LEU 87 9.441 -0.555 -1.356 637 HD21 LEU 87 3HD2 LEU 87 7.493 -0.659 -3.860 638 HD22 LEU 87 1HD2 LEU 87 8.148 0.419 -5.093 639 HD23 LEU 87 2HD2 LEU 87 7.292 1.087 -3.703 640 H GLN 88 H GLN 88 10.097 4.036 -5.774 641 HA GLN 88 HA GLN 88 12.868 4.974 -5.429 642 HB2 GLN 88 1HB GLN 88 10.900 5.598 -7.624 643 HB3 GLN 88 2HB GLN 88 12.300 6.612 -7.302 644 HG2 GLN 88 1HG GLN 88 13.719 4.559 -7.607 645 HG3 GLN 88 2HG GLN 88 12.269 3.744 -8.191 646 HE21 GLN 88 1HE2 GLN 88 13.751 6.932 -8.695 647 HE22 GLN 88 2HE2 GLN 88 13.712 6.866 -10.421 648 H TYR 89 H TYR 89 13.120 7.205 -4.855 649 HA TYR 89 HA TYR 89 10.914 8.870 -4.209 650 HB2 TYR 89 1HB TYR 89 11.368 8.852 -1.699 651 HB3 TYR 89 2HB TYR 89 10.491 7.472 -2.349 652 HD1 TYR 89 1HD TYR 89 13.810 8.607 -1.163 653 HD2 TYR 89 2HD TYR 89 11.352 5.277 -2.151 654 HE1 TYR 89 1HE TYR 89 15.475 7.091 -0.172 655 HE2 TYR 89 2HE TYR 89 13.009 3.753 -1.161 656 HH TYR 89 HH TYR 89 14.910 4.085 0.743 657 H THR 90 H THR 90 11.561 10.921 -3.367 658 HA THR 90 HA THR 90 14.439 11.441 -3.723 659 HB THR 90 HB THR 90 13.720 13.819 -4.180 660 HG1 THR 90 1HG THR 90 11.447 13.935 -4.887 661 HG21 THR 90 3HG2 THR 90 13.536 11.494 -5.874 662 HG22 THR 90 1HG2 THR 90 14.118 13.113 -6.259 663 HG23 THR 90 2HG2 THR 90 12.400 12.736 -6.400 664 H VAL 91 H VAL 91 15.549 12.641 -2.224 665 HA VAL 91 HA VAL 91 14.118 13.182 0.292 666 HB VAL 91 HB VAL 91 17.015 12.504 -0.204 667 HG11 VAL 91 1HG1 VAL 91 15.957 14.169 1.820 668 HG12 VAL 91 2HG1 VAL 91 16.388 12.632 2.573 669 HG13 VAL 91 3HG1 VAL 91 17.598 13.542 1.668 670 HG21 VAL 91 3HG2 VAL 91 14.956 11.124 1.511 671 HG22 VAL 91 1HG2 VAL 91 15.349 10.650 -0.142 672 HG23 VAL 91 2HG2 VAL 91 16.578 10.554 1.119 673 HA PRO 92 HA PRO 92 14.855 17.483 -0.472 674 HB2 PRO 92 1HB PRO 92 14.125 18.382 1.983 675 HB3 PRO 92 2HB PRO 92 12.956 17.860 0.765 676 HG2 PRO 92 1HG PRO 92 14.035 16.360 3.120 677 HG3 PRO 92 2HG PRO 92 12.369 16.452 2.520 678 HD2 PRO 92 1HD PRO 92 13.986 14.341 2.012 679 HD3 PRO 92 2HD PRO 92 12.745 14.890 0.867 680 H GLY 93 H GLY 93 16.914 18.148 -0.609 681 HA2 GLY 93 1HA GLY 93 18.587 19.421 0.705 682 HA3 GLY 93 2HA GLY 93 18.537 18.099 1.862 683 H THR 94 H THR 94 18.568 15.938 0.070 684 HA THR 94 HA THR 94 21.378 15.985 -0.668 685 HB THR 94 HB THR 94 20.246 14.055 0.572 686 HG1 THR 94 1HG THR 94 22.146 14.077 -1.344 687 HG21 THR 94 3HG2 THR 94 18.272 13.896 -0.894 688 HG22 THR 94 1HG2 THR 94 19.151 12.371 -0.804 689 HG23 THR 94 2HG2 THR 94 19.315 13.400 -2.226 690 H GLU 95 H GLU 95 22.161 15.370 -2.734 691 HA GLU 95 HA GLU 95 20.385 16.189 -4.902 692 HB2 GLU 95 1HB GLU 95 23.367 15.691 -4.890 693 HB3 GLU 95 2HB GLU 95 22.444 16.303 -6.255 694 HG2 GLU 95 1HG GLU 95 21.932 18.323 -5.099 695 HG3 GLU 95 2HG GLU 95 22.613 17.698 -3.598 696 H GLY 96 H GLY 96 19.527 14.808 -6.318 697 HA2 GLY 96 1HA GLY 96 19.723 12.918 -7.798 698 HA3 GLY 96 2HA GLY 96 20.751 12.143 -6.602 699 H VAL 97 H VAL 97 18.950 10.509 -7.424 700 HA VAL 97 HA VAL 97 16.701 10.657 -5.524 701 HB VAL 97 HB VAL 97 16.852 9.135 -8.129 702 HG11 VAL 97 1HG1 VAL 97 14.220 9.228 -7.357 703 HG12 VAL 97 2HG1 VAL 97 15.296 7.841 -7.177 704 HG13 VAL 97 3HG1 VAL 97 15.064 8.959 -5.833 705 HG21 VAL 97 3HG2 VAL 97 15.847 10.855 -9.158 706 HG22 VAL 97 1HG2 VAL 97 14.784 11.173 -7.787 707 HG23 VAL 97 2HG2 VAL 97 16.426 11.816 -7.797 708 H THR 98 H THR 98 16.177 8.853 -4.298 709 HA THR 98 HA THR 98 18.298 6.819 -4.137 710 HB THR 98 HB THR 98 16.317 7.658 -2.010 711 HG1 THR 98 1HG THR 98 18.212 9.076 -2.661 712 HG21 THR 98 3HG2 THR 98 16.803 5.467 -1.452 713 HG22 THR 98 1HG2 THR 98 18.079 6.336 -0.600 714 HG23 THR 98 2HG2 THR 98 18.427 5.542 -2.136 715 H GLN 99 H GLN 99 17.837 4.747 -4.538 716 HA GLN 99 HA GLN 99 15.026 4.036 -5.008 717 HB2 GLN 99 1HB GLN 99 17.531 2.629 -5.948 718 HB3 GLN 99 2HB GLN 99 15.880 2.205 -6.382 719 HG2 GLN 99 1HG GLN 99 16.686 3.382 -8.220 720 HG3 GLN 99 2HG GLN 99 15.703 4.553 -7.344 721 HE21 GLN 99 1HE2 GLN 99 19.040 3.365 -7.078 722 HE22 GLN 99 2HE2 GLN 99 19.775 4.928 -7.070 723 H LEU 100 H LEU 100 14.592 1.612 -4.620 724 HA LEU 100 HA LEU 100 15.994 0.578 -2.278 725 HB2 LEU 100 1HB LEU 100 13.943 2.048 -1.682 726 HB3 LEU 100 2HB LEU 100 13.002 0.669 -2.247 727 HG LEU 100 HG LEU 100 14.408 -0.680 -0.536 728 HD11 LEU 100 1HD1 LEU 100 14.607 1.313 1.391 729 HD12 LEU 100 2HD1 LEU 100 15.324 2.015 -0.059 730 HD13 LEU 100 3HD1 LEU 100 15.935 0.487 0.575 731 HD21 LEU 100 3HD2 LEU 100 11.915 0.306 -0.504 732 HD22 LEU 100 1HD2 LEU 100 12.581 1.148 0.895 733 HD23 LEU 100 2HD2 LEU 100 12.608 -0.615 0.832 734 H LYS 101 H LYS 101 16.456 -1.476 -2.652 735 HA LYS 101 HA LYS 101 14.654 -3.034 -4.387 736 HB2 LYS 101 1HB LYS 101 17.156 -2.513 -5.029 737 HB3 LYS 101 2HB LYS 101 17.499 -3.832 -3.918 738 HG2 LYS 101 1HG LYS 101 15.868 -5.216 -5.269 739 HG3 LYS 101 2HG LYS 101 15.910 -3.917 -6.464 740 HD2 LYS 101 1HD LYS 101 17.537 -5.366 -7.249 741 HD3 LYS 101 2HD LYS 101 18.485 -4.207 -6.315 742 HE2 LYS 101 1HE LYS 101 17.997 -5.948 -4.375 743 HE3 LYS 101 2HE LYS 101 17.843 -7.052 -5.741 744 HZ1 LYS 101 3HZ LYS 101 20.047 -6.519 -6.441 745 HZ2 LYS 101 1HZ LYS 101 20.111 -6.928 -4.801 746 HZ3 LYS 101 2HZ LYS 101 20.197 -5.306 -5.272 747 H LEU 102 H LEU 102 13.611 -4.667 -3.466 748 HA LEU 102 HA LEU 102 14.585 -5.668 -0.877 749 HB2 LEU 102 1HB LEU 102 11.813 -5.899 -2.033 750 HB3 LEU 102 2HB LEU 102 12.320 -6.331 -0.401 751 HG LEU 102 HG LEU 102 12.292 -3.526 -1.514 752 HD11 LEU 102 1HD1 LEU 102 10.468 -3.978 0.640 753 HD12 LEU 102 2HD1 LEU 102 10.140 -5.123 -0.660 754 HD13 LEU 102 3HD1 LEU 102 10.144 -3.390 -0.991 755 HD21 LEU 102 3HD2 LEU 102 12.283 -3.357 1.207 756 HD22 LEU 102 1HD2 LEU 102 13.712 -3.195 0.186 757 HD23 LEU 102 2HD2 LEU 102 13.334 -4.747 0.934 758 H THR 103 H THR 103 14.690 -7.880 -0.480 759 HA THR 103 HA THR 103 14.163 -9.702 -2.706 760 HB THR 103 HB THR 103 16.816 -9.711 -1.261 761 HG1 THR 103 1HG THR 103 16.255 -7.925 -2.890 762 HG21 THR 103 3HG2 THR 103 17.213 -11.096 -3.526 763 HG22 THR 103 1HG2 THR 103 15.504 -11.446 -3.269 764 HG23 THR 103 2HG2 THR 103 16.684 -11.848 -2.021 765 H VAL 104 H VAL 104 13.893 -11.881 -2.096 766 HA VAL 104 HA VAL 104 12.832 -12.239 0.533 767 HB VAL 104 HB VAL 104 13.331 -14.264 -1.653 768 HG11 VAL 104 1HG1 VAL 104 12.193 -15.854 -0.432 769 HG12 VAL 104 2HG1 VAL 104 13.099 -15.021 0.833 770 HG13 VAL 104 3HG1 VAL 104 11.391 -14.655 0.582 771 HG21 VAL 104 3HG2 VAL 104 11.693 -12.299 -2.007 772 HG22 VAL 104 1HG2 VAL 104 11.139 -13.937 -2.357 773 HG23 VAL 104 2HG2 VAL 104 10.668 -13.149 -0.852 774 H VAL 105 H VAL 105 13.641 -13.370 2.247 775 HA VAL 105 HA VAL 105 16.466 -14.182 2.045 776 HB VAL 105 HB VAL 105 14.918 -13.263 4.471 777 HG11 VAL 105 1HG1 VAL 105 17.249 -14.885 4.279 778 HG12 VAL 105 2HG1 VAL 105 17.712 -13.310 4.928 779 HG13 VAL 105 3HG1 VAL 105 16.455 -14.259 5.724 780 HG21 VAL 105 3HG2 VAL 105 15.813 -11.646 2.578 781 HG22 VAL 105 1HG2 VAL 105 15.929 -11.224 4.286 782 HG23 VAL 105 2HG2 VAL 105 17.335 -11.871 3.441 783 H GLU 106 H GLU 106 17.113 -16.162 2.790 784 HA GLU 106 HA GLU 106 15.130 -18.211 2.923 785 HB2 GLU 106 1HB GLU 106 17.135 -19.679 3.445 786 HB3 GLU 106 2HB GLU 106 17.177 -18.821 1.911 787 HG2 GLU 106 1HG GLU 106 18.701 -17.199 2.786 788 HG3 GLU 106 2HG GLU 106 18.549 -17.865 4.411 789 H ASP 107 H ASP 107 13.830 -18.061 4.687 790 HA ASP 107 HA ASP 107 15.148 -18.281 7.314 791 HB2 ASP 107 1HB ASP 107 13.214 -17.105 8.291 792 HB3 ASP 107 2HB ASP 107 14.053 -16.108 7.106 793 H VAL 108 H VAL 108 13.411 -19.128 8.981 794 HA VAL 108 HA VAL 108 12.601 -21.723 7.983 795 HB VAL 108 HB VAL 108 13.710 -21.588 10.153 796 HG11 VAL 108 1HG1 VAL 108 12.498 -20.613 12.088 797 HG12 VAL 108 2HG1 VAL 108 12.997 -19.414 10.893 798 HG13 VAL 108 3HG1 VAL 108 11.316 -19.945 10.964 799 HG21 VAL 108 3HG2 VAL 108 11.668 -22.642 11.500 800 HG22 VAL 108 1HG2 VAL 108 10.957 -22.652 9.886 801 HG23 VAL 108 2HG2 VAL 108 12.475 -23.498 10.187 802 H THR 109 H THR 109 11.072 -18.827 9.312 803 HA THR 109 HA THR 109 8.465 -19.901 8.447 804 HB THR 109 HB THR 109 7.466 -18.382 10.211 805 HG1 THR 109 1HG THR 109 8.898 -17.760 11.891 806 HG21 THR 109 3HG2 THR 109 7.230 -20.366 11.200 807 HG22 THR 109 1HG2 THR 109 8.760 -20.078 12.026 808 HG23 THR 109 2HG2 THR 109 8.735 -20.954 10.495 809 H VAL 110 H VAL 110 6.835 -17.924 8.330 810 HA VAL 110 HA VAL 110 6.230 -16.341 6.749 811 HB VAL 110 HB VAL 110 7.007 -14.114 7.383 812 HG11 VAL 110 1HG1 VAL 110 5.301 -15.237 8.749 813 HG12 VAL 110 2HG1 VAL 110 6.572 -15.869 9.797 814 HG13 VAL 110 3HG1 VAL 110 6.290 -14.131 9.702 815 HG21 VAL 110 3HG2 VAL 110 8.694 -13.875 9.189 816 HG22 VAL 110 1HG2 VAL 110 9.028 -15.601 9.055 817 HG23 VAL 110 2HG2 VAL 110 9.359 -14.531 7.693 818 H GLY 111 H GLY 111 8.104 -18.025 5.565 819 HA2 GLY 111 1HA GLY 111 10.351 -16.742 4.473 820 HA3 GLY 111 2HA GLY 111 9.534 -18.132 3.774 821 H ARG 112 H ARG 112 9.041 -17.766 1.724 822 HA ARG 112 HA ARG 112 8.859 -15.180 0.589 823 HB2 ARG 112 1HB ARG 112 8.311 -17.958 -0.382 824 HB3 ARG 112 2HB ARG 112 7.785 -16.588 -1.351 825 HG2 ARG 112 1HG ARG 112 10.278 -15.811 -0.975 826 HG3 ARG 112 2HG ARG 112 10.527 -17.543 -0.739 827 HD2 ARG 112 1HD ARG 112 9.069 -17.662 -2.955 828 HD3 ARG 112 2HD ARG 112 9.735 -16.044 -3.177 829 HE ARG 112 HE ARG 112 11.791 -16.978 -3.581 830 HH11 ARG 112 1HH1 ARG 112 9.677 -19.381 -2.211 831 HH12 ARG 112 2HH1 ARG 112 10.770 -20.694 -2.498 832 HH21 ARG 112 1HH2 ARG 112 13.239 -18.698 -3.964 833 HH22 ARG 112 2HH2 ARG 112 12.796 -20.304 -3.494 834 H ARG 113 H ARG 113 6.392 -17.622 1.363 835 HA ARG 113 HA ARG 113 4.110 -16.569 0.421 836 HB2 ARG 113 1HB ARG 113 2.940 -17.454 2.405 837 HB3 ARG 113 2HB ARG 113 4.134 -18.583 1.779 838 HG2 ARG 113 1HG ARG 113 5.692 -17.501 3.560 839 HG3 ARG 113 2HG ARG 113 4.174 -16.988 4.298 840 HD2 ARG 113 1HD ARG 113 4.441 -19.829 3.464 841 HD3 ARG 113 2HD ARG 113 5.316 -19.301 4.901 842 HE ARG 113 HE ARG 113 2.856 -18.379 5.397 843 HH11 ARG 113 1HH1 ARG 113 3.973 -21.487 4.296 844 HH12 ARG 113 2HH1 ARG 113 2.673 -22.361 5.036 845 HH21 ARG 113 1HH2 ARG 113 1.140 -19.519 6.376 846 HH22 ARG 113 2HH2 ARG 113 1.062 -21.241 6.218 847 H GLN 114 H GLN 114 5.791 -15.426 3.326 848 HA GLN 114 HA GLN 114 3.867 -13.355 3.832 849 HB2 GLN 114 1HB GLN 114 5.392 -14.556 5.534 850 HB3 GLN 114 2HB GLN 114 6.642 -13.448 4.985 851 HG2 GLN 114 1HG GLN 114 5.650 -12.551 6.956 852 HG3 GLN 114 2HG GLN 114 5.157 -11.557 5.586 853 HE21 GLN 114 1HE2 GLN 114 3.443 -10.835 6.983 854 HE22 GLN 114 2HE2 GLN 114 2.012 -11.789 7.149 855 H ALA 115 H ALA 115 7.173 -13.481 2.551 856 HA ALA 115 HA ALA 115 7.482 -10.708 2.165 857 HB1 ALA 115 1HB ALA 115 9.243 -11.459 0.473 858 HB2 ALA 115 2HB ALA 115 9.453 -11.970 2.148 859 HB3 ALA 115 3HB ALA 115 8.823 -13.103 0.953 860 H VAL 116 H VAL 116 6.969 -13.194 -0.347 861 HA VAL 116 HA VAL 116 6.449 -11.554 -2.479 862 HB VAL 116 HB VAL 116 5.097 -14.189 -1.878 863 HG11 VAL 116 1HG1 VAL 116 5.277 -14.052 -4.576 864 HG12 VAL 116 2HG1 VAL 116 3.842 -13.602 -3.652 865 HG13 VAL 116 3HG1 VAL 116 4.980 -12.360 -4.177 866 HG21 VAL 116 3HG2 VAL 116 7.714 -13.456 -3.142 867 HG22 VAL 116 1HG2 VAL 116 7.380 -14.646 -1.883 868 HG23 VAL 116 2HG2 VAL 116 6.901 -14.967 -3.550 869 H ALA 117 H ALA 117 4.088 -12.782 -0.121 870 HA ALA 117 HA ALA 117 1.774 -11.717 -1.200 871 HB1 ALA 117 1HB ALA 117 1.771 -13.260 0.682 872 HB2 ALA 117 2HB ALA 117 2.470 -12.015 1.719 873 HB3 ALA 117 3HB ALA 117 0.846 -11.808 1.063 874 H TRP 118 H TRP 118 4.110 -10.183 0.983 875 HA TRP 118 HA TRP 118 2.682 -7.753 1.267 876 HB2 TRP 118 1HB TRP 118 4.544 -8.617 2.764 877 HB3 TRP 118 2HB TRP 118 5.672 -8.085 1.520 878 HD1 TRP 118 HD TRP 118 3.766 -6.846 4.477 879 HE1 TRP 118 1HE TRP 118 4.114 -4.310 4.751 880 HE3 TRP 118 3HE TRP 118 5.976 -5.840 -0.021 881 HZ2 TRP 118 2HZ TRP 118 5.183 -2.167 3.257 882 HZ3 TRP 118 3HZ TRP 118 6.630 -3.521 -0.521 883 HH2 TRP 118 HH TRP 118 6.241 -1.724 1.085 884 H LEU 119 H LEU 119 5.348 -8.736 -0.860 885 HA LEU 119 HA LEU 119 5.913 -6.357 -2.108 886 HB2 LEU 119 1HB LEU 119 5.738 -9.053 -3.443 887 HB3 LEU 119 2HB LEU 119 6.648 -7.660 -4.024 888 HG LEU 119 HG LEU 119 7.247 -9.000 -1.398 889 HD11 LEU 119 1HD1 LEU 119 7.431 -10.331 -3.740 890 HD12 LEU 119 2HD1 LEU 119 8.507 -10.588 -2.367 891 HD13 LEU 119 3HD1 LEU 119 9.005 -9.536 -3.693 892 HD21 LEU 119 3HD2 LEU 119 8.040 -6.615 -2.122 893 HD22 LEU 119 1HD2 LEU 119 9.187 -7.518 -3.112 894 HD23 LEU 119 2HD2 LEU 119 9.169 -7.738 -1.362 895 H VAL 120 H VAL 120 3.607 -8.788 -3.340 896 HA VAL 120 HA VAL 120 2.541 -7.158 -5.364 897 HB VAL 120 HB VAL 120 2.237 -9.568 -5.401 898 HG11 VAL 120 1HG1 VAL 120 1.107 -10.805 -3.820 899 HG12 VAL 120 2HG1 VAL 120 1.871 -9.574 -2.813 900 HG13 VAL 120 3HG1 VAL 120 0.170 -9.424 -3.253 901 HG21 VAL 120 3HG2 VAL 120 -0.537 -8.497 -5.093 902 HG22 VAL 120 1HG2 VAL 120 0.516 -7.868 -6.360 903 HG23 VAL 120 2HG2 VAL 120 0.115 -9.585 -6.319 904 H ALA 121 H ALA 121 1.469 -7.761 -2.040 905 HA ALA 121 HA ALA 121 -0.948 -6.435 -2.042 906 HB1 ALA 121 1HB ALA 121 -0.756 -7.290 0.010 907 HB2 ALA 121 2HB ALA 121 1.006 -7.229 -0.035 908 HB3 ALA 121 3HB ALA 121 0.086 -5.796 0.422 909 H MET 122 H MET 122 2.295 -5.073 -1.576 910 HA MET 122 HA MET 122 1.537 -2.444 -1.012 911 HB2 MET 122 1HB MET 122 3.819 -3.256 -0.693 912 HB3 MET 122 2HB MET 122 4.012 -3.447 -2.430 913 HG2 MET 122 1HG MET 122 5.042 -1.448 -2.162 914 HG3 MET 122 2HG MET 122 3.393 -0.884 -2.426 915 HE1 MET 122 3HE MET 122 2.747 1.052 -1.258 916 HE2 MET 122 1HE MET 122 3.460 1.672 0.232 917 HE3 MET 122 2HE MET 122 4.451 1.506 -1.218 918 H HIS 123 H HIS 123 2.689 -3.721 -4.141 919 HA HIS 123 HA HIS 123 2.159 -1.498 -5.690 920 HB2 HIS 123 1HB HIS 123 3.393 -3.520 -6.452 921 HB3 HIS 123 2HB HIS 123 1.859 -4.378 -6.566 922 HD2 HIS 123 2HD HIS 123 4.010 -3.309 -9.104 923 HE1 HIS 123 1HE HIS 123 0.392 -1.484 -10.359 924 HE2 HIS 123 2HE HIS 123 2.679 -2.270 -11.063 925 H LYS 124 H LYS 124 0.045 -4.363 -5.436 926 HA LYS 124 HA LYS 124 -2.125 -3.592 -6.829 927 HB2 LYS 124 1HB LYS 124 -1.922 -5.056 -4.217 928 HB3 LYS 124 2HB LYS 124 -3.497 -4.731 -4.930 929 HG2 LYS 124 1HG LYS 124 -1.330 -6.071 -6.504 930 HG3 LYS 124 2HG LYS 124 -2.378 -6.984 -5.415 931 HD2 LYS 124 1HD LYS 124 -4.253 -6.621 -6.699 932 HD3 LYS 124 2HD LYS 124 -3.616 -5.131 -7.399 933 HE2 LYS 124 1HE LYS 124 -3.566 -6.694 -9.149 934 HE3 LYS 124 2HE LYS 124 -1.903 -6.608 -8.570 935 HZ1 LYS 124 3HZ LYS 124 -2.003 -8.801 -8.362 936 HZ2 LYS 124 1HZ LYS 124 -3.671 -8.837 -8.640 937 HZ3 LYS 124 2HZ LYS 124 -3.081 -8.584 -7.076 938 H ALA 125 H ALA 125 -1.834 -2.891 -3.340 939 HA ALA 125 HA ALA 125 -4.015 -1.164 -3.173 940 HB1 ALA 125 1HB ALA 125 -1.848 -1.983 -1.474 941 HB2 ALA 125 2HB ALA 125 -2.153 -0.255 -1.292 942 HB3 ALA 125 3HB ALA 125 -3.459 -1.412 -1.038 943 H ALA 126 H ALA 126 -0.584 -0.429 -3.733 944 HA ALA 126 HA ALA 126 -0.478 2.261 -3.680 945 HB1 ALA 126 1HB ALA 126 0.667 0.648 -5.954 946 HB2 ALA 126 2HB ALA 126 1.251 2.196 -5.342 947 HB3 ALA 126 3HB ALA 126 1.379 0.748 -4.343 948 H LYS 127 H LYS 127 -1.875 0.339 -6.306 949 HA LYS 127 HA LYS 127 -2.384 2.292 -8.174 950 HB2 LYS 127 1HB LYS 127 -3.866 -0.198 -7.399 951 HB3 LYS 127 2HB LYS 127 -4.516 0.865 -8.641 952 HG2 LYS 127 1HG LYS 127 -2.860 0.370 -10.132 953 HG3 LYS 127 2HG LYS 127 -1.685 -0.008 -8.871 954 HD2 LYS 127 1HD LYS 127 -2.173 -2.096 -9.761 955 HD3 LYS 127 2HD LYS 127 -3.240 -2.013 -8.358 956 HE2 LYS 127 1HE LYS 127 -4.254 -1.041 -10.983 957 HE3 LYS 127 2HE LYS 127 -4.127 -2.780 -10.721 958 HZ1 LYS 127 3HZ LYS 127 -6.111 -1.018 -9.806 959 HZ2 LYS 127 1HZ LYS 127 -5.319 -1.668 -8.460 960 HZ3 LYS 127 2HZ LYS 127 -6.020 -2.695 -9.606 961 H LEU 128 H LEU 128 -4.636 1.246 -5.610 962 HA LEU 128 HA LEU 128 -6.649 3.078 -6.042 963 HB2 LEU 128 1HB LEU 128 -5.631 1.813 -3.516 964 HB3 LEU 128 2HB LEU 128 -7.036 2.878 -3.525 965 HG LEU 128 HG LEU 128 -6.861 0.367 -5.180 966 HD11 LEU 128 1HD1 LEU 128 -7.352 0.709 -2.323 967 HD12 LEU 128 2HD1 LEU 128 -6.976 -0.745 -3.246 968 HD13 LEU 128 3HD1 LEU 128 -8.636 -0.155 -3.168 969 HD21 LEU 128 3HD2 LEU 128 -9.244 1.974 -4.273 970 HD22 LEU 128 1HD2 LEU 128 -9.233 0.613 -5.394 971 HD23 LEU 128 2HD2 LEU 128 -8.478 2.139 -5.853 972 H LEU 129 H LEU 129 -3.883 3.445 -3.823 973 HA LEU 129 HA LEU 129 -4.303 5.881 -2.746 974 HB2 LEU 129 1HB LEU 129 -1.856 4.496 -3.689 975 HB3 LEU 129 2HB LEU 129 -1.709 6.198 -3.256 976 HG LEU 129 HG LEU 129 -2.700 4.008 -1.430 977 HD11 LEU 129 1HD1 LEU 129 -0.438 4.957 -0.305 978 HD12 LEU 129 2HD1 LEU 129 -0.029 5.092 -2.015 979 HD13 LEU 129 3HD1 LEU 129 -0.504 3.532 -1.342 980 HD21 LEU 129 3HD2 LEU 129 -2.585 6.955 -1.234 981 HD22 LEU 129 1HD2 LEU 129 -2.064 6.047 0.185 982 HD23 LEU 129 2HD2 LEU 129 -3.684 5.805 -0.470 983 H TYR 130 H TYR 130 -2.529 5.492 -5.820 984 HA TYR 130 HA TYR 130 -2.784 8.277 -6.448 985 HB2 TYR 130 1HB TYR 130 -2.049 6.230 -8.502 986 HB3 TYR 130 2HB TYR 130 -1.409 7.852 -8.264 987 HD1 TYR 130 2HD TYR 130 -0.612 7.831 -5.456 988 HD2 TYR 130 1HD TYR 130 -0.231 4.789 -8.407 989 HE1 TYR 130 2HE TYR 130 1.310 6.898 -4.238 990 HE2 TYR 130 1HE TYR 130 1.691 3.847 -7.196 991 HH TYR 130 HH TYR 130 3.007 5.431 -4.320 992 H GLU 131 H GLU 131 -3.918 5.369 -8.182 993 HA GLU 131 HA GLU 131 -5.603 6.606 -9.975 994 HB2 GLU 131 1HB GLU 131 -6.078 3.937 -8.637 995 HB3 GLU 131 2HB GLU 131 -6.780 4.472 -10.157 996 HG2 GLU 131 1HG GLU 131 -3.822 4.440 -9.910 997 HG3 GLU 131 2HG GLU 131 -4.670 2.904 -10.081 998 H SER 132 H SER 132 -8.072 6.335 -9.979 999 HA SER 132 HA SER 132 -9.299 8.101 -8.370 1000 HB2 SER 132 1HB SER 132 -11.406 7.103 -8.925 1001 HB3 SER 132 2HB SER 132 -10.333 6.834 -10.299 1002 HG SER 132 HG SER 132 -11.216 5.000 -8.348 1003 H ARG 133 H ARG 133 -10.686 7.977 -6.506 1004 HA ARG 133 HA ARG 133 -10.193 5.706 -4.719 1005 HB2 ARG 133 1HB ARG 133 -9.860 7.344 -2.833 1006 HB3 ARG 133 2HB ARG 133 -8.547 7.268 -4.000 1007 HG2 ARG 133 1HG ARG 133 -9.916 9.257 -5.098 1008 HG3 ARG 133 2HG ARG 133 -10.459 9.455 -3.430 1009 HD2 ARG 133 1HD ARG 133 -7.551 9.087 -3.921 1010 HD3 ARG 133 2HD ARG 133 -8.272 10.638 -4.348 1011 HE ARG 133 HE ARG 133 -8.992 9.806 -1.716 1012 HH11 ARG 133 1HH1 ARG 133 -6.462 11.278 -3.601 1013 HH12 ARG 133 2HH1 ARG 133 -5.793 12.150 -2.262 1014 HH21 ARG 133 1HH2 ARG 133 -8.120 10.948 0.055 1015 HH22 ARG 133 2HH2 ARG 133 -6.736 11.961 -0.182 1016 H ASP 134 H ASP 134 -12.097 4.942 -4.111 1017 HA ASP 134 HA ASP 134 -14.573 5.904 -4.584 1018 HB2 ASP 134 1HB ASP 134 -14.411 3.718 -3.700 1019 HB3 ASP 134 2HB ASP 134 -13.577 4.277 -2.253 1020 H GLN 135 H GLN 135 -15.693 7.647 -4.036 1021 HA GLN 135 HA GLN 135 -15.056 8.988 -1.492 1022 HB2 GLN 135 1HB GLN 135 -14.215 10.207 -3.522 1023 HB3 GLN 135 2HB GLN 135 -15.886 10.380 -4.041 1024 HG2 GLN 135 1HG GLN 135 -16.413 11.754 -2.184 1025 HG3 GLN 135 2HG GLN 135 -14.876 11.393 -1.400 1026 HE21 GLN 135 1HE2 GLN 135 -15.883 12.487 -4.627 1027 HE22 GLN 135 2HE2 GLN 135 -14.800 13.831 -4.695 1028 H SER 136 H SER 136 -16.848 10.434 -0.733 1029 HA SER 136 HA SER 136 -19.491 9.401 -1.506 1030 HB2 SER 136 1HB SER 136 -18.517 9.839 1.328 1031 HB3 SER 136 2HB SER 136 -20.156 9.378 0.870 1032 HG SER 136 HG SER 136 -19.511 7.393 0.564 1033 H GLY 137 H GLY 137 -17.889 11.890 0.491 1034 HA2 GLY 137 1HA GLY 137 -19.962 13.722 0.604 1035 HA3 GLY 137 2HA GLY 137 -18.258 14.150 0.654 1036 HA PRO 138 HA PRO 138 -20.488 15.250 -3.488 1037 HB2 PRO 138 1HB PRO 138 -21.646 17.632 -2.894 1038 HB3 PRO 138 2HB PRO 138 -22.497 16.089 -2.752 1039 HG2 PRO 138 1HG PRO 138 -21.181 17.729 -0.622 1040 HG3 PRO 138 2HG PRO 138 -22.741 16.887 -0.582 1041 HD2 PRO 138 1HD PRO 138 -20.507 15.871 0.563 1042 HD3 PRO 138 2HD PRO 138 -21.768 14.843 -0.146 1043 H SER 139 H SER 139 -19.435 16.533 -4.941 1044 HA SER 139 HA SER 139 -17.427 18.392 -3.845 1045 HB2 SER 139 1HB SER 139 -15.922 17.780 -5.554 1046 HB3 SER 139 2HB SER 139 -16.638 16.252 -5.043 1047 HG SER 139 HG SER 139 -17.301 17.794 -7.329 1048 H SER 140 H SER 140 -17.453 20.449 -4.515 1049 HA SER 140 HA SER 140 -19.123 21.134 -6.843 1050 HB2 SER 140 1HB SER 140 -20.083 21.666 -4.483 1051 HB3 SER 140 2HB SER 140 -18.893 22.968 -4.472 1052 HG SER 140 HG SER 140 -19.842 23.724 -6.424 1053 H GLY 141 H GLY 141 -18.594 23.263 -7.798 1054 HA2 GLY 141 1HA GLY 141 -16.141 24.566 -7.174 1055 HA3 GLY 141 2HA GLY 141 -15.934 23.468 -8.530 Start of MODEL 18 1 H1 GLY 1 H GLY 1 -18.300 9.504 -3.521 2 HA2 GLY 1 1HA GLY 1 -20.165 8.711 -1.820 3 HA3 GLY 1 2HA GLY 1 -18.633 7.853 -1.895 4 H SER 2 H SER 2 -20.658 8.641 0.297 5 HA SER 2 HA SER 2 -18.971 10.164 2.106 6 HB2 SER 2 1HB SER 2 -20.860 10.112 3.627 7 HB3 SER 2 2HB SER 2 -21.437 10.534 2.015 8 HG SER 2 HG SER 2 -21.424 7.851 2.864 9 H SER 3 H SER 3 -18.921 9.280 4.451 10 HA SER 3 HA SER 3 -17.180 7.222 4.678 11 HB2 SER 3 1HB SER 3 -17.672 8.574 6.598 12 HB3 SER 3 2HB SER 3 -19.351 8.034 6.620 13 HG SER 3 HG SER 3 -17.677 5.925 6.726 14 H GLY 4 H GLY 4 -17.211 5.015 4.878 15 HA2 GLY 4 1HA GLY 4 -18.821 3.103 5.465 16 HA3 GLY 4 2HA GLY 4 -19.746 3.725 4.106 17 H SER 5 H SER 5 -18.084 1.184 4.786 18 HA SER 5 HA SER 5 -16.051 1.110 2.778 19 HB2 SER 5 1HB SER 5 -17.384 -1.186 4.235 20 HB3 SER 5 2HB SER 5 -15.874 -1.267 3.328 21 HG SER 5 HG SER 5 -15.382 0.612 4.943 22 H SER 6 H SER 6 -16.179 -0.938 1.236 23 HA SER 6 HA SER 6 -18.811 -0.970 -0.075 24 HB2 SER 6 1HB SER 6 -16.151 -0.640 -1.486 25 HB3 SER 6 2HB SER 6 -17.720 -0.806 -2.275 26 HG SER 6 HG SER 6 -16.876 1.403 -1.954 27 H GLY 7 H GLY 7 -15.560 -2.441 -0.215 28 HA2 GLY 7 1HA GLY 7 -16.365 -5.033 0.414 29 HA3 GLY 7 2HA GLY 7 -16.450 -4.884 -1.335 30 H ALA 8 H ALA 8 -14.647 -5.202 -2.482 31 HA ALA 8 HA ALA 8 -12.481 -5.684 -2.988 32 HB1 ALA 8 1HB ALA 8 -11.949 -3.439 -2.506 33 HB2 ALA 8 2HB ALA 8 -12.073 -3.701 -0.766 34 HB3 ALA 8 3HB ALA 8 -10.733 -4.406 -1.671 35 H GLU 9 H GLU 9 -13.698 -7.655 -1.587 36 HA GLU 9 HA GLU 9 -12.733 -8.544 0.801 37 HB2 GLU 9 1HB GLU 9 -13.279 -10.157 -1.694 38 HB3 GLU 9 2HB GLU 9 -13.017 -10.867 -0.107 39 HG2 GLU 9 1HG GLU 9 -14.956 -9.335 0.640 40 HG3 GLU 9 2HG GLU 9 -15.315 -9.226 -1.082 41 H PHE 10 H PHE 10 -11.202 -9.063 -2.369 42 HA PHE 10 HA PHE 10 -9.036 -10.571 -1.656 43 HB2 PHE 10 1HB PHE 10 -9.671 -9.738 -3.973 44 HB3 PHE 10 2HB PHE 10 -8.825 -8.247 -3.570 45 HD1 PHE 10 2HD PHE 10 -8.173 -11.917 -3.317 46 HD2 PHE 10 1HD PHE 10 -6.709 -8.074 -4.412 47 HE1 PHE 10 2HE PHE 10 -6.051 -12.934 -4.035 48 HE2 PHE 10 1HE PHE 10 -4.584 -9.084 -5.133 49 HZ PHE 10 HZ PHE 10 -4.253 -11.517 -4.943 50 H TYR 11 H TYR 11 -9.369 -7.057 -1.388 51 HA TYR 11 HA TYR 11 -6.736 -6.597 -0.436 52 HB2 TYR 11 1HB TYR 11 -9.271 -4.976 -0.389 53 HB3 TYR 11 2HB TYR 11 -7.799 -4.399 0.384 54 HD1 TYR 11 2HD TYR 11 -9.313 -5.337 -2.851 55 HD2 TYR 11 1HD TYR 11 -5.999 -3.516 -0.900 56 HE1 TYR 11 2HE TYR 11 -8.531 -4.457 -5.011 57 HE2 TYR 11 1HE TYR 11 -5.209 -2.630 -3.054 58 HH TYR 11 HH TYR 11 -6.850 -3.437 -6.084 59 H ASP 12 H ASP 12 -9.875 -6.679 1.250 60 HA ASP 12 HA ASP 12 -9.248 -6.215 3.809 61 HB2 ASP 12 1HB ASP 12 -10.983 -8.434 2.724 62 HB3 ASP 12 2HB ASP 12 -10.893 -8.052 4.441 63 H LYS 13 H LYS 13 -8.394 -9.130 2.035 64 HA LYS 13 HA LYS 13 -7.345 -10.527 4.293 65 HB2 LYS 13 1HB LYS 13 -7.251 -10.913 1.325 66 HB3 LYS 13 2HB LYS 13 -6.175 -11.851 2.352 67 HG2 LYS 13 1HG LYS 13 -7.943 -12.953 3.401 68 HG3 LYS 13 2HG LYS 13 -9.126 -11.760 2.861 69 HD2 LYS 13 1HD LYS 13 -9.569 -13.463 1.394 70 HD3 LYS 13 2HD LYS 13 -8.353 -12.572 0.476 71 HE2 LYS 13 1HE LYS 13 -6.670 -14.141 1.673 72 HE3 LYS 13 2HE LYS 13 -8.084 -15.147 1.979 73 HZ1 LYS 13 3HZ LYS 13 -7.125 -14.266 -0.690 74 HZ2 LYS 13 1HZ LYS 13 -8.501 -15.209 -0.406 75 HZ3 LYS 13 2HZ LYS 13 -6.968 -15.821 -0.042 76 H GLN 14 H GLN 14 -5.837 -8.778 1.584 77 HA GLN 14 HA GLN 14 -3.181 -9.124 2.275 78 HB2 GLN 14 1HB GLN 14 -4.462 -6.684 1.033 79 HB3 GLN 14 2HB GLN 14 -2.742 -7.050 1.015 80 HG2 GLN 14 1HG GLN 14 -4.967 -8.475 -0.399 81 HG3 GLN 14 2HG GLN 14 -3.547 -7.690 -1.088 82 HE21 GLN 14 1HE2 GLN 14 -1.979 -8.985 -1.701 83 HE22 GLN 14 2HE2 GLN 14 -1.681 -10.580 -1.108 84 H LEU 15 H LEU 15 -5.598 -7.225 3.818 85 HA LEU 15 HA LEU 15 -4.260 -5.181 5.033 86 HB2 LEU 15 1HB LEU 15 -6.266 -7.007 6.348 87 HB3 LEU 15 2HB LEU 15 -5.828 -5.391 6.897 88 HG LEU 15 HG LEU 15 -7.236 -6.060 4.313 89 HD11 LEU 15 1HD1 LEU 15 -9.125 -4.850 5.400 90 HD12 LEU 15 2HD1 LEU 15 -8.213 -4.886 6.908 91 HD13 LEU 15 3HD1 LEU 15 -8.723 -6.394 6.151 92 HD21 LEU 15 3HD2 LEU 15 -5.808 -3.711 5.198 93 HD22 LEU 15 1HD2 LEU 15 -7.509 -3.354 4.900 94 HD23 LEU 15 2HD2 LEU 15 -6.522 -4.069 3.625 95 H LYS 16 H LYS 16 -4.826 -8.227 6.789 96 HA LYS 16 HA LYS 16 -3.014 -7.880 8.809 97 HB2 LYS 16 1HB LYS 16 -3.080 -10.239 9.165 98 HB3 LYS 16 2HB LYS 16 -4.661 -9.766 8.557 99 HG2 LYS 16 1HG LYS 16 -3.698 -10.424 6.246 100 HG3 LYS 16 2HG LYS 16 -2.494 -11.302 7.192 101 HD2 LYS 16 1HD LYS 16 -4.060 -12.947 6.972 102 HD3 LYS 16 2HD LYS 16 -4.663 -12.178 8.442 103 HE2 LYS 16 1HE LYS 16 -5.607 -11.457 5.674 104 HE3 LYS 16 2HE LYS 16 -6.397 -12.664 6.688 105 HZ1 LYS 16 3HZ LYS 16 -7.517 -10.588 6.950 106 HZ2 LYS 16 1HZ LYS 16 -6.071 -9.775 7.286 107 HZ3 LYS 16 2HZ LYS 16 -6.680 -10.906 8.386 108 H VAL 17 H VAL 17 -2.394 -9.111 5.557 109 HA VAL 17 HA VAL 17 0.256 -9.932 5.918 110 HB VAL 17 HB VAL 17 -0.999 -8.783 3.421 111 HG11 VAL 17 1HG1 VAL 17 0.923 -9.138 2.364 112 HG12 VAL 17 2HG1 VAL 17 1.672 -9.427 3.935 113 HG13 VAL 17 3HG1 VAL 17 1.032 -10.779 3.000 114 HG21 VAL 17 3HG2 VAL 17 -2.332 -10.599 3.795 115 HG22 VAL 17 1HG2 VAL 17 -0.999 -11.389 2.952 116 HG23 VAL 17 2HG2 VAL 17 -1.095 -11.458 4.712 117 H LEU 18 H LEU 18 -1.047 -6.791 4.886 118 HA LEU 18 HA LEU 18 1.433 -5.519 4.507 119 HB2 LEU 18 1HB LEU 18 -1.287 -4.418 5.180 120 HB3 LEU 18 2HB LEU 18 0.106 -3.408 4.797 121 HG LEU 18 HG LEU 18 -1.093 -5.438 2.915 122 HD11 LEU 18 1HD1 LEU 18 -2.640 -3.572 3.454 123 HD12 LEU 18 2HD1 LEU 18 -2.128 -3.605 1.767 124 HD13 LEU 18 3HD1 LEU 18 -1.412 -2.442 2.882 125 HD21 LEU 18 3HD2 LEU 18 0.313 -3.456 1.542 126 HD22 LEU 18 1HD2 LEU 18 0.796 -5.135 1.786 127 HD23 LEU 18 2HD2 LEU 18 1.338 -3.890 2.911 128 H LEU 19 H LEU 19 -0.841 -5.202 7.241 129 HA LEU 19 HA LEU 19 0.797 -3.690 8.897 130 HB2 LEU 19 1HB LEU 19 -1.251 -5.758 9.685 131 HB3 LEU 19 2HB LEU 19 -0.584 -4.524 10.752 132 HG LEU 19 HG LEU 19 -2.050 -3.757 8.252 133 HD11 LEU 19 1HD1 LEU 19 -3.533 -3.833 10.810 134 HD12 LEU 19 2HD1 LEU 19 -3.287 -5.369 9.980 135 HD13 LEU 19 3HD1 LEU 19 -4.106 -4.043 9.156 136 HD21 LEU 19 3HD2 LEU 19 -0.645 -2.283 10.022 137 HD22 LEU 19 1HD2 LEU 19 -2.246 -2.226 10.760 138 HD23 LEU 19 2HD2 LEU 19 -2.020 -1.670 9.101 139 H SER 20 H SER 20 0.360 -7.228 8.889 140 HA SER 20 HA SER 20 2.003 -8.011 10.891 141 HB2 SER 20 1HB SER 20 2.473 -10.061 9.593 142 HB3 SER 20 2HB SER 20 0.775 -9.599 9.490 143 HG SER 20 HG SER 20 2.795 -9.177 7.544 144 H GLY 21 H GLY 21 3.082 -7.282 7.573 145 HA2 GLY 21 1HA GLY 21 5.083 -6.308 6.905 146 HA3 GLY 21 2HA GLY 21 5.604 -6.294 8.583 147 H ALA 22 H ALA 22 6.984 -7.132 6.081 148 HA ALA 22 HA ALA 22 7.785 -9.804 7.014 149 HB1 ALA 22 1HB ALA 22 7.623 -10.780 4.967 150 HB2 ALA 22 2HB ALA 22 6.326 -9.595 4.805 151 HB3 ALA 22 3HB ALA 22 7.910 -9.271 4.099 152 H THR 23 H THR 23 9.959 -10.441 6.194 153 HA THR 23 HA THR 23 11.788 -8.227 6.537 154 HB THR 23 HB THR 23 12.478 -11.125 6.035 155 HG1 THR 23 1HG THR 23 12.614 -11.214 8.356 156 HG21 THR 23 3HG2 THR 23 14.396 -9.764 5.732 157 HG22 THR 23 1HG2 THR 23 14.529 -10.439 7.356 158 HG23 THR 23 2HG2 THR 23 14.002 -8.771 7.135 159 H PHE 24 H PHE 24 13.299 -7.501 5.062 160 HA PHE 24 HA PHE 24 13.374 -8.665 2.399 161 HB2 PHE 24 1HB PHE 24 12.673 -5.749 2.778 162 HB3 PHE 24 2HB PHE 24 12.815 -6.613 1.251 163 HD1 PHE 24 2HD PHE 24 11.096 -8.196 0.553 164 HD2 PHE 24 1HD PHE 24 10.718 -5.948 4.147 165 HE1 PHE 24 2HE PHE 24 8.700 -8.745 0.640 166 HE2 PHE 24 1HE PHE 24 8.321 -6.494 4.240 167 HZ PHE 24 HZ PHE 24 7.308 -7.893 2.485 168 H LEU 25 H LEU 25 15.188 -8.025 1.169 169 HA LEU 25 HA LEU 25 17.387 -7.032 2.810 170 HB2 LEU 25 1HB LEU 25 17.153 -8.631 0.316 171 HB3 LEU 25 2HB LEU 25 18.619 -7.683 0.556 172 HG LEU 25 HG LEU 25 17.582 -9.863 2.367 173 HD11 LEU 25 1HD1 LEU 25 20.234 -10.143 1.210 174 HD12 LEU 25 2HD1 LEU 25 18.959 -10.089 -0.006 175 HD13 LEU 25 3HD1 LEU 25 18.898 -11.294 1.280 176 HD21 LEU 25 3HD2 LEU 25 18.666 -8.538 3.878 177 HD22 LEU 25 1HD2 LEU 25 19.733 -7.832 2.664 178 HD23 LEU 25 2HD2 LEU 25 20.036 -9.463 3.261 179 H VAL 26 H VAL 26 17.615 -4.891 2.824 180 HA VAL 26 HA VAL 26 17.029 -3.348 0.410 181 HB VAL 26 HB VAL 26 17.705 -2.368 3.187 182 HG11 VAL 26 1HG1 VAL 26 17.918 -0.982 0.855 183 HG12 VAL 26 2HG1 VAL 26 16.259 -0.617 1.332 184 HG13 VAL 26 3HG1 VAL 26 17.592 -0.258 2.430 185 HG21 VAL 26 3HG2 VAL 26 15.272 -3.430 2.081 186 HG22 VAL 26 1HG2 VAL 26 15.616 -2.902 3.729 187 HG23 VAL 26 2HG2 VAL 26 15.056 -1.738 2.528 188 H THR 27 H THR 27 18.593 -2.745 -0.923 189 HA THR 27 HA THR 27 21.370 -2.796 0.044 190 HB THR 27 HB THR 27 20.616 -2.701 -2.861 191 HG1 THR 27 1HG THR 27 20.986 -5.147 -2.529 192 HG21 THR 27 3HG2 THR 27 22.980 -2.366 -2.074 193 HG22 THR 27 1HG2 THR 27 22.756 -3.706 -3.197 194 HG23 THR 27 2HG2 THR 27 22.944 -4.023 -1.472 195 H PHE 28 H PHE 28 21.823 -0.789 0.774 196 HA PHE 28 HA PHE 28 20.827 1.582 -0.488 197 HB2 PHE 28 1HB PHE 28 22.769 1.050 1.747 198 HB3 PHE 28 2HB PHE 28 22.547 2.675 1.106 199 HD1 PHE 28 1HD PHE 28 20.929 -0.098 2.889 200 HD2 PHE 28 2HD PHE 28 20.575 3.934 1.572 201 HE1 PHE 28 1HE PHE 28 18.971 0.203 4.348 202 HE2 PHE 28 2HE PHE 28 18.617 4.241 3.029 203 HZ PHE 28 HZ PHE 28 17.812 2.375 4.420 204 H GLY 29 H GLY 29 21.984 3.138 -1.650 205 HA2 GLY 29 1HA GLY 29 23.600 2.382 -3.685 206 HA3 GLY 29 2HA GLY 29 23.679 3.987 -2.974 207 H ASN 30 H ASN 30 24.786 3.541 -0.534 208 HA ASN 30 HA ASN 30 27.527 3.106 -1.220 209 HB2 ASN 30 1HB ASN 30 26.077 3.794 1.322 210 HB3 ASN 30 2HB ASN 30 27.792 3.394 1.347 211 HD21 ASN 30 1HD2 ASN 30 27.033 5.822 2.204 212 HD22 ASN 30 2HD2 ASN 30 27.489 7.042 1.069 213 H SER 31 H SER 31 25.261 1.453 0.976 214 HA SER 31 HA SER 31 27.012 -0.621 1.711 215 HB2 SER 31 1HB SER 31 23.987 -0.701 1.605 216 HB3 SER 31 2HB SER 31 25.027 -1.770 2.545 217 HG SER 31 HG SER 31 24.748 1.037 2.870 218 H GLU 32 H GLU 32 28.024 -1.375 -0.174 219 HA GLU 32 HA GLU 32 26.821 -2.229 -2.513 220 HB2 GLU 32 1HB GLU 32 28.809 -3.567 -2.904 221 HB3 GLU 32 2HB GLU 32 29.259 -2.021 -2.198 222 HG2 GLU 32 1HG GLU 32 28.985 -4.580 -0.641 223 HG3 GLU 32 2HG GLU 32 30.504 -3.956 -1.283 224 H LYS 33 H LYS 33 27.001 -3.807 0.589 225 HA LYS 33 HA LYS 33 25.762 -6.225 -0.527 226 HB2 LYS 33 1HB LYS 33 27.526 -6.964 0.767 227 HB3 LYS 33 2HB LYS 33 27.362 -5.653 1.928 228 HG2 LYS 33 1HG LYS 33 25.724 -6.726 3.121 229 HG3 LYS 33 2HG LYS 33 25.201 -7.694 1.739 230 HD2 LYS 33 1HD LYS 33 27.660 -8.669 1.984 231 HD3 LYS 33 2HD LYS 33 27.427 -8.149 3.654 232 HE2 LYS 33 1HE LYS 33 25.554 -9.553 3.934 233 HE3 LYS 33 2HE LYS 33 25.402 -9.828 2.199 234 HZ1 LYS 33 3HZ LYS 33 26.445 -11.649 3.654 235 HZ2 LYS 33 1HZ LYS 33 27.831 -10.678 3.638 236 HZ3 LYS 33 2HZ LYS 33 27.194 -11.266 2.186 237 HA PRO 34 HA PRO 34 21.838 -4.943 1.047 238 HB2 PRO 34 1HB PRO 34 20.579 -7.343 0.886 239 HB3 PRO 34 2HB PRO 34 20.929 -6.345 -0.530 240 HG2 PRO 34 1HG PRO 34 22.416 -8.717 0.530 241 HG3 PRO 34 2HG PRO 34 22.002 -8.314 -1.147 242 HD2 PRO 34 1HD PRO 34 24.463 -7.871 -0.107 243 HD3 PRO 34 2HD PRO 34 23.751 -6.826 -1.354 244 H GLU 35 H GLU 35 20.815 -4.880 2.992 245 HA GLU 35 HA GLU 35 21.801 -6.718 5.073 246 HB2 GLU 35 1HB GLU 35 22.210 -4.103 5.126 247 HB3 GLU 35 2HB GLU 35 20.573 -4.088 5.768 248 HG2 GLU 35 1HG GLU 35 22.655 -5.875 6.953 249 HG3 GLU 35 2HG GLU 35 22.565 -4.172 7.398 250 H THR 36 H THR 36 20.306 -7.342 6.737 251 HA THR 36 HA THR 36 17.678 -7.883 5.677 252 HB THR 36 HB THR 36 18.785 -8.579 8.403 253 HG1 THR 36 1HG THR 36 18.583 -10.454 6.331 254 HG21 THR 36 3HG2 THR 36 16.629 -9.136 8.741 255 HG22 THR 36 1HG2 THR 36 17.001 -10.524 7.719 256 HG23 THR 36 2HG2 THR 36 16.246 -9.091 7.020 257 H MET 37 H MET 37 16.140 -6.384 5.791 258 HA MET 37 HA MET 37 15.853 -4.876 8.304 259 HB2 MET 37 1HB MET 37 15.517 -3.896 5.471 260 HB3 MET 37 2HB MET 37 14.895 -3.022 6.864 261 HG2 MET 37 1HG MET 37 17.329 -3.172 7.731 262 HG3 MET 37 2HG MET 37 17.723 -3.505 6.046 263 HE1 MET 37 3HE MET 37 17.982 -1.225 8.503 264 HE2 MET 37 1HE MET 37 17.717 0.401 7.873 265 HE3 MET 37 2HE MET 37 16.364 -0.521 8.528 266 H THR 38 H THR 38 13.542 -3.798 8.290 267 HA THR 38 HA THR 38 11.590 -5.814 7.391 268 HB THR 38 HB THR 38 11.538 -4.352 10.039 269 HG1 THR 38 1HG THR 38 13.055 -6.198 9.724 270 HG21 THR 38 3HG2 THR 38 9.569 -5.618 10.545 271 HG22 THR 38 1HG2 THR 38 9.709 -6.537 9.047 272 HG23 THR 38 2HG2 THR 38 9.308 -4.820 8.994 273 H CYS 39 H CYS 39 9.870 -5.041 6.330 274 HA CYS 39 HA CYS 39 9.356 -2.143 6.453 275 HB2 CYS 39 1HB CYS 39 10.415 -2.966 4.301 276 HB3 CYS 39 2HB CYS 39 8.932 -3.868 4.012 277 HG CYS 39 HG CYS 39 9.399 -0.498 3.981 278 H ARG 40 H ARG 40 7.430 -1.687 7.264 279 HA ARG 40 HA ARG 40 5.144 -3.382 6.591 280 HB2 ARG 40 1HB ARG 40 4.400 -3.571 8.866 281 HB3 ARG 40 2HB ARG 40 6.058 -4.151 8.785 282 HG2 ARG 40 1HG ARG 40 6.789 -1.893 9.589 283 HG3 ARG 40 2HG ARG 40 5.086 -1.521 9.866 284 HD2 ARG 40 1HD ARG 40 6.254 -4.014 11.018 285 HD3 ARG 40 2HD ARG 40 6.574 -2.467 11.800 286 HE ARG 40 HE ARG 40 3.790 -2.949 11.257 287 HH11 ARG 40 1HH1 ARG 40 6.399 -3.408 13.516 288 HH12 ARG 40 2HH1 ARG 40 5.354 -3.593 14.886 289 HH21 ARG 40 1HH2 ARG 40 2.404 -3.192 13.053 290 HH22 ARG 40 2HH2 ARG 40 3.082 -3.471 14.621 291 H LEU 41 H LEU 41 3.059 -2.341 7.200 292 HA LEU 41 HA LEU 41 3.268 0.565 6.818 293 HB2 LEU 41 1HB LEU 41 1.327 -1.507 5.966 294 HB3 LEU 41 2HB LEU 41 0.691 0.097 6.322 295 HG LEU 41 HG LEU 41 2.999 -0.161 4.449 296 HD11 LEU 41 1HD1 LEU 41 0.563 -0.138 2.978 297 HD12 LEU 41 2HD1 LEU 41 0.563 -1.535 4.053 298 HD13 LEU 41 3HD1 LEU 41 1.887 -1.301 2.912 299 HD21 LEU 41 3HD2 LEU 41 1.260 1.674 3.456 300 HD22 LEU 41 1HD2 LEU 41 2.588 2.043 4.557 301 HD23 LEU 41 2HD2 LEU 41 0.957 1.812 5.188 302 H SER 42 H SER 42 2.500 1.954 8.294 303 HA SER 42 HA SER 42 1.931 1.136 10.906 304 HB2 SER 42 1HB SER 42 2.719 3.436 10.071 305 HB3 SER 42 2HB SER 42 1.015 3.772 9.764 306 HG SER 42 HG SER 42 1.150 4.408 11.791 307 H ASN 43 H ASN 43 -0.168 2.077 12.026 308 HA ASN 43 HA ASN 43 -2.282 0.415 11.391 309 HB2 ASN 43 1HB ASN 43 -2.254 3.036 12.894 310 HB3 ASN 43 2HB ASN 43 -3.668 1.990 12.807 311 HD21 ASN 43 1HD2 ASN 43 -0.997 2.761 14.578 312 HD22 ASN 43 2HD2 ASN 43 -0.863 1.324 15.528 313 H ASN 44 H ASN 44 -1.884 3.853 10.572 314 HA ASN 44 HA ASN 44 -4.307 4.171 9.205 315 HB2 ASN 44 1HB ASN 44 -3.250 6.144 8.168 316 HB3 ASN 44 2HB ASN 44 -2.945 6.076 9.901 317 HD21 ASN 44 1HD2 ASN 44 -1.160 7.460 9.580 318 HD22 ASN 44 2HD2 ASN 44 0.337 6.852 8.967 319 H GLN 45 H GLN 45 -1.446 2.512 8.327 320 HA GLN 45 HA GLN 45 -0.742 1.475 6.424 321 HB2 GLN 45 1HB GLN 45 -3.728 1.319 6.263 322 HB3 GLN 45 2HB GLN 45 -2.755 0.717 4.928 323 HG2 GLN 45 1HG GLN 45 -1.499 -0.588 6.798 324 HG3 GLN 45 2HG GLN 45 -2.972 -0.297 7.721 325 HE21 GLN 45 1HE2 GLN 45 -1.655 -2.718 6.426 326 HE22 GLN 45 2HE2 GLN 45 -2.945 -3.472 5.560 327 H ARG 46 H ARG 46 -0.570 4.242 6.285 328 HA ARG 46 HA ARG 46 -1.140 4.720 3.434 329 HB2 ARG 46 1HB ARG 46 -1.377 6.600 5.774 330 HB3 ARG 46 2HB ARG 46 -1.196 7.193 4.128 331 HG2 ARG 46 1HG ARG 46 -3.346 5.223 4.759 332 HG3 ARG 46 2HG ARG 46 -3.561 6.926 5.172 333 HD2 ARG 46 1HD ARG 46 -3.109 7.530 2.832 334 HD3 ARG 46 2HD ARG 46 -2.943 5.821 2.434 335 HE ARG 46 HE ARG 46 -5.398 5.915 3.514 336 HH11 ARG 46 1HH1 ARG 46 -3.847 7.847 1.068 337 HH12 ARG 46 2HH1 ARG 46 -5.319 8.190 0.221 338 HH21 ARG 46 1HH2 ARG 46 -7.343 6.360 2.408 339 HH22 ARG 46 2HH2 ARG 46 -7.307 7.345 0.984 340 H TYR 47 H TYR 47 1.113 4.841 6.048 341 HA TYR 47 HA TYR 47 3.165 5.894 4.212 342 HB2 TYR 47 1HB TYR 47 2.819 6.308 7.177 343 HB3 TYR 47 2HB TYR 47 4.358 6.587 6.371 344 HD1 TYR 47 1HD TYR 47 4.613 8.432 4.780 345 HD2 TYR 47 2HD TYR 47 0.959 7.812 6.870 346 HE1 TYR 47 1HE TYR 47 3.887 10.702 4.172 347 HE2 TYR 47 2HE TYR 47 0.223 10.080 6.266 348 HH TYR 47 HH TYR 47 2.345 12.402 4.913 349 H LEU 48 H LEU 48 5.201 4.922 4.240 350 HA LEU 48 HA LEU 48 5.201 2.192 5.299 351 HB2 LEU 48 1HB LEU 48 6.556 3.577 3.051 352 HB3 LEU 48 2HB LEU 48 7.399 2.226 3.806 353 HG LEU 48 HG LEU 48 4.646 2.080 2.577 354 HD11 LEU 48 1HD1 LEU 48 7.344 1.809 1.454 355 HD12 LEU 48 2HD1 LEU 48 5.808 2.149 0.659 356 HD13 LEU 48 3HD1 LEU 48 6.238 0.489 1.071 357 HD21 LEU 48 3HD2 LEU 48 4.926 0.458 4.340 358 HD22 LEU 48 1HD2 LEU 48 6.487 -0.036 3.685 359 HD23 LEU 48 2HD2 LEU 48 5.008 -0.358 2.778 360 H PHE 49 H PHE 49 6.899 1.375 6.536 361 HA PHE 49 HA PHE 49 8.873 3.305 7.528 362 HB2 PHE 49 1HB PHE 49 7.166 1.521 9.278 363 HB3 PHE 49 2HB PHE 49 8.509 2.511 9.842 364 HD1 PHE 49 2HD PHE 49 5.143 2.640 8.322 365 HD2 PHE 49 1HD PHE 49 8.218 4.790 10.331 366 HE1 PHE 49 2HE PHE 49 3.605 4.533 8.643 367 HE2 PHE 49 1HE PHE 49 6.684 6.687 10.656 368 HZ PHE 49 HZ PHE 49 4.375 6.560 9.811 369 H LEU 50 H LEU 50 10.845 2.439 8.110 370 HA LEU 50 HA LEU 50 11.199 -0.423 7.504 371 HB2 LEU 50 1HB LEU 50 13.257 1.761 7.243 372 HB3 LEU 50 2HB LEU 50 13.425 0.080 6.742 373 HG LEU 50 HG LEU 50 11.368 1.892 5.513 374 HD11 LEU 50 1HD1 LEU 50 12.981 3.107 4.592 375 HD12 LEU 50 2HD1 LEU 50 13.485 1.658 3.724 376 HD13 LEU 50 3HD1 LEU 50 14.237 2.067 5.265 377 HD21 LEU 50 3HD2 LEU 50 11.453 0.313 3.701 378 HD22 LEU 50 1HD2 LEU 50 11.191 -0.563 5.209 379 HD23 LEU 50 2HD2 LEU 50 12.789 -0.552 4.463 380 H ASP 51 H ASP 51 12.984 -1.491 8.645 381 HA ASP 51 HA ASP 51 13.860 -0.255 11.127 382 HB2 ASP 51 1HB ASP 51 12.004 -2.614 10.995 383 HB3 ASP 51 2HB ASP 51 13.124 -2.431 12.342 384 H GLY 52 H GLY 52 15.901 -0.806 11.563 385 HA2 GLY 52 1HA GLY 52 17.094 -3.266 11.491 386 HA3 GLY 52 2HA GLY 52 17.268 -2.661 9.849 387 H ASP 53 H ASP 53 19.350 -2.124 9.657 388 HA ASP 53 HA ASP 53 21.243 -1.487 11.422 389 HB2 ASP 53 1HB ASP 53 20.705 -0.382 8.693 390 HB3 ASP 53 2HB ASP 53 22.039 0.277 9.636 391 H SER 54 H SER 54 18.821 0.814 10.243 392 HA SER 54 HA SER 54 19.101 2.359 12.678 393 HB2 SER 54 1HB SER 54 19.796 3.476 9.963 394 HB3 SER 54 2HB SER 54 19.324 4.509 11.312 395 HG SER 54 HG SER 54 21.704 3.378 10.808 396 H HIS 55 H HIS 55 17.516 4.284 12.597 397 HA HIS 55 HA HIS 55 14.942 3.221 11.911 398 HB2 HIS 55 1HB HIS 55 15.698 5.943 12.994 399 HB3 HIS 55 2HB HIS 55 14.064 5.291 12.912 400 HD2 HIS 55 2HD HIS 55 17.293 4.926 15.059 401 HE1 HIS 55 1HE HIS 55 14.199 2.672 16.890 402 HE2 HIS 55 2HE HIS 55 16.516 3.625 17.155 403 H TYR 56 H TYR 56 14.245 3.248 9.878 404 HA TYR 56 HA TYR 56 14.689 5.689 8.287 405 HB2 TYR 56 1HB TYR 56 14.963 2.813 7.575 406 HB3 TYR 56 2HB TYR 56 14.305 3.890 6.347 407 HD1 TYR 56 2HD TYR 56 17.186 3.620 8.707 408 HD2 TYR 56 1HD TYR 56 15.765 5.024 4.950 409 HE1 TYR 56 2HE TYR 56 19.466 4.328 8.116 410 HE2 TYR 56 1HE TYR 56 18.041 5.735 4.348 411 HH TYR 56 HH TYR 56 20.123 6.242 5.293 412 H GLU 57 H GLU 57 13.023 6.199 6.726 413 HA GLU 57 HA GLU 57 10.452 4.886 7.027 414 HB2 GLU 57 1HB GLU 57 10.768 7.823 7.669 415 HB3 GLU 57 2HB GLU 57 9.259 6.922 7.640 416 HG2 GLU 57 1HG GLU 57 9.855 5.675 9.554 417 HG3 GLU 57 2HG GLU 57 11.526 6.230 9.482 418 H ILE 58 H ILE 58 9.542 4.742 5.091 419 HA ILE 58 HA ILE 58 10.403 6.618 2.996 420 HB ILE 58 HB ILE 58 9.187 3.868 2.709 421 HG12 ILE 58 1HG1 ILE 58 11.964 4.671 1.889 422 HG13 ILE 58 2HG1 ILE 58 11.630 4.175 3.544 423 HG21 ILE 58 1HG2 ILE 58 9.173 4.120 0.440 424 HG22 ILE 58 2HG2 ILE 58 8.839 5.782 0.923 425 HG23 ILE 58 3HG2 ILE 58 10.472 5.312 0.452 426 HD11 ILE 58 3HD1 ILE 58 10.889 2.018 2.798 427 HD12 ILE 58 1HD1 ILE 58 11.045 2.507 1.111 428 HD13 ILE 58 2HD1 ILE 58 12.483 2.354 2.121 429 H GLU 59 H GLU 59 8.975 8.277 3.074 430 HA GLU 59 HA GLU 59 6.211 7.996 3.618 431 HB2 GLU 59 1HB GLU 59 7.980 10.183 2.638 432 HB3 GLU 59 2HB GLU 59 6.248 10.360 2.392 433 HG2 GLU 59 1HG GLU 59 5.834 10.201 4.744 434 HG3 GLU 59 2HG GLU 59 7.524 9.811 5.060 435 H ILE 60 H ILE 60 4.890 6.873 2.344 436 HA ILE 60 HA ILE 60 5.231 6.145 -0.278 437 HB ILE 60 HB ILE 60 2.629 6.692 1.152 438 HG12 ILE 60 1HG1 ILE 60 4.223 4.160 0.705 439 HG13 ILE 60 2HG1 ILE 60 3.978 4.986 2.240 440 HG21 ILE 60 1HG2 ILE 60 1.565 6.309 -0.755 441 HG22 ILE 60 2HG2 ILE 60 3.104 6.130 -1.596 442 HG23 ILE 60 3HG2 ILE 60 2.333 4.725 -0.859 443 HD11 ILE 60 3HD1 ILE 60 2.334 3.512 2.531 444 HD12 ILE 60 1HD1 ILE 60 1.418 4.543 1.432 445 HD13 ILE 60 2HD1 ILE 60 2.253 3.118 0.814 446 H VAL 61 H VAL 61 3.518 9.013 0.935 447 HA VAL 61 HA VAL 61 2.542 10.067 -1.399 448 HB VAL 61 HB VAL 61 2.474 12.183 -0.368 449 HG11 VAL 61 1HG1 VAL 61 1.324 11.693 1.535 450 HG12 VAL 61 2HG1 VAL 61 1.459 10.064 0.869 451 HG13 VAL 61 3HG1 VAL 61 2.566 10.595 2.136 452 HG21 VAL 61 3HG2 VAL 61 3.910 12.858 1.482 453 HG22 VAL 61 1HG2 VAL 61 4.714 11.289 1.444 454 HG23 VAL 61 2HG2 VAL 61 4.875 12.395 0.081 455 H HIS 62 H HIS 62 5.849 10.159 -0.201 456 HA HIS 62 HA HIS 62 6.802 11.953 -2.214 457 HB2 HIS 62 1HB HIS 62 8.025 10.298 -0.063 458 HB3 HIS 62 2HB HIS 62 9.067 10.805 -1.389 459 HD2 HIS 62 2HD HIS 62 7.078 12.395 1.582 460 HE1 HIS 62 1HE HIS 62 9.665 15.330 -0.059 461 HE2 HIS 62 2HE HIS 62 8.129 14.743 1.849 462 H ILE 63 H ILE 63 6.703 8.451 -1.822 463 HA ILE 63 HA ILE 63 8.358 7.637 -3.870 464 HB ILE 63 HB ILE 63 5.723 6.354 -3.142 465 HG12 ILE 63 1HG1 ILE 63 8.485 5.938 -1.976 466 HG13 ILE 63 2HG1 ILE 63 7.131 6.715 -1.163 467 HG21 ILE 63 1HG2 ILE 63 7.866 4.567 -3.862 468 HG22 ILE 63 2HG2 ILE 63 6.244 4.706 -4.538 469 HG23 ILE 63 3HG2 ILE 63 7.546 5.722 -5.155 470 HD11 ILE 63 3HD1 ILE 63 7.347 3.832 -1.982 471 HD12 ILE 63 1HD1 ILE 63 7.340 4.486 -0.345 472 HD13 ILE 63 2HD1 ILE 63 5.884 4.576 -1.337 473 H SER 64 H SER 64 8.365 7.983 -5.983 474 HA SER 64 HA SER 64 5.945 8.997 -7.271 475 HB2 SER 64 1HB SER 64 7.939 10.319 -7.638 476 HB3 SER 64 2HB SER 64 8.825 8.901 -8.197 477 HG SER 64 HG SER 64 7.961 10.300 -9.882 478 H THR 65 H THR 65 8.490 6.589 -7.924 479 HA THR 65 HA THR 65 6.622 5.184 -9.703 480 HB THR 65 HB THR 65 9.614 4.831 -9.437 481 HG1 THR 65 1HG THR 65 8.214 6.714 -10.675 482 HG21 THR 65 3HG2 THR 65 9.500 3.387 -11.311 483 HG22 THR 65 1HG2 THR 65 7.815 3.801 -11.622 484 HG23 THR 65 2HG2 THR 65 8.241 2.839 -10.206 485 H VAL 66 H VAL 66 6.171 3.005 -9.445 486 HA VAL 66 HA VAL 66 7.294 1.611 -7.136 487 HB VAL 66 HB VAL 66 4.323 1.985 -7.538 488 HG11 VAL 66 1HG1 VAL 66 5.207 -0.302 -6.744 489 HG12 VAL 66 2HG1 VAL 66 5.596 0.540 -5.242 490 HG13 VAL 66 3HG1 VAL 66 3.928 0.476 -5.812 491 HG21 VAL 66 3HG2 VAL 66 5.570 3.899 -6.516 492 HG22 VAL 66 1HG2 VAL 66 4.337 3.189 -5.474 493 HG23 VAL 66 2HG2 VAL 66 6.040 2.818 -5.204 494 H GLN 67 H GLN 67 8.166 -0.081 -8.174 495 HA GLN 67 HA GLN 67 6.372 -1.737 -9.807 496 HB2 GLN 67 1HB GLN 67 8.086 -2.152 -11.433 497 HB3 GLN 67 2HB GLN 67 7.913 -0.411 -11.260 498 HG2 GLN 67 1HG GLN 67 9.858 -0.744 -9.511 499 HG3 GLN 67 2HG GLN 67 10.159 -2.186 -10.480 500 HE21 GLN 67 1HE2 GLN 67 11.609 -1.893 -11.997 501 HE22 GLN 67 2HE2 GLN 67 11.905 -0.428 -12.864 502 H ILE 68 H ILE 68 7.087 -3.993 -9.993 503 HA ILE 68 HA ILE 68 8.459 -4.845 -7.534 504 HB ILE 68 HB ILE 68 6.484 -6.333 -9.265 505 HG12 ILE 68 1HG1 ILE 68 6.242 -5.455 -6.384 506 HG13 ILE 68 2HG1 ILE 68 5.609 -4.526 -7.739 507 HG21 ILE 68 1HG2 ILE 68 7.711 -8.098 -8.528 508 HG22 ILE 68 2HG2 ILE 68 8.316 -7.231 -7.117 509 HG23 ILE 68 3HG2 ILE 68 6.678 -7.886 -7.115 510 HD11 ILE 68 3HD1 ILE 68 3.877 -5.936 -8.070 511 HD12 ILE 68 1HD1 ILE 68 4.789 -7.358 -7.564 512 HD13 ILE 68 2HD1 ILE 68 4.138 -6.251 -6.355 513 H LEU 69 H LEU 69 10.259 -6.062 -7.623 514 HA LEU 69 HA LEU 69 11.509 -6.449 -10.203 515 HB2 LEU 69 1HB LEU 69 12.451 -7.011 -7.397 516 HB3 LEU 69 2HB LEU 69 13.428 -7.268 -8.841 517 HG LEU 69 HG LEU 69 12.347 -4.590 -7.970 518 HD11 LEU 69 1HD1 LEU 69 13.891 -5.056 -6.315 519 HD12 LEU 69 2HD1 LEU 69 14.876 -4.239 -7.527 520 HD13 LEU 69 3HD1 LEU 69 14.921 -5.996 -7.394 521 HD21 LEU 69 3HD2 LEU 69 13.638 -5.566 -10.369 522 HD22 LEU 69 1HD2 LEU 69 14.567 -4.276 -9.605 523 HD23 LEU 69 2HD2 LEU 69 12.881 -4.005 -10.049 524 H THR 70 H THR 70 11.451 -8.261 -11.347 525 HA THR 70 HA THR 70 10.938 -10.804 -9.957 526 HB THR 70 HB THR 70 9.602 -11.512 -11.982 527 HG1 THR 70 1HG THR 70 10.172 -8.878 -12.644 528 HG21 THR 70 3HG2 THR 70 8.684 -9.395 -10.069 529 HG22 THR 70 1HG2 THR 70 8.302 -11.116 -10.093 530 HG23 THR 70 2HG2 THR 70 7.584 -10.037 -11.288 531 H GLU 71 H GLU 71 12.117 -12.526 -10.637 532 HA GLU 71 HA GLU 71 14.387 -12.010 -12.305 533 HB2 GLU 71 1HB GLU 71 13.384 -14.349 -10.735 534 HB3 GLU 71 2HB GLU 71 14.629 -14.609 -11.949 535 HG2 GLU 71 1HG GLU 71 14.772 -12.873 -9.504 536 HG3 GLU 71 2HG GLU 71 15.723 -14.310 -9.875 537 H GLY 72 H GLY 72 14.994 -13.529 -14.095 538 HA2 GLY 72 1HA GLY 72 14.464 -14.815 -15.978 539 HA3 GLY 72 2HA GLY 72 12.763 -14.700 -15.551 540 H PHE 73 H PHE 73 15.382 -13.279 -17.307 541 HA PHE 73 HA PHE 73 14.286 -10.801 -17.976 542 HB2 PHE 73 1HB PHE 73 16.312 -12.610 -19.202 543 HB3 PHE 73 2HB PHE 73 15.684 -11.296 -20.191 544 HD1 PHE 73 1HD PHE 73 16.050 -8.963 -19.534 545 HD2 PHE 73 2HD PHE 73 17.770 -12.194 -17.362 546 HE1 PHE 73 1HE PHE 73 17.616 -7.400 -18.457 547 HE2 PHE 73 2HE PHE 73 19.338 -10.637 -16.281 548 HZ PHE 73 HZ PHE 73 19.262 -8.236 -16.827 549 HA PRO 74 HA PRO 74 12.362 -12.921 -21.877 550 HB2 PRO 74 1HB PRO 74 12.284 -15.634 -21.891 551 HB3 PRO 74 2HB PRO 74 13.640 -14.709 -22.547 552 HG2 PRO 74 1HG PRO 74 13.377 -16.060 -19.888 553 HG3 PRO 74 2HG PRO 74 14.762 -16.029 -20.996 554 HD2 PRO 74 1HD PRO 74 14.611 -14.442 -18.807 555 HD3 PRO 74 2HD PRO 74 15.434 -13.938 -20.297 556 HA PRO 75 HA PRO 75 8.588 -13.280 -19.534 557 HB2 PRO 75 1HB PRO 75 6.904 -12.905 -21.630 558 HB3 PRO 75 2HB PRO 75 7.789 -11.583 -20.860 559 HG2 PRO 75 1HG PRO 75 8.423 -13.073 -23.377 560 HG3 PRO 75 2HG PRO 75 8.514 -11.332 -23.055 561 HD2 PRO 75 1HD PRO 75 10.697 -12.935 -23.032 562 HD3 PRO 75 2HD PRO 75 10.547 -11.510 -21.983 563 H GLY 76 H GLY 76 6.505 -14.540 -19.762 564 HA2 GLY 76 1HA GLY 76 6.925 -17.065 -21.226 565 HA3 GLY 76 2HA GLY 76 6.481 -17.085 -19.526 566 H GLY 77 H GLY 77 4.458 -15.665 -19.060 567 HA2 GLY 77 1HA GLY 77 2.454 -14.856 -20.515 568 HA3 GLY 77 2HA GLY 77 2.412 -16.553 -20.969 569 H GLY 78 H GLY 78 2.752 -14.727 -17.917 570 HA2 GLY 78 1HA GLY 78 0.670 -14.793 -16.490 571 HA3 GLY 78 2HA GLY 78 0.709 -16.527 -16.772 572 H ASN 79 H ASN 79 3.439 -14.378 -16.105 573 HA ASN 79 HA ASN 79 4.536 -16.131 -14.176 574 HB2 ASN 79 1HB ASN 79 6.294 -14.616 -14.001 575 HB3 ASN 79 2HB ASN 79 5.685 -14.291 -15.621 576 HD21 ASN 79 1HD2 ASN 79 4.186 -12.488 -15.854 577 HD22 ASN 79 2HD2 ASN 79 4.376 -11.111 -14.828 578 H ALA 80 H ALA 80 3.829 -16.471 -12.185 579 HA ALA 80 HA ALA 80 2.492 -14.260 -10.764 580 HB1 ALA 80 1HB ALA 80 1.721 -17.009 -11.180 581 HB2 ALA 80 2HB ALA 80 1.811 -16.624 -9.461 582 HB3 ALA 80 3HB ALA 80 0.785 -15.664 -10.527 583 H ARG 81 H ARG 81 5.321 -14.603 -10.800 584 HA ARG 81 HA ARG 81 5.797 -15.329 -7.984 585 HB2 ARG 81 1HB ARG 81 8.012 -16.078 -8.558 586 HB3 ARG 81 2HB ARG 81 6.857 -16.903 -9.596 587 HG2 ARG 81 1HG ARG 81 7.420 -15.522 -11.452 588 HG3 ARG 81 2HG ARG 81 8.393 -14.458 -10.434 589 HD2 ARG 81 1HD ARG 81 9.951 -15.822 -11.534 590 HD3 ARG 81 2HD ARG 81 9.804 -16.517 -9.920 591 HE ARG 81 HE ARG 81 8.953 -17.707 -12.420 592 HH11 ARG 81 1HH1 ARG 81 8.781 -17.769 -8.943 593 HH12 ARG 81 2HH1 ARG 81 8.281 -19.426 -8.867 594 HH21 ARG 81 1HH2 ARG 81 8.295 -19.889 -12.333 595 HH22 ARG 81 2HH2 ARG 81 8.005 -20.631 -10.796 596 H ALA 82 H ALA 82 7.350 -14.074 -6.844 597 HA ALA 82 HA ALA 82 8.498 -11.730 -8.052 598 HB1 ALA 82 1HB ALA 82 6.438 -10.690 -7.802 599 HB2 ALA 82 2HB ALA 82 6.096 -11.511 -6.278 600 HB3 ALA 82 3HB ALA 82 7.298 -10.223 -6.334 601 H THR 83 H THR 83 10.465 -11.789 -7.197 602 HA THR 83 HA THR 83 10.721 -12.269 -4.300 603 HB THR 83 HB THR 83 11.594 -14.180 -5.601 604 HG1 THR 83 1HG THR 83 13.914 -13.789 -4.726 605 HG21 THR 83 3HG2 THR 83 13.216 -12.017 -6.887 606 HG22 THR 83 1HG2 THR 83 12.351 -13.359 -7.636 607 HG23 THR 83 2HG2 THR 83 13.859 -13.655 -6.770 608 H GLY 84 H GLY 84 10.361 -9.711 -5.302 609 HA2 GLY 84 1HA GLY 84 12.513 -8.322 -4.173 610 HA3 GLY 84 2HA GLY 84 12.741 -8.332 -5.915 611 H MET 85 H MET 85 12.533 -5.921 -4.952 612 HA MET 85 HA MET 85 10.089 -4.936 -6.074 613 HB2 MET 85 1HB MET 85 9.388 -5.540 -3.757 614 HB3 MET 85 2HB MET 85 10.580 -4.404 -3.139 615 HG2 MET 85 1HG MET 85 9.402 -2.559 -3.886 616 HG3 MET 85 2HG MET 85 8.487 -3.496 -5.065 617 HE1 MET 85 3HE MET 85 6.102 -3.393 -4.749 618 HE2 MET 85 1HE MET 85 6.413 -5.096 -4.410 619 HE3 MET 85 2HE MET 85 5.288 -4.187 -3.400 620 H PHE 86 H PHE 86 10.396 -2.957 -6.922 621 HA PHE 86 HA PHE 86 12.790 -1.466 -6.068 622 HB2 PHE 86 1HB PHE 86 12.904 -2.594 -8.355 623 HB3 PHE 86 2HB PHE 86 11.679 -1.440 -8.872 624 HD1 PHE 86 2HD PHE 86 15.131 -1.775 -7.620 625 HD2 PHE 86 1HD PHE 86 12.237 0.793 -9.394 626 HE1 PHE 86 2HE PHE 86 16.893 -0.124 -8.096 627 HE2 PHE 86 1HE PHE 86 13.994 2.447 -9.874 628 HZ PHE 86 HZ PHE 86 16.325 1.990 -9.224 629 H LEU 87 H LEU 87 12.220 0.346 -5.078 630 HA LEU 87 HA LEU 87 9.856 1.803 -6.065 631 HB2 LEU 87 1HB LEU 87 10.952 1.770 -3.257 632 HB3 LEU 87 2HB LEU 87 9.522 2.640 -3.809 633 HG LEU 87 HG LEU 87 9.683 -0.349 -4.002 634 HD11 LEU 87 1HD1 LEU 87 8.227 -0.041 -1.791 635 HD12 LEU 87 2HD1 LEU 87 9.328 1.321 -1.586 636 HD13 LEU 87 3HD1 LEU 87 9.970 -0.312 -1.756 637 HD21 LEU 87 3HD2 LEU 87 7.541 1.739 -4.069 638 HD22 LEU 87 1HD2 LEU 87 7.158 0.081 -3.602 639 HD23 LEU 87 2HD2 LEU 87 7.848 0.412 -5.191 640 H GLN 88 H GLN 88 9.936 4.119 -5.938 641 HA GLN 88 HA GLN 88 12.638 5.249 -5.707 642 HB2 GLN 88 1HB GLN 88 10.685 5.685 -7.967 643 HB3 GLN 88 2HB GLN 88 12.089 6.706 -7.687 644 HG2 GLN 88 1HG GLN 88 13.419 4.491 -7.789 645 HG3 GLN 88 2HG GLN 88 11.973 3.858 -8.575 646 HE21 GLN 88 1HE2 GLN 88 13.835 6.879 -8.739 647 HE22 GLN 88 2HE2 GLN 88 13.985 6.891 -10.460 648 H TYR 89 H TYR 89 12.743 7.089 -4.574 649 HA TYR 89 HA TYR 89 10.382 8.774 -4.291 650 HB2 TYR 89 1HB TYR 89 10.849 8.829 -1.752 651 HB3 TYR 89 2HB TYR 89 9.981 7.444 -2.406 652 HD1 TYR 89 1HD TYR 89 13.262 8.601 -1.156 653 HD2 TYR 89 2HD TYR 89 10.885 5.250 -2.263 654 HE1 TYR 89 1HE TYR 89 14.933 7.094 -0.163 655 HE2 TYR 89 2HE TYR 89 12.549 3.734 -1.272 656 HH TYR 89 HH TYR 89 14.714 4.517 0.854 657 H THR 90 H THR 90 10.908 10.811 -3.093 658 HA THR 90 HA THR 90 13.693 11.606 -3.639 659 HB THR 90 HB THR 90 12.828 13.917 -3.924 660 HG1 THR 90 1HG THR 90 10.472 14.017 -4.279 661 HG21 THR 90 3HG2 THR 90 11.394 12.015 -5.769 662 HG22 THR 90 1HG2 THR 90 13.135 12.282 -5.833 663 HG23 THR 90 2HG2 THR 90 12.026 13.619 -6.140 664 H VAL 91 H VAL 91 14.830 12.706 -2.102 665 HA VAL 91 HA VAL 91 13.587 12.855 0.555 666 HB VAL 91 HB VAL 91 16.484 12.746 -0.282 667 HG11 VAL 91 1HG1 VAL 91 15.291 13.190 2.449 668 HG12 VAL 91 2HG1 VAL 91 16.966 12.713 2.168 669 HG13 VAL 91 3HG1 VAL 91 16.376 14.262 1.565 670 HG21 VAL 91 3HG2 VAL 91 16.490 10.577 0.382 671 HG22 VAL 91 1HG2 VAL 91 15.296 10.849 1.650 672 HG23 VAL 91 2HG2 VAL 91 14.780 10.697 -0.029 673 HA PRO 92 HA PRO 92 13.519 17.273 0.178 674 HB2 PRO 92 1HB PRO 92 12.865 17.802 2.759 675 HB3 PRO 92 2HB PRO 92 11.697 17.201 1.576 676 HG2 PRO 92 1HG PRO 92 13.207 15.699 3.680 677 HG3 PRO 92 2HG PRO 92 11.503 15.557 3.209 678 HD2 PRO 92 1HD PRO 92 13.397 13.813 2.371 679 HD3 PRO 92 2HD PRO 92 11.989 14.242 1.379 680 H GLY 93 H GLY 93 15.394 18.338 -0.007 681 HA2 GLY 93 1HA GLY 93 16.938 19.738 1.337 682 HA3 GLY 93 2HA GLY 93 17.233 18.303 2.308 683 H THR 94 H THR 94 17.314 16.509 0.014 684 HA THR 94 HA THR 94 20.041 17.126 -0.845 685 HB THR 94 HB THR 94 19.491 14.896 0.193 686 HG1 THR 94 1HG THR 94 21.260 15.389 -1.409 687 HG21 THR 94 3HG2 THR 94 18.377 13.223 -1.140 688 HG22 THR 94 1HG2 THR 94 18.180 14.359 -2.474 689 HG23 THR 94 2HG2 THR 94 17.305 14.613 -0.964 690 H GLU 95 H GLU 95 20.607 16.346 -3.114 691 HA GLU 95 HA GLU 95 18.508 17.256 -4.971 692 HB2 GLU 95 1HB GLU 95 21.507 17.523 -5.081 693 HB3 GLU 95 2HB GLU 95 20.492 17.765 -6.496 694 HG2 GLU 95 1HG GLU 95 19.499 19.672 -5.615 695 HG3 GLU 95 2HG GLU 95 19.982 19.276 -3.966 696 H GLY 96 H GLY 96 17.653 15.696 -6.166 697 HA2 GLY 96 1HA GLY 96 18.192 14.107 -7.999 698 HA3 GLY 96 2HA GLY 96 19.373 13.407 -6.902 699 H VAL 97 H VAL 97 17.870 11.555 -7.794 700 HA VAL 97 HA VAL 97 15.668 11.184 -5.869 701 HB VAL 97 HB VAL 97 16.017 9.927 -8.594 702 HG11 VAL 97 1HG1 VAL 97 13.422 9.496 -7.696 703 HG12 VAL 97 2HG1 VAL 97 14.712 8.297 -7.820 704 HG13 VAL 97 3HG1 VAL 97 14.441 9.149 -6.299 705 HG21 VAL 97 3HG2 VAL 97 14.112 11.241 -9.263 706 HG22 VAL 97 1HG2 VAL 97 13.934 11.882 -7.629 707 HG23 VAL 97 2HG2 VAL 97 15.343 12.316 -8.598 708 H THR 98 H THR 98 15.522 9.277 -4.727 709 HA THR 98 HA THR 98 17.916 7.562 -4.827 710 HB THR 98 HB THR 98 16.053 8.035 -2.491 711 HG1 THR 98 1HG THR 98 18.385 8.873 -1.832 712 HG21 THR 98 3HG2 THR 98 17.873 6.868 -1.219 713 HG22 THR 98 1HG2 THR 98 18.590 6.424 -2.768 714 HG23 THR 98 2HG2 THR 98 16.984 5.835 -2.338 715 H GLN 99 H GLN 99 17.697 5.441 -5.217 716 HA GLN 99 HA GLN 99 14.965 4.390 -5.493 717 HB2 GLN 99 1HB GLN 99 17.513 3.303 -6.700 718 HB3 GLN 99 2HB GLN 99 15.873 2.769 -7.047 719 HG2 GLN 99 1HG GLN 99 15.363 4.720 -8.226 720 HG3 GLN 99 2HG GLN 99 16.742 5.590 -7.556 721 HE21 GLN 99 1HE2 GLN 99 15.907 5.089 -10.343 722 HE22 GLN 99 2HE2 GLN 99 17.272 4.356 -11.107 723 H LEU 100 H LEU 100 14.390 2.423 -4.592 724 HA LEU 100 HA LEU 100 16.302 1.313 -2.643 725 HB2 LEU 100 1HB LEU 100 14.271 2.594 -1.762 726 HB3 LEU 100 2HB LEU 100 13.316 1.228 -2.335 727 HG LEU 100 HG LEU 100 14.780 -0.224 -0.842 728 HD11 LEU 100 1HD1 LEU 100 16.605 0.908 -0.138 729 HD12 LEU 100 2HD1 LEU 100 15.518 1.378 1.169 730 HD13 LEU 100 3HD1 LEU 100 15.793 2.473 -0.186 731 HD21 LEU 100 3HD2 LEU 100 12.596 0.057 -0.114 732 HD22 LEU 100 1HD2 LEU 100 12.793 1.792 0.133 733 HD23 LEU 100 2HD2 LEU 100 13.540 0.652 1.252 734 H LYS 101 H LYS 101 16.705 -0.810 -2.744 735 HA LYS 101 HA LYS 101 15.030 -2.436 -4.544 736 HB2 LYS 101 1HB LYS 101 17.346 -2.029 -5.355 737 HB3 LYS 101 2HB LYS 101 17.962 -2.815 -3.907 738 HG2 LYS 101 1HG LYS 101 17.207 -4.913 -4.576 739 HG3 LYS 101 2HG LYS 101 16.079 -4.235 -5.752 740 HD2 LYS 101 1HD LYS 101 18.002 -3.448 -7.090 741 HD3 LYS 101 2HD LYS 101 19.092 -4.223 -5.938 742 HE2 LYS 101 1HE LYS 101 16.925 -5.756 -7.341 743 HE3 LYS 101 2HE LYS 101 18.503 -5.498 -8.083 744 HZ1 LYS 101 3HZ LYS 101 18.075 -6.770 -5.435 745 HZ2 LYS 101 1HZ LYS 101 19.549 -6.611 -6.249 746 HZ3 LYS 101 2HZ LYS 101 18.342 -7.615 -6.876 747 H LEU 102 H LEU 102 14.130 -4.245 -3.759 748 HA LEU 102 HA LEU 102 14.989 -5.165 -1.095 749 HB2 LEU 102 1HB LEU 102 12.193 -5.181 -2.221 750 HB3 LEU 102 2HB LEU 102 12.676 -5.778 -0.635 751 HG LEU 102 HG LEU 102 12.889 -2.898 -1.504 752 HD11 LEU 102 1HD1 LEU 102 10.591 -3.282 -1.436 753 HD12 LEU 102 2HD1 LEU 102 10.966 -2.669 0.174 754 HD13 LEU 102 3HD1 LEU 102 10.722 -4.398 -0.075 755 HD21 LEU 102 3HD2 LEU 102 14.326 -4.022 0.409 756 HD22 LEU 102 1HD2 LEU 102 12.836 -3.800 1.326 757 HD23 LEU 102 2HD2 LEU 102 13.636 -2.409 0.595 758 H THR 103 H THR 103 15.047 -7.371 -0.720 759 HA THR 103 HA THR 103 14.341 -9.174 -2.908 760 HB THR 103 HB THR 103 17.095 -9.165 -1.657 761 HG1 THR 103 1HG THR 103 17.783 -8.267 -3.521 762 HG21 THR 103 3HG2 THR 103 16.764 -11.384 -2.171 763 HG22 THR 103 1HG2 THR 103 17.398 -10.788 -3.705 764 HG23 THR 103 2HG2 THR 103 15.662 -11.023 -3.500 765 H VAL 104 H VAL 104 13.532 -11.067 -2.213 766 HA VAL 104 HA VAL 104 13.034 -11.444 0.568 767 HB VAL 104 HB VAL 104 12.595 -13.347 -1.738 768 HG11 VAL 104 1HG1 VAL 104 11.732 -13.421 1.139 769 HG12 VAL 104 2HG1 VAL 104 10.881 -14.315 -0.122 770 HG13 VAL 104 3HG1 VAL 104 12.578 -14.660 0.213 771 HG21 VAL 104 3HG2 VAL 104 11.225 -10.955 -0.894 772 HG22 VAL 104 1HG2 VAL 104 10.957 -11.959 -2.320 773 HG23 VAL 104 2HG2 VAL 104 10.159 -12.356 -0.798 774 H VAL 105 H VAL 105 14.060 -12.673 2.036 775 HA VAL 105 HA VAL 105 16.436 -14.156 1.130 776 HB VAL 105 HB VAL 105 16.835 -12.272 2.710 777 HG11 VAL 105 1HG1 VAL 105 14.645 -13.421 4.069 778 HG12 VAL 105 2HG1 VAL 105 16.050 -13.577 5.124 779 HG13 VAL 105 3HG1 VAL 105 15.575 -11.991 4.515 780 HG21 VAL 105 3HG2 VAL 105 18.450 -14.046 2.591 781 HG22 VAL 105 1HG2 VAL 105 18.251 -13.581 4.280 782 HG23 VAL 105 2HG2 VAL 105 17.491 -15.053 3.676 783 H GLU 106 H GLU 106 16.942 -16.170 2.150 784 HA GLU 106 HA GLU 106 14.547 -17.579 3.124 785 HB2 GLU 106 1HB GLU 106 15.447 -19.604 2.200 786 HB3 GLU 106 2HB GLU 106 15.502 -18.364 0.955 787 HG2 GLU 106 1HG GLU 106 17.859 -18.049 1.299 788 HG3 GLU 106 2HG GLU 106 17.843 -19.158 2.669 789 H ASP 107 H ASP 107 14.572 -18.496 5.083 790 HA ASP 107 HA ASP 107 17.037 -19.244 6.382 791 HB2 ASP 107 1HB ASP 107 15.449 -16.851 7.250 792 HB3 ASP 107 2HB ASP 107 16.311 -17.816 8.445 793 H VAL 108 H VAL 108 16.559 -20.100 8.647 794 HA VAL 108 HA VAL 108 14.846 -22.219 8.575 795 HB VAL 108 HB VAL 108 14.890 -22.240 11.047 796 HG11 VAL 108 1HG1 VAL 108 17.196 -22.145 9.287 797 HG12 VAL 108 2HG1 VAL 108 17.609 -21.753 10.958 798 HG13 VAL 108 3HG1 VAL 108 16.807 -23.278 10.581 799 HG21 VAL 108 3HG2 VAL 108 14.693 -19.804 11.377 800 HG22 VAL 108 1HG2 VAL 108 16.042 -20.499 12.276 801 HG23 VAL 108 2HG2 VAL 108 16.343 -19.608 10.784 802 H THR 109 H THR 109 14.108 -18.928 9.607 803 HA THR 109 HA THR 109 11.458 -19.533 10.495 804 HB THR 109 HB THR 109 12.473 -16.809 9.685 805 HG1 THR 109 1HG THR 109 13.924 -17.814 11.185 806 HG21 THR 109 3HG2 THR 109 10.917 -16.480 11.882 807 HG22 THR 109 1HG2 THR 109 10.132 -17.866 11.126 808 HG23 THR 109 2HG2 THR 109 10.326 -16.362 10.225 809 H VAL 110 H VAL 110 9.487 -18.925 9.505 810 HA VAL 110 HA VAL 110 9.518 -19.224 6.625 811 HB VAL 110 HB VAL 110 7.869 -20.459 7.967 812 HG11 VAL 110 1HG1 VAL 110 7.584 -18.081 9.347 813 HG12 VAL 110 2HG1 VAL 110 6.074 -18.229 8.445 814 HG13 VAL 110 3HG1 VAL 110 6.585 -19.522 9.530 815 HG21 VAL 110 3HG2 VAL 110 6.053 -18.692 6.509 816 HG22 VAL 110 1HG2 VAL 110 7.466 -19.191 5.578 817 HG23 VAL 110 2HG2 VAL 110 6.397 -20.406 6.278 818 H GLY 111 H GLY 111 9.436 -17.604 5.216 819 HA2 GLY 111 1HA GLY 111 8.139 -15.090 6.001 820 HA3 GLY 111 2HA GLY 111 9.801 -15.034 5.433 821 H ARG 112 H ARG 112 9.607 -17.001 3.412 822 HA ARG 112 HA ARG 112 9.114 -15.669 1.155 823 HB2 ARG 112 1HB ARG 112 9.845 -18.093 1.404 824 HB3 ARG 112 2HB ARG 112 8.136 -18.506 1.449 825 HG2 ARG 112 1HG ARG 112 8.824 -18.846 -0.771 826 HG3 ARG 112 2HG ARG 112 7.925 -17.328 -0.777 827 HD2 ARG 112 1HD ARG 112 9.866 -16.975 -2.092 828 HD3 ARG 112 2HD ARG 112 10.135 -16.146 -0.560 829 HE ARG 112 HE ARG 112 11.300 -18.490 -0.082 830 HH11 ARG 112 1HH1 ARG 112 11.490 -16.383 -2.846 831 HH12 ARG 112 2HH1 ARG 112 13.107 -16.852 -3.256 832 HH21 ARG 112 1HH2 ARG 112 13.429 -19.115 -0.610 833 HH22 ARG 112 2HH2 ARG 112 14.209 -18.406 -1.983 834 H ARG 113 H ARG 113 6.587 -17.468 2.904 835 HA ARG 113 HA ARG 113 4.455 -16.852 1.215 836 HB2 ARG 113 1HB ARG 113 4.633 -17.547 4.131 837 HB3 ARG 113 2HB ARG 113 3.085 -17.142 3.403 838 HG2 ARG 113 1HG ARG 113 4.812 -19.227 2.148 839 HG3 ARG 113 2HG ARG 113 3.838 -19.620 3.566 840 HD2 ARG 113 1HD ARG 113 2.562 -20.178 1.627 841 HD3 ARG 113 2HD ARG 113 1.846 -18.736 2.347 842 HE ARG 113 HE ARG 113 2.455 -17.529 0.484 843 HH11 ARG 113 1HH1 ARG 113 3.979 -20.658 0.418 844 HH12 ARG 113 2HH1 ARG 113 4.529 -20.501 -1.218 845 HH21 ARG 113 1HH2 ARG 113 3.174 -17.310 -1.670 846 HH22 ARG 113 2HH2 ARG 113 4.071 -18.595 -2.404 847 H GLN 114 H GLN 114 5.372 -15.239 4.263 848 HA GLN 114 HA GLN 114 3.499 -13.169 4.104 849 HB2 GLN 114 1HB GLN 114 5.116 -13.918 6.034 850 HB3 GLN 114 2HB GLN 114 6.184 -12.706 5.340 851 HG2 GLN 114 1HG GLN 114 4.844 -11.839 7.202 852 HG3 GLN 114 2HG GLN 114 4.539 -10.986 5.689 853 HE21 GLN 114 1HE2 GLN 114 2.542 -11.083 4.761 854 HE22 GLN 114 2HE2 GLN 114 1.173 -11.814 5.519 855 H ALA 115 H ALA 115 6.991 -12.979 3.384 856 HA ALA 115 HA ALA 115 7.122 -10.452 2.356 857 HB1 ALA 115 1HB ALA 115 8.761 -12.018 0.682 858 HB2 ALA 115 2HB ALA 115 9.227 -11.108 2.119 859 HB3 ALA 115 3HB ALA 115 8.746 -12.799 2.263 860 H VAL 116 H VAL 116 6.868 -13.325 0.252 861 HA VAL 116 HA VAL 116 6.350 -12.125 -2.132 862 HB VAL 116 HB VAL 116 5.027 -14.637 -1.098 863 HG11 VAL 116 1HG1 VAL 116 5.534 -14.441 -3.961 864 HG12 VAL 116 2HG1 VAL 116 4.086 -14.964 -3.099 865 HG13 VAL 116 3HG1 VAL 116 4.375 -13.246 -3.377 866 HG21 VAL 116 3HG2 VAL 116 6.929 -15.750 -1.513 867 HG22 VAL 116 1HG2 VAL 116 7.234 -14.857 -3.003 868 HG23 VAL 116 2HG2 VAL 116 7.698 -14.164 -1.449 869 H ALA 117 H ALA 117 3.929 -12.947 0.337 870 HA ALA 117 HA ALA 117 1.689 -11.996 -1.080 871 HB1 ALA 117 1HB ALA 117 0.544 -12.019 1.087 872 HB2 ALA 117 2HB ALA 117 1.473 -13.495 0.822 873 HB3 ALA 117 3HB ALA 117 2.094 -12.244 1.899 874 H TRP 118 H TRP 118 3.981 -10.412 1.067 875 HA TRP 118 HA TRP 118 2.531 -7.981 1.326 876 HB2 TRP 118 1HB TRP 118 4.412 -8.833 2.829 877 HB3 TRP 118 2HB TRP 118 5.523 -8.272 1.582 878 HD1 TRP 118 HD TRP 118 3.252 -7.012 4.356 879 HE1 TRP 118 1HE TRP 118 3.675 -4.497 4.708 880 HE3 TRP 118 3HE TRP 118 6.246 -6.117 0.310 881 HZ2 TRP 118 2HZ TRP 118 5.089 -2.411 3.438 882 HZ3 TRP 118 3HZ TRP 118 7.091 -3.835 -0.050 883 HH2 TRP 118 HH TRP 118 6.523 -2.021 1.482 884 H LEU 119 H LEU 119 5.213 -8.999 -0.766 885 HA LEU 119 HA LEU 119 5.723 -6.621 -2.071 886 HB2 LEU 119 1HB LEU 119 5.736 -9.400 -3.237 887 HB3 LEU 119 2HB LEU 119 6.514 -7.990 -3.953 888 HG LEU 119 HG LEU 119 7.267 -9.025 -1.232 889 HD11 LEU 119 1HD1 LEU 119 9.125 -9.683 -3.347 890 HD12 LEU 119 2HD1 LEU 119 7.562 -10.463 -3.585 891 HD13 LEU 119 3HD1 LEU 119 8.448 -10.706 -2.079 892 HD21 LEU 119 3HD2 LEU 119 8.111 -6.863 -2.976 893 HD22 LEU 119 1HD2 LEU 119 9.451 -7.903 -2.493 894 HD23 LEU 119 2HD2 LEU 119 8.445 -7.133 -1.265 895 H VAL 120 H VAL 120 3.371 -9.131 -2.981 896 HA VAL 120 HA VAL 120 2.341 -7.684 -5.204 897 HB VAL 120 HB VAL 120 2.141 -10.140 -4.990 898 HG11 VAL 120 1HG1 VAL 120 1.656 -10.215 -2.582 899 HG12 VAL 120 2HG1 VAL 120 0.064 -9.520 -2.892 900 HG13 VAL 120 3HG1 VAL 120 0.469 -11.116 -3.524 901 HG21 VAL 120 3HG2 VAL 120 0.483 -9.965 -6.459 902 HG22 VAL 120 1HG2 VAL 120 -0.668 -9.635 -5.165 903 HG23 VAL 120 2HG2 VAL 120 0.213 -8.308 -5.921 904 H ALA 121 H ALA 121 1.225 -8.156 -1.869 905 HA ALA 121 HA ALA 121 -1.207 -6.838 -2.008 906 HB1 ALA 121 1HB ALA 121 -1.068 -7.740 0.042 907 HB2 ALA 121 2HB ALA 121 0.684 -7.548 0.118 908 HB3 ALA 121 3HB ALA 121 -0.370 -6.184 0.492 909 H MET 122 H MET 122 2.001 -5.479 -1.293 910 HA MET 122 HA MET 122 1.208 -2.839 -0.860 911 HB2 MET 122 1HB MET 122 3.500 -3.908 -0.474 912 HB3 MET 122 2HB MET 122 3.804 -3.610 -2.180 913 HG2 MET 122 1HG MET 122 4.772 -1.835 -0.928 914 HG3 MET 122 2HG MET 122 3.366 -1.203 -1.781 915 HE1 MET 122 3HE MET 122 4.043 0.868 0.850 916 HE2 MET 122 1HE MET 122 3.225 0.735 -0.707 917 HE3 MET 122 2HE MET 122 2.286 0.995 0.763 918 H HIS 123 H HIS 123 2.420 -4.331 -3.863 919 HA HIS 123 HA HIS 123 2.257 -2.172 -5.553 920 HB2 HIS 123 1HB HIS 123 3.210 -4.250 -6.311 921 HB3 HIS 123 2HB HIS 123 1.669 -5.081 -6.125 922 HD2 HIS 123 2HD HIS 123 3.508 -2.791 -8.664 923 HE1 HIS 123 1HE HIS 123 -0.228 -3.900 -10.342 924 HE2 HIS 123 2HE HIS 123 2.023 -2.858 -10.781 925 H LYS 124 H LYS 124 -0.319 -4.574 -4.990 926 HA LYS 124 HA LYS 124 -2.291 -3.420 -6.555 927 HB2 LYS 124 1HB LYS 124 -2.278 -5.222 -4.190 928 HB3 LYS 124 2HB LYS 124 -3.808 -4.465 -4.613 929 HG2 LYS 124 1HG LYS 124 -3.667 -6.630 -5.645 930 HG3 LYS 124 2HG LYS 124 -3.601 -5.382 -6.892 931 HD2 LYS 124 1HD LYS 124 -1.040 -5.607 -6.663 932 HD3 LYS 124 2HD LYS 124 -1.398 -7.133 -5.852 933 HE2 LYS 124 1HE LYS 124 -2.635 -7.892 -7.815 934 HE3 LYS 124 2HE LYS 124 -2.313 -6.357 -8.621 935 HZ1 LYS 124 3HZ LYS 124 0.048 -6.853 -8.550 936 HZ2 LYS 124 1HZ LYS 124 -0.791 -8.084 -9.353 937 HZ3 LYS 124 2HZ LYS 124 -0.255 -8.321 -7.767 938 H ALA 125 H ALA 125 -1.488 -2.782 -3.161 939 HA ALA 125 HA ALA 125 -3.574 -0.947 -2.674 940 HB1 ALA 125 1HB ALA 125 -1.140 -1.825 -1.304 941 HB2 ALA 125 2HB ALA 125 -1.616 -0.164 -0.949 942 HB3 ALA 125 3HB ALA 125 -2.747 -1.486 -0.662 943 H ALA 126 H ALA 126 -0.098 -0.227 -3.055 944 HA ALA 126 HA ALA 126 -0.045 2.437 -3.206 945 HB1 ALA 126 1HB ALA 126 1.897 0.943 -3.592 946 HB2 ALA 126 2HB ALA 126 1.345 0.714 -5.251 947 HB3 ALA 126 3HB ALA 126 1.835 2.315 -4.698 948 H LYS 127 H LYS 127 -1.143 0.338 -5.839 949 HA LYS 127 HA LYS 127 -1.510 2.201 -7.842 950 HB2 LYS 127 1HB LYS 127 -2.875 -0.361 -7.132 951 HB3 LYS 127 2HB LYS 127 -3.564 0.638 -8.405 952 HG2 LYS 127 1HG LYS 127 -0.663 -0.029 -8.500 953 HG3 LYS 127 2HG LYS 127 -1.849 -1.251 -8.964 954 HD2 LYS 127 1HD LYS 127 -2.539 -0.075 -10.808 955 HD3 LYS 127 2HD LYS 127 -2.113 1.487 -10.105 956 HE2 LYS 127 1HE LYS 127 -0.471 1.256 -11.696 957 HE3 LYS 127 2HE LYS 127 0.328 0.564 -10.286 958 HZ1 LYS 127 3HZ LYS 127 -0.457 -1.647 -11.098 959 HZ2 LYS 127 1HZ LYS 127 0.688 -0.898 -12.093 960 HZ3 LYS 127 2HZ LYS 127 -0.945 -0.894 -12.531 961 H LEU 128 H LEU 128 -3.957 1.153 -5.465 962 HA LEU 128 HA LEU 128 -5.973 2.913 -6.202 963 HB2 LEU 128 1HB LEU 128 -5.272 1.451 -3.714 964 HB3 LEU 128 2HB LEU 128 -6.486 2.724 -3.605 965 HG LEU 128 HG LEU 128 -6.680 0.392 -5.504 966 HD11 LEU 128 1HD1 LEU 128 -6.654 -0.378 -3.167 967 HD12 LEU 128 2HD1 LEU 128 -8.223 -0.613 -3.937 968 HD13 LEU 128 3HD1 LEU 128 -7.986 0.719 -2.807 969 HD21 LEU 128 3HD2 LEU 128 -8.954 1.061 -5.773 970 HD22 LEU 128 1HD2 LEU 128 -7.946 2.486 -6.027 971 HD23 LEU 128 2HD2 LEU 128 -8.808 2.276 -4.502 972 H LEU 129 H LEU 129 -3.436 3.349 -3.747 973 HA LEU 129 HA LEU 129 -4.068 5.750 -2.666 974 HB2 LEU 129 1HB LEU 129 -1.492 4.464 -3.379 975 HB3 LEU 129 2HB LEU 129 -1.450 6.163 -2.912 976 HG LEU 129 HG LEU 129 -2.556 3.925 -1.217 977 HD11 LEU 129 1HD1 LEU 129 0.143 5.049 -1.537 978 HD12 LEU 129 2HD1 LEU 129 -0.372 3.475 -0.930 979 HD13 LEU 129 3HD1 LEU 129 -0.422 4.887 0.126 980 HD21 LEU 129 3HD2 LEU 129 -2.075 5.977 0.460 981 HD22 LEU 129 1HD2 LEU 129 -3.639 5.677 -0.299 982 HD23 LEU 129 2HD2 LEU 129 -2.535 6.865 -0.993 983 H TYR 130 H TYR 130 -2.041 5.435 -5.587 984 HA TYR 130 HA TYR 130 -2.325 8.230 -6.200 985 HB2 TYR 130 1HB TYR 130 -1.280 6.210 -8.153 986 HB3 TYR 130 2HB TYR 130 -0.776 7.877 -7.903 987 HD1 TYR 130 2HD TYR 130 -0.382 7.835 -4.937 988 HD2 TYR 130 1HD TYR 130 0.743 5.040 -7.941 989 HE1 TYR 130 2HE TYR 130 1.472 7.064 -3.517 990 HE2 TYR 130 1HE TYR 130 2.600 4.260 -6.529 991 HH TYR 130 HH TYR 130 3.976 5.079 -4.681 992 H GLU 131 H GLU 131 -3.146 5.294 -8.059 993 HA GLU 131 HA GLU 131 -4.774 6.589 -9.931 994 HB2 GLU 131 1HB GLU 131 -4.996 3.723 -8.997 995 HB3 GLU 131 2HB GLU 131 -5.598 4.375 -10.514 996 HG2 GLU 131 1HG GLU 131 -3.144 5.015 -10.958 997 HG3 GLU 131 2HG GLU 131 -2.775 3.868 -9.672 998 H SER 132 H SER 132 -7.190 5.740 -10.163 999 HA SER 132 HA SER 132 -8.579 6.855 -7.874 1000 HB2 SER 132 1HB SER 132 -9.177 7.524 -10.194 1001 HB3 SER 132 2HB SER 132 -9.705 5.870 -10.507 1002 HG SER 132 HG SER 132 -10.753 7.404 -8.376 1003 H ARG 133 H ARG 133 -10.686 5.778 -7.217 1004 HA ARG 133 HA ARG 133 -10.079 3.051 -6.455 1005 HB2 ARG 133 1HB ARG 133 -12.310 4.948 -5.726 1006 HB3 ARG 133 2HB ARG 133 -12.253 3.283 -5.163 1007 HG2 ARG 133 1HG ARG 133 -11.290 4.355 -3.395 1008 HG3 ARG 133 2HG ARG 133 -9.856 3.972 -4.350 1009 HD2 ARG 133 1HD ARG 133 -9.487 6.189 -3.887 1010 HD3 ARG 133 2HD ARG 133 -10.328 6.309 -5.432 1011 HE ARG 133 HE ARG 133 -11.395 6.998 -2.802 1012 HH11 ARG 133 1HH1 ARG 133 -11.876 6.694 -6.237 1013 HH12 ARG 133 2HH1 ARG 133 -13.299 7.682 -6.257 1014 HH21 ARG 133 1HH2 ARG 133 -13.267 8.301 -2.816 1015 HH22 ARG 133 2HH2 ARG 133 -14.089 8.597 -4.311 1016 H ASP 134 H ASP 134 -11.265 1.235 -6.981 1017 HA ASP 134 HA ASP 134 -13.094 1.551 -9.268 1018 HB2 ASP 134 1HB ASP 134 -12.484 -0.958 -9.598 1019 HB3 ASP 134 2HB ASP 134 -11.322 0.276 -10.080 1020 H GLN 135 H GLN 135 -15.161 1.189 -8.852 1021 HA GLN 135 HA GLN 135 -15.935 -0.201 -6.422 1022 HB2 GLN 135 1HB GLN 135 -18.179 0.593 -6.899 1023 HB3 GLN 135 2HB GLN 135 -17.033 1.920 -7.037 1024 HG2 GLN 135 1HG GLN 135 -17.031 1.527 -9.514 1025 HG3 GLN 135 2HG GLN 135 -18.369 0.407 -9.263 1026 HE21 GLN 135 1HE2 GLN 135 -17.585 3.510 -10.024 1027 HE22 GLN 135 2HE2 GLN 135 -19.075 4.289 -9.627 1028 H SER 136 H SER 136 -14.718 -1.900 -8.239 1029 HA SER 136 HA SER 136 -16.096 -3.256 -10.115 1030 HB2 SER 136 1HB SER 136 -14.366 -4.348 -7.897 1031 HB3 SER 136 2HB SER 136 -15.002 -5.374 -9.184 1032 HG SER 136 HG SER 136 -13.018 -4.680 -9.856 1033 H GLY 137 H GLY 137 -16.358 -3.976 -6.627 1034 HA2 GLY 137 1HA GLY 137 -18.643 -4.193 -5.721 1035 HA3 GLY 137 2HA GLY 137 -19.043 -5.079 -7.185 1036 HA PRO 138 HA PRO 138 -17.185 -7.784 -3.644 1037 HB2 PRO 138 1HB PRO 138 -19.379 -8.318 -2.136 1038 HB3 PRO 138 2HB PRO 138 -18.282 -6.975 -1.794 1039 HG2 PRO 138 1HG PRO 138 -20.921 -6.952 -3.207 1040 HG3 PRO 138 2HG PRO 138 -20.288 -5.817 -2.000 1041 HD2 PRO 138 1HD PRO 138 -20.270 -5.282 -4.655 1042 HD3 PRO 138 2HD PRO 138 -19.015 -4.683 -3.551 1043 H SER 139 H SER 139 -20.156 -7.811 -5.483 1044 HA SER 139 HA SER 139 -19.729 -10.650 -6.063 1045 HB2 SER 139 1HB SER 139 -21.976 -11.269 -5.657 1046 HB3 SER 139 2HB SER 139 -21.518 -10.299 -4.258 1047 HG SER 139 HG SER 139 -23.149 -9.086 -4.753 1048 H SER 140 H SER 140 -21.381 -11.308 -7.875 1049 HA SER 140 HA SER 140 -20.894 -9.485 -10.062 1050 HB2 SER 140 1HB SER 140 -20.616 -11.976 -10.253 1051 HB3 SER 140 2HB SER 140 -22.368 -12.127 -10.127 1052 HG SER 140 HG SER 140 -20.983 -10.646 -12.115 1053 H GLY 141 H GLY 141 -22.347 -8.229 -11.098 1054 HA2 GLY 141 1HA GLY 141 -24.916 -8.324 -11.622 1055 HA3 GLY 141 2HA GLY 141 -25.008 -8.030 -9.892 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -20.302 0.895 1.819 2 HA2 GLY 1 1HA GLY 1 -22.767 1.410 1.095 3 HA3 GLY 1 2HA GLY 1 -22.009 2.448 2.294 4 H SER 2 H SER 2 -20.908 4.392 1.497 5 HA SER 2 HA SER 2 -22.271 5.448 -0.890 6 HB2 SER 2 1HB SER 2 -21.932 7.692 0.138 7 HB3 SER 2 2HB SER 2 -22.931 6.628 1.128 8 HG SER 2 HG SER 2 -20.202 7.296 1.500 9 H SER 3 H SER 3 -21.097 6.185 -2.553 10 HA SER 3 HA SER 3 -19.263 6.383 -3.908 11 HB2 SER 3 1HB SER 3 -18.352 7.978 -1.502 12 HB3 SER 3 2HB SER 3 -17.609 8.056 -3.099 13 HG SER 3 HG SER 3 -19.043 9.569 -3.402 14 H GLY 4 H GLY 4 -19.207 3.931 -2.763 15 HA2 GLY 4 1HA GLY 4 -16.337 3.455 -2.574 16 HA3 GLY 4 2HA GLY 4 -17.299 2.955 -1.191 17 H SER 5 H SER 5 -17.035 0.775 -1.363 18 HA SER 5 HA SER 5 -18.400 -0.493 -3.620 19 HB2 SER 5 1HB SER 5 -15.916 -0.471 -4.058 20 HB3 SER 5 2HB SER 5 -15.719 -1.477 -2.623 21 HG SER 5 HG SER 5 -16.985 -2.096 -5.065 22 H SER 6 H SER 6 -19.415 -2.421 -3.134 23 HA SER 6 HA SER 6 -19.627 -3.009 -0.269 24 HB2 SER 6 1HB SER 6 -21.717 -4.197 -0.892 25 HB3 SER 6 2HB SER 6 -21.735 -2.503 -1.383 26 HG SER 6 HG SER 6 -21.934 -3.134 -3.369 27 H GLY 7 H GLY 7 -18.920 -4.867 0.583 28 HA2 GLY 7 1HA GLY 7 -18.155 -7.038 0.733 29 HA3 GLY 7 2HA GLY 7 -18.721 -7.298 -0.910 30 H ALA 8 H ALA 8 -16.073 -5.957 1.006 31 HA ALA 8 HA ALA 8 -14.273 -6.526 -1.258 32 HB1 ALA 8 1HB ALA 8 -13.761 -4.337 0.734 33 HB2 ALA 8 2HB ALA 8 -13.007 -4.595 -0.840 34 HB3 ALA 8 3HB ALA 8 -14.686 -4.063 -0.743 35 H GLU 9 H GLU 9 -13.874 -8.605 -0.355 36 HA GLU 9 HA GLU 9 -12.375 -8.593 2.176 37 HB2 GLU 9 1HB GLU 9 -13.927 -10.741 0.749 38 HB3 GLU 9 2HB GLU 9 -12.757 -11.133 2.001 39 HG2 GLU 9 1HG GLU 9 -14.809 -11.074 3.102 40 HG3 GLU 9 2HG GLU 9 -14.050 -9.531 3.492 41 H PHE 10 H PHE 10 -12.290 -9.667 -1.180 42 HA PHE 10 HA PHE 10 -9.894 -11.097 -1.125 43 HB2 PHE 10 1HB PHE 10 -11.687 -10.686 -3.033 44 HB3 PHE 10 2HB PHE 10 -10.549 -9.432 -3.515 45 HD1 PHE 10 1HD PHE 10 -7.988 -10.345 -3.420 46 HD2 PHE 10 2HD PHE 10 -11.477 -12.678 -4.128 47 HE1 PHE 10 1HE PHE 10 -6.621 -12.030 -4.580 48 HE2 PHE 10 2HE PHE 10 -10.115 -14.368 -5.288 49 HZ PHE 10 HZ PHE 10 -7.684 -14.046 -5.515 50 H TYR 11 H TYR 11 -10.501 -7.644 -1.470 51 HA TYR 11 HA TYR 11 -7.724 -7.020 -1.923 52 HB2 TYR 11 1HB TYR 11 -9.919 -5.722 -2.650 53 HB3 TYR 11 2HB TYR 11 -9.694 -4.937 -1.091 54 HD1 TYR 11 1HD TYR 11 -6.909 -4.503 -0.792 55 HD2 TYR 11 2HD TYR 11 -9.220 -4.349 -4.362 56 HE1 TYR 11 1HE TYR 11 -5.253 -2.984 -1.791 57 HE2 TYR 11 2HE TYR 11 -7.570 -2.830 -5.371 58 HH TYR 11 HH TYR 11 -4.856 -1.567 -3.510 59 H ASP 12 H ASP 12 -10.045 -6.417 0.712 60 HA ASP 12 HA ASP 12 -8.363 -5.193 2.520 61 HB2 ASP 12 1HB ASP 12 -10.788 -6.919 2.810 62 HB3 ASP 12 2HB ASP 12 -9.882 -6.477 4.255 63 H LYS 13 H LYS 13 -8.870 -8.663 2.009 64 HA LYS 13 HA LYS 13 -7.505 -9.816 4.034 65 HB2 LYS 13 1HB LYS 13 -7.626 -10.485 1.116 66 HB3 LYS 13 2HB LYS 13 -6.616 -11.446 2.188 67 HG2 LYS 13 1HG LYS 13 -9.499 -10.948 2.822 68 HG3 LYS 13 2HG LYS 13 -9.011 -12.236 1.718 69 HD2 LYS 13 1HD LYS 13 -7.613 -13.215 3.459 70 HD3 LYS 13 2HD LYS 13 -8.051 -11.908 4.562 71 HE2 LYS 13 1HE LYS 13 -10.441 -12.620 4.304 72 HE3 LYS 13 2HE LYS 13 -9.862 -14.023 3.407 73 HZ1 LYS 13 3HZ LYS 13 -9.503 -13.378 6.261 74 HZ2 LYS 13 1HZ LYS 13 -8.418 -14.414 5.478 75 HZ3 LYS 13 2HZ LYS 13 -10.060 -14.811 5.554 76 H GLN 14 H GLN 14 -6.120 -7.983 1.398 77 HA GLN 14 HA GLN 14 -3.411 -8.724 1.904 78 HB2 GLN 14 1HB GLN 14 -4.634 -6.426 0.376 79 HB3 GLN 14 2HB GLN 14 -2.901 -6.714 0.466 80 HG2 GLN 14 1HG GLN 14 -3.062 -8.725 -0.732 81 HG3 GLN 14 2HG GLN 14 -4.810 -8.804 -0.522 82 HE21 GLN 14 1HE2 GLN 14 -4.451 -9.165 -2.929 83 HE22 GLN 14 2HE2 GLN 14 -4.533 -7.758 -3.930 84 H LEU 15 H LEU 15 -5.295 -5.784 2.607 85 HA LEU 15 HA LEU 15 -3.555 -4.151 3.807 86 HB2 LEU 15 1HB LEU 15 -6.221 -4.913 4.989 87 HB3 LEU 15 2HB LEU 15 -5.315 -3.447 5.358 88 HG LEU 15 HG LEU 15 -6.662 -4.169 2.760 89 HD11 LEU 15 1HD1 LEU 15 -7.308 -1.596 3.771 90 HD12 LEU 15 2HD1 LEU 15 -7.498 -2.766 5.077 91 HD13 LEU 15 3HD1 LEU 15 -8.362 -2.995 3.556 92 HD21 LEU 15 3HD2 LEU 15 -4.460 -2.311 3.334 93 HD22 LEU 15 1HD2 LEU 15 -5.814 -1.615 2.443 94 HD23 LEU 15 2HD2 LEU 15 -4.974 -3.031 1.808 95 H LYS 16 H LYS 16 -5.327 -6.492 5.831 96 HA LYS 16 HA LYS 16 -3.909 -6.307 8.136 97 HB2 LYS 16 1HB LYS 16 -4.473 -8.698 8.549 98 HB3 LYS 16 2HB LYS 16 -5.837 -7.742 7.984 99 HG2 LYS 16 1HG LYS 16 -5.376 -8.618 5.682 100 HG3 LYS 16 2HG LYS 16 -4.203 -9.716 6.412 101 HD2 LYS 16 1HD LYS 16 -6.253 -10.288 7.982 102 HD3 LYS 16 2HD LYS 16 -7.173 -9.706 6.593 103 HE2 LYS 16 1HE LYS 16 -6.947 -12.038 6.296 104 HE3 LYS 16 2HE LYS 16 -5.802 -11.293 5.182 105 HZ1 LYS 16 3HZ LYS 16 -4.078 -12.206 6.237 106 HZ2 LYS 16 1HZ LYS 16 -5.207 -13.247 6.945 107 HZ3 LYS 16 2HZ LYS 16 -4.693 -11.866 7.776 108 H VAL 17 H VAL 17 -3.020 -8.246 5.306 109 HA VAL 17 HA VAL 17 -0.720 -9.434 6.422 110 HB VAL 17 HB VAL 17 -1.323 -8.832 3.522 111 HG11 VAL 17 1HG1 VAL 17 0.634 -9.731 2.976 112 HG12 VAL 17 2HG1 VAL 17 1.069 -9.702 4.686 113 HG13 VAL 17 3HG1 VAL 17 0.326 -11.142 3.987 114 HG21 VAL 17 3HG2 VAL 17 -2.576 -10.703 3.427 115 HG22 VAL 17 1HG2 VAL 17 -1.551 -11.573 4.569 116 HG23 VAL 17 2HG2 VAL 17 -2.761 -10.434 5.160 117 H LEU 18 H LEU 18 -1.134 -6.523 4.427 118 HA LEU 18 HA LEU 18 1.512 -5.805 4.097 119 HB2 LEU 18 1HB LEU 18 -0.918 -4.070 4.483 120 HB3 LEU 18 2HB LEU 18 0.658 -3.450 3.993 121 HG LEU 18 HG LEU 18 -0.883 -5.499 2.410 122 HD11 LEU 18 1HD1 LEU 18 -1.809 -3.820 1.095 123 HD12 LEU 18 2HD1 LEU 18 -0.714 -2.589 1.722 124 HD13 LEU 18 3HD1 LEU 18 -2.012 -3.214 2.739 125 HD21 LEU 18 3HD2 LEU 18 0.621 -4.720 0.598 126 HD22 LEU 18 1HD2 LEU 18 1.474 -5.495 1.933 127 HD23 LEU 18 2HD2 LEU 18 1.483 -3.738 1.784 128 H LEU 19 H LEU 19 -0.665 -4.581 6.647 129 HA LEU 19 HA LEU 19 1.169 -3.153 8.119 130 HB2 LEU 19 1HB LEU 19 -1.095 -4.810 9.222 131 HB3 LEU 19 2HB LEU 19 -0.299 -3.465 10.035 132 HG LEU 19 HG LEU 19 -1.776 -3.113 7.440 133 HD11 LEU 19 1HD1 LEU 19 -2.925 -2.699 10.192 134 HD12 LEU 19 2HD1 LEU 19 -3.254 -4.113 9.191 135 HD13 LEU 19 3HD1 LEU 19 -3.743 -2.510 8.641 136 HD21 LEU 19 3HD2 LEU 19 -1.812 -0.807 8.045 137 HD22 LEU 19 1HD2 LEU 19 -0.154 -1.379 8.232 138 HD23 LEU 19 2HD2 LEU 19 -1.175 -1.158 9.653 139 H SER 20 H SER 20 0.373 -6.601 8.412 140 HA SER 20 HA SER 20 1.732 -7.430 10.568 141 HB2 SER 20 1HB SER 20 2.063 -8.814 7.900 142 HB3 SER 20 2HB SER 20 2.098 -9.551 9.502 143 HG SER 20 HG SER 20 0.078 -9.901 8.663 144 H GLY 21 H GLY 21 3.274 -6.835 7.410 145 HA2 GLY 21 1HA GLY 21 5.392 -5.924 7.038 146 HA3 GLY 21 2HA GLY 21 5.715 -6.029 8.762 147 H ALA 22 H ALA 22 7.142 -6.928 6.200 148 HA ALA 22 HA ALA 22 7.760 -9.636 7.174 149 HB1 ALA 22 1HB ALA 22 6.453 -9.222 4.845 150 HB2 ALA 22 2HB ALA 22 8.127 -9.187 4.290 151 HB3 ALA 22 3HB ALA 22 7.514 -10.597 5.153 152 H THR 23 H THR 23 9.923 -10.406 6.402 153 HA THR 23 HA THR 23 11.873 -8.319 6.868 154 HB THR 23 HB THR 23 12.415 -11.241 6.330 155 HG1 THR 23 1HG THR 23 11.782 -11.642 8.311 156 HG21 THR 23 3HG2 THR 23 14.329 -9.648 6.191 157 HG22 THR 23 1HG2 THR 23 14.497 -10.848 7.471 158 HG23 THR 23 2HG2 THR 23 14.019 -9.198 7.867 159 H PHE 24 H PHE 24 13.560 -7.750 5.483 160 HA PHE 24 HA PHE 24 13.775 -8.879 2.850 161 HB2 PHE 24 1HB PHE 24 12.784 -6.034 3.139 162 HB3 PHE 24 2HB PHE 24 13.245 -6.811 1.628 163 HD1 PHE 24 2HD PHE 24 11.972 -9.086 1.155 164 HD2 PHE 24 1HD PHE 24 10.561 -5.970 3.687 165 HE1 PHE 24 2HE PHE 24 9.669 -9.905 0.874 166 HE2 PHE 24 1HE PHE 24 8.256 -6.784 3.411 167 HZ PHE 24 HZ PHE 24 7.807 -8.754 2.002 168 H LEU 25 H LEU 25 15.381 -7.518 1.509 169 HA LEU 25 HA LEU 25 17.512 -6.613 3.326 170 HB2 LEU 25 1HB LEU 25 17.625 -7.894 0.607 171 HB3 LEU 25 2HB LEU 25 19.023 -7.146 1.375 172 HG LEU 25 HG LEU 25 17.486 -9.454 2.558 173 HD11 LEU 25 1HD1 LEU 25 20.196 -9.834 1.442 174 HD12 LEU 25 2HD1 LEU 25 18.873 -9.682 0.287 175 HD13 LEU 25 3HD1 LEU 25 18.829 -10.946 1.516 176 HD21 LEU 25 3HD2 LEU 25 20.086 -8.103 3.251 177 HD22 LEU 25 1HD2 LEU 25 19.607 -9.678 3.884 178 HD23 LEU 25 2HD2 LEU 25 18.639 -8.250 4.251 179 H VAL 26 H VAL 26 17.748 -4.485 3.374 180 HA VAL 26 HA VAL 26 17.002 -2.896 1.027 181 HB VAL 26 HB VAL 26 17.577 -2.036 3.865 182 HG11 VAL 26 1HG1 VAL 26 17.110 -0.512 1.357 183 HG12 VAL 26 2HG1 VAL 26 16.394 0.100 2.850 184 HG13 VAL 26 3HG1 VAL 26 18.140 -0.132 2.738 185 HG21 VAL 26 3HG2 VAL 26 15.051 -2.485 2.311 186 HG22 VAL 26 1HG2 VAL 26 15.502 -3.108 3.898 187 HG23 VAL 26 2HG2 VAL 26 15.095 -1.403 3.702 188 H THR 27 H THR 27 18.547 -2.298 -0.327 189 HA THR 27 HA THR 27 21.319 -2.172 0.626 190 HB THR 27 HB THR 27 20.507 -2.001 -2.263 191 HG1 THR 27 1HG THR 27 19.643 -3.930 -1.889 192 HG21 THR 27 3HG2 THR 27 22.756 -3.326 -2.347 193 HG22 THR 27 1HG2 THR 27 22.983 -2.673 -0.725 194 HG23 THR 27 2HG2 THR 27 22.776 -1.581 -2.094 195 H PHE 28 H PHE 28 21.661 -0.177 1.447 196 HA PHE 28 HA PHE 28 20.588 2.181 0.165 197 HB2 PHE 28 1HB PHE 28 22.242 1.689 2.626 198 HB3 PHE 28 2HB PHE 28 22.034 3.319 1.994 199 HD1 PHE 28 2HD PHE 28 19.415 3.759 1.330 200 HD2 PHE 28 1HD PHE 28 20.867 1.154 4.367 201 HE1 PHE 28 2HE PHE 28 17.265 3.943 2.512 202 HE2 PHE 28 1HE PHE 28 18.719 1.333 5.553 203 HZ PHE 28 HZ PHE 28 16.915 2.730 4.626 204 H GLY 29 H GLY 29 21.740 3.770 -0.903 205 HA2 GLY 29 1HA GLY 29 23.746 3.095 -2.627 206 HA3 GLY 29 2HA GLY 29 23.481 4.737 -2.062 207 H ASN 30 H ASN 30 24.121 4.226 0.690 208 HA ASN 30 HA ASN 30 26.960 4.504 0.527 209 HB2 ASN 30 1HB ASN 30 25.827 5.805 2.180 210 HB3 ASN 30 2HB ASN 30 25.044 4.380 2.857 211 HD21 ASN 30 1HD2 ASN 30 25.991 3.373 4.498 212 HD22 ASN 30 2HD2 ASN 30 27.592 3.680 5.069 213 H SER 31 H SER 31 24.838 2.109 2.096 214 HA SER 31 HA SER 31 27.004 0.370 2.764 215 HB2 SER 31 1HB SER 31 24.042 -0.249 2.660 216 HB3 SER 31 2HB SER 31 25.278 -1.184 3.501 217 HG SER 31 HG SER 31 24.052 0.319 4.832 218 H GLU 32 H GLU 32 28.074 -0.876 1.394 219 HA GLU 32 HA GLU 32 27.036 -1.436 -1.237 220 HB2 GLU 32 1HB GLU 32 29.212 -2.567 -1.589 221 HB3 GLU 32 2HB GLU 32 29.386 -0.915 -1.014 222 HG2 GLU 32 1HG GLU 32 30.172 -1.561 1.039 223 HG3 GLU 32 2HG GLU 32 29.384 -3.136 0.965 224 H LYS 33 H LYS 33 26.667 -2.858 1.742 225 HA LYS 33 HA LYS 33 26.090 -5.477 0.518 226 HB2 LYS 33 1HB LYS 33 27.788 -6.103 1.920 227 HB3 LYS 33 2HB LYS 33 27.497 -4.778 3.040 228 HG2 LYS 33 1HG LYS 33 25.897 -5.931 4.209 229 HG3 LYS 33 2HG LYS 33 25.484 -6.963 2.837 230 HD2 LYS 33 1HD LYS 33 26.690 -8.161 4.645 231 HD3 LYS 33 2HD LYS 33 27.530 -8.208 3.093 232 HE2 LYS 33 1HE LYS 33 28.834 -6.183 3.933 233 HE3 LYS 33 2HE LYS 33 28.179 -6.564 5.524 234 HZ1 LYS 33 3HZ LYS 33 29.558 -8.639 3.951 235 HZ2 LYS 33 1HZ LYS 33 29.346 -8.536 5.626 236 HZ3 LYS 33 2HZ LYS 33 30.453 -7.520 4.850 237 HA PRO 34 HA PRO 34 21.936 -4.785 1.834 238 HB2 PRO 34 1HB PRO 34 21.045 -7.344 1.662 239 HB3 PRO 34 2HB PRO 34 21.343 -6.333 0.243 240 HG2 PRO 34 1HG PRO 34 23.078 -8.446 1.461 241 HG3 PRO 34 2HG PRO 34 22.724 -8.138 -0.249 242 HD2 PRO 34 1HD PRO 34 25.022 -7.327 0.931 243 HD3 PRO 34 2HD PRO 34 24.253 -6.420 -0.387 244 H GLU 35 H GLU 35 20.801 -4.818 3.713 245 HA GLU 35 HA GLU 35 21.779 -6.586 5.858 246 HB2 GLU 35 1HB GLU 35 22.494 -4.261 6.229 247 HB3 GLU 35 2HB GLU 35 20.821 -3.731 6.134 248 HG2 GLU 35 1HG GLU 35 21.244 -3.816 8.409 249 HG3 GLU 35 2HG GLU 35 20.402 -5.331 8.087 250 H THR 36 H THR 36 20.273 -7.539 7.172 251 HA THR 36 HA THR 36 17.673 -7.919 6.124 252 HB THR 36 HB THR 36 18.611 -8.589 8.918 253 HG1 THR 36 1HG THR 36 20.016 -9.637 7.595 254 HG21 THR 36 3HG2 THR 36 16.710 -9.760 9.178 255 HG22 THR 36 1HG2 THR 36 16.752 -10.374 7.526 256 HG23 THR 36 2HG2 THR 36 16.095 -8.770 7.855 257 H MET 37 H MET 37 16.248 -6.288 6.084 258 HA MET 37 HA MET 37 15.771 -4.831 8.601 259 HB2 MET 37 1HB MET 37 15.782 -3.828 5.764 260 HB3 MET 37 2HB MET 37 14.923 -2.971 7.037 261 HG2 MET 37 1HG MET 37 17.072 -2.862 8.302 262 HG3 MET 37 2HG MET 37 17.872 -3.528 6.881 263 HE1 MET 37 3HE MET 37 15.855 -0.935 8.479 264 HE2 MET 37 1HE MET 37 17.238 0.159 8.423 265 HE3 MET 37 2HE MET 37 15.826 0.471 7.413 266 H THR 38 H THR 38 13.562 -4.059 8.896 267 HA THR 38 HA THR 38 11.625 -5.927 7.706 268 HB THR 38 HB THR 38 11.309 -4.336 10.257 269 HG1 THR 38 1HG THR 38 12.347 -5.901 11.231 270 HG21 THR 38 3HG2 THR 38 9.200 -5.050 10.237 271 HG22 THR 38 1HG2 THR 38 9.753 -6.721 10.144 272 HG23 THR 38 2HG2 THR 38 9.474 -5.802 8.665 273 H CYS 39 H CYS 39 10.245 -5.135 6.271 274 HA CYS 39 HA CYS 39 9.703 -2.242 6.285 275 HB2 CYS 39 1HB CYS 39 9.359 -4.169 3.980 276 HB3 CYS 39 2HB CYS 39 9.237 -2.414 3.920 277 HG CYS 39 HG CYS 39 12.185 -3.504 5.058 278 H ARG 40 H ARG 40 7.729 -1.582 6.803 279 HA ARG 40 HA ARG 40 5.429 -3.299 6.268 280 HB2 ARG 40 1HB ARG 40 4.575 -3.204 8.492 281 HB3 ARG 40 2HB ARG 40 6.240 -3.755 8.607 282 HG2 ARG 40 1HG ARG 40 6.894 -1.399 9.136 283 HG3 ARG 40 2HG ARG 40 5.174 -1.014 9.227 284 HD2 ARG 40 1HD ARG 40 4.861 -2.249 11.143 285 HD3 ARG 40 2HD ARG 40 6.228 -3.310 10.808 286 HE ARG 40 HE ARG 40 7.298 -0.808 11.243 287 HH11 ARG 40 1HH1 ARG 40 5.372 -3.090 13.031 288 HH12 ARG 40 2HH1 ARG 40 5.988 -2.599 14.574 289 HH21 ARG 40 1HH2 ARG 40 8.117 -0.152 13.268 290 HH22 ARG 40 2HH2 ARG 40 7.549 -0.927 14.708 291 H LEU 41 H LEU 41 3.346 -2.102 6.740 292 HA LEU 41 HA LEU 41 3.662 0.679 5.854 293 HB2 LEU 41 1HB LEU 41 1.600 -1.417 5.448 294 HB3 LEU 41 2HB LEU 41 1.062 0.261 5.493 295 HG LEU 41 HG LEU 41 3.266 -0.600 3.650 296 HD11 LEU 41 1HD1 LEU 41 0.325 -1.027 3.350 297 HD12 LEU 41 2HD1 LEU 41 1.665 -2.090 2.918 298 HD13 LEU 41 3HD1 LEU 41 1.317 -0.666 1.936 299 HD21 LEU 41 3HD2 LEU 41 1.903 1.302 2.366 300 HD22 LEU 41 1HD2 LEU 41 3.196 1.662 3.511 301 HD23 LEU 41 2HD2 LEU 41 1.511 1.755 4.026 302 H SER 42 H SER 42 2.624 2.369 6.883 303 HA SER 42 HA SER 42 2.375 2.257 9.653 304 HB2 SER 42 1HB SER 42 2.697 4.324 8.218 305 HB3 SER 42 2HB SER 42 0.965 4.268 7.892 306 HG SER 42 HG SER 42 1.616 5.630 9.694 307 H ASN 43 H ASN 43 0.262 3.073 10.774 308 HA ASN 43 HA ASN 43 -1.545 1.038 10.934 309 HB2 ASN 43 1HB ASN 43 -1.261 3.273 12.320 310 HB3 ASN 43 2HB ASN 43 -2.587 3.815 11.295 311 HD21 ASN 43 1HD2 ASN 43 -3.276 3.859 13.747 312 HD22 ASN 43 2HD2 ASN 43 -4.215 2.493 14.233 313 H ASN 44 H ASN 44 -2.004 4.030 9.051 314 HA ASN 44 HA ASN 44 -4.245 2.780 7.651 315 HB2 ASN 44 1HB ASN 44 -4.196 5.208 8.632 316 HB3 ASN 44 2HB ASN 44 -3.326 5.589 7.150 317 HD21 ASN 44 1HD2 ASN 44 -6.351 4.726 8.552 318 HD22 ASN 44 2HD2 ASN 44 -7.311 4.921 7.129 319 H GLN 45 H GLN 45 -1.082 2.613 7.306 320 HA GLN 45 HA GLN 45 0.332 2.120 5.595 321 HB2 GLN 45 1HB GLN 45 -1.993 2.030 3.701 322 HB3 GLN 45 2HB GLN 45 -0.528 1.058 3.698 323 HG2 GLN 45 1HG GLN 45 -1.297 -0.353 5.350 324 HG3 GLN 45 2HG GLN 45 -2.455 0.827 5.963 325 HE21 GLN 45 1HE2 GLN 45 -1.921 -0.234 2.641 326 HE22 GLN 45 2HE2 GLN 45 -3.500 -0.893 2.407 327 H ARG 46 H ARG 46 0.031 4.794 6.190 328 HA ARG 46 HA ARG 46 -0.128 6.169 3.607 329 HB2 ARG 46 1HB ARG 46 -0.093 7.182 6.449 330 HB3 ARG 46 2HB ARG 46 0.021 8.244 5.053 331 HG2 ARG 46 1HG ARG 46 -2.156 7.512 4.281 332 HG3 ARG 46 2HG ARG 46 -2.266 6.371 5.623 333 HD2 ARG 46 1HD ARG 46 -1.999 8.382 7.153 334 HD3 ARG 46 2HD ARG 46 -2.280 9.376 5.723 335 HE ARG 46 HE ARG 46 -4.312 7.407 6.069 336 HH11 ARG 46 1HH1 ARG 46 -3.212 10.520 7.173 337 HH12 ARG 46 2HH1 ARG 46 -4.789 11.053 7.653 338 HH21 ARG 46 1HH2 ARG 46 -6.394 8.096 6.697 339 HH22 ARG 46 2HH2 ARG 46 -6.598 9.673 7.383 340 H TYR 47 H TYR 47 2.138 4.805 5.664 341 HA TYR 47 HA TYR 47 4.315 5.994 4.179 342 HB2 TYR 47 1HB TYR 47 4.205 6.285 7.188 343 HB3 TYR 47 2HB TYR 47 5.551 6.749 6.154 344 HD1 TYR 47 2HD TYR 47 1.921 7.435 6.676 345 HD2 TYR 47 1HD TYR 47 5.684 8.930 5.368 346 HE1 TYR 47 2HE TYR 47 0.932 9.670 6.403 347 HE2 TYR 47 1HE TYR 47 4.705 11.169 5.093 348 HH TYR 47 HH TYR 47 1.626 11.809 4.815 349 H LEU 48 H LEU 48 6.369 4.913 4.579 350 HA LEU 48 HA LEU 48 5.954 2.149 5.495 351 HB2 LEU 48 1HB LEU 48 7.856 3.338 3.492 352 HB3 LEU 48 2HB LEU 48 8.025 1.696 4.109 353 HG LEU 48 HG LEU 48 5.603 2.712 2.625 354 HD11 LEU 48 1HD1 LEU 48 7.415 0.760 1.368 355 HD12 LEU 48 2HD1 LEU 48 8.024 2.410 1.488 356 HD13 LEU 48 3HD1 LEU 48 6.503 2.091 0.657 357 HD21 LEU 48 3HD2 LEU 48 5.232 0.814 4.166 358 HD22 LEU 48 1HD2 LEU 48 6.474 -0.095 3.304 359 HD23 LEU 48 2HD2 LEU 48 4.994 0.383 2.472 360 H PHE 49 H PHE 49 7.256 1.254 7.017 361 HA PHE 49 HA PHE 49 9.309 3.009 8.196 362 HB2 PHE 49 1HB PHE 49 7.675 0.901 9.620 363 HB3 PHE 49 2HB PHE 49 8.821 2.015 10.357 364 HD1 PHE 49 1HD PHE 49 7.909 4.415 8.614 365 HD2 PHE 49 2HD PHE 49 5.833 1.568 11.001 366 HE1 PHE 49 1HE PHE 49 6.098 6.041 8.972 367 HE2 PHE 49 2HE PHE 49 4.018 3.189 11.362 368 HZ PHE 49 HZ PHE 49 4.149 5.429 10.347 369 H LEU 50 H LEU 50 11.297 2.170 8.661 370 HA LEU 50 HA LEU 50 11.751 -0.651 7.941 371 HB2 LEU 50 1HB LEU 50 13.739 1.560 7.499 372 HB3 LEU 50 2HB LEU 50 13.806 -0.096 6.899 373 HG LEU 50 HG LEU 50 11.728 1.896 6.013 374 HD11 LEU 50 1HD1 LEU 50 13.520 1.473 3.931 375 HD12 LEU 50 2HD1 LEU 50 14.532 1.756 5.346 376 HD13 LEU 50 3HD1 LEU 50 13.320 2.948 4.877 377 HD21 LEU 50 3HD2 LEU 50 10.865 -0.077 5.320 378 HD22 LEU 50 1HD2 LEU 50 12.426 -0.898 5.353 379 HD23 LEU 50 2HD2 LEU 50 12.011 0.153 3.999 380 H ASP 51 H ASP 51 13.108 -1.826 9.230 381 HA ASP 51 HA ASP 51 14.213 -0.440 11.585 382 HB2 ASP 51 1HB ASP 51 12.589 -1.676 12.625 383 HB3 ASP 51 2HB ASP 51 12.576 -2.913 11.372 384 H GLY 52 H GLY 52 16.314 -0.761 12.016 385 HA2 GLY 52 1HA GLY 52 17.887 -2.941 11.805 386 HA3 GLY 52 2HA GLY 52 17.866 -2.343 10.152 387 H ASP 53 H ASP 53 19.778 -1.425 9.792 388 HA ASP 53 HA ASP 53 21.683 -0.503 11.412 389 HB2 ASP 53 1HB ASP 53 20.749 0.857 8.878 390 HB3 ASP 53 2HB ASP 53 22.286 1.188 9.672 391 H SER 54 H SER 54 18.888 1.452 10.414 392 HA SER 54 HA SER 54 18.948 2.891 12.911 393 HB2 SER 54 1HB SER 54 19.883 4.134 10.363 394 HB3 SER 54 2HB SER 54 18.915 5.119 11.460 395 HG SER 54 HG SER 54 20.580 4.098 13.058 396 H HIS 55 H HIS 55 17.217 4.743 12.770 397 HA HIS 55 HA HIS 55 14.764 3.475 12.044 398 HB2 HIS 55 1HB HIS 55 15.437 6.194 13.159 399 HB3 HIS 55 2HB HIS 55 13.785 5.728 12.763 400 HD2 HIS 55 2HD HIS 55 15.780 5.893 15.811 401 HE1 HIS 55 1HE HIS 55 13.456 2.383 16.341 402 HE2 HIS 55 2HE HIS 55 14.848 4.148 17.477 403 H TYR 56 H TYR 56 14.861 3.191 9.796 404 HA TYR 56 HA TYR 56 14.871 5.631 8.166 405 HB2 TYR 56 1HB TYR 56 15.517 2.770 7.630 406 HB3 TYR 56 2HB TYR 56 14.895 3.740 6.300 407 HD1 TYR 56 1HD TYR 56 16.099 6.264 6.422 408 HD2 TYR 56 2HD TYR 56 17.802 2.531 7.546 409 HE1 TYR 56 1HE TYR 56 18.348 7.180 6.032 410 HE2 TYR 56 2HE TYR 56 20.056 3.436 7.160 411 HH TYR 56 HH TYR 56 21.016 6.062 7.198 412 H GLU 57 H GLU 57 13.222 6.065 6.684 413 HA GLU 57 HA GLU 57 10.885 4.354 6.598 414 HB2 GLU 57 1HB GLU 57 9.349 6.185 7.286 415 HB3 GLU 57 2HB GLU 57 10.385 5.615 8.587 416 HG2 GLU 57 1HG GLU 57 11.252 7.960 6.973 417 HG3 GLU 57 2HG GLU 57 9.998 8.169 8.194 418 H ILE 58 H ILE 58 9.467 4.843 4.886 419 HA ILE 58 HA ILE 58 10.427 6.898 3.009 420 HB ILE 58 HB ILE 58 9.448 4.142 2.257 421 HG12 ILE 58 1HG1 ILE 58 12.206 5.312 1.876 422 HG13 ILE 58 2HG1 ILE 58 11.772 4.309 3.256 423 HG21 ILE 58 1HG2 ILE 58 9.246 6.450 0.794 424 HG22 ILE 58 2HG2 ILE 58 10.766 5.765 0.223 425 HG23 ILE 58 3HG2 ILE 58 9.283 4.816 0.131 426 HD11 ILE 58 3HD1 ILE 58 12.865 2.948 1.634 427 HD12 ILE 58 1HD1 ILE 58 11.159 2.503 1.667 428 HD13 ILE 58 2HD1 ILE 58 11.784 3.509 0.359 429 H GLU 59 H GLU 59 8.856 8.399 3.277 430 HA GLU 59 HA GLU 59 6.125 7.829 3.707 431 HB2 GLU 59 1HB GLU 59 5.757 10.217 3.213 432 HB3 GLU 59 2HB GLU 59 7.079 9.968 4.345 433 HG2 GLU 59 1HG GLU 59 8.550 10.053 2.189 434 HG3 GLU 59 2HG GLU 59 7.155 10.895 1.518 435 H ILE 60 H ILE 60 4.629 7.137 2.340 436 HA ILE 60 HA ILE 60 5.113 6.578 -0.356 437 HB ILE 60 HB ILE 60 2.417 6.968 0.948 438 HG12 ILE 60 1HG1 ILE 60 4.041 4.433 0.653 439 HG13 ILE 60 2HG1 ILE 60 3.897 5.356 2.145 440 HG21 ILE 60 1HG2 ILE 60 1.604 6.548 -1.076 441 HG22 ILE 60 2HG2 ILE 60 3.222 6.279 -1.721 442 HG23 ILE 60 3HG2 ILE 60 2.333 4.945 -0.986 443 HD11 ILE 60 3HD1 ILE 60 1.383 5.002 1.908 444 HD12 ILE 60 1HD1 ILE 60 1.798 3.776 0.711 445 HD13 ILE 60 2HD1 ILE 60 2.368 3.615 2.372 446 H VAL 61 H VAL 61 3.660 9.378 1.200 447 HA VAL 61 HA VAL 61 2.452 10.671 -0.891 448 HB VAL 61 HB VAL 61 2.894 12.772 0.229 449 HG11 VAL 61 1HG1 VAL 61 1.241 11.238 1.212 450 HG12 VAL 61 2HG1 VAL 61 2.499 10.573 2.256 451 HG13 VAL 61 3HG1 VAL 61 2.009 12.259 2.427 452 HG21 VAL 61 3HG2 VAL 61 5.309 11.482 1.000 453 HG22 VAL 61 1HG2 VAL 61 4.840 13.168 1.220 454 HG23 VAL 61 2HG2 VAL 61 4.451 11.975 2.460 455 H HIS 62 H HIS 62 5.862 10.226 -0.325 456 HA HIS 62 HA HIS 62 6.606 12.104 -2.418 457 HB2 HIS 62 1HB HIS 62 8.082 10.502 -0.375 458 HB3 HIS 62 2HB HIS 62 8.948 11.016 -1.820 459 HD2 HIS 62 2HD HIS 62 6.818 12.850 0.980 460 HE1 HIS 62 1HE HIS 62 9.970 15.374 -0.320 461 HE2 HIS 62 2HE HIS 62 8.085 15.078 1.325 462 H ILE 63 H ILE 63 6.907 8.616 -1.780 463 HA ILE 63 HA ILE 63 8.190 7.649 -3.919 464 HB ILE 63 HB ILE 63 5.555 6.546 -2.937 465 HG12 ILE 63 1HG1 ILE 63 8.400 6.007 -2.059 466 HG13 ILE 63 2HG1 ILE 63 7.154 6.819 -1.118 467 HG21 ILE 63 1HG2 ILE 63 5.810 4.830 -4.329 468 HG22 ILE 63 2HG2 ILE 63 7.079 5.759 -5.126 469 HG23 ILE 63 3HG2 ILE 63 7.494 4.613 -3.852 470 HD11 ILE 63 3HD1 ILE 63 6.321 4.895 -0.394 471 HD12 ILE 63 1HD1 ILE 63 6.321 4.191 -2.011 472 HD13 ILE 63 2HD1 ILE 63 7.786 4.146 -1.029 473 H SER 64 H SER 64 8.063 7.757 -6.061 474 HA SER 64 HA SER 64 5.588 8.798 -7.258 475 HB2 SER 64 1HB SER 64 7.615 10.145 -7.651 476 HB3 SER 64 2HB SER 64 8.398 8.748 -8.389 477 HG SER 64 HG SER 64 6.665 10.513 -9.478 478 H THR 65 H THR 65 8.200 6.474 -7.951 479 HA THR 65 HA THR 65 6.324 4.967 -9.639 480 HB THR 65 HB THR 65 9.339 4.762 -9.509 481 HG1 THR 65 1HG THR 65 7.660 5.897 -11.517 482 HG21 THR 65 3HG2 THR 65 8.819 2.711 -10.347 483 HG22 THR 65 1HG2 THR 65 8.685 3.631 -11.844 484 HG23 THR 65 2HG2 THR 65 7.236 3.227 -10.925 485 H VAL 66 H VAL 66 5.783 2.892 -9.189 486 HA VAL 66 HA VAL 66 7.153 1.526 -6.985 487 HB VAL 66 HB VAL 66 4.149 1.782 -7.191 488 HG11 VAL 66 1HG1 VAL 66 5.932 -0.007 -5.681 489 HG12 VAL 66 2HG1 VAL 66 4.635 0.739 -4.746 490 HG13 VAL 66 3HG1 VAL 66 4.253 -0.225 -6.173 491 HG21 VAL 66 3HG2 VAL 66 5.300 2.678 -4.713 492 HG22 VAL 66 1HG2 VAL 66 6.014 3.545 -6.073 493 HG23 VAL 66 2HG2 VAL 66 4.265 3.548 -5.845 494 H GLN 67 H GLN 67 7.988 -0.169 -8.048 495 HA GLN 67 HA GLN 67 6.120 -1.915 -9.487 496 HB2 GLN 67 1HB GLN 67 7.609 -2.255 -11.304 497 HB3 GLN 67 2HB GLN 67 7.495 -0.514 -11.081 498 HG2 GLN 67 1HG GLN 67 9.618 -0.669 -9.730 499 HG3 GLN 67 2HG GLN 67 9.754 -2.331 -10.304 500 HE21 GLN 67 1HE2 GLN 67 11.255 -2.412 -11.809 501 HE22 GLN 67 2HE2 GLN 67 11.448 -1.299 -13.117 502 H ILE 68 H ILE 68 6.851 -4.143 -9.657 503 HA ILE 68 HA ILE 68 8.539 -4.880 -7.365 504 HB ILE 68 HB ILE 68 6.511 -6.561 -8.843 505 HG12 ILE 68 1HG1 ILE 68 6.342 -5.387 -6.062 506 HG13 ILE 68 2HG1 ILE 68 5.580 -4.669 -7.477 507 HG21 ILE 68 1HG2 ILE 68 7.168 -8.345 -7.659 508 HG22 ILE 68 2HG2 ILE 68 8.661 -7.441 -7.411 509 HG23 ILE 68 3HG2 ILE 68 7.393 -7.402 -6.186 510 HD11 ILE 68 3HD1 ILE 68 4.330 -6.815 -7.774 511 HD12 ILE 68 1HD1 ILE 68 4.967 -7.322 -6.209 512 HD13 ILE 68 2HD1 ILE 68 3.924 -5.903 -6.320 513 H LEU 69 H LEU 69 10.322 -6.124 -7.609 514 HA LEU 69 HA LEU 69 11.351 -6.460 -10.288 515 HB2 LEU 69 1HB LEU 69 12.553 -7.192 -7.622 516 HB3 LEU 69 2HB LEU 69 13.394 -7.219 -9.170 517 HG LEU 69 HG LEU 69 12.279 -4.736 -7.868 518 HD11 LEU 69 1HD1 LEU 69 14.108 -4.615 -6.626 519 HD12 LEU 69 2HD1 LEU 69 15.125 -4.781 -8.058 520 HD13 LEU 69 3HD1 LEU 69 14.580 -6.218 -7.193 521 HD21 LEU 69 3HD2 LEU 69 13.503 -5.337 -10.469 522 HD22 LEU 69 1HD2 LEU 69 14.188 -3.948 -9.626 523 HD23 LEU 69 2HD2 LEU 69 12.461 -3.999 -9.982 524 H THR 70 H THR 70 11.354 -8.274 -11.450 525 HA THR 70 HA THR 70 10.638 -10.793 -10.096 526 HB THR 70 HB THR 70 9.568 -11.509 -12.218 527 HG1 THR 70 1HG THR 70 10.384 -10.266 -13.804 528 HG21 THR 70 3HG2 THR 70 8.428 -10.183 -10.257 529 HG22 THR 70 1HG2 THR 70 7.543 -10.514 -11.746 530 HG23 THR 70 2HG2 THR 70 8.263 -8.926 -11.482 531 H GLU 71 H GLU 71 11.274 -12.752 -11.457 532 HA GLU 71 HA GLU 71 14.078 -12.709 -11.833 533 HB2 GLU 71 1HB GLU 71 13.754 -15.035 -12.687 534 HB3 GLU 71 2HB GLU 71 13.030 -14.742 -11.113 535 HG2 GLU 71 1HG GLU 71 10.842 -14.436 -12.219 536 HG3 GLU 71 2HG GLU 71 11.596 -14.855 -13.756 537 H GLY 72 H GLY 72 11.354 -12.831 -14.105 538 HA2 GLY 72 1HA GLY 72 13.088 -11.711 -16.169 539 HA3 GLY 72 2HA GLY 72 12.361 -13.274 -16.513 540 H PHE 73 H PHE 73 11.522 -11.904 -18.350 541 HA PHE 73 HA PHE 73 9.701 -9.850 -18.088 542 HB2 PHE 73 1HB PHE 73 10.234 -11.930 -20.125 543 HB3 PHE 73 2HB PHE 73 8.658 -11.151 -20.215 544 HD1 PHE 73 1HD PHE 73 8.894 -8.458 -19.807 545 HD2 PHE 73 2HD PHE 73 11.828 -11.039 -21.495 546 HE1 PHE 73 1HE PHE 73 9.906 -6.540 -20.970 547 HE2 PHE 73 2HE PHE 73 12.846 -9.125 -22.659 548 HZ PHE 73 HZ PHE 73 11.886 -6.873 -22.397 549 HA PRO 74 HA PRO 74 6.079 -13.028 -17.825 550 HB2 PRO 74 1HB PRO 74 6.726 -15.645 -17.508 551 HB3 PRO 74 2HB PRO 74 6.538 -14.887 -19.094 552 HG2 PRO 74 1HG PRO 74 9.041 -15.477 -17.561 553 HG3 PRO 74 2HG PRO 74 8.707 -15.701 -19.289 554 HD2 PRO 74 1HD PRO 74 10.106 -13.587 -18.338 555 HD3 PRO 74 2HD PRO 74 9.072 -13.478 -19.776 556 HA PRO 75 HA PRO 75 6.028 -13.236 -13.429 557 HB2 PRO 75 1HB PRO 75 3.828 -14.769 -13.005 558 HB3 PRO 75 2HB PRO 75 3.739 -13.096 -13.569 559 HG2 PRO 75 1HG PRO 75 3.549 -15.638 -15.139 560 HG3 PRO 75 2HG PRO 75 2.574 -14.163 -15.276 561 HD2 PRO 75 1HD PRO 75 4.608 -14.728 -16.972 562 HD3 PRO 75 2HD PRO 75 4.179 -13.067 -16.516 563 H GLY 76 H GLY 76 5.776 -16.294 -15.184 564 HA2 GLY 76 1HA GLY 76 7.768 -17.737 -14.245 565 HA3 GLY 76 2HA GLY 76 6.716 -17.769 -12.838 566 H GLY 77 H GLY 77 7.291 -20.156 -13.748 567 HA2 GLY 77 1HA GLY 77 5.216 -20.962 -15.659 568 HA3 GLY 77 2HA GLY 77 6.574 -21.947 -15.136 569 H GLY 78 H GLY 78 4.196 -20.161 -13.194 570 HA2 GLY 78 1HA GLY 78 2.360 -21.991 -12.509 571 HA3 GLY 78 2HA GLY 78 3.754 -22.542 -11.591 572 H ASN 79 H ASN 79 4.625 -21.168 -9.955 573 HA ASN 79 HA ASN 79 2.590 -19.386 -8.823 574 HB2 ASN 79 1HB ASN 79 3.943 -19.629 -6.713 575 HB3 ASN 79 2HB ASN 79 3.233 -21.127 -7.307 576 HD21 ASN 79 1HD2 ASN 79 4.553 -22.755 -7.001 577 HD22 ASN 79 2HD2 ASN 79 6.267 -22.737 -7.218 578 H ALA 80 H ALA 80 3.083 -17.306 -8.120 579 HA ALA 80 HA ALA 80 5.087 -15.946 -9.638 580 HB1 ALA 80 1HB ALA 80 4.269 -13.930 -8.545 581 HB2 ALA 80 2HB ALA 80 2.926 -14.914 -9.131 582 HB3 ALA 80 3HB ALA 80 3.333 -14.908 -7.415 583 H ARG 81 H ARG 81 7.133 -15.569 -9.107 584 HA ARG 81 HA ARG 81 7.912 -15.809 -6.274 585 HB2 ARG 81 1HB ARG 81 9.543 -16.520 -8.720 586 HB3 ARG 81 2HB ARG 81 10.103 -16.617 -7.055 587 HG2 ARG 81 1HG ARG 81 8.540 -18.360 -6.563 588 HG3 ARG 81 2HG ARG 81 7.769 -18.176 -8.140 589 HD2 ARG 81 1HD ARG 81 10.680 -18.854 -7.888 590 HD3 ARG 81 2HD ARG 81 9.438 -20.103 -7.815 591 HE ARG 81 HE ARG 81 9.099 -18.450 -10.099 592 HH11 ARG 81 1HH1 ARG 81 11.026 -21.054 -8.825 593 HH12 ARG 81 2HH1 ARG 81 11.409 -21.707 -10.384 594 HH21 ARG 81 1HH2 ARG 81 9.596 -19.299 -12.156 595 HH22 ARG 81 2HH2 ARG 81 10.595 -20.707 -12.278 596 H ALA 82 H ALA 82 7.551 -13.529 -6.047 597 HA ALA 82 HA ALA 82 8.913 -11.603 -7.627 598 HB1 ALA 82 1HB ALA 82 7.280 -10.469 -6.601 599 HB2 ALA 82 2HB ALA 82 7.211 -11.601 -5.250 600 HB3 ALA 82 3HB ALA 82 8.423 -10.321 -5.266 601 H THR 83 H THR 83 11.092 -12.051 -7.741 602 HA THR 83 HA THR 83 12.804 -12.825 -5.726 603 HB THR 83 HB THR 83 14.632 -11.809 -7.030 604 HG1 THR 83 1HG THR 83 13.851 -10.773 -9.079 605 HG21 THR 83 3HG2 THR 83 14.501 -13.563 -8.398 606 HG22 THR 83 1HG2 THR 83 13.191 -12.809 -9.307 607 HG23 THR 83 2HG2 THR 83 12.829 -13.787 -7.884 608 H GLY 84 H GLY 84 11.918 -9.513 -6.673 609 HA2 GLY 84 1HA GLY 84 12.352 -8.591 -3.973 610 HA3 GLY 84 2HA GLY 84 13.537 -7.986 -5.121 611 H MET 85 H MET 85 12.318 -6.017 -4.049 612 HA MET 85 HA MET 85 10.139 -5.268 -5.887 613 HB2 MET 85 1HB MET 85 9.284 -5.472 -3.625 614 HB3 MET 85 2HB MET 85 10.563 -4.431 -3.013 615 HG2 MET 85 1HG MET 85 9.659 -2.541 -4.182 616 HG3 MET 85 2HG MET 85 8.459 -3.557 -4.976 617 HE1 MET 85 3HE MET 85 6.486 -3.722 -4.532 618 HE2 MET 85 1HE MET 85 5.764 -4.162 -2.984 619 HE3 MET 85 2HE MET 85 5.751 -2.481 -3.515 620 H PHE 86 H PHE 86 10.037 -3.024 -6.499 621 HA PHE 86 HA PHE 86 12.549 -1.542 -6.151 622 HB2 PHE 86 1HB PHE 86 12.490 -2.752 -8.362 623 HB3 PHE 86 2HB PHE 86 11.099 -1.762 -8.793 624 HD1 PHE 86 2HD PHE 86 14.706 -1.752 -8.122 625 HD2 PHE 86 1HD PHE 86 11.350 0.540 -9.388 626 HE1 PHE 86 2HE PHE 86 16.219 0.010 -8.932 627 HE2 PHE 86 1HE PHE 86 12.859 2.306 -10.202 628 HZ PHE 86 HZ PHE 86 15.297 2.043 -9.973 629 H LEU 87 H LEU 87 12.136 0.386 -5.318 630 HA LEU 87 HA LEU 87 9.671 1.777 -6.120 631 HB2 LEU 87 1HB LEU 87 10.830 1.917 -3.350 632 HB3 LEU 87 2HB LEU 87 9.271 2.521 -3.906 633 HG LEU 87 HG LEU 87 9.888 -0.415 -3.926 634 HD11 LEU 87 1HD1 LEU 87 8.361 0.631 -1.646 635 HD12 LEU 87 2HD1 LEU 87 10.086 0.995 -1.625 636 HD13 LEU 87 3HD1 LEU 87 9.540 -0.678 -1.724 637 HD21 LEU 87 3HD2 LEU 87 7.903 -0.272 -4.977 638 HD22 LEU 87 1HD2 LEU 87 7.548 1.325 -4.318 639 HD23 LEU 87 2HD2 LEU 87 7.268 -0.115 -3.338 640 H GLN 88 H GLN 88 9.776 4.064 -6.120 641 HA GLN 88 HA GLN 88 12.481 5.197 -5.910 642 HB2 GLN 88 1HB GLN 88 10.493 5.705 -8.130 643 HB3 GLN 88 2HB GLN 88 12.004 6.578 -7.914 644 HG2 GLN 88 1HG GLN 88 13.115 4.264 -8.045 645 HG3 GLN 88 2HG GLN 88 11.577 3.730 -8.721 646 HE21 GLN 88 1HE2 GLN 88 13.924 6.365 -9.102 647 HE22 GLN 88 2HE2 GLN 88 13.868 6.394 -10.828 648 H TYR 89 H TYR 89 12.624 7.237 -5.073 649 HA TYR 89 HA TYR 89 10.285 8.885 -4.720 650 HB2 TYR 89 1HB TYR 89 10.642 8.991 -2.201 651 HB3 TYR 89 2HB TYR 89 9.885 7.528 -2.821 652 HD1 TYR 89 1HD TYR 89 12.999 8.944 -1.447 653 HD2 TYR 89 2HD TYR 89 10.958 5.400 -2.622 654 HE1 TYR 89 1HE TYR 89 14.724 7.589 -0.334 655 HE2 TYR 89 2HE TYR 89 12.676 4.035 -1.510 656 HH TYR 89 HH TYR 89 15.579 4.999 -0.746 657 H THR 90 H THR 90 10.788 10.997 -3.898 658 HA THR 90 HA THR 90 13.595 11.716 -4.372 659 HB THR 90 HB THR 90 12.738 14.044 -4.624 660 HG1 THR 90 1HG THR 90 10.798 14.341 -3.828 661 HG21 THR 90 3HG2 THR 90 12.847 12.140 -6.473 662 HG22 THR 90 1HG2 THR 90 12.217 13.747 -6.831 663 HG23 THR 90 2HG2 THR 90 11.106 12.417 -6.503 664 H VAL 91 H VAL 91 14.636 13.262 -3.003 665 HA VAL 91 HA VAL 91 13.563 13.277 -0.257 666 HB VAL 91 HB VAL 91 16.445 13.301 -1.162 667 HG11 VAL 91 1HG1 VAL 91 15.951 12.885 1.670 668 HG12 VAL 91 2HG1 VAL 91 17.083 13.975 0.867 669 HG13 VAL 91 3HG1 VAL 91 15.407 14.468 1.116 670 HG21 VAL 91 3HG2 VAL 91 15.408 11.109 -1.341 671 HG22 VAL 91 1HG2 VAL 91 16.564 11.135 -0.009 672 HG23 VAL 91 2HG2 VAL 91 14.834 11.225 0.322 673 HA PRO 92 HA PRO 92 13.381 17.682 -0.702 674 HB2 PRO 92 1HB PRO 92 12.869 18.251 1.903 675 HB3 PRO 92 2HB PRO 92 11.648 17.598 0.804 676 HG2 PRO 92 1HG PRO 92 13.316 16.176 2.843 677 HG3 PRO 92 2HG PRO 92 11.592 15.985 2.479 678 HD2 PRO 92 1HD PRO 92 13.473 14.267 1.562 679 HD3 PRO 92 2HD PRO 92 11.998 14.644 0.649 680 H GLY 93 H GLY 93 15.723 17.720 -1.187 681 HA2 GLY 93 1HA GLY 93 17.277 19.518 -0.205 682 HA3 GLY 93 2HA GLY 93 17.380 18.404 1.149 683 H THR 94 H THR 94 17.205 17.394 -2.204 684 HA THR 94 HA THR 94 20.067 16.908 -2.331 685 HB THR 94 HB THR 94 18.834 14.901 -1.206 686 HG1 THR 94 1HG THR 94 20.243 13.497 -2.699 687 HG21 THR 94 3HG2 THR 94 17.039 14.744 -2.876 688 HG22 THR 94 1HG2 THR 94 17.978 13.255 -2.791 689 HG23 THR 94 2HG2 THR 94 18.234 14.385 -4.121 690 H GLU 95 H GLU 95 20.490 15.590 -4.489 691 HA GLU 95 HA GLU 95 18.793 16.801 -6.573 692 HB2 GLU 95 1HB GLU 95 21.778 16.433 -6.453 693 HB3 GLU 95 2HB GLU 95 20.939 16.683 -7.977 694 HG2 GLU 95 1HG GLU 95 20.792 18.571 -5.641 695 HG3 GLU 95 2HG GLU 95 21.915 18.741 -6.989 696 H GLY 96 H GLY 96 17.704 15.358 -7.723 697 HA2 GLY 96 1HA GLY 96 17.743 13.528 -9.293 698 HA3 GLY 96 2HA GLY 96 18.988 12.772 -8.310 699 H VAL 97 H VAL 97 17.241 11.020 -8.809 700 HA VAL 97 HA VAL 97 15.259 11.043 -6.627 701 HB VAL 97 HB VAL 97 15.190 9.550 -9.252 702 HG11 VAL 97 1HG1 VAL 97 14.033 8.836 -6.780 703 HG12 VAL 97 2HG1 VAL 97 12.729 9.434 -7.808 704 HG13 VAL 97 3HG1 VAL 97 13.754 8.110 -8.362 705 HG21 VAL 97 3HG2 VAL 97 13.029 11.384 -8.393 706 HG22 VAL 97 1HG2 VAL 97 14.554 12.116 -8.892 707 HG23 VAL 97 2HG2 VAL 97 13.674 11.066 -10.003 708 H THR 98 H THR 98 15.242 9.414 -5.167 709 HA THR 98 HA THR 98 17.428 7.464 -5.348 710 HB THR 98 HB THR 98 15.791 8.302 -2.946 711 HG1 THR 98 1HG THR 98 18.492 8.787 -2.943 712 HG21 THR 98 3HG2 THR 98 18.349 6.751 -2.827 713 HG22 THR 98 1HG2 THR 98 16.820 5.912 -3.086 714 HG23 THR 98 2HG2 THR 98 17.061 6.877 -1.629 715 H GLN 99 H GLN 99 17.077 5.303 -5.357 716 HA GLN 99 HA GLN 99 14.269 4.417 -5.364 717 HB2 GLN 99 1HB GLN 99 15.036 2.537 -6.778 718 HB3 GLN 99 2HB GLN 99 15.313 4.104 -7.526 719 HG2 GLN 99 1HG GLN 99 17.203 2.629 -7.873 720 HG3 GLN 99 2HG GLN 99 17.658 4.012 -6.878 721 HE21 GLN 99 1HE2 GLN 99 16.210 0.817 -6.315 722 HE22 GLN 99 2HE2 GLN 99 17.280 0.371 -5.034 723 H LEU 100 H LEU 100 14.029 2.045 -4.759 724 HA LEU 100 HA LEU 100 15.906 1.274 -2.637 725 HB2 LEU 100 1HB LEU 100 13.952 2.424 -1.649 726 HB3 LEU 100 2HB LEU 100 12.903 1.213 -2.382 727 HG LEU 100 HG LEU 100 14.318 -0.475 -1.003 728 HD11 LEU 100 1HD1 LEU 100 15.344 0.335 0.957 729 HD12 LEU 100 2HD1 LEU 100 14.704 1.960 0.715 730 HD13 LEU 100 3HD1 LEU 100 15.960 1.339 -0.356 731 HD21 LEU 100 3HD2 LEU 100 12.853 0.320 1.077 732 HD22 LEU 100 1HD2 LEU 100 12.148 -0.457 -0.341 733 HD23 LEU 100 2HD2 LEU 100 12.094 1.299 -0.180 734 H LYS 101 H LYS 101 16.398 -0.842 -2.586 735 HA LYS 101 HA LYS 101 14.841 -2.640 -4.328 736 HB2 LYS 101 1HB LYS 101 17.346 -1.959 -4.861 737 HB3 LYS 101 2HB LYS 101 17.698 -3.214 -3.681 738 HG2 LYS 101 1HG LYS 101 16.724 -4.886 -4.999 739 HG3 LYS 101 2HG LYS 101 15.891 -3.712 -6.022 740 HD2 LYS 101 1HD LYS 101 18.126 -2.927 -6.811 741 HD3 LYS 101 2HD LYS 101 18.856 -4.257 -5.908 742 HE2 LYS 101 1HE LYS 101 17.168 -5.719 -7.258 743 HE3 LYS 101 2HE LYS 101 17.133 -4.335 -8.349 744 HZ1 LYS 101 3HZ LYS 101 19.407 -6.089 -7.672 745 HZ2 LYS 101 1HZ LYS 101 19.667 -4.535 -8.287 746 HZ3 LYS 101 2HZ LYS 101 18.807 -5.671 -9.197 747 H LEU 102 H LEU 102 14.131 -4.525 -3.493 748 HA LEU 102 HA LEU 102 15.028 -5.239 -0.779 749 HB2 LEU 102 1HB LEU 102 12.245 -5.501 -1.909 750 HB3 LEU 102 2HB LEU 102 12.760 -6.018 -0.304 751 HG LEU 102 HG LEU 102 12.854 -3.149 -1.218 752 HD11 LEU 102 1HD1 LEU 102 10.668 -2.947 -0.924 753 HD12 LEU 102 2HD1 LEU 102 10.781 -3.674 0.679 754 HD13 LEU 102 3HD1 LEU 102 10.554 -4.698 -0.739 755 HD21 LEU 102 3HD2 LEU 102 12.557 -3.163 1.478 756 HD22 LEU 102 1HD2 LEU 102 14.108 -3.063 0.644 757 HD23 LEU 102 2HD2 LEU 102 13.524 -4.619 1.235 758 H THR 103 H THR 103 14.977 -7.481 -0.246 759 HA THR 103 HA THR 103 14.642 -9.351 -2.471 760 HB THR 103 HB THR 103 17.150 -9.282 -0.782 761 HG1 THR 103 1HG THR 103 16.933 -7.616 -2.462 762 HG21 THR 103 3HG2 THR 103 15.940 -11.305 -2.460 763 HG22 THR 103 1HG2 THR 103 17.339 -11.422 -1.393 764 HG23 THR 103 2HG2 THR 103 17.538 -10.852 -3.050 765 H VAL 104 H VAL 104 14.143 -11.454 -1.860 766 HA VAL 104 HA VAL 104 13.119 -11.720 0.843 767 HB VAL 104 HB VAL 104 12.969 -13.679 -1.452 768 HG11 VAL 104 1HG1 VAL 104 12.449 -15.011 0.316 769 HG12 VAL 104 2HG1 VAL 104 11.925 -13.661 1.323 770 HG13 VAL 104 3HG1 VAL 104 10.864 -14.284 0.059 771 HG21 VAL 104 3HG2 VAL 104 10.453 -12.653 -1.085 772 HG22 VAL 104 1HG2 VAL 104 11.482 -11.239 -0.856 773 HG23 VAL 104 2HG2 VAL 104 11.581 -12.169 -2.351 774 H VAL 105 H VAL 105 14.286 -12.556 2.430 775 HA VAL 105 HA VAL 105 16.671 -14.113 1.823 776 HB VAL 105 HB VAL 105 15.696 -13.322 4.563 777 HG11 VAL 105 1HG1 VAL 105 18.547 -13.346 4.118 778 HG12 VAL 105 2HG1 VAL 105 17.587 -14.229 5.306 779 HG13 VAL 105 3HG1 VAL 105 17.824 -14.897 3.691 780 HG21 VAL 105 3HG2 VAL 105 17.782 -11.680 3.292 781 HG22 VAL 105 1HG2 VAL 105 16.158 -11.489 2.629 782 HG23 VAL 105 2HG2 VAL 105 16.449 -11.208 4.346 783 H GLU 106 H GLU 106 13.683 -15.013 1.784 784 HA GLU 106 HA GLU 106 14.118 -17.469 3.355 785 HB2 GLU 106 1HB GLU 106 11.505 -16.074 2.749 786 HB3 GLU 106 2HB GLU 106 11.653 -17.625 3.563 787 HG2 GLU 106 1HG GLU 106 13.070 -15.244 4.663 788 HG3 GLU 106 2HG GLU 106 11.340 -15.441 4.938 789 H ASP 107 H ASP 107 13.918 -19.379 2.330 790 HA ASP 107 HA ASP 107 13.178 -19.296 -0.518 791 HB2 ASP 107 1HB ASP 107 15.162 -20.929 1.023 792 HB3 ASP 107 2HB ASP 107 14.476 -21.575 -0.465 793 H VAL 108 H VAL 108 12.569 -20.828 2.548 794 HA VAL 108 HA VAL 108 11.103 -23.058 1.637 795 HB VAL 108 HB VAL 108 10.419 -23.393 3.847 796 HG11 VAL 108 1HG1 VAL 108 12.910 -23.358 3.480 797 HG12 VAL 108 2HG1 VAL 108 12.917 -21.754 4.215 798 HG13 VAL 108 3HG1 VAL 108 12.386 -23.152 5.151 799 HG21 VAL 108 3HG2 VAL 108 10.726 -20.420 4.222 800 HG22 VAL 108 1HG2 VAL 108 9.242 -21.371 4.287 801 HG23 VAL 108 2HG2 VAL 108 10.459 -21.548 5.551 802 H THR 109 H THR 109 8.674 -23.164 2.626 803 HA THR 109 HA THR 109 7.145 -21.501 0.869 804 HB THR 109 HB THR 109 6.365 -23.578 2.911 805 HG1 THR 109 1HG THR 109 5.772 -24.701 0.998 806 HG21 THR 109 3HG2 THR 109 4.064 -23.367 2.145 807 HG22 THR 109 1HG2 THR 109 4.519 -22.034 1.084 808 HG23 THR 109 2HG2 THR 109 4.618 -21.841 2.834 809 H VAL 110 H VAL 110 7.271 -21.859 4.414 810 HA VAL 110 HA VAL 110 5.441 -20.039 5.240 811 HB VAL 110 HB VAL 110 8.202 -20.485 6.373 812 HG11 VAL 110 1HG1 VAL 110 6.340 -18.435 7.010 813 HG12 VAL 110 2HG1 VAL 110 6.389 -19.578 8.354 814 HG13 VAL 110 3HG1 VAL 110 7.875 -18.812 7.792 815 HG21 VAL 110 3HG2 VAL 110 6.551 -22.397 6.268 816 HG22 VAL 110 1HG2 VAL 110 7.170 -22.000 7.871 817 HG23 VAL 110 2HG2 VAL 110 5.553 -21.481 7.396 818 H GLY 111 H GLY 111 8.868 -19.071 5.064 819 HA2 GLY 111 1HA GLY 111 8.424 -16.331 5.117 820 HA3 GLY 111 2HA GLY 111 9.852 -17.096 4.435 821 H ARG 112 H ARG 112 9.434 -18.092 2.187 822 HA ARG 112 HA ARG 112 9.151 -16.253 0.280 823 HB2 ARG 112 1HB ARG 112 9.637 -18.714 -0.039 824 HB3 ARG 112 2HB ARG 112 7.899 -18.980 -0.046 825 HG2 ARG 112 1HG ARG 112 8.408 -18.870 -2.293 826 HG3 ARG 112 2HG ARG 112 7.874 -17.225 -1.941 827 HD2 ARG 112 1HD ARG 112 9.813 -16.899 -3.178 828 HD3 ARG 112 2HD ARG 112 10.368 -16.744 -1.512 829 HE ARG 112 HE ARG 112 10.676 -19.408 -2.242 830 HH11 ARG 112 1HH1 ARG 112 11.931 -16.293 -3.162 831 HH12 ARG 112 2HH1 ARG 112 13.467 -16.916 -3.667 832 HH21 ARG 112 1HH2 ARG 112 12.695 -20.239 -2.904 833 HH22 ARG 112 2HH2 ARG 112 13.900 -19.160 -3.521 834 H ARG 113 H ARG 113 6.374 -18.220 1.356 835 HA ARG 113 HA ARG 113 4.404 -16.935 -0.108 836 HB2 ARG 113 1HB ARG 113 4.386 -18.437 2.485 837 HB3 ARG 113 2HB ARG 113 2.918 -17.648 1.924 838 HG2 ARG 113 1HG ARG 113 4.463 -19.579 0.222 839 HG3 ARG 113 2HG ARG 113 3.190 -20.087 1.333 840 HD2 ARG 113 1HD ARG 113 2.751 -17.981 -0.765 841 HD3 ARG 113 2HD ARG 113 2.526 -19.698 -1.094 842 HE ARG 113 HE ARG 113 0.754 -17.984 0.333 843 HH11 ARG 113 1HH1 ARG 113 1.925 -21.257 0.143 844 HH12 ARG 113 2HH1 ARG 113 0.489 -21.948 0.824 845 HH21 ARG 113 1HH2 ARG 113 -1.141 -18.882 1.230 846 HH22 ARG 113 2HH2 ARG 113 -1.254 -20.596 1.441 847 H GLN 114 H GLN 114 5.584 -16.187 3.157 848 HA GLN 114 HA GLN 114 3.825 -14.055 3.667 849 HB2 GLN 114 1HB GLN 114 5.211 -15.227 5.380 850 HB3 GLN 114 2HB GLN 114 6.629 -14.407 4.739 851 HG2 GLN 114 1HG GLN 114 6.047 -13.116 6.565 852 HG3 GLN 114 2HG GLN 114 5.333 -12.241 5.212 853 HE21 GLN 114 1HE2 GLN 114 3.778 -11.243 6.449 854 HE22 GLN 114 2HE2 GLN 114 2.442 -12.092 7.141 855 H ALA 115 H ALA 115 7.305 -13.806 2.917 856 HA ALA 115 HA ALA 115 7.479 -11.122 2.457 857 HB1 ALA 115 1HB ALA 115 9.524 -12.135 2.366 858 HB2 ALA 115 2HB ALA 115 8.946 -13.465 1.361 859 HB3 ALA 115 3HB ALA 115 9.237 -11.880 0.644 860 H VAL 116 H VAL 116 7.040 -13.508 -0.165 861 HA VAL 116 HA VAL 116 6.555 -11.770 -2.238 862 HB VAL 116 HB VAL 116 5.278 -14.470 -1.781 863 HG11 VAL 116 1HG1 VAL 116 4.672 -14.524 -4.051 864 HG12 VAL 116 2HG1 VAL 116 4.165 -12.933 -3.480 865 HG13 VAL 116 3HG1 VAL 116 5.641 -13.101 -4.431 866 HG21 VAL 116 3HG2 VAL 116 7.943 -13.796 -2.193 867 HG22 VAL 116 1HG2 VAL 116 7.213 -15.390 -2.390 868 HG23 VAL 116 2HG2 VAL 116 7.366 -14.313 -3.778 869 H ALA 117 H ALA 117 4.208 -13.089 0.071 870 HA ALA 117 HA ALA 117 1.867 -12.089 -1.011 871 HB1 ALA 117 1HB ALA 117 1.315 -11.879 1.612 872 HB2 ALA 117 2HB ALA 117 1.346 -13.413 0.741 873 HB3 ALA 117 3HB ALA 117 2.748 -12.905 1.682 874 H TRP 118 H TRP 118 4.196 -10.481 1.115 875 HA TRP 118 HA TRP 118 2.653 -8.057 1.257 876 HB2 TRP 118 1HB TRP 118 4.200 -8.844 3.071 877 HB3 TRP 118 2HB TRP 118 5.553 -8.470 2.007 878 HD1 TRP 118 HD TRP 118 3.235 -6.901 4.486 879 HE1 TRP 118 1HE TRP 118 3.720 -4.380 4.665 880 HE3 TRP 118 3HE TRP 118 6.313 -6.378 0.437 881 HZ2 TRP 118 2HZ TRP 118 5.210 -2.427 3.273 882 HZ3 TRP 118 3HZ TRP 118 7.225 -4.150 -0.070 883 HH2 TRP 118 HH TRP 118 6.684 -2.217 1.319 884 H LEU 119 H LEU 119 5.324 -9.277 -0.655 885 HA LEU 119 HA LEU 119 6.155 -6.833 -1.785 886 HB2 LEU 119 1HB LEU 119 6.328 -9.664 -2.795 887 HB3 LEU 119 2HB LEU 119 7.080 -8.293 -3.608 888 HG LEU 119 HG LEU 119 7.727 -9.141 -0.788 889 HD11 LEU 119 1HD1 LEU 119 9.379 -10.502 -1.526 890 HD12 LEU 119 2HD1 LEU 119 9.642 -9.572 -3.000 891 HD13 LEU 119 3HD1 LEU 119 8.279 -10.685 -2.892 892 HD21 LEU 119 3HD2 LEU 119 9.236 -7.349 -2.683 893 HD22 LEU 119 1HD2 LEU 119 9.599 -7.668 -0.986 894 HD23 LEU 119 2HD2 LEU 119 8.148 -6.765 -1.422 895 H VAL 120 H VAL 120 3.857 -9.292 -2.921 896 HA VAL 120 HA VAL 120 3.147 -7.765 -5.256 897 HB VAL 120 HB VAL 120 3.072 -10.269 -5.164 898 HG11 VAL 120 1HG1 VAL 120 2.054 -10.396 -2.899 899 HG12 VAL 120 2HG1 VAL 120 0.531 -9.842 -3.599 900 HG13 VAL 120 3HG1 VAL 120 1.228 -11.382 -4.105 901 HG21 VAL 120 3HG2 VAL 120 0.495 -8.881 -5.898 902 HG22 VAL 120 1HG2 VAL 120 1.928 -9.015 -6.918 903 HG23 VAL 120 2HG2 VAL 120 1.018 -10.461 -6.480 904 H ALA 121 H ALA 121 1.747 -8.398 -2.080 905 HA ALA 121 HA ALA 121 -0.770 -7.248 -2.485 906 HB1 ALA 121 1HB ALA 121 -0.824 -6.977 -0.024 907 HB2 ALA 121 2HB ALA 121 -0.321 -8.588 -0.537 908 HB3 ALA 121 3HB ALA 121 0.881 -7.429 0.031 909 H MET 122 H MET 122 2.163 -5.774 -1.086 910 HA MET 122 HA MET 122 1.278 -3.245 -0.585 911 HB2 MET 122 1HB MET 122 3.593 -4.150 -0.185 912 HB3 MET 122 2HB MET 122 3.940 -3.839 -1.880 913 HG2 MET 122 1HG MET 122 2.935 -1.647 -0.119 914 HG3 MET 122 2HG MET 122 4.635 -2.110 -0.094 915 HE1 MET 122 3HE MET 122 4.701 1.128 -1.597 916 HE2 MET 122 1HE MET 122 2.991 1.052 -2.026 917 HE3 MET 122 2HE MET 122 3.529 0.489 -0.443 918 H HIS 123 H HIS 123 3.013 -4.013 -3.605 919 HA HIS 123 HA HIS 123 2.601 -1.801 -5.062 920 HB2 HIS 123 1HB HIS 123 3.782 -3.670 -6.010 921 HB3 HIS 123 2HB HIS 123 2.323 -4.656 -6.014 922 HD2 HIS 123 2HD HIS 123 3.987 -1.821 -8.110 923 HE1 HIS 123 1HE HIS 123 0.558 -3.203 -10.192 924 HE2 HIS 123 2HE HIS 123 2.649 -1.804 -10.324 925 H LYS 124 H LYS 124 0.180 -4.323 -4.526 926 HA LYS 124 HA LYS 124 -1.811 -3.168 -6.187 927 HB2 LYS 124 1HB LYS 124 -1.724 -5.314 -4.126 928 HB3 LYS 124 2HB LYS 124 -3.297 -4.638 -4.528 929 HG2 LYS 124 1HG LYS 124 -3.064 -6.494 -5.924 930 HG3 LYS 124 2HG LYS 124 -2.699 -5.109 -6.956 931 HD2 LYS 124 1HD LYS 124 -0.242 -5.555 -6.280 932 HD3 LYS 124 2HD LYS 124 -0.833 -7.146 -5.793 933 HE2 LYS 124 1HE LYS 124 -1.451 -6.043 -8.509 934 HE3 LYS 124 2HE LYS 124 0.096 -6.825 -8.186 935 HZ1 LYS 124 3HZ LYS 124 -2.520 -8.108 -7.636 936 HZ2 LYS 124 1HZ LYS 124 -0.992 -8.836 -7.629 937 HZ3 LYS 124 2HZ LYS 124 -1.673 -8.311 -9.086 938 H ALA 125 H ALA 125 -1.427 -3.221 -2.643 939 HA ALA 125 HA ALA 125 -3.596 -1.649 -1.960 940 HB1 ALA 125 1HB ALA 125 -1.700 -0.904 -0.118 941 HB2 ALA 125 2HB ALA 125 -2.732 -2.332 -0.017 942 HB3 ALA 125 3HB ALA 125 -1.106 -2.465 -0.686 943 H ALA 126 H ALA 126 -0.527 -0.711 -3.316 944 HA ALA 126 HA ALA 126 -0.626 2.044 -2.683 945 HB1 ALA 126 1HB ALA 126 1.473 1.230 -3.314 946 HB2 ALA 126 2HB ALA 126 0.838 0.465 -4.772 947 HB3 ALA 126 3HB ALA 126 0.961 2.222 -4.680 948 H LYS 127 H LYS 127 -1.527 0.271 -5.638 949 HA LYS 127 HA LYS 127 -2.268 2.130 -7.384 950 HB2 LYS 127 1HB LYS 127 -3.576 -0.417 -6.575 951 HB3 LYS 127 2HB LYS 127 -4.476 0.647 -7.648 952 HG2 LYS 127 1HG LYS 127 -2.450 0.661 -9.146 953 HG3 LYS 127 2HG LYS 127 -1.803 -0.634 -8.136 954 HD2 LYS 127 1HD LYS 127 -4.123 -1.751 -8.598 955 HD3 LYS 127 2HD LYS 127 -4.152 -0.655 -9.982 956 HE2 LYS 127 1HE LYS 127 -3.150 -2.495 -10.916 957 HE3 LYS 127 2HE LYS 127 -1.735 -1.593 -10.376 958 HZ1 LYS 127 3HZ LYS 127 -2.544 -4.177 -9.636 959 HZ2 LYS 127 1HZ LYS 127 -2.573 -3.197 -8.257 960 HZ3 LYS 127 2HZ LYS 127 -1.154 -3.335 -9.167 961 H LEU 128 H LEU 128 -4.459 1.129 -4.751 962 HA LEU 128 HA LEU 128 -6.563 2.786 -5.113 963 HB2 LEU 128 1HB LEU 128 -5.184 1.829 -2.651 964 HB3 LEU 128 2HB LEU 128 -6.491 3.002 -2.495 965 HG LEU 128 HG LEU 128 -6.854 0.396 -3.948 966 HD11 LEU 128 1HD1 LEU 128 -6.378 0.744 -1.163 967 HD12 LEU 128 2HD1 LEU 128 -6.781 -0.729 -2.043 968 HD13 LEU 128 3HD1 LEU 128 -8.066 0.293 -1.400 969 HD21 LEU 128 3HD2 LEU 128 -8.796 2.269 -2.600 970 HD22 LEU 128 1HD2 LEU 128 -9.201 0.801 -3.489 971 HD23 LEU 128 2HD2 LEU 128 -8.499 2.179 -4.337 972 H LEU 129 H LEU 129 -3.508 3.684 -3.545 973 HA LEU 129 HA LEU 129 -3.954 6.178 -2.634 974 HB2 LEU 129 1HB LEU 129 -1.612 5.221 -4.264 975 HB3 LEU 129 2HB LEU 129 -1.639 6.766 -3.416 976 HG LEU 129 HG LEU 129 -2.136 4.257 -1.877 977 HD11 LEU 129 1HD1 LEU 129 -0.039 4.118 -3.424 978 HD12 LEU 129 2HD1 LEU 129 0.077 3.652 -1.728 979 HD13 LEU 129 3HD1 LEU 129 0.658 5.233 -2.249 980 HD21 LEU 129 3HD2 LEU 129 -0.576 5.822 -0.360 981 HD22 LEU 129 1HD2 LEU 129 -2.333 5.967 -0.412 982 HD23 LEU 129 2HD2 LEU 129 -1.330 7.054 -1.373 983 H TYR 130 H TYR 130 -3.022 5.532 -6.018 984 HA TYR 130 HA TYR 130 -3.978 8.190 -6.760 985 HB2 TYR 130 1HB TYR 130 -3.043 7.228 -9.077 986 HB3 TYR 130 2HB TYR 130 -1.995 7.956 -7.865 987 HD1 TYR 130 2HD TYR 130 -0.895 6.353 -6.164 988 HD2 TYR 130 1HD TYR 130 -2.629 5.061 -9.828 989 HE1 TYR 130 2HE TYR 130 0.421 4.278 -6.048 990 HE2 TYR 130 1HE TYR 130 -1.319 2.983 -9.722 991 HH TYR 130 HH TYR 130 0.471 1.984 -8.700 992 H GLU 131 H GLU 131 -4.350 4.832 -7.906 993 HA GLU 131 HA GLU 131 -6.256 5.082 -9.803 994 HB2 GLU 131 1HB GLU 131 -5.889 3.004 -7.671 995 HB3 GLU 131 2HB GLU 131 -7.227 2.881 -8.805 996 HG2 GLU 131 1HG GLU 131 -4.476 3.290 -9.862 997 HG3 GLU 131 2HG GLU 131 -4.944 1.695 -9.273 998 H SER 132 H SER 132 -6.640 5.745 -6.439 999 HA SER 132 HA SER 132 -9.171 5.447 -5.723 1000 HB2 SER 132 1HB SER 132 -7.345 6.934 -4.646 1001 HB3 SER 132 2HB SER 132 -8.065 8.243 -5.583 1002 HG SER 132 HG SER 132 -10.112 7.238 -4.523 1003 H ARG 133 H ARG 133 -10.758 5.284 -7.235 1004 HA ARG 133 HA ARG 133 -12.084 5.874 -9.040 1005 HB2 ARG 133 1HB ARG 133 -12.387 8.301 -7.262 1006 HB3 ARG 133 2HB ARG 133 -13.554 7.719 -8.443 1007 HG2 ARG 133 1HG ARG 133 -12.690 6.266 -5.950 1008 HG3 ARG 133 2HG ARG 133 -14.213 7.127 -6.180 1009 HD2 ARG 133 1HD ARG 133 -13.281 4.735 -7.764 1010 HD3 ARG 133 2HD ARG 133 -14.479 4.708 -6.471 1011 HE ARG 133 HE ARG 133 -14.902 5.481 -9.185 1012 HH11 ARG 133 1HH1 ARG 133 -15.935 6.052 -5.909 1013 HH12 ARG 133 2HH1 ARG 133 -17.520 6.586 -6.364 1014 HH21 ARG 133 1HH2 ARG 133 -16.985 6.183 -9.796 1015 HH22 ARG 133 2HH2 ARG 133 -18.116 6.659 -8.575 1016 H ASP 134 H ASP 134 -9.702 6.285 -10.039 1017 HA ASP 134 HA ASP 134 -9.798 8.985 -11.220 1018 HB2 ASP 134 1HB ASP 134 -7.801 8.923 -9.960 1019 HB3 ASP 134 2HB ASP 134 -7.439 7.273 -10.460 1020 H GLN 135 H GLN 135 -8.890 5.602 -11.805 1021 HA GLN 135 HA GLN 135 -8.462 5.831 -14.568 1022 HB2 GLN 135 1HB GLN 135 -8.003 3.867 -12.871 1023 HB3 GLN 135 2HB GLN 135 -9.585 3.316 -13.407 1024 HG2 GLN 135 1HG GLN 135 -7.338 3.947 -15.298 1025 HG3 GLN 135 2HG GLN 135 -7.611 2.345 -14.616 1026 HE21 GLN 135 1HE2 GLN 135 -7.711 3.300 -17.394 1027 HE22 GLN 135 2HE2 GLN 135 -9.281 2.876 -17.976 1028 H SER 136 H SER 136 -9.772 5.442 -16.345 1029 HA SER 136 HA SER 136 -12.669 5.364 -15.813 1030 HB2 SER 136 1HB SER 136 -13.031 6.887 -17.683 1031 HB3 SER 136 2HB SER 136 -11.941 7.629 -16.513 1032 HG SER 136 HG SER 136 -11.498 6.947 -19.115 1033 H GLY 137 H GLY 137 -13.115 3.282 -16.315 1034 HA2 GLY 137 1HA GLY 137 -11.868 1.837 -18.416 1035 HA3 GLY 137 2HA GLY 137 -13.324 1.358 -17.556 1036 HA PRO 138 HA PRO 138 -14.636 2.140 -21.879 1037 HB2 PRO 138 1HB PRO 138 -16.499 0.165 -21.891 1038 HB3 PRO 138 2HB PRO 138 -14.790 -0.125 -22.235 1039 HG2 PRO 138 1HG PRO 138 -16.309 -0.554 -19.692 1040 HG3 PRO 138 2HG PRO 138 -15.103 -1.599 -20.464 1041 HD2 PRO 138 1HD PRO 138 -14.507 0.017 -18.375 1042 HD3 PRO 138 2HD PRO 138 -13.332 -0.370 -19.649 1043 H SER 139 H SER 139 -16.445 1.747 -18.893 1044 HA SER 139 HA SER 139 -18.981 2.489 -19.590 1045 HB2 SER 139 1HB SER 139 -18.289 1.881 -17.294 1046 HB3 SER 139 2HB SER 139 -17.486 3.443 -17.134 1047 HG SER 139 HG SER 139 -19.801 4.156 -17.834 1048 H SER 140 H SER 140 -20.041 4.318 -20.147 1049 HA SER 140 HA SER 140 -18.682 6.423 -21.365 1050 HB2 SER 140 1HB SER 140 -20.819 7.499 -21.592 1051 HB3 SER 140 2HB SER 140 -21.083 5.763 -21.754 1052 HG SER 140 HG SER 140 -21.423 6.039 -19.289 1053 H GLY 141 H GLY 141 -18.405 8.617 -20.783 1054 HA2 GLY 141 1HA GLY 141 -18.549 9.151 -17.883 1055 HA3 GLY 141 2HA GLY 141 -17.103 9.531 -18.808 Start of MODEL 20 1 H1 GLY 1 H GLY 1 -17.627 2.578 1.682 2 HA2 GLY 1 1HA GLY 1 -16.520 3.451 -0.273 3 HA3 GLY 1 2HA GLY 1 -15.482 2.033 -0.263 4 H SER 2 H SER 2 -16.183 0.129 -1.195 5 HA SER 2 HA SER 2 -18.000 0.358 -3.329 6 HB2 SER 2 1HB SER 2 -16.035 -1.346 -2.870 7 HB3 SER 2 2HB SER 2 -17.333 -2.327 -2.188 8 HG SER 2 HG SER 2 -16.866 -2.596 -4.508 9 H SER 3 H SER 3 -20.047 0.939 -2.764 10 HA SER 3 HA SER 3 -21.497 -0.054 -0.577 11 HB2 SER 3 1HB SER 3 -22.246 1.344 -3.121 12 HB3 SER 3 2HB SER 3 -23.513 0.698 -2.078 13 HG SER 3 HG SER 3 -22.967 2.093 -0.517 14 H GLY 4 H GLY 4 -21.446 -1.059 -3.983 15 HA2 GLY 4 1HA GLY 4 -23.188 -3.325 -3.344 16 HA3 GLY 4 2HA GLY 4 -22.722 -2.798 -4.955 17 H SER 5 H SER 5 -22.027 -4.890 -2.342 18 HA SER 5 HA SER 5 -20.302 -6.506 -3.888 19 HB2 SER 5 1HB SER 5 -18.207 -6.206 -2.660 20 HB3 SER 5 2HB SER 5 -18.696 -4.687 -3.411 21 HG SER 5 HG SER 5 -19.122 -3.848 -1.486 22 H SER 6 H SER 6 -19.434 -8.349 -2.627 23 HA SER 6 HA SER 6 -20.865 -8.789 -0.099 24 HB2 SER 6 1HB SER 6 -20.773 -10.699 -2.446 25 HB3 SER 6 2HB SER 6 -21.373 -11.118 -0.842 26 HG SER 6 HG SER 6 -22.789 -10.147 -2.741 27 H GLY 7 H GLY 7 -18.988 -8.576 1.099 28 HA2 GLY 7 1HA GLY 7 -17.020 -9.237 2.079 29 HA3 GLY 7 2HA GLY 7 -17.457 -10.856 1.554 30 H ALA 8 H ALA 8 -15.739 -7.921 0.674 31 HA ALA 8 HA ALA 8 -14.509 -9.242 -1.618 32 HB1 ALA 8 1HB ALA 8 -13.978 -6.448 -0.636 33 HB2 ALA 8 2HB ALA 8 -13.665 -7.117 -2.238 34 HB3 ALA 8 3HB ALA 8 -15.324 -6.858 -1.699 35 H GLU 9 H GLU 9 -13.924 -10.255 1.013 36 HA GLU 9 HA GLU 9 -11.679 -9.457 2.293 37 HB2 GLU 9 1HB GLU 9 -12.370 -12.289 1.495 38 HB3 GLU 9 2HB GLU 9 -11.173 -11.859 2.709 39 HG2 GLU 9 1HG GLU 9 -12.776 -11.089 4.201 40 HG3 GLU 9 2HG GLU 9 -13.997 -10.905 2.943 41 H PHE 10 H PHE 10 -11.865 -10.745 -0.931 42 HA PHE 10 HA PHE 10 -9.441 -11.700 -1.557 43 HB2 PHE 10 1HB PHE 10 -9.923 -11.221 -3.733 44 HB3 PHE 10 2HB PHE 10 -11.495 -10.822 -3.048 45 HD1 PHE 10 1HD PHE 10 -12.172 -8.498 -2.757 46 HD2 PHE 10 2HD PHE 10 -8.460 -9.520 -4.572 47 HE1 PHE 10 1HE PHE 10 -11.980 -6.211 -3.645 48 HE2 PHE 10 2HE PHE 10 -8.262 -7.235 -5.461 49 HZ PHE 10 HZ PHE 10 -10.023 -5.576 -4.998 50 H TYR 11 H TYR 11 -10.163 -8.229 -1.274 51 HA TYR 11 HA TYR 11 -7.377 -7.526 -1.591 52 HB2 TYR 11 1HB TYR 11 -8.957 -6.001 -2.536 53 HB3 TYR 11 2HB TYR 11 -9.858 -5.900 -1.027 54 HD1 TYR 11 2HD TYR 11 -6.258 -5.485 -1.970 55 HD2 TYR 11 1HD TYR 11 -9.673 -3.825 -0.050 56 HE1 TYR 11 2HE TYR 11 -4.929 -3.523 -1.315 57 HE2 TYR 11 1HE TYR 11 -8.354 -1.858 0.610 58 HH TYR 11 HH TYR 11 -5.215 -1.243 -0.655 59 H ASP 12 H ASP 12 -9.800 -7.076 0.988 60 HA ASP 12 HA ASP 12 -8.382 -6.010 2.996 61 HB2 ASP 12 1HB ASP 12 -10.266 -8.366 3.195 62 HB3 ASP 12 2HB ASP 12 -9.692 -7.449 4.586 63 H LYS 13 H LYS 13 -8.342 -9.487 2.232 64 HA LYS 13 HA LYS 13 -6.745 -10.549 4.102 65 HB2 LYS 13 1HB LYS 13 -7.593 -11.736 2.081 66 HB3 LYS 13 2HB LYS 13 -6.302 -10.994 1.145 67 HG2 LYS 13 1HG LYS 13 -4.664 -12.276 2.132 68 HG3 LYS 13 2HG LYS 13 -5.630 -12.585 3.577 69 HD2 LYS 13 1HD LYS 13 -5.789 -14.621 2.537 70 HD3 LYS 13 2HD LYS 13 -7.202 -13.811 1.854 71 HE2 LYS 13 1HE LYS 13 -4.542 -13.667 0.484 72 HE3 LYS 13 2HE LYS 13 -5.582 -15.075 0.278 73 HZ1 LYS 13 3HZ LYS 13 -6.758 -12.423 -0.112 74 HZ2 LYS 13 1HZ LYS 13 -7.122 -13.887 -0.876 75 HZ3 LYS 13 2HZ LYS 13 -5.738 -13.023 -1.321 76 H GLN 14 H GLN 14 -5.578 -8.608 1.371 77 HA GLN 14 HA GLN 14 -2.833 -8.813 2.008 78 HB2 GLN 14 1HB GLN 14 -4.434 -6.879 0.354 79 HB3 GLN 14 2HB GLN 14 -2.706 -6.660 0.595 80 HG2 GLN 14 1HG GLN 14 -3.075 -7.783 -1.485 81 HG3 GLN 14 2HG GLN 14 -2.322 -8.903 -0.351 82 HE21 GLN 14 1HE2 GLN 14 -3.073 -10.676 -1.526 83 HE22 GLN 14 2HE2 GLN 14 -4.729 -11.168 -1.477 84 H LEU 15 H LEU 15 -5.201 -6.229 2.637 85 HA LEU 15 HA LEU 15 -3.776 -4.314 3.847 86 HB2 LEU 15 1HB LEU 15 -6.299 -5.469 5.023 87 HB3 LEU 15 2HB LEU 15 -5.667 -3.848 5.298 88 HG LEU 15 HG LEU 15 -6.699 -4.914 2.670 89 HD11 LEU 15 1HD1 LEU 15 -8.352 -4.455 4.567 90 HD12 LEU 15 2HD1 LEU 15 -8.642 -3.666 3.017 91 HD13 LEU 15 3HD1 LEU 15 -7.931 -2.756 4.349 92 HD21 LEU 15 3HD2 LEU 15 -5.147 -2.546 3.405 93 HD22 LEU 15 1HD2 LEU 15 -6.612 -2.191 2.490 94 HD23 LEU 15 2HD2 LEU 15 -5.404 -3.292 1.828 95 H LYS 16 H LYS 16 -5.016 -7.128 5.659 96 HA LYS 16 HA LYS 16 -3.617 -6.568 8.032 97 HB2 LYS 16 1HB LYS 16 -4.210 -8.793 8.730 98 HB3 LYS 16 2HB LYS 16 -5.565 -8.112 7.839 99 HG2 LYS 16 1HG LYS 16 -5.242 -9.504 6.023 100 HG3 LYS 16 2HG LYS 16 -3.554 -9.818 6.435 101 HD2 LYS 16 1HD LYS 16 -4.640 -10.878 8.594 102 HD3 LYS 16 2HD LYS 16 -6.043 -11.032 7.534 103 HE2 LYS 16 1HE LYS 16 -3.392 -11.921 6.516 104 HE3 LYS 16 2HE LYS 16 -4.215 -12.933 7.703 105 HZ1 LYS 16 3HZ LYS 16 -5.818 -13.500 6.243 106 HZ2 LYS 16 1HZ LYS 16 -4.625 -13.140 5.099 107 HZ3 LYS 16 2HZ LYS 16 -5.819 -11.999 5.462 108 H VAL 17 H VAL 17 -2.716 -8.302 5.126 109 HA VAL 17 HA VAL 17 -0.391 -9.552 6.170 110 HB VAL 17 HB VAL 17 -1.022 -8.819 3.307 111 HG11 VAL 17 1HG1 VAL 17 0.720 -10.165 2.617 112 HG12 VAL 17 2HG1 VAL 17 1.402 -9.413 4.061 113 HG13 VAL 17 3HG1 VAL 17 0.772 -11.059 4.136 114 HG21 VAL 17 3HG2 VAL 17 -2.395 -10.576 3.193 115 HG22 VAL 17 1HG2 VAL 17 -1.268 -11.612 4.069 116 HG23 VAL 17 2HG2 VAL 17 -2.380 -10.570 4.957 117 H LEU 18 H LEU 18 -1.032 -6.418 4.735 118 HA LEU 18 HA LEU 18 1.686 -5.684 4.335 119 HB2 LEU 18 1HB LEU 18 -0.863 -4.104 4.534 120 HB3 LEU 18 2HB LEU 18 0.704 -3.341 4.273 121 HG LEU 18 HG LEU 18 -0.286 -5.471 2.412 122 HD11 LEU 18 1HD1 LEU 18 -1.318 -3.797 1.023 123 HD12 LEU 18 2HD1 LEU 18 -0.887 -2.528 2.169 124 HD13 LEU 18 3HD1 LEU 18 -2.061 -3.763 2.623 125 HD21 LEU 18 3HD2 LEU 18 1.385 -4.790 1.044 126 HD22 LEU 18 1HD2 LEU 18 2.101 -4.277 2.572 127 HD23 LEU 18 2HD2 LEU 18 1.267 -3.105 1.552 128 H LEU 19 H LEU 19 -0.659 -4.366 6.681 129 HA LEU 19 HA LEU 19 0.966 -2.931 8.291 130 HB2 LEU 19 1HB LEU 19 -1.255 -4.770 9.164 131 HB3 LEU 19 2HB LEU 19 -0.531 -3.528 10.183 132 HG LEU 19 HG LEU 19 -1.937 -2.933 7.585 133 HD11 LEU 19 1HD1 LEU 19 -3.934 -2.880 8.597 134 HD12 LEU 19 2HD1 LEU 19 -3.271 -2.227 10.094 135 HD13 LEU 19 3HD1 LEU 19 -3.184 -3.958 9.774 136 HD21 LEU 19 3HD2 LEU 19 -0.233 -1.324 8.640 137 HD22 LEU 19 1HD2 LEU 19 -1.455 -1.074 9.887 138 HD23 LEU 19 2HD2 LEU 19 -1.821 -0.689 8.204 139 H SER 20 H SER 20 0.379 -6.425 8.653 140 HA SER 20 HA SER 20 1.885 -7.014 10.838 141 HB2 SER 20 1HB SER 20 0.605 -8.677 9.511 142 HB3 SER 20 2HB SER 20 1.870 -8.640 8.283 143 HG SER 20 HG SER 20 3.289 -9.536 9.725 144 H GLY 21 H GLY 21 3.077 -6.434 7.559 145 HA2 GLY 21 1HA GLY 21 5.160 -5.681 6.890 146 HA3 GLY 21 2HA GLY 21 5.646 -5.640 8.578 147 H ALA 22 H ALA 22 6.948 -6.691 6.072 148 HA ALA 22 HA ALA 22 7.557 -9.373 7.126 149 HB1 ALA 22 1HB ALA 22 7.568 -8.701 4.193 150 HB2 ALA 22 2HB ALA 22 7.691 -10.291 4.949 151 HB3 ALA 22 3HB ALA 22 6.172 -9.398 5.017 152 H THR 23 H THR 23 9.704 -10.191 6.295 153 HA THR 23 HA THR 23 11.681 -8.105 6.697 154 HB THR 23 HB THR 23 12.162 -11.061 6.297 155 HG1 THR 23 1HG THR 23 12.110 -9.761 8.808 156 HG21 THR 23 3HG2 THR 23 13.974 -9.045 6.253 157 HG22 THR 23 1HG2 THR 23 14.332 -10.683 6.797 158 HG23 THR 23 2HG2 THR 23 13.947 -9.427 7.974 159 H PHE 24 H PHE 24 13.257 -7.498 5.250 160 HA PHE 24 HA PHE 24 13.398 -8.763 2.642 161 HB2 PHE 24 1HB PHE 24 12.629 -5.852 2.945 162 HB3 PHE 24 2HB PHE 24 13.022 -6.648 1.424 163 HD1 PHE 24 2HD PHE 24 11.563 -8.640 0.735 164 HD2 PHE 24 1HD PHE 24 10.448 -5.826 3.727 165 HE1 PHE 24 2HE PHE 24 9.207 -9.297 0.470 166 HE2 PHE 24 1HE PHE 24 8.090 -6.478 3.467 167 HZ PHE 24 HZ PHE 24 7.466 -8.215 1.836 168 H LEU 25 H LEU 25 15.203 -7.973 1.352 169 HA LEU 25 HA LEU 25 17.385 -7.045 3.074 170 HB2 LEU 25 1HB LEU 25 17.280 -8.589 0.509 171 HB3 LEU 25 2HB LEU 25 18.767 -7.799 1.028 172 HG LEU 25 HG LEU 25 17.290 -9.886 2.629 173 HD11 LEU 25 1HD1 LEU 25 19.494 -10.079 0.621 174 HD12 LEU 25 2HD1 LEU 25 18.083 -11.113 0.843 175 HD13 LEU 25 3HD1 LEU 25 19.430 -11.204 1.978 176 HD21 LEU 25 3HD2 LEU 25 19.733 -9.921 3.630 177 HD22 LEU 25 1HD2 LEU 25 18.515 -8.785 4.210 178 HD23 LEU 25 2HD2 LEU 25 19.738 -8.252 3.056 179 H VAL 26 H VAL 26 17.588 -4.897 3.044 180 HA VAL 26 HA VAL 26 17.086 -3.410 0.584 181 HB VAL 26 HB VAL 26 17.816 -2.320 3.304 182 HG11 VAL 26 1HG1 VAL 26 17.710 -1.091 0.807 183 HG12 VAL 26 2HG1 VAL 26 16.201 -0.637 1.602 184 HG13 VAL 26 3HG1 VAL 26 17.747 -0.297 2.380 185 HG21 VAL 26 3HG2 VAL 26 15.264 -1.754 3.228 186 HG22 VAL 26 1HG2 VAL 26 15.196 -3.133 2.130 187 HG23 VAL 26 2HG2 VAL 26 15.806 -3.341 3.772 188 H THR 27 H THR 27 18.648 -2.690 -0.708 189 HA THR 27 HA THR 27 21.421 -2.748 0.293 190 HB THR 27 HB THR 27 20.784 -2.908 -2.631 191 HG1 THR 27 1HG THR 27 19.674 -4.669 -2.070 192 HG21 THR 27 3HG2 THR 27 23.060 -2.728 -2.387 193 HG22 THR 27 1HG2 THR 27 22.882 -4.480 -2.315 194 HG23 THR 27 2HG2 THR 27 23.069 -3.551 -0.828 195 H PHE 28 H PHE 28 22.581 -0.924 0.197 196 HA PHE 28 HA PHE 28 21.342 1.411 -1.080 197 HB2 PHE 28 1HB PHE 28 23.430 1.215 1.098 198 HB3 PHE 28 2HB PHE 28 22.891 2.730 0.380 199 HD1 PHE 28 2HD PHE 28 20.342 3.198 0.482 200 HD2 PHE 28 1HD PHE 28 22.356 0.386 2.962 201 HE1 PHE 28 2HE PHE 28 18.494 3.309 2.102 202 HE2 PHE 28 1HE PHE 28 20.510 0.491 4.586 203 HZ PHE 28 HZ PHE 28 18.576 1.955 4.157 204 H GLY 29 H GLY 29 22.558 2.810 -2.391 205 HA2 GLY 29 1HA GLY 29 24.292 1.617 -4.213 206 HA3 GLY 29 2HA GLY 29 24.118 3.350 -3.986 207 H ASN 30 H ASN 30 24.970 2.914 -1.090 208 HA ASN 30 HA ASN 30 27.800 3.253 -1.605 209 HB2 ASN 30 1HB ASN 30 26.048 3.602 0.816 210 HB3 ASN 30 2HB ASN 30 27.804 3.626 0.955 211 HD21 ASN 30 1HD2 ASN 30 25.715 5.708 1.345 212 HD22 ASN 30 2HD2 ASN 30 26.216 7.032 0.354 213 H SER 31 H SER 31 25.659 0.918 -0.105 214 HA SER 31 HA SER 31 27.953 -0.731 0.681 215 HB2 SER 31 1HB SER 31 26.398 -2.002 2.033 216 HB3 SER 31 2HB SER 31 26.156 -0.286 2.359 217 HG SER 31 HG SER 31 24.146 -1.062 2.044 218 H GLU 32 H GLU 32 28.481 -2.549 -0.364 219 HA GLU 32 HA GLU 32 27.015 -3.231 -2.769 220 HB2 GLU 32 1HB GLU 32 29.536 -4.439 -1.616 221 HB3 GLU 32 2HB GLU 32 28.880 -4.762 -3.214 222 HG2 GLU 32 1HG GLU 32 29.095 -2.213 -3.562 223 HG3 GLU 32 2HG GLU 32 30.186 -2.284 -2.179 224 H LYS 33 H LYS 33 27.173 -4.278 0.471 225 HA LYS 33 HA LYS 33 25.970 -6.874 -0.204 226 HB2 LYS 33 1HB LYS 33 27.663 -7.417 1.244 227 HB3 LYS 33 2HB LYS 33 27.582 -5.875 2.087 228 HG2 LYS 33 1HG LYS 33 25.906 -6.574 3.492 229 HG3 LYS 33 2HG LYS 33 25.328 -7.804 2.366 230 HD2 LYS 33 1HD LYS 33 28.055 -8.042 3.573 231 HD3 LYS 33 2HD LYS 33 26.633 -8.515 4.507 232 HE2 LYS 33 1HE LYS 33 27.310 -9.562 1.761 233 HE3 LYS 33 2HE LYS 33 27.688 -10.392 3.269 234 HZ1 LYS 33 3HZ LYS 33 24.976 -9.702 3.299 235 HZ2 LYS 33 1HZ LYS 33 25.663 -11.248 3.264 236 HZ3 LYS 33 2HZ LYS 33 25.300 -10.451 1.817 237 HA PRO 34 HA PRO 34 22.021 -5.359 1.055 238 HB2 PRO 34 1HB PRO 34 20.791 -7.752 1.414 239 HB3 PRO 34 2HB PRO 34 21.142 -7.083 -0.184 240 HG2 PRO 34 1HG PRO 34 22.647 -9.147 1.379 241 HG3 PRO 34 2HG PRO 34 22.243 -9.125 -0.348 242 HD2 PRO 34 1HD PRO 34 24.690 -8.434 0.586 243 HD3 PRO 34 2HD PRO 34 23.977 -7.696 -0.864 244 H GLU 35 H GLU 35 20.559 -5.394 2.878 245 HA GLU 35 HA GLU 35 21.686 -6.554 5.332 246 HB2 GLU 35 1HB GLU 35 22.341 -4.221 5.323 247 HB3 GLU 35 2HB GLU 35 20.691 -3.723 4.978 248 HG2 GLU 35 1HG GLU 35 19.998 -4.663 7.159 249 HG3 GLU 35 2HG GLU 35 21.690 -5.015 7.504 250 H THR 36 H THR 36 20.228 -7.377 6.752 251 HA THR 36 HA THR 36 17.557 -7.808 5.803 252 HB THR 36 HB THR 36 18.537 -8.506 8.564 253 HG1 THR 36 1HG THR 36 19.679 -10.137 7.752 254 HG21 THR 36 3HG2 THR 36 16.450 -9.590 6.688 255 HG22 THR 36 1HG2 THR 36 16.238 -8.971 8.326 256 HG23 THR 36 2HG2 THR 36 17.046 -10.517 8.065 257 H MET 37 H MET 37 15.933 -6.434 6.063 258 HA MET 37 HA MET 37 15.742 -4.925 8.574 259 HB2 MET 37 1HB MET 37 15.394 -3.798 5.793 260 HB3 MET 37 2HB MET 37 14.921 -2.957 7.263 261 HG2 MET 37 1HG MET 37 17.286 -3.097 8.022 262 HG3 MET 37 2HG MET 37 17.699 -3.762 6.444 263 HE1 MET 37 3HE MET 37 18.547 -1.021 8.206 264 HE2 MET 37 1HE MET 37 17.922 0.472 7.505 265 HE3 MET 37 2HE MET 37 16.873 -0.543 8.496 266 H THR 38 H THR 38 13.472 -3.783 8.602 267 HA THR 38 HA THR 38 11.478 -5.746 7.671 268 HB THR 38 HB THR 38 11.210 -4.088 10.179 269 HG1 THR 38 1HG THR 38 12.979 -5.834 10.012 270 HG21 THR 38 3HG2 THR 38 9.453 -5.791 8.700 271 HG22 THR 38 1HG2 THR 38 9.130 -4.885 10.178 272 HG23 THR 38 2HG2 THR 38 9.777 -6.523 10.271 273 H CYS 39 H CYS 39 9.986 -4.962 6.343 274 HA CYS 39 HA CYS 39 9.523 -2.053 6.319 275 HB2 CYS 39 1HB CYS 39 9.138 -3.998 4.035 276 HB3 CYS 39 2HB CYS 39 8.968 -2.248 3.962 277 HG CYS 39 HG CYS 39 11.407 -3.468 2.788 278 H ARG 40 H ARG 40 7.603 -1.425 7.026 279 HA ARG 40 HA ARG 40 5.259 -3.097 6.501 280 HB2 ARG 40 1HB ARG 40 4.491 -3.063 8.737 281 HB3 ARG 40 2HB ARG 40 6.183 -3.532 8.827 282 HG2 ARG 40 1HG ARG 40 6.739 -1.158 9.351 283 HG3 ARG 40 2HG ARG 40 5.006 -0.833 9.440 284 HD2 ARG 40 1HD ARG 40 6.250 -3.029 11.056 285 HD3 ARG 40 2HD ARG 40 6.291 -1.358 11.617 286 HE ARG 40 HE ARG 40 3.659 -2.146 10.883 287 HH11 ARG 40 1HH1 ARG 40 6.046 -2.424 13.402 288 HH12 ARG 40 2HH1 ARG 40 4.879 -2.669 14.660 289 HH21 ARG 40 1HH2 ARG 40 2.114 -2.468 12.530 290 HH22 ARG 40 2HH2 ARG 40 2.643 -2.695 14.162 291 H LEU 41 H LEU 41 3.203 -1.887 7.026 292 HA LEU 41 HA LEU 41 3.520 0.904 6.168 293 HB2 LEU 41 1HB LEU 41 1.449 -1.178 5.751 294 HB3 LEU 41 2HB LEU 41 0.911 0.497 5.840 295 HG LEU 41 HG LEU 41 3.059 -0.387 3.932 296 HD11 LEU 41 1HD1 LEU 41 1.113 -0.292 2.250 297 HD12 LEU 41 2HD1 LEU 41 0.082 -0.553 3.657 298 HD13 LEU 41 3HD1 LEU 41 1.310 -1.745 3.231 299 HD21 LEU 41 3HD2 LEU 41 1.178 1.970 3.999 300 HD22 LEU 41 1HD2 LEU 41 2.343 1.626 2.720 301 HD23 LEU 41 2HD2 LEU 41 2.907 1.998 4.350 302 H SER 42 H SER 42 2.046 2.509 7.061 303 HA SER 42 HA SER 42 1.855 2.243 9.927 304 HB2 SER 42 1HB SER 42 1.206 4.598 9.900 305 HB3 SER 42 2HB SER 42 2.620 4.351 8.876 306 HG SER 42 HG SER 42 0.004 5.011 8.182 307 H ASN 43 H ASN 43 -0.233 3.298 10.918 308 HA ASN 43 HA ASN 43 -2.301 1.532 10.780 309 HB2 ASN 43 1HB ASN 43 -2.040 3.327 12.491 310 HB3 ASN 43 2HB ASN 43 -2.626 4.493 11.309 311 HD21 ASN 43 1HD2 ASN 43 -4.547 5.085 12.054 312 HD22 ASN 43 2HD2 ASN 43 -5.840 4.011 12.454 313 H ASN 44 H ASN 44 -2.189 4.657 9.065 314 HA ASN 44 HA ASN 44 -4.486 3.907 7.460 315 HB2 ASN 44 1HB ASN 44 -3.819 6.284 8.406 316 HB3 ASN 44 2HB ASN 44 -2.878 6.369 6.920 317 HD21 ASN 44 1HD2 ASN 44 -4.942 8.113 7.443 318 HD22 ASN 44 2HD2 ASN 44 -6.238 7.809 6.341 319 H GLN 45 H GLN 45 -1.253 3.274 7.333 320 HA GLN 45 HA GLN 45 0.151 2.474 5.733 321 HB2 GLN 45 1HB GLN 45 -2.377 2.222 4.095 322 HB3 GLN 45 2HB GLN 45 -0.842 1.436 3.748 323 HG2 GLN 45 1HG GLN 45 -1.062 -0.067 5.473 324 HG3 GLN 45 2HG GLN 45 -2.164 0.971 6.377 325 HE21 GLN 45 1HE2 GLN 45 -3.665 -0.671 6.643 326 HE22 GLN 45 2HE2 GLN 45 -4.651 -1.241 5.345 327 H ARG 46 H ARG 46 -0.376 5.325 5.902 328 HA ARG 46 HA ARG 46 -0.163 6.216 3.125 329 HB2 ARG 46 1HB ARG 46 -0.791 7.535 5.721 330 HB3 ARG 46 2HB ARG 46 -0.047 8.513 4.463 331 HG2 ARG 46 1HG ARG 46 -1.857 8.003 2.945 332 HG3 ARG 46 2HG ARG 46 -2.583 6.923 4.138 333 HD2 ARG 46 1HD ARG 46 -3.286 8.655 5.478 334 HD3 ARG 46 2HD ARG 46 -2.037 9.753 4.893 335 HE ARG 46 HE ARG 46 -4.658 9.480 3.865 336 HH11 ARG 46 1HH1 ARG 46 -1.363 9.999 2.868 337 HH12 ARG 46 2HH1 ARG 46 -1.797 10.864 1.431 338 HH21 ARG 46 1HH2 ARG 46 -5.242 10.618 1.976 339 HH22 ARG 46 2HH2 ARG 46 -4.003 11.216 0.925 340 H TYR 47 H TYR 47 1.894 5.015 5.305 341 HA TYR 47 HA TYR 47 4.177 6.275 4.077 342 HB2 TYR 47 1HB TYR 47 3.841 6.510 7.072 343 HB3 TYR 47 2HB TYR 47 5.195 7.098 6.114 344 HD1 TYR 47 2HD TYR 47 1.687 7.669 7.032 345 HD2 TYR 47 1HD TYR 47 5.023 9.141 4.839 346 HE1 TYR 47 2HE TYR 47 0.551 9.835 6.769 347 HE2 TYR 47 1HE TYR 47 3.896 11.311 4.570 348 HH TYR 47 HH TYR 47 1.595 12.206 4.593 349 H LEU 48 H LEU 48 6.094 5.103 4.352 350 HA LEU 48 HA LEU 48 5.689 2.399 5.426 351 HB2 LEU 48 1HB LEU 48 7.616 3.481 3.382 352 HB3 LEU 48 2HB LEU 48 7.707 1.846 4.032 353 HG LEU 48 HG LEU 48 5.269 2.883 2.608 354 HD11 LEU 48 1HD1 LEU 48 7.761 2.572 1.435 355 HD12 LEU 48 2HD1 LEU 48 6.203 2.611 0.610 356 HD13 LEU 48 3HD1 LEU 48 6.916 1.066 1.074 357 HD21 LEU 48 3HD2 LEU 48 6.269 0.198 3.489 358 HD22 LEU 48 1HD2 LEU 48 5.087 0.355 2.190 359 HD23 LEU 48 2HD2 LEU 48 4.710 0.962 3.803 360 H PHE 49 H PHE 49 7.194 1.450 6.795 361 HA PHE 49 HA PHE 49 9.178 3.288 7.966 362 HB2 PHE 49 1HB PHE 49 7.666 1.138 9.458 363 HB3 PHE 49 2HB PHE 49 8.755 2.340 10.144 364 HD1 PHE 49 1HD PHE 49 7.708 4.670 8.440 365 HD2 PHE 49 2HD PHE 49 5.768 1.690 10.779 366 HE1 PHE 49 1HE PHE 49 5.806 6.191 8.794 367 HE2 PHE 49 2HE PHE 49 3.863 3.205 11.137 368 HZ PHE 49 HZ PHE 49 3.880 5.458 10.143 369 H LEU 50 H LEU 50 11.144 2.398 8.658 370 HA LEU 50 HA LEU 50 11.672 -0.354 7.756 371 HB2 LEU 50 1HB LEU 50 13.548 1.991 7.499 372 HB3 LEU 50 2HB LEU 50 13.864 0.336 6.980 373 HG LEU 50 HG LEU 50 11.848 2.238 5.788 374 HD11 LEU 50 1HD1 LEU 50 13.342 2.712 4.183 375 HD12 LEU 50 2HD1 LEU 50 13.980 1.069 4.147 376 HD13 LEU 50 3HD1 LEU 50 14.528 2.200 5.384 377 HD21 LEU 50 3HD2 LEU 50 12.240 0.016 4.130 378 HD22 LEU 50 1HD2 LEU 50 10.785 0.442 5.031 379 HD23 LEU 50 2HD2 LEU 50 11.985 -0.632 5.751 380 H ASP 51 H ASP 51 13.348 -1.473 8.873 381 HA ASP 51 HA ASP 51 14.282 -0.258 11.368 382 HB2 ASP 51 1HB ASP 51 12.892 -2.941 11.206 383 HB3 ASP 51 2HB ASP 51 13.676 -2.285 12.641 384 H GLY 52 H GLY 52 16.365 -0.678 11.759 385 HA2 GLY 52 1HA GLY 52 17.696 -3.087 11.357 386 HA3 GLY 52 2HA GLY 52 17.925 -2.137 9.897 387 H ASP 53 H ASP 53 19.778 -1.075 9.869 388 HA ASP 53 HA ASP 53 21.503 -0.798 12.037 389 HB2 ASP 53 1HB ASP 53 21.333 0.418 9.320 390 HB3 ASP 53 2HB ASP 53 22.429 1.156 10.485 391 H SER 54 H SER 54 19.178 1.504 10.681 392 HA SER 54 HA SER 54 19.109 2.904 13.228 393 HB2 SER 54 1HB SER 54 20.127 4.109 10.681 394 HB3 SER 54 2HB SER 54 19.234 5.121 11.816 395 HG SER 54 HG SER 54 21.626 3.676 12.289 396 H HIS 55 H HIS 55 17.432 4.771 13.047 397 HA HIS 55 HA HIS 55 14.975 3.593 12.227 398 HB2 HIS 55 1HB HIS 55 15.772 6.203 13.455 399 HB3 HIS 55 2HB HIS 55 14.148 6.026 12.796 400 HD2 HIS 55 2HD HIS 55 15.679 5.739 16.103 401 HE1 HIS 55 1HE HIS 55 12.739 2.680 16.093 402 HE2 HIS 55 2HE HIS 55 14.230 4.128 17.516 403 H TYR 56 H TYR 56 14.558 3.376 10.115 404 HA TYR 56 HA TYR 56 14.892 5.750 8.401 405 HB2 TYR 56 1HB TYR 56 15.450 2.860 7.886 406 HB3 TYR 56 2HB TYR 56 14.912 3.867 6.547 407 HD1 TYR 56 1HD TYR 56 16.294 5.773 5.796 408 HD2 TYR 56 2HD TYR 56 17.653 3.081 8.797 409 HE1 TYR 56 1HE TYR 56 18.592 6.588 5.477 410 HE2 TYR 56 2HE TYR 56 19.955 3.890 8.487 411 HH TYR 56 HH TYR 56 20.807 6.058 5.887 412 H GLU 57 H GLU 57 13.277 6.180 6.869 413 HA GLU 57 HA GLU 57 10.918 4.525 6.733 414 HB2 GLU 57 1HB GLU 57 9.360 6.204 7.549 415 HB3 GLU 57 2HB GLU 57 10.522 5.798 8.805 416 HG2 GLU 57 1HG GLU 57 10.683 8.223 7.030 417 HG3 GLU 57 2HG GLU 57 10.036 8.207 8.670 418 H ILE 58 H ILE 58 9.743 4.877 4.897 419 HA ILE 58 HA ILE 58 10.630 7.098 3.173 420 HB ILE 58 HB ILE 58 9.831 4.314 2.315 421 HG12 ILE 58 1HG1 ILE 58 12.486 5.603 1.787 422 HG13 ILE 58 2HG1 ILE 58 12.180 4.849 3.347 423 HG21 ILE 58 1HG2 ILE 58 9.447 5.111 0.281 424 HG22 ILE 58 2HG2 ILE 58 9.641 6.745 0.913 425 HG23 ILE 58 3HG2 ILE 58 11.030 5.886 0.249 426 HD11 ILE 58 3HD1 ILE 58 11.444 2.814 1.905 427 HD12 ILE 58 1HD1 ILE 58 12.401 3.604 0.652 428 HD13 ILE 58 2HD1 ILE 58 13.156 3.138 2.177 429 H GLU 59 H GLU 59 8.989 8.525 3.431 430 HA GLU 59 HA GLU 59 6.269 7.838 3.728 431 HB2 GLU 59 1HB GLU 59 5.927 10.294 3.032 432 HB3 GLU 59 2HB GLU 59 6.828 9.968 4.506 433 HG2 GLU 59 1HG GLU 59 8.337 10.259 1.965 434 HG3 GLU 59 2HG GLU 59 7.675 11.705 2.724 435 H ILE 60 H ILE 60 4.656 7.527 2.294 436 HA ILE 60 HA ILE 60 5.309 6.914 -0.404 437 HB ILE 60 HB ILE 60 2.608 7.215 0.914 438 HG12 ILE 60 1HG1 ILE 60 4.216 4.739 0.253 439 HG13 ILE 60 2HG1 ILE 60 4.059 5.440 1.860 440 HG21 ILE 60 1HG2 ILE 60 1.860 5.789 -1.036 441 HG22 ILE 60 2HG2 ILE 60 2.254 7.466 -1.408 442 HG23 ILE 60 3HG2 ILE 60 3.401 6.185 -1.797 443 HD11 ILE 60 3HD1 ILE 60 1.460 5.138 1.168 444 HD12 ILE 60 1HD1 ILE 60 2.200 3.769 0.339 445 HD13 ILE 60 2HD1 ILE 60 2.401 3.959 2.081 446 H VAL 61 H VAL 61 4.479 9.808 1.178 447 HA VAL 61 HA VAL 61 3.149 11.146 -0.946 448 HB VAL 61 HB VAL 61 3.708 13.226 0.289 449 HG11 VAL 61 1HG1 VAL 61 2.757 11.250 2.317 450 HG12 VAL 61 2HG1 VAL 61 2.151 12.867 1.951 451 HG13 VAL 61 3HG1 VAL 61 1.810 11.527 0.856 452 HG21 VAL 61 3HG2 VAL 61 5.417 13.315 1.707 453 HG22 VAL 61 1HG2 VAL 61 4.704 12.037 2.690 454 HG23 VAL 61 2HG2 VAL 61 5.774 11.625 1.350 455 H HIS 62 H HIS 62 6.441 10.389 -0.322 456 HA HIS 62 HA HIS 62 7.404 12.400 -2.217 457 HB2 HIS 62 1HB HIS 62 8.668 10.719 -0.110 458 HB3 HIS 62 2HB HIS 62 9.660 11.172 -1.493 459 HD2 HIS 62 2HD HIS 62 7.540 13.078 1.253 460 HE1 HIS 62 1HE HIS 62 10.761 15.526 -0.023 461 HE2 HIS 62 2HE HIS 62 8.866 15.269 1.615 462 H ILE 63 H ILE 63 7.235 8.903 -1.759 463 HA ILE 63 HA ILE 63 8.735 7.976 -3.853 464 HB ILE 63 HB ILE 63 6.045 6.882 -3.023 465 HG12 ILE 63 1HG1 ILE 63 8.827 6.274 -2.000 466 HG13 ILE 63 2HG1 ILE 63 7.558 7.113 -1.114 467 HG21 ILE 63 1HG2 ILE 63 6.365 5.211 -4.452 468 HG22 ILE 63 2HG2 ILE 63 7.709 6.128 -5.130 469 HG23 ILE 63 3HG2 ILE 63 8.003 4.942 -3.858 470 HD11 ILE 63 3HD1 ILE 63 7.090 5.118 -0.255 471 HD12 ILE 63 1HD1 ILE 63 6.342 4.764 -1.812 472 HD13 ILE 63 2HD1 ILE 63 8.005 4.267 -1.498 473 H SER 64 H SER 64 8.613 7.959 -6.017 474 HA SER 64 HA SER 64 6.221 9.156 -7.250 475 HB2 SER 64 1HB SER 64 8.607 10.234 -7.437 476 HB3 SER 64 2HB SER 64 8.863 8.990 -8.660 477 HG SER 64 HG SER 64 6.520 10.504 -8.798 478 H THR 65 H THR 65 8.785 6.763 -7.867 479 HA THR 65 HA THR 65 6.959 5.361 -9.693 480 HB THR 65 HB THR 65 9.939 4.959 -9.367 481 HG1 THR 65 1HG THR 65 9.391 7.027 -10.252 482 HG21 THR 65 3HG2 THR 65 8.314 4.134 -11.741 483 HG22 THR 65 1HG2 THR 65 8.365 3.105 -10.310 484 HG23 THR 65 2HG2 THR 65 9.856 3.500 -11.165 485 H VAL 66 H VAL 66 6.211 3.371 -9.244 486 HA VAL 66 HA VAL 66 7.402 1.888 -7.004 487 HB VAL 66 HB VAL 66 4.438 2.321 -7.402 488 HG11 VAL 66 1HG1 VAL 66 5.722 0.907 -5.090 489 HG12 VAL 66 2HG1 VAL 66 4.036 0.879 -5.610 490 HG13 VAL 66 3HG1 VAL 66 5.267 0.043 -6.558 491 HG21 VAL 66 3HG2 VAL 66 5.206 3.100 -4.834 492 HG22 VAL 66 1HG2 VAL 66 6.434 3.768 -5.909 493 HG23 VAL 66 2HG2 VAL 66 4.732 4.151 -6.169 494 H GLN 67 H GLN 67 8.261 0.224 -8.122 495 HA GLN 67 HA GLN 67 6.398 -1.428 -9.683 496 HB2 GLN 67 1HB GLN 67 8.029 -1.839 -11.376 497 HB3 GLN 67 2HB GLN 67 7.929 -0.096 -11.166 498 HG2 GLN 67 1HG GLN 67 9.937 -0.263 -9.672 499 HG3 GLN 67 2HG GLN 67 10.081 -1.945 -10.179 500 HE21 GLN 67 1HE2 GLN 67 11.687 -2.116 -11.562 501 HE22 GLN 67 2HE2 GLN 67 12.013 -1.050 -12.882 502 H ILE 68 H ILE 68 7.028 -3.688 -9.845 503 HA ILE 68 HA ILE 68 8.467 -4.552 -7.434 504 HB ILE 68 HB ILE 68 6.411 -5.955 -9.135 505 HG12 ILE 68 1HG1 ILE 68 6.425 -5.226 -6.199 506 HG13 ILE 68 2HG1 ILE 68 5.613 -4.300 -7.457 507 HG21 ILE 68 1HG2 ILE 68 6.748 -7.667 -7.116 508 HG22 ILE 68 2HG2 ILE 68 7.637 -7.794 -8.632 509 HG23 ILE 68 3HG2 ILE 68 8.394 -7.043 -7.228 510 HD11 ILE 68 3HD1 ILE 68 4.745 -6.977 -7.685 511 HD12 ILE 68 1HD1 ILE 68 4.657 -6.527 -5.982 512 HD13 ILE 68 2HD1 ILE 68 3.820 -5.558 -7.195 513 H LEU 69 H LEU 69 10.068 -6.121 -7.522 514 HA LEU 69 HA LEU 69 11.446 -6.304 -10.072 515 HB2 LEU 69 1HB LEU 69 12.214 -7.215 -7.304 516 HB3 LEU 69 2HB LEU 69 13.242 -7.367 -8.728 517 HG LEU 69 HG LEU 69 12.319 -4.790 -7.457 518 HD11 LEU 69 1HD1 LEU 69 14.217 -4.771 -6.293 519 HD12 LEU 69 2HD1 LEU 69 15.171 -5.282 -7.685 520 HD13 LEU 69 3HD1 LEU 69 14.355 -6.485 -6.686 521 HD21 LEU 69 3HD2 LEU 69 13.551 -5.415 -10.061 522 HD22 LEU 69 1HD2 LEU 69 14.284 -4.089 -9.157 523 HD23 LEU 69 2HD2 LEU 69 12.570 -4.034 -9.567 524 H THR 70 H THR 70 11.169 -7.951 -11.409 525 HA THR 70 HA THR 70 10.534 -10.598 -10.291 526 HB THR 70 HB THR 70 8.991 -11.053 -12.111 527 HG1 THR 70 1HG THR 70 9.162 -8.341 -12.913 528 HG21 THR 70 3HG2 THR 70 7.361 -9.009 -11.604 529 HG22 THR 70 1HG2 THR 70 8.543 -8.720 -10.328 530 HG23 THR 70 2HG2 THR 70 7.692 -10.263 -10.409 531 H GLU 71 H GLU 71 12.324 -11.748 -10.672 532 HA GLU 71 HA GLU 71 13.868 -11.329 -13.097 533 HB2 GLU 71 1HB GLU 71 14.977 -11.637 -10.888 534 HB3 GLU 71 2HB GLU 71 14.347 -13.277 -10.837 535 HG2 GLU 71 1HG GLU 71 15.607 -13.817 -12.866 536 HG3 GLU 71 2HG GLU 71 16.255 -12.178 -12.888 537 H GLY 72 H GLY 72 14.114 -12.784 -14.750 538 HA2 GLY 72 1HA GLY 72 12.060 -14.862 -14.898 539 HA3 GLY 72 2HA GLY 72 12.989 -14.224 -16.247 540 H PHE 73 H PHE 73 13.334 -16.159 -13.288 541 HA PHE 73 HA PHE 73 15.382 -17.745 -14.693 542 HB2 PHE 73 1HB PHE 73 16.663 -17.938 -12.764 543 HB3 PHE 73 2HB PHE 73 16.073 -16.284 -12.645 544 HD1 PHE 73 1HD PHE 73 14.414 -15.667 -10.995 545 HD2 PHE 73 2HD PHE 73 15.867 -19.658 -11.272 546 HE1 PHE 73 1HE PHE 73 13.463 -16.164 -8.780 547 HE2 PHE 73 2HE PHE 73 14.917 -20.162 -9.059 548 HZ PHE 73 HZ PHE 73 13.712 -18.414 -7.810 549 HA PRO 74 HA PRO 74 12.811 -21.260 -14.099 550 HB2 PRO 74 1HB PRO 74 14.691 -23.218 -14.091 551 HB3 PRO 74 2HB PRO 74 14.210 -22.354 -15.556 552 HG2 PRO 74 1HG PRO 74 16.594 -21.921 -13.798 553 HG3 PRO 74 2HG PRO 74 16.497 -21.931 -15.568 554 HD2 PRO 74 1HD PRO 74 16.575 -19.640 -14.127 555 HD3 PRO 74 2HD PRO 74 15.694 -19.773 -15.663 556 HA PRO 75 HA PRO 75 13.153 -21.538 -9.598 557 HB2 PRO 75 1HB PRO 75 10.602 -22.394 -9.238 558 HB3 PRO 75 2HB PRO 75 11.019 -20.695 -9.489 559 HG2 PRO 75 1HG PRO 75 9.985 -22.702 -11.455 560 HG3 PRO 75 2HG PRO 75 9.516 -21.006 -11.236 561 HD2 PRO 75 1HD PRO 75 11.205 -21.810 -13.194 562 HD3 PRO 75 2HD PRO 75 11.335 -20.220 -12.413 563 H GLY 76 H GLY 76 12.637 -23.336 -8.041 564 HA2 GLY 76 1HA GLY 76 12.770 -25.977 -9.348 565 HA3 GLY 76 2HA GLY 76 13.914 -25.544 -8.086 566 H GLY 77 H GLY 77 12.563 -24.489 -6.107 567 HA2 GLY 77 1HA GLY 77 10.449 -26.461 -5.489 568 HA3 GLY 77 2HA GLY 77 11.642 -25.939 -4.310 569 H GLY 78 H GLY 78 11.704 -23.332 -4.306 570 HA2 GLY 78 1HA GLY 78 9.212 -22.579 -3.154 571 HA3 GLY 78 2HA GLY 78 10.594 -21.525 -3.413 572 H ASN 79 H ASN 79 7.449 -22.218 -4.339 573 HA ASN 79 HA ASN 79 7.654 -21.115 -7.011 574 HB2 ASN 79 1HB ASN 79 6.059 -22.953 -6.468 575 HB3 ASN 79 2HB ASN 79 5.176 -21.835 -5.432 576 HD21 ASN 79 1HD2 ASN 79 3.299 -21.707 -6.514 577 HD22 ASN 79 2HD2 ASN 79 3.139 -21.112 -8.128 578 H ALA 80 H ALA 80 7.842 -18.996 -7.276 579 HA ALA 80 HA ALA 80 5.953 -17.193 -6.074 580 HB1 ALA 80 1HB ALA 80 8.028 -17.615 -4.467 581 HB2 ALA 80 2HB ALA 80 8.745 -16.378 -5.501 582 HB3 ALA 80 3HB ALA 80 7.257 -16.035 -4.618 583 H ARG 81 H ARG 81 5.698 -15.348 -7.258 584 HA ARG 81 HA ARG 81 7.145 -15.238 -9.780 585 HB2 ARG 81 1HB ARG 81 4.657 -13.920 -8.729 586 HB3 ARG 81 2HB ARG 81 5.436 -13.338 -10.194 587 HG2 ARG 81 1HG ARG 81 5.249 -15.688 -11.087 588 HG3 ARG 81 2HG ARG 81 4.216 -16.038 -9.699 589 HD2 ARG 81 1HD ARG 81 2.745 -15.496 -11.454 590 HD3 ARG 81 2HD ARG 81 2.808 -14.059 -10.433 591 HE ARG 81 HE ARG 81 3.634 -12.917 -12.219 592 HH11 ARG 81 1HH1 ARG 81 4.278 -16.306 -12.690 593 HH12 ARG 81 2HH1 ARG 81 4.953 -16.092 -14.271 594 HH21 ARG 81 1HH2 ARG 81 4.522 -12.622 -14.300 595 HH22 ARG 81 2HH2 ARG 81 5.092 -13.996 -15.186 596 H ALA 82 H ALA 82 6.170 -12.840 -7.321 597 HA ALA 82 HA ALA 82 8.068 -10.910 -8.219 598 HB1 ALA 82 1HB ALA 82 6.419 -11.061 -5.701 599 HB2 ALA 82 2HB ALA 82 7.413 -9.678 -6.160 600 HB3 ALA 82 3HB ALA 82 6.048 -10.156 -7.169 601 H THR 83 H THR 83 10.185 -11.039 -7.917 602 HA THR 83 HA THR 83 11.216 -12.515 -5.599 603 HB THR 83 HB THR 83 13.339 -12.639 -6.772 604 HG1 THR 83 1HG THR 83 13.147 -10.595 -7.874 605 HG21 THR 83 3HG2 THR 83 12.697 -14.347 -8.097 606 HG22 THR 83 1HG2 THR 83 11.578 -13.344 -9.020 607 HG23 THR 83 2HG2 THR 83 11.090 -14.003 -7.458 608 H GLY 84 H GLY 84 10.155 -9.852 -5.299 609 HA2 GLY 84 1HA GLY 84 11.565 -8.593 -3.505 610 HA3 GLY 84 2HA GLY 84 12.559 -8.215 -4.904 611 H MET 85 H MET 85 12.090 -5.977 -4.334 612 HA MET 85 HA MET 85 9.818 -5.009 -5.830 613 HB2 MET 85 1HB MET 85 8.682 -5.244 -3.762 614 HB3 MET 85 2HB MET 85 10.046 -4.607 -2.853 615 HG2 MET 85 1HG MET 85 8.420 -2.910 -2.882 616 HG3 MET 85 2HG MET 85 9.664 -2.419 -4.029 617 HE1 MET 85 3HE MET 85 6.352 -3.883 -3.328 618 HE2 MET 85 1HE MET 85 5.743 -2.305 -3.832 619 HE3 MET 85 2HE MET 85 5.393 -3.736 -4.801 620 H PHE 86 H PHE 86 10.054 -2.883 -6.518 621 HA PHE 86 HA PHE 86 12.569 -1.556 -5.750 622 HB2 PHE 86 1HB PHE 86 12.480 -2.700 -8.078 623 HB3 PHE 86 2HB PHE 86 11.440 -1.353 -8.528 624 HD1 PHE 86 2HD PHE 86 14.723 -1.985 -6.873 625 HD2 PHE 86 1HD PHE 86 12.419 0.510 -9.439 626 HE1 PHE 86 2HE PHE 86 16.711 -0.603 -7.309 627 HE2 PHE 86 1HE PHE 86 14.404 1.896 -9.880 628 HZ PHE 86 HZ PHE 86 16.554 1.341 -8.814 629 H LEU 87 H LEU 87 12.307 0.441 -5.010 630 HA LEU 87 HA LEU 87 9.930 1.960 -5.848 631 HB2 LEU 87 1HB LEU 87 11.105 1.878 -3.073 632 HB3 LEU 87 2HB LEU 87 9.737 2.862 -3.590 633 HG LEU 87 HG LEU 87 9.548 -0.096 -3.887 634 HD11 LEU 87 1HD1 LEU 87 10.471 0.482 -1.576 635 HD12 LEU 87 2HD1 LEU 87 8.999 -0.486 -1.649 636 HD13 LEU 87 3HD1 LEU 87 8.904 1.235 -1.276 637 HD21 LEU 87 3HD2 LEU 87 7.553 2.012 -3.067 638 HD22 LEU 87 1HD2 LEU 87 7.212 0.331 -3.480 639 HD23 LEU 87 2HD2 LEU 87 7.797 1.442 -4.719 640 H GLN 88 H GLN 88 10.153 4.266 -5.774 641 HA GLN 88 HA GLN 88 12.924 5.234 -5.640 642 HB2 GLN 88 1HB GLN 88 10.925 5.823 -7.829 643 HB3 GLN 88 2HB GLN 88 12.457 6.664 -7.630 644 HG2 GLN 88 1HG GLN 88 13.588 4.431 -7.849 645 HG3 GLN 88 2HG GLN 88 12.020 3.772 -8.313 646 HE21 GLN 88 1HE2 GLN 88 14.264 6.387 -9.135 647 HE22 GLN 88 2HE2 GLN 88 13.974 6.335 -10.837 648 H TYR 89 H TYR 89 13.195 7.178 -4.679 649 HA TYR 89 HA TYR 89 10.953 8.978 -4.309 650 HB2 TYR 89 1HB TYR 89 11.343 9.057 -1.815 651 HB3 TYR 89 2HB TYR 89 10.581 7.584 -2.407 652 HD1 TYR 89 1HD TYR 89 13.688 9.029 -1.062 653 HD2 TYR 89 2HD TYR 89 11.694 5.463 -2.250 654 HE1 TYR 89 1HE TYR 89 15.439 7.693 0.032 655 HE2 TYR 89 2HE TYR 89 13.439 4.117 -1.158 656 HH TYR 89 HH TYR 89 15.961 4.525 -0.541 657 H THR 90 H THR 90 11.565 11.080 -3.767 658 HA THR 90 HA THR 90 14.433 11.616 -4.106 659 HB THR 90 HB THR 90 13.778 13.901 -4.726 660 HG1 THR 90 1HG THR 90 11.194 12.914 -4.109 661 HG21 THR 90 3HG2 THR 90 12.206 11.819 -6.249 662 HG22 THR 90 1HG2 THR 90 13.924 12.155 -6.463 663 HG23 THR 90 2HG2 THR 90 12.728 13.389 -6.859 664 H VAL 91 H VAL 91 15.560 12.933 -2.700 665 HA VAL 91 HA VAL 91 14.291 13.326 -0.083 666 HB VAL 91 HB VAL 91 17.196 13.205 -0.890 667 HG11 VAL 91 1HG1 VAL 91 16.838 13.205 1.940 668 HG12 VAL 91 2HG1 VAL 91 17.767 14.324 0.940 669 HG13 VAL 91 3HG1 VAL 91 16.061 14.637 1.265 670 HG21 VAL 91 3HG2 VAL 91 16.442 11.018 -0.738 671 HG22 VAL 91 1HG2 VAL 91 17.055 11.321 0.888 672 HG23 VAL 91 2HG2 VAL 91 15.321 11.387 0.573 673 HA PRO 92 HA PRO 92 14.132 17.687 -0.857 674 HB2 PRO 92 1HB PRO 92 13.503 18.444 1.673 675 HB3 PRO 92 2HB PRO 92 12.332 17.708 0.571 676 HG2 PRO 92 1HG PRO 92 13.906 16.445 2.783 677 HG3 PRO 92 2HG PRO 92 12.199 16.223 2.355 678 HD2 PRO 92 1HD PRO 92 14.120 14.448 1.654 679 HD3 PRO 92 2HD PRO 92 12.688 14.752 0.650 680 H GLY 93 H GLY 93 16.507 17.658 -1.227 681 HA2 GLY 93 1HA GLY 93 18.051 19.505 -0.395 682 HA3 GLY 93 2HA GLY 93 18.014 18.618 1.122 683 H THR 94 H THR 94 18.127 17.199 -2.101 684 HA THR 94 HA THR 94 20.942 16.500 -1.734 685 HB THR 94 HB THR 94 19.346 14.664 -0.825 686 HG1 THR 94 1HG THR 94 21.095 13.633 -2.763 687 HG21 THR 94 3HG2 THR 94 19.151 14.123 -3.790 688 HG22 THR 94 1HG2 THR 94 17.827 14.681 -2.768 689 HG23 THR 94 2HG2 THR 94 18.541 13.091 -2.497 690 H GLU 95 H GLU 95 21.700 15.199 -3.748 691 HA GLU 95 HA GLU 95 20.515 16.471 -6.128 692 HB2 GLU 95 1HB GLU 95 22.879 16.101 -7.091 693 HB3 GLU 95 2HB GLU 95 22.642 17.412 -5.944 694 HG2 GLU 95 1HG GLU 95 23.442 15.839 -4.151 695 HG3 GLU 95 2HG GLU 95 23.902 14.732 -5.444 696 H GLY 96 H GLY 96 19.301 14.984 -7.124 697 HA2 GLY 96 1HA GLY 96 19.395 13.167 -8.735 698 HA3 GLY 96 2HA GLY 96 20.553 12.370 -7.680 699 H VAL 97 H VAL 97 18.806 10.662 -8.251 700 HA VAL 97 HA VAL 97 16.702 10.760 -6.188 701 HB VAL 97 HB VAL 97 16.704 9.310 -8.837 702 HG11 VAL 97 1HG1 VAL 97 15.083 8.943 -6.393 703 HG12 VAL 97 2HG1 VAL 97 14.211 8.955 -7.927 704 HG13 VAL 97 3HG1 VAL 97 15.509 7.790 -7.658 705 HG21 VAL 97 3HG2 VAL 97 15.660 11.102 -9.629 706 HG22 VAL 97 1HG2 VAL 97 14.416 10.941 -8.389 707 HG23 VAL 97 2HG2 VAL 97 15.859 11.903 -8.070 708 H THR 98 H THR 98 16.407 9.003 -4.857 709 HA THR 98 HA THR 98 18.597 7.045 -4.864 710 HB THR 98 HB THR 98 16.724 7.812 -2.616 711 HG1 THR 98 1HG THR 98 18.247 9.184 -2.028 712 HG21 THR 98 3HG2 THR 98 17.372 5.920 -1.634 713 HG22 THR 98 1HG2 THR 98 19.028 6.525 -1.647 714 HG23 THR 98 2HG2 THR 98 18.440 5.537 -2.984 715 H GLN 99 H GLN 99 18.224 4.897 -5.018 716 HA GLN 99 HA GLN 99 15.416 4.046 -5.282 717 HB2 GLN 99 1HB GLN 99 16.225 2.289 -6.805 718 HB3 GLN 99 2HB GLN 99 16.603 3.900 -7.400 719 HG2 GLN 99 1HG GLN 99 18.893 3.578 -6.342 720 HG3 GLN 99 2HG GLN 99 18.456 1.876 -6.194 721 HE21 GLN 99 1HE2 GLN 99 19.701 0.909 -7.659 722 HE22 GLN 99 2HE2 GLN 99 19.756 1.305 -9.339 723 H LEU 100 H LEU 100 14.715 2.300 -4.155 724 HA LEU 100 HA LEU 100 16.671 1.008 -2.370 725 HB2 LEU 100 1HB LEU 100 14.801 2.509 -1.415 726 HB3 LEU 100 2HB LEU 100 13.732 1.164 -1.807 727 HG LEU 100 HG LEU 100 15.543 -0.172 -0.381 728 HD11 LEU 100 1HD1 LEU 100 15.820 2.689 0.427 729 HD12 LEU 100 2HD1 LEU 100 17.058 1.447 0.247 730 HD13 LEU 100 3HD1 LEU 100 15.972 1.413 1.635 731 HD21 LEU 100 3HD2 LEU 100 13.979 -0.234 1.327 732 HD22 LEU 100 1HD2 LEU 100 13.008 0.251 -0.064 733 HD23 LEU 100 2HD2 LEU 100 13.526 1.458 1.113 734 H LYS 101 H LYS 101 17.013 -1.074 -2.730 735 HA LYS 101 HA LYS 101 15.073 -2.574 -4.336 736 HB2 LYS 101 1HB LYS 101 17.593 -2.390 -4.902 737 HB3 LYS 101 2HB LYS 101 17.820 -3.543 -3.594 738 HG2 LYS 101 1HG LYS 101 16.410 -5.153 -4.728 739 HG3 LYS 101 2HG LYS 101 16.087 -3.991 -6.016 740 HD2 LYS 101 1HD LYS 101 18.922 -4.636 -5.391 741 HD3 LYS 101 2HD LYS 101 17.964 -5.847 -6.246 742 HE2 LYS 101 1HE LYS 101 18.778 -4.671 -8.026 743 HE3 LYS 101 2HE LYS 101 17.295 -3.767 -7.725 744 HZ1 LYS 101 3HZ LYS 101 19.546 -2.823 -6.204 745 HZ2 LYS 101 1HZ LYS 101 18.437 -1.958 -7.145 746 HZ3 LYS 101 2HZ LYS 101 19.771 -2.696 -7.876 747 H LEU 102 H LEU 102 14.000 -4.312 -3.571 748 HA LEU 102 HA LEU 102 14.645 -5.219 -0.843 749 HB2 LEU 102 1HB LEU 102 11.903 -4.973 -2.071 750 HB3 LEU 102 2HB LEU 102 12.266 -5.562 -0.450 751 HG LEU 102 HG LEU 102 12.751 -2.749 -1.429 752 HD11 LEU 102 1HD1 LEU 102 10.903 -2.315 0.312 753 HD12 LEU 102 2HD1 LEU 102 10.503 -4.018 0.088 754 HD13 LEU 102 3HD1 LEU 102 10.439 -2.910 -1.282 755 HD21 LEU 102 3HD2 LEU 102 12.727 -2.709 1.302 756 HD22 LEU 102 1HD2 LEU 102 14.176 -2.725 0.297 757 HD23 LEU 102 2HD2 LEU 102 13.548 -4.233 0.961 758 H THR 103 H THR 103 14.891 -7.351 -0.569 759 HA THR 103 HA THR 103 13.962 -9.149 -2.709 760 HB THR 103 HB THR 103 16.592 -9.401 -1.238 761 HG1 THR 103 1HG THR 103 17.525 -8.646 -3.083 762 HG21 THR 103 3HG2 THR 103 15.778 -11.571 -1.819 763 HG22 THR 103 1HG2 THR 103 17.016 -11.144 -2.999 764 HG23 THR 103 2HG2 THR 103 15.310 -11.029 -3.430 765 H VAL 104 H VAL 104 13.328 -11.225 -2.081 766 HA VAL 104 HA VAL 104 12.322 -11.407 0.606 767 HB VAL 104 HB VAL 104 12.255 -13.453 -1.617 768 HG11 VAL 104 1HG1 VAL 104 11.296 -13.458 1.163 769 HG12 VAL 104 2HG1 VAL 104 10.122 -13.993 -0.041 770 HG13 VAL 104 3HG1 VAL 104 11.683 -14.804 0.091 771 HG21 VAL 104 3HG2 VAL 104 10.628 -11.076 -1.009 772 HG22 VAL 104 1HG2 VAL 104 10.893 -11.912 -2.539 773 HG23 VAL 104 2HG2 VAL 104 9.721 -12.543 -1.382 774 H VAL 105 H VAL 105 12.907 -12.853 2.203 775 HA VAL 105 HA VAL 105 15.485 -14.224 1.794 776 HB VAL 105 HB VAL 105 15.887 -13.950 4.214 777 HG11 VAL 105 1HG1 VAL 105 15.803 -11.821 2.244 778 HG12 VAL 105 2HG1 VAL 105 15.721 -11.209 3.897 779 HG13 VAL 105 3HG1 VAL 105 17.065 -12.240 3.402 780 HG21 VAL 105 3HG2 VAL 105 13.198 -13.450 4.379 781 HG22 VAL 105 1HG2 VAL 105 14.375 -13.146 5.657 782 HG23 VAL 105 2HG2 VAL 105 13.896 -11.842 4.571 783 H GLU 106 H GLU 106 15.829 -16.140 3.171 784 HA GLU 106 HA GLU 106 13.304 -17.565 3.698 785 HB2 GLU 106 1HB GLU 106 15.887 -18.688 2.600 786 HB3 GLU 106 2HB GLU 106 14.485 -19.649 3.049 787 HG2 GLU 106 1HG GLU 106 13.163 -18.399 1.357 788 HG3 GLU 106 2HG GLU 106 14.651 -17.603 0.851 789 H ASP 107 H ASP 107 16.643 -17.037 4.652 790 HA ASP 107 HA ASP 107 16.892 -18.845 6.731 791 HB2 ASP 107 1HB ASP 107 17.975 -16.023 6.763 792 HB3 ASP 107 2HB ASP 107 18.629 -17.424 7.607 793 H VAL 108 H VAL 108 15.793 -15.460 6.969 794 HA VAL 108 HA VAL 108 15.160 -15.461 9.676 795 HB VAL 108 HB VAL 108 13.736 -13.929 7.496 796 HG11 VAL 108 1HG1 VAL 108 13.213 -12.325 9.265 797 HG12 VAL 108 2HG1 VAL 108 12.536 -13.915 9.623 798 HG13 VAL 108 3HG1 VAL 108 13.996 -13.371 10.449 799 HG21 VAL 108 3HG2 VAL 108 16.233 -13.305 9.063 800 HG22 VAL 108 1HG2 VAL 108 16.077 -13.495 7.317 801 HG23 VAL 108 2HG2 VAL 108 15.340 -12.110 8.123 802 H THR 109 H THR 109 13.210 -15.718 10.812 803 HA THR 109 HA THR 109 11.763 -17.953 10.530 804 HB THR 109 HB THR 109 10.460 -15.366 11.389 805 HG1 THR 109 1HG THR 109 11.925 -17.174 13.028 806 HG21 THR 109 3HG2 THR 109 9.300 -16.959 12.984 807 HG22 THR 109 1HG2 THR 109 9.945 -18.271 12.000 808 HG23 THR 109 2HG2 THR 109 8.840 -17.095 11.287 809 H VAL 110 H VAL 110 10.595 -14.823 9.270 810 HA VAL 110 HA VAL 110 8.339 -15.686 7.961 811 HB VAL 110 HB VAL 110 8.594 -13.762 6.449 812 HG11 VAL 110 1HG1 VAL 110 9.267 -12.149 8.561 813 HG12 VAL 110 2HG1 VAL 110 7.663 -12.815 8.250 814 HG13 VAL 110 3HG1 VAL 110 8.760 -13.637 9.360 815 HG21 VAL 110 3HG2 VAL 110 10.741 -13.425 5.818 816 HG22 VAL 110 1HG2 VAL 110 10.739 -12.332 7.202 817 HG23 VAL 110 2HG2 VAL 110 11.395 -13.961 7.366 818 H GLY 111 H GLY 111 7.854 -16.611 6.018 819 HA2 GLY 111 1HA GLY 111 10.121 -17.809 4.581 820 HA3 GLY 111 2HA GLY 111 8.463 -18.392 4.547 821 H ARG 112 H ARG 112 8.506 -18.435 2.264 822 HA ARG 112 HA ARG 112 8.943 -15.975 0.809 823 HB2 ARG 112 1HB ARG 112 9.421 -18.454 0.071 824 HB3 ARG 112 2HB ARG 112 7.734 -18.417 -0.427 825 HG2 ARG 112 1HG ARG 112 8.737 -17.769 -2.365 826 HG3 ARG 112 2HG ARG 112 8.480 -16.192 -1.616 827 HD2 ARG 112 1HD ARG 112 10.681 -16.009 -2.224 828 HD3 ARG 112 2HD ARG 112 10.852 -16.650 -0.590 829 HE ARG 112 HE ARG 112 10.731 -18.722 -2.545 830 HH11 ARG 112 1HH1 ARG 112 12.836 -16.364 -1.087 831 HH12 ARG 112 2HH1 ARG 112 14.282 -17.261 -1.413 832 HH21 ARG 112 1HH2 ARG 112 12.627 -19.913 -2.979 833 HH22 ARG 112 2HH2 ARG 112 14.162 -19.279 -2.490 834 H ARG 113 H ARG 113 6.207 -18.073 1.622 835 HA ARG 113 HA ARG 113 4.204 -16.841 0.171 836 HB2 ARG 113 1HB ARG 113 4.282 -18.387 2.715 837 HB3 ARG 113 2HB ARG 113 2.799 -17.525 2.327 838 HG2 ARG 113 1HG ARG 113 2.425 -19.621 1.436 839 HG3 ARG 113 2HG ARG 113 2.985 -18.702 0.038 840 HD2 ARG 113 1HD ARG 113 4.209 -20.666 -0.112 841 HD3 ARG 113 2HD ARG 113 5.326 -19.568 0.697 842 HE ARG 113 HE ARG 113 3.846 -20.971 2.630 843 HH11 ARG 113 1HH1 ARG 113 6.331 -21.490 0.248 844 HH12 ARG 113 2HH1 ARG 113 7.061 -22.806 1.106 845 HH21 ARG 113 1HH2 ARG 113 4.798 -22.703 3.769 846 HH22 ARG 113 2HH2 ARG 113 6.188 -23.496 3.108 847 H GLN 114 H GLN 114 5.577 -15.919 3.287 848 HA GLN 114 HA GLN 114 3.720 -13.864 3.866 849 HB2 GLN 114 1HB GLN 114 5.256 -14.949 5.522 850 HB3 GLN 114 2HB GLN 114 6.587 -14.055 4.799 851 HG2 GLN 114 1HG GLN 114 6.081 -12.687 6.544 852 HG3 GLN 114 2HG GLN 114 5.051 -11.989 5.295 853 HE21 GLN 114 1HE2 GLN 114 3.413 -11.218 6.488 854 HE22 GLN 114 2HE2 GLN 114 2.397 -12.180 7.502 855 H ALA 115 H ALA 115 7.112 -13.600 2.784 856 HA ALA 115 HA ALA 115 7.119 -10.878 2.262 857 HB1 ALA 115 1HB ALA 115 9.242 -11.583 2.087 858 HB2 ALA 115 2HB ALA 115 8.771 -13.175 1.491 859 HB3 ALA 115 3HB ALA 115 8.847 -11.805 0.383 860 H VAL 116 H VAL 116 6.673 -13.493 -0.128 861 HA VAL 116 HA VAL 116 6.148 -11.999 -2.363 862 HB VAL 116 HB VAL 116 4.800 -14.581 -1.561 863 HG11 VAL 116 1HG1 VAL 116 4.772 -12.991 -4.082 864 HG12 VAL 116 2HG1 VAL 116 4.745 -14.753 -4.179 865 HG13 VAL 116 3HG1 VAL 116 3.473 -13.896 -3.306 866 HG21 VAL 116 3HG2 VAL 116 7.081 -14.314 -3.482 867 HG22 VAL 116 1HG2 VAL 116 7.376 -14.395 -1.745 868 HG23 VAL 116 2HG2 VAL 116 6.555 -15.724 -2.563 869 H ALA 117 H ALA 117 3.862 -12.929 0.179 870 HA ALA 117 HA ALA 117 1.539 -11.896 -1.009 871 HB1 ALA 117 1HB ALA 117 2.303 -12.419 1.847 872 HB2 ALA 117 2HB ALA 117 0.725 -11.765 1.407 873 HB3 ALA 117 3HB ALA 117 1.224 -13.346 0.804 874 H TRP 118 H TRP 118 3.865 -10.405 1.220 875 HA TRP 118 HA TRP 118 2.512 -7.935 1.454 876 HB2 TRP 118 1HB TRP 118 4.286 -8.759 3.013 877 HB3 TRP 118 2HB TRP 118 5.479 -8.437 1.757 878 HD1 TRP 118 HD TRP 118 3.447 -6.733 4.444 879 HE1 TRP 118 1HE TRP 118 4.114 -4.250 4.572 880 HE3 TRP 118 3HE TRP 118 6.310 -6.442 0.218 881 HZ2 TRP 118 2HZ TRP 118 5.650 -2.411 3.079 882 HZ3 TRP 118 3HZ TRP 118 7.341 -4.285 -0.361 883 HH2 TRP 118 HH TRP 118 7.017 -2.312 1.041 884 H LEU 119 H LEU 119 5.193 -8.984 -0.628 885 HA LEU 119 HA LEU 119 5.815 -6.638 -1.898 886 HB2 LEU 119 1HB LEU 119 5.592 -9.364 -3.167 887 HB3 LEU 119 2HB LEU 119 6.483 -7.995 -3.828 888 HG LEU 119 HG LEU 119 7.176 -9.129 -1.140 889 HD11 LEU 119 1HD1 LEU 119 8.961 -10.104 -3.109 890 HD12 LEU 119 2HD1 LEU 119 7.325 -10.540 -3.600 891 HD13 LEU 119 3HD1 LEU 119 7.926 -11.020 -2.013 892 HD21 LEU 119 3HD2 LEU 119 8.887 -7.791 -3.226 893 HD22 LEU 119 1HD2 LEU 119 9.296 -8.127 -1.544 894 HD23 LEU 119 2HD2 LEU 119 8.068 -6.921 -1.928 895 H VAL 120 H VAL 120 3.511 -9.030 -3.210 896 HA VAL 120 HA VAL 120 2.481 -7.347 -5.206 897 HB VAL 120 HB VAL 120 2.227 -9.871 -5.036 898 HG11 VAL 120 1HG1 VAL 120 0.267 -10.722 -3.878 899 HG12 VAL 120 2HG1 VAL 120 1.352 -9.920 -2.741 900 HG13 VAL 120 3HG1 VAL 120 -0.112 -9.103 -3.291 901 HG21 VAL 120 3HG2 VAL 120 -0.137 -8.128 -5.712 902 HG22 VAL 120 1HG2 VAL 120 1.140 -8.677 -6.798 903 HG23 VAL 120 2HG2 VAL 120 -0.017 -9.834 -6.141 904 H ALA 121 H ALA 121 1.442 -7.945 -1.884 905 HA ALA 121 HA ALA 121 -1.003 -6.619 -1.916 906 HB1 ALA 121 1HB ALA 121 -0.523 -7.881 -0.005 907 HB2 ALA 121 2HB ALA 121 1.016 -7.062 0.260 908 HB3 ALA 121 3HB ALA 121 -0.499 -6.209 0.555 909 H MET 122 H MET 122 2.262 -5.341 -1.444 910 HA MET 122 HA MET 122 1.545 -2.716 -0.761 911 HB2 MET 122 1HB MET 122 3.832 -3.768 -0.562 912 HB3 MET 122 2HB MET 122 4.017 -3.526 -2.294 913 HG2 MET 122 1HG MET 122 5.093 -1.781 -0.907 914 HG3 MET 122 2HG MET 122 3.905 -1.159 -2.050 915 HE1 MET 122 3HE MET 122 2.885 1.424 0.474 916 HE2 MET 122 1HE MET 122 4.482 1.029 -0.163 917 HE3 MET 122 2HE MET 122 3.074 0.980 -1.223 918 H HIS 123 H HIS 123 2.565 -4.013 -3.925 919 HA HIS 123 HA HIS 123 2.116 -1.685 -5.400 920 HB2 HIS 123 1HB HIS 123 3.382 -3.636 -6.239 921 HB3 HIS 123 2HB HIS 123 1.879 -4.547 -6.352 922 HD2 HIS 123 2HD HIS 123 4.069 -2.858 -8.722 923 HE1 HIS 123 1HE HIS 123 0.184 -2.012 -10.201 924 HE2 HIS 123 2HE HIS 123 2.642 -2.102 -10.742 925 H LYS 124 H LYS 124 -0.005 -4.531 -5.060 926 HA LYS 124 HA LYS 124 -2.163 -3.781 -6.524 927 HB2 LYS 124 1HB LYS 124 -1.907 -5.286 -3.956 928 HB3 LYS 124 2HB LYS 124 -3.516 -4.882 -4.539 929 HG2 LYS 124 1HG LYS 124 -1.478 -6.323 -6.213 930 HG3 LYS 124 2HG LYS 124 -2.652 -7.149 -5.186 931 HD2 LYS 124 1HD LYS 124 -4.439 -6.525 -6.498 932 HD3 LYS 124 2HD LYS 124 -3.612 -5.099 -7.131 933 HE2 LYS 124 1HE LYS 124 -2.105 -6.612 -8.403 934 HE3 LYS 124 2HE LYS 124 -3.072 -7.978 -7.850 935 HZ1 LYS 124 3HZ LYS 124 -5.011 -6.922 -8.924 936 HZ2 LYS 124 1HZ LYS 124 -3.793 -7.340 -10.023 937 HZ3 LYS 124 2HZ LYS 124 -3.991 -5.727 -9.552 938 H ALA 125 H ALA 125 -1.800 -3.006 -3.058 939 HA ALA 125 HA ALA 125 -4.012 -1.277 -2.929 940 HB1 ALA 125 1HB ALA 125 -2.776 -2.364 -1.002 941 HB2 ALA 125 2HB ALA 125 -1.587 -1.071 -1.164 942 HB3 ALA 125 3HB ALA 125 -3.263 -0.684 -0.774 943 H ALA 126 H ALA 126 -0.578 -0.659 -3.528 944 HA ALA 126 HA ALA 126 -0.406 2.050 -3.408 945 HB1 ALA 126 1HB ALA 126 0.967 -0.040 -4.883 946 HB2 ALA 126 2HB ALA 126 0.974 1.504 -5.736 947 HB3 ALA 126 3HB ALA 126 1.612 1.400 -4.095 948 H LYS 127 H LYS 127 -1.969 0.153 -5.922 949 HA LYS 127 HA LYS 127 -2.368 2.237 -7.779 950 HB2 LYS 127 1HB LYS 127 -3.993 -0.271 -7.318 951 HB3 LYS 127 2HB LYS 127 -4.118 0.768 -8.731 952 HG2 LYS 127 1HG LYS 127 -1.561 0.294 -8.950 953 HG3 LYS 127 2HG LYS 127 -1.939 -1.105 -7.941 954 HD2 LYS 127 1HD LYS 127 -3.635 -0.550 -10.330 955 HD3 LYS 127 2HD LYS 127 -2.036 -1.259 -10.567 956 HE2 LYS 127 1HE LYS 127 -2.758 -2.947 -8.761 957 HE3 LYS 127 2HE LYS 127 -4.393 -2.371 -9.082 958 HZ1 LYS 127 3HZ LYS 127 -3.238 -2.880 -11.546 959 HZ2 LYS 127 1HZ LYS 127 -4.457 -3.769 -10.780 960 HZ3 LYS 127 2HZ LYS 127 -2.836 -4.201 -10.568 961 H LEU 128 H LEU 128 -4.509 0.898 -5.271 962 HA LEU 128 HA LEU 128 -6.732 2.481 -5.692 963 HB2 LEU 128 1HB LEU 128 -5.559 1.217 -3.249 964 HB3 LEU 128 2HB LEU 128 -6.983 2.247 -3.112 965 HG LEU 128 HG LEU 128 -6.950 -0.083 -4.999 966 HD11 LEU 128 1HD1 LEU 128 -7.556 -1.596 -3.367 967 HD12 LEU 128 2HD1 LEU 128 -8.007 -0.338 -2.217 968 HD13 LEU 128 3HD1 LEU 128 -6.305 -0.660 -2.549 969 HD21 LEU 128 3HD2 LEU 128 -8.727 1.793 -4.915 970 HD22 LEU 128 1HD2 LEU 128 -9.266 0.994 -3.438 971 HD23 LEU 128 2HD2 LEU 128 -9.261 0.112 -4.965 972 H LEU 129 H LEU 129 -3.910 3.173 -3.646 973 HA LEU 129 HA LEU 129 -4.643 5.539 -2.495 974 HB2 LEU 129 1HB LEU 129 -2.055 4.435 -3.442 975 HB3 LEU 129 2HB LEU 129 -2.102 6.137 -2.984 976 HG LEU 129 HG LEU 129 -2.832 3.815 -1.198 977 HD11 LEU 129 1HD1 LEU 129 -0.318 5.254 -1.730 978 HD12 LEU 129 2HD1 LEU 129 -0.590 3.625 -1.113 979 HD13 LEU 129 3HD1 LEU 129 -0.721 5.011 -0.030 980 HD21 LEU 129 3HD2 LEU 129 -3.040 6.763 -0.929 981 HD22 LEU 129 1HD2 LEU 129 -2.509 5.845 0.480 982 HD23 LEU 129 2HD2 LEU 129 -4.065 5.487 -0.270 983 H TYR 130 H TYR 130 -2.887 5.300 -5.594 984 HA TYR 130 HA TYR 130 -3.314 8.047 -6.229 985 HB2 TYR 130 1HB TYR 130 -2.672 6.059 -8.358 986 HB3 TYR 130 2HB TYR 130 -2.013 7.669 -8.092 987 HD1 TYR 130 2HD TYR 130 -1.162 7.428 -5.250 988 HD2 TYR 130 1HD TYR 130 -0.759 4.718 -8.505 989 HE1 TYR 130 2HE TYR 130 0.820 6.443 -4.177 990 HE2 TYR 130 1HE TYR 130 1.223 3.725 -7.441 991 HH TYR 130 HH TYR 130 2.558 3.726 -5.669 992 H GLU 131 H GLU 131 -4.481 5.094 -7.863 993 HA GLU 131 HA GLU 131 -6.340 6.317 -9.517 994 HB2 GLU 131 1HB GLU 131 -6.524 3.567 -8.274 995 HB3 GLU 131 2HB GLU 131 -7.416 4.117 -9.685 996 HG2 GLU 131 1HG GLU 131 -5.155 4.538 -10.760 997 HG3 GLU 131 2HG GLU 131 -4.473 3.610 -9.427 998 H SER 132 H SER 132 -8.676 6.355 -9.407 999 HA SER 132 HA SER 132 -9.626 6.859 -6.666 1000 HB2 SER 132 1HB SER 132 -11.271 8.376 -7.651 1001 HB3 SER 132 2HB SER 132 -9.646 8.826 -8.169 1002 HG SER 132 HG SER 132 -11.483 7.269 -9.675 1003 H ARG 133 H ARG 133 -11.977 6.456 -6.318 1004 HA ARG 133 HA ARG 133 -12.729 3.919 -7.593 1005 HB2 ARG 133 1HB ARG 133 -13.485 5.134 -4.935 1006 HB3 ARG 133 2HB ARG 133 -14.256 3.696 -5.590 1007 HG2 ARG 133 1HG ARG 133 -12.681 2.719 -4.279 1008 HG3 ARG 133 2HG ARG 133 -11.758 2.868 -5.775 1009 HD2 ARG 133 1HD ARG 133 -10.554 4.709 -4.986 1010 HD3 ARG 133 2HD ARG 133 -11.717 5.031 -3.701 1011 HE ARG 133 HE ARG 133 -9.460 3.328 -3.548 1012 HH11 ARG 133 1HH1 ARG 133 -12.764 3.617 -2.490 1013 HH12 ARG 133 2HH1 ARG 133 -12.525 2.672 -1.058 1014 HH21 ARG 133 1HH2 ARG 133 -9.133 2.081 -1.666 1015 HH22 ARG 133 2HH2 ARG 133 -10.459 1.799 -0.590 1016 H ASP 134 H ASP 134 -14.424 3.843 -8.911 1017 HA ASP 134 HA ASP 134 -15.953 6.208 -9.451 1018 HB2 ASP 134 1HB ASP 134 -15.936 3.412 -10.553 1019 HB3 ASP 134 2HB ASP 134 -17.216 4.540 -10.989 1020 H GLN 135 H GLN 135 -16.627 3.048 -7.997 1021 HA GLN 135 HA GLN 135 -19.346 3.182 -7.667 1022 HB2 GLN 135 1HB GLN 135 -17.644 1.349 -6.969 1023 HB3 GLN 135 2HB GLN 135 -17.605 2.197 -5.429 1024 HG2 GLN 135 1HG GLN 135 -19.165 0.360 -5.336 1025 HG3 GLN 135 2HG GLN 135 -20.023 1.895 -5.207 1026 HE21 GLN 135 1HE2 GLN 135 -21.954 1.474 -6.054 1027 HE22 GLN 135 2HE2 GLN 135 -22.234 0.828 -7.632 1028 H SER 136 H SER 136 -17.097 4.017 -5.030 1029 HA SER 136 HA SER 136 -18.952 5.319 -3.429 1030 HB2 SER 136 1HB SER 136 -17.113 6.156 -2.177 1031 HB3 SER 136 2HB SER 136 -16.578 4.607 -2.828 1032 HG SER 136 HG SER 136 -15.363 5.665 -4.340 1033 H GLY 137 H GLY 137 -17.409 6.388 -6.316 1034 HA2 GLY 137 1HA GLY 137 -18.331 8.223 -7.553 1035 HA3 GLY 137 2HA GLY 137 -18.766 8.983 -6.030 1036 HA PRO 138 HA PRO 138 -14.998 11.153 -7.507 1037 HB2 PRO 138 1HB PRO 138 -15.798 13.591 -6.622 1038 HB3 PRO 138 2HB PRO 138 -16.282 12.932 -8.189 1039 HG2 PRO 138 1HG PRO 138 -17.799 12.993 -5.609 1040 HG3 PRO 138 2HG PRO 138 -18.373 13.330 -7.252 1041 HD2 PRO 138 1HD PRO 138 -18.810 10.962 -6.014 1042 HD3 PRO 138 2HD PRO 138 -18.589 11.095 -7.770 1043 H SER 139 H SER 139 -13.614 12.766 -6.191 1044 HA SER 139 HA SER 139 -13.581 11.885 -3.378 1045 HB2 SER 139 1HB SER 139 -11.229 12.607 -5.144 1046 HB3 SER 139 2HB SER 139 -11.129 12.142 -3.446 1047 HG SER 139 HG SER 139 -10.926 10.214 -4.280 1048 H SER 140 H SER 140 -12.661 14.542 -5.554 1049 HA SER 140 HA SER 140 -12.457 16.398 -3.342 1050 HB2 SER 140 1HB SER 140 -12.213 16.810 -6.331 1051 HB3 SER 140 2HB SER 140 -11.928 18.061 -5.121 1052 HG SER 140 HG SER 140 -10.421 16.242 -4.270 1053 H GLY 141 H GLY 141 -13.598 18.553 -3.545 1054 HA2 GLY 141 1HA GLY 141 -15.643 19.532 -4.719 1055 HA3 GLY 141 2HA GLY 141 -16.423 18.039 -4.219
Contact the webmaster for help, if required. Thursday, May 23, 2024 5:05:44 PM GMT (wattos1)