NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
570071 | 2mh4 | 19617 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 1.808 0.000 0.855 2 HA MET 1 HA MET 1 1.659 -0.741 -1.897 3 HB2 MET 1 2HB MET 1 1.815 2.118 -1.164 4 HB3 MET 1 3HB MET 1 2.958 1.584 -2.388 5 HG2 MET 1 2HG MET 1 1.379 1.708 -3.922 6 HG3 MET 1 3HG MET 1 0.433 0.502 -3.052 7 HE1 MET 1 3HE MET 1 -1.929 1.117 -1.876 8 HE2 MET 1 1HE MET 1 -2.669 2.426 -2.797 9 HE3 MET 1 2HE MET 1 -1.778 1.154 -3.633 10 HA PRO 2 HA PRO 2 5.824 -1.921 -1.189 11 HB2 PRO 2 2HB PRO 2 6.962 -1.562 -3.627 12 HB3 PRO 2 3HB PRO 2 5.816 -2.864 -3.284 13 HG2 PRO 2 2HG PRO 2 5.341 -0.225 -4.613 14 HG3 PRO 2 3HG PRO 2 4.732 -1.829 -5.061 15 HD2 PRO 2 2HD PRO 2 3.225 -0.020 -3.724 16 HD3 PRO 2 3HD PRO 2 3.053 -1.770 -3.484 17 H ALA 3 H ALA 3 8.020 -1.193 -1.029 18 HA ALA 3 HA ALA 3 8.771 1.461 -1.777 19 HB1 ALA 3 1HB ALA 3 7.245 1.692 0.296 20 HB2 ALA 3 2HB ALA 3 8.638 1.078 1.188 21 HB3 ALA 3 3HB ALA 3 8.773 2.571 0.258 22 H ALA 4 H ALA 4 10.977 1.864 -1.476 23 HA ALA 4 HA ALA 4 12.538 -0.515 -0.727 24 HB1 ALA 4 1HB ALA 4 13.523 1.802 -2.372 25 HB2 ALA 4 2HB ALA 4 14.228 0.192 -2.218 26 HB3 ALA 4 3HB ALA 4 12.702 0.409 -3.076 27 H LEU 5 H LEU 5 13.462 -0.430 1.204 28 HA LEU 5 HA LEU 5 14.779 2.031 2.058 29 HB2 LEU 5 2HB LEU 5 12.397 1.841 2.992 30 HB3 LEU 5 3HB LEU 5 13.033 0.529 3.982 31 HG LEU 5 HG LEU 5 14.663 2.131 4.959 32 HD11 LEU 5 1HD1 LEU 5 13.230 3.996 3.119 33 HD12 LEU 5 2HD1 LEU 5 14.956 3.848 3.448 34 HD13 LEU 5 3HD1 LEU 5 13.892 4.593 4.641 35 HD21 LEU 5 3HD2 LEU 5 11.756 2.175 5.294 36 HD22 LEU 5 1HD2 LEU 5 12.579 3.604 5.920 37 HD23 LEU 5 2HD2 LEU 5 13.038 2.001 6.494 38 H VAL 6 H VAL 6 16.090 -0.124 1.090 39 HA VAL 6 HA VAL 6 16.793 -2.193 2.770 40 HB VAL 6 HB VAL 6 17.628 -2.229 0.549 41 HG11 VAL 6 1HG1 VAL 6 18.333 0.519 1.119 42 HG12 VAL 6 2HG1 VAL 6 19.665 -0.353 0.358 43 HG13 VAL 6 3HG1 VAL 6 18.089 -0.283 -0.432 44 HG21 VAL 6 3HG2 VAL 6 19.120 -3.005 2.563 45 HG22 VAL 6 1HG2 VAL 6 19.754 -3.017 0.917 46 HG23 VAL 6 2HG2 VAL 6 20.171 -1.700 2.014 47 H SER 7 H SER 7 17.164 -1.869 4.890 48 HA SER 7 HA SER 7 19.166 0.153 5.649 49 HB2 SER 7 2HB SER 7 16.725 -0.904 7.006 50 HB3 SER 7 3HB SER 7 18.079 -0.389 8.010 51 HG SER 7 HG SER 7 17.871 1.649 7.276 52 H ILE 8 H ILE 8 21.109 -0.648 6.047 53 HA ILE 8 HA ILE 8 21.309 -3.350 7.211 54 HB ILE 8 HB ILE 8 22.260 -3.343 4.995 55 HG12 ILE 8 2HG1 ILE 8 24.800 -3.207 6.467 56 HG13 ILE 8 3HG1 ILE 8 23.564 -4.179 7.257 57 HG21 ILE 8 1HG2 ILE 8 23.013 -0.708 5.641 58 HG22 ILE 8 2HG2 ILE 8 24.500 -1.601 5.330 59 HG23 ILE 8 3HG2 ILE 8 23.229 -1.554 4.109 60 HD11 ILE 8 3HD1 ILE 8 23.574 -4.874 4.519 61 HD12 ILE 8 1HD1 ILE 8 25.245 -4.862 5.081 62 HD13 ILE 8 2HD1 ILE 8 24.043 -5.855 5.907 63 H SER 9 H SER 9 22.005 -3.396 9.233 64 HA SER 9 HA SER 9 23.712 -1.191 10.187 65 HB2 SER 9 2HB SER 9 21.349 -2.506 11.355 66 HB3 SER 9 3HB SER 9 22.693 -2.286 12.476 67 HG SER 9 HG SER 9 22.635 -0.024 11.425 68 H VAL 10 H VAL 10 25.751 -1.858 10.297 69 HA VAL 10 HA VAL 10 26.294 -4.606 11.205 70 HB VAL 10 HB VAL 10 27.164 -4.049 8.960 71 HG11 VAL 10 1HG1 VAL 10 29.350 -2.375 9.898 72 HG12 VAL 10 2HG1 VAL 10 28.300 -2.185 8.492 73 HG13 VAL 10 3HG1 VAL 10 27.774 -1.604 10.073 74 HG21 VAL 10 3HG2 VAL 10 29.057 -4.675 11.197 75 HG22 VAL 10 1HG2 VAL 10 28.365 -5.755 9.986 76 HG23 VAL 10 2HG2 VAL 10 29.622 -4.605 9.527 77 H SER 11 H SER 11 27.466 -4.961 13.004 78 HA SER 11 HA SER 11 28.502 -2.595 14.423 79 HB2 SER 11 2HB SER 11 27.308 -5.159 15.485 80 HB3 SER 11 3HB SER 11 28.185 -4.016 16.502 81 HG SER 11 HG SER 11 26.525 -2.718 16.467 82 HA PRO 12 HA PRO 12 32.122 -5.317 13.366 83 HB2 PRO 12 2HB PRO 12 33.703 -3.285 12.507 84 HB3 PRO 12 3HB PRO 12 32.565 -4.129 11.450 85 HG2 PRO 12 2HG PRO 12 32.257 -1.502 12.853 86 HG3 PRO 12 3HG PRO 12 31.813 -1.943 11.194 87 HD2 PRO 12 2HD PRO 12 30.001 -1.814 13.202 88 HD3 PRO 12 3HD PRO 12 29.854 -2.962 11.856 89 H THR 13 H THR 13 34.124 -5.452 14.451 90 HA THR 13 HA THR 13 34.265 -3.805 16.883 91 HB THR 13 HB THR 13 36.034 -6.095 16.908 92 HG1 THR 13 HG1 THR 13 33.318 -6.498 16.218 93 HG21 THR 13 3HG2 THR 13 34.694 -4.589 18.727 94 HG22 THR 13 1HG2 THR 13 35.396 -6.169 19.072 95 HG23 THR 13 2HG2 THR 13 33.683 -6.032 18.676 96 H ASN 14 H ASN 14 35.694 -2.208 16.776 97 HA ASN 14 HA ASN 14 37.979 -2.389 14.990 98 HB2 ASN 14 2HB ASN 14 38.366 -0.005 15.766 99 HB3 ASN 14 3HB ASN 14 36.852 -0.294 14.914 100 HD21 ASN 14 1HD2 ASN 14 38.307 0.846 17.741 101 HD22 ASN 14 2HD2 ASN 14 36.871 1.126 18.660 102 H SER 15 H SER 15 39.529 -3.679 15.836 103 HA SER 15 HA SER 15 41.006 -2.696 18.096 104 HB2 SER 15 2HB SER 15 39.769 -5.451 18.297 105 HB3 SER 15 3HB SER 15 40.841 -4.694 19.475 106 HG SER 15 HG SER 15 39.149 -3.789 20.303 107 H THR 16 H THR 16 42.600 -4.821 18.664 108 HA THR 16 HA THR 16 43.926 -5.289 16.084 109 HB THR 16 HB THR 16 45.986 -5.522 17.246 110 HG1 THR 16 HG1 THR 16 45.950 -5.418 19.623 111 HG21 THR 16 3HG2 THR 16 46.216 -3.330 17.612 112 HG22 THR 16 1HG2 THR 16 45.148 -3.385 19.013 113 HG23 THR 16 2HG2 THR 16 44.472 -3.192 17.395 114 H VAL 17 H VAL 17 44.615 -7.328 15.472 115 HA VAL 17 HA VAL 17 43.818 -9.585 17.174 116 HB VAL 17 HB VAL 17 42.057 -9.162 15.446 117 HG11 VAL 17 1HG1 VAL 17 43.709 -8.403 13.702 118 HG12 VAL 17 2HG1 VAL 17 44.115 -10.103 13.460 119 HG13 VAL 17 3HG1 VAL 17 42.477 -9.532 13.141 120 HG21 VAL 17 3HG2 VAL 17 42.863 -11.467 16.436 121 HG22 VAL 17 1HG2 VAL 17 41.643 -11.397 15.165 122 HG23 VAL 17 2HG2 VAL 17 43.318 -11.771 14.760 123 H ALA 18 H ALA 18 44.935 -11.556 16.747 124 HA ALA 18 HA ALA 18 47.671 -11.186 16.070 125 HB1 ALA 18 1HB ALA 18 47.609 -13.794 16.227 126 HB2 ALA 18 2HB ALA 18 47.399 -12.810 17.675 127 HB3 ALA 18 3HB ALA 18 45.994 -13.516 16.878 128 H LYS 19 H LYS 19 48.851 -11.988 14.333 129 HA LYS 19 HA LYS 19 47.765 -11.780 11.805 130 HB2 LYS 19 2HB LYS 19 49.812 -13.033 11.038 131 HB3 LYS 19 3HB LYS 19 50.129 -11.640 12.063 132 HG2 LYS 19 2HG LYS 19 51.316 -12.926 13.411 133 HG3 LYS 19 3HG LYS 19 49.869 -13.873 13.766 134 HD2 LYS 19 2HD LYS 19 50.478 -14.979 11.433 135 HD3 LYS 19 3HD LYS 19 52.096 -14.428 11.876 136 HE2 LYS 19 2HE LYS 19 50.367 -16.014 13.755 137 HE3 LYS 19 3HE LYS 19 51.431 -16.786 12.581 138 HZ1 LYS 19 3HZ LYS 19 52.229 -16.232 15.010 139 HZ2 LYS 19 1HZ LYS 19 52.581 -14.731 14.314 140 HZ3 LYS 19 2HZ LYS 19 53.286 -16.137 13.692 141 H GLY 20 H GLY 20 46.919 -13.176 10.307 142 HA2 GLY 20 2HA GLY 20 45.829 -15.031 9.506 143 HA3 GLY 20 3HA GLY 20 46.961 -15.979 10.459 144 H LEU 21 H LEU 21 43.771 -14.679 10.262 145 HA LEU 21 HA LEU 21 42.701 -16.557 12.058 146 HB2 LEU 21 2HB LEU 21 43.902 -14.513 13.413 147 HB3 LEU 21 3HB LEU 21 42.239 -13.942 13.297 148 HG LEU 21 HG LEU 21 42.346 -16.696 14.175 149 HD11 LEU 21 1HD1 LEU 21 44.562 -15.528 15.032 150 HD12 LEU 21 2HD1 LEU 21 43.624 -16.615 16.056 151 HD13 LEU 21 3HD1 LEU 21 43.453 -14.869 16.235 152 HD21 LEU 21 3HD2 LEU 21 40.468 -15.012 14.342 153 HD22 LEU 21 1HD2 LEU 21 41.379 -14.259 15.651 154 HD23 LEU 21 2HD2 LEU 21 40.822 -15.925 15.810 155 H GLN 22 H GLN 22 40.357 -16.062 12.566 156 HA GLN 22 HA GLN 22 39.182 -14.393 10.442 157 HB2 GLN 22 2HB GLN 22 38.055 -17.007 11.453 158 HB3 GLN 22 3HB GLN 22 37.428 -16.028 10.134 159 HG2 GLN 22 2HG GLN 22 38.672 -17.168 8.714 160 HG3 GLN 22 3HG GLN 22 40.123 -16.590 9.532 161 HE21 GLN 22 1HE2 GLN 22 41.431 -18.241 9.833 162 HE22 GLN 22 2HE2 GLN 22 40.983 -19.800 10.427 163 H GLU 23 H GLU 23 37.479 -13.113 10.986 164 HA GLU 23 HA GLU 23 36.582 -13.228 13.792 165 HB2 GLU 23 2HB GLU 23 37.838 -11.099 12.381 166 HB3 GLU 23 3HB GLU 23 36.179 -10.621 12.709 167 HG2 GLU 23 2HG GLU 23 37.988 -11.714 14.838 168 HG3 GLU 23 3HG GLU 23 37.916 -9.998 14.438 169 H ASN 24 H ASN 24 34.428 -13.119 14.197 170 HA ASN 24 HA ASN 24 32.661 -13.173 11.853 171 HB2 ASN 24 2HB ASN 24 31.031 -14.274 13.344 172 HB3 ASN 24 3HB ASN 24 32.554 -15.156 13.274 173 HD21 ASN 24 1HD2 ASN 24 33.865 -15.242 15.075 174 HD22 ASN 24 2HD2 ASN 24 33.324 -14.760 16.643 175 H PHE 25 H PHE 25 30.939 -11.807 11.646 176 HA PHE 25 HA PHE 25 30.538 -9.805 13.764 177 HB2 PHE 25 2HB PHE 25 30.540 -9.179 10.807 178 HB3 PHE 25 3HB PHE 25 30.382 -8.033 12.134 179 HD1 PHE 25 HD1 PHE 25 32.488 -8.840 13.960 180 HD2 PHE 25 HD2 PHE 25 32.497 -8.655 9.708 181 HE1 PHE 25 HE1 PHE 25 34.929 -8.528 13.982 182 HE2 PHE 25 HE2 PHE 25 34.938 -8.343 9.723 183 HZ PHE 25 HZ PHE 25 36.157 -8.280 11.862 184 H LYS 26 H LYS 26 28.525 -8.348 12.618 185 HA LYS 26 HA LYS 26 26.435 -10.252 11.863 186 HB2 LYS 26 2HB LYS 26 26.692 -9.113 14.464 187 HB3 LYS 26 3HB LYS 26 25.281 -8.399 13.695 188 HG2 LYS 26 2HG LYS 26 24.471 -10.697 13.192 189 HG3 LYS 26 3HG LYS 26 25.822 -11.326 14.138 190 HD2 LYS 26 2HD LYS 26 24.881 -10.743 16.112 191 HD3 LYS 26 3HD LYS 26 24.173 -9.265 15.457 192 HE2 LYS 26 2HE LYS 26 22.639 -10.956 14.161 193 HE3 LYS 26 3HE LYS 26 23.105 -12.050 15.463 194 HZ1 LYS 26 3HZ LYS 26 21.394 -11.121 16.534 195 HZ2 LYS 26 1HZ LYS 26 21.342 -9.767 15.520 196 HZ3 LYS 26 2HZ LYS 26 22.439 -9.819 16.807 197 H ALA 27 H ALA 27 25.270 -9.495 10.225 198 HA ALA 27 HA ALA 27 24.877 -6.604 9.948 199 HB1 ALA 27 1HB ALA 27 25.283 -6.926 7.440 200 HB2 ALA 27 2HB ALA 27 26.691 -6.864 8.500 201 HB3 ALA 27 3HB ALA 27 26.108 -8.416 7.899 202 H THR 28 H THR 28 22.780 -6.217 9.755 203 HA THR 28 HA THR 28 21.077 -8.266 8.492 204 HB THR 28 HB THR 28 19.204 -7.299 9.850 205 HG1 THR 28 HG1 THR 28 19.588 -5.695 11.205 206 HG21 THR 28 3HG2 THR 28 19.582 -8.798 11.501 207 HG22 THR 28 1HG2 THR 28 21.167 -8.131 11.887 208 HG23 THR 28 2HG2 THR 28 20.981 -9.224 10.516 209 H GLY 29 H GLY 29 20.821 -7.574 6.438 210 HA2 GLY 29 2HA GLY 29 19.958 -4.772 6.058 211 HA3 GLY 29 3HA GLY 29 20.877 -5.680 4.866 212 H ILE 30 H ILE 30 17.799 -4.768 5.909 213 HA ILE 30 HA ILE 30 16.577 -6.628 3.979 214 HB ILE 30 HB ILE 30 15.298 -5.681 6.546 215 HG12 ILE 30 2HG1 ILE 30 15.510 -8.506 6.428 216 HG13 ILE 30 3HG1 ILE 30 17.095 -7.856 6.026 217 HG21 ILE 30 1HG2 ILE 30 13.477 -7.154 5.983 218 HG22 ILE 30 2HG2 ILE 30 13.748 -6.032 4.651 219 HG23 ILE 30 3HG2 ILE 30 14.317 -7.696 4.531 220 HD11 ILE 30 3HD1 ILE 30 15.602 -7.787 8.565 221 HD12 ILE 30 1HD1 ILE 30 17.334 -7.928 8.264 222 HD13 ILE 30 2HD1 ILE 30 16.546 -6.353 8.161 223 H PHE 31 H PHE 31 15.092 -5.784 2.588 224 HA PHE 31 HA PHE 31 14.541 -2.900 2.832 225 HB2 PHE 31 2HB PHE 31 14.284 -3.383 0.156 226 HB3 PHE 31 3HB PHE 31 15.736 -2.747 0.922 227 HD1 PHE 31 HD2 PHE 31 17.625 -4.253 1.429 228 HD2 PHE 31 HD1 PHE 31 14.226 -5.564 -0.772 229 HE1 PHE 31 HE2 PHE 31 18.900 -6.196 0.624 230 HE2 PHE 31 HE1 PHE 31 15.496 -7.511 -1.580 231 HZ PHE 31 HZ PHE 31 17.837 -7.828 -0.883 232 H THR 32 H THR 32 12.480 -2.210 2.523 233 HA THR 32 HA THR 32 10.353 -3.975 2.915 234 HB THR 32 HB THR 32 9.126 -1.818 1.754 235 HG1 THR 32 HG1 THR 32 10.387 -0.101 1.866 236 HG21 THR 32 3HG2 THR 32 8.472 -1.288 3.892 237 HG22 THR 32 1HG2 THR 32 10.081 -1.546 4.565 238 HG23 THR 32 2HG2 THR 32 9.069 -2.928 4.145 239 H ASP 33 H ASP 33 11.992 -3.058 0.031 240 HA ASP 33 HA ASP 33 9.857 -3.774 -1.764 241 HB2 ASP 33 2HB ASP 33 11.994 -2.182 -2.074 242 HB3 ASP 33 3HB ASP 33 12.665 -3.672 -2.732 243 H ASN 34 H ASN 34 11.792 -5.565 0.186 244 HA ASN 34 HA ASN 34 11.062 -8.034 -0.822 245 HB2 ASN 34 2HB ASN 34 13.347 -6.868 -2.207 246 HB3 ASN 34 3HB ASN 34 13.732 -8.427 -1.483 247 HD21 ASN 34 1HD2 ASN 34 11.663 -9.966 -1.769 248 HD22 ASN 34 2HD2 ASN 34 11.169 -10.120 -3.417 249 H SER 35 H SER 35 10.815 -8.413 1.373 250 HA SER 35 HA SER 35 12.729 -7.999 3.358 251 HB2 SER 35 2HB SER 35 11.432 -9.995 4.481 252 HB3 SER 35 3HB SER 35 10.623 -8.451 4.216 253 HG SER 35 HG SER 35 9.458 -9.309 2.625 254 H ASN 36 H ASN 36 14.776 -8.668 2.910 255 HA ASN 36 HA ASN 36 15.243 -11.540 3.005 256 HB2 ASN 36 2HB ASN 36 15.515 -9.989 0.591 257 HB3 ASN 36 3HB ASN 36 17.086 -10.611 1.086 258 HD21 ASN 36 1HD2 ASN 36 17.529 -12.729 0.849 259 HD22 ASN 36 2HD2 ASN 36 16.431 -13.883 0.180 260 H SER 37 H SER 37 17.623 -12.012 3.252 261 HA SER 37 HA SER 37 18.701 -10.201 5.237 262 HB2 SER 37 2HB SER 37 20.389 -12.472 4.500 263 HB3 SER 37 3HB SER 37 19.726 -12.026 6.072 264 HG SER 37 HG SER 37 18.281 -13.510 5.797 265 H ASP 38 H ASP 38 21.063 -9.692 5.204 266 HA ASP 38 HA ASP 38 21.713 -8.286 2.834 267 HB2 ASP 38 2HB ASP 38 22.562 -7.337 4.803 268 HB3 ASP 38 3HB ASP 38 23.190 -8.876 5.384 269 H ILE 39 H ILE 39 22.146 -9.376 1.015 270 HA ILE 39 HA ILE 39 24.563 -10.747 0.671 271 HB ILE 39 HB ILE 39 23.572 -12.576 1.895 272 HG12 ILE 39 2HG1 ILE 39 23.733 -14.354 0.206 273 HG13 ILE 39 3HG1 ILE 39 23.559 -13.159 -1.075 274 HG21 ILE 39 1HG2 ILE 39 21.215 -11.933 1.508 275 HG22 ILE 39 2HG2 ILE 39 21.344 -12.561 -0.134 276 HG23 ILE 39 3HG2 ILE 39 21.515 -13.650 1.242 277 HD11 ILE 39 3HD1 ILE 39 25.919 -14.091 0.070 278 HD12 ILE 39 1HD1 ILE 39 25.732 -12.751 -1.062 279 HD13 ILE 39 2HD1 ILE 39 25.720 -12.447 0.676 280 H THR 40 H THR 40 21.235 -10.377 -0.439 281 HA THR 40 HA THR 40 21.703 -11.002 -3.154 282 HB THR 40 HB THR 40 19.564 -9.162 -2.069 283 HG1 THR 40 HG1 THR 40 19.801 -11.976 -2.121 284 HG21 THR 40 3HG2 THR 40 18.414 -10.464 -4.107 285 HG22 THR 40 1HG2 THR 40 20.082 -10.471 -4.677 286 HG23 THR 40 2HG2 THR 40 19.279 -8.942 -4.315 287 H ASP 41 H ASP 41 21.693 -7.935 -1.379 288 HA ASP 41 HA ASP 41 22.102 -6.268 -3.621 289 HB2 ASP 41 2HB ASP 41 22.145 -5.984 -0.699 290 HB3 ASP 41 3HB ASP 41 23.236 -4.886 -1.539 291 H GLN 42 H GLN 42 24.177 -8.400 -1.965 292 HA GLN 42 HA GLN 42 26.378 -8.923 -2.201 293 HB2 GLN 42 2HB GLN 42 25.651 -8.584 -4.667 294 HB3 GLN 42 3HB GLN 42 26.543 -7.072 -4.560 295 HG2 GLN 42 2HG GLN 42 28.577 -8.243 -4.061 296 HG3 GLN 42 3HG GLN 42 27.716 -9.779 -3.974 297 HE21 GLN 42 1HE2 GLN 42 26.628 -10.484 -5.967 298 HE22 GLN 42 2HE2 GLN 42 27.384 -10.134 -7.481 299 H VAL 43 H VAL 43 26.430 -7.514 -0.201 300 HA VAL 43 HA VAL 43 27.245 -4.873 -0.151 301 HB VAL 43 HB VAL 43 26.603 -6.000 1.884 302 HG11 VAL 43 1HG1 VAL 43 28.299 -8.035 0.968 303 HG12 VAL 43 2HG1 VAL 43 29.008 -7.454 2.477 304 HG13 VAL 43 3HG1 VAL 43 27.337 -8.020 2.446 305 HG21 VAL 43 3HG2 VAL 43 29.450 -5.450 2.491 306 HG22 VAL 43 1HG2 VAL 43 28.524 -4.157 1.729 307 HG23 VAL 43 2HG2 VAL 43 27.986 -4.840 3.263 308 H THR 44 H THR 44 28.982 -3.875 -0.904 309 HA THR 44 HA THR 44 31.243 -5.343 -1.887 310 HB THR 44 HB THR 44 31.079 -2.346 -1.599 311 HG1 THR 44 HG1 THR 44 30.052 -2.339 -3.615 312 HG21 THR 44 3HG2 THR 44 32.574 -2.332 -3.500 313 HG22 THR 44 1HG2 THR 44 32.471 -4.086 -3.638 314 HG23 THR 44 2HG2 THR 44 33.254 -3.356 -2.236 315 H TRP 45 H TRP 45 33.039 -5.848 -0.824 316 HA TRP 45 HA TRP 45 33.605 -4.443 1.704 317 HB2 TRP 45 2HB TRP 45 34.743 -6.499 2.439 318 HB3 TRP 45 3HB TRP 45 33.053 -6.800 2.042 319 HD1 TRP 45 HD1 TRP 45 36.584 -7.364 0.587 320 HE1 TRP 45 HE1 TRP 45 36.478 -9.374 -1.017 321 HE3 TRP 45 HE3 TRP 45 31.541 -8.204 0.670 322 HZ2 TRP 45 HZ2 TRP 45 34.516 -11.089 -2.104 323 HZ3 TRP 45 HZ3 TRP 45 30.631 -10.049 -0.681 324 HH2 TRP 45 HH2 TRP 45 32.089 -11.460 -2.039 325 H ASP 46 H ASP 46 35.697 -3.786 2.151 326 HA ASP 46 HA ASP 46 37.680 -4.113 0.006 327 HB2 ASP 46 2HB ASP 46 36.695 -1.566 1.245 328 HB3 ASP 46 3HB ASP 46 38.349 -1.668 0.647 329 H SER 47 H SER 47 39.821 -4.194 0.655 330 HA SER 47 HA SER 47 40.298 -4.183 3.561 331 HB2 SER 47 2HB SER 47 40.766 -6.372 3.483 332 HB3 SER 47 3HB SER 47 40.505 -6.396 1.739 333 HG SER 47 HG SER 47 42.655 -5.854 1.437 334 H SER 48 H SER 48 42.378 -3.569 4.240 335 HA SER 48 HA SER 48 43.561 -1.468 2.875 336 HB2 SER 48 2HB SER 48 43.908 -2.691 5.349 337 HB3 SER 48 3HB SER 48 45.474 -2.880 4.560 338 HG SER 48 HG SER 48 45.800 -0.807 4.730 339 H ASN 49 H ASN 49 46.023 -1.475 2.341 340 HA ASN 49 HA ASN 49 46.572 -3.787 0.597 341 HB2 ASN 49 2HB ASN 49 45.967 -1.686 -0.629 342 HB3 ASN 49 3HB ASN 49 47.389 -0.922 0.075 343 HD21 ASN 49 1HD2 ASN 49 47.942 -0.606 -2.197 344 HD22 ASN 49 2HD2 ASN 49 48.768 -1.872 -3.033 345 H THR 50 H THR 50 47.552 -4.313 2.873 346 HA THR 50 HA THR 50 50.267 -3.207 3.074 347 HB THR 50 HB THR 50 50.294 -4.389 5.313 348 HG1 THR 50 HG1 THR 50 48.354 -5.135 6.112 349 HG21 THR 50 3HG2 THR 50 49.381 -2.565 6.392 350 HG22 THR 50 1HG2 THR 50 48.021 -2.450 5.275 351 HG23 THR 50 2HG2 THR 50 49.624 -1.913 4.772 352 H ASP 51 H ASP 51 48.897 -6.378 3.925 353 HA ASP 51 HA ASP 51 51.060 -7.628 2.361 354 HB2 ASP 51 2HB ASP 51 50.920 -7.751 5.041 355 HB3 ASP 51 3HB ASP 51 49.887 -9.120 4.644 356 H ILE 52 H ILE 52 47.962 -8.520 3.895 357 HA ILE 52 HA ILE 52 46.669 -9.187 1.488 358 HB ILE 52 HB ILE 52 48.195 -11.042 1.327 359 HG12 ILE 52 2HG1 ILE 52 46.611 -12.917 1.327 360 HG13 ILE 52 3HG1 ILE 52 45.510 -11.996 2.347 361 HG21 ILE 52 1HG2 ILE 52 47.491 -12.631 3.577 362 HG22 ILE 52 2HG2 ILE 52 49.074 -12.003 3.121 363 HG23 ILE 52 3HG2 ILE 52 48.010 -11.046 4.151 364 HD11 ILE 52 3HD1 ILE 52 46.295 -10.674 -0.151 365 HD12 ILE 52 1HD1 ILE 52 45.340 -12.145 -0.337 366 HD13 ILE 52 2HD1 ILE 52 44.717 -10.804 0.625 367 H LEU 53 H LEU 53 44.623 -8.816 1.994 368 HA LEU 53 HA LEU 53 43.495 -10.007 4.409 369 HB2 LEU 53 2HB LEU 53 44.078 -7.222 4.110 370 HB3 LEU 53 3HB LEU 53 42.331 -7.447 4.192 371 HG LEU 53 HG LEU 53 43.014 -8.930 6.294 372 HD11 LEU 53 1HD1 LEU 53 44.843 -7.789 7.516 373 HD12 LEU 53 2HD1 LEU 53 45.231 -6.905 6.041 374 HD13 LEU 53 3HD1 LEU 53 45.391 -8.661 6.084 375 HD21 LEU 53 3HD2 LEU 53 41.462 -7.080 6.362 376 HD22 LEU 53 1HD2 LEU 53 42.788 -5.923 6.252 377 HD23 LEU 53 2HD2 LEU 53 42.615 -6.931 7.689 378 H SER 54 H SER 54 41.597 -10.930 3.994 379 HA SER 54 HA SER 54 39.935 -9.877 1.818 380 HB2 SER 54 2HB SER 54 39.462 -12.410 1.318 381 HB3 SER 54 3HB SER 54 40.890 -11.633 0.634 382 HG SER 54 HG SER 54 40.704 -13.645 2.482 383 H ILE 55 H ILE 55 37.982 -9.465 2.584 384 HA ILE 55 HA ILE 55 36.949 -11.132 4.785 385 HB ILE 55 HB ILE 55 37.333 -8.875 5.566 386 HG12 ILE 55 2HG1 ILE 55 34.369 -9.219 5.083 387 HG13 ILE 55 3HG1 ILE 55 35.274 -10.141 6.279 388 HG21 ILE 55 1HG2 ILE 55 37.145 -7.121 4.222 389 HG22 ILE 55 2HG2 ILE 55 36.500 -8.164 2.955 390 HG23 ILE 55 3HG2 ILE 55 35.406 -7.388 4.099 391 HD11 ILE 55 3HD1 ILE 55 35.935 -7.933 7.296 392 HD12 ILE 55 1HD1 ILE 55 34.740 -7.189 6.235 393 HD13 ILE 55 2HD1 ILE 55 34.235 -8.377 7.437 394 H SER 56 H SER 56 35.126 -12.217 4.425 395 HA SER 56 HA SER 56 33.438 -11.401 2.151 396 HB2 SER 56 2HB SER 56 34.757 -13.944 2.677 397 HB3 SER 56 3HB SER 56 33.016 -14.134 2.470 398 HG SER 56 HG SER 56 34.951 -13.295 0.650 399 H ASN 57 H ASN 57 31.340 -11.124 2.577 400 HA ASN 57 HA ASN 57 30.402 -11.669 5.283 401 HB2 ASN 57 2HB ASN 57 28.731 -10.319 3.193 402 HB3 ASN 57 3HB ASN 57 28.767 -10.053 4.934 403 HD21 ASN 57 1HD2 ASN 57 29.921 -8.413 5.693 404 HD22 ASN 57 2HD2 ASN 57 31.040 -7.467 4.777 405 H ALA 58 H ALA 58 29.294 -13.442 5.740 406 HA ALA 58 HA ALA 58 28.579 -15.426 3.963 407 HB1 ALA 58 1HB ALA 58 28.668 -15.413 6.559 408 HB2 ALA 58 2HB ALA 58 26.957 -15.002 6.436 409 HB3 ALA 58 3HB ALA 58 27.556 -16.503 5.731 410 H SER 59 H SER 59 26.317 -16.240 3.549 411 HA SER 59 HA SER 59 24.838 -14.161 2.215 412 HB2 SER 59 2HB SER 59 23.353 -16.062 1.511 413 HB3 SER 59 3HB SER 59 25.051 -16.278 1.084 414 HG SER 59 HG SER 59 24.043 -18.151 2.042 415 H ASP 60 H ASP 60 24.621 -15.895 5.199 416 HA ASP 60 HA ASP 60 21.852 -15.424 5.695 417 HB2 ASP 60 2HB ASP 60 24.161 -16.484 7.215 418 HB3 ASP 60 3HB ASP 60 22.866 -15.776 8.176 419 H SER 61 H SER 61 24.755 -14.012 7.220 420 HA SER 61 HA SER 61 23.956 -11.346 6.991 421 HB2 SER 61 2HB SER 61 22.270 -11.298 8.504 422 HB3 SER 61 3HB SER 61 22.774 -12.811 9.255 423 HG SER 61 HG SER 61 22.978 -10.690 10.464 424 H HIS 62 H HIS 62 25.290 -13.343 9.632 425 HA HIS 62 HA HIS 62 27.300 -11.633 10.438 426 HB2 HIS 62 2HB HIS 62 28.442 -13.638 11.331 427 HB3 HIS 62 3HB HIS 62 26.720 -13.631 11.700 428 HD1 HIS 62 HD1 HIS 62 25.227 -15.336 10.362 429 HD2 HIS 62 HD2 HIS 62 29.321 -15.766 9.806 430 HE1 HIS 62 HE1 HIS 62 25.528 -17.596 9.301 431 H GLY 63 H GLY 63 29.320 -11.126 9.759 432 HA2 GLY 63 2HA GLY 63 30.142 -12.260 7.164 433 HA3 GLY 63 3HA GLY 63 30.571 -10.657 7.741 434 H LEU 64 H LEU 64 32.168 -13.064 6.840 435 HA LEU 64 HA LEU 64 33.816 -13.399 9.256 436 HB2 LEU 64 2HB LEU 64 34.784 -15.357 8.011 437 HB3 LEU 64 3HB LEU 64 33.102 -15.517 8.513 438 HG LEU 64 HG LEU 64 33.692 -14.580 5.744 439 HD11 LEU 64 1HD1 LEU 64 33.477 -17.502 6.205 440 HD12 LEU 64 2HD1 LEU 64 35.036 -16.735 6.502 441 HD13 LEU 64 3HD1 LEU 64 34.282 -16.612 4.912 442 HD21 LEU 64 3HD2 LEU 64 31.489 -14.796 5.614 443 HD22 LEU 64 1HD2 LEU 64 31.427 -15.407 7.267 444 HD23 LEU 64 2HD2 LEU 64 31.650 -16.525 5.922 445 H ALA 65 H ALA 65 35.569 -12.172 9.306 446 HA ALA 65 HA ALA 65 36.798 -11.340 6.767 447 HB1 ALA 65 1HB ALA 65 37.484 -10.075 9.381 448 HB2 ALA 65 2HB ALA 65 37.479 -9.379 7.760 449 HB3 ALA 65 3HB ALA 65 35.956 -9.677 8.596 450 H SER 66 H SER 66 38.707 -12.150 6.207 451 HA SER 66 HA SER 66 40.302 -13.516 8.274 452 HB2 SER 66 2HB SER 66 39.601 -15.142 6.690 453 HB3 SER 66 3HB SER 66 39.962 -14.081 5.329 454 HG SER 66 HG SER 66 41.548 -15.768 5.771 455 H THR 67 H THR 67 42.103 -12.509 8.829 456 HA THR 67 HA THR 67 43.443 -10.805 6.830 457 HB THR 67 HB THR 67 44.212 -9.358 8.578 458 HG1 THR 67 HG1 THR 67 43.904 -9.816 10.732 459 HG21 THR 67 3HG2 THR 67 42.232 -8.296 9.099 460 HG22 THR 67 1HG2 THR 67 41.383 -9.806 9.428 461 HG23 THR 67 2HG2 THR 67 41.719 -9.327 7.764 462 H LEU 68 H LEU 68 45.712 -10.813 6.764 463 HA LEU 68 HA LEU 68 47.215 -12.582 8.475 464 HB2 LEU 68 2HB LEU 68 46.186 -14.049 6.705 465 HB3 LEU 68 3HB LEU 68 47.151 -13.168 5.522 466 HG LEU 68 HG LEU 68 48.938 -14.065 7.508 467 HD11 LEU 68 1HD1 LEU 68 47.706 -16.526 6.494 468 HD12 LEU 68 2HD1 LEU 68 46.764 -15.674 7.717 469 HD13 LEU 68 3HD1 LEU 68 48.419 -16.174 8.068 470 HD21 LEU 68 3HD2 LEU 68 49.474 -13.744 5.167 471 HD22 LEU 68 1HD2 LEU 68 48.382 -15.052 4.712 472 HD23 LEU 68 2HD2 LEU 68 49.836 -15.403 5.648 473 H ASN 69 H ASN 69 47.450 -9.885 8.213 474 HA ASN 69 HA ASN 69 49.890 -9.544 6.597 475 HB2 ASN 69 2HB ASN 69 49.325 -7.328 6.170 476 HB3 ASN 69 3HB ASN 69 47.753 -8.122 6.131 477 HD21 ASN 69 1HD2 ASN 69 46.620 -8.180 8.293 478 HD22 ASN 69 2HD2 ASN 69 46.678 -6.731 9.232 479 H GLN 70 H GLN 70 51.262 -7.644 7.538 480 HA GLN 70 HA GLN 70 51.457 -8.003 10.456 481 HB2 GLN 70 2HB GLN 70 53.956 -7.668 10.105 482 HB3 GLN 70 3HB GLN 70 53.287 -9.207 9.579 483 HG2 GLN 70 2HG GLN 70 53.928 -8.870 7.485 484 HG3 GLN 70 3HG GLN 70 53.234 -7.250 7.457 485 HE21 GLN 70 1HE2 GLN 70 54.768 -5.990 6.653 486 HE22 GLN 70 2HE2 GLN 70 56.395 -5.895 7.226 487 H GLY 71 H GLY 71 50.332 -6.089 10.885 488 HA2 GLY 71 2HA GLY 71 51.616 -3.818 11.463 489 HA3 GLY 71 3HA GLY 71 51.300 -3.594 9.748 490 H ASN 72 H ASN 72 49.598 -2.352 9.394 491 HA ASN 72 HA ASN 72 47.221 -2.711 11.088 492 HB2 ASN 72 2HB ASN 72 46.847 -0.328 11.172 493 HB3 ASN 72 3HB ASN 72 48.479 -0.655 11.747 494 HD21 ASN 72 1HD2 ASN 72 46.642 1.242 9.761 495 HD22 ASN 72 2HD2 ASN 72 47.887 1.858 8.733 496 H VAL 73 H VAL 73 45.325 -2.828 10.024 497 HA VAL 73 HA VAL 73 45.243 -2.021 7.201 498 HB VAL 73 HB VAL 73 43.831 -4.092 6.772 499 HG11 VAL 73 1HG1 VAL 73 45.732 -4.513 5.684 500 HG12 VAL 73 2HG1 VAL 73 46.716 -3.810 6.969 501 HG13 VAL 73 3HG1 VAL 73 46.192 -5.491 7.077 502 HG21 VAL 73 3HG2 VAL 73 44.301 -6.019 8.260 503 HG22 VAL 73 1HG2 VAL 73 45.097 -4.916 9.382 504 HG23 VAL 73 2HG2 VAL 73 43.374 -4.743 9.048 505 H LYS 74 H LYS 74 43.314 -1.200 6.501 506 HA LYS 74 HA LYS 74 41.207 -0.927 8.542 507 HB2 LYS 74 2HB LYS 74 41.627 0.930 6.206 508 HB3 LYS 74 3HB LYS 74 40.659 1.205 7.648 509 HG2 LYS 74 2HG LYS 74 43.662 1.070 7.497 510 HG3 LYS 74 3HG LYS 74 42.676 2.509 7.762 511 HD2 LYS 74 2HD LYS 74 42.809 0.120 9.602 512 HD3 LYS 74 3HD LYS 74 43.659 1.648 9.850 513 HE2 LYS 74 2HE LYS 74 40.671 1.248 9.740 514 HE3 LYS 74 3HE LYS 74 41.631 1.585 11.180 515 HZ1 LYS 74 3HZ LYS 74 40.634 3.605 10.458 516 HZ2 LYS 74 1HZ LYS 74 41.177 3.391 8.870 517 HZ3 LYS 74 2HZ LYS 74 42.285 3.710 10.108 518 H VAL 75 H VAL 75 39.632 -2.337 8.121 519 HA VAL 75 HA VAL 75 38.922 -2.923 5.341 520 HB VAL 75 HB VAL 75 38.040 -4.277 7.894 521 HG11 VAL 75 1HG1 VAL 75 37.548 -5.037 5.017 522 HG12 VAL 75 2HG1 VAL 75 37.103 -5.998 6.428 523 HG13 VAL 75 3HG1 VAL 75 36.342 -4.431 6.151 524 HG21 VAL 75 3HG2 VAL 75 40.416 -4.611 7.359 525 HG22 VAL 75 1HG2 VAL 75 39.487 -6.102 7.201 526 HG23 VAL 75 2HG2 VAL 75 39.964 -5.202 5.760 527 H THR 76 H THR 76 37.128 -2.162 4.421 528 HA THR 76 HA THR 76 34.924 -1.225 6.108 529 HB THR 76 HB THR 76 34.715 0.874 5.014 530 HG1 THR 76 HG1 THR 76 36.216 1.436 3.303 531 HG21 THR 76 3HG2 THR 76 36.468 1.962 5.973 532 HG22 THR 76 1HG2 THR 76 37.669 0.892 5.251 533 HG23 THR 76 2HG2 THR 76 36.759 0.366 6.667 534 H ALA 77 H ALA 77 32.896 -1.339 5.163 535 HA ALA 77 HA ALA 77 32.669 -2.173 2.383 536 HB1 ALA 77 1HB ALA 77 31.594 -3.875 4.629 537 HB2 ALA 77 2HB ALA 77 31.346 -4.151 2.905 538 HB3 ALA 77 3HB ALA 77 32.965 -4.278 3.594 539 H SER 78 H SER 78 30.869 -1.401 1.442 540 HA SER 78 HA SER 78 28.727 -0.377 3.187 541 HB2 SER 78 2HB SER 78 29.757 0.963 0.675 542 HB3 SER 78 3HB SER 78 28.471 1.558 1.724 543 HG SER 78 HG SER 78 31.067 1.054 2.711 544 H ILE 79 H ILE 79 26.658 -0.737 2.535 545 HA ILE 79 HA ILE 79 26.220 -1.928 -0.111 546 HB ILE 79 HB ILE 79 26.378 -3.825 1.372 547 HG12 ILE 79 2HG1 ILE 79 23.466 -3.238 0.796 548 HG13 ILE 79 3HG1 ILE 79 24.624 -3.825 -0.392 549 HG21 ILE 79 1HG2 ILE 79 25.809 -3.708 3.512 550 HG22 ILE 79 2HG2 ILE 79 25.206 -2.072 3.251 551 HG23 ILE 79 3HG2 ILE 79 24.121 -3.451 3.071 552 HD11 ILE 79 3HD1 ILE 79 24.481 -5.929 0.338 553 HD12 ILE 79 1HD1 ILE 79 24.466 -5.447 2.034 554 HD13 ILE 79 2HD1 ILE 79 22.979 -5.390 1.088 555 H GLY 80 H GLY 80 24.665 -0.868 -1.139 556 HA2 GLY 80 2HA GLY 80 22.776 0.370 -1.549 557 HA3 GLY 80 3HA GLY 80 22.131 -0.306 -0.061 558 H GLY 81 H GLY 81 21.970 0.960 1.713 559 HA2 GLY 81 2HA GLY 81 22.798 3.759 1.378 560 HA3 GLY 81 3HA GLY 81 21.552 3.183 2.475 561 H ILE 82 H ILE 82 22.106 2.457 4.507 562 HA ILE 82 HA ILE 82 24.271 3.587 5.785 563 HB ILE 82 HB ILE 82 22.941 1.016 6.638 564 HG12 ILE 82 2HG1 ILE 82 21.803 3.133 8.046 565 HG13 ILE 82 3HG1 ILE 82 21.896 3.720 6.389 566 HG21 ILE 82 1HG2 ILE 82 24.515 3.124 8.089 567 HG22 ILE 82 2HG2 ILE 82 23.456 1.991 8.926 568 HG23 ILE 82 3HG2 ILE 82 24.828 1.391 7.994 569 HD11 ILE 82 3HD1 ILE 82 20.489 2.061 5.593 570 HD12 ILE 82 1HD1 ILE 82 20.753 1.026 6.997 571 HD13 ILE 82 2HD1 ILE 82 19.780 2.489 7.149 572 H GLN 83 H GLN 83 26.257 2.803 6.550 573 HA GLN 83 HA GLN 83 27.215 0.226 5.625 574 HB2 GLN 83 2HB GLN 83 29.165 1.161 4.470 575 HB3 GLN 83 3HB GLN 83 27.665 1.660 3.700 576 HG2 GLN 83 2HG GLN 83 28.016 3.728 5.364 577 HG3 GLN 83 3HG GLN 83 29.697 3.259 5.114 578 HE21 GLN 83 1HE2 GLN 83 30.530 4.631 3.709 579 HE22 GLN 83 2HE2 GLN 83 29.820 5.098 2.205 580 H GLY 84 H GLY 84 29.393 -0.272 6.477 581 HA2 GLY 84 2HA GLY 84 30.251 1.397 8.720 582 HA3 GLY 84 3HA GLY 84 29.734 -0.241 9.089 583 H SER 85 H SER 85 32.224 0.418 9.807 584 HA SER 85 HA SER 85 33.835 -1.233 8.020 585 HB2 SER 85 2HB SER 85 35.755 0.472 8.399 586 HB3 SER 85 3HB SER 85 34.536 0.839 7.178 587 HG SER 85 HG SER 85 35.209 2.440 9.003 588 H THR 86 H THR 86 35.757 -2.081 9.031 589 HA THR 86 HA THR 86 35.653 -2.000 11.976 590 HB THR 86 HB THR 86 34.803 -4.155 11.020 591 HG1 THR 86 HG1 THR 86 35.831 -4.009 13.115 592 HG21 THR 86 3HG2 THR 86 37.672 -4.471 10.131 593 HG22 THR 86 1HG2 THR 86 36.276 -4.287 9.071 594 HG23 THR 86 2HG2 THR 86 36.434 -5.725 10.079 595 H ASP 87 H ASP 87 37.651 -2.316 13.079 596 HA ASP 87 HA ASP 87 39.976 -1.525 11.461 597 HB2 ASP 87 2HB ASP 87 39.242 0.007 13.307 598 HB3 ASP 87 3HB ASP 87 39.630 -1.272 14.454 599 H PHE 88 H PHE 88 41.606 -2.899 11.201 600 HA PHE 88 HA PHE 88 41.854 -5.155 13.079 601 HB2 PHE 88 2HB PHE 88 41.727 -5.139 10.109 602 HB3 PHE 88 3HB PHE 88 42.863 -6.258 10.856 603 HD1 PHE 88 HD1 PHE 88 39.301 -5.192 11.038 604 HD2 PHE 88 HD2 PHE 88 42.127 -8.335 11.536 605 HE1 PHE 88 HE1 PHE 88 37.463 -6.775 11.447 606 HE2 PHE 88 HE2 PHE 88 40.293 -9.923 11.945 607 HZ PHE 88 HZ PHE 88 37.958 -9.144 11.900 608 H LYS 89 H LYS 89 43.680 -4.958 14.179 609 HA LYS 89 HA LYS 89 46.053 -3.897 12.789 610 HB2 LYS 89 2HB LYS 89 44.892 -3.300 15.429 611 HB3 LYS 89 3HB LYS 89 46.630 -3.564 15.436 612 HG2 LYS 89 2HG LYS 89 46.184 -1.886 13.266 613 HG3 LYS 89 3HG LYS 89 45.116 -1.282 14.535 614 HD2 LYS 89 2HD LYS 89 47.906 -1.976 15.284 615 HD3 LYS 89 3HD LYS 89 47.650 -0.510 14.334 616 HE2 LYS 89 2HE LYS 89 45.699 -0.341 16.260 617 HE3 LYS 89 3HE LYS 89 47.046 -1.066 17.136 618 HZ1 LYS 89 3HZ LYS 89 46.959 1.537 15.738 619 HZ2 LYS 89 1HZ LYS 89 48.427 0.791 16.125 620 HZ3 LYS 89 2HZ LYS 89 47.347 1.222 17.354 621 H VAL 90 H VAL 90 47.526 -5.404 12.413 622 HA VAL 90 HA VAL 90 47.665 -7.735 14.202 623 HB VAL 90 HB VAL 90 48.856 -7.495 11.439 624 HG11 VAL 90 1HG1 VAL 90 48.735 -10.028 11.635 625 HG12 VAL 90 2HG1 VAL 90 49.950 -9.212 12.622 626 HG13 VAL 90 3HG1 VAL 90 48.447 -9.773 13.356 627 HG21 VAL 90 3HG2 VAL 90 46.939 -8.826 10.666 628 HG22 VAL 90 1HG2 VAL 90 46.214 -8.691 12.268 629 HG23 VAL 90 2HG2 VAL 90 46.444 -7.249 11.280 630 H THR 91 H THR 91 49.160 -7.477 15.729 631 HA THR 91 HA THR 91 51.792 -6.416 14.928 632 HB THR 91 HB THR 91 52.071 -5.474 17.165 633 HG1 THR 91 HG1 THR 91 50.161 -5.431 18.538 634 HG21 THR 91 3HG2 THR 91 49.409 -4.516 16.146 635 HG22 THR 91 1HG2 THR 91 50.907 -4.210 15.268 636 HG23 THR 91 2HG2 THR 91 50.699 -3.581 16.902 637 H GLN 92 H GLN 92 53.618 -7.361 15.882 638 HA GLN 92 HA GLN 92 53.517 -10.119 16.294 639 HB2 GLN 92 2HB GLN 92 55.835 -10.001 16.821 640 HB3 GLN 92 3HB GLN 92 55.528 -8.758 15.615 641 HG2 GLN 92 2HG GLN 92 55.159 -7.429 17.995 642 HG3 GLN 92 3HG GLN 92 56.502 -8.517 18.339 643 HE21 GLN 92 1HE2 GLN 92 56.077 -5.507 17.736 644 HE22 GLN 92 2HE2 GLN 92 57.364 -5.152 16.639 Start of MODEL 2 1 H1 MET 1 H MET 1 0.567 -1.093 -0.690 2 HA MET 1 HA MET 1 2.222 -0.368 -2.082 3 HB2 MET 1 2HB MET 1 2.895 2.050 -1.690 4 HB3 MET 1 3HB MET 1 1.175 1.745 -1.896 5 HG2 MET 1 2HG MET 1 0.689 2.194 0.300 6 HG3 MET 1 3HG MET 1 2.316 1.803 0.852 7 HE1 MET 1 3HE MET 1 0.557 3.991 1.794 8 HE2 MET 1 1HE MET 1 1.234 5.605 1.573 9 HE3 MET 1 2HE MET 1 0.027 4.992 0.441 10 HA PRO 2 HA PRO 2 5.561 -1.514 0.952 11 HB2 PRO 2 2HB PRO 2 6.411 -3.688 -0.435 12 HB3 PRO 2 3HB PRO 2 5.102 -3.757 0.751 13 HG2 PRO 2 2HG PRO 2 4.946 -3.591 -2.234 14 HG3 PRO 2 3HG PRO 2 3.999 -4.592 -1.118 15 HD2 PRO 2 2HD PRO 2 3.042 -2.295 -2.185 16 HD3 PRO 2 3HD PRO 2 2.584 -2.859 -0.565 17 H ALA 3 H ALA 3 7.855 -1.488 0.611 18 HA ALA 3 HA ALA 3 8.686 -0.489 -2.032 19 HB1 ALA 3 1HB ALA 3 8.679 0.943 0.425 20 HB2 ALA 3 2HB ALA 3 10.354 0.671 -0.058 21 HB3 ALA 3 3HB ALA 3 9.237 1.474 -1.162 22 H ALA 4 H ALA 4 11.119 -0.574 -2.287 23 HA ALA 4 HA ALA 4 12.215 -2.950 -0.931 24 HB1 ALA 4 1HB ALA 4 11.800 -3.809 -3.028 25 HB2 ALA 4 2HB ALA 4 12.136 -2.279 -3.839 26 HB3 ALA 4 3HB ALA 4 13.464 -3.247 -3.198 27 H LEU 5 H LEU 5 14.406 -2.939 -0.454 28 HA LEU 5 HA LEU 5 16.431 -2.064 0.095 29 HB2 LEU 5 2HB LEU 5 16.086 -1.458 -2.531 30 HB3 LEU 5 3HB LEU 5 16.333 0.144 -1.840 31 HG LEU 5 HG LEU 5 18.241 -2.180 -1.590 32 HD11 LEU 5 1HD1 LEU 5 18.277 -1.446 -3.844 33 HD12 LEU 5 2HD1 LEU 5 19.675 -0.721 -3.050 34 HD13 LEU 5 3HD1 LEU 5 18.237 0.250 -3.364 35 HD21 LEU 5 3HD2 LEU 5 18.229 0.614 -0.522 36 HD22 LEU 5 1HD2 LEU 5 19.753 -0.201 -0.877 37 HD23 LEU 5 2HD2 LEU 5 18.634 -0.896 0.296 38 H VAL 6 H VAL 6 16.287 -1.153 2.052 39 HA VAL 6 HA VAL 6 15.390 1.652 2.192 40 HB VAL 6 HB VAL 6 15.063 -0.426 4.361 41 HG11 VAL 6 1HG1 VAL 6 13.642 1.346 5.403 42 HG12 VAL 6 2HG1 VAL 6 15.360 1.742 5.323 43 HG13 VAL 6 3HG1 VAL 6 14.233 2.464 4.174 44 HG21 VAL 6 3HG2 VAL 6 12.622 -0.134 3.885 45 HG22 VAL 6 1HG2 VAL 6 13.074 0.754 2.430 46 HG23 VAL 6 2HG2 VAL 6 13.527 -0.942 2.606 47 H SER 7 H SER 7 17.122 -0.714 4.229 48 HA SER 7 HA SER 7 19.592 0.636 4.157 49 HB2 SER 7 2HB SER 7 17.669 1.469 6.269 50 HB3 SER 7 3HB SER 7 19.347 1.233 6.758 51 HG SER 7 HG SER 7 19.634 2.592 4.651 52 H ILE 8 H ILE 8 21.196 -0.362 5.490 53 HA ILE 8 HA ILE 8 20.339 -2.963 6.581 54 HB ILE 8 HB ILE 8 23.049 -2.341 5.411 55 HG12 ILE 8 2HG1 ILE 8 21.381 -2.207 3.644 56 HG13 ILE 8 3HG1 ILE 8 22.314 -3.689 3.467 57 HG21 ILE 8 1HG2 ILE 8 23.013 -4.932 5.302 58 HG22 ILE 8 2HG2 ILE 8 23.346 -4.136 6.840 59 HG23 ILE 8 3HG2 ILE 8 21.741 -4.792 6.516 60 HD11 ILE 8 3HD1 ILE 8 19.922 -4.020 3.062 61 HD12 ILE 8 1HD1 ILE 8 20.509 -4.975 4.423 62 HD13 ILE 8 2HD1 ILE 8 19.583 -3.503 4.713 63 H SER 9 H SER 9 21.365 -3.734 8.452 64 HA SER 9 HA SER 9 22.600 -1.619 10.076 65 HB2 SER 9 2HB SER 9 21.429 -4.200 11.114 66 HB3 SER 9 3HB SER 9 21.772 -2.722 12.013 67 HG SER 9 HG SER 9 19.600 -2.730 11.613 68 H VAL 10 H VAL 10 24.745 -1.722 10.090 69 HA VAL 10 HA VAL 10 26.046 -4.358 10.034 70 HB VAL 10 HB VAL 10 26.685 -2.769 8.241 71 HG11 VAL 10 1HG1 VAL 10 26.614 -0.869 10.207 72 HG12 VAL 10 2HG1 VAL 10 28.347 -1.112 9.981 73 HG13 VAL 10 3HG1 VAL 10 27.333 -0.659 8.611 74 HG21 VAL 10 3HG2 VAL 10 29.261 -2.791 9.332 75 HG22 VAL 10 1HG2 VAL 10 28.435 -4.182 10.035 76 HG23 VAL 10 2HG2 VAL 10 28.533 -4.008 8.283 77 H SER 11 H SER 11 27.269 -5.045 11.694 78 HA SER 11 HA SER 11 27.671 -3.183 13.942 79 HB2 SER 11 2HB SER 11 26.089 -4.951 14.518 80 HB3 SER 11 3HB SER 11 27.248 -6.181 14.011 81 HG SER 11 HG SER 11 27.049 -5.498 16.373 82 HA PRO 12 HA PRO 12 31.837 -4.515 12.336 83 HB2 PRO 12 2HB PRO 12 32.893 -2.014 12.297 84 HB3 PRO 12 3HB PRO 12 31.989 -2.697 10.940 85 HG2 PRO 12 2HG PRO 12 31.064 -0.814 13.075 86 HG3 PRO 12 3HG PRO 12 30.740 -0.775 11.332 87 HD2 PRO 12 2HD PRO 12 28.946 -1.719 13.127 88 HD3 PRO 12 3HD PRO 12 29.078 -2.364 11.478 89 H THR 13 H THR 13 33.687 -4.759 13.552 90 HA THR 13 HA THR 13 33.584 -3.670 16.290 91 HB THR 13 HB THR 13 35.323 -5.966 16.049 92 HG1 THR 13 HG1 THR 13 32.576 -6.467 15.491 93 HG21 THR 13 3HG2 THR 13 34.458 -5.126 18.160 94 HG22 THR 13 1HG2 THR 13 33.917 -6.784 17.904 95 HG23 THR 13 2HG2 THR 13 32.805 -5.442 17.633 96 H ASN 14 H ASN 14 35.035 -2.112 16.562 97 HA ASN 14 HA ASN 14 37.509 -2.150 14.999 98 HB2 ASN 14 2HB ASN 14 36.223 0.012 16.678 99 HB3 ASN 14 3HB ASN 14 37.775 0.189 15.866 100 HD21 ASN 14 1HD2 ASN 14 34.420 -0.733 15.195 101 HD22 ASN 14 2HD2 ASN 14 34.340 0.030 13.647 102 H SER 15 H SER 15 39.168 -3.170 15.900 103 HA SER 15 HA SER 15 40.270 -2.393 18.372 104 HB2 SER 15 2HB SER 15 38.172 -4.169 18.721 105 HB3 SER 15 3HB SER 15 39.595 -5.210 18.762 106 HG SER 15 HG SER 15 39.864 -4.514 20.715 107 H THR 16 H THR 16 41.754 -4.546 19.099 108 HA THR 16 HA THR 16 43.351 -5.029 16.681 109 HB THR 16 HB THR 16 45.265 -5.311 18.071 110 HG1 THR 16 HG1 THR 16 43.421 -5.297 20.244 111 HG21 THR 16 3HG2 THR 16 44.319 -3.137 19.716 112 HG22 THR 16 1HG2 THR 16 43.775 -2.945 18.050 113 HG23 THR 16 2HG2 THR 16 45.495 -3.117 18.402 114 H VAL 17 H VAL 17 44.123 -7.084 16.181 115 HA VAL 17 HA VAL 17 43.056 -9.325 17.753 116 HB VAL 17 HB VAL 17 42.967 -9.269 14.738 117 HG11 VAL 17 1HG1 VAL 17 41.379 -11.193 15.157 118 HG12 VAL 17 2HG1 VAL 17 43.078 -11.496 15.526 119 HG13 VAL 17 3HG1 VAL 17 41.935 -11.169 16.830 120 HG21 VAL 17 3HG2 VAL 17 41.404 -7.621 15.435 121 HG22 VAL 17 1HG2 VAL 17 40.478 -9.077 15.070 122 HG23 VAL 17 2HG2 VAL 17 40.812 -8.641 16.746 123 H ALA 18 H ALA 18 44.212 -11.292 17.545 124 HA ALA 18 HA ALA 18 47.019 -10.958 17.234 125 HB1 ALA 18 1HB ALA 18 46.778 -12.607 18.731 126 HB2 ALA 18 2HB ALA 18 45.200 -13.082 18.101 127 HB3 ALA 18 3HB ALA 18 46.672 -13.659 17.319 128 H LYS 19 H LYS 19 48.405 -11.730 15.668 129 HA LYS 19 HA LYS 19 47.635 -11.634 13.020 130 HB2 LYS 19 2HB LYS 19 49.994 -11.580 14.057 131 HB3 LYS 19 3HB LYS 19 49.942 -13.334 13.939 132 HG2 LYS 19 2HG LYS 19 49.161 -12.155 11.443 133 HG3 LYS 19 3HG LYS 19 50.717 -11.508 11.970 134 HD2 LYS 19 2HD LYS 19 51.164 -14.080 12.484 135 HD3 LYS 19 3HD LYS 19 49.963 -14.276 11.206 136 HE2 LYS 19 2HE LYS 19 51.698 -14.084 9.804 137 HE3 LYS 19 3HE LYS 19 51.606 -12.359 10.159 138 HZ1 LYS 19 3HZ LYS 19 53.497 -12.422 11.328 139 HZ2 LYS 19 1HZ LYS 19 53.792 -13.876 10.515 140 HZ3 LYS 19 2HZ LYS 19 53.129 -13.896 12.071 141 H GLY 20 H GLY 20 47.036 -13.106 11.473 142 HA2 GLY 20 2HA GLY 20 46.150 -15.033 10.596 143 HA3 GLY 20 3HA GLY 20 47.134 -15.906 11.761 144 H LEU 21 H LEU 21 44.075 -14.159 11.391 145 HA LEU 21 HA LEU 21 42.759 -16.144 13.044 146 HB2 LEU 21 2HB LEU 21 43.563 -13.645 14.116 147 HB3 LEU 21 3HB LEU 21 41.808 -13.619 13.955 148 HG LEU 21 HG LEU 21 42.475 -16.090 15.139 149 HD11 LEU 21 1HD1 LEU 21 44.575 -15.451 15.888 150 HD12 LEU 21 2HD1 LEU 21 43.532 -15.068 17.257 151 HD13 LEU 21 3HD1 LEU 21 44.076 -13.784 16.177 152 HD21 LEU 21 3HD2 LEU 21 41.384 -14.862 17.149 153 HD22 LEU 21 1HD2 LEU 21 40.435 -15.154 15.691 154 HD23 LEU 21 2HD2 LEU 21 41.128 -13.559 15.988 155 H GLN 22 H GLN 22 40.368 -15.814 13.064 156 HA GLN 22 HA GLN 22 39.458 -14.385 10.655 157 HB2 GLN 22 2HB GLN 22 38.374 -17.036 11.614 158 HB3 GLN 22 3HB GLN 22 37.943 -16.187 10.135 159 HG2 GLN 22 2HG GLN 22 40.185 -16.525 9.264 160 HG3 GLN 22 3HG GLN 22 40.656 -17.331 10.759 161 HE21 GLN 22 1HE2 GLN 22 39.276 -19.243 11.343 162 HE22 GLN 22 2HE2 GLN 22 38.818 -20.299 10.056 163 H GLU 23 H GLU 23 37.592 -13.237 10.822 164 HA GLU 23 HA GLU 23 36.099 -13.426 13.350 165 HB2 GLU 23 2HB GLU 23 37.762 -11.324 12.710 166 HB3 GLU 23 3HB GLU 23 36.187 -10.741 12.188 167 HG2 GLU 23 2HG GLU 23 36.313 -11.983 14.862 168 HG3 GLU 23 3HG GLU 23 37.122 -10.429 14.668 169 H ASN 24 H ASN 24 33.940 -13.475 13.150 170 HA ASN 24 HA ASN 24 32.818 -13.489 10.479 171 HB2 ASN 24 2HB ASN 24 30.795 -14.331 11.539 172 HB3 ASN 24 3HB ASN 24 32.192 -15.227 12.128 173 HD21 ASN 24 1HD2 ASN 24 29.434 -13.595 12.995 174 HD22 ASN 24 2HD2 ASN 24 29.768 -13.371 14.676 175 H PHE 25 H PHE 25 31.374 -12.047 9.649 176 HA PHE 25 HA PHE 25 31.156 -9.500 11.053 177 HB2 PHE 25 2HB PHE 25 31.628 -10.136 8.407 178 HB3 PHE 25 3HB PHE 25 29.935 -9.653 8.400 179 HD1 PHE 25 HD1 PHE 25 33.063 -8.470 10.066 180 HD2 PHE 25 HD2 PHE 25 29.597 -7.474 7.805 181 HE1 PHE 25 HE1 PHE 25 33.743 -6.105 10.071 182 HE2 PHE 25 HE2 PHE 25 30.272 -5.108 7.806 183 HZ PHE 25 HZ PHE 25 32.348 -4.421 8.939 184 H LYS 26 H LYS 26 28.955 -8.327 10.413 185 HA LYS 26 HA LYS 26 26.688 -10.141 10.729 186 HB2 LYS 26 2HB LYS 26 27.789 -8.562 12.859 187 HB3 LYS 26 3HB LYS 26 26.180 -7.969 12.468 188 HG2 LYS 26 2HG LYS 26 26.672 -10.891 12.877 189 HG3 LYS 26 3HG LYS 26 26.433 -9.807 14.250 190 HD2 LYS 26 2HD LYS 26 24.233 -9.879 13.944 191 HD3 LYS 26 3HD LYS 26 24.426 -9.263 12.301 192 HE2 LYS 26 2HE LYS 26 24.913 -11.614 11.579 193 HE3 LYS 26 3HE LYS 26 24.464 -12.139 13.201 194 HZ1 LYS 26 3HZ LYS 26 22.749 -11.955 11.167 195 HZ2 LYS 26 1HZ LYS 26 22.538 -10.430 11.870 196 HZ3 LYS 26 2HZ LYS 26 22.293 -11.827 12.791 197 H ALA 27 H ALA 27 25.049 -9.550 9.467 198 HA ALA 27 HA ALA 27 24.719 -6.720 8.771 199 HB1 ALA 27 1HB ALA 27 24.176 -7.555 6.393 200 HB2 ALA 27 2HB ALA 27 25.868 -7.405 6.871 201 HB3 ALA 27 3HB ALA 27 25.094 -8.989 6.853 202 H THR 28 H THR 28 22.723 -6.149 9.294 203 HA THR 28 HA THR 28 20.570 -8.148 9.040 204 HB THR 28 HB THR 28 19.845 -5.968 10.780 205 HG1 THR 28 HG1 THR 28 21.395 -6.149 12.326 206 HG21 THR 28 3HG2 THR 28 19.782 -8.068 12.381 207 HG22 THR 28 1HG2 THR 28 19.973 -8.943 10.863 208 HG23 THR 28 2HG2 THR 28 18.595 -7.867 11.093 209 H GLY 29 H GLY 29 19.585 -7.683 7.155 210 HA2 GLY 29 2HA GLY 29 19.222 -4.932 6.304 211 HA3 GLY 29 3HA GLY 29 18.761 -6.372 5.409 212 H ILE 30 H ILE 30 17.435 -3.739 6.489 213 HA ILE 30 HA ILE 30 14.952 -5.082 7.331 214 HB ILE 30 HB ILE 30 14.431 -2.974 8.624 215 HG12 ILE 30 2HG1 ILE 30 17.215 -2.319 9.094 216 HG13 ILE 30 3HG1 ILE 30 16.787 -2.082 7.403 217 HG21 ILE 30 1HG2 ILE 30 15.676 -3.676 10.584 218 HG22 ILE 30 2HG2 ILE 30 15.109 -5.083 9.685 219 HG23 ILE 30 3HG2 ILE 30 16.797 -4.586 9.570 220 HD11 ILE 30 3HD1 ILE 30 15.038 -0.568 7.993 221 HD12 ILE 30 1HD1 ILE 30 15.250 -0.917 9.709 222 HD13 ILE 30 2HD1 ILE 30 16.514 -0.068 8.819 223 H PHE 31 H PHE 31 13.571 -4.921 5.693 224 HA PHE 31 HA PHE 31 13.391 -2.348 4.267 225 HB2 PHE 31 2HB PHE 31 12.663 -5.039 3.108 226 HB3 PHE 31 3HB PHE 31 12.815 -3.507 2.255 227 HD1 PHE 31 HD1 PHE 31 15.353 -2.475 3.253 228 HD2 PHE 31 HD2 PHE 31 14.245 -6.443 2.182 229 HE1 PHE 31 HE1 PHE 31 17.704 -2.991 2.746 230 HE2 PHE 31 HE2 PHE 31 16.595 -6.965 1.673 231 HZ PHE 31 HZ PHE 31 18.328 -5.239 1.956 232 H THR 32 H THR 32 11.299 -1.672 3.590 233 HA THR 32 HA THR 32 9.272 -2.125 5.517 234 HB THR 32 HB THR 32 8.372 -0.987 2.961 235 HG1 THR 32 HG1 THR 32 10.249 0.545 4.417 236 HG21 THR 32 3HG2 THR 32 7.811 0.909 4.583 237 HG22 THR 32 1HG2 THR 32 8.356 -0.179 5.858 238 HG23 THR 32 2HG2 THR 32 6.993 -0.632 4.835 239 H ASP 33 H ASP 33 10.155 -3.806 2.698 240 HA ASP 33 HA ASP 33 7.533 -4.858 2.109 241 HB2 ASP 33 2HB ASP 33 8.830 -6.368 0.550 242 HB3 ASP 33 3HB ASP 33 9.009 -4.642 0.247 243 H ASN 34 H ASN 34 9.591 -5.377 4.585 244 HA ASN 34 HA ASN 34 9.893 -7.025 6.124 245 HB2 ASN 34 2HB ASN 34 7.452 -8.425 5.084 246 HB3 ASN 34 3HB ASN 34 8.001 -8.236 6.747 247 HD21 ASN 34 1HD2 ASN 34 8.113 -5.864 7.449 248 HD22 ASN 34 2HD2 ASN 34 6.740 -4.899 7.040 249 H SER 35 H SER 35 10.911 -7.365 3.336 250 HA SER 35 HA SER 35 11.379 -10.267 3.484 251 HB2 SER 35 2HB SER 35 9.823 -9.372 1.565 252 HB3 SER 35 3HB SER 35 11.347 -8.881 0.827 253 HG SER 35 HG SER 35 11.548 -10.872 0.225 254 H ASN 36 H ASN 36 13.304 -9.689 4.649 255 HA ASN 36 HA ASN 36 15.356 -8.243 3.165 256 HB2 ASN 36 2HB ASN 36 16.671 -8.408 5.246 257 HB3 ASN 36 3HB ASN 36 15.085 -7.697 5.531 258 HD21 ASN 36 1HD2 ASN 36 13.790 -8.593 6.999 259 HD22 ASN 36 2HD2 ASN 36 14.099 -10.083 7.818 260 H SER 37 H SER 37 17.293 -9.134 2.502 261 HA SER 37 HA SER 37 17.519 -12.064 2.695 262 HB2 SER 37 2HB SER 37 17.695 -10.296 0.283 263 HB3 SER 37 3HB SER 37 18.649 -11.778 0.339 264 HG SER 37 HG SER 37 15.886 -11.785 0.913 265 H ASP 38 H ASP 38 19.749 -12.855 2.249 266 HA ASP 38 HA ASP 38 21.638 -11.256 3.745 267 HB2 ASP 38 2HB ASP 38 23.127 -13.290 3.386 268 HB3 ASP 38 3HB ASP 38 21.645 -13.562 4.300 269 H ILE 39 H ILE 39 23.102 -9.943 2.892 270 HA ILE 39 HA ILE 39 24.103 -8.693 1.227 271 HB ILE 39 HB ILE 39 25.888 -9.948 0.090 272 HG12 ILE 39 2HG1 ILE 39 24.814 -12.423 1.438 273 HG13 ILE 39 3HG1 ILE 39 24.416 -12.013 -0.227 274 HG21 ILE 39 1HG2 ILE 39 25.599 -9.487 2.785 275 HG22 ILE 39 2HG2 ILE 39 26.105 -11.174 2.721 276 HG23 ILE 39 3HG2 ILE 39 27.098 -9.927 1.967 277 HD11 ILE 39 3HD1 ILE 39 27.037 -11.851 -0.442 278 HD12 ILE 39 1HD1 ILE 39 26.976 -12.942 0.942 279 HD13 ILE 39 2HD1 ILE 39 26.187 -13.390 -0.571 280 H THR 40 H THR 40 21.545 -9.178 0.390 281 HA THR 40 HA THR 40 21.237 -10.483 -2.062 282 HB THR 40 HB THR 40 19.597 -8.101 -1.928 283 HG1 THR 40 HG1 THR 40 18.935 -8.170 0.105 284 HG21 THR 40 3HG2 THR 40 17.791 -9.759 -1.884 285 HG22 THR 40 1HG2 THR 40 18.969 -11.037 -1.590 286 HG23 THR 40 2HG2 THR 40 18.990 -10.152 -3.116 287 H ASP 41 H ASP 41 22.537 -7.341 -1.283 288 HA ASP 41 HA ASP 41 22.638 -6.577 -4.101 289 HB2 ASP 41 2HB ASP 41 22.437 -5.144 -1.656 290 HB3 ASP 41 3HB ASP 41 23.963 -4.688 -2.411 291 H GLN 42 H GLN 42 24.382 -8.567 -2.327 292 HA GLN 42 HA GLN 42 26.449 -9.487 -2.684 293 HB2 GLN 42 2HB GLN 42 26.084 -8.160 -5.005 294 HB3 GLN 42 3HB GLN 42 27.462 -7.273 -4.368 295 HG2 GLN 42 2HG GLN 42 28.799 -9.224 -4.295 296 HG3 GLN 42 3HG GLN 42 27.411 -10.266 -4.603 297 HE21 GLN 42 1HE2 GLN 42 28.663 -11.140 -6.344 298 HE22 GLN 42 2HE2 GLN 42 28.734 -10.314 -7.859 299 H VAL 43 H VAL 43 26.521 -5.935 -2.497 300 HA VAL 43 HA VAL 43 27.582 -4.518 -1.061 301 HB VAL 43 HB VAL 43 28.341 -6.914 0.603 302 HG11 VAL 43 1HG1 VAL 43 27.905 -4.000 1.243 303 HG12 VAL 43 2HG1 VAL 43 28.180 -5.260 2.448 304 HG13 VAL 43 3HG1 VAL 43 29.434 -4.877 1.268 305 HG21 VAL 43 3HG2 VAL 43 26.072 -5.802 1.736 306 HG22 VAL 43 1HG2 VAL 43 25.708 -5.856 0.012 307 HG23 VAL 43 2HG2 VAL 43 26.166 -7.331 0.864 308 H THR 44 H THR 44 29.496 -3.559 -1.319 309 HA THR 44 HA THR 44 31.716 -5.156 -2.353 310 HB THR 44 HB THR 44 31.947 -2.200 -2.150 311 HG1 THR 44 HG1 THR 44 30.687 -2.092 -4.165 312 HG21 THR 44 3HG2 THR 44 32.437 -3.349 -4.733 313 HG22 THR 44 1HG2 THR 44 33.247 -4.306 -3.494 314 HG23 THR 44 2HG2 THR 44 33.573 -2.577 -3.627 315 H TRP 45 H TRP 45 33.430 -5.655 -1.158 316 HA TRP 45 HA TRP 45 33.923 -4.104 1.299 317 HB2 TRP 45 2HB TRP 45 34.887 -6.295 2.198 318 HB3 TRP 45 3HB TRP 45 33.134 -6.198 2.054 319 HD1 TRP 45 HD1 TRP 45 31.975 -8.043 0.667 320 HE1 TRP 45 HE1 TRP 45 32.788 -9.997 -0.797 321 HE3 TRP 45 HE3 TRP 45 36.960 -6.918 0.508 322 HZ2 TRP 45 HZ2 TRP 45 35.221 -10.938 -1.876 323 HZ3 TRP 45 HZ3 TRP 45 38.462 -8.396 -0.762 324 HH2 TRP 45 HH2 TRP 45 37.609 -10.364 -1.928 325 H ASP 46 H ASP 46 36.145 -4.018 2.013 326 HA ASP 46 HA ASP 46 38.204 -4.810 0.130 327 HB2 ASP 46 2HB ASP 46 37.199 -2.429 -0.417 328 HB3 ASP 46 3HB ASP 46 38.236 -1.926 0.914 329 H SER 47 H SER 47 40.244 -4.949 1.043 330 HA SER 47 HA SER 47 40.435 -4.280 3.904 331 HB2 SER 47 2HB SER 47 40.154 -6.818 3.126 332 HB3 SER 47 3HB SER 47 41.895 -6.671 2.887 333 HG SER 47 HG SER 47 41.950 -5.861 5.101 334 H SER 48 H SER 48 42.507 -3.746 4.678 335 HA SER 48 HA SER 48 44.069 -2.142 3.072 336 HB2 SER 48 2HB SER 48 44.299 -1.908 5.423 337 HB3 SER 48 3HB SER 48 44.723 -3.608 5.628 338 HG SER 48 HG SER 48 46.295 -1.463 4.859 339 H ASN 49 H ASN 49 46.346 -2.421 2.424 340 HA ASN 49 HA ASN 49 46.823 -5.147 1.413 341 HB2 ASN 49 2HB ASN 49 47.843 -2.575 0.196 342 HB3 ASN 49 3HB ASN 49 47.918 -4.189 -0.504 343 HD21 ASN 49 1HD2 ASN 49 45.858 -5.225 -1.007 344 HD22 ASN 49 2HD2 ASN 49 44.539 -4.238 -1.526 345 H THR 50 H THR 50 47.652 -4.016 3.995 346 HA THR 50 HA THR 50 50.279 -3.187 4.127 347 HB THR 50 HB THR 50 50.159 -4.814 6.308 348 HG1 THR 50 HG1 THR 50 48.177 -5.640 6.184 349 HG21 THR 50 3HG2 THR 50 49.982 -2.868 7.448 350 HG22 THR 50 1HG2 THR 50 48.556 -2.349 6.550 351 HG23 THR 50 2HG2 THR 50 50.161 -2.151 5.847 352 H ASP 51 H ASP 51 49.391 -6.544 4.898 353 HA ASP 51 HA ASP 51 51.819 -7.416 3.472 354 HB2 ASP 51 2HB ASP 51 51.541 -7.575 6.141 355 HB3 ASP 51 3HB ASP 51 50.774 -9.094 5.686 356 H ILE 52 H ILE 52 48.660 -8.546 4.668 357 HA ILE 52 HA ILE 52 47.878 -9.593 2.161 358 HB ILE 52 HB ILE 52 49.479 -11.344 2.567 359 HG12 ILE 52 2HG1 ILE 52 48.004 -13.305 2.554 360 HG13 ILE 52 3HG1 ILE 52 46.689 -12.332 3.205 361 HG21 ILE 52 1HG2 ILE 52 49.607 -12.639 4.536 362 HG22 ILE 52 2HG2 ILE 52 49.512 -10.961 5.067 363 HG23 ILE 52 3HG2 ILE 52 48.085 -11.994 5.150 364 HD11 ILE 52 3HD1 ILE 52 46.131 -11.577 1.194 365 HD12 ILE 52 1HD1 ILE 52 47.804 -11.207 0.776 366 HD13 ILE 52 2HD1 ILE 52 47.180 -12.841 0.552 367 H LEU 53 H LEU 53 45.773 -9.211 2.238 368 HA LEU 53 HA LEU 53 44.273 -10.039 4.626 369 HB2 LEU 53 2HB LEU 53 44.093 -7.425 3.153 370 HB3 LEU 53 3HB LEU 53 42.799 -8.016 4.194 371 HG LEU 53 HG LEU 53 44.057 -6.443 5.450 372 HD11 LEU 53 1HD1 LEU 53 44.975 -9.187 6.292 373 HD12 LEU 53 2HD1 LEU 53 43.378 -8.516 6.616 374 HD13 LEU 53 3HD1 LEU 53 44.809 -7.761 7.317 375 HD21 LEU 53 3HD2 LEU 53 46.632 -7.783 5.477 376 HD22 LEU 53 1HD2 LEU 53 46.243 -6.082 5.220 377 HD23 LEU 53 2HD2 LEU 53 46.188 -7.212 3.867 378 H SER 54 H SER 54 42.584 -11.295 4.180 379 HA SER 54 HA SER 54 41.321 -11.115 1.538 380 HB2 SER 54 2HB SER 54 42.957 -13.289 2.461 381 HB3 SER 54 3HB SER 54 41.298 -13.851 2.259 382 HG SER 54 HG SER 54 41.424 -12.792 0.133 383 H ILE 55 H ILE 55 39.240 -10.726 1.838 384 HA ILE 55 HA ILE 55 37.839 -12.115 4.019 385 HB ILE 55 HB ILE 55 37.482 -9.209 3.277 386 HG12 ILE 55 2HG1 ILE 55 37.999 -9.169 5.900 387 HG13 ILE 55 3HG1 ILE 55 38.870 -10.642 5.486 388 HG21 ILE 55 1HG2 ILE 55 35.927 -9.294 5.312 389 HG22 ILE 55 2HG2 ILE 55 35.334 -9.963 3.793 390 HG23 ILE 55 3HG2 ILE 55 35.916 -11.039 5.063 391 HD11 ILE 55 3HD1 ILE 55 40.524 -9.104 5.231 392 HD12 ILE 55 1HD1 ILE 55 39.869 -9.114 3.594 393 HD13 ILE 55 2HD1 ILE 55 39.417 -7.831 4.717 394 H SER 56 H SER 56 36.053 -13.137 3.388 395 HA SER 56 HA SER 56 34.817 -12.343 0.833 396 HB2 SER 56 2HB SER 56 36.046 -14.821 1.495 397 HB3 SER 56 3HB SER 56 34.310 -15.107 1.372 398 HG SER 56 HG SER 56 36.122 -14.586 -0.586 399 H ASN 57 H ASN 57 32.766 -11.754 1.014 400 HA ASN 57 HA ASN 57 31.218 -12.747 3.317 401 HB2 ASN 57 2HB ASN 57 30.728 -10.140 1.875 402 HB3 ASN 57 3HB ASN 57 30.060 -10.663 3.419 403 HD21 ASN 57 1HD2 ASN 57 31.392 -8.233 3.000 404 HD22 ASN 57 2HD2 ASN 57 32.845 -8.244 3.936 405 H ALA 58 H ALA 58 31.370 -14.177 0.904 406 HA ALA 58 HA ALA 58 28.731 -13.698 -0.311 407 HB1 ALA 58 1HB ALA 58 30.976 -15.359 -1.441 408 HB2 ALA 58 2HB ALA 58 29.495 -14.856 -2.258 409 HB3 ALA 58 3HB ALA 58 30.714 -13.657 -1.825 410 H SER 59 H SER 59 30.569 -15.854 1.619 411 HA SER 59 HA SER 59 29.385 -18.312 1.114 412 HB2 SER 59 2HB SER 59 30.907 -17.102 3.293 413 HB3 SER 59 3HB SER 59 29.756 -18.311 3.862 414 HG SER 59 HG SER 59 31.909 -18.613 2.068 415 H ASP 60 H ASP 60 28.283 -15.671 3.191 416 HA ASP 60 HA ASP 60 25.556 -16.365 2.889 417 HB2 ASP 60 2HB ASP 60 26.790 -17.946 4.765 418 HB3 ASP 60 3HB ASP 60 26.143 -16.638 5.752 419 H SER 61 H SER 61 24.438 -15.249 5.129 420 HA SER 61 HA SER 61 24.499 -12.545 4.635 421 HB2 SER 61 2HB SER 61 22.699 -12.946 5.952 422 HB3 SER 61 3HB SER 61 23.502 -14.257 6.816 423 HG SER 61 HG SER 61 23.709 -11.472 7.275 424 H HIS 62 H HIS 62 26.287 -14.311 7.147 425 HA HIS 62 HA HIS 62 27.707 -11.930 7.961 426 HB2 HIS 62 2HB HIS 62 28.716 -13.286 9.641 427 HB3 HIS 62 3HB HIS 62 27.036 -13.801 9.528 428 HD1 HIS 62 HD1 HIS 62 26.602 -16.214 8.953 429 HD2 HIS 62 HD2 HIS 62 30.588 -15.138 8.483 430 HE1 HIS 62 HE1 HIS 62 27.836 -18.367 8.541 431 H GLY 63 H GLY 63 29.792 -11.385 7.497 432 HA2 GLY 63 2HA GLY 63 31.039 -12.884 5.302 433 HA3 GLY 63 3HA GLY 63 31.393 -11.220 5.742 434 H LEU 64 H LEU 64 32.885 -13.977 5.516 435 HA LEU 64 HA LEU 64 34.143 -14.049 8.143 436 HB2 LEU 64 2HB LEU 64 35.431 -15.958 7.130 437 HB3 LEU 64 3HB LEU 64 33.689 -16.188 7.273 438 HG LEU 64 HG LEU 64 34.608 -15.145 4.677 439 HD11 LEU 64 1HD1 LEU 64 36.297 -16.953 5.586 440 HD12 LEU 64 2HD1 LEU 64 35.746 -16.968 3.911 441 HD13 LEU 64 3HD1 LEU 64 35.017 -18.060 5.089 442 HD21 LEU 64 3HD2 LEU 64 32.529 -16.926 5.794 443 HD22 LEU 64 1HD2 LEU 64 33.076 -17.277 4.154 444 HD23 LEU 64 2HD2 LEU 64 32.415 -15.688 4.542 445 H ALA 65 H ALA 65 35.684 -12.599 8.513 446 HA ALA 65 HA ALA 65 37.411 -11.732 6.310 447 HB1 ALA 65 1HB ALA 65 36.669 -10.555 8.951 448 HB2 ALA 65 2HB ALA 65 38.168 -10.061 8.163 449 HB3 ALA 65 3HB ALA 65 36.624 -9.830 7.344 450 H SER 66 H SER 66 39.428 -12.446 6.124 451 HA SER 66 HA SER 66 40.718 -13.640 8.490 452 HB2 SER 66 2HB SER 66 40.321 -15.523 7.182 453 HB3 SER 66 3HB SER 66 40.536 -14.643 5.669 454 HG SER 66 HG SER 66 42.514 -15.537 7.481 455 H THR 67 H THR 67 42.547 -12.685 9.062 456 HA THR 67 HA THR 67 44.039 -11.163 7.023 457 HB THR 67 HB THR 67 43.132 -9.546 8.504 458 HG1 THR 67 HG1 THR 67 45.136 -8.903 9.686 459 HG21 THR 67 3HG2 THR 67 43.781 -9.812 11.033 460 HG22 THR 67 1HG2 THR 67 43.851 -11.525 10.623 461 HG23 THR 67 2HG2 THR 67 42.354 -10.622 10.389 462 H LEU 68 H LEU 68 46.348 -11.011 7.346 463 HA LEU 68 HA LEU 68 47.638 -12.728 9.256 464 HB2 LEU 68 2HB LEU 68 46.796 -14.032 7.063 465 HB3 LEU 68 3HB LEU 68 48.358 -13.457 6.485 466 HG LEU 68 HG LEU 68 48.667 -14.654 9.074 467 HD11 LEU 68 1HD1 LEU 68 46.870 -16.044 7.196 468 HD12 LEU 68 2HD1 LEU 68 47.021 -16.189 8.946 469 HD13 LEU 68 3HD1 LEU 68 48.168 -17.015 7.892 470 HD21 LEU 68 3HD2 LEU 68 50.150 -14.325 6.849 471 HD22 LEU 68 1HD2 LEU 68 49.668 -16.011 6.658 472 HD23 LEU 68 2HD2 LEU 68 50.523 -15.498 8.113 473 H ASN 69 H ASN 69 47.834 -10.010 8.854 474 HA ASN 69 HA ASN 69 50.464 -9.690 7.569 475 HB2 ASN 69 2HB ASN 69 49.935 -7.330 7.306 476 HB3 ASN 69 3HB ASN 69 48.650 -8.307 6.600 477 HD21 ASN 69 1HD2 ASN 69 49.129 -5.601 8.224 478 HD22 ASN 69 2HD2 ASN 69 47.690 -5.525 9.177 479 H GLN 70 H GLN 70 51.755 -7.829 8.600 480 HA GLN 70 HA GLN 70 51.580 -8.063 11.533 481 HB2 GLN 70 2HB GLN 70 54.072 -7.844 9.835 482 HB3 GLN 70 3HB GLN 70 54.037 -7.884 11.593 483 HG2 GLN 70 2HG GLN 70 53.190 -10.129 11.580 484 HG3 GLN 70 3HG GLN 70 53.027 -10.098 9.825 485 HE21 GLN 70 1HE2 GLN 70 54.519 -11.279 8.892 486 HE22 GLN 70 2HE2 GLN 70 56.170 -11.418 9.381 487 H GLY 71 H GLY 71 50.176 -6.103 11.134 488 HA2 GLY 71 2HA GLY 71 51.559 -3.780 11.914 489 HA3 GLY 71 3HA GLY 71 51.214 -3.674 10.194 490 H ASN 72 H ASN 72 49.300 -2.882 9.597 491 HA ASN 72 HA ASN 72 47.099 -2.918 11.547 492 HB2 ASN 72 2HB ASN 72 46.604 -0.648 11.241 493 HB3 ASN 72 3HB ASN 72 48.362 -0.673 11.342 494 HD21 ASN 72 1HD2 ASN 72 49.582 -0.309 9.489 495 HD22 ASN 72 2HD2 ASN 72 48.900 0.399 8.069 496 H VAL 73 H VAL 73 44.987 -2.856 10.649 497 HA VAL 73 HA VAL 73 44.817 -3.320 7.753 498 HB VAL 73 HB VAL 73 43.331 -4.999 9.773 499 HG11 VAL 73 1HG1 VAL 73 43.016 -6.436 7.688 500 HG12 VAL 73 2HG1 VAL 73 42.092 -4.935 7.781 501 HG13 VAL 73 3HG1 VAL 73 43.540 -5.020 6.777 502 HG21 VAL 73 3HG2 VAL 73 44.845 -6.815 9.204 503 HG22 VAL 73 1HG2 VAL 73 45.749 -5.747 8.130 504 HG23 VAL 73 2HG2 VAL 73 45.745 -5.452 9.869 505 H LYS 74 H LYS 74 43.023 -2.507 6.769 506 HA LYS 74 HA LYS 74 40.974 -1.278 8.488 507 HB2 LYS 74 2HB LYS 74 42.629 0.382 7.534 508 HB3 LYS 74 3HB LYS 74 42.015 -0.037 5.940 509 HG2 LYS 74 2HG LYS 74 40.013 1.013 6.280 510 HG3 LYS 74 3HG LYS 74 40.076 0.806 8.032 511 HD2 LYS 74 2HD LYS 74 42.159 2.515 6.797 512 HD3 LYS 74 3HD LYS 74 40.514 3.155 6.837 513 HE2 LYS 74 2HE LYS 74 40.504 3.355 9.096 514 HE3 LYS 74 3HE LYS 74 41.520 1.934 9.335 515 HZ1 LYS 74 3HZ LYS 74 42.550 4.137 9.907 516 HZ2 LYS 74 1HZ LYS 74 42.572 4.482 8.251 517 HZ3 LYS 74 2HZ LYS 74 43.448 3.167 8.852 518 H VAL 75 H VAL 75 39.212 -2.477 8.141 519 HA VAL 75 HA VAL 75 38.604 -3.356 5.405 520 HB VAL 75 HB VAL 75 37.271 -4.263 7.957 521 HG11 VAL 75 1HG1 VAL 75 37.119 -6.252 6.034 522 HG12 VAL 75 2HG1 VAL 75 35.820 -5.164 6.525 523 HG13 VAL 75 3HG1 VAL 75 36.832 -4.762 5.137 524 HG21 VAL 75 3HG2 VAL 75 39.658 -5.363 6.497 525 HG22 VAL 75 1HG2 VAL 75 39.514 -4.935 8.202 526 HG23 VAL 75 2HG2 VAL 75 38.671 -6.351 7.575 527 H THR 76 H THR 76 37.201 -2.190 4.287 528 HA THR 76 HA THR 76 35.028 -0.822 5.734 529 HB THR 76 HB THR 76 35.114 0.931 3.931 530 HG1 THR 76 HG1 THR 76 36.907 1.007 2.615 531 HG21 THR 76 3HG2 THR 76 36.820 2.202 4.985 532 HG22 THR 76 1HG2 THR 76 37.693 0.753 5.480 533 HG23 THR 76 2HG2 THR 76 36.147 1.151 6.231 534 H ALA 77 H ALA 77 33.004 -0.967 4.884 535 HA ALA 77 HA ALA 77 32.623 -2.062 2.214 536 HB1 ALA 77 1HB ALA 77 30.913 -3.705 3.277 537 HB2 ALA 77 2HB ALA 77 32.626 -4.125 3.250 538 HB3 ALA 77 3HB ALA 77 31.895 -3.502 4.728 539 H SER 78 H SER 78 30.739 -1.420 1.265 540 HA SER 78 HA SER 78 28.849 0.105 2.932 541 HB2 SER 78 2HB SER 78 30.503 1.369 1.273 542 HB3 SER 78 3HB SER 78 29.274 0.918 0.092 543 HG SER 78 HG SER 78 28.546 2.805 0.856 544 H ILE 79 H ILE 79 26.704 -0.182 2.524 545 HA ILE 79 HA ILE 79 25.939 -1.839 0.226 546 HB ILE 79 HB ILE 79 26.076 -3.402 2.053 547 HG12 ILE 79 2HG1 ILE 79 23.762 -4.208 2.115 548 HG13 ILE 79 3HG1 ILE 79 23.187 -2.634 1.574 549 HG21 ILE 79 1HG2 ILE 79 24.966 -3.130 4.147 550 HG22 ILE 79 2HG2 ILE 79 25.903 -1.667 3.846 551 HG23 ILE 79 3HG2 ILE 79 24.158 -1.664 3.592 552 HD11 ILE 79 3HD1 ILE 79 23.833 -4.823 -0.003 553 HD12 ILE 79 1HD1 ILE 79 23.505 -3.178 -0.547 554 HD13 ILE 79 2HD1 ILE 79 25.164 -3.689 -0.234 555 H GLY 80 H GLY 80 24.370 -0.890 -0.887 556 HA2 GLY 80 2HA GLY 80 22.659 0.541 -1.437 557 HA3 GLY 80 3HA GLY 80 21.959 0.037 0.095 558 H GLY 81 H GLY 81 21.609 1.577 1.552 559 HA2 GLY 81 2HA GLY 81 22.761 4.221 1.071 560 HA3 GLY 81 3HA GLY 81 21.409 3.855 2.133 561 H ILE 82 H ILE 82 22.358 1.980 3.812 562 HA ILE 82 HA ILE 82 24.010 3.501 5.558 563 HB ILE 82 HB ILE 82 23.360 0.567 5.814 564 HG12 ILE 82 2HG1 ILE 82 21.285 1.795 5.465 565 HG13 ILE 82 3HG1 ILE 82 21.405 1.292 7.147 566 HG21 ILE 82 1HG2 ILE 82 23.455 1.249 8.285 567 HG22 ILE 82 2HG2 ILE 82 24.977 1.104 7.407 568 HG23 ILE 82 3HG2 ILE 82 24.283 2.697 7.712 569 HD11 ILE 82 3HD1 ILE 82 21.130 3.925 6.033 570 HD12 ILE 82 1HD1 ILE 82 20.973 3.387 7.705 571 HD13 ILE 82 2HD1 ILE 82 22.557 3.823 7.064 572 H GLN 83 H GLN 83 26.101 3.020 6.324 573 HA GLN 83 HA GLN 83 27.688 1.239 4.599 574 HB2 GLN 83 2HB GLN 83 29.553 2.862 4.767 575 HB3 GLN 83 3HB GLN 83 28.155 3.511 3.920 576 HG2 GLN 83 2HG GLN 83 27.762 5.079 5.483 577 HG3 GLN 83 3HG GLN 83 28.242 4.027 6.814 578 HE21 GLN 83 1HE2 GLN 83 28.948 6.847 5.680 579 HE22 GLN 83 2HE2 GLN 83 30.667 6.894 5.846 580 H GLY 84 H GLY 84 29.654 0.415 5.577 581 HA2 GLY 84 2HA GLY 84 29.556 0.423 8.529 582 HA3 GLY 84 3HA GLY 84 29.776 -1.063 7.618 583 H SER 85 H SER 85 31.489 0.324 9.628 584 HA SER 85 HA SER 85 33.966 0.155 8.095 585 HB2 SER 85 2HB SER 85 34.701 2.247 9.549 586 HB3 SER 85 3HB SER 85 33.893 2.458 7.996 587 HG SER 85 HG SER 85 33.054 3.669 9.897 588 H THR 86 H THR 86 35.586 -0.798 9.196 589 HA THR 86 HA THR 86 35.392 -1.027 12.110 590 HB THR 86 HB THR 86 34.395 -3.076 11.496 591 HG1 THR 86 HG1 THR 86 35.830 -4.472 12.392 592 HG21 THR 86 3HG2 THR 86 34.673 -3.420 9.243 593 HG22 THR 86 1HG2 THR 86 35.817 -4.602 9.877 594 HG23 THR 86 2HG2 THR 86 36.396 -3.044 9.287 595 H ASP 87 H ASP 87 37.379 -1.541 13.154 596 HA ASP 87 HA ASP 87 39.753 -1.097 11.465 597 HB2 ASP 87 2HB ASP 87 39.594 0.852 12.756 598 HB3 ASP 87 3HB ASP 87 39.051 -0.026 14.183 599 H PHE 88 H PHE 88 41.242 -2.646 11.493 600 HA PHE 88 HA PHE 88 41.231 -4.555 13.737 601 HB2 PHE 88 2HB PHE 88 41.389 -5.035 10.781 602 HB3 PHE 88 3HB PHE 88 42.149 -6.169 11.893 603 HD1 PHE 88 HD1 PHE 88 40.382 -6.488 14.068 604 HD2 PHE 88 HD2 PHE 88 39.424 -5.876 9.967 605 HE1 PHE 88 HE1 PHE 88 38.216 -7.603 14.412 606 HE2 PHE 88 HE2 PHE 88 37.256 -6.990 10.304 607 HZ PHE 88 HZ PHE 88 36.649 -7.854 12.528 608 H LYS 89 H LYS 89 43.020 -4.335 14.891 609 HA LYS 89 HA LYS 89 45.493 -3.496 13.542 610 HB2 LYS 89 2HB LYS 89 44.281 -2.871 16.108 611 HB3 LYS 89 3HB LYS 89 45.941 -3.421 16.292 612 HG2 LYS 89 2HG LYS 89 45.552 -1.461 14.153 613 HG3 LYS 89 3HG LYS 89 45.191 -0.863 15.774 614 HD2 LYS 89 2HD LYS 89 47.647 -2.433 15.646 615 HD3 LYS 89 3HD LYS 89 47.686 -0.995 14.623 616 HE2 LYS 89 2HE LYS 89 46.678 -0.758 17.419 617 HE3 LYS 89 3HE LYS 89 48.415 -0.886 17.147 618 HZ1 LYS 89 3HZ LYS 89 47.128 1.420 17.143 619 HZ2 LYS 89 1HZ LYS 89 46.977 1.038 15.501 620 HZ3 LYS 89 2HZ LYS 89 48.510 1.148 16.207 621 H VAL 90 H VAL 90 46.786 -5.125 13.013 622 HA VAL 90 HA VAL 90 46.858 -7.507 14.734 623 HB VAL 90 HB VAL 90 48.047 -8.565 12.770 624 HG11 VAL 90 1HG1 VAL 90 45.461 -8.494 13.361 625 HG12 VAL 90 2HG1 VAL 90 45.387 -7.677 11.798 626 HG13 VAL 90 3HG1 VAL 90 46.068 -9.300 11.915 627 HG21 VAL 90 3HG2 VAL 90 46.942 -6.741 10.821 628 HG22 VAL 90 1HG2 VAL 90 48.130 -5.939 11.850 629 HG23 VAL 90 2HG2 VAL 90 48.576 -7.391 10.953 630 H THR 91 H THR 91 48.454 -7.511 16.167 631 HA THR 91 HA THR 91 51.120 -6.617 15.302 632 HB THR 91 HB THR 91 51.528 -5.710 17.574 633 HG1 THR 91 HG1 THR 91 49.530 -5.282 18.808 634 HG21 THR 91 3HG2 THR 91 49.739 -3.782 17.295 635 HG22 THR 91 1HG2 THR 91 49.464 -4.580 15.747 636 HG23 THR 91 2HG2 THR 91 51.068 -3.970 16.152 637 H GLN 92 H GLN 92 52.856 -7.767 16.118 638 HA GLN 92 HA GLN 92 52.150 -10.291 17.447 639 HB2 GLN 92 2HB GLN 92 54.174 -11.218 16.501 640 HB3 GLN 92 3HB GLN 92 53.229 -10.463 15.225 641 HG2 GLN 92 2HG GLN 92 55.106 -9.442 14.632 642 HG3 GLN 92 3HG GLN 92 54.880 -8.431 16.059 643 HE21 GLN 92 1HE2 GLN 92 56.986 -8.122 16.569 644 HE22 GLN 92 2HE2 GLN 92 58.059 -9.386 17.056 Start of MODEL 3 1 H1 MET 1 H MET 1 2.628 -2.581 -0.432 2 HA MET 1 HA MET 1 3.641 -0.969 -2.681 3 HB2 MET 1 2HB MET 1 1.960 0.120 -1.017 4 HB3 MET 1 3HB MET 1 3.332 0.162 0.081 5 HG2 MET 1 2HG MET 1 4.572 1.341 -1.824 6 HG3 MET 1 3HG MET 1 2.976 1.579 -2.530 7 HE1 MET 1 3HE MET 1 3.892 5.114 -1.083 8 HE2 MET 1 1HE MET 1 4.850 3.940 -1.986 9 HE3 MET 1 2HE MET 1 3.191 4.285 -2.473 10 HA PRO 2 HA PRO 2 7.180 -2.954 -0.422 11 HB2 PRO 2 2HB PRO 2 8.491 -3.721 -2.672 12 HB3 PRO 2 3HB PRO 2 7.240 -4.707 -1.906 13 HG2 PRO 2 2HG PRO 2 7.031 -2.884 -4.270 14 HG3 PRO 2 3HG PRO 2 6.343 -4.502 -4.041 15 HD2 PRO 2 2HD PRO 2 4.882 -2.243 -3.740 16 HD3 PRO 2 3HD PRO 2 4.576 -3.712 -2.791 17 H ALA 3 H ALA 3 9.205 -2.082 -0.108 18 HA ALA 3 HA ALA 3 10.083 0.069 -1.895 19 HB1 ALA 3 1HB ALA 3 9.790 1.709 -0.425 20 HB2 ALA 3 2HB ALA 3 8.867 0.574 0.561 21 HB3 ALA 3 3HB ALA 3 10.593 0.791 0.849 22 H ALA 4 H ALA 4 11.828 -1.083 -2.627 23 HA ALA 4 HA ALA 4 13.572 -2.550 -0.914 24 HB1 ALA 4 1HB ALA 4 14.632 -3.218 -2.807 25 HB2 ALA 4 2HB ALA 4 13.124 -2.663 -3.535 26 HB3 ALA 4 3HB ALA 4 14.547 -1.621 -3.553 27 H LEU 5 H LEU 5 15.632 -2.037 -0.192 28 HA LEU 5 HA LEU 5 17.311 -0.732 0.611 29 HB2 LEU 5 2HB LEU 5 16.751 0.263 -2.030 30 HB3 LEU 5 3HB LEU 5 17.249 1.581 -0.971 31 HG LEU 5 HG LEU 5 19.128 0.627 -2.232 32 HD11 LEU 5 1HD1 LEU 5 18.965 0.816 0.670 33 HD12 LEU 5 2HD1 LEU 5 20.169 1.461 -0.445 34 HD13 LEU 5 3HD1 LEU 5 20.287 -0.209 0.111 35 HD21 LEU 5 3HD2 LEU 5 17.963 -1.765 -1.941 36 HD22 LEU 5 1HD2 LEU 5 19.121 -1.847 -0.613 37 HD23 LEU 5 2HD2 LEU 5 19.686 -1.567 -2.260 38 H VAL 6 H VAL 6 16.603 -0.095 2.577 39 HA VAL 6 HA VAL 6 15.297 2.537 2.721 40 HB VAL 6 HB VAL 6 14.621 0.235 4.553 41 HG11 VAL 6 1HG1 VAL 6 13.970 1.954 5.842 42 HG12 VAL 6 2HG1 VAL 6 13.991 3.099 4.499 43 HG13 VAL 6 3HG1 VAL 6 12.599 2.042 4.736 44 HG21 VAL 6 3HG2 VAL 6 13.128 1.326 2.173 45 HG22 VAL 6 1HG2 VAL 6 13.759 -0.307 2.387 46 HG23 VAL 6 2HG2 VAL 6 12.416 0.257 3.382 47 H SER 7 H SER 7 17.037 0.038 4.559 48 HA SER 7 HA SER 7 19.056 1.744 5.466 49 HB2 SER 7 2HB SER 7 16.593 1.912 6.983 50 HB3 SER 7 3HB SER 7 17.917 1.333 7.993 51 HG SER 7 HG SER 7 17.554 3.731 7.687 52 H ILE 8 H ILE 8 20.472 0.719 7.054 53 HA ILE 8 HA ILE 8 19.944 -2.083 7.643 54 HB ILE 8 HB ILE 8 22.440 -1.279 6.147 55 HG12 ILE 8 2HG1 ILE 8 20.001 -2.779 5.168 56 HG13 ILE 8 3HG1 ILE 8 20.481 -1.159 4.678 57 HG21 ILE 8 1HG2 ILE 8 23.261 -3.232 6.803 58 HG22 ILE 8 2HG2 ILE 8 21.806 -3.520 7.756 59 HG23 ILE 8 3HG2 ILE 8 21.885 -4.067 6.081 60 HD11 ILE 8 3HD1 ILE 8 21.206 -3.622 3.527 61 HD12 ILE 8 1HD1 ILE 8 21.730 -2.002 3.066 62 HD13 ILE 8 2HD1 ILE 8 22.663 -2.930 4.241 63 H SER 9 H SER 9 20.882 -2.757 9.499 64 HA SER 9 HA SER 9 22.452 -0.774 10.972 65 HB2 SER 9 2HB SER 9 20.469 -2.770 11.691 66 HB3 SER 9 3HB SER 9 21.920 -2.918 12.682 67 HG SER 9 HG SER 9 20.956 -1.364 13.752 68 H VAL 10 H VAL 10 24.580 -0.955 10.746 69 HA VAL 10 HA VAL 10 25.776 -3.610 10.406 70 HB VAL 10 HB VAL 10 26.378 -1.864 8.763 71 HG11 VAL 10 1HG1 VAL 10 27.168 0.174 9.297 72 HG12 VAL 10 2HG1 VAL 10 26.409 -0.146 10.858 73 HG13 VAL 10 3HG1 VAL 10 28.135 -0.438 10.639 74 HG21 VAL 10 3HG2 VAL 10 28.131 -3.554 10.228 75 HG22 VAL 10 1HG2 VAL 10 28.253 -3.032 8.548 76 HG23 VAL 10 2HG2 VAL 10 29.001 -2.074 9.826 77 H SER 11 H SER 11 27.071 -4.520 11.896 78 HA SER 11 HA SER 11 27.654 -2.950 14.321 79 HB2 SER 11 2HB SER 11 26.980 -5.869 13.971 80 HB3 SER 11 3HB SER 11 27.744 -5.256 15.438 81 HG SER 11 HG SER 11 25.957 -3.881 15.719 82 HA PRO 12 HA PRO 12 31.694 -4.114 12.320 83 HB2 PRO 12 2HB PRO 12 32.798 -1.645 12.553 84 HB3 PRO 12 3HB PRO 12 31.805 -2.127 11.172 85 HG2 PRO 12 2HG PRO 12 31.042 -0.537 13.591 86 HG3 PRO 12 3HG PRO 12 30.621 -0.259 11.891 87 HD2 PRO 12 2HD PRO 12 28.911 -1.412 13.645 88 HD3 PRO 12 3HD PRO 12 28.937 -1.832 11.920 89 H THR 13 H THR 13 33.426 -4.780 13.465 90 HA THR 13 HA THR 13 33.589 -3.941 16.284 91 HB THR 13 HB THR 13 34.717 -6.071 16.736 92 HG1 THR 13 HG1 THR 13 34.051 -6.972 14.147 93 HG21 THR 13 3HG2 THR 13 32.161 -5.794 16.691 94 HG22 THR 13 1HG2 THR 13 32.811 -7.432 16.698 95 HG23 THR 13 2HG2 THR 13 32.223 -6.724 15.194 96 H ASN 14 H ASN 14 35.168 -2.530 16.636 97 HA ASN 14 HA ASN 14 37.588 -2.646 14.981 98 HB2 ASN 14 2HB ASN 14 36.618 -0.442 16.816 99 HB3 ASN 14 3HB ASN 14 38.022 -0.362 15.755 100 HD21 ASN 14 1HD2 ASN 14 34.522 -0.767 15.781 101 HD22 ASN 14 2HD2 ASN 14 34.249 -0.068 14.225 102 H SER 15 H SER 15 39.244 -3.719 15.811 103 HA SER 15 HA SER 15 40.323 -3.135 18.362 104 HB2 SER 15 2HB SER 15 38.250 -5.001 18.458 105 HB3 SER 15 3HB SER 15 39.719 -5.975 18.505 106 HG SER 15 HG SER 15 39.292 -5.424 20.590 107 H THR 16 H THR 16 41.818 -5.339 18.899 108 HA THR 16 HA THR 16 43.463 -5.560 16.475 109 HB THR 16 HB THR 16 45.352 -5.992 17.878 110 HG1 THR 16 HG1 THR 16 43.573 -5.966 20.106 111 HG21 THR 16 3HG2 THR 16 44.225 -3.926 19.619 112 HG22 THR 16 1HG2 THR 16 43.997 -3.612 17.899 113 HG23 THR 16 2HG2 THR 16 45.620 -3.862 18.542 114 H VAL 17 H VAL 17 44.426 -7.575 15.921 115 HA VAL 17 HA VAL 17 43.204 -9.949 17.147 116 HB VAL 17 HB VAL 17 41.969 -9.347 15.059 117 HG11 VAL 17 1HG1 VAL 17 44.223 -8.577 13.977 118 HG12 VAL 17 2HG1 VAL 17 44.324 -10.266 13.475 119 HG13 VAL 17 3HG1 VAL 17 42.949 -9.278 12.980 120 HG21 VAL 17 3HG2 VAL 17 41.690 -11.547 14.424 121 HG22 VAL 17 1HG2 VAL 17 43.411 -11.911 14.551 122 HG23 VAL 17 2HG2 VAL 17 42.437 -11.734 16.010 123 H ALA 18 H ALA 18 44.399 -11.896 16.887 124 HA ALA 18 HA ALA 18 47.217 -11.530 16.983 125 HB1 ALA 18 1HB ALA 18 47.221 -13.544 17.941 126 HB2 ALA 18 2HB ALA 18 45.461 -13.456 17.869 127 HB3 ALA 18 3HB ALA 18 46.355 -14.280 16.592 128 H LYS 19 H LYS 19 48.758 -12.792 15.650 129 HA LYS 19 HA LYS 19 48.564 -12.132 12.947 130 HB2 LYS 19 2HB LYS 19 50.544 -13.082 14.601 131 HB3 LYS 19 3HB LYS 19 50.287 -14.437 13.510 132 HG2 LYS 19 2HG LYS 19 50.378 -12.065 11.956 133 HG3 LYS 19 3HG LYS 19 51.754 -12.058 13.062 134 HD2 LYS 19 2HD LYS 19 51.028 -14.441 11.372 135 HD3 LYS 19 3HD LYS 19 52.123 -13.173 10.817 136 HE2 LYS 19 2HE LYS 19 53.803 -13.869 12.146 137 HE3 LYS 19 3HE LYS 19 52.721 -14.256 13.483 138 HZ1 LYS 19 3HZ LYS 19 53.857 -16.205 12.479 139 HZ2 LYS 19 1HZ LYS 19 52.992 -15.932 11.051 140 HZ3 LYS 19 2HZ LYS 19 52.170 -16.322 12.476 141 H GLY 20 H GLY 20 47.794 -13.140 11.174 142 HA2 GLY 20 2HA GLY 20 46.611 -14.645 9.907 143 HA3 GLY 20 3HA GLY 20 47.450 -15.887 10.824 144 H LEU 21 H LEU 21 44.515 -14.089 10.447 145 HA LEU 21 HA LEU 21 42.932 -16.080 11.640 146 HB2 LEU 21 2HB LEU 21 44.047 -14.154 13.451 147 HB3 LEU 21 3HB LEU 21 42.295 -13.979 13.396 148 HG LEU 21 HG LEU 21 43.236 -16.744 13.701 149 HD11 LEU 21 1HD1 LEU 21 44.227 -14.620 15.452 150 HD12 LEU 21 2HD1 LEU 21 44.783 -16.282 15.250 151 HD13 LEU 21 3HD1 LEU 21 43.408 -15.934 16.298 152 HD21 LEU 21 3HD2 LEU 21 40.867 -15.879 13.837 153 HD22 LEU 21 1HD2 LEU 21 41.317 -15.141 15.375 154 HD23 LEU 21 2HD2 LEU 21 41.396 -16.893 15.181 155 H GLN 22 H GLN 22 40.636 -15.476 11.734 156 HA GLN 22 HA GLN 22 40.030 -13.151 10.029 157 HB2 GLN 22 2HB GLN 22 38.057 -14.591 9.226 158 HB3 GLN 22 3HB GLN 22 39.657 -14.965 8.598 159 HG2 GLN 22 2HG GLN 22 38.537 -17.006 9.135 160 HG3 GLN 22 3HG GLN 22 39.853 -16.762 10.282 161 HE21 GLN 22 1HE2 GLN 22 36.518 -15.566 10.071 162 HE22 GLN 22 2HE2 GLN 22 36.053 -16.081 11.653 163 H GLU 23 H GLU 23 38.014 -12.119 10.381 164 HA GLU 23 HA GLU 23 36.751 -12.765 12.963 165 HB2 GLU 23 2HB GLU 23 37.983 -10.281 12.047 166 HB3 GLU 23 3HB GLU 23 36.334 -10.053 12.612 167 HG2 GLU 23 2HG GLU 23 37.958 -11.720 14.372 168 HG3 GLU 23 3HG GLU 23 38.564 -10.076 14.182 169 H ASN 24 H ASN 24 34.606 -12.999 12.928 170 HA ASN 24 HA ASN 24 33.210 -12.673 10.413 171 HB2 ASN 24 2HB ASN 24 31.346 -13.795 11.543 172 HB3 ASN 24 3HB ASN 24 32.845 -14.693 11.765 173 HD21 ASN 24 1HD2 ASN 24 33.781 -14.799 13.789 174 HD22 ASN 24 2HD2 ASN 24 32.941 -14.334 15.225 175 H PHE 25 H PHE 25 31.574 -11.254 9.978 176 HA PHE 25 HA PHE 25 31.158 -9.121 11.965 177 HB2 PHE 25 2HB PHE 25 30.518 -7.720 9.965 178 HB3 PHE 25 3HB PHE 25 32.207 -8.212 10.020 179 HD1 PHE 25 HD1 PHE 25 33.050 -9.932 8.492 180 HD2 PHE 25 HD2 PHE 25 29.052 -8.492 8.249 181 HE1 PHE 25 HE1 PHE 25 32.844 -10.894 6.237 182 HE2 PHE 25 HE2 PHE 25 28.839 -9.453 5.994 183 HZ PHE 25 HZ PHE 25 30.736 -10.657 4.986 184 H LYS 26 H LYS 26 28.988 -7.906 11.433 185 HA LYS 26 HA LYS 26 26.859 -9.823 10.818 186 HB2 LYS 26 2HB LYS 26 27.519 -8.959 13.442 187 HB3 LYS 26 3HB LYS 26 26.001 -8.186 13.002 188 HG2 LYS 26 2HG LYS 26 25.656 -10.793 12.174 189 HG3 LYS 26 3HG LYS 26 26.556 -10.950 13.685 190 HD2 LYS 26 2HD LYS 26 24.902 -9.679 14.871 191 HD3 LYS 26 3HD LYS 26 24.062 -9.284 13.370 192 HE2 LYS 26 2HE LYS 26 22.761 -11.011 14.121 193 HE3 LYS 26 3HE LYS 26 23.928 -11.901 13.144 194 HZ1 LYS 26 3HZ LYS 26 24.310 -11.468 16.047 195 HZ2 LYS 26 1HZ LYS 26 25.087 -12.588 15.044 196 HZ3 LYS 26 2HZ LYS 26 23.456 -12.796 15.440 197 H ALA 27 H ALA 27 25.383 -8.973 9.505 198 HA ALA 27 HA ALA 27 24.898 -6.082 9.566 199 HB1 ALA 27 1HB ALA 27 24.765 -6.837 6.856 200 HB2 ALA 27 2HB ALA 27 25.914 -5.741 7.624 201 HB3 ALA 27 3HB ALA 27 26.291 -7.459 7.485 202 H THR 28 H THR 28 22.801 -5.803 9.897 203 HA THR 28 HA THR 28 20.914 -7.733 8.710 204 HB THR 28 HB THR 28 20.440 -6.087 11.200 205 HG1 THR 28 HG1 THR 28 21.121 -8.848 10.967 206 HG21 THR 28 3HG2 THR 28 18.639 -7.340 9.526 207 HG22 THR 28 1HG2 THR 28 18.352 -6.900 11.209 208 HG23 THR 28 2HG2 THR 28 18.898 -8.527 10.803 209 H GLY 29 H GLY 29 20.210 -6.759 6.891 210 HA2 GLY 29 2HA GLY 29 19.659 -3.902 6.869 211 HA3 GLY 29 3HA GLY 29 19.570 -4.993 5.494 212 H ILE 30 H ILE 30 17.684 -2.945 6.684 213 HA ILE 30 HA ILE 30 15.347 -4.722 6.957 214 HB ILE 30 HB ILE 30 15.665 -3.517 9.016 215 HG12 ILE 30 2HG1 ILE 30 13.457 -2.154 7.463 216 HG13 ILE 30 3HG1 ILE 30 13.347 -3.791 8.100 217 HG21 ILE 30 1HG2 ILE 30 15.548 -0.956 7.432 218 HG22 ILE 30 2HG2 ILE 30 15.814 -1.130 9.166 219 HG23 ILE 30 3HG2 ILE 30 17.038 -1.690 8.027 220 HD11 ILE 30 3HD1 ILE 30 13.085 -1.216 9.458 221 HD12 ILE 30 1HD1 ILE 30 12.408 -2.794 9.862 222 HD13 ILE 30 2HD1 ILE 30 14.067 -2.403 10.316 223 H PHE 31 H PHE 31 13.945 -4.641 5.340 224 HA PHE 31 HA PHE 31 13.615 -2.132 3.854 225 HB2 PHE 31 2HB PHE 31 13.716 -4.803 2.458 226 HB3 PHE 31 3HB PHE 31 13.744 -3.198 1.735 227 HD1 PHE 31 HD1 PHE 31 15.774 -1.765 2.027 228 HD2 PHE 31 HD2 PHE 31 15.697 -5.880 3.114 229 HE1 PHE 31 HE1 PHE 31 18.235 -1.811 2.016 230 HE2 PHE 31 HE2 PHE 31 18.157 -5.932 3.105 231 HZ PHE 31 HZ PHE 31 19.429 -3.896 2.556 232 H THR 32 H THR 32 11.567 -1.782 2.993 233 HA THR 32 HA THR 32 9.415 -2.970 4.402 234 HB THR 32 HB THR 32 8.765 -1.557 1.890 235 HG1 THR 32 HG1 THR 32 9.849 -0.038 4.018 236 HG21 THR 32 3HG2 THR 32 6.884 -1.421 3.088 237 HG22 THR 32 1HG2 THR 32 7.705 -0.225 4.089 238 HG23 THR 32 2HG2 THR 32 7.707 -1.923 4.564 239 H ASP 33 H ASP 33 10.794 -3.483 1.215 240 HA ASP 33 HA ASP 33 8.669 -5.301 0.439 241 HB2 ASP 33 2HB ASP 33 9.637 -5.331 -1.695 242 HB3 ASP 33 3HB ASP 33 9.944 -3.693 -1.126 243 H ASN 34 H ASN 34 11.231 -5.553 2.440 244 HA ASN 34 HA ASN 34 11.149 -8.353 2.602 245 HB2 ASN 34 2HB ASN 34 13.103 -7.239 0.716 246 HB3 ASN 34 3HB ASN 34 13.810 -8.321 1.912 247 HD21 ASN 34 1HD2 ASN 34 12.101 -10.260 2.293 248 HD22 ASN 34 2HD2 ASN 34 11.715 -11.092 0.828 249 H SER 35 H SER 35 11.090 -8.137 4.780 250 HA SER 35 HA SER 35 12.360 -6.400 6.434 251 HB2 SER 35 2HB SER 35 11.569 -9.270 6.795 252 HB3 SER 35 3HB SER 35 12.432 -8.436 8.087 253 HG SER 35 HG SER 35 10.732 -7.208 8.455 254 H ASN 36 H ASN 36 13.641 -9.706 6.170 255 HA ASN 36 HA ASN 36 16.348 -8.578 6.411 256 HB2 ASN 36 2HB ASN 36 17.009 -10.784 7.301 257 HB3 ASN 36 3HB ASN 36 15.734 -10.043 8.264 258 HD21 ASN 36 1HD2 ASN 36 13.613 -10.860 8.101 259 HD22 ASN 36 2HD2 ASN 36 13.317 -12.464 7.534 260 H SER 37 H SER 37 17.929 -9.121 4.973 261 HA SER 37 HA SER 37 17.262 -11.022 2.838 262 HB2 SER 37 2HB SER 37 17.558 -8.146 2.562 263 HB3 SER 37 3HB SER 37 18.722 -9.013 1.561 264 HG SER 37 HG SER 37 16.856 -8.799 0.379 265 H ASP 38 H ASP 38 18.858 -12.405 2.425 266 HA ASP 38 HA ASP 38 21.422 -12.015 3.744 267 HB2 ASP 38 2HB ASP 38 20.687 -14.420 2.097 268 HB3 ASP 38 3HB ASP 38 21.783 -14.315 3.472 269 H ILE 39 H ILE 39 22.739 -10.696 2.627 270 HA ILE 39 HA ILE 39 23.946 -9.792 0.911 271 HB ILE 39 HB ILE 39 24.073 -12.563 -0.246 272 HG12 ILE 39 2HG1 ILE 39 24.359 -12.829 2.158 273 HG13 ILE 39 3HG1 ILE 39 25.907 -13.038 1.346 274 HG21 ILE 39 1HG2 ILE 39 26.548 -11.684 -0.411 275 HG22 ILE 39 2HG2 ILE 39 25.332 -11.214 -1.598 276 HG23 ILE 39 3HG2 ILE 39 25.758 -10.112 -0.289 277 HD11 ILE 39 3HD1 ILE 39 26.211 -10.511 1.888 278 HD12 ILE 39 1HD1 ILE 39 24.971 -10.824 3.102 279 HD13 ILE 39 2HD1 ILE 39 26.485 -11.728 3.134 280 H THR 40 H THR 40 21.048 -9.938 0.520 281 HA THR 40 HA THR 40 20.432 -10.659 -2.143 282 HB THR 40 HB THR 40 19.027 -8.648 -0.374 283 HG1 THR 40 HG1 THR 40 18.106 -11.266 -0.806 284 HG21 THR 40 3HG2 THR 40 18.120 -10.119 -2.849 285 HG22 THR 40 1HG2 THR 40 18.356 -8.380 -2.680 286 HG23 THR 40 2HG2 THR 40 17.061 -9.185 -1.793 287 H ASP 41 H ASP 41 21.610 -7.698 -0.670 288 HA ASP 41 HA ASP 41 21.345 -6.198 -3.137 289 HB2 ASP 41 2HB ASP 41 22.456 -5.499 -0.417 290 HB3 ASP 41 3HB ASP 41 22.492 -4.389 -1.784 291 H GLN 42 H GLN 42 23.609 -8.273 -1.724 292 HA GLN 42 HA GLN 42 25.667 -8.974 -2.406 293 HB2 GLN 42 2HB GLN 42 24.570 -8.354 -4.712 294 HB3 GLN 42 3HB GLN 42 25.699 -7.007 -4.659 295 HG2 GLN 42 2HG GLN 42 27.531 -8.345 -4.899 296 HG3 GLN 42 3HG GLN 42 26.746 -9.740 -4.160 297 HE21 GLN 42 1HE2 GLN 42 26.399 -11.325 -5.522 298 HE22 GLN 42 2HE2 GLN 42 26.042 -11.172 -7.205 299 H VAL 43 H VAL 43 25.784 -7.372 -0.355 300 HA VAL 43 HA VAL 43 26.989 -4.902 -0.470 301 HB VAL 43 HB VAL 43 27.781 -5.247 1.758 302 HG11 VAL 43 1HG1 VAL 43 25.716 -5.288 2.585 303 HG12 VAL 43 2HG1 VAL 43 25.156 -5.741 0.974 304 HG13 VAL 43 3HG1 VAL 43 25.515 -6.989 2.167 305 HG21 VAL 43 3HG2 VAL 43 27.575 -8.171 1.095 306 HG22 VAL 43 1HG2 VAL 43 28.984 -7.264 1.645 307 HG23 VAL 43 2HG2 VAL 43 27.654 -7.588 2.757 308 H THR 44 H THR 44 29.016 -4.121 -0.764 309 HA THR 44 HA THR 44 30.990 -5.988 -1.843 310 HB THR 44 HB THR 44 31.384 -3.018 -1.815 311 HG1 THR 44 HG1 THR 44 30.109 -2.847 -3.666 312 HG21 THR 44 3HG2 THR 44 32.141 -5.263 -3.684 313 HG22 THR 44 1HG2 THR 44 33.215 -4.313 -2.657 314 HG23 THR 44 2HG2 THR 44 32.416 -3.557 -4.036 315 H TRP 45 H TRP 45 32.627 -6.676 -0.645 316 HA TRP 45 HA TRP 45 33.263 -5.262 1.838 317 HB2 TRP 45 2HB TRP 45 34.570 -7.358 2.356 318 HB3 TRP 45 3HB TRP 45 32.833 -7.586 2.179 319 HD1 TRP 45 HD1 TRP 45 32.030 -9.276 0.375 320 HE1 TRP 45 HE1 TRP 45 33.222 -10.782 -1.338 321 HE3 TRP 45 HE3 TRP 45 36.759 -7.375 0.775 322 HZ2 TRP 45 HZ2 TRP 45 35.823 -11.121 -2.381 323 HZ3 TRP 45 HZ3 TRP 45 38.542 -8.347 -0.615 324 HH2 TRP 45 HH2 TRP 45 38.081 -10.181 -2.159 325 H ASP 46 H ASP 46 35.390 -4.694 2.394 326 HA ASP 46 HA ASP 46 37.449 -4.902 0.340 327 HB2 ASP 46 2HB ASP 46 35.926 -2.606 0.493 328 HB3 ASP 46 3HB ASP 46 37.337 -2.204 1.468 329 H SER 47 H SER 47 39.539 -4.803 1.128 330 HA SER 47 HA SER 47 39.822 -4.502 4.044 331 HB2 SER 47 2HB SER 47 41.198 -6.420 4.200 332 HB3 SER 47 3HB SER 47 39.843 -6.919 3.188 333 HG SER 47 HG SER 47 41.522 -7.570 2.018 334 H SER 48 H SER 48 41.827 -3.724 4.786 335 HA SER 48 HA SER 48 42.985 -1.678 3.345 336 HB2 SER 48 2HB SER 48 43.461 -2.991 5.860 337 HB3 SER 48 3HB SER 48 45.001 -2.643 5.074 338 HG SER 48 HG SER 48 44.707 -0.607 5.478 339 H ASN 49 H ASN 49 45.381 -1.542 2.771 340 HA ASN 49 HA ASN 49 46.216 -3.985 1.353 341 HB2 ASN 49 2HB ASN 49 45.260 -2.127 -0.117 342 HB3 ASN 49 3HB ASN 49 46.693 -1.195 0.309 343 HD21 ASN 49 1HD2 ASN 49 47.906 -1.165 -1.450 344 HD22 ASN 49 2HD2 ASN 49 48.383 -2.550 -2.368 345 H THR 50 H THR 50 47.433 -4.240 3.417 346 HA THR 50 HA THR 50 49.827 -2.540 3.545 347 HB THR 50 HB THR 50 49.971 -4.198 5.737 348 HG1 THR 50 HG1 THR 50 47.245 -3.425 5.417 349 HG21 THR 50 3HG2 THR 50 49.793 -2.260 6.945 350 HG22 THR 50 1HG2 THR 50 48.432 -1.663 5.996 351 HG23 THR 50 2HG2 THR 50 50.068 -1.582 5.341 352 H ASP 51 H ASP 51 49.240 -5.936 4.426 353 HA ASP 51 HA ASP 51 51.585 -6.667 2.797 354 HB2 ASP 51 2HB ASP 51 51.809 -6.778 5.361 355 HB3 ASP 51 3HB ASP 51 50.734 -8.170 5.263 356 H ILE 52 H ILE 52 48.608 -7.967 4.255 357 HA ILE 52 HA ILE 52 47.762 -9.146 1.808 358 HB ILE 52 HB ILE 52 49.444 -10.812 2.313 359 HG12 ILE 52 2HG1 ILE 52 46.901 -12.157 3.143 360 HG13 ILE 52 3HG1 ILE 52 46.985 -11.383 1.564 361 HG21 ILE 52 1HG2 ILE 52 48.035 -11.332 4.921 362 HG22 ILE 52 2HG2 ILE 52 49.546 -12.036 4.347 363 HG23 ILE 52 3HG2 ILE 52 49.477 -10.327 4.778 364 HD11 ILE 52 3HD1 ILE 52 48.497 -12.894 0.754 365 HD12 ILE 52 1HD1 ILE 52 49.136 -13.279 2.352 366 HD13 ILE 52 2HD1 ILE 52 47.566 -13.910 1.853 367 H LEU 53 H LEU 53 45.621 -9.079 1.863 368 HA LEU 53 HA LEU 53 44.197 -9.790 4.306 369 HB2 LEU 53 2HB LEU 53 43.951 -7.142 2.901 370 HB3 LEU 53 3HB LEU 53 42.716 -7.765 3.993 371 HG LEU 53 HG LEU 53 45.107 -7.892 5.436 372 HD11 LEU 53 1HD1 LEU 53 45.683 -6.186 3.439 373 HD12 LEU 53 2HD1 LEU 53 46.342 -6.044 5.069 374 HD13 LEU 53 3HD1 LEU 53 44.948 -5.073 4.594 375 HD21 LEU 53 3HD2 LEU 53 42.615 -7.199 5.949 376 HD22 LEU 53 1HD2 LEU 53 43.265 -5.575 5.727 377 HD23 LEU 53 2HD2 LEU 53 43.950 -6.638 6.957 378 H SER 54 H SER 54 42.509 -11.045 3.859 379 HA SER 54 HA SER 54 41.177 -10.787 1.259 380 HB2 SER 54 2HB SER 54 42.793 -13.037 2.153 381 HB3 SER 54 3HB SER 54 41.144 -13.526 1.762 382 HG SER 54 HG SER 54 41.526 -13.163 -0.277 383 H ILE 55 H ILE 55 39.057 -10.614 1.511 384 HA ILE 55 HA ILE 55 37.838 -11.739 3.948 385 HB ILE 55 HB ILE 55 36.781 -9.388 2.383 386 HG12 ILE 55 2HG1 ILE 55 38.450 -9.398 4.907 387 HG13 ILE 55 3HG1 ILE 55 38.967 -8.814 3.329 388 HG21 ILE 55 1HG2 ILE 55 35.413 -9.010 4.366 389 HG22 ILE 55 2HG2 ILE 55 35.132 -10.618 3.701 390 HG23 ILE 55 3HG2 ILE 55 36.132 -10.422 5.140 391 HD11 ILE 55 3HD1 ILE 55 36.741 -7.650 4.986 392 HD12 ILE 55 1HD1 ILE 55 38.368 -6.988 4.825 393 HD13 ILE 55 2HD1 ILE 55 37.298 -7.052 3.424 394 H SER 56 H SER 56 36.315 -13.233 3.681 395 HA SER 56 HA SER 56 34.998 -13.441 1.054 396 HB2 SER 56 2HB SER 56 35.940 -15.711 2.823 397 HB3 SER 56 3HB SER 56 34.994 -15.905 1.347 398 HG SER 56 HG SER 56 36.749 -15.656 0.225 399 H ASN 57 H ASN 57 32.938 -12.899 1.309 400 HA ASN 57 HA ASN 57 31.574 -12.981 3.794 401 HB2 ASN 57 2HB ASN 57 29.532 -12.543 2.310 402 HB3 ASN 57 3HB ASN 57 30.825 -11.348 2.263 403 HD21 ASN 57 1HD2 ASN 57 29.620 -14.228 0.610 404 HD22 ASN 57 2HD2 ASN 57 30.127 -13.748 -0.970 405 H ALA 58 H ALA 58 29.927 -14.335 4.510 406 HA ALA 58 HA ALA 58 30.107 -17.061 3.553 407 HB1 ALA 58 1HB ALA 58 28.213 -16.238 5.702 408 HB2 ALA 58 2HB ALA 58 29.182 -17.704 5.553 409 HB3 ALA 58 3HB ALA 58 29.947 -16.185 6.019 410 H SER 59 H SER 59 27.784 -18.229 3.777 411 HA SER 59 HA SER 59 26.373 -17.549 1.464 412 HB2 SER 59 2HB SER 59 26.324 -19.639 3.348 413 HB3 SER 59 3HB SER 59 24.685 -18.989 3.312 414 HG SER 59 HG SER 59 24.576 -20.274 1.626 415 H ASP 60 H ASP 60 26.145 -16.324 4.664 416 HA ASP 60 HA ASP 60 23.710 -14.838 3.920 417 HB2 ASP 60 2HB ASP 60 23.864 -16.602 5.984 418 HB3 ASP 60 3HB ASP 60 24.314 -15.105 6.797 419 H SER 61 H SER 61 23.671 -13.012 5.970 420 HA SER 61 HA SER 61 25.277 -10.967 5.068 421 HB2 SER 61 2HB SER 61 23.680 -10.068 6.412 422 HB3 SER 61 3HB SER 61 23.673 -11.456 7.500 423 HG SER 61 HG SER 61 25.467 -10.640 8.530 424 H HIS 62 H HIS 62 25.785 -12.541 8.227 425 HA HIS 62 HA HIS 62 28.315 -11.568 8.725 426 HB2 HIS 62 2HB HIS 62 28.536 -13.259 10.374 427 HB3 HIS 62 3HB HIS 62 26.814 -12.901 10.285 428 HD1 HIS 62 HD1 HIS 62 25.422 -14.666 8.712 429 HD2 HIS 62 HD2 HIS 62 29.120 -15.895 10.151 430 HE1 HIS 62 HE1 HIS 62 25.424 -17.173 8.505 431 H GLY 63 H GLY 63 30.344 -12.028 8.076 432 HA2 GLY 63 2HA GLY 63 30.702 -14.350 6.285 433 HA3 GLY 63 3HA GLY 63 31.372 -12.774 5.893 434 H LEU 64 H LEU 64 33.489 -12.733 6.191 435 HA LEU 64 HA LEU 64 34.723 -13.176 8.665 436 HB2 LEU 64 2HB LEU 64 36.081 -15.183 8.048 437 HB3 LEU 64 3HB LEU 64 34.378 -15.500 8.373 438 HG LEU 64 HG LEU 64 35.157 -15.084 5.543 439 HD11 LEU 64 1HD1 LEU 64 36.862 -16.627 6.821 440 HD12 LEU 64 2HD1 LEU 64 36.247 -17.068 5.229 441 HD13 LEU 64 3HD1 LEU 64 35.559 -17.805 6.675 442 HD21 LEU 64 3HD2 LEU 64 32.919 -15.557 5.735 443 HD22 LEU 64 1HD2 LEU 64 33.151 -16.629 7.116 444 HD23 LEU 64 2HD2 LEU 64 33.578 -17.176 5.495 445 H ALA 65 H ALA 65 36.314 -11.749 8.582 446 HA ALA 65 HA ALA 65 37.717 -11.338 6.025 447 HB1 ALA 65 1HB ALA 65 37.364 -9.441 8.343 448 HB2 ALA 65 2HB ALA 65 38.285 -9.101 6.877 449 HB3 ALA 65 3HB ALA 65 36.543 -9.360 6.784 450 H SER 66 H SER 66 39.629 -12.308 5.958 451 HA SER 66 HA SER 66 41.140 -12.679 8.443 452 HB2 SER 66 2HB SER 66 40.614 -14.407 6.331 453 HB3 SER 66 3HB SER 66 42.285 -13.913 6.063 454 HG SER 66 HG SER 66 42.700 -14.524 8.254 455 H THR 67 H THR 67 43.213 -11.931 8.708 456 HA THR 67 HA THR 67 44.504 -10.478 6.539 457 HB THR 67 HB THR 67 43.237 -8.690 7.489 458 HG1 THR 67 HG1 THR 67 45.126 -7.563 8.653 459 HG21 THR 67 3HG2 THR 67 44.126 -8.449 10.141 460 HG22 THR 67 1HG2 THR 67 43.645 -10.134 9.943 461 HG23 THR 67 2HG2 THR 67 42.499 -8.842 9.587 462 H LEU 68 H LEU 68 46.618 -10.880 6.546 463 HA LEU 68 HA LEU 68 47.902 -11.626 9.088 464 HB2 LEU 68 2HB LEU 68 47.412 -13.506 7.383 465 HB3 LEU 68 3HB LEU 68 48.738 -12.799 6.461 466 HG LEU 68 HG LEU 68 49.416 -13.339 9.253 467 HD11 LEU 68 1HD1 LEU 68 49.174 -15.593 9.356 468 HD12 LEU 68 2HD1 LEU 68 49.257 -15.797 7.607 469 HD13 LEU 68 3HD1 LEU 68 47.769 -15.222 8.358 470 HD21 LEU 68 3HD2 LEU 68 50.594 -13.570 6.547 471 HD22 LEU 68 1HD2 LEU 68 51.214 -14.658 7.790 472 HD23 LEU 68 2HD2 LEU 68 51.279 -12.912 8.034 473 H ASN 69 H ASN 69 48.127 -9.109 8.643 474 HA ASN 69 HA ASN 69 50.678 -8.702 7.225 475 HB2 ASN 69 2HB ASN 69 50.017 -6.540 6.616 476 HB3 ASN 69 3HB ASN 69 48.545 -7.485 6.412 477 HD21 ASN 69 1HD2 ASN 69 47.104 -7.534 8.364 478 HD22 ASN 69 2HD2 ASN 69 46.908 -6.050 9.228 479 H GLN 70 H GLN 70 51.843 -6.669 8.133 480 HA GLN 70 HA GLN 70 51.883 -6.920 11.067 481 HB2 GLN 70 2HB GLN 70 54.115 -6.234 9.149 482 HB3 GLN 70 3HB GLN 70 54.262 -6.183 10.901 483 HG2 GLN 70 2HG GLN 70 54.152 -8.483 11.110 484 HG3 GLN 70 3HG GLN 70 53.381 -8.690 9.538 485 HE21 GLN 70 1HE2 GLN 70 56.380 -7.333 10.873 486 HE22 GLN 70 2HE2 GLN 70 57.423 -8.023 9.681 487 H GLY 71 H GLY 71 50.272 -5.283 11.298 488 HA2 GLY 71 2HA GLY 71 51.129 -2.782 11.965 489 HA3 GLY 71 3HA GLY 71 50.729 -2.640 10.259 490 H ASN 72 H ASN 72 48.841 -1.638 10.074 491 HA ASN 72 HA ASN 72 46.597 -2.609 11.709 492 HB2 ASN 72 2HB ASN 72 45.788 -0.388 12.075 493 HB3 ASN 72 3HB ASN 72 47.490 -0.396 12.530 494 HD21 ASN 72 1HD2 ASN 72 45.122 1.112 10.710 495 HD22 ASN 72 2HD2 ASN 72 46.141 2.113 9.738 496 H VAL 73 H VAL 73 44.879 -3.191 10.551 497 HA VAL 73 HA VAL 73 44.642 -2.171 7.794 498 HB VAL 73 HB VAL 73 43.467 -4.370 7.307 499 HG11 VAL 73 1HG1 VAL 73 45.589 -4.063 6.353 500 HG12 VAL 73 2HG1 VAL 73 46.404 -4.196 7.913 501 HG13 VAL 73 3HG1 VAL 73 45.683 -5.624 7.169 502 HG21 VAL 73 3HG2 VAL 73 43.363 -6.035 8.815 503 HG22 VAL 73 1HG2 VAL 73 44.973 -5.696 9.449 504 HG23 VAL 73 2HG2 VAL 73 43.591 -4.746 9.996 505 H LYS 74 H LYS 74 42.674 -1.471 7.119 506 HA LYS 74 HA LYS 74 40.480 -1.588 9.084 507 HB2 LYS 74 2HB LYS 74 41.746 0.664 8.008 508 HB3 LYS 74 3HB LYS 74 40.214 0.554 7.151 509 HG2 LYS 74 2HG LYS 74 40.123 0.232 10.088 510 HG3 LYS 74 3HG LYS 74 40.496 1.841 9.466 511 HD2 LYS 74 2HD LYS 74 38.453 1.998 8.329 512 HD3 LYS 74 3HD LYS 74 38.164 0.259 8.429 513 HE2 LYS 74 2HE LYS 74 36.802 0.852 10.125 514 HE3 LYS 74 3HE LYS 74 38.303 0.875 11.050 515 HZ1 LYS 74 3HZ LYS 74 38.093 3.043 11.379 516 HZ2 LYS 74 1HZ LYS 74 36.550 2.965 10.689 517 HZ3 LYS 74 2HZ LYS 74 37.886 3.352 9.729 518 H VAL 75 H VAL 75 38.650 -2.528 8.450 519 HA VAL 75 HA VAL 75 38.415 -3.418 5.687 520 HB VAL 75 HB VAL 75 36.707 -4.053 8.097 521 HG11 VAL 75 1HG1 VAL 75 36.202 -4.407 5.316 522 HG12 VAL 75 2HG1 VAL 75 36.445 -5.990 6.055 523 HG13 VAL 75 3HG1 VAL 75 35.214 -4.898 6.691 524 HG21 VAL 75 3HG2 VAL 75 39.252 -4.912 7.564 525 HG22 VAL 75 1HG2 VAL 75 38.071 -5.768 8.556 526 HG23 VAL 75 2HG2 VAL 75 38.266 -6.190 6.855 527 H THR 76 H THR 76 37.240 -2.377 4.230 528 HA THR 76 HA THR 76 35.190 -0.481 5.169 529 HB THR 76 HB THR 76 36.289 -0.336 2.396 530 HG1 THR 76 HG1 THR 76 38.029 0.924 3.177 531 HG21 THR 76 3HG2 THR 76 36.082 2.170 3.691 532 HG22 THR 76 1HG2 THR 76 34.638 1.248 4.107 533 HG23 THR 76 2HG2 THR 76 35.055 1.517 2.415 534 H ALA 77 H ALA 77 33.140 -0.940 4.729 535 HA ALA 77 HA ALA 77 32.447 -2.392 2.300 536 HB1 ALA 77 1HB ALA 77 31.247 -4.128 3.360 537 HB2 ALA 77 2HB ALA 77 32.820 -4.067 4.157 538 HB3 ALA 77 3HB ALA 77 31.404 -3.371 4.946 539 H SER 78 H SER 78 30.593 -1.679 1.424 540 HA SER 78 HA SER 78 28.585 -0.376 3.078 541 HB2 SER 78 2HB SER 78 30.166 1.033 0.934 542 HB3 SER 78 3HB SER 78 28.549 1.569 1.389 543 HG SER 78 HG SER 78 30.372 2.574 2.530 544 H ILE 79 H ILE 79 26.545 -0.535 2.263 545 HA ILE 79 HA ILE 79 26.221 -1.544 -0.474 546 HB ILE 79 HB ILE 79 26.101 -3.539 0.825 547 HG12 ILE 79 2HG1 ILE 79 24.132 -2.779 -0.833 548 HG13 ILE 79 3HG1 ILE 79 24.142 -4.343 -0.025 549 HG21 ILE 79 1HG2 ILE 79 24.261 -1.991 2.635 550 HG22 ILE 79 2HG2 ILE 79 24.458 -3.741 2.710 551 HG23 ILE 79 3HG2 ILE 79 25.833 -2.685 3.029 552 HD11 ILE 79 3HD1 ILE 79 21.992 -2.943 0.003 553 HD12 ILE 79 1HD1 ILE 79 22.526 -3.702 1.503 554 HD13 ILE 79 2HD1 ILE 79 22.812 -1.982 1.234 555 H GLY 80 H GLY 80 24.635 -0.565 -1.571 556 HA2 GLY 80 2HA GLY 80 22.820 0.762 -2.039 557 HA3 GLY 80 3HA GLY 80 22.189 0.300 -0.465 558 H GLY 81 H GLY 81 22.149 1.778 1.130 559 HA2 GLY 81 2HA GLY 81 23.479 4.356 0.572 560 HA3 GLY 81 3HA GLY 81 21.948 4.203 1.420 561 H ILE 82 H ILE 82 23.309 1.729 2.736 562 HA ILE 82 HA ILE 82 24.250 3.213 5.038 563 HB ILE 82 HB ILE 82 24.298 1.095 6.198 564 HG12 ILE 82 2HG1 ILE 82 23.211 -0.642 4.179 565 HG13 ILE 82 3HG1 ILE 82 24.735 0.035 3.615 566 HG21 ILE 82 1HG2 ILE 82 21.969 2.078 4.787 567 HG22 ILE 82 2HG2 ILE 82 21.832 0.362 5.168 568 HG23 ILE 82 3HG2 ILE 82 22.129 1.530 6.455 569 HD11 ILE 82 3HD1 ILE 82 25.950 -1.114 5.117 570 HD12 ILE 82 1HD1 ILE 82 24.721 -0.987 6.376 571 HD13 ILE 82 2HD1 ILE 82 24.551 -2.187 5.094 572 H GLN 83 H GLN 83 26.274 2.807 6.085 573 HA GLN 83 HA GLN 83 28.351 1.512 4.501 574 HB2 GLN 83 2HB GLN 83 29.834 3.427 4.572 575 HB3 GLN 83 3HB GLN 83 28.332 3.875 3.773 576 HG2 GLN 83 2HG GLN 83 27.736 4.586 6.290 577 HG3 GLN 83 3HG GLN 83 29.483 4.813 6.316 578 HE21 GLN 83 1HE2 GLN 83 27.109 6.674 6.320 579 HE22 GLN 83 2HE2 GLN 83 27.460 7.812 5.068 580 H GLY 84 H GLY 84 30.071 0.743 5.700 581 HA2 GLY 84 2HA GLY 84 30.399 1.482 8.472 582 HA3 GLY 84 3HA GLY 84 29.730 -0.127 8.243 583 H SER 85 H SER 85 32.290 0.690 9.415 584 HA SER 85 HA SER 85 33.988 -1.064 7.818 585 HB2 SER 85 2HB SER 85 34.776 1.740 8.638 586 HB3 SER 85 3HB SER 85 35.915 0.525 8.057 587 HG SER 85 HG SER 85 33.701 1.596 6.639 588 H THR 86 H THR 86 35.834 -1.881 9.000 589 HA THR 86 HA THR 86 35.538 -1.658 11.924 590 HB THR 86 HB THR 86 35.873 -3.972 12.235 591 HG1 THR 86 HG1 THR 86 36.185 -5.250 10.131 592 HG21 THR 86 3HG2 THR 86 34.235 -4.432 9.863 593 HG22 THR 86 1HG2 THR 86 33.702 -3.048 10.817 594 HG23 THR 86 2HG2 THR 86 33.838 -4.638 11.568 595 H ASP 87 H ASP 87 37.453 -1.988 13.162 596 HA ASP 87 HA ASP 87 39.904 -1.403 11.643 597 HB2 ASP 87 2HB ASP 87 38.998 0.231 13.419 598 HB3 ASP 87 3HB ASP 87 39.557 -0.951 14.599 599 H PHE 88 H PHE 88 41.478 -2.864 11.594 600 HA PHE 88 HA PHE 88 41.519 -4.956 13.666 601 HB2 PHE 88 2HB PHE 88 41.754 -5.223 10.681 602 HB3 PHE 88 3HB PHE 88 42.470 -6.424 11.750 603 HD1 PHE 88 HD2 PHE 88 40.578 -6.815 13.843 604 HD2 PHE 88 HD1 PHE 88 39.864 -6.082 9.711 605 HE1 PHE 88 HE2 PHE 88 38.404 -7.952 14.021 606 HE2 PHE 88 HE1 PHE 88 37.688 -7.218 9.883 607 HZ PHE 88 HZ PHE 88 36.956 -8.156 12.039 608 H LYS 89 H LYS 89 43.465 -5.448 14.533 609 HA LYS 89 HA LYS 89 45.848 -4.189 13.348 610 HB2 LYS 89 2HB LYS 89 44.692 -3.835 16.015 611 HB3 LYS 89 3HB LYS 89 46.397 -4.265 16.047 612 HG2 LYS 89 2HG LYS 89 46.256 -2.316 14.098 613 HG3 LYS 89 3HG LYS 89 45.122 -1.763 15.332 614 HD2 LYS 89 2HD LYS 89 47.779 -2.764 16.217 615 HD3 LYS 89 3HD LYS 89 47.704 -1.178 15.445 616 HE2 LYS 89 2HE LYS 89 45.635 -1.602 17.464 617 HE3 LYS 89 3HE LYS 89 47.274 -1.687 18.106 618 HZ1 LYS 89 3HZ LYS 89 46.654 0.528 16.308 619 HZ2 LYS 89 1HZ LYS 89 47.661 0.487 17.667 620 HZ3 LYS 89 2HZ LYS 89 45.983 0.585 17.860 621 H VAL 90 H VAL 90 47.065 -5.814 12.631 622 HA VAL 90 HA VAL 90 47.176 -8.314 14.156 623 HB VAL 90 HB VAL 90 48.195 -7.695 11.379 624 HG11 VAL 90 1HG1 VAL 90 48.290 -10.155 13.080 625 HG12 VAL 90 2HG1 VAL 90 48.237 -10.284 11.321 626 HG13 VAL 90 3HG1 VAL 90 49.562 -9.422 12.105 627 HG21 VAL 90 3HG2 VAL 90 46.162 -9.677 11.420 628 HG22 VAL 90 1HG2 VAL 90 45.586 -8.281 12.333 629 HG23 VAL 90 2HG2 VAL 90 46.128 -8.083 10.666 630 H THR 91 H THR 91 48.671 -8.229 15.717 631 HA THR 91 HA THR 91 51.310 -7.095 15.061 632 HB THR 91 HB THR 91 51.660 -6.877 17.504 633 HG1 THR 91 HG1 THR 91 48.915 -7.641 17.666 634 HG21 THR 91 3HG2 THR 91 49.203 -5.529 16.381 635 HG22 THR 91 1HG2 THR 91 50.863 -4.940 16.315 636 HG23 THR 91 2HG2 THR 91 50.021 -5.031 17.862 637 H GLN 92 H GLN 92 53.190 -8.207 15.745 638 HA GLN 92 HA GLN 92 52.929 -11.073 15.615 639 HB2 GLN 92 2HB GLN 92 54.887 -9.240 14.885 640 HB3 GLN 92 3HB GLN 92 55.592 -10.088 16.256 641 HG2 GLN 92 2HG GLN 92 54.456 -11.411 13.802 642 HG3 GLN 92 3HG GLN 92 56.168 -11.105 14.096 643 HE21 GLN 92 1HE2 GLN 92 56.804 -11.902 16.423 644 HE22 GLN 92 2HE2 GLN 92 56.337 -13.529 16.764 Start of MODEL 4 1 H1 MET 1 H MET 1 12.645 4.410 -1.178 2 HA MET 1 HA MET 1 11.378 2.800 -3.273 3 HB2 MET 1 2HB MET 1 14.255 2.752 -2.464 4 HB3 MET 1 3HB MET 1 13.481 1.246 -2.936 5 HG2 MET 1 2HG MET 1 12.715 2.756 -4.989 6 HG3 MET 1 3HG MET 1 14.197 3.607 -4.561 7 HE1 MET 1 3HE MET 1 13.929 2.845 -7.132 8 HE2 MET 1 1HE MET 1 15.168 1.712 -7.672 9 HE3 MET 1 2HE MET 1 13.508 1.161 -7.448 10 HA PRO 2 HA PRO 2 10.360 1.382 1.036 11 HB2 PRO 2 2HB PRO 2 7.688 1.194 0.596 12 HB3 PRO 2 3HB PRO 2 8.474 2.692 1.108 13 HG2 PRO 2 2HG PRO 2 7.619 1.842 -1.632 14 HG3 PRO 2 3HG PRO 2 7.445 3.421 -0.846 15 HD2 PRO 2 2HD PRO 2 9.397 2.899 -2.648 16 HD3 PRO 2 3HD PRO 2 9.623 4.027 -1.295 17 H ALA 3 H ALA 3 9.502 -0.671 1.695 18 HA ALA 3 HA ALA 3 9.012 -2.895 1.500 19 HB1 ALA 3 1HB ALA 3 8.692 -3.161 -1.348 20 HB2 ALA 3 2HB ALA 3 7.508 -3.382 -0.060 21 HB3 ALA 3 3HB ALA 3 7.779 -1.779 -0.743 22 H ALA 4 H ALA 4 10.660 -2.013 -1.544 23 HA ALA 4 HA ALA 4 12.543 -4.206 -1.119 24 HB1 ALA 4 1HB ALA 4 11.351 -3.803 -3.325 25 HB2 ALA 4 2HB ALA 4 12.421 -2.415 -3.529 26 HB3 ALA 4 3HB ALA 4 13.097 -4.039 -3.398 27 H LEU 5 H LEU 5 14.220 -3.696 0.143 28 HA LEU 5 HA LEU 5 16.126 -2.693 0.874 29 HB2 LEU 5 2HB LEU 5 16.088 -2.236 -1.849 30 HB3 LEU 5 3HB LEU 5 16.334 -0.630 -1.166 31 HG LEU 5 HG LEU 5 18.449 -1.714 -1.752 32 HD11 LEU 5 1HD1 LEU 5 19.576 -1.415 0.414 33 HD12 LEU 5 2HD1 LEU 5 18.004 -1.374 1.211 34 HD13 LEU 5 3HD1 LEU 5 18.441 -0.111 0.060 35 HD21 LEU 5 3HD2 LEU 5 17.642 -4.043 -1.346 36 HD22 LEU 5 1HD2 LEU 5 17.795 -3.736 0.384 37 HD23 LEU 5 2HD2 LEU 5 19.224 -3.687 -0.649 38 H VAL 6 H VAL 6 16.098 -1.418 2.593 39 HA VAL 6 HA VAL 6 14.987 1.281 2.371 40 HB VAL 6 HB VAL 6 14.222 -0.657 4.559 41 HG11 VAL 6 1HG1 VAL 6 12.656 1.360 5.099 42 HG12 VAL 6 2HG1 VAL 6 14.323 1.356 5.678 43 HG13 VAL 6 3HG1 VAL 6 13.887 2.293 4.249 44 HG21 VAL 6 3HG2 VAL 6 11.890 -0.078 3.650 45 HG22 VAL 6 1HG2 VAL 6 12.743 0.485 2.213 46 HG23 VAL 6 2HG2 VAL 6 12.885 -1.198 2.720 47 H SER 7 H SER 7 16.335 -0.909 4.849 48 HA SER 7 HA SER 7 18.761 0.512 5.119 49 HB2 SER 7 2HB SER 7 16.482 1.373 6.814 50 HB3 SER 7 3HB SER 7 18.031 1.164 7.630 51 HG SER 7 HG SER 7 17.535 3.302 6.648 52 H ILE 8 H ILE 8 20.222 -0.647 6.283 53 HA ILE 8 HA ILE 8 19.195 -3.024 7.692 54 HB ILE 8 HB ILE 8 21.178 -4.230 7.055 55 HG12 ILE 8 2HG1 ILE 8 22.374 -2.524 5.119 56 HG13 ILE 8 3HG1 ILE 8 22.228 -1.607 6.614 57 HG21 ILE 8 1HG2 ILE 8 20.421 -4.750 5.006 58 HG22 ILE 8 2HG2 ILE 8 19.169 -3.561 5.358 59 HG23 ILE 8 3HG2 ILE 8 20.584 -3.096 4.415 60 HD11 ILE 8 3HD1 ILE 8 24.377 -2.773 6.406 61 HD12 ILE 8 1HD1 ILE 8 23.455 -3.297 7.814 62 HD13 ILE 8 2HD1 ILE 8 23.518 -4.313 6.374 63 H SER 9 H SER 9 20.405 -3.772 9.517 64 HA SER 9 HA SER 9 21.799 -1.585 10.901 65 HB2 SER 9 2HB SER 9 19.752 -3.392 11.720 66 HB3 SER 9 3HB SER 9 21.192 -3.733 12.679 67 HG SER 9 HG SER 9 19.621 -1.429 12.570 68 H VAL 10 H VAL 10 23.935 -1.738 10.757 69 HA VAL 10 HA VAL 10 25.179 -4.402 10.774 70 HB VAL 10 HB VAL 10 25.711 -2.942 8.842 71 HG11 VAL 10 1HG1 VAL 10 25.593 -0.794 10.042 72 HG12 VAL 10 2HG1 VAL 10 27.090 -1.200 10.882 73 HG13 VAL 10 3HG1 VAL 10 27.092 -0.975 9.132 74 HG21 VAL 10 3HG2 VAL 10 27.621 -4.073 8.752 75 HG22 VAL 10 1HG2 VAL 10 28.355 -2.976 9.922 76 HG23 VAL 10 2HG2 VAL 10 27.484 -4.405 10.478 77 H SER 11 H SER 11 26.509 -5.015 12.380 78 HA SER 11 HA SER 11 27.120 -3.026 14.467 79 HB2 SER 11 2HB SER 11 26.280 -5.896 14.636 80 HB3 SER 11 3HB SER 11 27.293 -5.219 15.910 81 HG SER 11 HG SER 11 25.562 -4.335 16.676 82 HA PRO 12 HA PRO 12 31.121 -4.573 12.649 83 HB2 PRO 12 2HB PRO 12 32.229 -2.110 12.373 84 HB3 PRO 12 3HB PRO 12 31.210 -2.849 11.132 85 HG2 PRO 12 2HG PRO 12 30.494 -0.813 13.206 86 HG3 PRO 12 3HG PRO 12 30.041 -0.872 11.493 87 HD2 PRO 12 2HD PRO 12 28.364 -1.653 13.471 88 HD3 PRO 12 3HD PRO 12 28.357 -2.402 11.861 89 H THR 13 H THR 13 32.980 -4.888 13.792 90 HA THR 13 HA THR 13 33.164 -3.551 16.413 91 HB THR 13 HB THR 13 34.573 -6.131 16.016 92 HG1 THR 13 HG1 THR 13 32.789 -7.326 15.934 93 HG21 THR 13 3HG2 THR 13 34.738 -5.875 18.222 94 HG22 THR 13 1HG2 THR 13 32.990 -6.058 18.352 95 HG23 THR 13 2HG2 THR 13 33.697 -4.454 18.165 96 H ASN 14 H ASN 14 34.748 -2.103 16.441 97 HA ASN 14 HA ASN 14 37.088 -2.486 14.727 98 HB2 ASN 14 2HB ASN 14 36.152 -0.078 16.303 99 HB3 ASN 14 3HB ASN 14 37.596 -0.118 15.295 100 HD21 ASN 14 1HD2 ASN 14 34.107 -0.685 15.172 101 HD22 ASN 14 2HD2 ASN 14 33.893 -0.101 13.560 102 H SER 15 H SER 15 38.781 -3.482 15.581 103 HA SER 15 HA SER 15 39.971 -2.617 18.018 104 HB2 SER 15 2HB SER 15 37.975 -4.550 18.335 105 HB3 SER 15 3HB SER 15 39.489 -5.451 18.415 106 HG SER 15 HG SER 15 40.157 -3.769 19.963 107 H THR 16 H THR 16 41.571 -4.712 18.659 108 HA THR 16 HA THR 16 43.119 -5.076 16.188 109 HB THR 16 HB THR 16 45.083 -5.292 17.517 110 HG1 THR 16 HG1 THR 16 43.238 -5.690 19.605 111 HG21 THR 16 3HG2 THR 16 44.029 -3.198 19.225 112 HG22 THR 16 1HG2 THR 16 43.521 -2.997 17.549 113 HG23 THR 16 2HG2 THR 16 45.236 -3.103 17.944 114 H VAL 17 H VAL 17 44.054 -7.089 15.690 115 HA VAL 17 HA VAL 17 43.057 -9.400 17.206 116 HB VAL 17 HB VAL 17 41.600 -9.009 15.213 117 HG11 VAL 17 1HG1 VAL 17 43.362 -8.115 13.736 118 HG12 VAL 17 2HG1 VAL 17 44.076 -9.726 13.646 119 HG13 VAL 17 3HG1 VAL 17 42.463 -9.437 12.994 120 HG21 VAL 17 3HG2 VAL 17 41.991 -11.253 16.252 121 HG22 VAL 17 1HG2 VAL 17 41.520 -11.303 14.554 122 HG23 VAL 17 2HG2 VAL 17 43.205 -11.552 15.009 123 H ALA 18 H ALA 18 44.304 -11.315 16.982 124 HA ALA 18 HA ALA 18 47.100 -10.845 16.761 125 HB1 ALA 18 1HB ALA 18 45.378 -13.190 17.359 126 HB2 ALA 18 2HB ALA 18 47.048 -13.487 16.875 127 HB3 ALA 18 3HB ALA 18 46.704 -12.491 18.289 128 H LYS 19 H LYS 19 48.582 -11.948 15.334 129 HA LYS 19 HA LYS 19 48.079 -11.588 12.645 130 HB2 LYS 19 2HB LYS 19 50.076 -12.997 12.241 131 HB3 LYS 19 3HB LYS 19 50.336 -11.794 13.497 132 HG2 LYS 19 2HG LYS 19 49.744 -13.666 15.143 133 HG3 LYS 19 3HG LYS 19 49.996 -14.756 13.777 134 HD2 LYS 19 2HD LYS 19 52.264 -13.932 13.508 135 HD3 LYS 19 3HD LYS 19 52.018 -12.766 14.810 136 HE2 LYS 19 2HE LYS 19 52.309 -14.315 16.415 137 HE3 LYS 19 3HE LYS 19 51.420 -15.550 15.524 138 HZ1 LYS 19 3HZ LYS 19 53.629 -15.341 14.046 139 HZ2 LYS 19 1HZ LYS 19 53.450 -16.451 15.310 140 HZ3 LYS 19 2HZ LYS 19 54.263 -14.992 15.575 141 H GLY 20 H GLY 20 47.391 -12.857 10.962 142 HA2 GLY 20 2HA GLY 20 46.172 -14.503 9.926 143 HA3 GLY 20 3HA GLY 20 47.062 -15.618 10.952 144 H LEU 21 H LEU 21 44.226 -13.499 10.872 145 HA LEU 21 HA LEU 21 42.704 -15.499 12.313 146 HB2 LEU 21 2HB LEU 21 43.852 -13.335 13.693 147 HB3 LEU 21 3HB LEU 21 42.137 -12.962 13.531 148 HG LEU 21 HG LEU 21 42.446 -14.039 15.628 149 HD11 LEU 21 1HD1 LEU 21 41.421 -16.203 13.814 150 HD12 LEU 21 2HD1 LEU 21 40.509 -14.732 14.152 151 HD13 LEU 21 3HD1 LEU 21 40.928 -15.831 15.466 152 HD21 LEU 21 3HD2 LEU 21 43.728 -15.898 16.039 153 HD22 LEU 21 1HD2 LEU 21 44.643 -15.150 14.730 154 HD23 LEU 21 2HD2 LEU 21 43.570 -16.508 14.391 155 H GLN 22 H GLN 22 40.446 -15.234 12.119 156 HA GLN 22 HA GLN 22 39.611 -13.167 10.194 157 HB2 GLN 22 2HB GLN 22 37.900 -14.927 9.441 158 HB3 GLN 22 3HB GLN 22 39.567 -15.133 8.919 159 HG2 GLN 22 2HG GLN 22 39.861 -17.011 10.130 160 HG3 GLN 22 3HG GLN 22 38.823 -16.459 11.444 161 HE21 GLN 22 1HE2 GLN 22 38.251 -16.917 7.976 162 HE22 GLN 22 2HE2 GLN 22 36.921 -18.003 8.163 163 H GLU 23 H GLU 23 37.726 -12.110 10.598 164 HA GLU 23 HA GLU 23 36.218 -12.937 12.991 165 HB2 GLU 23 2HB GLU 23 37.757 -10.699 12.868 166 HB3 GLU 23 3HB GLU 23 36.212 -10.064 12.321 167 HG2 GLU 23 2HG GLU 23 35.954 -11.747 14.671 168 HG3 GLU 23 3HG GLU 23 37.021 -10.368 14.932 169 H ASN 24 H ASN 24 34.121 -13.269 12.666 170 HA ASN 24 HA ASN 24 32.960 -12.539 10.095 171 HB2 ASN 24 2HB ASN 24 31.093 -14.009 10.776 172 HB3 ASN 24 3HB ASN 24 32.647 -14.834 10.859 173 HD21 ASN 24 1HD2 ASN 24 33.341 -15.631 12.761 174 HD22 ASN 24 2HD2 ASN 24 32.462 -15.518 14.244 175 H PHE 25 H PHE 25 31.263 -11.162 9.814 176 HA PHE 25 HA PHE 25 30.525 -9.539 12.150 177 HB2 PHE 25 2HB PHE 25 30.246 -8.852 9.218 178 HB3 PHE 25 3HB PHE 25 29.956 -7.772 10.578 179 HD1 PHE 25 HD1 PHE 25 32.279 -8.379 12.288 180 HD2 PHE 25 HD2 PHE 25 32.004 -7.863 8.071 181 HE1 PHE 25 HE1 PHE 25 34.634 -7.666 12.224 182 HE2 PHE 25 HE2 PHE 25 34.358 -7.150 8.001 183 HZ PHE 25 HZ PHE 25 35.676 -7.051 10.079 184 H LYS 26 H LYS 26 28.245 -8.345 11.316 185 HA LYS 26 HA LYS 26 26.362 -10.431 10.531 186 HB2 LYS 26 2HB LYS 26 26.527 -9.178 13.223 187 HB3 LYS 26 3HB LYS 26 24.921 -9.419 12.546 188 HG2 LYS 26 2HG LYS 26 25.474 -11.815 12.223 189 HG3 LYS 26 3HG LYS 26 27.008 -11.530 13.050 190 HD2 LYS 26 2HD LYS 26 24.793 -10.481 14.578 191 HD3 LYS 26 3HD LYS 26 24.558 -12.193 14.214 192 HE2 LYS 26 2HE LYS 26 25.781 -12.373 16.133 193 HE3 LYS 26 3HE LYS 26 27.090 -12.333 14.953 194 HZ1 LYS 26 3HZ LYS 26 26.902 -10.711 17.088 195 HZ2 LYS 26 1HZ LYS 26 26.239 -9.735 15.876 196 HZ3 LYS 26 2HZ LYS 26 27.799 -10.362 15.697 197 H ALA 27 H ALA 27 24.582 -9.674 9.471 198 HA ALA 27 HA ALA 27 24.120 -6.778 9.419 199 HB1 ALA 27 1HB ALA 27 23.905 -8.150 6.812 200 HB2 ALA 27 2HB ALA 27 24.442 -6.514 7.197 201 HB3 ALA 27 3HB ALA 27 25.535 -7.878 7.429 202 H THR 28 H THR 28 22.060 -6.397 9.860 203 HA THR 28 HA THR 28 20.054 -8.413 9.080 204 HB THR 28 HB THR 28 19.215 -6.568 11.187 205 HG1 THR 28 HG1 THR 28 21.303 -6.731 11.943 206 HG21 THR 28 3HG2 THR 28 18.049 -8.380 11.921 207 HG22 THR 28 1HG2 THR 28 19.367 -9.502 11.586 208 HG23 THR 28 2HG2 THR 28 18.343 -8.926 10.270 209 H GLY 29 H GLY 29 19.147 -7.649 7.257 210 HA2 GLY 29 2HA GLY 29 18.627 -4.796 6.962 211 HA3 GLY 29 3HA GLY 29 18.411 -6.028 5.728 212 H ILE 30 H ILE 30 16.728 -3.836 7.267 213 HA ILE 30 HA ILE 30 14.322 -5.527 7.437 214 HB ILE 30 HB ILE 30 14.884 -3.121 9.172 215 HG12 ILE 30 2HG1 ILE 30 14.552 -5.555 10.642 216 HG13 ILE 30 3HG1 ILE 30 15.802 -5.797 9.428 217 HG21 ILE 30 1HG2 ILE 30 12.879 -4.218 10.420 218 HG22 ILE 30 2HG2 ILE 30 12.586 -3.206 9.007 219 HG23 ILE 30 3HG2 ILE 30 12.556 -4.962 8.855 220 HD11 ILE 30 3HD1 ILE 30 17.116 -4.044 10.299 221 HD12 ILE 30 1HD1 ILE 30 15.796 -3.463 11.315 222 HD13 ILE 30 2HD1 ILE 30 16.580 -5.001 11.680 223 H PHE 31 H PHE 31 13.145 -5.041 5.700 224 HA PHE 31 HA PHE 31 13.056 -2.270 4.753 225 HB2 PHE 31 2HB PHE 31 11.859 -4.663 3.365 226 HB3 PHE 31 3HB PHE 31 12.298 -3.107 2.668 227 HD1 PHE 31 HD2 PHE 31 15.013 -2.774 3.835 228 HD2 PHE 31 HD1 PHE 31 13.112 -6.164 2.100 229 HE1 PHE 31 HE2 PHE 31 17.212 -3.679 3.201 230 HE2 PHE 31 HE1 PHE 31 15.307 -7.075 1.465 231 HZ PHE 31 HZ PHE 31 17.361 -5.831 2.014 232 H THR 32 H THR 32 10.817 -1.704 3.746 233 HA THR 32 HA THR 32 8.960 -1.576 5.884 234 HB THR 32 HB THR 32 8.045 -1.025 3.103 235 HG1 THR 32 HG1 THR 32 9.883 0.669 4.471 236 HG21 THR 32 3HG2 THR 32 6.604 -0.534 5.018 237 HG22 THR 32 1HG2 THR 32 7.074 0.948 4.186 238 HG23 THR 32 2HG2 THR 32 7.856 0.502 5.703 239 H ASP 33 H ASP 33 9.457 -3.828 3.335 240 HA ASP 33 HA ASP 33 6.771 -4.942 3.569 241 HB2 ASP 33 2HB ASP 33 7.218 -6.170 1.633 242 HB3 ASP 33 3HB ASP 33 8.106 -4.673 1.363 243 H ASN 34 H ASN 34 8.975 -5.032 5.677 244 HA ASN 34 HA ASN 34 9.982 -6.539 7.088 245 HB2 ASN 34 2HB ASN 34 8.381 -8.152 8.037 246 HB3 ASN 34 3HB ASN 34 7.654 -6.560 7.842 247 HD21 ASN 34 1HD2 ASN 34 6.060 -6.253 6.304 248 HD22 ASN 34 2HD2 ASN 34 5.247 -7.572 5.538 249 H SER 35 H SER 35 10.964 -7.008 4.609 250 HA SER 35 HA SER 35 11.003 -9.950 4.428 251 HB2 SER 35 2HB SER 35 9.985 -8.813 2.444 252 HB3 SER 35 3HB SER 35 11.529 -8.005 2.169 253 HG SER 35 HG SER 35 11.138 -10.019 0.971 254 H ASN 36 H ASN 36 12.859 -10.815 5.046 255 HA ASN 36 HA ASN 36 15.253 -9.153 5.177 256 HB2 ASN 36 2HB ASN 36 16.140 -10.746 6.676 257 HB3 ASN 36 3HB ASN 36 14.433 -10.641 7.095 258 HD21 ASN 36 1HD2 ASN 36 13.261 -12.441 7.103 259 HD22 ASN 36 2HD2 ASN 36 13.788 -13.977 6.513 260 H SER 37 H SER 37 17.161 -9.609 4.123 261 HA SER 37 HA SER 37 17.134 -11.821 2.189 262 HB2 SER 37 2HB SER 37 18.555 -9.762 0.936 263 HB3 SER 37 3HB SER 37 16.953 -10.355 0.499 264 HG SER 37 HG SER 37 16.190 -8.818 2.168 265 H ASP 38 H ASP 38 19.009 -12.915 2.012 266 HA ASP 38 HA ASP 38 21.159 -12.182 3.826 267 HB2 ASP 38 2HB ASP 38 22.094 -14.430 3.090 268 HB3 ASP 38 3HB ASP 38 20.555 -14.473 3.947 269 H ILE 39 H ILE 39 22.505 -10.680 3.038 270 HA ILE 39 HA ILE 39 23.775 -9.488 1.534 271 HB ILE 39 HB ILE 39 25.258 -11.325 2.302 272 HG12 ILE 39 2HG1 ILE 39 26.404 -11.205 -0.281 273 HG13 ILE 39 3HG1 ILE 39 25.527 -9.696 -0.050 274 HG21 ILE 39 1HG2 ILE 39 25.714 -13.178 0.701 275 HG22 ILE 39 2HG2 ILE 39 24.111 -13.239 1.434 276 HG23 ILE 39 3HG2 ILE 39 24.302 -12.663 -0.222 277 HD11 ILE 39 3HD1 ILE 39 27.326 -10.667 2.111 278 HD12 ILE 39 1HD1 ILE 39 28.023 -9.920 0.674 279 HD13 ILE 39 2HD1 ILE 39 26.877 -9.020 1.669 280 H THR 40 H THR 40 21.230 -10.059 0.450 281 HA THR 40 HA THR 40 21.358 -11.154 -2.152 282 HB THR 40 HB THR 40 19.393 -9.161 -1.005 283 HG1 THR 40 HG1 THR 40 19.695 -11.478 -0.167 284 HG21 THR 40 3HG2 THR 40 19.357 -10.777 -3.548 285 HG22 THR 40 1HG2 THR 40 19.210 -9.029 -3.371 286 HG23 THR 40 2HG2 THR 40 17.903 -10.083 -2.831 287 H ASP 41 H ASP 41 21.719 -7.866 -0.916 288 HA ASP 41 HA ASP 41 21.903 -6.664 -3.507 289 HB2 ASP 41 2HB ASP 41 21.823 -5.778 -0.769 290 HB3 ASP 41 3HB ASP 41 23.145 -4.978 -1.617 291 H GLN 42 H GLN 42 24.045 -8.435 -1.565 292 HA GLN 42 HA GLN 42 26.238 -8.997 -1.783 293 HB2 GLN 42 2HB GLN 42 26.194 -7.564 -4.436 294 HB3 GLN 42 3HB GLN 42 27.263 -8.868 -3.935 295 HG2 GLN 42 2HG GLN 42 25.334 -10.390 -3.858 296 HG3 GLN 42 3HG GLN 42 24.302 -9.079 -4.429 297 HE21 GLN 42 1HE2 GLN 42 24.039 -8.870 -6.540 298 HE22 GLN 42 2HE2 GLN 42 25.013 -9.613 -7.758 299 H VAL 43 H VAL 43 26.775 -7.582 -0.056 300 HA VAL 43 HA VAL 43 27.421 -4.856 -0.395 301 HB VAL 43 HB VAL 43 28.544 -6.697 1.717 302 HG11 VAL 43 1HG1 VAL 43 29.548 -4.433 1.506 303 HG12 VAL 43 2HG1 VAL 43 27.954 -3.742 1.817 304 HG13 VAL 43 3HG1 VAL 43 28.752 -4.713 3.054 305 HG21 VAL 43 3HG2 VAL 43 26.381 -5.312 2.790 306 HG22 VAL 43 1HG2 VAL 43 25.816 -5.888 1.221 307 HG23 VAL 43 2HG2 VAL 43 26.452 -7.031 2.404 308 H THR 44 H THR 44 29.342 -3.812 -0.750 309 HA THR 44 HA THR 44 31.340 -5.259 -2.212 310 HB THR 44 HB THR 44 32.500 -2.870 -1.957 311 HG1 THR 44 HG1 THR 44 31.023 -1.267 -1.578 312 HG21 THR 44 3HG2 THR 44 31.834 -3.765 -4.079 313 HG22 THR 44 1HG2 THR 44 31.172 -2.136 -3.949 314 HG23 THR 44 2HG2 THR 44 30.127 -3.535 -3.699 315 H TRP 45 H TRP 45 32.874 -6.415 -1.258 316 HA TRP 45 HA TRP 45 33.801 -5.656 1.413 317 HB2 TRP 45 2HB TRP 45 34.900 -7.919 1.372 318 HB3 TRP 45 3HB TRP 45 33.143 -7.953 1.259 319 HD1 TRP 45 HD1 TRP 45 36.277 -8.476 -0.913 320 HE1 TRP 45 HE1 TRP 45 35.620 -9.906 -2.950 321 HE3 TRP 45 HE3 TRP 45 31.221 -8.659 -0.179 322 HZ2 TRP 45 HZ2 TRP 45 33.269 -10.971 -4.094 323 HZ3 TRP 45 HZ3 TRP 45 29.840 -9.904 -1.790 324 HH2 TRP 45 HH2 TRP 45 30.844 -11.035 -3.707 325 H ASP 46 H ASP 46 35.791 -4.886 1.799 326 HA ASP 46 HA ASP 46 37.904 -5.211 -0.176 327 HB2 ASP 46 2HB ASP 46 36.858 -3.167 -0.937 328 HB3 ASP 46 3HB ASP 46 36.874 -2.505 0.696 329 H SER 47 H SER 47 39.971 -5.023 0.668 330 HA SER 47 HA SER 47 40.147 -4.532 3.566 331 HB2 SER 47 2HB SER 47 40.246 -6.958 3.090 332 HB3 SER 47 3HB SER 47 41.627 -6.681 2.029 333 HG SER 47 HG SER 47 41.486 -6.218 4.824 334 H SER 48 H SER 48 42.088 -3.639 4.327 335 HA SER 48 HA SER 48 43.464 -2.010 2.367 336 HB2 SER 48 2HB SER 48 42.671 -1.275 4.724 337 HB3 SER 48 3HB SER 48 44.124 -2.091 5.302 338 HG SER 48 HG SER 48 43.906 0.154 3.609 339 H ASN 49 H ASN 49 45.970 -1.715 3.366 340 HA ASN 49 HA ASN 49 48.071 -2.584 3.312 341 HB2 ASN 49 2HB ASN 49 46.635 -4.257 5.001 342 HB3 ASN 49 3HB ASN 49 47.414 -5.367 3.878 343 HD21 ASN 49 1HD2 ASN 49 47.948 -2.831 6.227 344 HD22 ASN 49 2HD2 ASN 49 49.597 -3.223 6.560 345 H THR 50 H THR 50 49.431 -4.359 2.245 346 HA THR 50 HA THR 50 48.119 -5.471 -0.129 347 HB THR 50 HB THR 50 49.121 -3.273 -0.756 348 HG1 THR 50 HG1 THR 50 49.309 -4.281 -2.598 349 HG21 THR 50 3HG2 THR 50 51.257 -2.712 -0.330 350 HG22 THR 50 1HG2 THR 50 51.859 -4.321 -0.724 351 HG23 THR 50 2HG2 THR 50 51.192 -3.997 0.876 352 H ASP 51 H ASP 51 49.286 -6.529 2.411 353 HA ASP 51 HA ASP 51 51.523 -8.113 1.369 354 HB2 ASP 51 2HB ASP 51 50.872 -7.020 3.947 355 HB3 ASP 51 3HB ASP 51 51.039 -8.769 4.074 356 H ILE 52 H ILE 52 48.845 -8.818 3.613 357 HA ILE 52 HA ILE 52 48.028 -11.066 1.948 358 HB ILE 52 HB ILE 52 48.752 -11.461 4.853 359 HG12 ILE 52 2HG1 ILE 52 50.147 -12.447 2.355 360 HG13 ILE 52 3HG1 ILE 52 50.750 -11.198 3.439 361 HG21 ILE 52 1HG2 ILE 52 48.350 -13.846 4.344 362 HG22 ILE 52 2HG2 ILE 52 46.902 -12.854 4.178 363 HG23 ILE 52 3HG2 ILE 52 47.779 -13.380 2.742 364 HD11 ILE 52 3HD1 ILE 52 50.843 -12.865 5.249 365 HD12 ILE 52 1HD1 ILE 52 50.334 -14.103 4.101 366 HD13 ILE 52 2HD1 ILE 52 51.875 -13.273 3.879 367 H LEU 53 H LEU 53 46.149 -9.755 1.673 368 HA LEU 53 HA LEU 53 44.381 -9.731 4.032 369 HB2 LEU 53 2HB LEU 53 43.189 -7.868 2.726 370 HB3 LEU 53 3HB LEU 53 44.692 -7.487 3.564 371 HG LEU 53 HG LEU 53 44.861 -8.236 0.693 372 HD11 LEU 53 1HD1 LEU 53 44.560 -5.606 0.406 373 HD12 LEU 53 2HD1 LEU 53 43.439 -5.862 1.743 374 HD13 LEU 53 3HD1 LEU 53 43.222 -6.741 0.229 375 HD21 LEU 53 3HD2 LEU 53 46.578 -6.403 0.798 376 HD22 LEU 53 1HD2 LEU 53 46.909 -7.806 1.815 377 HD23 LEU 53 2HD2 LEU 53 46.280 -6.324 2.536 378 H SER 54 H SER 54 42.590 -10.911 3.892 379 HA SER 54 HA SER 54 41.481 -11.531 1.248 380 HB2 SER 54 2HB SER 54 42.913 -13.385 2.808 381 HB3 SER 54 3HB SER 54 41.213 -13.814 2.995 382 HG SER 54 HG SER 54 41.041 -13.955 0.757 383 H ILE 55 H ILE 55 39.443 -10.882 1.233 384 HA ILE 55 HA ILE 55 37.886 -11.061 3.730 385 HB ILE 55 HB ILE 55 36.447 -9.249 2.654 386 HG12 ILE 55 2HG1 ILE 55 37.786 -9.671 0.413 387 HG13 ILE 55 3HG1 ILE 55 37.184 -8.068 0.820 388 HG21 ILE 55 1HG2 ILE 55 38.137 -7.450 3.294 389 HG22 ILE 55 2HG2 ILE 55 37.727 -8.645 4.523 390 HG23 ILE 55 3HG2 ILE 55 39.244 -8.779 3.634 391 HD11 ILE 55 3HD1 ILE 55 39.270 -7.248 1.259 392 HD12 ILE 55 1HD1 ILE 55 39.925 -8.830 1.680 393 HD13 ILE 55 2HD1 ILE 55 39.635 -8.417 -0.010 394 H SER 56 H SER 56 36.131 -12.307 3.719 395 HA SER 56 HA SER 56 35.012 -13.123 1.117 396 HB2 SER 56 2HB SER 56 35.864 -14.756 3.446 397 HB3 SER 56 3HB SER 56 34.369 -15.241 2.647 398 HG SER 56 HG SER 56 36.895 -14.875 1.401 399 H ASN 57 H ASN 57 33.076 -12.222 0.907 400 HA ASN 57 HA ASN 57 31.220 -12.350 3.180 401 HB2 ASN 57 2HB ASN 57 31.825 -9.957 1.447 402 HB3 ASN 57 3HB ASN 57 30.326 -10.096 2.361 403 HD21 ASN 57 1HD2 ASN 57 30.797 -8.337 3.649 404 HD22 ASN 57 2HD2 ASN 57 32.012 -8.382 4.876 405 H ALA 58 H ALA 58 31.494 -14.075 0.885 406 HA ALA 58 HA ALA 58 29.117 -13.415 -0.705 407 HB1 ALA 58 1HB ALA 58 30.106 -14.405 -2.441 408 HB2 ALA 58 2HB ALA 58 31.578 -14.385 -1.469 409 HB3 ALA 58 3HB ALA 58 30.553 -15.819 -1.487 410 H SER 59 H SER 59 30.332 -15.620 1.676 411 HA SER 59 HA SER 59 28.642 -17.799 1.358 412 HB2 SER 59 2HB SER 59 29.375 -16.754 4.084 413 HB3 SER 59 3HB SER 59 29.226 -18.427 3.547 414 HG SER 59 HG SER 59 31.363 -16.712 3.389 415 H ASP 60 H ASP 60 28.085 -14.747 3.055 416 HA ASP 60 HA ASP 60 25.330 -14.714 2.593 417 HB2 ASP 60 2HB ASP 60 25.978 -16.519 4.621 418 HB3 ASP 60 3HB ASP 60 25.428 -15.079 5.471 419 H SER 61 H SER 61 24.344 -13.323 4.729 420 HA SER 61 HA SER 61 25.213 -10.744 4.315 421 HB2 SER 61 2HB SER 61 23.250 -10.587 5.425 422 HB3 SER 61 3HB SER 61 23.515 -12.098 6.294 423 HG SER 61 HG SER 61 24.725 -11.011 7.799 424 H HIS 62 H HIS 62 26.049 -12.845 7.069 425 HA HIS 62 HA HIS 62 27.750 -11.142 8.419 426 HB2 HIS 62 2HB HIS 62 28.784 -13.145 9.376 427 HB3 HIS 62 3HB HIS 62 27.034 -13.324 9.296 428 HD1 HIS 62 HD1 HIS 62 30.205 -14.730 7.962 429 HD2 HIS 62 HD2 HIS 62 26.116 -15.246 7.438 430 HE1 HIS 62 HE1 HIS 62 29.957 -16.880 6.681 431 H GLY 63 H GLY 63 29.667 -10.256 7.998 432 HA2 GLY 63 2HA GLY 63 31.120 -11.190 5.619 433 HA3 GLY 63 3HA GLY 63 31.273 -9.601 6.354 434 H LEU 64 H LEU 64 32.869 -12.397 5.865 435 HA LEU 64 HA LEU 64 34.258 -12.372 8.447 436 HB2 LEU 64 2HB LEU 64 34.849 -14.327 6.272 437 HB3 LEU 64 3HB LEU 64 34.978 -14.523 8.019 438 HG LEU 64 HG LEU 64 32.280 -14.198 7.666 439 HD11 LEU 64 1HD1 LEU 64 31.967 -14.402 5.433 440 HD12 LEU 64 2HD1 LEU 64 32.035 -16.118 5.830 441 HD13 LEU 64 3HD1 LEU 64 33.462 -15.304 5.190 442 HD21 LEU 64 3HD2 LEU 64 33.823 -15.950 8.888 443 HD22 LEU 64 1HD2 LEU 64 33.432 -16.935 7.478 444 HD23 LEU 64 2HD2 LEU 64 32.140 -16.320 8.509 445 H ALA 65 H ALA 65 35.985 -11.114 8.585 446 HA ALA 65 HA ALA 65 37.602 -10.655 6.167 447 HB1 ALA 65 1HB ALA 65 36.810 -8.929 8.424 448 HB2 ALA 65 2HB ALA 65 38.462 -8.735 7.838 449 HB3 ALA 65 3HB ALA 65 37.104 -8.527 6.733 450 H SER 66 H SER 66 39.532 -11.583 6.084 451 HA SER 66 HA SER 66 40.881 -12.260 8.615 452 HB2 SER 66 2HB SER 66 41.431 -14.372 7.871 453 HB3 SER 66 3HB SER 66 39.878 -14.162 7.062 454 HG SER 66 HG SER 66 40.858 -14.033 5.184 455 H THR 67 H THR 67 43.088 -11.962 8.719 456 HA THR 67 HA THR 67 44.482 -10.953 6.359 457 HB THR 67 HB THR 67 43.746 -8.890 7.284 458 HG1 THR 67 HG1 THR 67 45.878 -8.138 8.245 459 HG21 THR 67 3HG2 THR 67 44.333 -8.338 9.706 460 HG22 THR 67 1HG2 THR 67 44.567 -10.071 9.927 461 HG23 THR 67 2HG2 THR 67 42.989 -9.448 9.445 462 H LEU 68 H LEU 68 46.742 -11.133 6.463 463 HA LEU 68 HA LEU 68 47.804 -12.576 8.797 464 HB2 LEU 68 2HB LEU 68 47.350 -13.732 6.353 465 HB3 LEU 68 3HB LEU 68 49.045 -13.262 6.240 466 HG LEU 68 HG LEU 68 47.796 -15.115 8.264 467 HD11 LEU 68 1HD1 LEU 68 49.940 -16.347 7.051 468 HD12 LEU 68 2HD1 LEU 68 49.176 -15.462 5.731 469 HD13 LEU 68 3HD1 LEU 68 48.237 -16.615 6.678 470 HD21 LEU 68 3HD2 LEU 68 50.628 -14.090 8.088 471 HD22 LEU 68 1HD2 LEU 68 50.071 -15.383 9.151 472 HD23 LEU 68 2HD2 LEU 68 49.464 -13.741 9.368 473 H ASN 69 H ASN 69 47.921 -9.773 7.347 474 HA ASN 69 HA ASN 69 50.815 -9.511 7.098 475 HB2 ASN 69 2HB ASN 69 50.438 -7.478 6.013 476 HB3 ASN 69 3HB ASN 69 49.054 -8.447 5.515 477 HD21 ASN 69 1HD2 ASN 69 50.146 -5.832 7.536 478 HD22 ASN 69 2HD2 ASN 69 48.586 -5.163 7.856 479 H GLN 70 H GLN 70 51.799 -7.501 8.100 480 HA GLN 70 HA GLN 70 50.804 -7.220 10.858 481 HB2 GLN 70 2HB GLN 70 53.127 -6.791 11.520 482 HB3 GLN 70 3HB GLN 70 52.961 -8.360 10.744 483 HG2 GLN 70 2HG GLN 70 53.720 -7.237 8.611 484 HG3 GLN 70 3HG GLN 70 54.147 -5.848 9.609 485 HE21 GLN 70 1HE2 GLN 70 55.631 -6.286 11.424 486 HE22 GLN 70 2HE2 GLN 70 56.886 -7.450 11.187 487 H GLY 71 H GLY 71 50.080 -5.280 11.418 488 HA2 GLY 71 2HA GLY 71 51.099 -2.855 11.367 489 HA3 GLY 71 3HA GLY 71 50.658 -3.003 9.672 490 H ASN 72 H ASN 72 48.877 -1.880 9.281 491 HA ASN 72 HA ASN 72 46.612 -2.177 11.133 492 HB2 ASN 72 2HB ASN 72 46.113 0.127 11.092 493 HB3 ASN 72 3HB ASN 72 47.858 0.059 11.322 494 HD21 ASN 72 1HD2 ASN 72 49.180 0.253 9.348 495 HD22 ASN 72 2HD2 ASN 72 48.631 1.320 8.105 496 H VAL 73 H VAL 73 44.728 -2.669 10.189 497 HA VAL 73 HA VAL 73 44.414 -2.182 7.309 498 HB VAL 73 HB VAL 73 43.761 -4.791 8.687 499 HG11 VAL 73 1HG1 VAL 73 42.924 -3.604 6.141 500 HG12 VAL 73 2HG1 VAL 73 43.556 -5.246 6.011 501 HG13 VAL 73 3HG1 VAL 73 42.196 -4.905 7.082 502 HG21 VAL 73 3HG2 VAL 73 45.970 -5.112 8.336 503 HG22 VAL 73 1HG2 VAL 73 45.442 -5.440 6.685 504 HG23 VAL 73 2HG2 VAL 73 46.069 -3.847 7.112 505 H LYS 74 H LYS 74 42.354 -1.708 6.637 506 HA LYS 74 HA LYS 74 40.249 -1.682 8.694 507 HB2 LYS 74 2HB LYS 74 41.469 0.567 7.417 508 HB3 LYS 74 3HB LYS 74 39.796 0.461 6.886 509 HG2 LYS 74 2HG LYS 74 39.908 1.873 8.812 510 HG3 LYS 74 3HG LYS 74 39.097 0.371 9.261 511 HD2 LYS 74 2HD LYS 74 40.953 -0.409 10.453 512 HD3 LYS 74 3HD LYS 74 42.048 0.733 9.671 513 HE2 LYS 74 2HE LYS 74 40.599 2.543 10.807 514 HE3 LYS 74 3HE LYS 74 40.028 1.226 11.830 515 HZ1 LYS 74 3HZ LYS 74 42.729 0.936 11.856 516 HZ2 LYS 74 1HZ LYS 74 41.805 1.664 13.072 517 HZ3 LYS 74 2HZ LYS 74 42.533 2.616 11.879 518 H VAL 75 H VAL 75 38.415 -2.631 8.087 519 HA VAL 75 HA VAL 75 38.133 -3.496 5.318 520 HB VAL 75 HB VAL 75 36.472 -4.177 7.749 521 HG11 VAL 75 1HG1 VAL 75 36.404 -5.208 4.921 522 HG12 VAL 75 2HG1 VAL 75 35.645 -6.038 6.280 523 HG13 VAL 75 3HG1 VAL 75 35.104 -4.424 5.818 524 HG21 VAL 75 3HG2 VAL 75 37.888 -5.849 8.197 525 HG22 VAL 75 1HG2 VAL 75 38.036 -6.293 6.497 526 HG23 VAL 75 2HG2 VAL 75 39.030 -4.995 7.159 527 H THR 76 H THR 76 36.648 -2.747 3.919 528 HA THR 76 HA THR 76 34.770 -0.698 4.904 529 HB THR 76 HB THR 76 35.551 -0.782 2.026 530 HG1 THR 76 HG1 THR 76 37.315 0.732 2.743 531 HG21 THR 76 3HG2 THR 76 34.296 1.061 2.104 532 HG22 THR 76 1HG2 THR 76 35.577 1.818 3.047 533 HG23 THR 76 2HG2 THR 76 34.237 1.015 3.865 534 H ALA 77 H ALA 77 32.667 -1.073 4.638 535 HA ALA 77 HA ALA 77 31.746 -2.796 2.472 536 HB1 ALA 77 1HB ALA 77 31.703 -3.527 5.320 537 HB2 ALA 77 2HB ALA 77 30.186 -3.773 4.453 538 HB3 ALA 77 3HB ALA 77 31.663 -4.548 3.882 539 H SER 78 H SER 78 29.863 -2.126 1.621 540 HA SER 78 HA SER 78 28.045 -0.478 3.188 541 HB2 SER 78 2HB SER 78 28.032 1.372 1.665 542 HB3 SER 78 3HB SER 78 29.716 1.065 2.087 543 HG SER 78 HG SER 78 29.815 -0.183 0.099 544 H ILE 79 H ILE 79 25.942 -0.650 2.555 545 HA ILE 79 HA ILE 79 25.362 -2.047 0.039 546 HB ILE 79 HB ILE 79 25.302 -3.765 1.754 547 HG12 ILE 79 2HG1 ILE 79 22.486 -2.966 0.989 548 HG13 ILE 79 3HG1 ILE 79 23.617 -3.781 -0.086 549 HG21 ILE 79 1HG2 ILE 79 24.310 -1.702 3.377 550 HG22 ILE 79 2HG2 ILE 79 23.024 -2.904 3.269 551 HG23 ILE 79 3HG2 ILE 79 24.627 -3.376 3.833 552 HD11 ILE 79 3HD1 ILE 79 23.519 -5.761 1.111 553 HD12 ILE 79 1HD1 ILE 79 22.891 -4.971 2.557 554 HD13 ILE 79 2HD1 ILE 79 21.855 -5.178 1.145 555 H GLY 80 H GLY 80 23.856 -1.029 -1.108 556 HA2 GLY 80 2HA GLY 80 22.210 0.467 -1.677 557 HA3 GLY 80 3HA GLY 80 21.428 -0.057 -0.193 558 H GLY 81 H GLY 81 21.341 1.304 1.520 559 HA2 GLY 81 2HA GLY 81 22.518 3.970 1.102 560 HA3 GLY 81 3HA GLY 81 21.117 3.622 2.104 561 H ILE 82 H ILE 82 21.994 1.566 3.672 562 HA ILE 82 HA ILE 82 23.701 2.965 5.512 563 HB ILE 82 HB ILE 82 22.733 0.118 5.745 564 HG12 ILE 82 2HG1 ILE 82 20.807 1.553 5.351 565 HG13 ILE 82 3HG1 ILE 82 20.836 1.050 7.037 566 HG21 ILE 82 1HG2 ILE 82 24.353 0.472 7.382 567 HG22 ILE 82 2HG2 ILE 82 23.844 2.137 7.660 568 HG23 ILE 82 3HG2 ILE 82 22.838 0.803 8.222 569 HD11 ILE 82 3HD1 ILE 82 21.854 3.234 7.611 570 HD12 ILE 82 1HD1 ILE 82 21.644 3.726 5.930 571 HD13 ILE 82 2HD1 ILE 82 20.235 3.358 6.925 572 H GLN 83 H GLN 83 25.705 2.239 6.330 573 HA GLN 83 HA GLN 83 27.074 0.067 4.989 574 HB2 GLN 83 2HB GLN 83 28.868 1.354 4.096 575 HB3 GLN 83 3HB GLN 83 27.378 2.095 3.528 576 HG2 GLN 83 2HG GLN 83 27.632 3.669 5.538 577 HG3 GLN 83 3HG GLN 83 29.293 3.082 5.604 578 HE21 GLN 83 1HE2 GLN 83 30.759 3.908 4.244 579 HE22 GLN 83 2HE2 GLN 83 30.413 5.047 2.992 580 H GLY 84 H GLY 84 29.230 -0.346 5.937 581 HA2 GLY 84 2HA GLY 84 29.785 0.929 8.490 582 HA3 GLY 84 3HA GLY 84 29.299 -0.758 8.577 583 H SER 85 H SER 85 31.812 0.345 9.407 584 HA SER 85 HA SER 85 33.586 -1.160 7.604 585 HB2 SER 85 2HB SER 85 35.232 0.753 8.749 586 HB3 SER 85 3HB SER 85 34.603 0.784 7.102 587 HG SER 85 HG SER 85 33.274 1.897 9.349 588 H THR 86 H THR 86 35.500 -2.028 8.629 589 HA THR 86 HA THR 86 35.207 -2.366 11.542 590 HB THR 86 HB THR 86 36.277 -4.537 9.751 591 HG1 THR 86 HG1 THR 86 33.606 -3.880 10.383 592 HG21 THR 86 3HG2 THR 86 34.853 -5.141 12.256 593 HG22 THR 86 1HG2 THR 86 36.369 -4.262 12.449 594 HG23 THR 86 2HG2 THR 86 36.350 -5.814 11.612 595 H ASP 87 H ASP 87 37.063 -2.379 12.759 596 HA ASP 87 HA ASP 87 39.488 -1.498 11.363 597 HB2 ASP 87 2HB ASP 87 38.572 -0.051 13.169 598 HB3 ASP 87 3HB ASP 87 38.840 -1.362 14.315 599 H PHE 88 H PHE 88 41.200 -2.784 11.192 600 HA PHE 88 HA PHE 88 41.407 -5.095 13.006 601 HB2 PHE 88 2HB PHE 88 41.563 -4.972 10.031 602 HB3 PHE 88 3HB PHE 88 42.621 -6.105 10.866 603 HD1 PHE 88 HD2 PHE 88 41.407 -7.590 12.682 604 HD2 PHE 88 HD1 PHE 88 39.479 -5.688 9.399 605 HE1 PHE 88 HE2 PHE 88 39.555 -9.202 12.840 606 HE2 PHE 88 HE1 PHE 88 37.623 -7.296 9.552 607 HZ PHE 88 HZ PHE 88 37.660 -9.057 11.273 608 H LYS 89 H LYS 89 43.130 -4.859 14.253 609 HA LYS 89 HA LYS 89 45.547 -3.630 13.097 610 HB2 LYS 89 2HB LYS 89 44.135 -3.162 15.620 611 HB3 LYS 89 3HB LYS 89 45.860 -3.434 15.827 612 HG2 LYS 89 2HG LYS 89 45.665 -1.665 13.685 613 HG3 LYS 89 3HG LYS 89 44.470 -1.107 14.858 614 HD2 LYS 89 2HD LYS 89 46.115 -0.905 16.561 615 HD3 LYS 89 3HD LYS 89 47.316 -1.764 15.595 616 HE2 LYS 89 2HE LYS 89 47.184 0.103 13.933 617 HE3 LYS 89 3HE LYS 89 46.163 0.973 15.077 618 HZ1 LYS 89 3HZ LYS 89 47.935 1.027 16.650 619 HZ2 LYS 89 1HZ LYS 89 48.544 1.588 15.174 620 HZ3 LYS 89 2HZ LYS 89 48.904 0.020 15.696 621 H VAL 90 H VAL 90 46.953 -5.192 12.631 622 HA VAL 90 HA VAL 90 47.120 -7.551 14.358 623 HB VAL 90 HB VAL 90 48.373 -7.032 11.658 624 HG11 VAL 90 1HG1 VAL 90 48.618 -9.618 11.826 625 HG12 VAL 90 2HG1 VAL 90 49.803 -8.575 12.615 626 HG13 VAL 90 3HG1 VAL 90 48.522 -9.330 13.563 627 HG21 VAL 90 3HG2 VAL 90 45.779 -8.090 12.509 628 HG22 VAL 90 1HG2 VAL 90 46.285 -7.440 10.949 629 HG23 VAL 90 2HG2 VAL 90 46.637 -9.118 11.361 630 H THR 91 H THR 91 48.426 -7.221 16.052 631 HA THR 91 HA THR 91 51.063 -6.004 15.544 632 HB THR 91 HB THR 91 51.084 -5.395 17.967 633 HG1 THR 91 HG1 THR 91 49.588 -6.508 19.025 634 HG21 THR 91 3HG2 THR 91 50.582 -3.593 16.580 635 HG22 THR 91 1HG2 THR 91 49.228 -3.608 17.709 636 HG23 THR 91 2HG2 THR 91 49.032 -4.276 16.088 637 H GLN 92 H GLN 92 52.838 -6.818 16.847 638 HA GLN 92 HA GLN 92 54.171 -8.518 17.560 639 HB2 GLN 92 2HB GLN 92 52.291 -8.267 19.418 640 HB3 GLN 92 3HB GLN 92 51.868 -9.883 18.869 641 HG2 GLN 92 2HG GLN 92 54.512 -10.193 19.173 642 HG3 GLN 92 3HG GLN 92 54.214 -8.947 20.384 643 HE21 GLN 92 1HE2 GLN 92 54.713 -10.386 22.050 644 HE22 GLN 92 2HE2 GLN 92 53.618 -11.630 22.537 Start of MODEL 5 1 H1 MET 1 H MET 1 3.392 1.416 4.201 2 HA MET 1 HA MET 1 1.866 0.182 2.099 3 HB2 MET 1 2HB MET 1 2.936 1.762 0.360 4 HB3 MET 1 3HB MET 1 1.514 2.319 1.232 5 HG2 MET 1 2HG MET 1 2.671 3.886 2.406 6 HG3 MET 1 3HG MET 1 4.174 2.968 2.365 7 HE1 MET 1 3HE MET 1 5.925 3.435 1.310 8 HE2 MET 1 1HE MET 1 6.186 4.232 -0.241 9 HE3 MET 1 2HE MET 1 5.949 5.197 1.216 10 HA PRO 2 HA PRO 2 5.602 -2.038 1.493 11 HB2 PRO 2 2HB PRO 2 5.493 -2.604 -1.160 12 HB3 PRO 2 3HB PRO 2 4.444 -3.380 0.032 13 HG2 PRO 2 2HG PRO 2 3.853 -1.093 -1.807 14 HG3 PRO 2 3HG PRO 2 2.842 -2.492 -1.400 15 HD2 PRO 2 2HD PRO 2 2.480 -0.056 -0.274 16 HD3 PRO 2 3HD PRO 2 2.146 -1.568 0.594 17 H ALA 3 H ALA 3 7.725 -1.732 0.977 18 HA ALA 3 HA ALA 3 8.504 0.188 -1.048 19 HB1 ALA 3 1HB ALA 3 8.070 1.281 1.347 20 HB2 ALA 3 2HB ALA 3 9.733 0.742 1.587 21 HB3 ALA 3 3HB ALA 3 9.344 1.838 0.260 22 H ALA 4 H ALA 4 10.100 -0.762 -2.114 23 HA ALA 4 HA ALA 4 11.700 -2.820 -0.823 24 HB1 ALA 4 1HB ALA 4 11.349 -3.703 -2.847 25 HB2 ALA 4 2HB ALA 4 10.960 -2.140 -3.565 26 HB3 ALA 4 3HB ALA 4 12.644 -2.633 -3.384 27 H LEU 5 H LEU 5 13.929 -2.771 -0.609 28 HA LEU 5 HA LEU 5 15.986 -1.871 -0.255 29 HB2 LEU 5 2HB LEU 5 15.506 -1.288 -2.766 30 HB3 LEU 5 3HB LEU 5 15.401 0.359 -2.148 31 HG LEU 5 HG LEU 5 17.789 -0.707 -1.120 32 HD11 LEU 5 1HD1 LEU 5 17.401 -1.358 -4.036 33 HD12 LEU 5 2HD1 LEU 5 17.756 -2.485 -2.727 34 HD13 LEU 5 3HD1 LEU 5 18.966 -1.303 -3.223 35 HD21 LEU 5 3HD2 LEU 5 17.096 1.634 -1.949 36 HD22 LEU 5 1HD2 LEU 5 17.630 1.065 -3.530 37 HD23 LEU 5 2HD2 LEU 5 18.766 1.116 -2.182 38 H VAL 6 H VAL 6 16.044 -1.080 1.761 39 HA VAL 6 HA VAL 6 15.147 1.699 2.160 40 HB VAL 6 HB VAL 6 14.989 -0.552 4.170 41 HG11 VAL 6 1HG1 VAL 6 15.013 1.028 5.730 42 HG12 VAL 6 2HG1 VAL 6 15.099 2.295 4.506 43 HG13 VAL 6 3HG1 VAL 6 13.531 1.683 5.034 44 HG21 VAL 6 3HG2 VAL 6 12.532 -0.097 4.022 45 HG22 VAL 6 1HG2 VAL 6 12.867 0.932 2.630 46 HG23 VAL 6 2HG2 VAL 6 13.237 -0.791 2.563 47 H SER 7 H SER 7 16.937 -0.667 4.127 48 HA SER 7 HA SER 7 19.478 0.470 3.796 49 HB2 SER 7 2HB SER 7 19.252 1.287 6.430 50 HB3 SER 7 3HB SER 7 19.286 2.349 5.023 51 HG SER 7 HG SER 7 17.457 2.625 6.488 52 H ILE 8 H ILE 8 21.029 -0.288 5.516 53 HA ILE 8 HA ILE 8 20.062 -2.755 6.801 54 HB ILE 8 HB ILE 8 21.366 -3.246 4.731 55 HG12 ILE 8 2HG1 ILE 8 22.723 -4.113 7.293 56 HG13 ILE 8 3HG1 ILE 8 21.241 -4.818 6.656 57 HG21 ILE 8 1HG2 ILE 8 23.079 -1.269 5.774 58 HG22 ILE 8 2HG2 ILE 8 23.979 -2.784 5.791 59 HG23 ILE 8 3HG2 ILE 8 23.270 -2.197 4.287 60 HD11 ILE 8 3HD1 ILE 8 24.018 -4.976 5.549 61 HD12 ILE 8 1HD1 ILE 8 22.930 -6.285 6.010 62 HD13 ILE 8 2HD1 ILE 8 22.601 -5.333 4.562 63 H SER 9 H SER 9 21.134 -3.384 8.712 64 HA SER 9 HA SER 9 22.597 -1.187 10.017 65 HB2 SER 9 2HB SER 9 20.585 -1.571 11.215 66 HB3 SER 9 3HB SER 9 20.776 -3.322 11.127 67 HG SER 9 HG SER 9 21.374 -2.618 13.171 68 H VAL 10 H VAL 10 24.715 -1.544 10.017 69 HA VAL 10 HA VAL 10 25.700 -4.298 10.307 70 HB VAL 10 HB VAL 10 27.212 -1.840 9.410 71 HG11 VAL 10 1HG1 VAL 10 28.414 -4.266 8.571 72 HG12 VAL 10 2HG1 VAL 10 29.054 -3.049 9.679 73 HG13 VAL 10 3HG1 VAL 10 28.094 -4.393 10.300 74 HG21 VAL 10 3HG2 VAL 10 27.141 -2.988 7.173 75 HG22 VAL 10 1HG2 VAL 10 25.927 -4.073 7.851 76 HG23 VAL 10 2HG2 VAL 10 25.599 -2.344 7.736 77 H SER 11 H SER 11 26.855 -4.918 12.039 78 HA SER 11 HA SER 11 27.477 -2.862 14.057 79 HB2 SER 11 2HB SER 11 26.554 -5.714 14.339 80 HB3 SER 11 3HB SER 11 27.374 -4.885 15.662 81 HG SER 11 HG SER 11 25.674 -3.640 15.959 82 HA PRO 12 HA PRO 12 31.495 -4.693 12.604 83 HB2 PRO 12 2HB PRO 12 32.775 -2.308 12.388 84 HB3 PRO 12 3HB PRO 12 31.809 -3.002 11.081 85 HG2 PRO 12 2HG PRO 12 31.066 -0.893 13.071 86 HG3 PRO 12 3HG PRO 12 30.742 -0.950 11.329 87 HD2 PRO 12 2HD PRO 12 28.874 -1.595 13.180 88 HD3 PRO 12 3HD PRO 12 28.942 -2.367 11.583 89 H THR 13 H THR 13 33.456 -4.832 13.756 90 HA THR 13 HA THR 13 33.352 -3.701 16.477 91 HB THR 13 HB THR 13 35.048 -6.081 16.008 92 HG1 THR 13 HG1 THR 13 33.209 -6.728 14.875 93 HG21 THR 13 3HG2 THR 13 34.787 -6.361 18.229 94 HG22 THR 13 1HG2 THR 13 33.058 -6.020 18.171 95 HG23 THR 13 2HG2 THR 13 34.218 -4.692 18.197 96 H ASN 14 H ASN 14 34.779 -2.116 16.717 97 HA ASN 14 HA ASN 14 37.221 -2.103 15.115 98 HB2 ASN 14 2HB ASN 14 37.480 0.221 16.049 99 HB3 ASN 14 3HB ASN 14 36.026 -0.025 15.086 100 HD21 ASN 14 1HD2 ASN 14 37.231 1.178 17.928 101 HD22 ASN 14 2HD2 ASN 14 35.758 1.291 18.825 102 H SER 15 H SER 15 38.622 -3.513 16.065 103 HA SER 15 HA SER 15 39.843 -2.661 18.536 104 HB2 SER 15 2HB SER 15 37.809 -4.473 18.811 105 HB3 SER 15 3HB SER 15 39.212 -5.532 18.669 106 HG SER 15 HG SER 15 38.459 -4.421 20.828 107 H THR 16 H THR 16 41.408 -4.800 19.118 108 HA THR 16 HA THR 16 42.971 -5.133 16.644 109 HB THR 16 HB THR 16 44.958 -5.265 17.955 110 HG1 THR 16 HG1 THR 16 43.414 -5.041 20.330 111 HG21 THR 16 3HG2 THR 16 45.047 -3.053 18.214 112 HG22 THR 16 1HG2 THR 16 43.962 -3.123 19.602 113 HG23 THR 16 2HG2 THR 16 43.301 -3.004 17.971 114 H VAL 17 H VAL 17 44.121 -7.140 16.347 115 HA VAL 17 HA VAL 17 43.044 -9.418 17.857 116 HB VAL 17 HB VAL 17 41.792 -9.137 15.702 117 HG11 VAL 17 1HG1 VAL 17 44.162 -10.178 14.237 118 HG12 VAL 17 2HG1 VAL 17 42.785 -9.246 13.645 119 HG13 VAL 17 3HG1 VAL 17 44.066 -8.446 14.556 120 HG21 VAL 17 3HG2 VAL 17 42.135 -11.321 16.916 121 HG22 VAL 17 1HG2 VAL 17 41.768 -11.455 15.196 122 HG23 VAL 17 2HG2 VAL 17 43.424 -11.667 15.763 123 H ALA 18 H ALA 18 44.349 -11.327 17.780 124 HA ALA 18 HA ALA 18 47.138 -10.781 17.868 125 HB1 ALA 18 1HB ALA 18 46.854 -13.547 17.819 126 HB2 ALA 18 2HB ALA 18 46.953 -12.515 19.247 127 HB3 ALA 18 3HB ALA 18 45.379 -12.956 18.584 128 H LYS 19 H LYS 19 48.757 -12.145 16.691 129 HA LYS 19 HA LYS 19 48.710 -11.675 13.973 130 HB2 LYS 19 2HB LYS 19 50.545 -13.380 13.833 131 HB3 LYS 19 3HB LYS 19 50.789 -12.144 15.060 132 HG2 LYS 19 2HG LYS 19 49.933 -13.742 16.758 133 HG3 LYS 19 3HG LYS 19 49.877 -14.978 15.499 134 HD2 LYS 19 2HD LYS 19 52.434 -13.841 15.342 135 HD3 LYS 19 3HD LYS 19 52.112 -14.062 17.064 136 HE2 LYS 19 2HE LYS 19 51.497 -16.411 16.608 137 HE3 LYS 19 3HE LYS 19 51.917 -16.170 14.913 138 HZ1 LYS 19 3HZ LYS 19 54.179 -15.768 15.516 139 HZ2 LYS 19 1HZ LYS 19 53.697 -17.216 16.244 140 HZ3 LYS 19 2HZ LYS 19 53.814 -15.804 17.167 141 H GLY 20 H GLY 20 47.685 -12.564 12.303 142 HA2 GLY 20 2HA GLY 20 46.483 -14.047 11.029 143 HA3 GLY 20 3HA GLY 20 47.259 -15.324 11.954 144 H LEU 21 H LEU 21 44.374 -13.617 11.373 145 HA LEU 21 HA LEU 21 42.799 -15.446 12.826 146 HB2 LEU 21 2HB LEU 21 43.732 -13.108 14.266 147 HB3 LEU 21 3HB LEU 21 41.973 -13.184 14.202 148 HG LEU 21 HG LEU 21 42.943 -15.757 14.931 149 HD11 LEU 21 1HD1 LEU 21 43.828 -13.855 17.016 150 HD12 LEU 21 2HD1 LEU 21 44.891 -14.074 15.626 151 HD13 LEU 21 3HD1 LEU 21 44.431 -15.462 16.611 152 HD21 LEU 21 3HD2 LEU 21 41.743 -15.056 17.100 153 HD22 LEU 21 1HD2 LEU 21 40.804 -15.146 15.610 154 HD23 LEU 21 2HD2 LEU 21 41.337 -13.581 16.221 155 H GLN 22 H GLN 22 40.498 -14.970 12.680 156 HA GLN 22 HA GLN 22 39.872 -12.930 10.652 157 HB2 GLN 22 2HB GLN 22 38.066 -14.593 9.896 158 HB3 GLN 22 3HB GLN 22 39.729 -14.922 9.429 159 HG2 GLN 22 2HG GLN 22 39.851 -16.793 10.668 160 HG3 GLN 22 3HG GLN 22 38.865 -16.126 11.968 161 HE21 GLN 22 1HE2 GLN 22 38.615 -17.247 8.616 162 HE22 GLN 22 2HE2 GLN 22 37.060 -17.979 8.795 163 H GLU 23 H GLU 23 37.949 -11.828 10.879 164 HA GLU 23 HA GLU 23 36.448 -12.367 13.358 165 HB2 GLU 23 2HB GLU 23 37.847 -10.021 12.578 166 HB3 GLU 23 3HB GLU 23 36.130 -9.650 12.530 167 HG2 GLU 23 2HG GLU 23 37.529 -10.878 14.892 168 HG3 GLU 23 3HG GLU 23 37.227 -9.152 14.699 169 H ASN 24 H ASN 24 34.403 -12.914 13.044 170 HA ASN 24 HA ASN 24 33.194 -12.782 10.460 171 HB2 ASN 24 2HB ASN 24 31.158 -13.640 11.721 172 HB3 ASN 24 3HB ASN 24 32.600 -14.648 11.804 173 HD21 ASN 24 1HD2 ASN 24 33.202 -15.310 13.734 174 HD22 ASN 24 2HD2 ASN 24 32.730 -14.609 15.241 175 H PHE 25 H PHE 25 31.617 -11.446 9.696 176 HA PHE 25 HA PHE 25 31.148 -9.005 11.244 177 HB2 PHE 25 2HB PHE 25 30.804 -9.636 8.309 178 HB3 PHE 25 3HB PHE 25 30.305 -8.113 9.039 179 HD1 PHE 25 HD1 PHE 25 32.465 -7.473 10.846 180 HD2 PHE 25 HD2 PHE 25 32.613 -9.197 6.957 181 HE1 PHE 25 HE1 PHE 25 34.738 -6.582 10.541 182 HE2 PHE 25 HE2 PHE 25 34.887 -8.310 6.647 183 HZ PHE 25 HZ PHE 25 35.953 -7.001 8.440 184 H LYS 26 H LYS 26 28.924 -7.972 10.772 185 HA LYS 26 HA LYS 26 26.778 -9.942 10.605 186 HB2 LYS 26 2HB LYS 26 27.421 -8.281 13.015 187 HB3 LYS 26 3HB LYS 26 25.748 -8.693 12.664 188 HG2 LYS 26 2HG LYS 26 26.428 -11.095 12.631 189 HG3 LYS 26 3HG LYS 26 28.022 -10.590 13.195 190 HD2 LYS 26 2HD LYS 26 27.126 -9.749 15.231 191 HD3 LYS 26 3HD LYS 26 25.470 -9.906 14.641 192 HE2 LYS 26 2HE LYS 26 26.515 -12.457 14.391 193 HE3 LYS 26 3HE LYS 26 27.192 -11.871 15.910 194 HZ1 LYS 26 3HZ LYS 26 24.374 -11.332 15.545 195 HZ2 LYS 26 1HZ LYS 26 25.200 -11.909 16.904 196 HZ3 LYS 26 2HZ LYS 26 24.765 -12.974 15.664 197 H ALA 27 H ALA 27 25.123 -9.194 9.445 198 HA ALA 27 HA ALA 27 24.659 -6.301 9.307 199 HB1 ALA 27 1HB ALA 27 25.050 -6.101 7.113 200 HB2 ALA 27 2HB ALA 27 25.964 -7.599 7.288 201 HB3 ALA 27 3HB ALA 27 24.289 -7.647 6.739 202 H THR 28 H THR 28 22.585 -5.816 9.590 203 HA THR 28 HA THR 28 20.578 -7.923 9.109 204 HB THR 28 HB THR 28 19.542 -5.945 10.884 205 HG1 THR 28 HG1 THR 28 22.031 -7.071 11.708 206 HG21 THR 28 3HG2 THR 28 20.385 -8.636 11.837 207 HG22 THR 28 1HG2 THR 28 19.192 -8.548 10.542 208 HG23 THR 28 2HG2 THR 28 18.869 -7.772 12.093 209 H GLY 29 H GLY 29 19.691 -7.418 7.185 210 HA2 GLY 29 2HA GLY 29 19.200 -4.652 6.452 211 HA3 GLY 29 3HA GLY 29 18.894 -6.067 5.457 212 H ILE 30 H ILE 30 17.317 -3.593 6.526 213 HA ILE 30 HA ILE 30 14.891 -5.133 7.175 214 HB ILE 30 HB ILE 30 15.612 -2.419 8.288 215 HG12 ILE 30 2HG1 ILE 30 15.148 -4.516 10.228 216 HG13 ILE 30 3HG1 ILE 30 16.445 -4.964 9.125 217 HG21 ILE 30 1HG2 ILE 30 13.268 -2.498 8.043 218 HG22 ILE 30 2HG2 ILE 30 13.189 -4.170 8.594 219 HG23 ILE 30 3HG2 ILE 30 13.583 -2.885 9.734 220 HD11 ILE 30 3HD1 ILE 30 17.292 -3.845 11.111 221 HD12 ILE 30 1HD1 ILE 30 17.621 -2.906 9.656 222 HD13 ILE 30 2HD1 ILE 30 16.312 -2.428 10.737 223 H PHE 31 H PHE 31 13.642 -5.035 5.425 224 HA PHE 31 HA PHE 31 13.409 -2.458 4.015 225 HB2 PHE 31 2HB PHE 31 12.809 -5.201 2.895 226 HB3 PHE 31 3HB PHE 31 12.857 -3.681 2.008 227 HD1 PHE 31 HD2 PHE 31 15.320 -2.461 2.995 228 HD2 PHE 31 HD1 PHE 31 14.481 -6.511 1.989 229 HE1 PHE 31 HE2 PHE 31 17.701 -2.827 2.497 230 HE2 PHE 31 HE1 PHE 31 16.862 -6.883 1.490 231 HZ PHE 31 HZ PHE 31 18.475 -5.040 1.743 232 H THR 32 H THR 32 11.381 -1.673 3.490 233 HA THR 32 HA THR 32 9.278 -2.318 5.275 234 HB THR 32 HB THR 32 8.796 -0.793 2.738 235 HG1 THR 32 HG1 THR 32 10.466 -0.079 4.893 236 HG21 THR 32 3HG2 THR 32 7.738 -0.792 5.538 237 HG22 THR 32 1HG2 THR 32 6.859 -0.860 4.012 238 HG23 THR 32 2HG2 THR 32 7.593 0.654 4.540 239 H ASP 33 H ASP 33 10.240 -3.658 2.301 240 HA ASP 33 HA ASP 33 7.628 -4.588 1.503 241 HB2 ASP 33 2HB ASP 33 9.824 -4.113 0.068 242 HB3 ASP 33 3HB ASP 33 10.109 -5.818 0.406 243 H ASN 34 H ASN 34 9.594 -5.439 3.961 244 HA ASN 34 HA ASN 34 9.827 -7.268 5.294 245 HB2 ASN 34 2HB ASN 34 7.398 -8.481 4.013 246 HB3 ASN 34 3HB ASN 34 7.900 -8.522 5.701 247 HD21 ASN 34 1HD2 ASN 34 5.808 -7.161 3.535 248 HD22 ASN 34 2HD2 ASN 34 5.324 -5.776 4.448 249 H SER 35 H SER 35 10.953 -7.282 2.539 250 HA SER 35 HA SER 35 11.352 -10.190 2.324 251 HB2 SER 35 2HB SER 35 10.699 -8.215 0.173 252 HB3 SER 35 3HB SER 35 11.737 -9.586 -0.216 253 HG SER 35 HG SER 35 9.143 -9.735 0.933 254 H ASN 36 H ASN 36 13.229 -9.832 3.643 255 HA ASN 36 HA ASN 36 15.387 -8.267 2.455 256 HB2 ASN 36 2HB ASN 36 16.541 -8.532 4.539 257 HB3 ASN 36 3HB ASN 36 14.866 -8.137 4.914 258 HD21 ASN 36 1HD2 ASN 36 17.351 -10.516 5.073 259 HD22 ASN 36 2HD2 ASN 36 16.495 -11.655 6.051 260 H SER 37 H SER 37 17.326 -9.126 1.768 261 HA SER 37 HA SER 37 17.547 -12.056 1.702 262 HB2 SER 37 2HB SER 37 17.270 -10.230 -0.567 263 HB3 SER 37 3HB SER 37 18.692 -11.266 -0.688 264 HG SER 37 HG SER 37 17.386 -12.804 -1.229 265 H ASP 38 H ASP 38 19.770 -12.788 1.138 266 HA ASP 38 HA ASP 38 21.676 -11.387 2.747 267 HB2 ASP 38 2HB ASP 38 23.235 -13.222 1.909 268 HB3 ASP 38 3HB ASP 38 21.818 -13.750 2.812 269 H ILE 39 H ILE 39 22.595 -9.579 2.027 270 HA ILE 39 HA ILE 39 23.366 -7.999 0.527 271 HB ILE 39 HB ILE 39 25.477 -8.724 -0.550 272 HG12 ILE 39 2HG1 ILE 39 24.916 -11.432 0.664 273 HG13 ILE 39 3HG1 ILE 39 24.629 -11.063 -1.032 274 HG21 ILE 39 1HG2 ILE 39 26.605 -9.444 1.600 275 HG22 ILE 39 2HG2 ILE 39 25.669 -7.952 1.670 276 HG23 ILE 39 3HG2 ILE 39 24.999 -9.444 2.329 277 HD11 ILE 39 3HD1 ILE 39 27.253 -11.091 0.426 278 HD12 ILE 39 1HD1 ILE 39 26.726 -12.146 -0.885 279 HD13 ILE 39 2HD1 ILE 39 27.049 -10.441 -1.201 280 H THR 40 H THR 40 21.083 -8.897 -0.570 281 HA THR 40 HA THR 40 21.210 -10.124 -3.072 282 HB THR 40 HB THR 40 19.163 -8.130 -3.138 283 HG1 THR 40 HG1 THR 40 18.728 -7.908 -1.086 284 HG21 THR 40 3HG2 THR 40 19.313 -11.106 -2.836 285 HG22 THR 40 1HG2 THR 40 18.697 -10.150 -4.184 286 HG23 THR 40 2HG2 THR 40 17.763 -10.277 -2.693 287 H ASP 41 H ASP 41 21.888 -6.843 -2.108 288 HA ASP 41 HA ASP 41 21.984 -5.884 -4.847 289 HB2 ASP 41 2HB ASP 41 21.763 -4.690 -2.246 290 HB3 ASP 41 3HB ASP 41 23.139 -3.986 -3.091 291 H GLN 42 H GLN 42 23.934 -7.827 -3.221 292 HA GLN 42 HA GLN 42 26.113 -8.448 -3.418 293 HB2 GLN 42 2HB GLN 42 25.444 -7.557 -5.888 294 HB3 GLN 42 3HB GLN 42 26.770 -6.465 -5.508 295 HG2 GLN 42 2HG GLN 42 28.318 -8.070 -5.699 296 HG3 GLN 42 3HG GLN 42 27.304 -9.285 -4.922 297 HE21 GLN 42 1HE2 GLN 42 25.785 -10.423 -6.184 298 HE22 GLN 42 2HE2 GLN 42 25.964 -10.551 -7.898 299 H VAL 43 H VAL 43 27.008 -7.778 -1.537 300 HA VAL 43 HA VAL 43 27.677 -5.003 -1.088 301 HB VAL 43 HB VAL 43 26.898 -6.513 0.745 302 HG11 VAL 43 1HG1 VAL 43 28.153 -8.511 0.042 303 HG12 VAL 43 2HG1 VAL 43 29.656 -7.711 0.508 304 HG13 VAL 43 3HG1 VAL 43 28.444 -8.095 1.731 305 HG21 VAL 43 3HG2 VAL 43 27.812 -4.923 2.000 306 HG22 VAL 43 1HG2 VAL 43 29.323 -5.832 2.007 307 HG23 VAL 43 2HG2 VAL 43 29.035 -4.610 0.768 308 H THR 44 H THR 44 29.670 -4.079 -1.135 309 HA THR 44 HA THR 44 31.782 -5.620 -2.442 310 HB THR 44 HB THR 44 31.934 -2.675 -1.864 311 HG1 THR 44 HG1 THR 44 30.927 -2.403 -3.955 312 HG21 THR 44 3HG2 THR 44 33.920 -3.128 -2.835 313 HG22 THR 44 1HG2 THR 44 32.986 -3.100 -4.330 314 HG23 THR 44 2HG2 THR 44 33.345 -4.637 -3.544 315 H TRP 45 H TRP 45 33.505 -6.343 -1.381 316 HA TRP 45 HA TRP 45 34.047 -5.251 1.301 317 HB2 TRP 45 2HB TRP 45 35.293 -7.556 1.508 318 HB3 TRP 45 3HB TRP 45 33.546 -7.468 1.720 319 HD1 TRP 45 HD1 TRP 45 32.068 -8.846 0.079 320 HE1 TRP 45 HE1 TRP 45 32.567 -10.432 -1.886 321 HE3 TRP 45 HE3 TRP 45 37.056 -7.884 -0.494 322 HZ2 TRP 45 HZ2 TRP 45 34.782 -11.177 -3.469 323 HZ3 TRP 45 HZ3 TRP 45 38.292 -9.076 -2.256 324 HH2 TRP 45 HH2 TRP 45 37.177 -10.688 -3.712 325 H ASP 46 H ASP 46 36.152 -4.774 1.896 326 HA ASP 46 HA ASP 46 38.320 -5.205 0.021 327 HB2 ASP 46 2HB ASP 46 36.887 -2.738 0.046 328 HB3 ASP 46 3HB ASP 46 38.491 -2.447 0.713 329 H SER 47 H SER 47 40.347 -5.085 0.962 330 HA SER 47 HA SER 47 40.403 -4.496 3.847 331 HB2 SER 47 2HB SER 47 40.438 -6.916 3.554 332 HB3 SER 47 3HB SER 47 41.777 -6.783 2.415 333 HG SER 47 HG SER 47 41.768 -6.601 5.182 334 H SER 48 H SER 48 42.352 -3.673 4.679 335 HA SER 48 HA SER 48 43.678 -1.811 3.108 336 HB2 SER 48 2HB SER 48 44.064 -1.268 5.276 337 HB3 SER 48 3HB SER 48 44.042 -2.950 5.804 338 HG SER 48 HG SER 48 46.122 -1.815 5.931 339 H ASN 49 H ASN 49 45.312 -1.894 1.705 340 HA ASN 49 HA ASN 49 46.494 -4.460 1.081 341 HB2 ASN 49 2HB ASN 49 45.951 -2.052 -0.341 342 HB3 ASN 49 3HB ASN 49 47.685 -2.350 -0.431 343 HD21 ASN 49 1HD2 ASN 49 44.520 -3.732 -1.048 344 HD22 ASN 49 2HD2 ASN 49 45.038 -4.850 -2.259 345 H THR 50 H THR 50 47.975 -5.044 2.587 346 HA THR 50 HA THR 50 50.294 -3.259 2.911 347 HB THR 50 HB THR 50 49.137 -3.126 5.000 348 HG1 THR 50 HG1 THR 50 51.398 -3.424 5.184 349 HG21 THR 50 3HG2 THR 50 47.759 -5.182 4.659 350 HG22 THR 50 1HG2 THR 50 48.425 -5.027 6.284 351 HG23 THR 50 2HG2 THR 50 49.161 -6.141 5.131 352 H ASP 51 H ASP 51 49.076 -6.581 3.068 353 HA ASP 51 HA ASP 51 51.309 -7.619 1.664 354 HB2 ASP 51 2HB ASP 51 51.474 -7.535 4.581 355 HB3 ASP 51 3HB ASP 51 51.670 -9.160 3.930 356 H ILE 52 H ILE 52 49.452 -9.040 4.341 357 HA ILE 52 HA ILE 52 48.180 -10.834 2.378 358 HB ILE 52 HB ILE 52 48.873 -11.451 5.253 359 HG12 ILE 52 2HG1 ILE 52 50.030 -12.657 2.736 360 HG13 ILE 52 3HG1 ILE 52 50.794 -11.338 3.616 361 HG21 ILE 52 1HG2 ILE 52 47.418 -12.984 3.128 362 HG22 ILE 52 2HG2 ILE 52 48.254 -13.809 4.442 363 HG23 ILE 52 3HG2 ILE 52 46.946 -12.682 4.800 364 HD11 ILE 52 3HD1 ILE 52 50.446 -13.104 5.613 365 HD12 ILE 52 1HD1 ILE 52 50.644 -14.202 4.248 366 HD13 ILE 52 2HD1 ILE 52 51.897 -13.015 4.615 367 H LEU 53 H LEU 53 46.132 -10.245 2.102 368 HA LEU 53 HA LEU 53 44.452 -9.870 4.464 369 HB2 LEU 53 2HB LEU 53 43.312 -7.982 3.077 370 HB3 LEU 53 3HB LEU 53 44.736 -7.635 4.056 371 HG LEU 53 HG LEU 53 45.164 -8.329 1.200 372 HD11 LEU 53 1HD1 LEU 53 44.905 -5.668 0.981 373 HD12 LEU 53 2HD1 LEU 53 43.624 -5.998 2.146 374 HD13 LEU 53 3HD1 LEU 53 43.619 -6.806 0.579 375 HD21 LEU 53 3HD2 LEU 53 46.443 -6.610 3.291 376 HD22 LEU 53 1HD2 LEU 53 46.803 -6.369 1.581 377 HD23 LEU 53 2HD2 LEU 53 47.142 -7.923 2.342 378 H SER 54 H SER 54 42.658 -11.040 4.310 379 HA SER 54 HA SER 54 41.505 -11.569 1.669 380 HB2 SER 54 2HB SER 54 42.993 -13.481 3.053 381 HB3 SER 54 3HB SER 54 41.315 -13.909 3.384 382 HG SER 54 HG SER 54 41.696 -14.891 1.498 383 H ILE 55 H ILE 55 39.471 -10.910 1.727 384 HA ILE 55 HA ILE 55 37.963 -11.208 4.243 385 HB ILE 55 HB ILE 55 36.520 -9.327 3.304 386 HG12 ILE 55 2HG1 ILE 55 37.798 -9.635 1.011 387 HG13 ILE 55 3HG1 ILE 55 37.226 -8.050 1.521 388 HG21 ILE 55 1HG2 ILE 55 39.318 -9.005 4.309 389 HG22 ILE 55 2HG2 ILE 55 38.331 -7.589 3.947 390 HG23 ILE 55 3HG2 ILE 55 37.790 -8.756 5.154 391 HD11 ILE 55 3HD1 ILE 55 39.974 -8.876 2.283 392 HD12 ILE 55 1HD1 ILE 55 39.660 -8.401 0.614 393 HD13 ILE 55 2HD1 ILE 55 39.329 -7.274 1.930 394 H SER 56 H SER 56 36.225 -12.471 4.193 395 HA SER 56 HA SER 56 35.008 -13.083 1.580 396 HB2 SER 56 2HB SER 56 36.314 -14.879 3.359 397 HB3 SER 56 3HB SER 56 34.591 -15.254 3.394 398 HG SER 56 HG SER 56 36.163 -16.133 1.640 399 H ASN 57 H ASN 57 33.057 -12.192 1.544 400 HA ASN 57 HA ASN 57 31.173 -12.782 3.664 401 HB2 ASN 57 2HB ASN 57 30.503 -10.379 3.892 402 HB3 ASN 57 3HB ASN 57 32.102 -10.739 4.535 403 HD21 ASN 57 1HD2 ASN 57 30.369 -8.628 2.708 404 HD22 ASN 57 2HD2 ASN 57 31.655 -7.895 1.817 405 H ALA 58 H ALA 58 30.979 -13.883 1.289 406 HA ALA 58 HA ALA 58 28.978 -12.285 -0.173 407 HB1 ALA 58 1HB ALA 58 31.144 -14.078 -1.111 408 HB2 ALA 58 2HB ALA 58 29.631 -14.085 -2.017 409 HB3 ALA 58 3HB ALA 58 30.527 -12.581 -1.810 410 H SER 59 H SER 59 29.657 -15.229 1.490 411 HA SER 59 HA SER 59 27.640 -16.881 0.454 412 HB2 SER 59 2HB SER 59 27.897 -18.190 2.507 413 HB3 SER 59 3HB SER 59 29.476 -17.701 1.892 414 HG SER 59 HG SER 59 28.208 -17.021 4.232 415 H ASP 60 H ASP 60 27.609 -14.533 3.096 416 HA ASP 60 HA ASP 60 24.809 -14.077 2.793 417 HB2 ASP 60 2HB ASP 60 25.361 -16.247 4.370 418 HB3 ASP 60 3HB ASP 60 25.279 -14.951 5.561 419 H SER 61 H SER 61 24.186 -12.948 5.209 420 HA SER 61 HA SER 61 25.259 -10.416 5.060 421 HB2 SER 61 2HB SER 61 23.428 -10.286 6.388 422 HB3 SER 61 3HB SER 61 23.663 -11.910 7.034 423 HG SER 61 HG SER 61 24.716 -11.104 8.675 424 H HIS 62 H HIS 62 26.143 -12.948 7.409 425 HA HIS 62 HA HIS 62 28.365 -11.433 8.411 426 HB2 HIS 62 2HB HIS 62 28.750 -13.253 9.885 427 HB3 HIS 62 3HB HIS 62 27.000 -13.128 9.726 428 HD1 HIS 62 HD1 HIS 62 29.740 -15.489 9.442 429 HD2 HIS 62 HD2 HIS 62 25.912 -15.130 7.868 430 HE1 HIS 62 HE1 HIS 62 29.149 -17.777 8.581 431 H GLY 63 H GLY 63 30.575 -11.903 8.176 432 HA2 GLY 63 2HA GLY 63 31.246 -13.679 5.916 433 HA3 GLY 63 3HA GLY 63 31.914 -12.057 6.024 434 H LEU 64 H LEU 64 34.024 -12.333 6.396 435 HA LEU 64 HA LEU 64 34.953 -13.197 8.905 436 HB2 LEU 64 2HB LEU 64 36.310 -15.153 8.049 437 HB3 LEU 64 3HB LEU 64 34.583 -15.424 8.276 438 HG LEU 64 HG LEU 64 35.251 -14.605 5.561 439 HD11 LEU 64 1HD1 LEU 64 36.809 -16.742 6.846 440 HD12 LEU 64 2HD1 LEU 64 37.155 -15.790 5.403 441 HD13 LEU 64 3HD1 LEU 64 36.059 -17.168 5.307 442 HD21 LEU 64 3HD2 LEU 64 33.983 -16.822 5.184 443 HD22 LEU 64 1HD2 LEU 64 33.114 -15.455 5.882 444 HD23 LEU 64 2HD2 LEU 64 33.681 -16.762 6.921 445 H ALA 65 H ALA 65 36.004 -11.200 8.720 446 HA ALA 65 HA ALA 65 37.870 -10.711 6.580 447 HB1 ALA 65 1HB ALA 65 36.898 -8.750 7.331 448 HB2 ALA 65 2HB ALA 65 37.033 -9.211 9.028 449 HB3 ALA 65 3HB ALA 65 38.470 -8.723 8.130 450 H SER 66 H SER 66 39.639 -11.966 6.548 451 HA SER 66 HA SER 66 41.107 -12.368 9.068 452 HB2 SER 66 2HB SER 66 41.836 -14.427 8.305 453 HB3 SER 66 3HB SER 66 40.250 -14.339 7.538 454 HG SER 66 HG SER 66 41.220 -13.768 5.624 455 H THR 67 H THR 67 43.243 -11.826 9.225 456 HA THR 67 HA THR 67 44.639 -10.812 6.873 457 HB THR 67 HB THR 67 45.387 -8.840 8.483 458 HG1 THR 67 HG1 THR 67 44.141 -9.242 10.252 459 HG21 THR 67 3HG2 THR 67 44.451 -7.671 6.835 460 HG22 THR 67 1HG2 THR 67 42.843 -8.011 7.475 461 HG23 THR 67 2HG2 THR 67 43.586 -9.119 6.321 462 H LEU 68 H LEU 68 46.781 -11.218 6.917 463 HA LEU 68 HA LEU 68 47.980 -12.043 9.475 464 HB2 LEU 68 2HB LEU 68 47.339 -13.883 7.723 465 HB3 LEU 68 3HB LEU 68 48.810 -13.338 6.918 466 HG LEU 68 HG LEU 68 49.430 -13.804 9.651 467 HD11 LEU 68 1HD1 LEU 68 48.681 -15.913 10.144 468 HD12 LEU 68 2HD1 LEU 68 48.387 -16.325 8.455 469 HD13 LEU 68 3HD1 LEU 68 47.275 -15.254 9.307 470 HD21 LEU 68 3HD2 LEU 68 50.843 -13.949 7.540 471 HD22 LEU 68 1HD2 LEU 68 50.142 -15.551 7.313 472 HD23 LEU 68 2HD2 LEU 68 51.093 -15.202 8.757 473 H ASN 69 H ASN 69 48.362 -9.537 8.886 474 HA ASN 69 HA ASN 69 51.024 -9.414 7.628 475 HB2 ASN 69 2HB ASN 69 50.411 -6.957 7.204 476 HB3 ASN 69 3HB ASN 69 49.630 -8.169 6.193 477 HD21 ASN 69 1HD2 ASN 69 49.203 -6.069 8.969 478 HD22 ASN 69 2HD2 ASN 69 47.479 -5.992 8.881 479 H GLN 70 H GLN 70 52.227 -7.357 8.399 480 HA GLN 70 HA GLN 70 52.062 -7.322 11.331 481 HB2 GLN 70 2HB GLN 70 54.280 -7.190 9.385 482 HB3 GLN 70 3HB GLN 70 54.438 -6.138 10.786 483 HG2 GLN 70 2HG GLN 70 54.798 -7.844 12.195 484 HG3 GLN 70 3HG GLN 70 53.638 -8.897 11.386 485 HE21 GLN 70 1HE2 GLN 70 56.552 -9.097 12.316 486 HE22 GLN 70 2HE2 GLN 70 57.355 -9.809 10.963 487 H GLY 71 H GLY 71 50.361 -5.760 11.374 488 HA2 GLY 71 2HA GLY 71 51.090 -3.170 11.885 489 HA3 GLY 71 3HA GLY 71 50.703 -3.180 10.171 490 H ASN 72 H ASN 72 48.816 -2.120 10.048 491 HA ASN 72 HA ASN 72 46.565 -3.216 11.591 492 HB2 ASN 72 2HB ASN 72 45.656 -0.966 11.891 493 HB3 ASN 72 3HB ASN 72 47.263 -1.079 12.603 494 HD21 ASN 72 1HD2 ASN 72 48.989 -0.022 11.613 495 HD22 ASN 72 2HD2 ASN 72 48.744 1.240 10.460 496 H VAL 73 H VAL 73 44.667 -3.453 10.497 497 HA VAL 73 HA VAL 73 44.629 -2.570 7.685 498 HB VAL 73 HB VAL 73 43.211 -4.632 7.258 499 HG11 VAL 73 1HG1 VAL 73 46.110 -4.457 7.663 500 HG12 VAL 73 2HG1 VAL 73 45.471 -6.101 7.610 501 HG13 VAL 73 3HG1 VAL 73 45.189 -5.000 6.261 502 HG21 VAL 73 3HG2 VAL 73 43.259 -6.442 8.773 503 HG22 VAL 73 1HG2 VAL 73 44.484 -5.666 9.779 504 HG23 VAL 73 2HG2 VAL 73 42.841 -5.025 9.738 505 H LYS 74 H LYS 74 42.553 -2.131 6.781 506 HA LYS 74 HA LYS 74 40.419 -1.698 8.762 507 HB2 LYS 74 2HB LYS 74 41.421 0.456 8.348 508 HB3 LYS 74 3HB LYS 74 41.352 0.205 6.609 509 HG2 LYS 74 2HG LYS 74 39.609 1.710 7.217 510 HG3 LYS 74 3HG LYS 74 38.871 0.169 6.774 511 HD2 LYS 74 2HD LYS 74 37.747 0.408 8.707 512 HD3 LYS 74 3HD LYS 74 39.243 -0.168 9.446 513 HE2 LYS 74 2HE LYS 74 38.712 1.765 10.649 514 HE3 LYS 74 3HE LYS 74 39.944 2.292 9.503 515 HZ1 LYS 74 3HZ LYS 74 37.236 3.149 9.766 516 HZ2 LYS 74 1HZ LYS 74 37.575 2.650 8.185 517 HZ3 LYS 74 2HZ LYS 74 38.509 3.860 8.908 518 H VAL 75 H VAL 75 38.682 -2.831 8.233 519 HA VAL 75 HA VAL 75 38.259 -3.585 5.432 520 HB VAL 75 HB VAL 75 36.957 -4.654 7.941 521 HG11 VAL 75 1HG1 VAL 75 36.268 -6.500 6.298 522 HG12 VAL 75 2HG1 VAL 75 35.380 -4.976 6.247 523 HG13 VAL 75 3HG1 VAL 75 36.615 -5.320 5.036 524 HG21 VAL 75 3HG2 VAL 75 39.219 -5.633 6.228 525 HG22 VAL 75 1HG2 VAL 75 39.169 -5.413 7.977 526 HG23 VAL 75 2HG2 VAL 75 38.273 -6.734 7.228 527 H THR 76 H THR 76 36.441 -3.056 4.304 528 HA THR 76 HA THR 76 34.363 -1.496 5.671 529 HB THR 76 HB THR 76 34.290 0.084 3.744 530 HG1 THR 76 HG1 THR 76 35.509 -0.327 2.073 531 HG21 THR 76 3HG2 THR 76 35.403 0.756 5.793 532 HG22 THR 76 1HG2 THR 76 36.290 1.380 4.403 533 HG23 THR 76 2HG2 THR 76 36.893 -0.031 5.272 534 H ALA 77 H ALA 77 32.333 -1.946 5.025 535 HA ALA 77 HA ALA 77 31.856 -3.228 2.456 536 HB1 ALA 77 1HB ALA 77 32.163 -4.797 4.724 537 HB2 ALA 77 2HB ALA 77 30.417 -4.673 4.506 538 HB3 ALA 77 3HB ALA 77 31.428 -5.282 3.195 539 H SER 78 H SER 78 29.954 -2.638 1.587 540 HA SER 78 HA SER 78 27.847 -1.581 3.321 541 HB2 SER 78 2HB SER 78 28.368 -0.021 0.849 542 HB3 SER 78 3HB SER 78 27.795 0.522 2.426 543 HG SER 78 HG SER 78 29.962 1.204 1.882 544 H ILE 79 H ILE 79 25.806 -1.972 2.604 545 HA ILE 79 HA ILE 79 25.454 -3.012 -0.115 546 HB ILE 79 HB ILE 79 25.650 -5.015 1.165 547 HG12 ILE 79 2HG1 ILE 79 23.517 -4.486 -0.380 548 HG13 ILE 79 3HG1 ILE 79 23.765 -6.045 0.398 549 HG21 ILE 79 1HG2 ILE 79 25.392 -4.204 3.390 550 HG22 ILE 79 2HG2 ILE 79 23.724 -3.723 3.083 551 HG23 ILE 79 3HG2 ILE 79 24.154 -5.432 3.130 552 HD11 ILE 79 3HD1 ILE 79 22.172 -5.621 2.028 553 HD12 ILE 79 1HD1 ILE 79 22.217 -3.879 1.758 554 HD13 ILE 79 2HD1 ILE 79 21.462 -4.937 0.566 555 H GLY 80 H GLY 80 23.728 -2.179 -1.108 556 HA2 GLY 80 2HA GLY 80 21.821 -0.950 -1.459 557 HA3 GLY 80 3HA GLY 80 21.220 -1.713 0.006 558 H GLY 81 H GLY 81 21.202 -0.582 1.920 559 HA2 GLY 81 2HA GLY 81 21.945 2.268 1.685 560 HA3 GLY 81 3HA GLY 81 20.588 1.679 2.634 561 H ILE 82 H ILE 82 23.025 3.283 3.334 562 HA ILE 82 HA ILE 82 24.370 3.529 5.154 563 HB ILE 82 HB ILE 82 23.079 1.021 6.229 564 HG12 ILE 82 2HG1 ILE 82 22.234 3.907 6.573 565 HG13 ILE 82 3HG1 ILE 82 21.387 2.704 5.606 566 HG21 ILE 82 1HG2 ILE 82 25.070 1.620 7.436 567 HG22 ILE 82 2HG2 ILE 82 24.536 3.295 7.564 568 HG23 ILE 82 3HG2 ILE 82 23.664 2.024 8.420 569 HD11 ILE 82 3HD1 ILE 82 20.247 2.948 7.682 570 HD12 ILE 82 1HD1 ILE 82 21.049 1.377 7.680 571 HD13 ILE 82 2HD1 ILE 82 21.742 2.720 8.590 572 H GLN 83 H GLN 83 26.379 2.826 5.929 573 HA GLN 83 HA GLN 83 27.366 0.296 4.796 574 HB2 GLN 83 2HB GLN 83 29.486 1.362 4.261 575 HB3 GLN 83 3HB GLN 83 28.168 2.194 3.447 576 HG2 GLN 83 2HG GLN 83 28.536 3.470 5.932 577 HG3 GLN 83 3HG GLN 83 30.133 3.241 5.222 578 HE21 GLN 83 1HE2 GLN 83 30.577 5.284 4.618 579 HE22 GLN 83 2HE2 GLN 83 29.654 6.185 3.469 580 H GLY 84 H GLY 84 29.337 -0.522 5.875 581 HA2 GLY 84 2HA GLY 84 29.389 0.269 8.723 582 HA3 GLY 84 3HA GLY 84 29.465 -1.408 8.205 583 H SER 85 H SER 85 31.344 0.281 9.788 584 HA SER 85 HA SER 85 33.739 -0.292 8.184 585 HB2 SER 85 2HB SER 85 34.782 1.759 8.784 586 HB3 SER 85 3HB SER 85 33.157 2.190 8.251 587 HG SER 85 HG SER 85 32.756 1.869 10.702 588 H THR 86 H THR 86 35.346 -1.307 9.249 589 HA THR 86 HA THR 86 35.230 -1.444 12.179 590 HB THR 86 HB THR 86 34.183 -3.485 11.584 591 HG1 THR 86 HG1 THR 86 36.895 -4.269 11.841 592 HG21 THR 86 3HG2 THR 86 35.975 -4.913 9.991 593 HG22 THR 86 1HG2 THR 86 35.890 -3.311 9.259 594 HG23 THR 86 2HG2 THR 86 34.416 -4.250 9.501 595 H ASP 87 H ASP 87 37.202 -1.704 13.209 596 HA ASP 87 HA ASP 87 39.560 -1.395 11.472 597 HB2 ASP 87 2HB ASP 87 39.425 0.559 12.760 598 HB3 ASP 87 3HB ASP 87 38.906 -0.314 14.199 599 H PHE 88 H PHE 88 41.038 -2.953 11.475 600 HA PHE 88 HA PHE 88 41.113 -4.815 13.756 601 HB2 PHE 88 2HB PHE 88 41.206 -5.437 10.806 602 HB3 PHE 88 3HB PHE 88 41.768 -6.575 12.026 603 HD1 PHE 88 HD2 PHE 88 39.807 -6.318 14.142 604 HD2 PHE 88 HD1 PHE 88 39.262 -6.297 9.921 605 HE1 PHE 88 HE2 PHE 88 37.506 -7.136 14.438 606 HE2 PHE 88 HE1 PHE 88 36.959 -7.114 10.211 607 HZ PHE 88 HZ PHE 88 36.079 -7.536 12.472 608 H LYS 89 H LYS 89 42.986 -4.599 14.770 609 HA LYS 89 HA LYS 89 45.380 -3.912 13.202 610 HB2 LYS 89 2HB LYS 89 44.521 -3.315 16.002 611 HB3 LYS 89 3HB LYS 89 46.241 -3.427 15.652 612 HG2 LYS 89 2HG LYS 89 45.168 -1.805 13.642 613 HG3 LYS 89 3HG LYS 89 44.411 -1.276 15.146 614 HD2 LYS 89 2HD LYS 89 47.364 -1.743 15.039 615 HD3 LYS 89 3HD LYS 89 46.684 -0.242 14.406 616 HE2 LYS 89 2HE LYS 89 45.524 -0.821 16.959 617 HE3 LYS 89 3HE LYS 89 47.281 -0.888 17.083 618 HZ1 LYS 89 3HZ LYS 89 46.367 1.359 15.562 619 HZ2 LYS 89 1HZ LYS 89 47.432 1.308 16.875 620 HZ3 LYS 89 2HZ LYS 89 45.763 1.368 17.142 621 H VAL 90 H VAL 90 46.680 -5.562 12.783 622 HA VAL 90 HA VAL 90 46.736 -7.842 14.637 623 HB VAL 90 HB VAL 90 46.164 -8.522 12.411 624 HG11 VAL 90 1HG1 VAL 90 47.016 -6.590 11.198 625 HG12 VAL 90 2HG1 VAL 90 48.673 -7.111 11.507 626 HG13 VAL 90 3HG1 VAL 90 47.616 -8.087 10.486 627 HG21 VAL 90 3HG2 VAL 90 48.336 -9.520 13.824 628 HG22 VAL 90 1HG2 VAL 90 47.450 -10.337 12.536 629 HG23 VAL 90 2HG2 VAL 90 48.906 -9.418 12.158 630 H THR 91 H THR 91 48.471 -8.190 15.854 631 HA THR 91 HA THR 91 51.045 -7.030 15.024 632 HB THR 91 HB THR 91 51.543 -6.509 17.397 633 HG1 THR 91 HG1 THR 91 48.767 -6.995 17.828 634 HG21 THR 91 3HG2 THR 91 49.435 -5.184 15.811 635 HG22 THR 91 1HG2 THR 91 50.939 -4.536 16.464 636 HG23 THR 91 2HG2 THR 91 49.529 -4.715 17.508 637 H GLN 92 H GLN 92 52.917 -8.115 15.819 638 HA GLN 92 HA GLN 92 52.421 -10.808 16.892 639 HB2 GLN 92 2HB GLN 92 52.827 -11.105 14.541 640 HB3 GLN 92 3HB GLN 92 54.232 -10.050 14.598 641 HG2 GLN 92 2HG GLN 92 54.382 -12.333 16.416 642 HG3 GLN 92 3HG GLN 92 54.294 -12.768 14.710 643 HE21 GLN 92 1HE2 GLN 92 55.968 -12.215 13.342 644 HE22 GLN 92 2HE2 GLN 92 57.503 -11.671 13.920 Start of MODEL 6 1 H1 MET 1 H MET 1 3.564 -2.022 1.923 2 HA MET 1 HA MET 1 3.160 -2.780 -0.893 3 HB2 MET 1 2HB MET 1 2.540 -0.242 0.506 4 HB3 MET 1 3HB MET 1 3.277 -0.095 -1.083 5 HG2 MET 1 2HG MET 1 1.125 -0.139 -1.741 6 HG3 MET 1 3HG MET 1 1.392 -1.880 -1.672 7 HE1 MET 1 3HE MET 1 -1.924 0.176 -0.347 8 HE2 MET 1 1HE MET 1 -1.051 -0.243 -1.821 9 HE3 MET 1 2HE MET 1 -2.054 -1.451 -1.018 10 HA PRO 2 HA PRO 2 7.453 -2.172 -1.558 11 HB2 PRO 2 2HB PRO 2 7.512 -1.020 -4.015 12 HB3 PRO 2 3HB PRO 2 7.095 -2.718 -3.761 13 HG2 PRO 2 2HG PRO 2 5.290 -0.369 -4.187 14 HG3 PRO 2 3HG PRO 2 5.190 -1.997 -4.881 15 HD2 PRO 2 2HD PRO 2 3.664 -1.210 -2.788 16 HD3 PRO 2 3HD PRO 2 4.224 -2.883 -2.985 17 H ALA 3 H ALA 3 9.135 -0.659 -1.513 18 HA ALA 3 HA ALA 3 8.695 2.141 -1.854 19 HB1 ALA 3 1HB ALA 3 7.857 1.227 0.581 20 HB2 ALA 3 2HB ALA 3 9.510 1.740 0.924 21 HB3 ALA 3 3HB ALA 3 8.359 2.882 0.231 22 H ALA 4 H ALA 4 10.704 3.323 -0.668 23 HA ALA 4 HA ALA 4 13.095 1.695 -1.231 24 HB1 ALA 4 1HB ALA 4 13.352 4.569 -1.759 25 HB2 ALA 4 2HB ALA 4 13.929 3.185 -2.688 26 HB3 ALA 4 3HB ALA 4 12.253 3.714 -2.842 27 H LEU 5 H LEU 5 14.565 1.666 0.344 28 HA LEU 5 HA LEU 5 15.219 3.860 1.989 29 HB2 LEU 5 2HB LEU 5 12.888 2.851 2.808 30 HB3 LEU 5 3HB LEU 5 13.973 1.759 3.667 31 HG LEU 5 HG LEU 5 14.951 4.324 4.191 32 HD11 LEU 5 1HD1 LEU 5 12.911 5.324 3.384 33 HD12 LEU 5 2HD1 LEU 5 12.974 5.454 5.141 34 HD13 LEU 5 3HD1 LEU 5 11.944 4.239 4.383 35 HD21 LEU 5 3HD2 LEU 5 13.111 2.832 6.027 36 HD22 LEU 5 1HD2 LEU 5 14.563 3.756 6.413 37 HD23 LEU 5 2HD2 LEU 5 14.702 2.191 5.613 38 H VAL 6 H VAL 6 15.110 0.347 1.676 39 HA VAL 6 HA VAL 6 16.593 -1.274 2.397 40 HB VAL 6 HB VAL 6 17.501 -0.803 0.258 41 HG11 VAL 6 1HG1 VAL 6 19.100 1.027 -0.144 42 HG12 VAL 6 2HG1 VAL 6 17.517 1.619 0.364 43 HG13 VAL 6 3HG1 VAL 6 18.857 1.583 1.511 44 HG21 VAL 6 3HG2 VAL 6 19.983 -0.524 1.882 45 HG22 VAL 6 1HG2 VAL 6 18.962 -1.941 2.125 46 HG23 VAL 6 2HG2 VAL 6 19.634 -1.602 0.530 47 H SER 7 H SER 7 16.455 -0.896 4.675 48 HA SER 7 HA SER 7 18.637 0.684 5.835 49 HB2 SER 7 2HB SER 7 15.949 0.427 6.539 50 HB3 SER 7 3HB SER 7 16.813 -0.508 7.759 51 HG SER 7 HG SER 7 17.595 1.275 8.557 52 H ILE 8 H ILE 8 20.380 -0.275 6.638 53 HA ILE 8 HA ILE 8 20.199 -3.095 7.455 54 HB ILE 8 HB ILE 8 22.601 -1.957 6.036 55 HG12 ILE 8 2HG1 ILE 8 21.582 -3.649 4.216 56 HG13 ILE 8 3HG1 ILE 8 20.081 -3.102 4.955 57 HG21 ILE 8 1HG2 ILE 8 22.187 -4.800 5.842 58 HG22 ILE 8 2HG2 ILE 8 23.568 -3.908 6.477 59 HG23 ILE 8 3HG2 ILE 8 22.202 -4.281 7.528 60 HD11 ILE 8 3HD1 ILE 8 20.246 -1.041 4.074 61 HD12 ILE 8 1HD1 ILE 8 22.002 -0.993 4.232 62 HD13 ILE 8 2HD1 ILE 8 21.261 -1.870 2.893 63 H SER 9 H SER 9 21.320 -3.659 9.266 64 HA SER 9 HA SER 9 22.749 -1.482 10.645 65 HB2 SER 9 2HB SER 9 20.602 -3.189 11.510 66 HB3 SER 9 3HB SER 9 22.017 -3.463 12.525 67 HG SER 9 HG SER 9 20.364 -1.574 12.867 68 H VAL 10 H VAL 10 24.870 -1.795 10.503 69 HA VAL 10 HA VAL 10 25.920 -4.538 10.607 70 HB VAL 10 HB VAL 10 26.589 -3.202 8.648 71 HG11 VAL 10 1HG1 VAL 10 28.422 -1.482 10.159 72 HG12 VAL 10 2HG1 VAL 10 27.427 -1.121 8.747 73 HG13 VAL 10 3HG1 VAL 10 26.714 -1.094 10.361 74 HG21 VAL 10 3HG2 VAL 10 29.206 -3.287 9.779 75 HG22 VAL 10 1HG2 VAL 10 28.269 -4.644 10.404 76 HG23 VAL 10 2HG2 VAL 10 28.446 -4.421 8.664 77 H SER 11 H SER 11 27.185 -5.210 12.240 78 HA SER 11 HA SER 11 27.902 -3.228 14.301 79 HB2 SER 11 2HB SER 11 27.020 -6.100 14.534 80 HB3 SER 11 3HB SER 11 27.890 -5.296 15.840 81 HG SER 11 HG SER 11 26.111 -4.322 16.357 82 HA PRO 12 HA PRO 12 31.830 -5.007 12.548 83 HB2 PRO 12 2HB PRO 12 33.083 -2.613 12.292 84 HB3 PRO 12 3HB PRO 12 32.040 -3.290 11.036 85 HG2 PRO 12 2HG PRO 12 31.414 -1.218 13.104 86 HG3 PRO 12 3HG PRO 12 30.982 -1.249 11.385 87 HD2 PRO 12 2HD PRO 12 29.237 -1.933 13.339 88 HD3 PRO 12 3HD PRO 12 29.207 -2.679 11.728 89 H THR 13 H THR 13 33.846 -5.176 13.582 90 HA THR 13 HA THR 13 33.919 -4.072 16.315 91 HB THR 13 HB THR 13 35.561 -6.461 15.711 92 HG1 THR 13 HG1 THR 13 33.570 -7.747 16.158 93 HG21 THR 13 3HG2 THR 13 33.907 -6.726 18.001 94 HG22 THR 13 1HG2 THR 13 34.531 -5.077 17.978 95 HG23 THR 13 2HG2 THR 13 35.646 -6.443 17.936 96 H ASN 14 H ASN 14 35.366 -2.494 16.475 97 HA ASN 14 HA ASN 14 37.742 -2.538 14.763 98 HB2 ASN 14 2HB ASN 14 38.019 -0.171 15.502 99 HB3 ASN 14 3HB ASN 14 36.490 -0.472 14.683 100 HD21 ASN 14 1HD2 ASN 14 37.833 1.103 17.179 101 HD22 ASN 14 2HD2 ASN 14 36.478 1.201 18.247 102 H SER 15 H SER 15 39.304 -3.736 15.679 103 HA SER 15 HA SER 15 40.557 -2.795 18.070 104 HB2 SER 15 2HB SER 15 38.526 -4.602 18.525 105 HB3 SER 15 3HB SER 15 39.953 -5.636 18.465 106 HG SER 15 HG SER 15 39.189 -3.807 20.356 107 H THR 16 H THR 16 42.130 -4.902 18.746 108 HA THR 16 HA THR 16 43.652 -5.341 16.271 109 HB THR 16 HB THR 16 45.620 -5.605 17.617 110 HG1 THR 16 HG1 THR 16 44.125 -5.180 19.982 111 HG21 THR 16 3HG2 THR 16 44.121 -3.247 17.537 112 HG22 THR 16 1HG2 THR 16 45.848 -3.398 17.854 113 HG23 THR 16 2HG2 THR 16 44.704 -3.370 19.196 114 H VAL 17 H VAL 17 44.535 -7.377 15.794 115 HA VAL 17 HA VAL 17 43.533 -9.641 17.375 116 HB VAL 17 HB VAL 17 42.049 -9.249 15.391 117 HG11 VAL 17 1HG1 VAL 17 44.090 -8.561 13.961 118 HG12 VAL 17 2HG1 VAL 17 44.279 -10.294 13.689 119 HG13 VAL 17 3HG1 VAL 17 42.790 -9.482 13.204 120 HG21 VAL 17 3HG2 VAL 17 41.874 -11.558 14.821 121 HG22 VAL 17 1HG2 VAL 17 43.564 -11.848 15.237 122 HG23 VAL 17 2HG2 VAL 17 42.396 -11.471 16.504 123 H ALA 18 H ALA 18 44.724 -11.607 17.101 124 HA ALA 18 HA ALA 18 47.527 -11.193 16.870 125 HB1 ALA 18 1HB ALA 18 47.778 -13.424 17.531 126 HB2 ALA 18 2HB ALA 18 46.302 -12.890 18.335 127 HB3 ALA 18 3HB ALA 18 46.204 -13.887 16.883 128 H LYS 19 H LYS 19 48.963 -12.431 15.445 129 HA LYS 19 HA LYS 19 48.528 -11.953 12.764 130 HB2 LYS 19 2HB LYS 19 50.434 -13.386 12.319 131 HB3 LYS 19 3HB LYS 19 50.736 -12.430 13.764 132 HG2 LYS 19 2HG LYS 19 51.338 -14.351 14.711 133 HG3 LYS 19 3HG LYS 19 49.612 -14.715 14.781 134 HD2 LYS 19 2HD LYS 19 50.230 -16.568 13.649 135 HD3 LYS 19 3HD LYS 19 50.166 -15.487 12.255 136 HE2 LYS 19 2HE LYS 19 52.666 -15.871 13.879 137 HE3 LYS 19 3HE LYS 19 52.255 -16.922 12.525 138 HZ1 LYS 19 3HZ LYS 19 52.930 -14.053 12.495 139 HZ2 LYS 19 1HZ LYS 19 52.027 -14.731 11.236 140 HZ3 LYS 19 2HZ LYS 19 53.581 -15.309 11.567 141 H GLY 20 H GLY 20 47.589 -13.009 11.097 142 HA2 GLY 20 2HA GLY 20 46.167 -14.472 10.040 143 HA3 GLY 20 3HA GLY 20 47.120 -15.720 10.829 144 H LEU 21 H LEU 21 44.229 -13.764 11.009 145 HA LEU 21 HA LEU 21 42.981 -15.794 12.668 146 HB2 LEU 21 2HB LEU 21 44.050 -13.603 13.909 147 HB3 LEU 21 3HB LEU 21 42.385 -13.096 13.635 148 HG LEU 21 HG LEU 21 42.526 -15.762 14.768 149 HD11 LEU 21 1HD1 LEU 21 43.132 -14.399 17.052 150 HD12 LEU 21 2HD1 LEU 21 44.266 -13.701 15.896 151 HD13 LEU 21 3HD1 LEU 21 44.242 -15.444 16.165 152 HD21 LEU 21 3HD2 LEU 21 40.733 -13.731 14.657 153 HD22 LEU 21 1HD2 LEU 21 41.364 -13.538 16.293 154 HD23 LEU 21 2HD2 LEU 21 40.652 -15.074 15.799 155 H GLN 22 H GLN 22 40.595 -15.256 12.986 156 HA GLN 22 HA GLN 22 39.562 -13.834 10.623 157 HB2 GLN 22 2HB GLN 22 39.402 -16.280 10.336 158 HB3 GLN 22 3HB GLN 22 38.466 -16.384 11.821 159 HG2 GLN 22 2HG GLN 22 36.819 -14.800 10.696 160 HG3 GLN 22 3HG GLN 22 37.678 -15.165 9.200 161 HE21 GLN 22 1HE2 GLN 22 37.542 -17.224 8.322 162 HE22 GLN 22 2HE2 GLN 22 36.338 -18.360 8.816 163 H GLU 23 H GLU 23 37.763 -12.575 10.897 164 HA GLU 23 HA GLU 23 36.728 -12.364 13.649 165 HB2 GLU 23 2HB GLU 23 38.114 -10.422 12.266 166 HB3 GLU 23 3HB GLU 23 36.437 -9.968 11.995 167 HG2 GLU 23 2HG GLU 23 36.616 -8.893 13.936 168 HG3 GLU 23 3HG GLU 23 36.440 -10.488 14.666 169 H ASN 24 H ASN 24 34.556 -12.299 13.936 170 HA ASN 24 HA ASN 24 32.912 -12.711 11.540 171 HB2 ASN 24 2HB ASN 24 31.243 -13.672 13.087 172 HB3 ASN 24 3HB ASN 24 32.793 -14.502 13.192 173 HD21 ASN 24 1HD2 ASN 24 30.338 -13.541 14.996 174 HD22 ASN 24 2HD2 ASN 24 31.140 -13.187 16.485 175 H PHE 25 H PHE 25 31.175 -11.438 11.070 176 HA PHE 25 HA PHE 25 30.657 -9.165 12.870 177 HB2 PHE 25 2HB PHE 25 30.565 -9.017 9.855 178 HB3 PHE 25 3HB PHE 25 30.446 -7.683 10.997 179 HD1 PHE 25 HD2 PHE 25 32.596 -7.873 12.772 180 HD2 PHE 25 HD1 PHE 25 32.509 -8.962 8.658 181 HE1 PHE 25 HE2 PHE 25 35.030 -7.540 12.636 182 HE2 PHE 25 HE1 PHE 25 34.943 -8.630 8.515 183 HZ PHE 25 HZ PHE 25 36.207 -7.917 10.505 184 H LYS 26 H LYS 26 28.565 -7.998 11.595 185 HA LYS 26 HA LYS 26 26.560 -10.055 11.085 186 HB2 LYS 26 2HB LYS 26 26.823 -8.890 13.612 187 HB3 LYS 26 3HB LYS 26 25.476 -8.040 12.866 188 HG2 LYS 26 2HG LYS 26 24.313 -10.109 12.486 189 HG3 LYS 26 3HG LYS 26 25.697 -11.036 13.070 190 HD2 LYS 26 2HD LYS 26 25.437 -9.915 15.277 191 HD3 LYS 26 3HD LYS 26 23.965 -9.153 14.669 192 HE2 LYS 26 2HE LYS 26 22.768 -11.077 14.769 193 HE3 LYS 26 3HE LYS 26 24.157 -12.088 14.372 194 HZ1 LYS 26 3HZ LYS 26 23.224 -12.259 16.709 195 HZ2 LYS 26 1HZ LYS 26 23.918 -10.743 16.993 196 HZ3 LYS 26 2HZ LYS 26 24.897 -12.055 16.570 197 H ALA 27 H ALA 27 25.292 -9.478 9.446 198 HA ALA 27 HA ALA 27 24.775 -6.634 8.959 199 HB1 ALA 27 1HB ALA 27 25.650 -8.537 6.791 200 HB2 ALA 27 2HB ALA 27 25.267 -6.825 6.607 201 HB3 ALA 27 3HB ALA 27 26.681 -7.317 7.539 202 H THR 28 H THR 28 22.650 -6.376 8.936 203 HA THR 28 HA THR 28 20.979 -8.531 7.812 204 HB THR 28 HB THR 28 19.179 -7.837 9.305 205 HG1 THR 28 HG1 THR 28 21.085 -5.951 10.278 206 HG21 THR 28 3HG2 THR 28 20.099 -9.405 10.607 207 HG22 THR 28 1HG2 THR 28 20.835 -8.085 11.515 208 HG23 THR 28 2HG2 THR 28 21.734 -8.872 10.218 209 H GLY 29 H GLY 29 20.354 -7.933 5.833 210 HA2 GLY 29 2HA GLY 29 19.936 -5.128 5.195 211 HA3 GLY 29 3HA GLY 29 19.876 -6.476 4.069 212 H ILE 30 H ILE 30 18.043 -4.114 5.128 213 HA ILE 30 HA ILE 30 15.589 -5.741 5.057 214 HB ILE 30 HB ILE 30 15.959 -3.214 6.668 215 HG12 ILE 30 2HG1 ILE 30 15.300 -5.487 8.264 216 HG13 ILE 30 3HG1 ILE 30 16.691 -5.902 7.269 217 HG21 ILE 30 1HG2 ILE 30 13.743 -4.058 7.655 218 HG22 ILE 30 2HG2 ILE 30 13.709 -3.295 6.066 219 HG23 ILE 30 3HG2 ILE 30 13.638 -5.052 6.201 220 HD11 ILE 30 3HD1 ILE 30 16.574 -3.391 8.905 221 HD12 ILE 30 1HD1 ILE 30 17.170 -4.923 9.544 222 HD13 ILE 30 2HD1 ILE 30 17.983 -4.161 8.176 223 H PHE 31 H PHE 31 14.531 -5.341 3.239 224 HA PHE 31 HA PHE 31 14.466 -2.574 2.232 225 HB2 PHE 31 2HB PHE 31 14.185 -4.848 0.323 226 HB3 PHE 31 3HB PHE 31 14.844 -3.237 0.059 227 HD1 PHE 31 HD2 PHE 31 15.552 -6.614 1.283 228 HD2 PHE 31 HD1 PHE 31 17.153 -2.749 0.501 229 HE1 PHE 31 HE2 PHE 31 17.830 -7.516 1.506 230 HE2 PHE 31 HE1 PHE 31 19.434 -3.645 0.721 231 HZ PHE 31 HZ PHE 31 19.775 -6.031 1.225 232 H THR 32 H THR 32 12.509 -1.751 1.765 233 HA THR 32 HA THR 32 10.174 -3.122 2.627 234 HB THR 32 HB THR 32 9.989 -0.708 0.871 235 HG1 THR 32 HG1 THR 32 10.601 -0.406 3.606 236 HG21 THR 32 3HG2 THR 32 8.628 -1.426 3.468 237 HG22 THR 32 1HG2 THR 32 7.979 -1.788 1.869 238 HG23 THR 32 2HG2 THR 32 8.200 -0.112 2.373 239 H ASP 33 H ASP 33 11.805 -2.868 -0.399 240 HA ASP 33 HA ASP 33 9.489 -4.036 -1.791 241 HB2 ASP 33 2HB ASP 33 10.278 -3.138 -3.806 242 HB3 ASP 33 3HB ASP 33 10.609 -1.867 -2.632 243 H ASN 34 H ASN 34 11.563 -5.363 -0.047 244 HA ASN 34 HA ASN 34 12.002 -7.631 -1.772 245 HB2 ASN 34 2HB ASN 34 14.081 -5.726 -1.469 246 HB3 ASN 34 3HB ASN 34 14.543 -7.146 -0.535 247 HD21 ASN 34 1HD2 ASN 34 15.447 -8.773 -1.581 248 HD22 ASN 34 2HD2 ASN 34 15.447 -8.995 -3.294 249 H SER 35 H SER 35 13.509 -6.433 1.229 250 HA SER 35 HA SER 35 13.512 -7.238 3.358 251 HB2 SER 35 2HB SER 35 10.961 -7.229 2.858 252 HB3 SER 35 3HB SER 35 11.143 -8.978 2.720 253 HG SER 35 HG SER 35 11.360 -9.115 4.811 254 H ASN 36 H ASN 36 15.432 -8.341 2.165 255 HA ASN 36 HA ASN 36 15.231 -11.221 2.720 256 HB2 ASN 36 2HB ASN 36 16.223 -9.866 0.251 257 HB3 ASN 36 3HB ASN 36 17.036 -11.336 0.780 258 HD21 ASN 36 1HD2 ASN 36 16.345 -12.990 -0.351 259 HD22 ASN 36 2HD2 ASN 36 14.706 -13.310 -0.796 260 H SER 37 H SER 37 17.454 -12.225 2.944 261 HA SER 37 HA SER 37 18.976 -10.610 4.796 262 HB2 SER 37 2HB SER 37 19.639 -13.415 3.902 263 HB3 SER 37 3HB SER 37 20.087 -12.620 5.411 264 HG SER 37 HG SER 37 18.269 -13.260 6.225 265 H ASP 38 H ASP 38 21.381 -10.603 4.682 266 HA ASP 38 HA ASP 38 22.256 -9.430 2.282 267 HB2 ASP 38 2HB ASP 38 23.578 -10.314 4.809 268 HB3 ASP 38 3HB ASP 38 24.596 -9.935 3.421 269 H ILE 39 H ILE 39 22.292 -10.576 0.443 270 HA ILE 39 HA ILE 39 24.285 -12.443 -0.091 271 HB ILE 39 HB ILE 39 23.175 -14.075 1.222 272 HG12 ILE 39 2HG1 ILE 39 23.762 -14.509 -1.363 273 HG13 ILE 39 3HG1 ILE 39 23.134 -15.769 -0.306 274 HG21 ILE 39 1HG2 ILE 39 20.777 -14.673 0.796 275 HG22 ILE 39 2HG2 ILE 39 21.032 -13.088 1.525 276 HG23 ILE 39 3HG2 ILE 39 20.661 -13.219 -0.194 277 HD11 ILE 39 3HD1 ILE 39 21.289 -14.057 -1.918 278 HD12 ILE 39 1HD1 ILE 39 22.085 -15.462 -2.625 279 HD13 ILE 39 2HD1 ILE 39 21.014 -15.660 -1.237 280 H THR 40 H THR 40 21.036 -11.336 -0.864 281 HA THR 40 HA THR 40 21.041 -12.104 -3.587 282 HB THR 40 HB THR 40 19.520 -9.734 -2.521 283 HG1 THR 40 HG1 THR 40 19.161 -12.484 -1.996 284 HG21 THR 40 3HG2 THR 40 18.381 -9.873 -4.435 285 HG22 THR 40 1HG2 THR 40 18.102 -11.599 -4.213 286 HG23 THR 40 2HG2 THR 40 19.583 -11.037 -4.990 287 H ASP 41 H ASP 41 21.901 -9.078 -1.950 288 HA ASP 41 HA ASP 41 22.786 -7.931 -4.487 289 HB2 ASP 41 2HB ASP 41 21.934 -6.873 -1.892 290 HB3 ASP 41 3HB ASP 41 23.358 -6.065 -2.543 291 H GLN 42 H GLN 42 24.036 -9.551 -1.761 292 HA GLN 42 HA GLN 42 26.140 -10.070 -1.068 293 HB2 GLN 42 2HB GLN 42 26.200 -10.709 -3.551 294 HB3 GLN 42 3HB GLN 42 27.105 -9.220 -3.790 295 HG2 GLN 42 2HG GLN 42 28.721 -10.082 -2.046 296 HG3 GLN 42 3HG GLN 42 27.894 -11.632 -2.189 297 HE21 GLN 42 1HE2 GLN 42 30.127 -9.452 -3.600 298 HE22 GLN 42 2HE2 GLN 42 30.565 -10.426 -4.959 299 H VAL 43 H VAL 43 26.449 -8.489 0.468 300 HA VAL 43 HA VAL 43 26.989 -5.813 0.114 301 HB VAL 43 HB VAL 43 28.120 -7.633 2.244 302 HG11 VAL 43 1HG1 VAL 43 29.420 -5.673 2.313 303 HG12 VAL 43 2HG1 VAL 43 28.023 -4.638 2.011 304 HG13 VAL 43 3HG1 VAL 43 28.193 -5.462 3.561 305 HG21 VAL 43 3HG2 VAL 43 25.476 -6.591 1.736 306 HG22 VAL 43 1HG2 VAL 43 26.010 -7.764 2.939 307 HG23 VAL 43 2HG2 VAL 43 26.089 -6.038 3.294 308 H THR 44 H THR 44 28.771 -4.573 -0.274 309 HA THR 44 HA THR 44 31.076 -5.967 -1.409 310 HB THR 44 HB THR 44 31.548 -3.286 -1.805 311 HG1 THR 44 HG1 THR 44 29.651 -2.408 -1.329 312 HG21 THR 44 3HG2 THR 44 29.871 -4.903 -3.703 313 HG22 THR 44 1HG2 THR 44 31.560 -5.303 -3.395 314 HG23 THR 44 2HG2 THR 44 31.135 -3.730 -4.071 315 H TRP 45 H TRP 45 32.706 -6.381 -0.074 316 HA TRP 45 HA TRP 45 33.299 -4.459 2.074 317 HB2 TRP 45 2HB TRP 45 32.976 -7.234 2.159 318 HB3 TRP 45 3HB TRP 45 34.715 -6.982 2.279 319 HD1 TRP 45 HD1 TRP 45 35.160 -4.718 4.175 320 HE1 TRP 45 HE1 TRP 45 34.290 -4.696 6.598 321 HE3 TRP 45 HE3 TRP 45 31.403 -8.155 3.720 322 HZ2 TRP 45 HZ2 TRP 45 32.278 -5.968 8.115 323 HZ3 TRP 45 HZ3 TRP 45 30.053 -8.696 5.704 324 HH2 TRP 45 HH2 TRP 45 30.484 -7.625 7.855 325 H ASP 46 H ASP 46 35.432 -3.794 2.444 326 HA ASP 46 HA ASP 46 37.399 -4.469 0.374 327 HB2 ASP 46 2HB ASP 46 36.063 -1.948 0.650 328 HB3 ASP 46 3HB ASP 46 37.771 -1.735 1.023 329 H SER 47 H SER 47 39.540 -4.407 1.025 330 HA SER 47 HA SER 47 40.013 -3.839 3.876 331 HB2 SER 47 2HB SER 47 40.068 -6.367 2.708 332 HB3 SER 47 3HB SER 47 41.766 -5.902 2.806 333 HG SER 47 HG SER 47 39.918 -6.360 4.844 334 H SER 48 H SER 48 42.107 -3.118 4.428 335 HA SER 48 HA SER 48 43.253 -1.235 2.795 336 HB2 SER 48 2HB SER 48 43.867 -2.435 5.322 337 HB3 SER 48 3HB SER 48 45.357 -2.283 4.390 338 HG SER 48 HG SER 48 43.626 -0.099 4.415 339 H ASN 49 H ASN 49 43.901 -4.674 2.931 340 HA ASN 49 HA ASN 49 45.225 -6.052 1.690 341 HB2 ASN 49 2HB ASN 49 43.630 -4.843 -0.019 342 HB3 ASN 49 3HB ASN 49 45.124 -4.090 -0.570 343 HD21 ASN 49 1HD2 ASN 49 43.893 -7.300 0.311 344 HD22 ASN 49 2HD2 ASN 49 44.660 -8.138 -0.991 345 H THR 50 H THR 50 46.544 -3.959 3.259 346 HA THR 50 HA THR 50 48.682 -2.771 1.903 347 HB THR 50 HB THR 50 47.980 -2.236 4.247 348 HG1 THR 50 HG1 THR 50 50.148 -1.850 4.922 349 HG21 THR 50 3HG2 THR 50 49.750 -4.379 5.282 350 HG22 THR 50 1HG2 THR 50 48.132 -4.853 4.767 351 HG23 THR 50 2HG2 THR 50 48.335 -3.626 6.017 352 H ASP 51 H ASP 51 48.151 -6.043 2.844 353 HA ASP 51 HA ASP 51 50.588 -6.859 1.532 354 HB2 ASP 51 2HB ASP 51 50.748 -6.440 4.260 355 HB3 ASP 51 3HB ASP 51 50.440 -8.171 4.140 356 H ILE 52 H ILE 52 48.300 -8.252 3.892 357 HA ILE 52 HA ILE 52 47.292 -10.046 1.821 358 HB ILE 52 HB ILE 52 48.377 -11.051 4.455 359 HG12 ILE 52 2HG1 ILE 52 49.730 -12.462 2.657 360 HG13 ILE 52 3HG1 ILE 52 49.406 -11.053 1.652 361 HG21 ILE 52 1HG2 ILE 52 46.641 -12.491 4.115 362 HG22 ILE 52 2HG2 ILE 52 46.651 -12.267 2.367 363 HG23 ILE 52 3HG2 ILE 52 47.871 -13.286 3.132 364 HD11 ILE 52 3HD1 ILE 52 51.034 -9.924 2.628 365 HD12 ILE 52 1HD1 ILE 52 50.355 -10.228 4.227 366 HD13 ILE 52 2HD1 ILE 52 51.464 -11.393 3.503 367 H LEU 53 H LEU 53 45.379 -8.795 2.020 368 HA LEU 53 HA LEU 53 43.813 -9.451 4.424 369 HB2 LEU 53 2HB LEU 53 43.863 -6.853 2.900 370 HB3 LEU 53 3HB LEU 53 42.646 -7.264 4.107 371 HG LEU 53 HG LEU 53 44.183 -5.853 5.194 372 HD11 LEU 53 1HD1 LEU 53 44.654 -7.110 7.022 373 HD12 LEU 53 2HD1 LEU 53 45.381 -8.411 6.081 374 HD13 LEU 53 3HD1 LEU 53 43.626 -8.265 6.172 375 HD21 LEU 53 3HD2 LEU 53 46.021 -6.854 3.336 376 HD22 LEU 53 1HD2 LEU 53 46.652 -7.299 4.922 377 HD23 LEU 53 2HD2 LEU 53 46.296 -5.610 4.557 378 H SER 54 H SER 54 41.973 -10.485 4.018 379 HA SER 54 HA SER 54 40.668 -10.127 1.416 380 HB2 SER 54 2HB SER 54 41.914 -12.580 2.432 381 HB3 SER 54 3HB SER 54 40.242 -12.800 1.918 382 HG SER 54 HG SER 54 42.213 -12.863 0.344 383 H ILE 55 H ILE 55 38.460 -10.225 1.453 384 HA ILE 55 HA ILE 55 37.225 -10.613 4.102 385 HB ILE 55 HB ILE 55 35.948 -8.970 1.946 386 HG12 ILE 55 2HG1 ILE 55 37.062 -7.076 3.540 387 HG13 ILE 55 3HG1 ILE 55 38.332 -8.295 3.558 388 HG21 ILE 55 1HG2 ILE 55 35.535 -7.915 4.512 389 HG22 ILE 55 2HG2 ILE 55 34.383 -8.795 3.509 390 HG23 ILE 55 3HG2 ILE 55 35.386 -9.665 4.669 391 HD11 ILE 55 3HD1 ILE 55 38.888 -7.934 1.411 392 HD12 ILE 55 1HD1 ILE 55 37.222 -7.637 0.914 393 HD13 ILE 55 2HD1 ILE 55 38.144 -6.364 1.713 394 H SER 56 H SER 56 35.655 -12.086 4.296 395 HA SER 56 HA SER 56 34.500 -13.214 1.830 396 HB2 SER 56 2HB SER 56 35.647 -14.586 4.231 397 HB3 SER 56 3HB SER 56 34.321 -15.354 3.358 398 HG SER 56 HG SER 56 35.652 -15.838 1.809 399 H ASN 57 H ASN 57 32.436 -12.638 1.735 400 HA ASN 57 HA ASN 57 30.897 -12.425 4.228 401 HB2 ASN 57 2HB ASN 57 29.224 -11.253 2.632 402 HB3 ASN 57 3HB ASN 57 30.688 -10.390 3.095 403 HD21 ASN 57 1HD2 ASN 57 28.885 -11.767 0.539 404 HD22 ASN 57 2HD2 ASN 57 29.950 -11.333 -0.749 405 H ALA 58 H ALA 58 29.732 -14.153 4.725 406 HA ALA 58 HA ALA 58 29.071 -16.180 2.829 407 HB1 ALA 58 1HB ALA 58 27.881 -15.901 5.575 408 HB2 ALA 58 2HB ALA 58 28.140 -17.371 4.636 409 HB3 ALA 58 3HB ALA 58 29.518 -16.499 5.306 410 H SER 59 H SER 59 26.707 -17.034 2.849 411 HA SER 59 HA SER 59 25.086 -14.944 1.713 412 HB2 SER 59 2HB SER 59 23.426 -16.955 1.518 413 HB3 SER 59 3HB SER 59 24.878 -16.933 0.518 414 HG SER 59 HG SER 59 24.718 -18.943 1.470 415 H ASP 60 H ASP 60 25.208 -16.742 4.695 416 HA ASP 60 HA ASP 60 22.638 -16.349 5.673 417 HB2 ASP 60 2HB ASP 60 25.296 -16.873 6.857 418 HB3 ASP 60 3HB ASP 60 24.104 -16.169 7.947 419 H SER 61 H SER 61 25.392 -14.478 6.916 420 HA SER 61 HA SER 61 24.456 -11.931 6.270 421 HB2 SER 61 2HB SER 61 22.652 -11.804 7.637 422 HB3 SER 61 3HB SER 61 23.192 -13.154 8.635 423 HG SER 61 HG SER 61 23.917 -11.757 10.011 424 H HIS 62 H HIS 62 25.837 -13.670 9.057 425 HA HIS 62 HA HIS 62 27.652 -11.653 9.797 426 HB2 HIS 62 2HB HIS 62 28.758 -13.379 11.127 427 HB3 HIS 62 3HB HIS 62 27.009 -13.504 11.289 428 HD1 HIS 62 HD1 HIS 62 29.990 -15.331 10.028 429 HD2 HIS 62 HD2 HIS 62 25.864 -15.805 10.115 430 HE1 HIS 62 HE1 HIS 62 29.576 -17.728 9.391 431 H GLY 63 H GLY 63 29.516 -11.006 8.933 432 HA2 GLY 63 2HA GLY 63 30.598 -12.531 6.678 433 HA3 GLY 63 3HA GLY 63 30.964 -10.856 7.064 434 H LEU 64 H LEU 64 32.688 -13.257 6.547 435 HA LEU 64 HA LEU 64 34.191 -13.255 9.079 436 HB2 LEU 64 2HB LEU 64 35.273 -15.328 8.138 437 HB3 LEU 64 3HB LEU 64 33.578 -15.471 8.597 438 HG LEU 64 HG LEU 64 34.246 -14.886 5.751 439 HD11 LEU 64 1HD1 LEU 64 34.169 -17.713 6.724 440 HD12 LEU 64 2HD1 LEU 64 35.687 -16.816 6.699 441 HD13 LEU 64 3HD1 LEU 64 34.787 -17.067 5.203 442 HD21 LEU 64 3HD2 LEU 64 32.112 -15.448 5.404 443 HD22 LEU 64 1HD2 LEU 64 31.922 -15.301 7.151 444 HD23 LEU 64 2HD2 LEU 64 32.229 -16.880 6.427 445 H ALA 65 H ALA 65 35.785 -11.814 9.001 446 HA ALA 65 HA ALA 65 37.147 -11.294 6.464 447 HB1 ALA 65 1HB ALA 65 38.263 -9.489 8.029 448 HB2 ALA 65 2HB ALA 65 36.655 -9.243 7.345 449 HB3 ALA 65 3HB ALA 65 36.830 -9.793 9.012 450 H SER 66 H SER 66 39.165 -11.952 6.050 451 HA SER 66 HA SER 66 40.680 -13.195 8.252 452 HB2 SER 66 2HB SER 66 39.833 -14.698 6.364 453 HB3 SER 66 3HB SER 66 41.002 -13.877 5.329 454 HG SER 66 HG SER 66 41.847 -14.954 7.779 455 H THR 67 H THR 67 42.613 -12.376 8.725 456 HA THR 67 HA THR 67 43.953 -10.675 6.729 457 HB THR 67 HB THR 67 43.057 -9.093 8.239 458 HG1 THR 67 HG1 THR 67 45.568 -9.295 7.927 459 HG21 THR 67 3HG2 THR 67 42.311 -10.398 10.059 460 HG22 THR 67 1HG2 THR 67 43.528 -9.315 10.734 461 HG23 THR 67 2HG2 THR 67 43.934 -10.998 10.397 462 H LEU 68 H LEU 68 46.203 -10.703 6.739 463 HA LEU 68 HA LEU 68 47.654 -12.227 8.709 464 HB2 LEU 68 2HB LEU 68 46.737 -13.952 7.171 465 HB3 LEU 68 3HB LEU 68 47.619 -13.186 5.852 466 HG LEU 68 HG LEU 68 49.626 -13.649 7.626 467 HD11 LEU 68 1HD1 LEU 68 49.016 -16.237 8.030 468 HD12 LEU 68 2HD1 LEU 68 47.424 -15.508 8.236 469 HD13 LEU 68 3HD1 LEU 68 48.774 -14.973 9.236 470 HD21 LEU 68 3HD2 LEU 68 49.463 -14.170 5.175 471 HD22 LEU 68 1HD2 LEU 68 48.663 -15.678 5.620 472 HD23 LEU 68 2HD2 LEU 68 50.320 -15.371 6.141 473 H ASN 69 H ASN 69 48.053 -9.674 8.370 474 HA ASN 69 HA ASN 69 50.496 -9.485 6.733 475 HB2 ASN 69 2HB ASN 69 49.974 -7.292 6.071 476 HB3 ASN 69 3HB ASN 69 48.444 -8.153 5.927 477 HD21 ASN 69 1HD2 ASN 69 47.092 -8.082 7.977 478 HD22 ASN 69 2HD2 ASN 69 46.983 -6.548 8.764 479 H GLN 70 H GLN 70 51.821 -7.475 7.497 480 HA GLN 70 HA GLN 70 51.988 -7.620 10.434 481 HB2 GLN 70 2HB GLN 70 54.405 -6.968 10.078 482 HB3 GLN 70 3HB GLN 70 53.958 -8.574 9.517 483 HG2 GLN 70 2HG GLN 70 54.523 -8.105 7.423 484 HG3 GLN 70 3HG GLN 70 53.646 -6.576 7.445 485 HE21 GLN 70 1HE2 GLN 70 56.594 -7.902 7.035 486 HE22 GLN 70 2HE2 GLN 70 57.593 -6.561 7.473 487 H GLY 71 H GLY 71 50.811 -5.873 11.071 488 HA2 GLY 71 2HA GLY 71 51.690 -3.443 11.510 489 HA3 GLY 71 3HA GLY 71 51.327 -3.285 9.797 490 H ASN 72 H ASN 72 49.542 -2.105 9.606 491 HA ASN 72 HA ASN 72 47.193 -2.900 11.186 492 HB2 ASN 72 2HB ASN 72 46.545 -0.557 11.434 493 HB3 ASN 72 3HB ASN 72 48.136 -0.830 12.139 494 HD21 ASN 72 1HD2 ASN 72 49.910 0.143 11.256 495 HD22 ASN 72 2HD2 ASN 72 49.815 1.341 10.015 496 H VAL 73 H VAL 73 45.268 -2.939 10.108 497 HA VAL 73 HA VAL 73 45.220 -1.967 7.337 498 HB VAL 73 HB VAL 73 43.944 -4.026 6.691 499 HG11 VAL 73 1HG1 VAL 73 46.110 -4.009 5.878 500 HG12 VAL 73 2HG1 VAL 73 46.825 -4.091 7.489 501 HG13 VAL 73 3HG1 VAL 73 46.065 -5.519 6.787 502 HG21 VAL 73 3HG2 VAL 73 45.000 -5.805 8.636 503 HG22 VAL 73 1HG2 VAL 73 44.125 -4.527 9.479 504 HG23 VAL 73 2HG2 VAL 73 43.312 -5.485 8.241 505 H LYS 74 H LYS 74 43.316 -1.093 6.682 506 HA LYS 74 HA LYS 74 41.164 -0.995 8.687 507 HB2 LYS 74 2HB LYS 74 41.552 0.938 6.406 508 HB3 LYS 74 3HB LYS 74 40.551 1.141 7.837 509 HG2 LYS 74 2HG LYS 74 43.558 0.999 7.847 510 HG3 LYS 74 3HG LYS 74 42.611 2.487 7.897 511 HD2 LYS 74 2HD LYS 74 42.248 0.302 9.928 512 HD3 LYS 74 3HD LYS 74 43.471 1.560 10.120 513 HE2 LYS 74 2HE LYS 74 40.902 2.682 9.415 514 HE3 LYS 74 3HE LYS 74 40.789 1.689 10.867 515 HZ1 LYS 74 3HZ LYS 74 43.098 3.325 10.966 516 HZ2 LYS 74 1HZ LYS 74 41.790 3.262 12.036 517 HZ3 LYS 74 2HZ LYS 74 41.729 4.278 10.685 518 H VAL 75 H VAL 75 39.313 -1.983 8.237 519 HA VAL 75 HA VAL 75 38.746 -2.680 5.430 520 HB VAL 75 HB VAL 75 37.684 -4.091 7.878 521 HG11 VAL 75 1HG1 VAL 75 36.431 -4.190 5.663 522 HG12 VAL 75 2HG1 VAL 75 37.806 -5.114 5.056 523 HG13 VAL 75 3HG1 VAL 75 36.858 -5.729 6.410 524 HG21 VAL 75 3HG2 VAL 75 39.944 -4.589 8.002 525 HG22 VAL 75 1HG2 VAL 75 39.321 -5.910 7.013 526 HG23 VAL 75 2HG2 VAL 75 40.153 -4.554 6.251 527 H THR 76 H THR 76 36.814 -2.149 4.547 528 HA THR 76 HA THR 76 34.734 -1.018 6.277 529 HB THR 76 HB THR 76 34.404 0.908 4.888 530 HG1 THR 76 HG1 THR 76 36.460 -0.205 3.257 531 HG21 THR 76 3HG2 THR 76 36.216 2.163 5.554 532 HG22 THR 76 1HG2 THR 76 37.379 0.908 5.131 533 HG23 THR 76 2HG2 THR 76 36.401 0.748 6.590 534 H ALA 77 H ALA 77 32.621 -1.020 5.357 535 HA ALA 77 HA ALA 77 32.245 -2.391 2.816 536 HB1 ALA 77 1HB ALA 77 30.445 -3.646 4.607 537 HB2 ALA 77 2HB ALA 77 31.749 -4.376 3.669 538 HB3 ALA 77 3HB ALA 77 32.065 -3.770 5.295 539 H SER 78 H SER 78 30.327 -1.901 1.818 540 HA SER 78 HA SER 78 28.473 -0.152 3.293 541 HB2 SER 78 2HB SER 78 28.239 1.283 1.387 542 HB3 SER 78 3HB SER 78 29.968 1.090 1.678 543 HG SER 78 HG SER 78 30.121 -0.240 -0.055 544 H ILE 79 H ILE 79 26.325 -0.498 2.988 545 HA ILE 79 HA ILE 79 25.500 -2.419 0.930 546 HB ILE 79 HB ILE 79 25.705 -3.762 2.916 547 HG12 ILE 79 2HG1 ILE 79 23.389 -4.546 3.159 548 HG13 ILE 79 3HG1 ILE 79 22.801 -3.053 2.436 549 HG21 ILE 79 1HG2 ILE 79 23.786 -1.938 4.338 550 HG22 ILE 79 2HG2 ILE 79 24.756 -3.248 5.010 551 HG23 ILE 79 3HG2 ILE 79 25.536 -1.762 4.469 552 HD11 ILE 79 3HD1 ILE 79 24.717 -4.289 0.704 553 HD12 ILE 79 1HD1 ILE 79 23.458 -5.443 1.146 554 HD13 ILE 79 2HD1 ILE 79 23.022 -3.901 0.408 555 H GLY 80 H GLY 80 24.047 -1.414 -0.289 556 HA2 GLY 80 2HA GLY 80 22.335 -0.026 -0.938 557 HA3 GLY 80 3HA GLY 80 21.578 -0.518 0.569 558 H GLY 81 H GLY 81 21.146 1.034 1.994 559 HA2 GLY 81 2HA GLY 81 22.169 3.711 1.487 560 HA3 GLY 81 3HA GLY 81 20.895 3.277 2.617 561 H ILE 82 H ILE 82 21.674 1.957 4.544 562 HA ILE 82 HA ILE 82 23.670 3.459 5.893 563 HB ILE 82 HB ILE 82 22.264 0.900 6.652 564 HG12 ILE 82 2HG1 ILE 82 21.305 2.626 8.380 565 HG13 ILE 82 3HG1 ILE 82 21.833 3.817 7.196 566 HG21 ILE 82 1HG2 ILE 82 24.180 0.738 7.927 567 HG22 ILE 82 2HG2 ILE 82 24.358 2.485 8.072 568 HG23 ILE 82 3HG2 ILE 82 23.113 1.647 8.997 569 HD11 ILE 82 3HD1 ILE 82 20.070 3.428 5.917 570 HD12 ILE 82 1HD1 ILE 82 20.351 1.688 5.942 571 HD13 ILE 82 2HD1 ILE 82 19.424 2.450 7.234 572 H GLN 83 H GLN 83 25.738 2.910 6.512 573 HA GLN 83 HA GLN 83 26.846 0.361 5.633 574 HB2 GLN 83 2HB GLN 83 28.810 1.577 4.611 575 HB3 GLN 83 3HB GLN 83 27.305 1.673 3.707 576 HG2 GLN 83 2HG GLN 83 27.276 3.884 3.830 577 HG3 GLN 83 3HG GLN 83 27.542 3.860 5.572 578 HE21 GLN 83 1HE2 GLN 83 28.640 5.531 3.343 579 HE22 GLN 83 2HE2 GLN 83 30.355 5.449 3.540 580 H GLY 84 H GLY 84 29.051 -0.004 6.485 581 HA2 GLY 84 2HA GLY 84 29.771 1.684 8.767 582 HA3 GLY 84 3HA GLY 84 29.395 -0.002 9.089 583 H SER 85 H SER 85 31.795 0.725 9.875 584 HA SER 85 HA SER 85 33.555 -0.644 7.992 585 HB2 SER 85 2HB SER 85 35.266 1.288 8.852 586 HB3 SER 85 3HB SER 85 34.391 1.357 7.322 587 HG SER 85 HG SER 85 33.656 3.160 8.127 588 H THR 86 H THR 86 35.529 -1.420 8.977 589 HA THR 86 HA THR 86 35.446 -1.519 11.917 590 HB THR 86 HB THR 86 34.551 -3.625 11.325 591 HG1 THR 86 HG1 THR 86 35.956 -4.747 12.462 592 HG21 THR 86 3HG2 THR 86 36.213 -3.317 8.983 593 HG22 THR 86 1HG2 THR 86 34.813 -4.359 9.233 594 HG23 THR 86 2HG2 THR 86 36.421 -4.914 9.700 595 H ASP 87 H ASP 87 37.468 -1.917 12.945 596 HA ASP 87 HA ASP 87 39.763 -1.151 11.273 597 HB2 ASP 87 2HB ASP 87 38.921 0.198 13.383 598 HB3 ASP 87 3HB ASP 87 39.848 -1.017 14.258 599 H PHE 88 H PHE 88 41.545 -2.409 11.159 600 HA PHE 88 HA PHE 88 41.613 -4.829 12.836 601 HB2 PHE 88 2HB PHE 88 41.784 -4.542 9.886 602 HB3 PHE 88 3HB PHE 88 42.875 -5.706 10.632 603 HD1 PHE 88 HD2 PHE 88 42.025 -7.697 11.708 604 HD2 PHE 88 HD1 PHE 88 39.394 -4.880 9.903 605 HE1 PHE 88 HE2 PHE 88 40.203 -9.349 11.791 606 HE2 PHE 88 HE1 PHE 88 37.568 -6.527 9.985 607 HZ PHE 88 HZ PHE 88 37.972 -8.766 10.929 608 H LYS 89 H LYS 89 43.323 -4.779 14.120 609 HA LYS 89 HA LYS 89 45.835 -3.644 13.077 610 HB2 LYS 89 2HB LYS 89 44.356 -3.049 15.539 611 HB3 LYS 89 3HB LYS 89 46.057 -3.403 15.807 612 HG2 LYS 89 2HG LYS 89 45.603 -1.576 13.584 613 HG3 LYS 89 3HG LYS 89 45.012 -0.965 15.130 614 HD2 LYS 89 2HD LYS 89 47.759 -2.147 14.858 615 HD3 LYS 89 3HD LYS 89 47.443 -0.452 14.475 616 HE2 LYS 89 2HE LYS 89 46.879 0.065 16.673 617 HE3 LYS 89 3HE LYS 89 46.561 -1.618 17.089 618 HZ1 LYS 89 3HZ LYS 89 49.017 -1.982 16.721 619 HZ2 LYS 89 1HZ LYS 89 48.595 -1.084 18.092 620 HZ3 LYS 89 2HZ LYS 89 49.183 -0.298 16.715 621 H VAL 90 H VAL 90 47.208 -5.260 12.740 622 HA VAL 90 HA VAL 90 47.235 -7.510 14.641 623 HB VAL 90 HB VAL 90 46.713 -8.212 12.370 624 HG11 VAL 90 1HG1 VAL 90 49.400 -7.119 11.556 625 HG12 VAL 90 2HG1 VAL 90 48.188 -7.872 10.518 626 HG13 VAL 90 3HG1 VAL 90 47.868 -6.301 11.254 627 HG21 VAL 90 3HG2 VAL 90 47.814 -10.072 12.879 628 HG22 VAL 90 1HG2 VAL 90 49.293 -9.366 12.228 629 HG23 VAL 90 2HG2 VAL 90 48.896 -9.163 13.934 630 H THR 91 H THR 91 48.953 -7.743 15.907 631 HA THR 91 HA THR 91 51.499 -6.514 15.081 632 HB THR 91 HB THR 91 51.922 -6.020 17.513 633 HG1 THR 91 HG1 THR 91 50.394 -6.409 18.949 634 HG21 THR 91 3HG2 THR 91 51.278 -3.923 17.081 635 HG22 THR 91 1HG2 THR 91 49.574 -4.378 17.052 636 HG23 THR 91 2HG2 THR 91 50.557 -4.545 15.597 637 H GLN 92 H GLN 92 53.404 -7.497 15.958 638 HA GLN 92 HA GLN 92 53.014 -10.181 17.084 639 HB2 GLN 92 2HB GLN 92 53.401 -10.304 14.614 640 HB3 GLN 92 3HB GLN 92 54.969 -9.549 14.869 641 HG2 GLN 92 2HG GLN 92 55.449 -11.488 16.455 642 HG3 GLN 92 3HG GLN 92 54.038 -12.261 15.735 643 HE21 GLN 92 1HE2 GLN 92 56.492 -13.436 15.566 644 HE22 GLN 92 2HE2 GLN 92 57.056 -13.386 13.934 Start of MODEL 7 1 H1 MET 1 H MET 1 6.879 1.941 -5.035 2 HA MET 1 HA MET 1 6.521 3.213 -3.134 3 HB2 MET 1 2HB MET 1 3.837 2.607 -3.916 4 HB3 MET 1 3HB MET 1 3.989 2.348 -2.183 5 HG2 MET 1 2HG MET 1 4.792 4.597 -1.872 6 HG3 MET 1 3HG MET 1 4.799 4.868 -3.613 7 HE1 MET 1 3HE MET 1 3.637 6.712 -3.886 8 HE2 MET 1 1HE MET 1 2.360 5.964 -4.846 9 HE3 MET 1 2HE MET 1 1.944 7.062 -3.530 10 HA PRO 2 HA PRO 2 5.659 -0.528 -0.209 11 HB2 PRO 2 2HB PRO 2 4.798 -2.838 -1.345 12 HB3 PRO 2 3HB PRO 2 3.696 -1.575 -0.784 13 HG2 PRO 2 2HG PRO 2 4.663 -2.150 -3.558 14 HG3 PRO 2 3HG PRO 2 3.029 -1.736 -3.006 15 HD2 PRO 2 2HD PRO 2 4.686 0.079 -4.143 16 HD3 PRO 2 3HD PRO 2 3.501 0.517 -2.896 17 H ALA 3 H ALA 3 7.016 -2.282 0.408 18 HA ALA 3 HA ALA 3 8.937 -3.502 0.401 19 HB1 ALA 3 1HB ALA 3 8.705 -3.720 -2.583 20 HB2 ALA 3 2HB ALA 3 9.376 -4.882 -1.438 21 HB3 ALA 3 3HB ALA 3 7.635 -4.609 -1.499 22 H ALA 4 H ALA 4 8.952 -0.556 -0.109 23 HA ALA 4 HA ALA 4 11.120 0.014 -1.871 24 HB1 ALA 4 1HB ALA 4 9.573 1.570 0.151 25 HB2 ALA 4 2HB ALA 4 11.082 2.228 -0.482 26 HB3 ALA 4 3HB ALA 4 9.758 1.844 -1.582 27 H LEU 5 H LEU 5 13.203 -0.346 -1.526 28 HA LEU 5 HA LEU 5 14.316 -1.479 0.720 29 HB2 LEU 5 2HB LEU 5 15.229 -0.821 -1.735 30 HB3 LEU 5 3HB LEU 5 16.076 0.372 -0.751 31 HG LEU 5 HG LEU 5 16.742 -1.741 0.665 32 HD11 LEU 5 1HD1 LEU 5 16.191 -2.917 -2.056 33 HD12 LEU 5 2HD1 LEU 5 15.366 -3.327 -0.552 34 HD13 LEU 5 3HD1 LEU 5 17.075 -3.713 -0.753 35 HD21 LEU 5 3HD2 LEU 5 18.178 -1.577 -1.929 36 HD22 LEU 5 1HD2 LEU 5 18.808 -1.577 -0.282 37 HD23 LEU 5 2HD2 LEU 5 18.076 -0.116 -0.946 38 H VAL 6 H VAL 6 15.859 -0.603 2.279 39 HA VAL 6 HA VAL 6 15.453 2.231 2.926 40 HB VAL 6 HB VAL 6 15.305 0.055 5.012 41 HG11 VAL 6 1HG1 VAL 6 15.861 2.760 5.237 42 HG12 VAL 6 2HG1 VAL 6 14.151 2.633 5.654 43 HG13 VAL 6 3HG1 VAL 6 15.347 1.681 6.534 44 HG21 VAL 6 3HG2 VAL 6 12.890 0.609 5.136 45 HG22 VAL 6 1HG2 VAL 6 13.079 1.600 3.689 46 HG23 VAL 6 2HG2 VAL 6 13.356 -0.140 3.609 47 H SER 7 H SER 7 17.067 -0.563 4.444 48 HA SER 7 HA SER 7 19.681 0.123 3.736 49 HB2 SER 7 2HB SER 7 20.074 0.802 6.382 50 HB3 SER 7 3HB SER 7 20.038 1.934 5.030 51 HG SER 7 HG SER 7 18.399 2.768 6.039 52 H ILE 8 H ILE 8 21.262 -0.792 5.604 53 HA ILE 8 HA ILE 8 20.079 -3.313 6.563 54 HB ILE 8 HB ILE 8 22.889 -3.080 5.498 55 HG12 ILE 8 2HG1 ILE 8 21.255 -2.652 3.693 56 HG13 ILE 8 3HG1 ILE 8 22.107 -4.175 3.464 57 HG21 ILE 8 1HG2 ILE 8 22.252 -5.671 5.294 58 HG22 ILE 8 2HG2 ILE 8 22.971 -4.968 6.742 59 HG23 ILE 8 3HG2 ILE 8 21.229 -5.230 6.661 60 HD11 ILE 8 3HD1 ILE 8 19.439 -4.102 4.809 61 HD12 ILE 8 1HD1 ILE 8 19.576 -4.093 3.051 62 HD13 ILE 8 2HD1 ILE 8 20.235 -5.440 3.980 63 H SER 9 H SER 9 21.033 -4.227 8.435 64 HA SER 9 HA SER 9 22.430 -2.242 10.096 65 HB2 SER 9 2HB SER 9 20.148 -3.234 10.784 66 HB3 SER 9 3HB SER 9 21.050 -4.706 11.146 67 HG SER 9 HG SER 9 20.962 -3.489 13.005 68 H VAL 10 H VAL 10 24.554 -2.551 10.134 69 HA VAL 10 HA VAL 10 25.564 -5.316 10.314 70 HB VAL 10 HB VAL 10 26.229 -4.283 8.208 71 HG11 VAL 10 1HG1 VAL 10 26.114 -1.943 8.894 72 HG12 VAL 10 2HG1 VAL 10 27.535 -2.167 9.917 73 HG13 VAL 10 3HG1 VAL 10 27.676 -2.314 8.164 74 HG21 VAL 10 3HG2 VAL 10 27.865 -5.582 9.964 75 HG22 VAL 10 1HG2 VAL 10 28.269 -5.212 8.287 76 HG23 VAL 10 2HG2 VAL 10 28.812 -4.144 9.582 77 H SER 11 H SER 11 26.908 -5.822 11.954 78 HA SER 11 HA SER 11 27.621 -3.652 13.815 79 HB2 SER 11 2HB SER 11 27.044 -6.575 14.334 80 HB3 SER 11 3HB SER 11 27.712 -5.484 15.548 81 HG SER 11 HG SER 11 25.204 -5.280 14.241 82 HA PRO 12 HA PRO 12 31.604 -5.254 12.067 83 HB2 PRO 12 2HB PRO 12 32.732 -2.800 11.793 84 HB3 PRO 12 3HB PRO 12 31.702 -3.527 10.554 85 HG2 PRO 12 2HG PRO 12 31.011 -1.491 12.637 86 HG3 PRO 12 3HG PRO 12 30.551 -1.541 10.925 87 HD2 PRO 12 2HD PRO 12 28.876 -2.314 12.908 88 HD3 PRO 12 3HD PRO 12 28.855 -3.058 11.296 89 H THR 13 H THR 13 33.656 -5.302 13.055 90 HA THR 13 HA THR 13 33.646 -4.394 15.851 91 HB THR 13 HB THR 13 35.834 -6.136 15.391 92 HG1 THR 13 HG1 THR 13 34.563 -8.000 14.686 93 HG21 THR 13 3HG2 THR 13 34.280 -7.665 16.828 94 HG22 THR 13 1HG2 THR 13 33.255 -6.233 16.905 95 HG23 THR 13 2HG2 THR 13 34.909 -6.167 17.513 96 H ASN 14 H ASN 14 35.222 -3.092 16.645 97 HA ASN 14 HA ASN 14 37.400 -2.319 14.822 98 HB2 ASN 14 2HB ASN 14 37.166 0.013 15.820 99 HB3 ASN 14 3HB ASN 14 35.894 -0.488 14.708 100 HD21 ASN 14 1HD2 ASN 14 36.584 0.763 17.730 101 HD22 ASN 14 2HD2 ASN 14 35.018 0.606 18.442 102 H SER 15 H SER 15 39.134 -3.214 15.764 103 HA SER 15 HA SER 15 40.178 -2.167 18.161 104 HB2 SER 15 2HB SER 15 38.283 -4.075 18.705 105 HB3 SER 15 3HB SER 15 39.766 -5.029 18.693 106 HG SER 15 HG SER 15 40.137 -4.239 20.592 107 H THR 16 H THR 16 41.899 -4.093 18.989 108 HA THR 16 HA THR 16 43.482 -4.597 16.561 109 HB THR 16 HB THR 16 44.694 -3.166 18.025 110 HG1 THR 16 HG1 THR 16 46.430 -4.665 18.706 111 HG21 THR 16 3HG2 THR 16 45.163 -4.495 20.394 112 HG22 THR 16 1HG2 THR 16 43.451 -4.793 20.101 113 HG23 THR 16 2HG2 THR 16 44.058 -3.139 20.174 114 H VAL 17 H VAL 17 44.418 -6.591 16.191 115 HA VAL 17 HA VAL 17 43.768 -8.760 18.060 116 HB VAL 17 HB VAL 17 43.425 -9.068 15.082 117 HG11 VAL 17 1HG1 VAL 17 42.093 -11.062 15.836 118 HG12 VAL 17 2HG1 VAL 17 43.827 -11.151 16.157 119 HG13 VAL 17 3HG1 VAL 17 42.705 -10.765 17.463 120 HG21 VAL 17 3HG2 VAL 17 40.979 -9.010 15.539 121 HG22 VAL 17 1HG2 VAL 17 41.342 -8.448 17.171 122 HG23 VAL 17 2HG2 VAL 17 41.783 -7.459 15.779 123 H ALA 18 H ALA 18 45.102 -10.642 17.846 124 HA ALA 18 HA ALA 18 47.822 -10.027 17.303 125 HB1 ALA 18 1HB ALA 18 47.471 -12.839 17.486 126 HB2 ALA 18 2HB ALA 18 48.117 -11.728 18.694 127 HB3 ALA 18 3HB ALA 18 46.388 -12.070 18.647 128 H LYS 19 H LYS 19 49.229 -11.248 15.847 129 HA LYS 19 HA LYS 19 48.500 -11.076 13.193 130 HB2 LYS 19 2HB LYS 19 50.454 -12.625 12.770 131 HB3 LYS 19 3HB LYS 19 50.811 -11.194 13.728 132 HG2 LYS 19 2HG LYS 19 51.546 -12.432 15.409 133 HG3 LYS 19 3HG LYS 19 50.050 -13.368 15.442 134 HD2 LYS 19 2HD LYS 19 50.903 -15.033 14.130 135 HD3 LYS 19 3HD LYS 19 52.003 -13.947 13.278 136 HE2 LYS 19 2HE LYS 19 53.515 -13.912 15.117 137 HE3 LYS 19 3HE LYS 19 52.358 -14.734 16.163 138 HZ1 LYS 19 3HZ LYS 19 53.787 -16.416 15.540 139 HZ2 LYS 19 1HZ LYS 19 53.969 -15.842 13.959 140 HZ3 LYS 19 2HZ LYS 19 52.531 -16.601 14.423 141 H GLY 20 H GLY 20 47.691 -12.459 11.661 142 HA2 GLY 20 2HA GLY 20 46.597 -14.281 10.784 143 HA3 GLY 20 3HA GLY 20 47.314 -15.243 12.068 144 H LEU 21 H LEU 21 44.502 -13.600 10.961 145 HA LEU 21 HA LEU 21 42.757 -15.032 12.608 146 HB2 LEU 21 2HB LEU 21 43.913 -12.731 13.853 147 HB3 LEU 21 3HB LEU 21 42.187 -12.460 13.617 148 HG LEU 21 HG LEU 21 42.562 -15.068 14.713 149 HD11 LEU 21 1HD1 LEU 21 44.701 -13.615 15.459 150 HD12 LEU 21 2HD1 LEU 21 43.947 -14.844 16.474 151 HD13 LEU 21 3HD1 LEU 21 43.551 -13.142 16.709 152 HD21 LEU 21 3HD2 LEU 21 40.745 -13.072 14.859 153 HD22 LEU 21 1HD2 LEU 21 41.549 -12.896 16.419 154 HD23 LEU 21 2HD2 LEU 21 40.810 -14.436 15.976 155 H GLN 22 H GLN 22 40.493 -14.274 12.415 156 HA GLN 22 HA GLN 22 40.071 -12.431 10.171 157 HB2 GLN 22 2HB GLN 22 38.539 -13.929 9.088 158 HB3 GLN 22 3HB GLN 22 40.050 -14.789 9.350 159 HG2 GLN 22 2HG GLN 22 38.524 -16.370 9.978 160 HG3 GLN 22 3HG GLN 22 38.881 -15.609 11.528 161 HE21 GLN 22 1HE2 GLN 22 36.920 -16.195 12.422 162 HE22 GLN 22 2HE2 GLN 22 35.428 -15.461 11.955 163 H GLU 23 H GLU 23 37.971 -11.480 10.083 164 HA GLU 23 HA GLU 23 36.501 -11.644 12.632 165 HB2 GLU 23 2HB GLU 23 37.625 -9.359 11.224 166 HB3 GLU 23 3HB GLU 23 35.907 -9.159 11.536 167 HG2 GLU 23 2HG GLU 23 37.350 -8.224 13.305 168 HG3 GLU 23 3HG GLU 23 36.232 -9.457 13.887 169 H ASN 24 H ASN 24 34.535 -12.455 12.403 170 HA ASN 24 HA ASN 24 33.102 -11.986 9.871 171 HB2 ASN 24 2HB ASN 24 32.223 -14.161 9.902 172 HB3 ASN 24 3HB ASN 24 33.900 -14.385 10.393 173 HD21 ASN 24 1HD2 ASN 24 30.748 -15.105 11.100 174 HD22 ASN 24 2HD2 ASN 24 30.943 -15.621 12.738 175 H PHE 25 H PHE 25 30.995 -11.346 9.973 176 HA PHE 25 HA PHE 25 29.667 -11.256 12.574 177 HB2 PHE 25 2HB PHE 25 30.811 -8.963 11.254 178 HB3 PHE 25 3HB PHE 25 29.063 -8.786 11.361 179 HD1 PHE 25 HD2 PHE 25 27.993 -9.164 13.668 180 HD2 PHE 25 HD1 PHE 25 32.149 -8.462 13.075 181 HE1 PHE 25 HE2 PHE 25 28.207 -8.468 16.018 182 HE2 PHE 25 HE1 PHE 25 32.370 -7.766 15.424 183 HZ PHE 25 HZ PHE 25 30.397 -7.766 16.899 184 H LYS 26 H LYS 26 27.446 -9.820 11.925 185 HA LYS 26 HA LYS 26 26.318 -11.199 9.582 186 HB2 LYS 26 2HB LYS 26 24.309 -11.719 10.774 187 HB3 LYS 26 3HB LYS 26 25.661 -12.303 11.735 188 HG2 LYS 26 2HG LYS 26 25.484 -10.131 13.034 189 HG3 LYS 26 3HG LYS 26 23.937 -9.894 12.218 190 HD2 LYS 26 2HD LYS 26 22.987 -11.783 13.229 191 HD3 LYS 26 3HD LYS 26 24.561 -12.434 13.693 192 HE2 LYS 26 2HE LYS 26 24.479 -11.374 15.645 193 HE3 LYS 26 3HE LYS 26 24.198 -9.830 14.842 194 HZ1 LYS 26 3HZ LYS 26 22.056 -11.808 15.390 195 HZ2 LYS 26 1HZ LYS 26 21.868 -10.216 14.849 196 HZ3 LYS 26 2HZ LYS 26 22.423 -10.515 16.418 197 H ALA 27 H ALA 27 24.442 -10.164 8.651 198 HA ALA 27 HA ALA 27 24.185 -7.315 9.346 199 HB1 ALA 27 1HB ALA 27 25.453 -7.109 7.438 200 HB2 ALA 27 2HB ALA 27 24.753 -8.544 6.687 201 HB3 ALA 27 3HB ALA 27 23.820 -7.050 6.774 202 H THR 28 H THR 28 22.168 -6.909 9.941 203 HA THR 28 HA THR 28 19.999 -8.596 8.925 204 HB THR 28 HB THR 28 19.319 -6.576 10.948 205 HG1 THR 28 HG1 THR 28 20.624 -7.274 12.506 206 HG21 THR 28 3HG2 THR 28 18.841 -9.496 10.470 207 HG22 THR 28 1HG2 THR 28 17.674 -8.178 10.563 208 HG23 THR 28 2HG2 THR 28 18.457 -8.768 12.029 209 H GLY 29 H GLY 29 19.141 -7.844 7.087 210 HA2 GLY 29 2HA GLY 29 19.029 -4.995 6.549 211 HA3 GLY 29 3HA GLY 29 18.535 -6.284 5.462 212 H ILE 30 H ILE 30 17.243 -3.720 6.463 213 HA ILE 30 HA ILE 30 14.679 -4.953 7.230 214 HB ILE 30 HB ILE 30 14.177 -2.777 8.423 215 HG12 ILE 30 2HG1 ILE 30 16.984 -2.254 8.990 216 HG13 ILE 30 3HG1 ILE 30 16.599 -2.001 7.291 217 HG21 ILE 30 1HG2 ILE 30 14.847 -4.981 9.481 218 HG22 ILE 30 2HG2 ILE 30 16.461 -4.293 9.652 219 HG23 ILE 30 3HG2 ILE 30 15.090 -3.534 10.460 220 HD11 ILE 30 3HD1 ILE 30 16.313 0.072 8.370 221 HD12 ILE 30 1HD1 ILE 30 14.693 -0.552 8.061 222 HD13 ILE 30 2HD1 ILE 30 15.383 -0.655 9.681 223 H PHE 31 H PHE 31 13.428 -4.828 5.482 224 HA PHE 31 HA PHE 31 13.350 -2.274 4.014 225 HB2 PHE 31 2HB PHE 31 12.643 -4.935 2.793 226 HB3 PHE 31 3HB PHE 31 13.001 -3.418 1.975 227 HD1 PHE 31 HD1 PHE 31 15.363 -2.536 2.053 228 HD2 PHE 31 HD2 PHE 31 14.329 -6.488 3.249 229 HE1 PHE 31 HE1 PHE 31 17.713 -3.222 1.808 230 HE2 PHE 31 HE2 PHE 31 16.677 -7.180 3.007 231 HZ PHE 31 HZ PHE 31 18.373 -5.546 2.286 232 H THR 32 H THR 32 11.212 -2.096 2.730 233 HA THR 32 HA THR 32 9.092 -2.054 4.614 234 HB THR 32 HB THR 32 9.010 -1.649 1.617 235 HG1 THR 32 HG1 THR 32 9.140 0.203 3.784 236 HG21 THR 32 3HG2 THR 32 6.796 -2.170 2.395 237 HG22 THR 32 1HG2 THR 32 6.888 -0.432 2.114 238 HG23 THR 32 2HG2 THR 32 6.965 -1.065 3.759 239 H ASP 33 H ASP 33 10.144 -4.366 2.267 240 HA ASP 33 HA ASP 33 7.644 -5.788 2.136 241 HB2 ASP 33 2HB ASP 33 9.091 -7.540 0.982 242 HB3 ASP 33 3HB ASP 33 8.998 -5.965 0.200 243 H ASN 34 H ASN 34 9.823 -5.446 4.543 244 HA ASN 34 HA ASN 34 10.369 -6.608 6.422 245 HB2 ASN 34 2HB ASN 34 8.044 -8.442 6.049 246 HB3 ASN 34 3HB ASN 34 8.602 -7.620 7.503 247 HD21 ASN 34 1HD2 ASN 34 8.437 -5.162 7.338 248 HD22 ASN 34 2HD2 ASN 34 6.955 -4.549 6.695 249 H SER 35 H SER 35 11.223 -7.629 3.735 250 HA SER 35 HA SER 35 11.811 -10.402 4.544 251 HB2 SER 35 2HB SER 35 10.601 -9.451 2.150 252 HB3 SER 35 3HB SER 35 12.199 -10.067 1.731 253 HG SER 35 HG SER 35 11.584 -11.985 2.956 254 H ASN 36 H ASN 36 13.795 -10.229 5.430 255 HA ASN 36 HA ASN 36 15.835 -8.608 4.120 256 HB2 ASN 36 2HB ASN 36 17.088 -8.775 6.102 257 HB3 ASN 36 3HB ASN 36 15.421 -8.669 6.660 258 HD21 ASN 36 1HD2 ASN 36 18.038 -9.952 7.631 259 HD22 ASN 36 2HD2 ASN 36 17.543 -11.534 8.119 260 H SER 37 H SER 37 17.705 -9.413 3.230 261 HA SER 37 HA SER 37 18.000 -12.332 3.105 262 HB2 SER 37 2HB SER 37 18.824 -11.182 0.609 263 HB3 SER 37 3HB SER 37 17.589 -12.406 0.905 264 HG SER 37 HG SER 37 16.064 -10.903 0.886 265 H ASP 38 H ASP 38 20.161 -13.024 2.424 266 HA ASP 38 HA ASP 38 22.186 -11.683 3.842 267 HB2 ASP 38 2HB ASP 38 23.718 -13.287 2.560 268 HB3 ASP 38 3HB ASP 38 22.468 -14.009 3.569 269 H ILE 39 H ILE 39 22.905 -9.729 3.287 270 HA ILE 39 HA ILE 39 23.424 -7.918 1.948 271 HB ILE 39 HB ILE 39 25.443 -8.355 0.573 272 HG12 ILE 39 2HG1 ILE 39 25.157 -11.223 1.481 273 HG13 ILE 39 3HG1 ILE 39 24.693 -10.667 -0.124 274 HG21 ILE 39 1HG2 ILE 39 26.753 -9.437 2.567 275 HG22 ILE 39 2HG2 ILE 39 26.023 -7.842 2.733 276 HG23 ILE 39 3HG2 ILE 39 25.211 -9.256 3.404 277 HD11 ILE 39 3HD1 ILE 39 27.355 -11.154 1.018 278 HD12 ILE 39 1HD1 ILE 39 26.776 -11.319 -0.640 279 HD13 ILE 39 2HD1 ILE 39 27.207 -9.729 -0.010 280 H THR 40 H THR 40 21.092 -8.772 0.968 281 HA THR 40 HA THR 40 20.998 -9.681 -1.668 282 HB THR 40 HB THR 40 18.909 -7.747 -1.196 283 HG1 THR 40 HG1 THR 40 18.097 -8.732 0.729 284 HG21 THR 40 3HG2 THR 40 17.507 -9.812 -1.281 285 HG22 THR 40 1HG2 THR 40 18.992 -10.761 -1.339 286 HG23 THR 40 2HG2 THR 40 18.610 -9.641 -2.646 287 H ASP 41 H ASP 41 21.665 -6.513 -0.374 288 HA ASP 41 HA ASP 41 21.388 -5.182 -2.923 289 HB2 ASP 41 2HB ASP 41 21.817 -4.393 -0.139 290 HB3 ASP 41 3HB ASP 41 22.771 -3.448 -1.279 291 H GLN 42 H GLN 42 23.610 -7.263 -1.784 292 HA GLN 42 HA GLN 42 25.732 -7.816 -2.387 293 HB2 GLN 42 2HB GLN 42 24.674 -7.011 -4.660 294 HB3 GLN 42 3HB GLN 42 25.787 -5.664 -4.461 295 HG2 GLN 42 2HG GLN 42 27.515 -7.618 -4.052 296 HG3 GLN 42 3HG GLN 42 26.342 -8.524 -5.007 297 HE21 GLN 42 1HE2 GLN 42 27.074 -8.681 -6.999 298 HE22 GLN 42 2HE2 GLN 42 27.756 -7.401 -7.937 299 H VAL 43 H VAL 43 26.858 -7.188 -0.600 300 HA VAL 43 HA VAL 43 27.744 -4.408 -0.390 301 HB VAL 43 HB VAL 43 26.788 -5.557 1.610 302 HG11 VAL 43 1HG1 VAL 43 28.102 -7.214 2.787 303 HG12 VAL 43 2HG1 VAL 43 27.747 -7.783 1.155 304 HG13 VAL 43 3HG1 VAL 43 29.348 -7.151 1.541 305 HG21 VAL 43 3HG2 VAL 43 28.003 -3.718 2.241 306 HG22 VAL 43 1HG2 VAL 43 28.900 -4.987 3.076 307 HG23 VAL 43 2HG2 VAL 43 29.504 -4.336 1.552 308 H THR 44 H THR 44 29.809 -3.770 -0.661 309 HA THR 44 HA THR 44 31.700 -5.763 -1.659 310 HB THR 44 HB THR 44 32.183 -2.794 -1.640 311 HG1 THR 44 HG1 THR 44 30.467 -2.670 -2.887 312 HG21 THR 44 3HG2 THR 44 33.248 -3.652 -3.913 313 HG22 THR 44 1HG2 THR 44 33.291 -5.179 -3.032 314 HG23 THR 44 2HG2 THR 44 34.119 -3.763 -2.384 315 H TRP 45 H TRP 45 33.010 -6.655 -0.210 316 HA TRP 45 HA TRP 45 33.990 -4.991 2.015 317 HB2 TRP 45 2HB TRP 45 32.779 -7.542 2.025 318 HB3 TRP 45 3HB TRP 45 34.476 -7.798 2.420 319 HD1 TRP 45 HD1 TRP 45 35.196 -5.505 4.293 320 HE1 TRP 45 HE1 TRP 45 34.044 -5.179 6.572 321 HE3 TRP 45 HE3 TRP 45 30.893 -8.120 3.409 322 HZ2 TRP 45 HZ2 TRP 45 31.631 -5.931 7.828 323 HZ3 TRP 45 HZ3 TRP 45 29.214 -8.269 5.201 324 HH2 TRP 45 HH2 TRP 45 29.578 -7.197 7.365 325 H ASP 46 H ASP 46 36.080 -4.500 2.053 326 HA ASP 46 HA ASP 46 37.980 -6.242 0.643 327 HB2 ASP 46 2HB ASP 46 37.375 -3.407 0.109 328 HB3 ASP 46 3HB ASP 46 39.090 -3.783 0.249 329 H SER 47 H SER 47 40.124 -6.194 1.438 330 HA SER 47 HA SER 47 40.439 -4.902 4.066 331 HB2 SER 47 2HB SER 47 40.174 -7.112 4.729 332 HB3 SER 47 3HB SER 47 40.933 -7.749 3.271 333 HG SER 47 HG SER 47 42.090 -7.567 5.521 334 H SER 48 H SER 48 42.542 -4.259 4.631 335 HA SER 48 HA SER 48 44.086 -3.124 2.648 336 HB2 SER 48 2HB SER 48 44.247 -2.494 5.022 337 HB3 SER 48 3HB SER 48 45.018 -4.039 5.382 338 HG SER 48 HG SER 48 46.448 -2.171 5.037 339 H ASN 49 H ASN 49 46.091 -3.643 1.705 340 HA ASN 49 HA ASN 49 46.706 -6.525 1.682 341 HB2 ASN 49 2HB ASN 49 45.742 -5.329 -0.443 342 HB3 ASN 49 3HB ASN 49 47.388 -4.727 -0.617 343 HD21 ASN 49 1HD2 ASN 49 46.382 -6.255 -2.576 344 HD22 ASN 49 2HD2 ASN 49 47.113 -7.820 -2.570 345 H THR 50 H THR 50 48.146 -6.036 3.490 346 HA THR 50 HA THR 50 50.540 -4.502 2.819 347 HB THR 50 HB THR 50 50.724 -5.730 5.401 348 HG1 THR 50 HG1 THR 50 48.843 -4.886 6.340 349 HG21 THR 50 3HG2 THR 50 51.009 -3.491 6.148 350 HG22 THR 50 1HG2 THR 50 50.150 -2.843 4.751 351 HG23 THR 50 2HG2 THR 50 51.740 -3.579 4.546 352 H ASP 51 H ASP 51 49.441 -7.761 3.140 353 HA ASP 51 HA ASP 51 51.916 -8.771 2.097 354 HB2 ASP 51 2HB ASP 51 51.946 -8.564 4.790 355 HB3 ASP 51 3HB ASP 51 51.211 -10.155 4.619 356 H ILE 52 H ILE 52 48.793 -9.491 3.583 357 HA ILE 52 HA ILE 52 48.028 -11.158 1.398 358 HB ILE 52 HB ILE 52 49.390 -12.811 2.516 359 HG12 ILE 52 2HG1 ILE 52 46.537 -13.459 3.242 360 HG13 ILE 52 3HG1 ILE 52 47.077 -13.379 1.569 361 HG21 ILE 52 1HG2 ILE 52 48.518 -11.521 4.858 362 HG22 ILE 52 2HG2 ILE 52 47.934 -13.182 4.951 363 HG23 ILE 52 3HG2 ILE 52 49.653 -12.864 4.719 364 HD11 ILE 52 3HD1 ILE 52 48.841 -15.023 3.138 365 HD12 ILE 52 1HD1 ILE 52 47.171 -15.574 3.267 366 HD13 ILE 52 2HD1 ILE 52 47.928 -15.418 1.682 367 H LEU 53 H LEU 53 45.935 -10.786 1.142 368 HA LEU 53 HA LEU 53 44.246 -10.460 3.527 369 HB2 LEU 53 2HB LEU 53 43.185 -8.573 2.696 370 HB3 LEU 53 3HB LEU 53 44.883 -8.293 2.318 371 HG LEU 53 HG LEU 53 44.131 -9.383 0.004 372 HD11 LEU 53 1HD1 LEU 53 41.727 -9.381 1.208 373 HD12 LEU 53 2HD1 LEU 53 41.949 -9.233 -0.535 374 HD13 LEU 53 3HD1 LEU 53 41.692 -7.791 0.447 375 HD21 LEU 53 3HD2 LEU 53 44.754 -7.371 -0.694 376 HD22 LEU 53 1HD2 LEU 53 44.698 -6.813 0.978 377 HD23 LEU 53 2HD2 LEU 53 43.278 -6.646 -0.054 378 H SER 54 H SER 54 42.388 -11.579 3.499 379 HA SER 54 HA SER 54 41.416 -12.641 0.939 380 HB2 SER 54 2HB SER 54 41.998 -14.212 3.449 381 HB3 SER 54 3HB SER 54 40.902 -14.805 2.202 382 HG SER 54 HG SER 54 43.610 -14.061 1.783 383 H ILE 55 H ILE 55 39.398 -11.988 0.668 384 HA ILE 55 HA ILE 55 37.669 -11.729 3.043 385 HB ILE 55 HB ILE 55 37.485 -10.129 0.488 386 HG12 ILE 55 2HG1 ILE 55 39.449 -9.476 1.777 387 HG13 ILE 55 3HG1 ILE 55 38.216 -8.224 1.884 388 HG21 ILE 55 1HG2 ILE 55 35.465 -9.494 1.153 389 HG22 ILE 55 2HG2 ILE 55 35.560 -10.680 2.453 390 HG23 ILE 55 3HG2 ILE 55 36.090 -9.022 2.733 391 HD11 ILE 55 3HD1 ILE 55 38.710 -8.302 4.067 392 HD12 ILE 55 1HD1 ILE 55 37.617 -9.686 4.065 393 HD13 ILE 55 2HD1 ILE 55 39.360 -9.939 3.971 394 H SER 56 H SER 56 35.881 -12.926 3.077 395 HA SER 56 HA SER 56 34.920 -14.079 0.541 396 HB2 SER 56 2HB SER 56 36.032 -15.500 2.649 397 HB3 SER 56 3HB SER 56 34.296 -15.682 2.899 398 HG SER 56 HG SER 56 35.857 -16.439 0.676 399 H ASN 57 H ASN 57 33.033 -13.174 0.070 400 HA ASN 57 HA ASN 57 30.830 -13.338 1.884 401 HB2 ASN 57 2HB ASN 57 31.581 -11.354 2.881 402 HB3 ASN 57 3HB ASN 57 32.126 -10.679 1.348 403 HD21 ASN 57 1HD2 ASN 57 30.736 -9.530 0.114 404 HD22 ASN 57 2HD2 ASN 57 29.111 -9.166 0.573 405 H ALA 58 H ALA 58 29.544 -14.280 0.409 406 HA ALA 58 HA ALA 58 28.522 -12.675 -1.748 407 HB1 ALA 58 1HB ALA 58 30.185 -15.110 -2.329 408 HB2 ALA 58 2HB ALA 58 29.002 -14.471 -3.471 409 HB3 ALA 58 3HB ALA 58 30.370 -13.477 -2.970 410 H SER 59 H SER 59 28.729 -16.188 -1.180 411 HA SER 59 HA SER 59 26.012 -16.661 -1.723 412 HB2 SER 59 2HB SER 59 28.312 -18.208 -0.920 413 HB3 SER 59 3HB SER 59 26.888 -18.719 -0.014 414 HG SER 59 HG SER 59 27.516 -19.177 -2.591 415 H ASP 60 H ASP 60 27.552 -15.388 1.031 416 HA ASP 60 HA ASP 60 25.054 -15.665 2.564 417 HB2 ASP 60 2HB ASP 60 27.460 -16.844 3.262 418 HB3 ASP 60 3HB ASP 60 27.439 -15.367 4.222 419 H SER 61 H SER 61 25.661 -14.078 4.705 420 HA SER 61 HA SER 61 26.099 -11.449 3.445 421 HB2 SER 61 2HB SER 61 24.220 -10.674 4.412 422 HB3 SER 61 3HB SER 61 23.823 -12.360 4.745 423 HG SER 61 HG SER 61 24.433 -12.122 6.789 424 H HIS 62 H HIS 62 27.328 -13.658 5.630 425 HA HIS 62 HA HIS 62 28.385 -11.837 7.574 426 HB2 HIS 62 2HB HIS 62 29.447 -14.602 7.032 427 HB3 HIS 62 3HB HIS 62 29.434 -13.713 8.552 428 HD1 HIS 62 HD1 HIS 62 26.495 -12.960 8.771 429 HD2 HIS 62 HD2 HIS 62 27.817 -16.705 7.551 430 HE1 HIS 62 HE1 HIS 62 24.587 -14.531 9.237 431 H GLY 63 H GLY 63 30.164 -10.631 7.440 432 HA2 GLY 63 2HA GLY 63 31.882 -10.954 5.092 433 HA3 GLY 63 3HA GLY 63 31.814 -9.544 6.139 434 H LEU 64 H LEU 64 33.147 -12.735 5.693 435 HA LEU 64 HA LEU 64 34.700 -12.591 8.141 436 HB2 LEU 64 2HB LEU 64 35.620 -14.768 7.363 437 HB3 LEU 64 3HB LEU 64 33.870 -14.744 7.569 438 HG LEU 64 HG LEU 64 34.690 -14.139 4.840 439 HD11 LEU 64 1HD1 LEU 64 36.408 -15.606 4.804 440 HD12 LEU 64 2HD1 LEU 64 35.100 -16.776 4.633 441 HD13 LEU 64 3HD1 LEU 64 35.828 -16.493 6.214 442 HD21 LEU 64 3HD2 LEU 64 32.436 -14.625 5.186 443 HD22 LEU 64 1HD2 LEU 64 32.794 -15.999 6.233 444 HD23 LEU 64 2HD2 LEU 64 33.082 -16.115 4.496 445 H ALA 65 H ALA 65 36.183 -10.972 7.954 446 HA ALA 65 HA ALA 65 37.926 -10.926 5.601 447 HB1 ALA 65 1HB ALA 65 37.513 -8.954 7.839 448 HB2 ALA 65 2HB ALA 65 38.745 -8.773 6.590 449 HB3 ALA 65 3HB ALA 65 37.038 -8.786 6.149 450 H SER 66 H SER 66 39.613 -12.260 5.742 451 HA SER 66 HA SER 66 40.995 -12.513 8.328 452 HB2 SER 66 2HB SER 66 41.615 -14.690 7.763 453 HB3 SER 66 3HB SER 66 40.003 -14.568 7.058 454 HG SER 66 HG SER 66 42.123 -15.273 5.800 455 H THR 67 H THR 67 43.221 -12.289 8.447 456 HA THR 67 HA THR 67 44.714 -11.588 6.051 457 HB THR 67 HB THR 67 45.548 -9.604 7.804 458 HG1 THR 67 HG1 THR 67 42.723 -9.425 7.644 459 HG21 THR 67 3HG2 THR 67 44.134 -8.141 6.159 460 HG22 THR 67 1HG2 THR 67 43.878 -9.673 5.325 461 HG23 THR 67 2HG2 THR 67 45.515 -9.059 5.558 462 H LEU 68 H LEU 68 47.062 -11.233 6.571 463 HA LEU 68 HA LEU 68 48.011 -12.321 9.074 464 HB2 LEU 68 2HB LEU 68 47.463 -14.156 7.182 465 HB3 LEU 68 3HB LEU 68 49.117 -13.743 6.735 466 HG LEU 68 HG LEU 68 48.980 -14.222 9.558 467 HD11 LEU 68 1HD1 LEU 68 47.468 -16.092 7.833 468 HD12 LEU 68 2HD1 LEU 68 47.270 -15.708 9.543 469 HD13 LEU 68 3HD1 LEU 68 48.557 -16.799 9.028 470 HD21 LEU 68 3HD2 LEU 68 50.345 -15.548 7.225 471 HD22 LEU 68 1HD2 LEU 68 50.612 -16.020 8.903 472 HD23 LEU 68 2HD2 LEU 68 51.027 -14.391 8.369 473 H ASN 69 H ASN 69 48.334 -9.801 7.980 474 HA ASN 69 HA ASN 69 51.136 -9.803 7.076 475 HB2 ASN 69 2HB ASN 69 50.713 -7.585 6.143 476 HB3 ASN 69 3HB ASN 69 49.552 -8.746 5.506 477 HD21 ASN 69 1HD2 ASN 69 47.511 -8.156 5.525 478 HD22 ASN 69 2HD2 ASN 69 46.816 -6.931 6.526 479 H GLN 70 H GLN 70 52.249 -7.632 7.733 480 HA GLN 70 HA GLN 70 51.800 -7.285 10.621 481 HB2 GLN 70 2HB GLN 70 54.156 -6.748 10.822 482 HB3 GLN 70 3HB GLN 70 53.969 -8.296 10.008 483 HG2 GLN 70 2HG GLN 70 54.173 -6.959 7.834 484 HG3 GLN 70 3HG GLN 70 54.783 -5.657 8.854 485 HE21 GLN 70 1HE2 GLN 70 56.776 -5.792 7.751 486 HE22 GLN 70 2HE2 GLN 70 57.911 -7.044 8.110 487 H GLY 71 H GLY 71 51.327 -5.320 11.399 488 HA2 GLY 71 2HA GLY 71 51.955 -2.881 11.181 489 HA3 GLY 71 3HA GLY 71 51.457 -3.057 9.505 490 H ASN 72 H ASN 72 49.564 -2.125 9.155 491 HA ASN 72 HA ASN 72 47.421 -2.525 11.128 492 HB2 ASN 72 2HB ASN 72 46.771 -0.275 11.091 493 HB3 ASN 72 3HB ASN 72 48.529 -0.187 11.147 494 HD21 ASN 72 1HD2 ASN 72 49.656 0.538 9.368 495 HD22 ASN 72 2HD2 ASN 72 48.887 1.319 8.033 496 H VAL 73 H VAL 73 45.303 -2.577 10.288 497 HA VAL 73 HA VAL 73 45.071 -2.674 7.361 498 HB VAL 73 HB VAL 73 43.975 -4.768 9.244 499 HG11 VAL 73 1HG1 VAL 73 42.395 -5.010 7.683 500 HG12 VAL 73 2HG1 VAL 73 43.255 -3.987 6.530 501 HG13 VAL 73 3HG1 VAL 73 43.669 -5.695 6.676 502 HG21 VAL 73 3HG2 VAL 73 45.476 -6.304 8.116 503 HG22 VAL 73 1HG2 VAL 73 46.062 -5.004 7.078 504 HG23 VAL 73 2HG2 VAL 73 46.392 -4.967 8.810 505 H LYS 74 H LYS 74 43.196 -1.880 6.542 506 HA LYS 74 HA LYS 74 41.127 -1.054 8.471 507 HB2 LYS 74 2HB LYS 74 42.732 0.705 7.220 508 HB3 LYS 74 3HB LYS 74 41.479 0.544 5.996 509 HG2 LYS 74 2HG LYS 74 40.935 1.230 8.875 510 HG3 LYS 74 3HG LYS 74 41.141 2.424 7.591 511 HD2 LYS 74 2HD LYS 74 38.983 2.216 7.098 512 HD3 LYS 74 3HD LYS 74 39.272 0.532 6.652 513 HE2 LYS 74 2HE LYS 74 37.496 0.719 8.318 514 HE3 LYS 74 3HE LYS 74 38.886 -0.154 8.961 515 HZ1 LYS 74 3HZ LYS 74 37.947 1.489 10.520 516 HZ2 LYS 74 1HZ LYS 74 38.353 2.727 9.441 517 HZ3 LYS 74 2HZ LYS 74 39.570 1.791 10.150 518 H VAL 75 H VAL 75 39.258 -2.031 8.100 519 HA VAL 75 HA VAL 75 38.711 -3.116 5.436 520 HB VAL 75 HB VAL 75 37.162 -3.619 7.976 521 HG11 VAL 75 1HG1 VAL 75 36.218 -5.481 6.825 522 HG12 VAL 75 2HG1 VAL 75 36.055 -4.072 5.774 523 HG13 VAL 75 3HG1 VAL 75 37.314 -5.267 5.460 524 HG21 VAL 75 3HG2 VAL 75 39.543 -5.049 6.826 525 HG22 VAL 75 1HG2 VAL 75 39.332 -4.403 8.453 526 HG23 VAL 75 2HG2 VAL 75 38.421 -5.825 7.944 527 H THR 76 H THR 76 36.984 -2.517 4.216 528 HA THR 76 HA THR 76 35.143 -0.509 5.321 529 HB THR 76 HB THR 76 35.976 -0.206 2.477 530 HG1 THR 76 HG1 THR 76 37.996 -0.193 3.309 531 HG21 THR 76 3HG2 THR 76 34.293 1.284 3.128 532 HG22 THR 76 1HG2 THR 76 35.769 2.242 3.246 533 HG23 THR 76 2HG2 THR 76 35.032 1.575 4.703 534 H ALA 77 H ALA 77 33.071 -0.957 4.942 535 HA ALA 77 HA ALA 77 32.291 -2.435 2.558 536 HB1 ALA 77 1HB ALA 77 32.462 -3.652 5.168 537 HB2 ALA 77 2HB ALA 77 30.809 -3.692 4.553 538 HB3 ALA 77 3HB ALA 77 32.121 -4.390 3.603 539 H SER 78 H SER 78 30.332 -1.840 1.804 540 HA SER 78 HA SER 78 28.473 -0.440 3.572 541 HB2 SER 78 2HB SER 78 28.203 1.421 2.004 542 HB3 SER 78 3HB SER 78 29.876 1.318 2.551 543 HG SER 78 HG SER 78 29.699 1.616 0.276 544 H ILE 79 H ILE 79 26.353 -0.732 3.058 545 HA ILE 79 HA ILE 79 25.710 -2.043 0.512 546 HB ILE 79 HB ILE 79 25.865 -3.856 2.101 547 HG12 ILE 79 2HG1 ILE 79 22.916 -3.327 1.839 548 HG13 ILE 79 3HG1 ILE 79 23.908 -3.637 0.418 549 HG21 ILE 79 1HG2 ILE 79 24.673 -3.945 4.158 550 HG22 ILE 79 2HG2 ILE 79 25.525 -2.402 4.115 551 HG23 ILE 79 3HG2 ILE 79 23.794 -2.462 3.783 552 HD11 ILE 79 3HD1 ILE 79 24.240 -5.574 2.589 553 HD12 ILE 79 1HD1 ILE 79 22.635 -5.537 1.858 554 HD13 ILE 79 2HD1 ILE 79 24.056 -5.825 0.853 555 H GLY 80 H GLY 80 24.128 -0.996 -0.490 556 HA2 GLY 80 2HA GLY 80 22.332 0.381 -0.874 557 HA3 GLY 80 3HA GLY 80 21.679 -0.274 0.621 558 H GLY 81 H GLY 81 21.664 0.962 2.440 559 HA2 GLY 81 2HA GLY 81 22.513 3.750 2.080 560 HA3 GLY 81 3HA GLY 81 21.336 3.177 3.253 561 H ILE 82 H ILE 82 22.132 1.961 5.098 562 HA ILE 82 HA ILE 82 24.329 3.211 6.330 563 HB ILE 82 HB ILE 82 23.071 0.584 7.124 564 HG12 ILE 82 2HG1 ILE 82 21.394 2.385 6.851 565 HG13 ILE 82 3HG1 ILE 82 21.570 1.886 8.530 566 HG21 ILE 82 1HG2 ILE 82 25.096 0.902 8.317 567 HG22 ILE 82 2HG2 ILE 82 24.733 2.602 8.613 568 HG23 ILE 82 3HG2 ILE 82 23.788 1.346 9.413 569 HD11 ILE 82 3HD1 ILE 82 21.702 4.471 7.496 570 HD12 ILE 82 1HD1 ILE 82 22.064 3.951 9.142 571 HD13 ILE 82 2HD1 ILE 82 23.356 4.053 7.944 572 H GLN 83 H GLN 83 26.377 2.429 6.890 573 HA GLN 83 HA GLN 83 27.286 0.007 5.505 574 HB2 GLN 83 2HB GLN 83 29.353 1.176 4.816 575 HB3 GLN 83 3HB GLN 83 27.914 1.851 4.063 576 HG2 GLN 83 2HG GLN 83 28.902 3.786 4.664 577 HG3 GLN 83 3HG GLN 83 28.051 3.461 6.174 578 HE21 GLN 83 1HE2 GLN 83 29.221 3.608 7.940 579 HE22 GLN 83 2HE2 GLN 83 30.935 3.423 8.049 580 H GLY 84 H GLY 84 29.392 -0.785 6.316 581 HA2 GLY 84 2HA GLY 84 30.032 0.132 9.033 582 HA3 GLY 84 3HA GLY 84 29.614 -1.557 8.787 583 H SER 85 H SER 85 32.122 -0.231 9.707 584 HA SER 85 HA SER 85 33.921 -1.600 7.834 585 HB2 SER 85 2HB SER 85 35.419 0.540 8.830 586 HB3 SER 85 3HB SER 85 34.791 0.367 7.191 587 HG SER 85 HG SER 85 33.405 1.887 7.595 588 H THR 86 H THR 86 35.467 -2.812 8.776 589 HA THR 86 HA THR 86 35.542 -2.820 11.715 590 HB THR 86 HB THR 86 36.247 -5.090 11.639 591 HG1 THR 86 HG1 THR 86 36.594 -6.069 9.485 592 HG21 THR 86 3HG2 THR 86 34.202 -5.845 11.162 593 HG22 THR 86 1HG2 THR 86 34.429 -5.535 9.441 594 HG23 THR 86 2HG2 THR 86 33.836 -4.253 10.497 595 H ASP 87 H ASP 87 37.431 -2.608 12.829 596 HA ASP 87 HA ASP 87 39.765 -1.769 11.257 597 HB2 ASP 87 2HB ASP 87 38.944 -0.112 12.849 598 HB3 ASP 87 3HB ASP 87 39.076 -1.279 14.162 599 H PHE 88 H PHE 88 41.527 -2.996 11.176 600 HA PHE 88 HA PHE 88 41.883 -5.077 13.230 601 HB2 PHE 88 2HB PHE 88 41.195 -6.247 11.278 602 HB3 PHE 88 3HB PHE 88 42.240 -5.280 10.242 603 HD1 PHE 88 HD2 PHE 88 43.001 -7.002 13.449 604 HD2 PHE 88 HD1 PHE 88 43.692 -6.786 9.254 605 HE1 PHE 88 HE2 PHE 88 44.770 -8.700 13.656 606 HE2 PHE 88 HE1 PHE 88 45.461 -8.485 9.455 607 HZ PHE 88 HZ PHE 88 46.003 -9.443 11.658 608 H LYS 89 H LYS 89 43.622 -4.630 14.395 609 HA LYS 89 HA LYS 89 45.967 -3.470 13.036 610 HB2 LYS 89 2HB LYS 89 44.658 -2.804 15.616 611 HB3 LYS 89 3HB LYS 89 46.416 -2.765 15.587 612 HG2 LYS 89 2HG LYS 89 45.708 -1.395 13.302 613 HG3 LYS 89 3HG LYS 89 44.493 -0.896 14.482 614 HD2 LYS 89 2HD LYS 89 46.708 -0.725 15.998 615 HD3 LYS 89 3HD LYS 89 47.402 -0.383 14.412 616 HE2 LYS 89 2HE LYS 89 46.786 1.708 15.316 617 HE3 LYS 89 3HE LYS 89 45.554 1.318 14.117 618 HZ1 LYS 89 3HZ LYS 89 45.265 0.858 17.036 619 HZ2 LYS 89 1HZ LYS 89 44.074 0.629 15.856 620 HZ3 LYS 89 2HZ LYS 89 44.629 2.188 16.206 621 H VAL 90 H VAL 90 47.414 -5.043 12.769 622 HA VAL 90 HA VAL 90 47.682 -7.130 14.801 623 HB VAL 90 HB VAL 90 47.515 -7.945 12.538 624 HG11 VAL 90 1HG1 VAL 90 48.357 -6.853 10.799 625 HG12 VAL 90 2HG1 VAL 90 49.036 -5.659 11.908 626 HG13 VAL 90 3HG1 VAL 90 49.994 -7.059 11.422 627 HG21 VAL 90 3HG2 VAL 90 49.010 -9.135 14.092 628 HG22 VAL 90 1HG2 VAL 90 49.526 -9.295 12.413 629 HG23 VAL 90 2HG2 VAL 90 50.368 -8.183 13.492 630 H THR 91 H THR 91 49.160 -6.929 16.334 631 HA THR 91 HA THR 91 51.704 -5.601 15.695 632 HB THR 91 HB THR 91 51.596 -4.804 18.185 633 HG1 THR 91 HG1 THR 91 49.319 -4.225 18.639 634 HG21 THR 91 3HG2 THR 91 51.180 -2.711 17.394 635 HG22 THR 91 1HG2 THR 91 49.742 -3.214 16.506 636 HG23 THR 91 2HG2 THR 91 51.345 -3.533 15.843 637 H GLN 92 H GLN 92 53.515 -6.395 16.759 638 HA GLN 92 HA GLN 92 54.841 -7.961 17.740 639 HB2 GLN 92 2HB GLN 92 52.949 -7.283 19.626 640 HB3 GLN 92 3HB GLN 92 52.839 -9.038 19.581 641 HG2 GLN 92 2HG GLN 92 55.366 -9.046 19.847 642 HG3 GLN 92 3HG GLN 92 55.216 -7.336 20.249 643 HE21 GLN 92 1HE2 GLN 92 55.968 -9.844 21.777 644 HE22 GLN 92 2HE2 GLN 92 55.008 -9.762 23.211 Start of MODEL 8 1 H1 MET 1 H MET 1 3.291 2.687 -1.975 2 HA MET 1 HA MET 1 4.850 1.422 -4.131 3 HB2 MET 1 2HB MET 1 5.277 3.877 -3.544 4 HB3 MET 1 3HB MET 1 5.967 3.282 -2.040 5 HG2 MET 1 2HG MET 1 7.894 3.176 -3.131 6 HG3 MET 1 3HG MET 1 7.231 1.761 -3.946 7 HE1 MET 1 3HE MET 1 5.758 2.369 -6.709 8 HE2 MET 1 1HE MET 1 7.375 2.486 -7.404 9 HE3 MET 1 2HE MET 1 7.078 1.407 -6.041 10 HA PRO 2 HA PRO 2 5.059 -1.378 -0.426 11 HB2 PRO 2 2HB PRO 2 4.664 -3.664 -1.837 12 HB3 PRO 2 3HB PRO 2 3.336 -2.679 -1.212 13 HG2 PRO 2 2HG PRO 2 4.490 -2.771 -3.973 14 HG3 PRO 2 3HG PRO 2 2.790 -2.709 -3.473 15 HD2 PRO 2 2HD PRO 2 4.138 -0.522 -4.327 16 HD3 PRO 2 3HD PRO 2 2.849 -0.434 -3.109 17 H ALA 3 H ALA 3 6.753 -2.749 0.153 18 HA ALA 3 HA ALA 3 8.930 -3.428 0.180 19 HB1 ALA 3 1HB ALA 3 8.112 -4.188 -2.613 20 HB2 ALA 3 2HB ALA 3 9.668 -4.634 -1.911 21 HB3 ALA 3 3HB ALA 3 8.171 -5.211 -1.177 22 H ALA 4 H ALA 4 9.891 -1.400 0.490 23 HA ALA 4 HA ALA 4 11.267 -0.355 -1.890 24 HB1 ALA 4 1HB ALA 4 11.052 1.926 -0.631 25 HB2 ALA 4 2HB ALA 4 9.727 1.332 -1.633 26 HB3 ALA 4 3HB ALA 4 9.658 1.150 0.120 27 H LEU 5 H LEU 5 13.400 -0.332 -1.653 28 HA LEU 5 HA LEU 5 14.779 -1.265 0.534 29 HB2 LEU 5 2HB LEU 5 16.772 -0.182 -0.438 30 HB3 LEU 5 3HB LEU 5 15.826 -1.091 -1.614 31 HG LEU 5 HG LEU 5 15.007 1.666 -1.604 32 HD11 LEU 5 1HD1 LEU 5 17.046 2.494 -0.977 33 HD12 LEU 5 2HD1 LEU 5 17.286 2.340 -2.717 34 HD13 LEU 5 3HD1 LEU 5 17.933 1.115 -1.626 35 HD21 LEU 5 3HD2 LEU 5 15.032 -0.345 -3.363 36 HD22 LEU 5 1HD2 LEU 5 16.509 0.480 -3.861 37 HD23 LEU 5 2HD2 LEU 5 14.975 1.351 -3.848 38 H VAL 6 H VAL 6 15.006 -0.512 2.523 39 HA VAL 6 HA VAL 6 14.691 2.367 3.004 40 HB VAL 6 HB VAL 6 14.626 0.110 5.012 41 HG11 VAL 6 1HG1 VAL 6 14.241 3.069 5.197 42 HG12 VAL 6 2HG1 VAL 6 13.413 1.993 6.324 43 HG13 VAL 6 3HG1 VAL 6 15.175 1.994 6.238 44 HG21 VAL 6 3HG2 VAL 6 12.540 1.319 3.297 45 HG22 VAL 6 1HG2 VAL 6 12.665 -0.312 3.956 46 HG23 VAL 6 2HG2 VAL 6 12.107 1.011 4.979 47 H SER 7 H SER 7 16.518 -0.224 4.633 48 HA SER 7 HA SER 7 19.078 0.743 4.089 49 HB2 SER 7 2HB SER 7 17.685 2.068 6.344 50 HB3 SER 7 3HB SER 7 19.340 1.544 6.657 51 HG SER 7 HG SER 7 18.468 3.647 5.221 52 H ILE 8 H ILE 8 20.630 0.031 6.056 53 HA ILE 8 HA ILE 8 19.656 -2.392 7.338 54 HB ILE 8 HB ILE 8 20.387 -3.309 5.250 55 HG12 ILE 8 2HG1 ILE 8 22.793 -3.858 6.925 56 HG13 ILE 8 3HG1 ILE 8 21.213 -4.231 7.605 57 HG21 ILE 8 1HG2 ILE 8 21.989 -2.405 4.007 58 HG22 ILE 8 2HG2 ILE 8 22.208 -1.183 5.258 59 HG23 ILE 8 3HG2 ILE 8 23.182 -2.652 5.282 60 HD11 ILE 8 3HD1 ILE 8 22.692 -5.528 5.412 61 HD12 ILE 8 1HD1 ILE 8 21.616 -6.218 6.626 62 HD13 ILE 8 2HD1 ILE 8 20.945 -5.397 5.216 63 H SER 9 H SER 9 20.785 -2.952 9.165 64 HA SER 9 HA SER 9 22.729 -0.971 10.089 65 HB2 SER 9 2HB SER 9 20.628 -2.485 11.341 66 HB3 SER 9 3HB SER 9 22.158 -2.816 12.154 67 HG SER 9 HG SER 9 20.768 -0.861 12.753 68 H VAL 10 H VAL 10 24.826 -1.408 10.349 69 HA VAL 10 HA VAL 10 25.697 -4.210 10.059 70 HB VAL 10 HB VAL 10 27.762 -3.416 9.080 71 HG11 VAL 10 1HG1 VAL 10 25.437 -2.043 7.738 72 HG12 VAL 10 2HG1 VAL 10 26.929 -2.597 6.975 73 HG13 VAL 10 3HG1 VAL 10 25.782 -3.768 7.627 74 HG21 VAL 10 3HG2 VAL 10 26.846 -0.860 10.139 75 HG22 VAL 10 1HG2 VAL 10 28.476 -1.402 9.735 76 HG23 VAL 10 2HG2 VAL 10 27.425 -0.753 8.476 77 H SER 11 H SER 11 27.012 -5.071 11.568 78 HA SER 11 HA SER 11 27.838 -3.313 13.783 79 HB2 SER 11 2HB SER 11 26.721 -6.061 13.694 80 HB3 SER 11 3HB SER 11 27.979 -5.765 14.893 81 HG SER 11 HG SER 11 26.001 -5.277 15.808 82 HA PRO 12 HA PRO 12 31.737 -4.747 11.737 83 HB2 PRO 12 2HB PRO 12 32.992 -2.348 11.944 84 HB3 PRO 12 3HB PRO 12 31.929 -2.763 10.594 85 HG2 PRO 12 2HG PRO 12 31.338 -1.145 13.042 86 HG3 PRO 12 3HG PRO 12 30.880 -0.833 11.358 87 HD2 PRO 12 2HD PRO 12 29.163 -1.894 13.162 88 HD3 PRO 12 3HD PRO 12 29.108 -2.304 11.436 89 H THR 13 H THR 13 33.787 -5.083 12.678 90 HA THR 13 HA THR 13 33.846 -4.666 15.593 91 HB THR 13 HB THR 13 35.515 -6.707 14.144 92 HG1 THR 13 HG1 THR 13 32.848 -6.985 15.113 93 HG21 THR 13 3HG2 THR 13 34.611 -6.270 16.976 94 HG22 THR 13 1HG2 THR 13 36.253 -6.427 16.354 95 HG23 THR 13 2HG2 THR 13 35.198 -7.838 16.425 96 H ASN 14 H ASN 14 35.144 -3.061 16.180 97 HA ASN 14 HA ASN 14 37.564 -2.540 14.591 98 HB2 ASN 14 2HB ASN 14 37.470 -0.316 15.956 99 HB3 ASN 14 3HB ASN 14 36.376 -0.541 14.595 100 HD21 ASN 14 1HD2 ASN 14 34.256 -0.390 14.930 101 HD22 ASN 14 2HD2 ASN 14 33.501 -0.247 16.478 102 H SER 15 H SER 15 38.973 -3.987 15.539 103 HA SER 15 HA SER 15 40.150 -3.153 18.013 104 HB2 SER 15 2HB SER 15 38.067 -4.873 18.367 105 HB3 SER 15 3HB SER 15 39.411 -6.004 18.211 106 HG SER 15 HG SER 15 39.514 -3.766 19.937 107 H THR 16 H THR 16 41.652 -5.318 18.668 108 HA THR 16 HA THR 16 43.272 -5.688 16.245 109 HB THR 16 HB THR 16 44.537 -4.617 17.965 110 HG1 THR 16 HG1 THR 16 46.029 -6.495 18.500 111 HG21 THR 16 3HG2 THR 16 44.876 -5.818 20.180 112 HG22 THR 16 1HG2 THR 16 43.477 -6.800 19.749 113 HG23 THR 16 2HG2 THR 16 43.305 -5.055 19.937 114 H VAL 17 H VAL 17 44.130 -7.720 15.718 115 HA VAL 17 HA VAL 17 43.008 -10.024 17.157 116 HB VAL 17 HB VAL 17 42.576 -11.161 15.003 117 HG11 VAL 17 1HG1 VAL 17 40.662 -10.265 16.016 118 HG12 VAL 17 2HG1 VAL 17 41.129 -8.606 15.635 119 HG13 VAL 17 3HG1 VAL 17 40.590 -9.689 14.351 120 HG21 VAL 17 3HG2 VAL 17 43.316 -8.472 13.869 121 HG22 VAL 17 1HG2 VAL 17 44.035 -10.042 13.507 122 HG23 VAL 17 2HG2 VAL 17 42.395 -9.678 12.969 123 H ALA 18 H ALA 18 44.176 -12.002 16.872 124 HA ALA 18 HA ALA 18 46.995 -11.639 16.811 125 HB1 ALA 18 1HB ALA 18 46.408 -14.389 16.568 126 HB2 ALA 18 2HB ALA 18 46.871 -13.495 18.017 127 HB3 ALA 18 3HB ALA 18 45.167 -13.681 17.602 128 H LYS 19 H LYS 19 48.493 -12.794 15.409 129 HA LYS 19 HA LYS 19 48.173 -12.238 12.724 130 HB2 LYS 19 2HB LYS 19 50.044 -13.930 12.386 131 HB3 LYS 19 3HB LYS 19 50.370 -12.614 13.507 132 HG2 LYS 19 2HG LYS 19 50.306 -13.988 15.353 133 HG3 LYS 19 3HG LYS 19 49.316 -15.205 14.544 134 HD2 LYS 19 2HD LYS 19 52.068 -14.647 13.529 135 HD3 LYS 19 3HD LYS 19 51.864 -15.635 14.978 136 HE2 LYS 19 2HE LYS 19 50.025 -16.747 13.320 137 HE3 LYS 19 3HE LYS 19 51.259 -16.243 12.166 138 HZ1 LYS 19 3HZ LYS 19 52.670 -17.803 12.882 139 HZ2 LYS 19 1HZ LYS 19 51.307 -18.543 13.557 140 HZ3 LYS 19 2HZ LYS 19 52.296 -17.560 14.514 141 H GLY 20 H GLY 20 47.275 -13.232 11.008 142 HA2 GLY 20 2HA GLY 20 45.918 -14.683 9.854 143 HA3 GLY 20 3HA GLY 20 46.894 -15.939 10.601 144 H LEU 21 H LEU 21 44.084 -13.850 11.152 145 HA LEU 21 HA LEU 21 42.910 -16.024 12.753 146 HB2 LEU 21 2HB LEU 21 43.646 -13.595 13.756 147 HB3 LEU 21 3HB LEU 21 41.955 -13.317 13.348 148 HG LEU 21 HG LEU 21 41.437 -15.388 14.728 149 HD11 LEU 21 1HD1 LEU 21 44.339 -15.017 15.347 150 HD12 LEU 21 2HD1 LEU 21 43.449 -16.499 15.002 151 HD13 LEU 21 3HD1 LEU 21 43.242 -15.688 16.554 152 HD21 LEU 21 3HD2 LEU 21 41.012 -13.078 15.470 153 HD22 LEU 21 1HD2 LEU 21 42.636 -13.017 16.155 154 HD23 LEU 21 2HD2 LEU 21 41.446 -14.145 16.806 155 H GLN 22 H GLN 22 40.393 -15.056 13.105 156 HA GLN 22 HA GLN 22 39.331 -14.251 10.522 157 HB2 GLN 22 2HB GLN 22 39.243 -16.990 11.518 158 HB3 GLN 22 3HB GLN 22 37.642 -16.348 11.176 159 HG2 GLN 22 2HG GLN 22 38.260 -15.858 8.910 160 HG3 GLN 22 3HG GLN 22 39.933 -16.312 9.228 161 HE21 GLN 22 1HE2 GLN 22 40.266 -18.065 8.039 162 HE22 GLN 22 2HE2 GLN 22 39.289 -19.490 8.055 163 H GLU 23 H GLU 23 37.445 -13.136 10.675 164 HA GLU 23 HA GLU 23 36.139 -13.047 13.313 165 HB2 GLU 23 2HB GLU 23 37.648 -11.026 12.549 166 HB3 GLU 23 3HB GLU 23 36.237 -10.607 11.588 167 HG2 GLU 23 2HG GLU 23 35.384 -9.605 13.360 168 HG3 GLU 23 3HG GLU 23 35.270 -11.176 14.152 169 H ASN 24 H ASN 24 33.917 -12.835 13.334 170 HA ASN 24 HA ASN 24 32.606 -13.381 10.772 171 HB2 ASN 24 2HB ASN 24 30.636 -13.953 12.323 172 HB3 ASN 24 3HB ASN 24 32.022 -15.040 12.336 173 HD21 ASN 24 1HD2 ASN 24 30.382 -12.475 14.058 174 HD22 ASN 24 2HD2 ASN 24 31.081 -12.805 15.603 175 H PHE 25 H PHE 25 30.997 -12.116 9.950 176 HA PHE 25 HA PHE 25 30.592 -9.526 11.283 177 HB2 PHE 25 2HB PHE 25 30.714 -10.364 8.419 178 HB3 PHE 25 3HB PHE 25 29.711 -8.981 8.845 179 HD1 PHE 25 HD2 PHE 25 33.067 -10.183 9.955 180 HD2 PHE 25 HD1 PHE 25 30.751 -7.014 8.307 181 HE1 PHE 25 HE2 PHE 25 35.059 -8.740 9.939 182 HE2 PHE 25 HE1 PHE 25 32.741 -5.566 8.287 183 HZ PHE 25 HZ PHE 25 34.898 -6.428 9.105 184 H LYS 26 H LYS 26 28.483 -8.553 11.197 185 HA LYS 26 HA LYS 26 26.244 -10.326 10.597 186 HB2 LYS 26 2HB LYS 26 25.203 -9.754 12.823 187 HB3 LYS 26 3HB LYS 26 26.577 -10.849 12.895 188 HG2 LYS 26 2HG LYS 26 27.384 -8.077 13.137 189 HG3 LYS 26 3HG LYS 26 26.222 -8.548 14.379 190 HD2 LYS 26 2HD LYS 26 28.303 -10.544 13.916 191 HD3 LYS 26 3HD LYS 26 28.932 -8.989 14.466 192 HE2 LYS 26 2HE LYS 26 28.511 -10.210 16.429 193 HE3 LYS 26 3HE LYS 26 27.156 -9.092 16.284 194 HZ1 LYS 26 3HZ LYS 26 27.207 -12.004 15.891 195 HZ2 LYS 26 1HZ LYS 26 26.057 -11.079 15.063 196 HZ3 LYS 26 2HZ LYS 26 26.102 -11.058 16.754 197 H ALA 27 H ALA 27 24.673 -9.249 9.597 198 HA ALA 27 HA ALA 27 24.318 -6.389 10.142 199 HB1 ALA 27 1HB ALA 27 24.181 -5.854 7.784 200 HB2 ALA 27 2HB ALA 27 25.745 -6.587 8.146 201 HB3 ALA 27 3HB ALA 27 24.486 -7.539 7.359 202 H THR 28 H THR 28 22.238 -5.755 10.234 203 HA THR 28 HA THR 28 20.190 -7.733 9.471 204 HB THR 28 HB THR 28 18.891 -6.077 11.211 205 HG1 THR 28 HG1 THR 28 20.564 -4.982 12.056 206 HG21 THR 28 3HG2 THR 28 18.643 -8.411 11.387 207 HG22 THR 28 1HG2 THR 28 19.376 -7.921 12.914 208 HG23 THR 28 2HG2 THR 28 20.368 -8.658 11.656 209 H GLY 29 H GLY 29 19.481 -7.085 7.511 210 HA2 GLY 29 2HA GLY 29 19.092 -4.255 6.951 211 HA3 GLY 29 3HA GLY 29 18.897 -5.581 5.814 212 H ILE 30 H ILE 30 17.165 -3.238 6.602 213 HA ILE 30 HA ILE 30 14.735 -4.795 7.203 214 HB ILE 30 HB ILE 30 15.194 -3.364 9.089 215 HG12 ILE 30 2HG1 ILE 30 13.017 -2.071 7.438 216 HG13 ILE 30 3HG1 ILE 30 12.835 -3.617 8.259 217 HG21 ILE 30 1HG2 ILE 30 16.614 -1.759 7.758 218 HG22 ILE 30 2HG2 ILE 30 15.113 -0.986 7.251 219 HG23 ILE 30 3HG2 ILE 30 15.550 -1.027 8.959 220 HD11 ILE 30 3HD1 ILE 30 12.239 -2.564 10.103 221 HD12 ILE 30 1HD1 ILE 30 13.792 -1.730 10.144 222 HD13 ILE 30 2HD1 ILE 30 12.430 -1.015 9.281 223 H PHE 31 H PHE 31 13.396 -4.883 5.537 224 HA PHE 31 HA PHE 31 13.118 -2.527 3.807 225 HB2 PHE 31 2HB PHE 31 13.092 -5.303 2.650 226 HB3 PHE 31 3HB PHE 31 13.286 -3.765 1.816 227 HD1 PHE 31 HD1 PHE 31 15.411 -2.384 2.878 228 HD2 PHE 31 HD2 PHE 31 14.962 -6.611 2.661 229 HE1 PHE 31 HE1 PHE 31 17.856 -2.644 2.964 230 HE2 PHE 31 HE2 PHE 31 17.406 -6.878 2.748 231 HZ PHE 31 HZ PHE 31 18.857 -4.893 2.901 232 H THR 32 H THR 32 11.091 -2.362 2.719 233 HA THR 32 HA THR 32 8.889 -3.197 4.302 234 HB THR 32 HB THR 32 8.089 -2.371 1.647 235 HG1 THR 32 HG1 THR 32 9.692 -0.457 2.982 236 HG21 THR 32 3HG2 THR 32 7.743 -1.493 4.469 237 HG22 THR 32 1HG2 THR 32 6.529 -1.886 3.252 238 HG23 THR 32 2HG2 THR 32 7.371 -0.337 3.190 239 H ASP 33 H ASP 33 10.634 -4.751 1.867 240 HA ASP 33 HA ASP 33 8.496 -6.287 0.733 241 HB2 ASP 33 2HB ASP 33 10.424 -7.688 -0.167 242 HB3 ASP 33 3HB ASP 33 10.391 -5.996 -0.657 243 H ASN 34 H ASN 34 9.827 -6.316 3.732 244 HA ASN 34 HA ASN 34 9.965 -7.817 5.442 245 HB2 ASN 34 2HB ASN 34 7.891 -9.509 4.101 246 HB3 ASN 34 3HB ASN 34 8.042 -9.064 5.799 247 HD21 ASN 34 1HD2 ASN 34 7.517 -6.877 6.396 248 HD22 ASN 34 2HD2 ASN 34 6.343 -6.000 5.481 249 H SER 35 H SER 35 11.588 -8.308 3.001 250 HA SER 35 HA SER 35 12.296 -11.078 3.621 251 HB2 SER 35 2HB SER 35 12.176 -10.130 0.759 252 HB3 SER 35 3HB SER 35 12.380 -11.778 1.353 253 HG SER 35 HG SER 35 10.267 -11.841 1.928 254 H ASN 36 H ASN 36 13.884 -9.643 4.796 255 HA ASN 36 HA ASN 36 15.958 -8.511 3.086 256 HB2 ASN 36 2HB ASN 36 16.968 -7.838 5.322 257 HB3 ASN 36 3HB ASN 36 15.414 -7.111 4.925 258 HD21 ASN 36 1HD2 ASN 36 13.672 -7.517 6.184 259 HD22 ASN 36 2HD2 ASN 36 13.726 -8.465 7.628 260 H SER 37 H SER 37 18.052 -9.255 2.984 261 HA SER 37 HA SER 37 18.673 -11.745 4.415 262 HB2 SER 37 2HB SER 37 18.701 -11.267 1.460 263 HB3 SER 37 3HB SER 37 19.897 -12.357 2.161 264 HG SER 37 HG SER 37 18.136 -13.589 1.651 265 H ASP 38 H ASP 38 21.028 -12.271 4.323 266 HA ASP 38 HA ASP 38 22.550 -9.850 4.834 267 HB2 ASP 38 2HB ASP 38 23.647 -12.637 5.070 268 HB3 ASP 38 3HB ASP 38 24.082 -11.196 5.984 269 H ILE 39 H ILE 39 23.947 -8.970 3.460 270 HA ILE 39 HA ILE 39 25.126 -8.592 1.544 271 HB ILE 39 HB ILE 39 25.963 -11.478 1.674 272 HG12 ILE 39 2HG1 ILE 39 27.851 -10.319 3.164 273 HG13 ILE 39 3HG1 ILE 39 26.511 -9.257 3.582 274 HG21 ILE 39 1HG2 ILE 39 27.696 -10.878 0.373 275 HG22 ILE 39 2HG2 ILE 39 26.661 -9.515 -0.051 276 HG23 ILE 39 3HG2 ILE 39 27.903 -9.327 1.186 277 HD11 ILE 39 3HD1 ILE 39 25.762 -10.748 5.024 278 HD12 ILE 39 1HD1 ILE 39 25.620 -11.952 3.743 279 HD13 ILE 39 2HD1 ILE 39 27.131 -11.790 4.638 280 H THR 40 H THR 40 22.384 -9.561 1.244 281 HA THR 40 HA THR 40 22.204 -11.432 -0.868 282 HB THR 40 HB THR 40 20.354 -10.461 0.750 283 HG1 THR 40 HG1 THR 40 19.876 -11.180 -1.970 284 HG21 THR 40 3HG2 THR 40 20.612 -8.162 -0.287 285 HG22 THR 40 1HG2 THR 40 18.966 -8.786 -0.195 286 HG23 THR 40 2HG2 THR 40 19.839 -8.824 -1.727 287 H ASP 41 H ASP 41 22.738 -7.987 -0.773 288 HA ASP 41 HA ASP 41 22.421 -7.767 -3.670 289 HB2 ASP 41 2HB ASP 41 22.149 -5.957 -1.445 290 HB3 ASP 41 3HB ASP 41 23.297 -5.307 -2.612 291 H GLN 42 H GLN 42 24.749 -8.879 -1.786 292 HA GLN 42 HA GLN 42 26.986 -9.207 -2.041 293 HB2 GLN 42 2HB GLN 42 26.226 -9.325 -4.498 294 HB3 GLN 42 3HB GLN 42 26.864 -7.692 -4.637 295 HG2 GLN 42 2HG GLN 42 29.055 -8.383 -4.264 296 HG3 GLN 42 3HG GLN 42 28.549 -9.921 -3.568 297 HE21 GLN 42 1HE2 GLN 42 27.163 -11.245 -5.178 298 HE22 GLN 42 2HE2 GLN 42 27.821 -11.381 -6.769 299 H VAL 43 H VAL 43 27.055 -7.634 -0.241 300 HA VAL 43 HA VAL 43 27.499 -4.903 -0.541 301 HB VAL 43 HB VAL 43 28.801 -6.606 1.581 302 HG11 VAL 43 1HG1 VAL 43 29.457 -4.653 2.407 303 HG12 VAL 43 2HG1 VAL 43 28.649 -3.797 1.092 304 HG13 VAL 43 3HG1 VAL 43 27.769 -4.174 2.574 305 HG21 VAL 43 3HG2 VAL 43 25.957 -5.969 1.107 306 HG22 VAL 43 1HG2 VAL 43 26.692 -7.330 1.955 307 HG23 VAL 43 2HG2 VAL 43 26.536 -5.769 2.761 308 H THR 44 H THR 44 29.331 -3.634 -0.723 309 HA THR 44 HA THR 44 31.577 -4.910 -2.057 310 HB THR 44 HB THR 44 31.127 -1.965 -1.545 311 HG1 THR 44 HG1 THR 44 30.251 -3.698 -3.595 312 HG21 THR 44 3HG2 THR 44 32.791 -1.569 -3.183 313 HG22 THR 44 1HG2 THR 44 32.816 -3.261 -3.675 314 HG23 THR 44 2HG2 THR 44 33.462 -2.789 -2.103 315 H TRP 45 H TRP 45 33.173 -5.686 -0.847 316 HA TRP 45 HA TRP 45 33.921 -4.231 1.601 317 HB2 TRP 45 2HB TRP 45 35.066 -6.450 2.185 318 HB3 TRP 45 3HB TRP 45 33.306 -6.416 2.232 319 HD1 TRP 45 HD1 TRP 45 32.052 -8.131 0.749 320 HE1 TRP 45 HE1 TRP 45 32.776 -9.922 -0.952 321 HE3 TRP 45 HE3 TRP 45 36.990 -6.884 0.311 322 HZ2 TRP 45 HZ2 TRP 45 35.130 -10.703 -2.301 323 HZ3 TRP 45 HZ3 TRP 45 38.410 -8.203 -1.205 324 HH2 TRP 45 HH2 TRP 45 37.498 -10.073 -2.482 325 H ASP 46 H ASP 46 36.156 -3.978 2.094 326 HA ASP 46 HA ASP 46 38.107 -4.567 0.031 327 HB2 ASP 46 2HB ASP 46 36.897 -1.951 0.297 328 HB3 ASP 46 3HB ASP 46 38.631 -1.872 0.598 329 H SER 47 H SER 47 40.212 -4.604 0.781 330 HA SER 47 HA SER 47 40.590 -3.989 3.636 331 HB2 SER 47 2HB SER 47 40.359 -6.498 2.967 332 HB3 SER 47 3HB SER 47 41.995 -6.305 2.337 333 HG SER 47 HG SER 47 41.107 -6.425 4.937 334 H SER 48 H SER 48 42.684 -3.350 4.260 335 HA SER 48 HA SER 48 44.017 -1.633 2.548 336 HB2 SER 48 2HB SER 48 44.544 -2.806 5.196 337 HB3 SER 48 3HB SER 48 45.992 -2.309 4.319 338 HG SER 48 HG SER 48 45.340 -0.256 4.363 339 H ASN 49 H ASN 49 46.464 -1.853 2.068 340 HA ASN 49 HA ASN 49 46.981 -4.519 0.928 341 HB2 ASN 49 2HB ASN 49 47.455 -1.805 -0.309 342 HB3 ASN 49 3HB ASN 49 48.199 -3.279 -0.921 343 HD21 ASN 49 1HD2 ASN 49 45.510 -1.278 -1.024 344 HD22 ASN 49 2HD2 ASN 49 44.457 -2.310 -1.925 345 H THR 50 H THR 50 47.927 -4.166 3.361 346 HA THR 50 HA THR 50 50.553 -2.968 3.363 347 HB THR 50 HB THR 50 49.487 -4.790 5.509 348 HG1 THR 50 HG1 THR 50 48.954 -2.003 5.201 349 HG21 THR 50 3HG2 THR 50 51.817 -4.083 5.700 350 HG22 THR 50 1HG2 THR 50 50.836 -3.341 6.964 351 HG23 THR 50 2HG2 THR 50 51.328 -2.395 5.559 352 H ASP 51 H ASP 51 49.431 -6.277 4.097 353 HA ASP 51 HA ASP 51 51.837 -7.298 2.745 354 HB2 ASP 51 2HB ASP 51 51.907 -7.324 5.324 355 HB3 ASP 51 3HB ASP 51 50.709 -8.611 5.207 356 H ILE 52 H ILE 52 48.949 -8.663 4.333 357 HA ILE 52 HA ILE 52 47.925 -9.650 1.826 358 HB ILE 52 HB ILE 52 49.475 -11.420 2.173 359 HG12 ILE 52 2HG1 ILE 52 48.005 -13.349 2.454 360 HG13 ILE 52 3HG1 ILE 52 46.796 -12.339 3.239 361 HG21 ILE 52 1HG2 ILE 52 48.840 -12.639 4.589 362 HG22 ILE 52 2HG2 ILE 52 50.299 -11.722 4.217 363 HG23 ILE 52 3HG2 ILE 52 48.919 -10.917 4.962 364 HD11 ILE 52 3HD1 ILE 52 46.390 -11.147 1.203 365 HD12 ILE 52 1HD1 ILE 52 47.719 -11.982 0.400 366 HD13 ILE 52 2HD1 ILE 52 46.279 -12.878 0.885 367 H LEU 53 H LEU 53 46.007 -8.638 2.266 368 HA LEU 53 HA LEU 53 44.513 -9.646 4.597 369 HB2 LEU 53 2HB LEU 53 43.881 -7.026 3.310 370 HB3 LEU 53 3HB LEU 53 43.529 -7.580 4.946 371 HG LEU 53 HG LEU 53 46.292 -6.884 3.959 372 HD11 LEU 53 1HD1 LEU 53 45.275 -5.048 5.885 373 HD12 LEU 53 2HD1 LEU 53 44.145 -5.144 4.535 374 HD13 LEU 53 3HD1 LEU 53 45.835 -4.736 4.242 375 HD21 LEU 53 3HD2 LEU 53 46.519 -6.648 6.549 376 HD22 LEU 53 1HD2 LEU 53 46.617 -8.238 5.792 377 HD23 LEU 53 2HD2 LEU 53 45.121 -7.725 6.574 378 H SER 54 H SER 54 42.711 -10.730 4.154 379 HA SER 54 HA SER 54 41.300 -10.206 1.638 380 HB2 SER 54 2HB SER 54 42.834 -12.561 2.206 381 HB3 SER 54 3HB SER 54 41.128 -12.999 2.114 382 HG SER 54 HG SER 54 41.078 -12.449 0.049 383 H ILE 55 H ILE 55 39.279 -9.708 2.126 384 HA ILE 55 HA ILE 55 38.019 -11.031 4.440 385 HB ILE 55 HB ILE 55 36.522 -9.011 4.540 386 HG12 ILE 55 2HG1 ILE 55 38.625 -7.878 2.681 387 HG13 ILE 55 3HG1 ILE 55 36.934 -8.158 2.282 388 HG21 ILE 55 1HG2 ILE 55 39.197 -7.901 5.005 389 HG22 ILE 55 2HG2 ILE 55 37.857 -8.144 6.124 390 HG23 ILE 55 3HG2 ILE 55 38.920 -9.491 5.717 391 HD11 ILE 55 3HD1 ILE 55 37.349 -5.815 2.726 392 HD12 ILE 55 1HD1 ILE 55 36.271 -6.497 3.944 393 HD13 ILE 55 2HD1 ILE 55 37.969 -6.212 4.328 394 H SER 56 H SER 56 36.257 -12.207 4.059 395 HA SER 56 HA SER 56 34.832 -11.806 1.510 396 HB2 SER 56 2HB SER 56 35.462 -14.424 2.894 397 HB3 SER 56 3HB SER 56 34.413 -14.262 1.486 398 HG SER 56 HG SER 56 37.070 -13.305 1.480 399 H ASN 57 H ASN 57 32.694 -11.531 1.649 400 HA ASN 57 HA ASN 57 31.439 -11.894 4.281 401 HB2 ASN 57 2HB ASN 57 30.457 -10.228 1.955 402 HB3 ASN 57 3HB ASN 57 29.799 -10.247 3.588 403 HD21 ASN 57 1HD2 ASN 57 30.447 -7.875 2.605 404 HD22 ASN 57 2HD2 ASN 57 31.898 -7.268 3.319 405 H ALA 58 H ALA 58 30.922 -14.078 4.119 406 HA ALA 58 HA ALA 58 29.801 -15.426 1.992 407 HB1 ALA 58 1HB ALA 58 28.605 -16.725 3.982 408 HB2 ALA 58 2HB ALA 58 30.332 -16.876 3.657 409 HB3 ALA 58 3HB ALA 58 29.766 -15.797 4.931 410 H SER 59 H SER 59 27.790 -15.679 1.146 411 HA SER 59 HA SER 59 25.856 -13.631 1.706 412 HB2 SER 59 2HB SER 59 24.968 -14.158 -0.318 413 HB3 SER 59 3HB SER 59 26.490 -15.020 -0.540 414 HG SER 59 HG SER 59 24.343 -16.159 -0.874 415 H ASP 60 H ASP 60 26.426 -16.810 2.809 416 HA ASP 60 HA ASP 60 23.916 -17.823 3.332 417 HB2 ASP 60 2HB ASP 60 26.609 -18.209 4.400 418 HB3 ASP 60 3HB ASP 60 25.350 -18.516 5.594 419 H SER 61 H SER 61 25.857 -15.725 5.459 420 HA SER 61 HA SER 61 23.702 -14.174 6.337 421 HB2 SER 61 2HB SER 61 23.612 -15.074 8.728 422 HB3 SER 61 3HB SER 61 22.797 -16.037 7.496 423 HG SER 61 HG SER 61 24.010 -17.600 8.187 424 H HIS 62 H HIS 62 26.247 -15.658 8.322 425 HA HIS 62 HA HIS 62 27.251 -13.039 9.027 426 HB2 HIS 62 2HB HIS 62 28.560 -14.134 10.667 427 HB3 HIS 62 3HB HIS 62 27.035 -15.014 10.627 428 HD1 HIS 62 HD1 HIS 62 27.135 -17.285 9.091 429 HD2 HIS 62 HD2 HIS 62 30.747 -15.714 10.414 430 HE1 HIS 62 HE1 HIS 62 28.801 -19.156 8.875 431 H GLY 63 H GLY 63 29.363 -12.285 8.658 432 HA2 GLY 63 2HA GLY 63 30.494 -13.224 6.147 433 HA3 GLY 63 3HA GLY 63 30.942 -11.761 7.011 434 H LEU 64 H LEU 64 33.052 -12.891 6.141 435 HA LEU 64 HA LEU 64 34.329 -14.009 8.485 436 HB2 LEU 64 2HB LEU 64 35.337 -15.872 7.122 437 HB3 LEU 64 3HB LEU 64 33.637 -16.053 7.551 438 HG LEU 64 HG LEU 64 34.286 -14.884 4.895 439 HD11 LEU 64 1HD1 LEU 64 34.409 -17.198 3.960 440 HD12 LEU 64 2HD1 LEU 64 34.621 -17.790 5.608 441 HD13 LEU 64 3HD1 LEU 64 35.820 -16.708 4.899 442 HD21 LEU 64 3HD2 LEU 64 32.188 -15.550 4.356 443 HD22 LEU 64 1HD2 LEU 64 31.975 -15.450 6.104 444 HD23 LEU 64 2HD2 LEU 64 32.277 -17.011 5.340 445 H ALA 65 H ALA 65 35.757 -12.354 8.611 446 HA ALA 65 HA ALA 65 37.342 -11.695 6.229 447 HB1 ALA 65 1HB ALA 65 36.473 -9.713 7.068 448 HB2 ALA 65 2HB ALA 65 36.713 -10.201 8.746 449 HB3 ALA 65 3HB ALA 65 38.099 -9.753 7.751 450 H SER 66 H SER 66 39.492 -12.056 6.131 451 HA SER 66 HA SER 66 40.846 -13.027 8.555 452 HB2 SER 66 2HB SER 66 40.201 -14.926 7.052 453 HB3 SER 66 3HB SER 66 41.214 -14.216 5.796 454 HG SER 66 HG SER 66 42.662 -15.454 6.729 455 H THR 67 H THR 67 42.824 -12.206 8.911 456 HA THR 67 HA THR 67 44.286 -10.931 6.728 457 HB THR 67 HB THR 67 44.726 -8.916 8.174 458 HG1 THR 67 HG1 THR 67 43.306 -8.547 9.889 459 HG21 THR 67 3HG2 THR 67 42.831 -7.749 7.415 460 HG22 THR 67 1HG2 THR 67 41.798 -9.172 7.538 461 HG23 THR 67 2HG2 THR 67 43.022 -9.077 6.271 462 H LEU 68 H LEU 68 46.474 -11.018 6.955 463 HA LEU 68 HA LEU 68 47.612 -11.773 9.537 464 HB2 LEU 68 2HB LEU 68 47.243 -13.901 8.531 465 HB3 LEU 68 3HB LEU 68 47.906 -13.353 6.993 466 HG LEU 68 HG LEU 68 49.928 -13.058 8.964 467 HD11 LEU 68 1HD1 LEU 68 48.288 -15.517 9.224 468 HD12 LEU 68 2HD1 LEU 68 49.202 -14.628 10.442 469 HD13 LEU 68 3HD1 LEU 68 50.042 -15.681 9.303 470 HD21 LEU 68 3HD2 LEU 68 50.197 -13.435 6.533 471 HD22 LEU 68 1HD2 LEU 68 49.647 -15.096 6.759 472 HD23 LEU 68 2HD2 LEU 68 51.145 -14.553 7.516 473 H ASN 69 H ASN 69 48.398 -9.588 9.424 474 HA ASN 69 HA ASN 69 50.882 -9.414 7.888 475 HB2 ASN 69 2HB ASN 69 50.421 -7.343 6.919 476 HB3 ASN 69 3HB ASN 69 48.884 -8.188 6.762 477 HD21 ASN 69 1HD2 ASN 69 47.582 -7.933 8.972 478 HD22 ASN 69 2HD2 ASN 69 47.382 -6.286 9.455 479 H GLN 70 H GLN 70 52.397 -7.858 8.737 480 HA GLN 70 HA GLN 70 52.109 -7.558 11.627 481 HB2 GLN 70 2HB GLN 70 54.495 -7.259 9.797 482 HB3 GLN 70 3HB GLN 70 54.546 -6.981 11.533 483 HG2 GLN 70 2HG GLN 70 54.910 -9.130 11.873 484 HG3 GLN 70 3HG GLN 70 53.374 -9.521 11.102 485 HE21 GLN 70 1HE2 GLN 70 56.762 -8.808 10.407 486 HE22 GLN 70 2HE2 GLN 70 56.868 -9.804 9.000 487 H GLY 71 H GLY 71 50.449 -5.829 11.074 488 HA2 GLY 71 2HA GLY 71 51.551 -3.293 11.645 489 HA3 GLY 71 3HA GLY 71 51.143 -3.373 9.937 490 H ASN 72 H ASN 72 49.255 -2.465 9.516 491 HA ASN 72 HA ASN 72 47.025 -2.938 11.375 492 HB2 ASN 72 2HB ASN 72 46.295 -0.664 11.213 493 HB3 ASN 72 3HB ASN 72 48.005 -0.629 11.634 494 HD21 ASN 72 1HD2 ASN 72 45.659 -0.093 9.117 495 HD22 ASN 72 2HD2 ASN 72 46.685 0.838 8.085 496 H VAL 73 H VAL 73 44.902 -2.741 10.404 497 HA VAL 73 HA VAL 73 44.878 -2.971 7.474 498 HB VAL 73 HB VAL 73 43.355 -4.811 9.325 499 HG11 VAL 73 1HG1 VAL 73 43.093 -4.147 6.524 500 HG12 VAL 73 2HG1 VAL 73 43.418 -5.866 6.754 501 HG13 VAL 73 3HG1 VAL 73 42.039 -5.114 7.556 502 HG21 VAL 73 3HG2 VAL 73 45.565 -5.550 9.468 503 HG22 VAL 73 1HG2 VAL 73 44.871 -6.545 8.188 504 HG23 VAL 73 2HG2 VAL 73 45.900 -5.172 7.778 505 H LYS 74 H LYS 74 43.165 -2.037 6.471 506 HA LYS 74 HA LYS 74 41.103 -0.831 8.198 507 HB2 LYS 74 2HB LYS 74 42.598 0.869 7.274 508 HB3 LYS 74 3HB LYS 74 42.299 0.270 5.648 509 HG2 LYS 74 2HG LYS 74 41.026 2.288 6.077 510 HG3 LYS 74 3HG LYS 74 39.951 0.909 5.838 511 HD2 LYS 74 2HD LYS 74 40.599 1.121 8.613 512 HD3 LYS 74 3HD LYS 74 40.046 2.692 8.028 513 HE2 LYS 74 2HE LYS 74 38.449 0.436 7.069 514 HE3 LYS 74 3HE LYS 74 38.430 0.628 8.821 515 HZ1 LYS 74 3HZ LYS 74 37.969 3.088 8.254 516 HZ2 LYS 74 1HZ LYS 74 36.704 1.970 8.147 517 HZ3 LYS 74 2HZ LYS 74 37.492 2.491 6.745 518 H VAL 75 H VAL 75 39.319 -2.022 7.950 519 HA VAL 75 HA VAL 75 38.605 -2.962 5.257 520 HB VAL 75 HB VAL 75 37.586 -3.862 7.956 521 HG11 VAL 75 1HG1 VAL 75 36.724 -4.478 5.170 522 HG12 VAL 75 2HG1 VAL 75 36.654 -5.749 6.392 523 HG13 VAL 75 3HG1 VAL 75 35.755 -4.249 6.625 524 HG21 VAL 75 3HG2 VAL 75 39.656 -4.866 6.078 525 HG22 VAL 75 1HG2 VAL 75 39.618 -4.889 7.841 526 HG23 VAL 75 2HG2 VAL 75 38.665 -6.054 6.923 527 H THR 76 H THR 76 36.692 -2.414 4.308 528 HA THR 76 HA THR 76 34.792 -0.768 5.808 529 HB THR 76 HB THR 76 34.699 0.969 4.182 530 HG1 THR 76 HG1 THR 76 36.585 -0.539 2.663 531 HG21 THR 76 3HG2 THR 76 36.846 1.978 4.379 532 HG22 THR 76 1HG2 THR 76 37.642 0.412 4.528 533 HG23 THR 76 2HG2 THR 76 36.610 1.004 5.830 534 H ALA 77 H ALA 77 32.695 -1.055 5.226 535 HA ALA 77 HA ALA 77 32.043 -2.380 2.719 536 HB1 ALA 77 1HB ALA 77 31.000 -3.581 5.264 537 HB2 ALA 77 2HB ALA 77 30.981 -4.254 3.633 538 HB3 ALA 77 3HB ALA 77 32.501 -4.135 4.520 539 H SER 78 H SER 78 30.075 -1.811 1.938 540 HA SER 78 HA SER 78 28.104 -0.594 3.701 541 HB2 SER 78 2HB SER 78 27.913 1.446 2.403 542 HB3 SER 78 3HB SER 78 29.582 1.270 2.945 543 HG SER 78 HG SER 78 28.919 1.737 0.552 544 H ILE 79 H ILE 79 26.040 -0.907 3.031 545 HA ILE 79 HA ILE 79 25.576 -1.850 0.294 546 HB ILE 79 HB ILE 79 25.772 -3.892 1.551 547 HG12 ILE 79 2HG1 ILE 79 22.842 -3.258 1.137 548 HG13 ILE 79 3HG1 ILE 79 23.960 -3.722 -0.141 549 HG21 ILE 79 1HG2 ILE 79 23.579 -3.726 3.358 550 HG22 ILE 79 2HG2 ILE 79 25.284 -4.004 3.710 551 HG23 ILE 79 3HG2 ILE 79 24.654 -2.358 3.646 552 HD11 ILE 79 3HD1 ILE 79 23.720 -5.876 0.320 553 HD12 ILE 79 1HD1 ILE 79 23.980 -5.614 2.044 554 HD13 ILE 79 2HD1 ILE 79 22.370 -5.408 1.354 555 H GLY 80 H GLY 80 23.607 -1.301 -0.566 556 HA2 GLY 80 2HA GLY 80 21.683 -0.074 -0.816 557 HA3 GLY 80 3HA GLY 80 21.302 -0.584 0.822 558 H GLY 81 H GLY 81 20.799 1.083 2.068 559 HA2 GLY 81 2HA GLY 81 22.142 3.659 1.561 560 HA3 GLY 81 3HA GLY 81 20.559 3.479 2.303 561 H ILE 82 H ILE 82 23.861 2.255 2.886 562 HA ILE 82 HA ILE 82 23.978 3.508 5.462 563 HB ILE 82 HB ILE 82 22.598 1.258 5.641 564 HG12 ILE 82 2HG1 ILE 82 24.155 1.000 7.902 565 HG13 ILE 82 3HG1 ILE 82 24.451 2.666 7.420 566 HG21 ILE 82 1HG2 ILE 82 24.406 -0.051 4.534 567 HG22 ILE 82 2HG2 ILE 82 25.423 0.258 5.940 568 HG23 ILE 82 3HG2 ILE 82 23.935 -0.671 6.117 569 HD11 ILE 82 3HD1 ILE 82 21.639 1.965 7.322 570 HD12 ILE 82 1HD1 ILE 82 22.342 1.755 8.925 571 HD13 ILE 82 2HD1 ILE 82 22.446 3.318 8.114 572 H GLN 83 H GLN 83 26.042 3.267 6.485 573 HA GLN 83 HA GLN 83 28.120 2.050 4.800 574 HB2 GLN 83 2HB GLN 83 29.563 3.969 5.094 575 HB3 GLN 83 3HB GLN 83 28.038 4.492 4.390 576 HG2 GLN 83 2HG GLN 83 27.288 5.275 6.569 577 HG3 GLN 83 3HG GLN 83 28.801 4.731 7.292 578 HE21 GLN 83 1HE2 GLN 83 30.760 5.771 6.623 579 HE22 GLN 83 2HE2 GLN 83 30.724 7.406 6.065 580 H GLY 84 H GLY 84 29.651 0.930 5.876 581 HA2 GLY 84 2HA GLY 84 29.653 1.149 8.824 582 HA3 GLY 84 3HA GLY 84 29.751 -0.396 7.993 583 H SER 85 H SER 85 31.621 0.628 9.902 584 HA SER 85 HA SER 85 34.025 0.549 8.232 585 HB2 SER 85 2HB SER 85 34.899 2.255 10.127 586 HB3 SER 85 3HB SER 85 34.218 2.794 8.592 587 HG SER 85 HG SER 85 32.829 3.800 9.799 588 H THR 86 H THR 86 35.615 -0.703 9.036 589 HA THR 86 HA THR 86 35.511 -1.504 11.854 590 HB THR 86 HB THR 86 34.419 -3.367 11.001 591 HG1 THR 86 HG1 THR 86 36.586 -3.814 12.013 592 HG21 THR 86 3HG2 THR 86 35.996 -2.807 8.551 593 HG22 THR 86 1HG2 THR 86 34.296 -3.242 8.728 594 HG23 THR 86 2HG2 THR 86 35.542 -4.484 8.853 595 H ASP 87 H ASP 87 37.475 -1.823 12.784 596 HA ASP 87 HA ASP 87 39.826 -1.475 11.044 597 HB2 ASP 87 2HB ASP 87 39.630 0.404 12.517 598 HB3 ASP 87 3HB ASP 87 39.361 -0.641 13.909 599 H PHE 88 H PHE 88 41.410 -2.963 11.079 600 HA PHE 88 HA PHE 88 41.270 -5.072 13.129 601 HB2 PHE 88 2HB PHE 88 41.382 -5.293 10.162 602 HB3 PHE 88 3HB PHE 88 42.291 -6.472 11.100 603 HD1 PHE 88 HD2 PHE 88 38.942 -5.165 10.352 604 HD2 PHE 88 HD1 PHE 88 41.189 -8.171 12.361 605 HE1 PHE 88 HE2 PHE 88 36.883 -6.467 10.700 606 HE2 PHE 88 HE1 PHE 88 39.134 -9.478 12.711 607 HZ PHE 88 HZ PHE 88 36.977 -8.626 11.881 608 H LYS 89 H LYS 89 43.026 -4.976 14.350 609 HA LYS 89 HA LYS 89 45.554 -4.082 13.145 610 HB2 LYS 89 2HB LYS 89 44.308 -3.739 15.788 611 HB3 LYS 89 3HB LYS 89 46.021 -4.132 15.837 612 HG2 LYS 89 2HG LYS 89 44.856 -1.873 14.227 613 HG3 LYS 89 3HG LYS 89 45.523 -1.699 15.852 614 HD2 LYS 89 2HD LYS 89 47.135 -2.939 13.649 615 HD3 LYS 89 3HD LYS 89 47.037 -1.186 13.822 616 HE2 LYS 89 2HE LYS 89 47.567 -2.425 16.365 617 HE3 LYS 89 3HE LYS 89 48.752 -2.947 15.168 618 HZ1 LYS 89 3HZ LYS 89 48.393 -0.363 16.392 619 HZ2 LYS 89 1HZ LYS 89 48.592 -0.296 14.714 620 HZ3 LYS 89 2HZ LYS 89 49.768 -1.040 15.675 621 H VAL 90 H VAL 90 46.759 -5.740 12.486 622 HA VAL 90 HA VAL 90 46.786 -8.206 14.086 623 HB VAL 90 HB VAL 90 47.799 -7.784 11.271 624 HG11 VAL 90 1HG1 VAL 90 47.861 -10.239 11.188 625 HG12 VAL 90 2HG1 VAL 90 48.943 -9.592 12.423 626 HG13 VAL 90 3HG1 VAL 90 47.395 -10.299 12.888 627 HG21 VAL 90 3HG2 VAL 90 45.134 -8.342 12.336 628 HG22 VAL 90 1HG2 VAL 90 45.623 -7.767 10.741 629 HG23 VAL 90 2HG2 VAL 90 45.666 -9.491 11.109 630 H THR 91 H THR 91 48.337 -8.106 15.589 631 HA THR 91 HA THR 91 50.946 -6.966 14.866 632 HB THR 91 HB THR 91 51.412 -6.913 17.287 633 HG1 THR 91 HG1 THR 91 49.663 -7.396 18.717 634 HG21 THR 91 3HG2 THR 91 48.729 -5.631 16.919 635 HG22 THR 91 1HG2 THR 91 50.114 -5.083 15.976 636 HG23 THR 91 2HG2 THR 91 50.160 -5.006 17.737 637 H GLN 92 H GLN 92 52.855 -8.069 15.926 638 HA GLN 92 HA GLN 92 52.683 -10.923 15.350 639 HB2 GLN 92 2HB GLN 92 55.183 -10.821 15.486 640 HB3 GLN 92 3HB GLN 92 54.479 -9.799 14.240 641 HG2 GLN 92 2HG GLN 92 54.685 -8.265 16.614 642 HG3 GLN 92 3HG GLN 92 56.227 -9.078 16.347 643 HE21 GLN 92 1HE2 GLN 92 54.208 -6.523 15.442 644 HE22 GLN 92 2HE2 GLN 92 55.139 -5.933 14.112 Start of MODEL 9 1 H1 MET 1 H MET 1 14.535 -0.906 -9.056 2 HA MET 1 HA MET 1 15.375 0.467 -7.301 3 HB2 MET 1 2HB MET 1 13.691 1.903 -6.051 4 HB3 MET 1 3HB MET 1 14.085 2.410 -7.688 5 HG2 MET 1 2HG MET 1 12.028 1.754 -8.526 6 HG3 MET 1 3HG MET 1 11.711 0.674 -7.171 7 HE1 MET 1 3HE MET 1 9.159 2.272 -7.681 8 HE2 MET 1 1HE MET 1 9.571 1.220 -6.326 9 HE3 MET 1 2HE MET 1 8.896 2.821 -6.024 10 HA PRO 2 HA PRO 2 13.348 -3.191 -5.238 11 HB2 PRO 2 2HB PRO 2 15.657 -4.565 -4.844 12 HB3 PRO 2 3HB PRO 2 14.703 -4.693 -6.327 13 HG2 PRO 2 2HG PRO 2 17.159 -3.068 -5.788 14 HG3 PRO 2 3HG PRO 2 16.750 -4.037 -7.216 15 HD2 PRO 2 2HD PRO 2 16.466 -1.345 -7.152 16 HD3 PRO 2 3HD PRO 2 15.391 -2.396 -8.095 17 H ALA 3 H ALA 3 13.409 -3.707 -3.037 18 HA ALA 3 HA ALA 3 13.762 -3.383 -0.811 19 HB1 ALA 3 1HB ALA 3 16.452 -2.269 -1.583 20 HB2 ALA 3 2HB ALA 3 15.977 -2.952 -0.028 21 HB3 ALA 3 3HB ALA 3 16.099 -3.992 -1.447 22 H ALA 4 H ALA 4 12.509 -1.874 0.065 23 HA ALA 4 HA ALA 4 13.040 0.952 -0.557 24 HB1 ALA 4 1HB ALA 4 10.546 -0.462 0.351 25 HB2 ALA 4 2HB ALA 4 10.707 1.295 0.362 26 HB3 ALA 4 3HB ALA 4 10.823 0.408 -1.158 27 H LEU 5 H LEU 5 14.152 2.012 0.938 28 HA LEU 5 HA LEU 5 14.879 2.796 2.945 29 HB2 LEU 5 2HB LEU 5 12.207 2.498 3.269 30 HB3 LEU 5 3HB LEU 5 12.811 1.444 4.545 31 HG LEU 5 HG LEU 5 14.276 3.665 5.016 32 HD11 LEU 5 1HD1 LEU 5 12.827 5.611 4.826 33 HD12 LEU 5 2HD1 LEU 5 11.610 4.639 4.000 34 HD13 LEU 5 3HD1 LEU 5 13.173 4.928 3.237 35 HD21 LEU 5 3HD2 LEU 5 13.264 2.860 6.876 36 HD22 LEU 5 1HD2 LEU 5 11.730 2.574 6.053 37 HD23 LEU 5 2HD2 LEU 5 12.165 4.205 6.564 38 H VAL 6 H VAL 6 15.733 0.214 1.933 39 HA VAL 6 HA VAL 6 15.894 -1.842 3.740 40 HB VAL 6 HB VAL 6 16.838 -2.151 1.577 41 HG11 VAL 6 1HG1 VAL 6 19.270 -0.791 1.536 42 HG12 VAL 6 2HG1 VAL 6 17.830 -0.426 0.582 43 HG13 VAL 6 3HG1 VAL 6 18.097 0.387 2.125 44 HG21 VAL 6 3HG2 VAL 6 18.595 -3.461 2.171 45 HG22 VAL 6 1HG2 VAL 6 19.369 -2.186 3.112 46 HG23 VAL 6 2HG2 VAL 6 18.010 -3.082 3.791 47 H SER 7 H SER 7 16.191 -1.496 5.868 48 HA SER 7 HA SER 7 18.426 0.200 6.727 49 HB2 SER 7 2HB SER 7 15.822 0.049 7.639 50 HB3 SER 7 3HB SER 7 16.715 -0.888 8.837 51 HG SER 7 HG SER 7 18.172 0.968 8.932 52 H ILE 8 H ILE 8 20.263 -0.724 7.314 53 HA ILE 8 HA ILE 8 20.197 -3.519 8.251 54 HB ILE 8 HB ILE 8 22.278 -3.947 7.255 55 HG12 ILE 8 2HG1 ILE 8 23.286 -1.775 5.971 56 HG13 ILE 8 3HG1 ILE 8 22.571 -1.009 7.385 57 HG21 ILE 8 1HG2 ILE 8 21.420 -2.216 5.051 58 HG22 ILE 8 2HG2 ILE 8 21.620 -3.966 5.110 59 HG23 ILE 8 3HG2 ILE 8 20.144 -3.226 5.731 60 HD11 ILE 8 3HD1 ILE 8 24.512 -1.466 8.371 61 HD12 ILE 8 1HD1 ILE 8 23.906 -3.117 8.488 62 HD13 ILE 8 2HD1 ILE 8 24.959 -2.657 7.150 63 H SER 9 H SER 9 21.405 -4.089 10.034 64 HA SER 9 HA SER 9 22.605 -1.854 11.537 65 HB2 SER 9 2HB SER 9 21.256 -4.295 12.715 66 HB3 SER 9 3HB SER 9 21.866 -2.894 13.596 67 HG SER 9 HG SER 9 19.496 -3.055 13.009 68 H VAL 10 H VAL 10 24.743 -2.060 11.425 69 HA VAL 10 HA VAL 10 25.924 -4.749 11.574 70 HB VAL 10 HB VAL 10 26.531 -3.366 9.601 71 HG11 VAL 10 1HG1 VAL 10 26.683 -1.298 11.394 72 HG12 VAL 10 2HG1 VAL 10 28.381 -1.655 11.071 73 HG13 VAL 10 3HG1 VAL 10 27.291 -1.268 9.739 74 HG21 VAL 10 3HG2 VAL 10 29.160 -3.438 10.600 75 HG22 VAL 10 1HG2 VAL 10 28.282 -4.742 11.400 76 HG23 VAL 10 2HG2 VAL 10 28.334 -4.665 9.639 77 H SER 11 H SER 11 27.223 -5.322 13.223 78 HA SER 11 HA SER 11 27.801 -3.272 15.261 79 HB2 SER 11 2HB SER 11 26.172 -5.087 15.919 80 HB3 SER 11 3HB SER 11 27.496 -6.241 15.754 81 HG SER 11 HG SER 11 28.136 -5.660 17.657 82 HA PRO 12 HA PRO 12 31.833 -4.890 13.570 83 HB2 PRO 12 2HB PRO 12 32.947 -2.441 13.208 84 HB3 PRO 12 3HB PRO 12 31.951 -3.233 11.982 85 HG2 PRO 12 2HG PRO 12 31.197 -1.109 13.952 86 HG3 PRO 12 3HG PRO 12 30.775 -1.243 12.235 87 HD2 PRO 12 2HD PRO 12 29.063 -1.939 14.214 88 HD3 PRO 12 3HD PRO 12 29.084 -2.757 12.639 89 H THR 13 H THR 13 33.863 -4.873 14.604 90 HA THR 13 HA THR 13 33.850 -3.660 17.291 91 HB THR 13 HB THR 13 35.714 -5.882 16.926 92 HG1 THR 13 HG1 THR 13 32.923 -6.458 16.870 93 HG21 THR 13 3HG2 THR 13 34.623 -4.606 19.029 94 HG22 THR 13 1HG2 THR 13 35.256 -6.249 19.117 95 HG23 THR 13 2HG2 THR 13 33.526 -5.981 18.910 96 H ASN 14 H ASN 14 35.183 -1.980 17.383 97 HA ASN 14 HA ASN 14 37.474 -1.814 15.601 98 HB2 ASN 14 2HB ASN 14 36.629 0.211 17.674 99 HB3 ASN 14 3HB ASN 14 37.638 0.476 16.255 100 HD21 ASN 14 1HD2 ASN 14 36.701 0.811 14.293 101 HD22 ASN 14 2HD2 ASN 14 34.997 0.995 14.068 102 H SER 15 H SER 15 38.996 -3.236 16.353 103 HA SER 15 HA SER 15 40.468 -2.407 18.692 104 HB2 SER 15 2HB SER 15 38.562 -4.118 19.340 105 HB3 SER 15 3HB SER 15 39.704 -5.299 18.697 106 HG SER 15 HG SER 15 39.874 -4.800 21.009 107 H THR 16 H THR 16 42.131 -4.533 19.035 108 HA THR 16 HA THR 16 43.480 -4.666 16.427 109 HB THR 16 HB THR 16 45.544 -4.989 17.583 110 HG1 THR 16 HG1 THR 16 43.900 -5.347 19.876 111 HG21 THR 16 3HG2 THR 16 45.756 -2.847 18.207 112 HG22 THR 16 1HG2 THR 16 44.567 -3.017 19.498 113 HG23 THR 16 2HG2 THR 16 44.036 -2.698 17.847 114 H VAL 17 H VAL 17 44.527 -6.635 15.790 115 HA VAL 17 HA VAL 17 43.451 -9.058 17.070 116 HB VAL 17 HB VAL 17 43.111 -10.095 14.898 117 HG11 VAL 17 1HG1 VAL 17 41.124 -8.978 14.279 118 HG12 VAL 17 2HG1 VAL 17 41.325 -8.683 16.007 119 HG13 VAL 17 3HG1 VAL 17 41.734 -7.422 14.843 120 HG21 VAL 17 3HG2 VAL 17 43.284 -8.779 12.828 121 HG22 VAL 17 1HG2 VAL 17 43.946 -7.432 13.754 122 HG23 VAL 17 2HG2 VAL 17 44.842 -8.946 13.637 123 H ALA 18 H ALA 18 44.710 -10.976 16.762 124 HA ALA 18 HA ALA 18 47.511 -10.510 16.913 125 HB1 ALA 18 1HB ALA 18 47.594 -13.063 16.894 126 HB2 ALA 18 2HB ALA 18 46.720 -12.288 18.216 127 HB3 ALA 18 3HB ALA 18 45.831 -12.997 16.868 128 H LYS 19 H LYS 19 49.059 -11.909 15.589 129 HA LYS 19 HA LYS 19 48.883 -11.123 12.880 130 HB2 LYS 19 2HB LYS 19 51.019 -11.454 14.087 131 HB3 LYS 19 3HB LYS 19 50.707 -13.184 14.134 132 HG2 LYS 19 2HG LYS 19 50.896 -13.361 11.767 133 HG3 LYS 19 3HG LYS 19 50.943 -11.606 11.584 134 HD2 LYS 19 2HD LYS 19 53.177 -12.077 11.441 135 HD3 LYS 19 3HD LYS 19 53.029 -11.844 13.185 136 HE2 LYS 19 2HE LYS 19 52.897 -14.223 13.537 137 HE3 LYS 19 3HE LYS 19 52.864 -14.518 11.799 138 HZ1 LYS 19 3HZ LYS 19 55.099 -14.169 13.508 139 HZ2 LYS 19 1HZ LYS 19 55.129 -13.018 12.267 140 HZ3 LYS 19 2HZ LYS 19 55.059 -14.666 11.891 141 H GLY 20 H GLY 20 47.834 -12.040 11.246 142 HA2 GLY 20 2HA GLY 20 46.776 -13.607 9.943 143 HA3 GLY 20 3HA GLY 20 47.784 -14.810 10.733 144 H LEU 21 H LEU 21 44.654 -13.548 10.408 145 HA LEU 21 HA LEU 21 43.428 -15.651 11.782 146 HB2 LEU 21 2HB LEU 21 44.437 -13.896 13.583 147 HB3 LEU 21 3HB LEU 21 42.822 -13.232 13.343 148 HG LEU 21 HG LEU 21 42.524 -16.014 13.746 149 HD11 LEU 21 1HD1 LEU 21 44.404 -16.484 14.905 150 HD12 LEU 21 2HD1 LEU 21 43.493 -15.760 16.230 151 HD13 LEU 21 3HD1 LEU 21 44.684 -14.800 15.352 152 HD21 LEU 21 3HD2 LEU 21 42.006 -14.107 15.950 153 HD22 LEU 21 1HD2 LEU 21 40.958 -15.333 15.237 154 HD23 LEU 21 2HD2 LEU 21 41.203 -13.794 14.411 155 H GLN 22 H GLN 22 41.044 -15.312 12.021 156 HA GLN 22 HA GLN 22 40.071 -13.282 10.120 157 HB2 GLN 22 2HB GLN 22 38.247 -15.037 9.619 158 HB3 GLN 22 3HB GLN 22 39.839 -15.263 8.907 159 HG2 GLN 22 2HG GLN 22 40.291 -17.100 10.148 160 HG3 GLN 22 3HG GLN 22 39.354 -16.535 11.530 161 HE21 GLN 22 1HE2 GLN 22 37.244 -17.104 11.721 162 HE22 GLN 22 2HE2 GLN 22 36.439 -18.189 10.643 163 H GLU 23 H GLU 23 38.085 -12.325 10.559 164 HA GLU 23 HA GLU 23 36.917 -12.944 13.191 165 HB2 GLU 23 2HB GLU 23 37.988 -10.412 12.159 166 HB3 GLU 23 3HB GLU 23 36.380 -10.277 12.855 167 HG2 GLU 23 2HG GLU 23 37.621 -11.750 14.749 168 HG3 GLU 23 3HG GLU 23 38.965 -10.782 14.148 169 H ASN 24 H ASN 24 34.825 -13.411 13.120 170 HA ASN 24 HA ASN 24 33.349 -12.961 10.655 171 HB2 ASN 24 2HB ASN 24 32.182 -14.289 13.078 172 HB3 ASN 24 3HB ASN 24 31.864 -14.605 11.375 173 HD21 ASN 24 1HD2 ASN 24 32.656 -16.368 13.626 174 HD22 ASN 24 2HD2 ASN 24 34.064 -17.201 13.069 175 H PHE 25 H PHE 25 31.567 -11.678 10.439 176 HA PHE 25 HA PHE 25 30.879 -9.991 12.755 177 HB2 PHE 25 2HB PHE 25 30.663 -9.148 9.865 178 HB3 PHE 25 3HB PHE 25 30.542 -8.131 11.297 179 HD1 PHE 25 HD1 PHE 25 32.720 -8.316 12.868 180 HD2 PHE 25 HD2 PHE 25 32.606 -9.009 8.670 181 HE1 PHE 25 HE1 PHE 25 35.127 -7.828 12.725 182 HE2 PHE 25 HE2 PHE 25 35.013 -8.523 8.521 183 HZ PHE 25 HZ PHE 25 36.277 -7.932 10.550 184 H LYS 26 H LYS 26 28.663 -8.775 12.073 185 HA LYS 26 HA LYS 26 26.781 -10.694 10.936 186 HB2 LYS 26 2HB LYS 26 27.120 -10.667 13.637 187 HB3 LYS 26 3HB LYS 26 25.843 -9.471 13.451 188 HG2 LYS 26 2HG LYS 26 24.382 -11.034 12.467 189 HG3 LYS 26 3HG LYS 26 25.680 -12.203 12.216 190 HD2 LYS 26 2HD LYS 26 25.551 -11.541 14.990 191 HD3 LYS 26 3HD LYS 26 23.934 -11.971 14.429 192 HE2 LYS 26 2HE LYS 26 25.030 -14.004 13.352 193 HE3 LYS 26 3HE LYS 26 26.451 -13.613 14.319 194 HZ1 LYS 26 3HZ LYS 26 24.042 -14.903 15.107 195 HZ2 LYS 26 1HZ LYS 26 24.344 -13.550 16.077 196 HZ3 LYS 26 2HZ LYS 26 25.508 -14.770 15.941 197 H ALA 27 H ALA 27 25.380 -9.693 9.649 198 HA ALA 27 HA ALA 27 24.617 -6.923 10.229 199 HB1 ALA 27 1HB ALA 27 24.788 -6.869 7.505 200 HB2 ALA 27 2HB ALA 27 25.997 -6.218 8.613 201 HB3 ALA 27 3HB ALA 27 26.195 -7.838 7.944 202 H THR 28 H THR 28 22.485 -6.695 10.158 203 HA THR 28 HA THR 28 20.920 -8.618 8.563 204 HB THR 28 HB THR 28 19.055 -7.854 10.266 205 HG1 THR 28 HG1 THR 28 19.910 -6.588 11.738 206 HG21 THR 28 3HG2 THR 28 20.288 -9.670 11.882 207 HG22 THR 28 1HG2 THR 28 21.088 -9.972 10.340 208 HG23 THR 28 2HG2 THR 28 19.331 -10.081 10.459 209 H GLY 29 H GLY 29 20.450 -7.548 6.720 210 HA2 GLY 29 2HA GLY 29 19.392 -4.804 6.962 211 HA3 GLY 29 3HA GLY 29 20.152 -5.459 5.520 212 H ILE 30 H ILE 30 17.278 -4.557 6.757 213 HA ILE 30 HA ILE 30 15.815 -6.402 4.989 214 HB ILE 30 HB ILE 30 13.940 -6.453 6.484 215 HG12 ILE 30 2HG1 ILE 30 14.625 -5.365 8.884 216 HG13 ILE 30 3HG1 ILE 30 15.389 -4.230 7.777 217 HG21 ILE 30 1HG2 ILE 30 16.446 -7.558 7.077 218 HG22 ILE 30 2HG2 ILE 30 15.782 -7.007 8.614 219 HG23 ILE 30 3HG2 ILE 30 14.865 -8.129 7.610 220 HD11 ILE 30 3HD1 ILE 30 12.835 -4.647 6.748 221 HD12 ILE 30 1HD1 ILE 30 12.623 -4.510 8.493 222 HD13 ILE 30 2HD1 ILE 30 13.430 -3.222 7.598 223 H PHE 31 H PHE 31 14.351 -5.502 3.633 224 HA PHE 31 HA PHE 31 14.039 -2.577 3.777 225 HB2 PHE 31 2HB PHE 31 13.344 -3.190 1.217 226 HB3 PHE 31 3HB PHE 31 14.963 -2.711 1.717 227 HD1 PHE 31 HD2 PHE 31 16.705 -4.423 2.065 228 HD2 PHE 31 HD1 PHE 31 12.875 -5.397 0.485 229 HE1 PHE 31 HE2 PHE 31 17.593 -6.565 1.243 230 HE2 PHE 31 HE1 PHE 31 13.756 -7.542 -0.339 231 HZ PHE 31 HZ PHE 31 16.119 -8.127 0.039 232 H THR 32 H THR 32 12.013 -1.660 3.334 233 HA THR 32 HA THR 32 9.792 -3.130 4.303 234 HB THR 32 HB THR 32 8.460 -1.158 3.828 235 HG1 THR 32 HG1 THR 32 9.071 -0.322 1.935 236 HG21 THR 32 3HG2 THR 32 11.215 -0.598 4.910 237 HG22 THR 32 1HG2 THR 32 9.744 -0.951 5.814 238 HG23 THR 32 2HG2 THR 32 9.908 0.584 4.961 239 H ASP 33 H ASP 33 11.141 -2.724 1.173 240 HA ASP 33 HA ASP 33 8.730 -3.312 -0.285 241 HB2 ASP 33 2HB ASP 33 10.857 -2.012 -1.075 242 HB3 ASP 33 3HB ASP 33 11.480 -3.618 -1.441 243 H ASN 34 H ASN 34 10.659 -5.152 1.634 244 HA ASN 34 HA ASN 34 9.492 -7.579 1.063 245 HB2 ASN 34 2HB ASN 34 11.583 -6.906 -0.830 246 HB3 ASN 34 3HB ASN 34 11.970 -8.383 0.046 247 HD21 ASN 34 1HD2 ASN 34 9.946 -9.851 0.290 248 HD22 ASN 34 2HD2 ASN 34 9.071 -10.122 -1.175 249 H SER 35 H SER 35 9.582 -7.725 3.290 250 HA SER 35 HA SER 35 11.792 -7.345 4.921 251 HB2 SER 35 2HB SER 35 10.478 -9.278 6.286 252 HB3 SER 35 3HB SER 35 9.955 -7.595 6.241 253 HG SER 35 HG SER 35 8.310 -9.203 5.723 254 H ASN 36 H ASN 36 13.707 -8.213 4.301 255 HA ASN 36 HA ASN 36 13.974 -11.101 4.552 256 HB2 ASN 36 2HB ASN 36 13.809 -9.966 2.026 257 HB3 ASN 36 3HB ASN 36 15.543 -10.128 2.292 258 HD21 ASN 36 1HD2 ASN 36 12.526 -11.799 1.930 259 HD22 ASN 36 2HD2 ASN 36 13.192 -13.379 1.716 260 H SER 37 H SER 37 16.338 -11.740 4.515 261 HA SER 37 HA SER 37 17.776 -9.924 6.247 262 HB2 SER 37 2HB SER 37 18.058 -12.781 5.437 263 HB3 SER 37 3HB SER 37 19.497 -11.943 6.018 264 HG SER 37 HG SER 37 17.149 -12.614 7.373 265 H ASP 38 H ASP 38 20.143 -9.578 5.888 266 HA ASP 38 HA ASP 38 20.577 -8.247 3.451 267 HB2 ASP 38 2HB ASP 38 21.937 -8.551 5.932 268 HB3 ASP 38 3HB ASP 38 23.085 -8.908 4.645 269 H ILE 39 H ILE 39 20.588 -9.323 1.573 270 HA ILE 39 HA ILE 39 22.751 -10.953 0.838 271 HB ILE 39 HB ILE 39 21.593 -12.635 2.233 272 HG12 ILE 39 2HG1 ILE 39 22.810 -13.025 -0.112 273 HG13 ILE 39 3HG1 ILE 39 22.099 -14.350 0.803 274 HG21 ILE 39 1HG2 ILE 39 19.459 -13.588 1.388 275 HG22 ILE 39 2HG2 ILE 39 19.312 -11.936 1.986 276 HG23 ILE 39 3HG2 ILE 39 19.358 -12.245 0.250 277 HD11 ILE 39 3HD1 ILE 39 21.623 -14.162 -1.718 278 HD12 ILE 39 1HD1 ILE 39 20.291 -14.532 -0.623 279 HD13 ILE 39 2HD1 ILE 39 20.491 -12.894 -1.248 280 H THR 40 H THR 40 19.452 -9.931 0.267 281 HA THR 40 HA THR 40 19.306 -10.603 -2.474 282 HB THR 40 HB THR 40 17.832 -8.462 -0.928 283 HG1 THR 40 HG1 THR 40 16.183 -10.058 -0.901 284 HG21 THR 40 3HG2 THR 40 16.182 -8.619 -2.797 285 HG22 THR 40 1HG2 THR 40 17.357 -9.583 -3.690 286 HG23 THR 40 2HG2 THR 40 17.727 -7.912 -3.266 287 H ASP 41 H ASP 41 20.485 -7.767 -0.759 288 HA ASP 41 HA ASP 41 21.045 -6.399 -3.278 289 HB2 ASP 41 2HB ASP 41 20.959 -5.583 -0.406 290 HB3 ASP 41 3HB ASP 41 21.962 -4.651 -1.514 291 H GLN 42 H GLN 42 22.590 -8.377 -0.975 292 HA GLN 42 HA GLN 42 24.741 -9.048 -0.658 293 HB2 GLN 42 2HB GLN 42 24.477 -9.697 -3.019 294 HB3 GLN 42 3HB GLN 42 25.041 -8.108 -3.516 295 HG2 GLN 42 2HG GLN 42 27.020 -9.061 -1.812 296 HG3 GLN 42 3HG GLN 42 26.546 -10.452 -2.785 297 HE21 GLN 42 1HE2 GLN 42 26.682 -10.279 -5.078 298 HE22 GLN 42 2HE2 GLN 42 27.794 -9.177 -5.808 299 H VAL 43 H VAL 43 25.366 -7.569 0.902 300 HA VAL 43 HA VAL 43 26.236 -4.930 0.318 301 HB VAL 43 HB VAL 43 25.435 -5.621 2.553 302 HG11 VAL 43 1HG1 VAL 43 27.867 -6.685 3.603 303 HG12 VAL 43 2HG1 VAL 43 26.256 -7.405 3.589 304 HG13 VAL 43 3HG1 VAL 43 27.352 -7.667 2.232 305 HG21 VAL 43 3HG2 VAL 43 27.170 -3.712 2.005 306 HG22 VAL 43 1HG2 VAL 43 26.726 -4.096 3.669 307 HG23 VAL 43 2HG2 VAL 43 28.235 -4.711 2.994 308 H THR 44 H THR 44 28.336 -4.072 0.314 309 HA THR 44 HA THR 44 30.364 -5.949 -0.639 310 HB THR 44 HB THR 44 30.900 -3.024 -0.594 311 HG1 THR 44 HG1 THR 44 29.414 -2.551 -2.071 312 HG21 THR 44 3HG2 THR 44 32.555 -4.508 -1.532 313 HG22 THR 44 1HG2 THR 44 31.831 -3.565 -2.835 314 HG23 THR 44 2HG2 THR 44 31.351 -5.244 -2.590 315 H TRP 45 H TRP 45 31.720 -6.755 0.815 316 HA TRP 45 HA TRP 45 32.708 -4.975 2.944 317 HB2 TRP 45 2HB TRP 45 31.172 -7.279 3.307 318 HB3 TRP 45 3HB TRP 45 32.821 -7.785 3.664 319 HD1 TRP 45 HD1 TRP 45 33.804 -5.052 5.037 320 HE1 TRP 45 HE1 TRP 45 32.938 -4.465 7.389 321 HE3 TRP 45 HE3 TRP 45 29.599 -7.960 5.104 322 HZ2 TRP 45 HZ2 TRP 45 30.762 -5.145 9.052 323 HZ3 TRP 45 HZ3 TRP 45 28.180 -7.935 7.114 324 HH2 TRP 45 HH2 TRP 45 28.751 -6.556 9.046 325 H ASP 46 H ASP 46 34.840 -4.719 2.963 326 HA ASP 46 HA ASP 46 36.549 -6.851 1.894 327 HB2 ASP 46 2HB ASP 46 36.299 -5.267 0.071 328 HB3 ASP 46 3HB ASP 46 36.713 -3.927 1.137 329 H SER 47 H SER 47 38.570 -7.020 2.835 330 HA SER 47 HA SER 47 39.125 -5.184 5.069 331 HB2 SER 47 2HB SER 47 38.419 -7.062 6.245 332 HB3 SER 47 3HB SER 47 39.059 -8.182 5.044 333 HG SER 47 HG SER 47 40.324 -8.126 6.961 334 H SER 48 H SER 48 41.215 -4.560 5.338 335 HA SER 48 HA SER 48 43.373 -4.110 4.773 336 HB2 SER 48 2HB SER 48 43.184 -6.875 5.120 337 HB3 SER 48 3HB SER 48 44.073 -6.679 3.610 338 HG SER 48 HG SER 48 45.299 -6.665 5.685 339 H ASN 49 H ASN 49 45.048 -4.454 2.854 340 HA ASN 49 HA ASN 49 44.149 -4.928 0.255 341 HB2 ASN 49 2HB ASN 49 42.970 -2.640 1.193 342 HB3 ASN 49 3HB ASN 49 44.402 -2.001 0.391 343 HD21 ASN 49 1HD2 ASN 49 43.799 -1.254 -1.508 344 HD22 ASN 49 2HD2 ASN 49 42.797 -2.076 -2.650 345 H THR 50 H THR 50 46.465 -5.289 1.905 346 HA THR 50 HA THR 50 48.481 -3.662 0.511 347 HB THR 50 HB THR 50 50.028 -4.728 2.303 348 HG1 THR 50 HG1 THR 50 47.602 -4.900 3.756 349 HG21 THR 50 3HG2 THR 50 49.358 -2.978 3.955 350 HG22 THR 50 1HG2 THR 50 47.930 -2.664 2.971 351 HG23 THR 50 2HG2 THR 50 49.539 -2.376 2.307 352 H ASP 51 H ASP 51 48.587 -6.913 1.948 353 HA ASP 51 HA ASP 51 49.524 -7.945 -0.646 354 HB2 ASP 51 2HB ASP 51 50.659 -8.422 2.103 355 HB3 ASP 51 3HB ASP 51 50.944 -9.547 0.778 356 H ILE 52 H ILE 52 48.872 -9.453 2.506 357 HA ILE 52 HA ILE 52 47.197 -11.431 1.165 358 HB ILE 52 HB ILE 52 48.170 -11.335 4.024 359 HG12 ILE 52 2HG1 ILE 52 49.461 -13.422 3.022 360 HG13 ILE 52 3HG1 ILE 52 49.239 -12.547 1.510 361 HG21 ILE 52 1HG2 ILE 52 47.508 -13.799 3.916 362 HG22 ILE 52 2HG2 ILE 52 46.208 -12.615 4.048 363 HG23 ILE 52 3HG2 ILE 52 46.569 -13.358 2.490 364 HD11 ILE 52 3HD1 ILE 52 51.178 -12.143 3.544 365 HD12 ILE 52 1HD1 ILE 52 51.010 -11.322 1.992 366 HD13 ILE 52 2HD1 ILE 52 50.180 -10.695 3.417 367 H LEU 53 H LEU 53 45.066 -11.234 1.114 368 HA LEU 53 HA LEU 53 43.588 -10.304 3.405 369 HB2 LEU 53 2HB LEU 53 42.451 -8.488 2.291 370 HB3 LEU 53 3HB LEU 53 44.189 -8.197 2.314 371 HG LEU 53 HG LEU 53 43.632 -9.472 -0.133 372 HD11 LEU 53 1HD1 LEU 53 41.321 -8.979 -0.016 373 HD12 LEU 53 2HD1 LEU 53 42.034 -7.774 -1.087 374 HD13 LEU 53 3HD1 LEU 53 41.626 -7.345 0.574 375 HD21 LEU 53 3HD2 LEU 53 44.638 -6.892 0.860 376 HD22 LEU 53 1HD2 LEU 53 44.009 -6.878 -0.788 377 HD23 LEU 53 2HD2 LEU 53 45.309 -7.987 -0.350 378 H SER 54 H SER 54 41.777 -11.452 3.552 379 HA SER 54 HA SER 54 40.484 -12.414 1.101 380 HB2 SER 54 2HB SER 54 42.039 -14.080 2.656 381 HB3 SER 54 3HB SER 54 40.415 -14.374 3.278 382 HG SER 54 HG SER 54 40.277 -15.637 1.599 383 H ILE 55 H ILE 55 38.281 -12.524 1.187 384 HA ILE 55 HA ILE 55 36.939 -12.130 3.752 385 HB ILE 55 HB ILE 55 35.685 -10.245 3.093 386 HG12 ILE 55 2HG1 ILE 55 35.239 -10.930 0.776 387 HG13 ILE 55 3HG1 ILE 55 35.783 -9.258 0.849 388 HG21 ILE 55 1HG2 ILE 55 38.555 -9.890 2.248 389 HG22 ILE 55 2HG2 ILE 55 37.428 -8.560 2.509 390 HG23 ILE 55 3HG2 ILE 55 37.867 -9.619 3.849 391 HD11 ILE 55 3HD1 ILE 55 38.117 -10.251 0.365 392 HD12 ILE 55 1HD1 ILE 55 37.215 -11.666 -0.175 393 HD13 ILE 55 2HD1 ILE 55 36.950 -10.103 -0.948 394 H SER 56 H SER 56 34.945 -13.053 3.873 395 HA SER 56 HA SER 56 33.886 -14.275 1.409 396 HB2 SER 56 2HB SER 56 34.275 -15.468 4.138 397 HB3 SER 56 3HB SER 56 33.007 -16.080 3.076 398 HG SER 56 HG SER 56 34.499 -16.781 1.667 399 H ASN 57 H ASN 57 32.055 -13.274 0.907 400 HA ASN 57 HA ASN 57 29.969 -13.031 2.916 401 HB2 ASN 57 2HB ASN 57 29.518 -10.655 2.290 402 HB3 ASN 57 3HB ASN 57 31.046 -10.882 3.135 403 HD21 ASN 57 1HD2 ASN 57 32.991 -10.974 1.828 404 HD22 ASN 57 2HD2 ASN 57 33.063 -10.059 0.364 405 H ALA 58 H ALA 58 29.176 -14.756 1.514 406 HA ALA 58 HA ALA 58 27.824 -13.661 -0.864 407 HB1 ALA 58 1HB ALA 58 29.817 -15.427 -1.092 408 HB2 ALA 58 2HB ALA 58 28.473 -16.546 -0.858 409 HB3 ALA 58 3HB ALA 58 28.437 -15.391 -2.190 410 H SER 59 H SER 59 27.761 -15.988 1.782 411 HA SER 59 HA SER 59 25.297 -17.180 1.326 412 HB2 SER 59 2HB SER 59 26.452 -16.468 4.032 413 HB3 SER 59 3HB SER 59 25.277 -17.738 3.689 414 HG SER 59 HG SER 59 27.368 -18.600 3.851 415 H ASP 60 H ASP 60 26.053 -14.148 2.983 416 HA ASP 60 HA ASP 60 23.660 -12.887 2.286 417 HB2 ASP 60 2HB ASP 60 22.891 -12.830 4.861 418 HB3 ASP 60 3HB ASP 60 22.270 -14.005 3.704 419 H SER 61 H SER 61 25.194 -12.895 5.488 420 HA SER 61 HA SER 61 26.521 -10.364 4.839 421 HB2 SER 61 2HB SER 61 24.212 -10.620 6.520 422 HB3 SER 61 3HB SER 61 25.590 -10.133 7.509 423 HG SER 61 HG SER 61 25.147 -8.842 5.061 424 H HIS 62 H HIS 62 25.999 -12.238 7.821 425 HA HIS 62 HA HIS 62 28.523 -11.921 8.885 426 HB2 HIS 62 2HB HIS 62 28.035 -14.107 10.103 427 HB3 HIS 62 3HB HIS 62 26.846 -12.822 10.292 428 HD1 HIS 62 HD1 HIS 62 24.515 -13.209 9.290 429 HD2 HIS 62 HD2 HIS 62 27.162 -16.342 8.630 430 HE1 HIS 62 HE1 HIS 62 23.106 -15.113 8.447 431 H GLY 63 H GLY 63 30.489 -12.642 8.383 432 HA2 GLY 63 2HA GLY 63 30.763 -15.158 6.903 433 HA3 GLY 63 3HA GLY 63 31.443 -13.704 6.188 434 H LEU 64 H LEU 64 33.525 -13.391 6.564 435 HA LEU 64 HA LEU 64 34.754 -13.510 9.072 436 HB2 LEU 64 2HB LEU 64 36.230 -15.501 8.656 437 HB3 LEU 64 3HB LEU 64 34.552 -15.857 9.059 438 HG LEU 64 HG LEU 64 34.798 -15.741 6.221 439 HD11 LEU 64 1HD1 LEU 64 36.480 -17.229 5.687 440 HD12 LEU 64 2HD1 LEU 64 36.602 -17.847 7.334 441 HD13 LEU 64 3HD1 LEU 64 37.237 -16.249 6.942 442 HD21 LEU 64 3HD2 LEU 64 34.248 -17.937 8.207 443 HD22 LEU 64 1HD2 LEU 64 34.104 -18.137 6.461 444 HD23 LEU 64 2HD2 LEU 64 33.075 -16.978 7.303 445 H ALA 65 H ALA 65 36.072 -11.848 8.714 446 HA ALA 65 HA ALA 65 37.479 -11.633 6.158 447 HB1 ALA 65 1HB ALA 65 36.414 -9.615 6.729 448 HB2 ALA 65 2HB ALA 65 36.988 -9.687 8.395 449 HB3 ALA 65 3HB ALA 65 38.122 -9.356 7.085 450 H SER 66 H SER 66 39.449 -12.457 6.002 451 HA SER 66 HA SER 66 41.133 -12.554 8.419 452 HB2 SER 66 2HB SER 66 40.342 -14.687 6.931 453 HB3 SER 66 3HB SER 66 41.863 -14.284 6.135 454 HG SER 66 HG SER 66 42.941 -14.602 8.026 455 H THR 67 H THR 67 43.405 -12.195 8.154 456 HA THR 67 HA THR 67 44.428 -11.160 5.675 457 HB THR 67 HB THR 67 43.227 -9.177 6.458 458 HG1 THR 67 HG1 THR 67 45.270 -8.907 5.407 459 HG21 THR 67 3HG2 THR 67 45.038 -8.890 8.803 460 HG22 THR 67 1HG2 THR 67 43.643 -9.958 8.954 461 HG23 THR 67 2HG2 THR 67 43.412 -8.257 8.549 462 H LEU 68 H LEU 68 46.579 -11.445 5.572 463 HA LEU 68 HA LEU 68 48.007 -11.993 8.091 464 HB2 LEU 68 2HB LEU 68 47.592 -13.953 6.542 465 HB3 LEU 68 3HB LEU 68 48.690 -13.169 5.408 466 HG LEU 68 HG LEU 68 50.500 -13.341 7.060 467 HD11 LEU 68 1HD1 LEU 68 50.186 -14.716 9.062 468 HD12 LEU 68 2HD1 LEU 68 48.463 -14.838 8.704 469 HD13 LEU 68 3HD1 LEU 68 49.174 -13.272 9.094 470 HD21 LEU 68 3HD2 LEU 68 49.087 -15.653 5.909 471 HD22 LEU 68 1HD2 LEU 68 50.264 -16.028 7.168 472 HD23 LEU 68 2HD2 LEU 68 50.765 -15.138 5.729 473 H ASN 69 H ASN 69 48.443 -9.659 8.060 474 HA ASN 69 HA ASN 69 50.803 -9.078 6.407 475 HB2 ASN 69 2HB ASN 69 50.056 -6.953 5.803 476 HB3 ASN 69 3HB ASN 69 48.591 -7.921 5.677 477 HD21 ASN 69 1HD2 ASN 69 47.418 -8.068 7.903 478 HD22 ASN 69 2HD2 ASN 69 47.175 -6.547 8.686 479 H GLN 70 H GLN 70 51.902 -6.994 7.310 480 HA GLN 70 HA GLN 70 51.918 -7.169 10.251 481 HB2 GLN 70 2HB GLN 70 54.225 -6.909 8.329 482 HB3 GLN 70 3HB GLN 70 54.377 -6.543 10.042 483 HG2 GLN 70 2HG GLN 70 53.772 -8.818 10.611 484 HG3 GLN 70 3HG GLN 70 53.528 -9.198 8.907 485 HE21 GLN 70 1HE2 GLN 70 55.425 -8.942 7.496 486 HE22 GLN 70 2HE2 GLN 70 56.981 -9.337 8.136 487 H GLY 71 H GLY 71 50.398 -5.395 10.232 488 HA2 GLY 71 2HA GLY 71 51.562 -2.906 10.697 489 HA3 GLY 71 3HA GLY 71 50.974 -2.894 9.041 490 H ASN 72 H ASN 72 49.049 -1.987 8.845 491 HA ASN 72 HA ASN 72 47.061 -2.442 10.969 492 HB2 ASN 72 2HB ASN 72 46.252 -0.153 10.685 493 HB3 ASN 72 3HB ASN 72 47.956 -0.150 11.131 494 HD21 ASN 72 1HD2 ASN 72 49.516 0.286 9.503 495 HD22 ASN 72 2HD2 ASN 72 49.088 1.201 8.101 496 H VAL 73 H VAL 73 44.887 -2.542 10.310 497 HA VAL 73 HA VAL 73 44.417 -2.669 7.411 498 HB VAL 73 HB VAL 73 43.490 -4.737 9.409 499 HG11 VAL 73 1HG1 VAL 73 41.756 -4.873 7.975 500 HG12 VAL 73 2HG1 VAL 73 42.629 -4.062 6.674 501 HG13 VAL 73 3HG1 VAL 73 42.906 -5.775 6.990 502 HG21 VAL 73 3HG2 VAL 73 45.734 -5.221 8.946 503 HG22 VAL 73 1HG2 VAL 73 44.830 -6.243 7.829 504 HG23 VAL 73 2HG2 VAL 73 45.579 -4.754 7.252 505 H LYS 74 H LYS 74 42.480 -1.890 6.734 506 HA LYS 74 HA LYS 74 40.523 -1.119 8.792 507 HB2 LYS 74 2HB LYS 74 42.073 0.617 7.147 508 HB3 LYS 74 3HB LYS 74 40.399 0.724 6.619 509 HG2 LYS 74 2HG LYS 74 40.873 2.406 8.290 510 HG3 LYS 74 3HG LYS 74 39.711 1.232 8.912 511 HD2 LYS 74 2HD LYS 74 41.486 0.101 10.137 512 HD3 LYS 74 3HD LYS 74 42.677 1.225 9.478 513 HE2 LYS 74 2HE LYS 74 40.308 2.126 11.098 514 HE3 LYS 74 3HE LYS 74 41.852 1.693 11.831 515 HZ1 LYS 74 3HZ LYS 74 41.164 4.149 10.872 516 HZ2 LYS 74 1HZ LYS 74 42.152 3.520 9.651 517 HZ3 LYS 74 2HZ LYS 74 42.732 3.630 11.236 518 H VAL 75 H VAL 75 38.596 -1.978 8.425 519 HA VAL 75 HA VAL 75 37.976 -3.002 5.754 520 HB VAL 75 HB VAL 75 36.573 -3.473 8.389 521 HG11 VAL 75 1HG1 VAL 75 35.675 -3.859 5.723 522 HG12 VAL 75 2HG1 VAL 75 35.964 -5.444 6.441 523 HG13 VAL 75 3HG1 VAL 75 34.874 -4.303 7.230 524 HG21 VAL 75 3HG2 VAL 75 38.804 -4.801 7.005 525 HG22 VAL 75 1HG2 VAL 75 38.375 -4.783 8.716 526 HG23 VAL 75 2HG2 VAL 75 37.545 -5.877 7.610 527 H THR 76 H THR 76 36.491 -2.109 4.467 528 HA THR 76 HA THR 76 34.659 -0.110 5.620 529 HB THR 76 HB THR 76 34.832 0.998 3.285 530 HG1 THR 76 HG1 THR 76 36.090 -0.461 2.189 531 HG21 THR 76 3HG2 THR 76 35.698 2.466 4.748 532 HG22 THR 76 1HG2 THR 76 37.265 1.883 4.189 533 HG23 THR 76 2HG2 THR 76 36.543 1.209 5.650 534 H ALA 77 H ALA 77 32.578 -0.477 5.224 535 HA ALA 77 HA ALA 77 31.800 -1.938 2.809 536 HB1 ALA 77 1HB ALA 77 30.072 -2.978 4.674 537 HB2 ALA 77 2HB ALA 77 31.477 -3.802 3.996 538 HB3 ALA 77 3HB ALA 77 31.612 -2.950 5.534 539 H SER 78 H SER 78 30.002 -1.156 1.873 540 HA SER 78 HA SER 78 28.190 0.527 3.445 541 HB2 SER 78 2HB SER 78 30.087 1.609 1.719 542 HB3 SER 78 3HB SER 78 28.599 1.606 0.771 543 HG SER 78 HG SER 78 28.054 3.286 1.890 544 H ILE 79 H ILE 79 26.075 0.366 2.883 545 HA ILE 79 HA ILE 79 25.386 -1.050 0.409 546 HB ILE 79 HB ILE 79 25.352 -2.788 2.069 547 HG12 ILE 79 2HG1 ILE 79 22.500 -1.887 1.630 548 HG13 ILE 79 3HG1 ILE 79 23.487 -2.651 0.389 549 HG21 ILE 79 1HG2 ILE 79 23.400 -1.178 3.692 550 HG22 ILE 79 2HG2 ILE 79 24.222 -2.672 4.139 551 HG23 ILE 79 3HG2 ILE 79 25.136 -1.170 4.001 552 HD11 ILE 79 3HD1 ILE 79 22.018 -3.831 2.586 553 HD12 ILE 79 1HD1 ILE 79 22.649 -4.571 1.115 554 HD13 ILE 79 2HD1 ILE 79 23.693 -4.377 2.523 555 H GLY 80 H GLY 80 24.073 0.241 -0.692 556 HA2 GLY 80 2HA GLY 80 22.448 1.786 -1.186 557 HA3 GLY 80 3HA GLY 80 21.577 1.093 0.174 558 H GLY 81 H GLY 81 21.406 2.227 2.047 559 HA2 GLY 81 2HA GLY 81 22.557 4.936 2.002 560 HA3 GLY 81 3HA GLY 81 21.124 4.453 2.898 561 H ILE 82 H ILE 82 22.090 2.152 4.147 562 HA ILE 82 HA ILE 82 23.670 3.366 6.242 563 HB ILE 82 HB ILE 82 22.770 0.494 6.125 564 HG12 ILE 82 2HG1 ILE 82 20.810 1.884 5.737 565 HG13 ILE 82 3HG1 ILE 82 20.756 1.224 7.368 566 HG21 ILE 82 1HG2 ILE 82 24.165 0.628 7.931 567 HG22 ILE 82 2HG2 ILE 82 23.812 2.331 8.217 568 HG23 ILE 82 3HG2 ILE 82 22.643 1.098 8.688 569 HD11 ILE 82 3HD1 ILE 82 22.035 3.623 7.721 570 HD12 ILE 82 1HD1 ILE 82 20.848 3.983 6.469 571 HD13 ILE 82 2HD1 ILE 82 20.325 3.306 8.011 572 H GLN 83 H GLN 83 25.614 2.432 7.097 573 HA GLN 83 HA GLN 83 27.063 0.540 5.442 574 HB2 GLN 83 2HB GLN 83 28.899 1.939 4.925 575 HB3 GLN 83 3HB GLN 83 27.464 2.860 4.493 576 HG2 GLN 83 2HG GLN 83 27.637 4.054 6.653 577 HG3 GLN 83 3HG GLN 83 29.144 3.195 6.966 578 HE21 GLN 83 1HE2 GLN 83 28.553 6.071 6.617 579 HE22 GLN 83 2HE2 GLN 83 29.608 6.605 5.358 580 H GLY 84 H GLY 84 29.149 -0.094 6.433 581 HA2 GLY 84 2HA GLY 84 29.424 0.565 9.267 582 HA3 GLY 84 3HA GLY 84 29.083 -1.113 8.869 583 H SER 85 H SER 85 31.449 0.200 10.119 584 HA SER 85 HA SER 85 33.453 -1.117 8.456 585 HB2 SER 85 2HB SER 85 33.715 1.748 9.400 586 HB3 SER 85 3HB SER 85 35.009 0.805 8.662 587 HG SER 85 HG SER 85 33.064 2.189 7.465 588 H THR 86 H THR 86 35.442 -1.568 9.600 589 HA THR 86 HA THR 86 35.311 -1.302 12.514 590 HB THR 86 HB THR 86 34.402 -3.464 12.302 591 HG1 THR 86 HG1 THR 86 35.819 -4.225 13.666 592 HG21 THR 86 3HG2 THR 86 34.878 -3.785 9.914 593 HG22 THR 86 1HG2 THR 86 35.323 -5.206 10.859 594 HG23 THR 86 2HG2 THR 86 36.571 -4.094 10.296 595 H ASP 87 H ASP 87 37.338 -1.554 13.581 596 HA ASP 87 HA ASP 87 39.613 -0.997 11.812 597 HB2 ASP 87 2HB ASP 87 39.419 0.755 13.359 598 HB3 ASP 87 3HB ASP 87 39.022 -0.335 14.684 599 H PHE 88 H PHE 88 41.180 -2.443 11.551 600 HA PHE 88 HA PHE 88 41.466 -4.582 13.553 601 HB2 PHE 88 2HB PHE 88 41.207 -4.764 10.586 602 HB3 PHE 88 3HB PHE 88 42.261 -5.914 11.401 603 HD1 PHE 88 HD1 PHE 88 38.803 -4.550 11.497 604 HD2 PHE 88 HD2 PHE 88 41.374 -7.841 12.322 605 HE1 PHE 88 HE1 PHE 88 36.848 -5.931 12.066 606 HE2 PHE 88 HE2 PHE 88 39.422 -9.227 12.892 607 HZ PHE 88 HZ PHE 88 37.156 -8.273 12.764 608 H LYS 89 H LYS 89 43.368 -4.381 14.515 609 HA LYS 89 HA LYS 89 45.649 -3.374 12.950 610 HB2 LYS 89 2HB LYS 89 44.838 -3.073 15.800 611 HB3 LYS 89 3HB LYS 89 46.559 -3.127 15.442 612 HG2 LYS 89 2HG LYS 89 45.675 -1.340 13.591 613 HG3 LYS 89 3HG LYS 89 44.596 -1.015 14.950 614 HD2 LYS 89 2HD LYS 89 47.433 -1.342 15.656 615 HD3 LYS 89 3HD LYS 89 47.066 0.068 14.659 616 HE2 LYS 89 2HE LYS 89 45.396 -0.537 17.063 617 HE3 LYS 89 3HE LYS 89 46.966 0.241 17.260 618 HZ1 LYS 89 3HZ LYS 89 46.215 2.158 16.408 619 HZ2 LYS 89 1HZ LYS 89 44.684 1.557 16.807 620 HZ3 LYS 89 2HZ LYS 89 45.267 1.404 15.226 621 H VAL 90 H VAL 90 46.871 -4.992 12.232 622 HA VAL 90 HA VAL 90 47.174 -7.407 13.864 623 HB VAL 90 HB VAL 90 47.967 -6.895 10.994 624 HG11 VAL 90 1HG1 VAL 90 48.393 -9.186 12.839 625 HG12 VAL 90 2HG1 VAL 90 48.018 -9.534 11.150 626 HG13 VAL 90 3HG1 VAL 90 49.429 -8.557 11.558 627 HG21 VAL 90 3HG2 VAL 90 45.953 -8.930 11.536 628 HG22 VAL 90 1HG2 VAL 90 45.449 -7.309 12.017 629 HG23 VAL 90 2HG2 VAL 90 45.950 -7.620 10.355 630 H THR 91 H THR 91 48.773 -7.207 15.306 631 HA THR 91 HA THR 91 51.366 -6.180 14.349 632 HB THR 91 HB THR 91 51.726 -5.757 16.910 633 HG1 THR 91 HG1 THR 91 49.954 -6.242 17.976 634 HG21 THR 91 3HG2 THR 91 50.933 -4.164 14.740 635 HG22 THR 91 1HG2 THR 91 51.691 -3.631 16.239 636 HG23 THR 91 2HG2 THR 91 49.933 -3.657 16.101 637 H GLN 92 H GLN 92 53.236 -7.246 15.030 638 HA GLN 92 HA GLN 92 53.122 -10.014 15.226 639 HB2 GLN 92 2HB GLN 92 55.483 -9.953 15.700 640 HB3 GLN 92 3HB GLN 92 55.114 -8.700 14.523 641 HG2 GLN 92 2HG GLN 92 55.264 -6.995 16.183 642 HG3 GLN 92 3HG GLN 92 55.388 -8.190 17.473 643 HE21 GLN 92 1HE2 GLN 92 57.339 -8.914 18.045 644 HE22 GLN 92 2HE2 GLN 92 58.816 -8.531 17.235 Start of MODEL 10 1 H1 MET 1 H MET 1 3.238 -1.318 -1.843 2 HA MET 1 HA MET 1 3.975 -3.883 -1.533 3 HB2 MET 1 2HB MET 1 5.027 -3.691 -3.883 4 HB3 MET 1 3HB MET 1 3.325 -3.291 -3.695 5 HG2 MET 1 2HG MET 1 3.665 -1.058 -4.039 6 HG3 MET 1 3HG MET 1 5.330 -1.111 -3.464 7 HE1 MET 1 3HE MET 1 3.815 -0.896 -7.536 8 HE2 MET 1 1HE MET 1 3.247 -2.461 -6.953 9 HE3 MET 1 2HE MET 1 2.915 -1.001 -6.022 10 HA PRO 2 HA PRO 2 8.180 -4.242 -0.334 11 HB2 PRO 2 2HB PRO 2 8.963 -6.455 -1.697 12 HB3 PRO 2 3HB PRO 2 7.869 -6.518 -0.310 13 HG2 PRO 2 2HG PRO 2 7.229 -6.593 -3.234 14 HG3 PRO 2 3HG PRO 2 6.551 -7.565 -1.915 15 HD2 PRO 2 2HD PRO 2 5.262 -5.425 -2.958 16 HD3 PRO 2 3HD PRO 2 5.112 -5.891 -1.251 17 H ALA 3 H ALA 3 10.346 -3.964 -1.007 18 HA ALA 3 HA ALA 3 10.834 -3.471 -3.846 19 HB1 ALA 3 1HB ALA 3 10.266 -1.365 -2.160 20 HB2 ALA 3 2HB ALA 3 12.029 -1.383 -2.215 21 HB3 ALA 3 3HB ALA 3 11.102 -1.262 -3.710 22 H ALA 4 H ALA 4 13.344 -2.426 -3.726 23 HA ALA 4 HA ALA 4 14.878 -4.398 -2.163 24 HB1 ALA 4 1HB ALA 4 14.820 -5.109 -4.482 25 HB2 ALA 4 2HB ALA 4 15.412 -3.531 -5.002 26 HB3 ALA 4 3HB ALA 4 16.447 -4.588 -4.042 27 H LEU 5 H LEU 5 16.854 -3.730 -1.338 28 HA LEU 5 HA LEU 5 18.396 -2.292 -0.489 29 HB2 LEU 5 2HB LEU 5 18.695 -1.881 -2.982 30 HB3 LEU 5 3HB LEU 5 17.723 -0.430 -2.750 31 HG LEU 5 HG LEU 5 20.084 -0.739 -0.991 32 HD11 LEU 5 1HD1 LEU 5 20.983 0.512 -3.368 33 HD12 LEU 5 2HD1 LEU 5 20.334 -1.069 -3.800 34 HD13 LEU 5 3HD1 LEU 5 21.606 -0.941 -2.586 35 HD21 LEU 5 3HD2 LEU 5 18.770 1.515 -2.496 36 HD22 LEU 5 1HD2 LEU 5 20.252 1.697 -1.558 37 HD23 LEU 5 2HD2 LEU 5 18.754 1.223 -0.757 38 H VAL 6 H VAL 6 17.579 -1.595 1.404 39 HA VAL 6 HA VAL 6 16.133 0.959 1.371 40 HB VAL 6 HB VAL 6 15.343 -1.445 3.021 41 HG11 VAL 6 1HG1 VAL 6 13.439 0.572 3.314 42 HG12 VAL 6 2HG1 VAL 6 14.586 0.004 4.529 43 HG13 VAL 6 3HG1 VAL 6 14.997 1.377 3.500 44 HG21 VAL 6 3HG2 VAL 6 14.114 -0.033 0.682 45 HG22 VAL 6 1HG2 VAL 6 14.382 -1.759 0.928 46 HG23 VAL 6 2HG2 VAL 6 13.113 -0.926 1.826 47 H SER 7 H SER 7 17.163 -1.358 3.875 48 HA SER 7 HA SER 7 19.199 0.480 4.819 49 HB2 SER 7 2HB SER 7 16.639 -0.029 6.278 50 HB3 SER 7 3HB SER 7 18.122 0.158 7.214 51 HG SER 7 HG SER 7 17.040 2.154 6.881 52 H ILE 8 H ILE 8 20.476 -0.461 6.610 53 HA ILE 8 HA ILE 8 20.212 -3.326 7.012 54 HB ILE 8 HB ILE 8 22.487 -3.842 6.303 55 HG12 ILE 8 2HG1 ILE 8 22.938 -1.444 4.715 56 HG13 ILE 8 3HG1 ILE 8 22.875 -1.090 6.439 57 HG21 ILE 8 1HG2 ILE 8 20.644 -4.127 4.715 58 HG22 ILE 8 2HG2 ILE 8 20.907 -2.489 4.121 59 HG23 ILE 8 3HG2 ILE 8 22.151 -3.719 3.895 60 HD11 ILE 8 3HD1 ILE 8 24.548 -3.358 5.488 61 HD12 ILE 8 1HD1 ILE 8 25.128 -1.706 5.281 62 HD13 ILE 8 2HD1 ILE 8 24.754 -2.313 6.894 63 H SER 9 H SER 9 21.461 -4.125 8.756 64 HA SER 9 HA SER 9 22.533 -2.012 10.510 65 HB2 SER 9 2HB SER 9 20.382 -3.367 11.155 66 HB3 SER 9 3HB SER 9 21.536 -4.632 11.578 67 HG SER 9 HG SER 9 22.313 -3.419 13.177 68 H VAL 10 H VAL 10 24.646 -2.103 10.825 69 HA VAL 10 HA VAL 10 25.990 -4.721 10.632 70 HB VAL 10 HB VAL 10 26.630 -3.268 8.776 71 HG11 VAL 10 1HG1 VAL 10 26.348 -1.204 10.530 72 HG12 VAL 10 2HG1 VAL 10 28.104 -1.339 10.416 73 HG13 VAL 10 3HG1 VAL 10 27.141 -1.092 8.959 74 HG21 VAL 10 3HG2 VAL 10 29.149 -3.013 10.113 75 HG22 VAL 10 1HG2 VAL 10 28.372 -4.521 10.597 76 HG23 VAL 10 2HG2 VAL 10 28.653 -4.182 8.889 77 H SER 11 H SER 11 27.253 -5.348 12.286 78 HA SER 11 HA SER 11 27.641 -3.430 14.490 79 HB2 SER 11 2HB SER 11 27.514 -6.444 14.717 80 HB3 SER 11 3HB SER 11 27.532 -5.276 16.038 81 HG SER 11 HG SER 11 25.490 -5.524 14.081 82 HA PRO 12 HA PRO 12 31.836 -4.565 12.836 83 HB2 PRO 12 2HB PRO 12 32.786 -2.022 12.839 84 HB3 PRO 12 3HB PRO 12 31.893 -2.712 11.478 85 HG2 PRO 12 2HG PRO 12 30.920 -0.917 13.667 86 HG3 PRO 12 3HG PRO 12 30.571 -0.853 11.930 87 HD2 PRO 12 2HD PRO 12 28.842 -1.911 13.726 88 HD3 PRO 12 3HD PRO 12 28.978 -2.515 12.061 89 H THR 13 H THR 13 33.642 -4.865 14.065 90 HA THR 13 HA THR 13 33.589 -3.745 16.792 91 HB THR 13 HB THR 13 34.978 -6.312 16.045 92 HG1 THR 13 HG1 THR 13 32.359 -6.081 17.141 93 HG21 THR 13 3HG2 THR 13 33.985 -6.312 18.679 94 HG22 THR 13 1HG2 THR 13 34.720 -4.730 18.425 95 HG23 THR 13 2HG2 THR 13 35.666 -6.195 18.161 96 H ASN 14 H ASN 14 35.076 -2.215 17.027 97 HA ASN 14 HA ASN 14 37.480 -2.237 15.387 98 HB2 ASN 14 2HB ASN 14 36.645 -0.176 17.435 99 HB3 ASN 14 3HB ASN 14 37.837 0.015 16.152 100 HD21 ASN 14 1HD2 ASN 14 37.178 0.993 14.385 101 HD22 ASN 14 2HD2 ASN 14 35.539 1.155 13.862 102 H SER 15 H SER 15 38.923 -3.687 16.155 103 HA SER 15 HA SER 15 40.250 -3.083 18.630 104 HB2 SER 15 2HB SER 15 38.143 -4.888 18.807 105 HB3 SER 15 3HB SER 15 39.571 -5.917 18.698 106 HG SER 15 HG SER 15 40.367 -5.028 20.526 107 H THR 16 H THR 16 41.720 -5.339 19.014 108 HA THR 16 HA THR 16 43.228 -5.511 16.497 109 HB THR 16 HB THR 16 44.596 -4.645 18.249 110 HG1 THR 16 HG1 THR 16 45.859 -6.036 17.156 111 HG21 THR 16 3HG2 THR 16 44.882 -6.546 20.207 112 HG22 THR 16 1HG2 THR 16 43.151 -6.597 19.878 113 HG23 THR 16 2HG2 THR 16 43.916 -5.078 20.345 114 H VAL 17 H VAL 17 44.122 -7.528 15.834 115 HA VAL 17 HA VAL 17 42.817 -9.899 16.993 116 HB VAL 17 HB VAL 17 42.738 -10.823 14.630 117 HG11 VAL 17 1HG1 VAL 17 40.845 -9.698 16.060 118 HG12 VAL 17 2HG1 VAL 17 40.932 -8.459 14.806 119 HG13 VAL 17 3HG1 VAL 17 40.566 -10.130 14.374 120 HG21 VAL 17 3HG2 VAL 17 44.268 -8.931 13.799 121 HG22 VAL 17 1HG2 VAL 17 42.914 -9.414 12.779 122 HG23 VAL 17 2HG2 VAL 17 42.801 -7.953 13.760 123 H ALA 18 H ALA 18 43.942 -11.898 16.674 124 HA ALA 18 HA ALA 18 46.760 -11.651 16.959 125 HB1 ALA 18 1HB ALA 18 46.774 -13.899 17.477 126 HB2 ALA 18 2HB ALA 18 45.127 -13.440 17.912 127 HB3 ALA 18 3HB ALA 18 45.438 -14.268 16.386 128 H LYS 19 H LYS 19 48.352 -12.833 15.646 129 HA LYS 19 HA LYS 19 48.232 -12.075 12.939 130 HB2 LYS 19 2HB LYS 19 50.323 -12.407 14.277 131 HB3 LYS 19 3HB LYS 19 50.061 -14.142 14.169 132 HG2 LYS 19 2HG LYS 19 50.081 -13.833 11.647 133 HG3 LYS 19 3HG LYS 19 50.715 -12.216 11.964 134 HD2 LYS 19 2HD LYS 19 52.723 -13.218 11.902 135 HD3 LYS 19 3HD LYS 19 52.324 -13.760 13.534 136 HE2 LYS 19 2HE LYS 19 51.297 -15.415 11.314 137 HE3 LYS 19 3HE LYS 19 53.045 -15.421 11.545 138 HZ1 LYS 19 3HZ LYS 19 52.870 -16.446 13.550 139 HZ2 LYS 19 1HZ LYS 19 51.478 -17.079 12.825 140 HZ3 LYS 19 2HZ LYS 19 51.355 -15.783 13.905 141 H GLY 20 H GLY 20 47.253 -13.003 11.268 142 HA2 GLY 20 2HA GLY 20 46.246 -14.576 9.935 143 HA3 GLY 20 3HA GLY 20 47.290 -15.758 10.712 144 H LEU 21 H LEU 21 44.120 -14.510 10.455 145 HA LEU 21 HA LEU 21 42.918 -16.709 11.686 146 HB2 LEU 21 2HB LEU 21 43.939 -15.016 13.585 147 HB3 LEU 21 3HB LEU 21 42.267 -14.473 13.453 148 HG LEU 21 HG LEU 21 41.704 -16.996 13.766 149 HD11 LEU 21 1HD1 LEU 21 44.464 -16.855 14.970 150 HD12 LEU 21 2HD1 LEU 21 43.994 -17.809 13.564 151 HD13 LEU 21 3HD1 LEU 21 43.322 -18.187 15.150 152 HD21 LEU 21 3HD2 LEU 21 42.787 -15.709 16.229 153 HD22 LEU 21 1HD2 LEU 21 41.266 -16.566 15.980 154 HD23 LEU 21 2HD2 LEU 21 41.468 -14.929 15.354 155 H GLN 22 H GLN 22 40.524 -16.313 12.088 156 HA GLN 22 HA GLN 22 39.534 -14.206 10.283 157 HB2 GLN 22 2HB GLN 22 38.980 -17.118 10.330 158 HB3 GLN 22 3HB GLN 22 37.604 -16.063 10.037 159 HG2 GLN 22 2HG GLN 22 39.022 -14.981 8.225 160 HG3 GLN 22 3HG GLN 22 40.102 -16.362 8.408 161 HE21 GLN 22 1HE2 GLN 22 38.849 -18.521 8.417 162 HE22 GLN 22 2HE2 GLN 22 37.687 -18.702 7.152 163 H GLU 23 H GLU 23 37.735 -13.088 10.909 164 HA GLU 23 HA GLU 23 36.618 -13.778 13.548 165 HB2 GLU 23 2HB GLU 23 37.678 -11.243 12.488 166 HB3 GLU 23 3HB GLU 23 36.138 -11.103 13.324 167 HG2 GLU 23 2HG GLU 23 38.301 -12.652 14.637 168 HG3 GLU 23 3HG GLU 23 38.440 -10.895 14.591 169 H ASN 24 H ASN 24 34.410 -13.507 13.863 170 HA ASN 24 HA ASN 24 32.842 -13.049 11.411 171 HB2 ASN 24 2HB ASN 24 31.346 -14.752 12.004 172 HB3 ASN 24 3HB ASN 24 32.919 -15.425 12.425 173 HD21 ASN 24 1HD2 ASN 24 29.900 -14.241 13.602 174 HD22 ASN 24 2HD2 ASN 24 30.118 -14.706 15.251 175 H PHE 25 H PHE 25 31.083 -11.725 11.515 176 HA PHE 25 HA PHE 25 30.502 -10.485 14.123 177 HB2 PHE 25 2HB PHE 25 30.341 -9.034 11.483 178 HB3 PHE 25 3HB PHE 25 30.275 -8.345 13.102 179 HD1 PHE 25 HD2 PHE 25 32.527 -9.527 14.459 180 HD2 PHE 25 HD1 PHE 25 32.203 -8.187 10.432 181 HE1 PHE 25 HE2 PHE 25 34.956 -9.144 14.395 182 HE2 PHE 25 HE1 PHE 25 34.632 -7.803 10.361 183 HZ PHE 25 HZ PHE 25 36.012 -8.280 12.345 184 H LYS 26 H LYS 26 28.372 -8.933 13.456 185 HA LYS 26 HA LYS 26 26.402 -10.800 12.318 186 HB2 LYS 26 2HB LYS 26 24.799 -10.121 14.058 187 HB3 LYS 26 3HB LYS 26 26.217 -10.901 14.745 188 HG2 LYS 26 2HG LYS 26 27.101 -8.495 15.059 189 HG3 LYS 26 3HG LYS 26 25.414 -8.024 14.842 190 HD2 LYS 26 2HD LYS 26 24.798 -8.835 16.853 191 HD3 LYS 26 3HD LYS 26 25.858 -10.241 16.723 192 HE2 LYS 26 2HE LYS 26 27.153 -7.599 17.069 193 HE3 LYS 26 3HE LYS 26 26.285 -8.253 18.458 194 HZ1 LYS 26 3HZ LYS 26 28.808 -9.020 17.393 195 HZ2 LYS 26 1HZ LYS 26 27.764 -10.349 17.477 196 HZ3 LYS 26 2HZ LYS 26 28.095 -9.443 18.867 197 H ALA 27 H ALA 27 25.174 -9.933 10.780 198 HA ALA 27 HA ALA 27 24.692 -7.041 10.784 199 HB1 ALA 27 1HB ALA 27 24.986 -7.633 8.098 200 HB2 ALA 27 2HB ALA 27 26.132 -6.754 9.111 201 HB3 ALA 27 3HB ALA 27 26.318 -8.492 8.873 202 H THR 28 H THR 28 22.570 -6.754 10.767 203 HA THR 28 HA THR 28 20.879 -8.740 9.403 204 HB THR 28 HB THR 28 19.975 -6.737 11.475 205 HG1 THR 28 HG1 THR 28 20.063 -8.567 12.910 206 HG21 THR 28 3HG2 THR 28 18.203 -7.614 10.047 207 HG22 THR 28 1HG2 THR 28 18.051 -8.256 11.682 208 HG23 THR 28 2HG2 THR 28 18.717 -9.264 10.397 209 H GLY 29 H GLY 29 20.279 -8.105 7.437 210 HA2 GLY 29 2HA GLY 29 20.130 -5.288 6.761 211 HA3 GLY 29 3HA GLY 29 19.907 -6.641 5.661 212 H ILE 30 H ILE 30 18.338 -4.106 6.341 213 HA ILE 30 HA ILE 30 15.740 -5.440 6.746 214 HB ILE 30 HB ILE 30 16.484 -2.617 7.522 215 HG12 ILE 30 2HG1 ILE 30 15.518 -4.391 9.620 216 HG13 ILE 30 3HG1 ILE 30 16.993 -4.995 8.872 217 HG21 ILE 30 1HG2 ILE 30 14.194 -2.791 8.676 218 HG22 ILE 30 2HG2 ILE 30 14.232 -2.516 6.935 219 HG23 ILE 30 3HG2 ILE 30 13.897 -4.128 7.565 220 HD11 ILE 30 3HD1 ILE 30 18.243 -3.207 9.585 221 HD12 ILE 30 1HD1 ILE 30 16.842 -2.146 9.731 222 HD13 ILE 30 2HD1 ILE 30 17.118 -3.414 10.926 223 H PHE 31 H PHE 31 14.815 -5.610 4.806 224 HA PHE 31 HA PHE 31 15.108 -3.423 2.879 225 HB2 PHE 31 2HB PHE 31 14.417 -6.326 2.650 226 HB3 PHE 31 3HB PHE 31 13.881 -5.215 1.394 227 HD1 PHE 31 HD1 PHE 31 17.020 -4.733 3.219 228 HD2 PHE 31 HD2 PHE 31 15.208 -6.225 -0.331 229 HE1 PHE 31 HE1 PHE 31 19.234 -4.876 2.154 230 HE2 PHE 31 HE2 PHE 31 17.419 -6.372 -1.401 231 HZ PHE 31 HZ PHE 31 19.435 -5.698 -0.159 232 H THR 32 H THR 32 13.055 -3.177 1.439 233 HA THR 32 HA THR 32 11.004 -2.136 3.097 234 HB THR 32 HB THR 32 9.925 -2.373 0.523 235 HG1 THR 32 HG1 THR 32 12.016 -3.034 -0.201 236 HG21 THR 32 3HG2 THR 32 11.149 -0.259 2.197 237 HG22 THR 32 1HG2 THR 32 9.555 -0.329 1.447 238 HG23 THR 32 2HG2 THR 32 10.967 0.098 0.480 239 H ASP 33 H ASP 33 11.560 -5.231 1.740 240 HA ASP 33 HA ASP 33 8.784 -6.052 1.813 241 HB2 ASP 33 2HB ASP 33 9.475 -8.049 0.834 242 HB3 ASP 33 3HB ASP 33 10.645 -6.894 0.202 243 H ASN 34 H ASN 34 10.807 -5.356 4.186 244 HA ASN 34 HA ASN 34 11.243 -6.121 6.306 245 HB2 ASN 34 2HB ASN 34 9.198 -6.622 7.569 246 HB3 ASN 34 3HB ASN 34 8.953 -5.253 6.489 247 HD21 ASN 34 1HD2 ASN 34 8.011 -8.437 7.310 248 HD22 ASN 34 2HD2 ASN 34 6.760 -8.613 6.131 249 H SER 35 H SER 35 11.960 -8.032 4.346 250 HA SER 35 HA SER 35 12.191 -10.348 5.967 251 HB2 SER 35 2HB SER 35 10.124 -10.335 3.802 252 HB3 SER 35 3HB SER 35 11.029 -11.816 4.111 253 HG SER 35 HG SER 35 9.968 -12.082 5.910 254 H ASN 36 H ASN 36 14.189 -8.971 4.999 255 HA ASN 36 HA ASN 36 15.344 -10.743 2.991 256 HB2 ASN 36 2HB ASN 36 14.326 -8.543 1.984 257 HB3 ASN 36 3HB ASN 36 15.779 -7.799 2.645 258 HD21 ASN 36 1HD2 ASN 36 17.821 -8.506 1.881 259 HD22 ASN 36 2HD2 ASN 36 17.973 -9.241 0.325 260 H SER 37 H SER 37 17.551 -10.996 3.158 261 HA SER 37 HA SER 37 18.743 -9.873 5.588 262 HB2 SER 37 2HB SER 37 20.485 -11.677 5.195 263 HB3 SER 37 3HB SER 37 18.859 -12.256 5.554 264 HG SER 37 HG SER 37 19.489 -13.409 3.810 265 H ASP 38 H ASP 38 21.098 -9.364 5.493 266 HA ASP 38 HA ASP 38 21.589 -7.580 3.276 267 HB2 ASP 38 2HB ASP 38 22.155 -6.779 5.473 268 HB3 ASP 38 3HB ASP 38 23.158 -8.193 5.785 269 H ILE 39 H ILE 39 22.201 -8.551 1.434 270 HA ILE 39 HA ILE 39 24.769 -9.540 1.075 271 HB ILE 39 HB ILE 39 24.272 -11.522 2.257 272 HG12 ILE 39 2HG1 ILE 39 25.110 -11.613 -0.292 273 HG13 ILE 39 3HG1 ILE 39 24.930 -13.054 0.701 274 HG21 ILE 39 1HG2 ILE 39 21.897 -11.381 2.434 275 HG22 ILE 39 2HG2 ILE 39 21.699 -11.596 0.695 276 HG23 ILE 39 3HG2 ILE 39 22.284 -12.931 1.687 277 HD11 ILE 39 3HD1 ILE 39 22.967 -13.686 -0.358 278 HD12 ILE 39 1HD1 ILE 39 22.674 -12.068 -0.995 279 HD13 ILE 39 2HD1 ILE 39 23.964 -13.063 -1.672 280 H THR 40 H THR 40 21.415 -9.792 0.006 281 HA THR 40 HA THR 40 21.972 -10.333 -2.714 282 HB THR 40 HB THR 40 19.523 -8.971 -1.577 283 HG1 THR 40 HG1 THR 40 18.747 -10.979 -1.189 284 HG21 THR 40 3HG2 THR 40 18.442 -10.064 -3.579 285 HG22 THR 40 1HG2 THR 40 20.067 -10.398 -4.176 286 HG23 THR 40 2HG2 THR 40 19.538 -8.732 -3.945 287 H ASP 41 H ASP 41 21.823 -7.393 -0.845 288 HA ASP 41 HA ASP 41 21.560 -5.559 -2.974 289 HB2 ASP 41 2HB ASP 41 21.691 -5.392 -0.211 290 HB3 ASP 41 3HB ASP 41 23.161 -4.578 -0.740 291 H GLN 42 H GLN 42 24.155 -7.532 -1.988 292 HA GLN 42 HA GLN 42 26.258 -7.819 -2.811 293 HB2 GLN 42 2HB GLN 42 25.705 -5.650 -4.824 294 HB3 GLN 42 3HB GLN 42 26.806 -7.014 -4.966 295 HG2 GLN 42 2HG GLN 42 24.575 -8.394 -4.710 296 HG3 GLN 42 3HG GLN 42 23.863 -6.902 -5.321 297 HE21 GLN 42 1HE2 GLN 42 23.838 -9.390 -6.654 298 HE22 GLN 42 2HE2 GLN 42 24.739 -9.218 -8.118 299 H VAL 43 H VAL 43 26.113 -6.324 -0.599 300 HA VAL 43 HA VAL 43 27.036 -3.733 -0.568 301 HB VAL 43 HB VAL 43 27.829 -4.102 1.654 302 HG11 VAL 43 1HG1 VAL 43 25.727 -6.141 1.769 303 HG12 VAL 43 2HG1 VAL 43 25.816 -4.554 2.538 304 HG13 VAL 43 3HG1 VAL 43 25.295 -4.694 0.858 305 HG21 VAL 43 3HG2 VAL 43 27.940 -6.508 2.521 306 HG22 VAL 43 1HG2 VAL 43 27.996 -6.981 0.823 307 HG23 VAL 43 2HG2 VAL 43 29.260 -5.950 1.493 308 H THR 44 H THR 44 28.977 -2.720 -0.756 309 HA THR 44 HA THR 44 31.145 -4.281 -1.936 310 HB THR 44 HB THR 44 32.066 -1.753 -2.071 311 HG1 THR 44 HG1 THR 44 30.323 -0.354 -2.412 312 HG21 THR 44 3HG2 THR 44 30.854 -3.616 -3.823 313 HG22 THR 44 1HG2 THR 44 31.929 -2.279 -4.231 314 HG23 THR 44 2HG2 THR 44 30.183 -2.030 -4.201 315 H TRP 45 H TRP 45 32.884 -4.855 -0.817 316 HA TRP 45 HA TRP 45 33.442 -3.454 1.714 317 HB2 TRP 45 2HB TRP 45 34.633 -5.615 2.335 318 HB3 TRP 45 3HB TRP 45 32.877 -5.699 2.231 319 HD1 TRP 45 HD1 TRP 45 35.990 -6.636 0.132 320 HE1 TRP 45 HE1 TRP 45 35.374 -8.647 -1.352 321 HE3 TRP 45 HE3 TRP 45 31.024 -7.005 1.286 322 HZ2 TRP 45 HZ2 TRP 45 33.086 -10.186 -1.953 323 HZ3 TRP 45 HZ3 TRP 45 29.692 -8.774 0.213 324 HH2 TRP 45 HH2 TRP 45 30.703 -10.330 -1.374 325 H ASP 46 H ASP 46 35.684 -3.234 2.333 326 HA ASP 46 HA ASP 46 37.646 -3.508 0.186 327 HB2 ASP 46 2HB ASP 46 36.448 -1.016 0.918 328 HB3 ASP 46 3HB ASP 46 38.142 -0.988 1.399 329 H SER 47 H SER 47 39.760 -3.724 0.887 330 HA SER 47 HA SER 47 40.130 -3.852 3.808 331 HB2 SER 47 2HB SER 47 40.846 -5.976 3.667 332 HB3 SER 47 3HB SER 47 40.250 -5.983 2.007 333 HG SER 47 HG SER 47 42.869 -5.381 2.909 334 H SER 48 H SER 48 42.182 -3.297 4.622 335 HA SER 48 HA SER 48 43.589 -1.366 2.967 336 HB2 SER 48 2HB SER 48 42.898 -1.251 5.556 337 HB3 SER 48 3HB SER 48 44.505 -1.953 5.736 338 HG SER 48 HG SER 48 43.758 0.541 4.674 339 H ASN 49 H ASN 49 46.130 -1.424 3.937 340 HA ASN 49 HA ASN 49 48.166 -2.368 3.570 341 HB2 ASN 49 2HB ASN 49 46.662 -4.236 5.055 342 HB3 ASN 49 3HB ASN 49 47.506 -5.160 3.815 343 HD21 ASN 49 1HD2 ASN 49 48.003 -2.715 6.314 344 HD22 ASN 49 2HD2 ASN 49 49.614 -3.197 6.713 345 H THR 50 H THR 50 49.058 -4.648 2.397 346 HA THR 50 HA THR 50 47.637 -5.141 -0.071 347 HB THR 50 HB THR 50 48.796 -3.041 -0.606 348 HG1 THR 50 HG1 THR 50 50.049 -5.256 -1.891 349 HG21 THR 50 3HG2 THR 50 51.440 -4.413 -0.405 350 HG22 THR 50 1HG2 THR 50 50.734 -3.697 1.043 351 HG23 THR 50 2HG2 THR 50 51.061 -2.691 -0.368 352 H ASP 51 H ASP 51 48.419 -6.812 2.058 353 HA ASP 51 HA ASP 51 50.535 -8.438 0.808 354 HB2 ASP 51 2HB ASP 51 49.670 -8.374 3.707 355 HB3 ASP 51 3HB ASP 51 50.931 -9.405 3.037 356 H ILE 52 H ILE 52 48.050 -9.215 3.220 357 HA ILE 52 HA ILE 52 46.706 -10.982 1.337 358 HB ILE 52 HB ILE 52 46.765 -12.813 3.163 359 HG12 ILE 52 2HG1 ILE 52 48.067 -11.055 4.659 360 HG13 ILE 52 3HG1 ILE 52 48.409 -12.778 4.771 361 HG21 ILE 52 1HG2 ILE 52 47.729 -13.190 1.020 362 HG22 ILE 52 2HG2 ILE 52 49.108 -12.157 1.392 363 HG23 ILE 52 3HG2 ILE 52 48.914 -13.700 2.222 364 HD11 ILE 52 3HD1 ILE 52 49.969 -11.120 2.857 365 HD12 ILE 52 1HD1 ILE 52 50.340 -11.033 4.578 366 HD13 ILE 52 2HD1 ILE 52 50.436 -12.578 3.732 367 H LEU 53 H LEU 53 45.219 -9.119 1.833 368 HA LEU 53 HA LEU 53 43.668 -9.688 4.273 369 HB2 LEU 53 2HB LEU 53 44.133 -7.086 2.837 370 HB3 LEU 53 3HB LEU 53 42.873 -7.304 4.050 371 HG LEU 53 HG LEU 53 44.692 -6.238 5.126 372 HD11 LEU 53 1HD1 LEU 53 45.305 -7.828 6.840 373 HD12 LEU 53 2HD1 LEU 53 44.853 -9.173 5.793 374 HD13 LEU 53 3HD1 LEU 53 43.617 -8.061 6.383 375 HD21 LEU 53 3HD2 LEU 53 46.932 -6.774 4.913 376 HD22 LEU 53 1HD2 LEU 53 46.321 -7.069 3.286 377 HD23 LEU 53 2HD2 LEU 53 46.595 -8.422 4.383 378 H SER 54 H SER 54 41.655 -10.378 3.977 379 HA SER 54 HA SER 54 40.244 -9.676 1.505 380 HB2 SER 54 2HB SER 54 40.973 -11.816 0.894 381 HB3 SER 54 3HB SER 54 40.804 -12.445 2.533 382 HG SER 54 HG SER 54 38.927 -12.200 0.526 383 H ILE 55 H ILE 55 38.084 -9.341 1.739 384 HA ILE 55 HA ILE 55 36.890 -9.937 4.362 385 HB ILE 55 HB ILE 55 36.558 -7.364 2.816 386 HG12 ILE 55 2HG1 ILE 55 37.525 -7.406 5.619 387 HG13 ILE 55 3HG1 ILE 55 38.647 -7.998 4.399 388 HG21 ILE 55 1HG2 ILE 55 34.477 -8.035 3.874 389 HG22 ILE 55 2HG2 ILE 55 35.310 -8.257 5.411 390 HG23 ILE 55 3HG2 ILE 55 35.170 -6.646 4.709 391 HD11 ILE 55 3HD1 ILE 55 38.390 -5.878 3.179 392 HD12 ILE 55 1HD1 ILE 55 37.340 -5.290 4.467 393 HD13 ILE 55 2HD1 ILE 55 39.031 -5.660 4.807 394 H SER 56 H SER 56 34.999 -10.961 4.256 395 HA SER 56 HA SER 56 33.489 -10.851 1.728 396 HB2 SER 56 2HB SER 56 34.656 -13.127 3.024 397 HB3 SER 56 3HB SER 56 32.901 -13.294 3.046 398 HG SER 56 HG SER 56 33.116 -13.888 1.049 399 H ASN 57 H ASN 57 31.464 -10.168 1.923 400 HA ASN 57 HA ASN 57 30.037 -10.588 4.447 401 HB2 ASN 57 2HB ASN 57 29.757 -7.937 3.088 402 HB3 ASN 57 3HB ASN 57 29.496 -8.360 4.778 403 HD21 ASN 57 1HD2 ASN 57 31.223 -8.411 6.184 404 HD22 ASN 57 2HD2 ASN 57 32.769 -7.751 5.784 405 H ALA 58 H ALA 58 29.945 -11.697 1.673 406 HA ALA 58 HA ALA 58 27.148 -11.005 1.047 407 HB1 ALA 58 1HB ALA 58 28.392 -10.309 -0.811 408 HB2 ALA 58 2HB ALA 58 29.422 -11.741 -0.769 409 HB3 ALA 58 3HB ALA 58 27.739 -11.879 -1.277 410 H SER 59 H SER 59 28.380 -13.080 2.869 411 HA SER 59 HA SER 59 27.806 -15.606 1.612 412 HB2 SER 59 2HB SER 59 29.334 -16.091 3.212 413 HB3 SER 59 3HB SER 59 28.899 -14.687 4.187 414 HG SER 59 HG SER 59 27.695 -17.239 4.124 415 H ASP 60 H ASP 60 26.233 -13.502 3.978 416 HA ASP 60 HA ASP 60 23.634 -14.218 3.253 417 HB2 ASP 60 2HB ASP 60 23.917 -16.379 4.169 418 HB3 ASP 60 3HB ASP 60 24.778 -15.759 5.575 419 H SER 61 H SER 61 25.800 -13.122 5.786 420 HA SER 61 HA SER 61 24.509 -10.660 6.123 421 HB2 SER 61 2HB SER 61 23.450 -12.866 7.745 422 HB3 SER 61 3HB SER 61 23.932 -11.457 8.690 423 HG SER 61 HG SER 61 21.749 -11.350 7.951 424 H HIS 62 H HIS 62 25.934 -12.983 8.426 425 HA HIS 62 HA HIS 62 27.537 -11.205 9.802 426 HB2 HIS 62 2HB HIS 62 28.989 -13.240 10.286 427 HB3 HIS 62 3HB HIS 62 27.283 -13.384 10.699 428 HD1 HIS 62 HD1 HIS 62 29.748 -14.495 8.058 429 HD2 HIS 62 HD2 HIS 62 25.961 -15.450 9.476 430 HE1 HIS 62 HE1 HIS 62 29.113 -16.631 6.893 431 H GLY 63 H GLY 63 29.485 -10.263 9.491 432 HA2 GLY 63 2HA GLY 63 30.643 -10.510 6.815 433 HA3 GLY 63 3HA GLY 63 30.969 -9.227 7.971 434 H LEU 64 H LEU 64 32.100 -12.094 6.613 435 HA LEU 64 HA LEU 64 33.826 -12.828 8.818 436 HB2 LEU 64 2HB LEU 64 34.726 -14.489 7.183 437 HB3 LEU 64 3HB LEU 64 33.001 -14.627 7.517 438 HG LEU 64 HG LEU 64 33.703 -13.009 5.158 439 HD11 LEU 64 1HD1 LEU 64 34.490 -15.869 5.432 440 HD12 LEU 64 2HD1 LEU 64 35.297 -14.553 4.581 441 HD13 LEU 64 3HD1 LEU 64 33.854 -15.295 3.891 442 HD21 LEU 64 3HD2 LEU 64 31.471 -14.336 6.221 443 HD22 LEU 64 1HD2 LEU 64 31.894 -15.195 4.740 444 HD23 LEU 64 2HD2 LEU 64 31.580 -13.460 4.693 445 H ALA 65 H ALA 65 35.726 -11.921 9.203 446 HA ALA 65 HA ALA 65 37.083 -10.503 7.007 447 HB1 ALA 65 1HB ALA 65 37.077 -10.021 9.975 448 HB2 ALA 65 2HB ALA 65 38.259 -9.284 8.892 449 HB3 ALA 65 3HB ALA 65 36.541 -8.940 8.688 450 H SER 66 H SER 66 38.960 -11.275 6.303 451 HA SER 66 HA SER 66 40.444 -13.142 8.035 452 HB2 SER 66 2HB SER 66 40.956 -14.517 6.197 453 HB3 SER 66 3HB SER 66 39.262 -14.095 5.944 454 HG SER 66 HG SER 66 40.036 -13.559 4.040 455 H THR 67 H THR 67 42.365 -12.407 8.616 456 HA THR 67 HA THR 67 43.882 -10.732 6.736 457 HB THR 67 HB THR 67 44.544 -9.192 8.420 458 HG1 THR 67 HG1 THR 67 43.507 -11.140 10.152 459 HG21 THR 67 3HG2 THR 67 42.202 -8.979 7.453 460 HG22 THR 67 1HG2 THR 67 42.513 -8.104 8.951 461 HG23 THR 67 2HG2 THR 67 41.619 -9.625 8.987 462 H LEU 68 H LEU 68 45.997 -11.225 6.562 463 HA LEU 68 HA LEU 68 47.281 -12.840 8.627 464 HB2 LEU 68 2HB LEU 68 46.917 -13.654 5.761 465 HB3 LEU 68 3HB LEU 68 48.236 -14.287 6.744 466 HG LEU 68 HG LEU 68 45.643 -14.582 8.033 467 HD11 LEU 68 1HD1 LEU 68 46.006 -15.510 5.234 468 HD12 LEU 68 2HD1 LEU 68 44.547 -14.985 6.075 469 HD13 LEU 68 3HD1 LEU 68 45.209 -16.592 6.377 470 HD21 LEU 68 3HD2 LEU 68 47.611 -16.693 7.188 471 HD22 LEU 68 1HD2 LEU 68 46.464 -16.737 8.527 472 HD23 LEU 68 2HD2 LEU 68 47.863 -15.665 8.599 473 H ASN 69 H ASN 69 47.560 -10.090 7.743 474 HA ASN 69 HA ASN 69 50.224 -10.127 6.504 475 HB2 ASN 69 2HB ASN 69 49.850 -7.954 5.743 476 HB3 ASN 69 3HB ASN 69 48.253 -8.685 5.612 477 HD21 ASN 69 1HD2 ASN 69 50.026 -6.121 6.820 478 HD22 ASN 69 2HD2 ASN 69 48.832 -5.453 7.876 479 H GLN 70 H GLN 70 51.615 -8.186 7.322 480 HA GLN 70 HA GLN 70 51.600 -8.289 10.265 481 HB2 GLN 70 2HB GLN 70 53.808 -8.346 8.256 482 HB3 GLN 70 3HB GLN 70 54.118 -7.614 9.825 483 HG2 GLN 70 2HG GLN 70 53.837 -9.609 10.959 484 HG3 GLN 70 3HG GLN 70 52.913 -10.340 9.648 485 HE21 GLN 70 1HE2 GLN 70 54.197 -10.536 7.556 486 HE22 GLN 70 2HE2 GLN 70 55.813 -11.127 7.710 487 H GLY 71 H GLY 71 50.431 -6.456 10.716 488 HA2 GLY 71 2HA GLY 71 51.600 -4.047 11.066 489 HA3 GLY 71 3HA GLY 71 51.038 -3.951 9.403 490 H ASN 72 H ASN 72 49.105 -3.073 9.137 491 HA ASN 72 HA ASN 72 47.096 -3.413 11.258 492 HB2 ASN 72 2HB ASN 72 46.357 -1.033 10.701 493 HB3 ASN 72 3HB ASN 72 47.855 -1.198 11.614 494 HD21 ASN 72 1HD2 ASN 72 49.256 0.267 10.994 495 HD22 ASN 72 2HD2 ASN 72 49.563 0.763 9.368 496 H VAL 73 H VAL 73 44.911 -3.341 10.568 497 HA VAL 73 HA VAL 73 44.499 -3.516 7.661 498 HB VAL 73 HB VAL 73 43.157 -5.360 9.636 499 HG11 VAL 73 1HG1 VAL 73 43.345 -5.518 6.631 500 HG12 VAL 73 2HG1 VAL 73 42.395 -6.554 7.698 501 HG13 VAL 73 3HG1 VAL 73 41.968 -4.853 7.509 502 HG21 VAL 73 3HG2 VAL 73 45.566 -5.840 7.889 503 HG22 VAL 73 1HG2 VAL 73 45.479 -5.933 9.648 504 HG23 VAL 73 2HG2 VAL 73 44.633 -7.123 8.659 505 H LYS 74 H LYS 74 42.627 -2.639 6.896 506 HA LYS 74 HA LYS 74 40.729 -1.565 8.873 507 HB2 LYS 74 2HB LYS 74 42.350 0.147 7.864 508 HB3 LYS 74 3HB LYS 74 41.480 -0.093 6.354 509 HG2 LYS 74 2HG LYS 74 39.686 1.074 7.046 510 HG3 LYS 74 3HG LYS 74 39.805 0.480 8.704 511 HD2 LYS 74 2HD LYS 74 41.915 2.335 7.731 512 HD3 LYS 74 3HD LYS 74 40.319 3.005 8.078 513 HE2 LYS 74 2HE LYS 74 40.487 1.807 10.320 514 HE3 LYS 74 3HE LYS 74 42.193 1.573 9.943 515 HZ1 LYS 74 3HZ LYS 74 41.708 3.571 11.308 516 HZ2 LYS 74 1HZ LYS 74 40.867 4.227 9.994 517 HZ3 LYS 74 2HZ LYS 74 42.524 3.914 9.866 518 H VAL 75 H VAL 75 38.947 -2.747 8.568 519 HA VAL 75 HA VAL 75 38.150 -3.492 5.852 520 HB VAL 75 HB VAL 75 37.033 -4.369 8.519 521 HG11 VAL 75 1HG1 VAL 75 36.264 -6.188 6.579 522 HG12 VAL 75 2HG1 VAL 75 35.235 -4.978 7.350 523 HG13 VAL 75 3HG1 VAL 75 36.023 -4.618 5.813 524 HG21 VAL 75 3HG2 VAL 75 39.182 -5.373 6.777 525 HG22 VAL 75 1HG2 VAL 75 38.933 -5.580 8.510 526 HG23 VAL 75 2HG2 VAL 75 38.053 -6.592 7.366 527 H THR 76 H THR 76 36.774 -2.243 4.793 528 HA THR 76 HA THR 76 34.716 -0.790 6.322 529 HB THR 76 HB THR 76 36.501 0.738 5.473 530 HG1 THR 76 HG1 THR 76 34.829 2.054 4.220 531 HG21 THR 76 3HG2 THR 76 35.418 0.049 2.742 532 HG22 THR 76 1HG2 THR 76 36.942 -0.565 3.380 533 HG23 THR 76 2HG2 THR 76 36.727 1.167 3.124 534 H ALA 77 H ALA 77 32.668 -0.826 5.524 535 HA ALA 77 HA ALA 77 32.181 -1.869 2.844 536 HB1 ALA 77 1HB ALA 77 31.877 -3.933 3.687 537 HB2 ALA 77 2HB ALA 77 31.635 -3.341 5.331 538 HB3 ALA 77 3HB ALA 77 30.307 -3.293 4.173 539 H SER 78 H SER 78 30.469 -0.934 1.887 540 HA SER 78 HA SER 78 28.445 0.386 3.539 541 HB2 SER 78 2HB SER 78 28.632 2.481 2.431 542 HB3 SER 78 3HB SER 78 30.280 2.025 2.864 543 HG SER 78 HG SER 78 29.956 2.793 0.654 544 H ILE 79 H ILE 79 26.420 0.373 2.679 545 HA ILE 79 HA ILE 79 26.092 -0.523 -0.095 546 HB ILE 79 HB ILE 79 25.861 -2.537 1.221 547 HG12 ILE 79 2HG1 ILE 79 23.549 -3.166 0.612 548 HG13 ILE 79 3HG1 ILE 79 23.166 -1.468 0.351 549 HG21 ILE 79 1HG2 ILE 79 24.769 -0.814 3.147 550 HG22 ILE 79 2HG2 ILE 79 23.485 -1.940 2.710 551 HG23 ILE 79 3HG2 ILE 79 25.037 -2.552 3.282 552 HD11 ILE 79 3HD1 ILE 79 23.550 -2.505 -1.761 553 HD12 ILE 79 1HD1 ILE 79 24.894 -1.414 -1.426 554 HD13 ILE 79 2HD1 ILE 79 25.097 -3.154 -1.217 555 H GLY 80 H GLY 80 24.767 0.792 -1.154 556 HA2 GLY 80 2HA GLY 80 23.181 2.395 -1.582 557 HA3 GLY 80 3HA GLY 80 22.232 1.584 -0.345 558 H GLY 81 H GLY 81 21.960 2.535 1.613 559 HA2 GLY 81 2HA GLY 81 23.081 5.238 1.882 560 HA3 GLY 81 3HA GLY 81 21.650 4.634 2.705 561 H ILE 82 H ILE 82 22.134 2.721 4.218 562 HA ILE 82 HA ILE 82 23.921 3.626 6.206 563 HB ILE 82 HB ILE 82 22.772 0.844 5.995 564 HG12 ILE 82 2HG1 ILE 82 20.959 2.443 5.742 565 HG13 ILE 82 3HG1 ILE 82 20.884 1.721 7.345 566 HG21 ILE 82 1HG2 ILE 82 24.066 2.444 8.140 567 HG22 ILE 82 2HG2 ILE 82 22.776 1.331 8.590 568 HG23 ILE 82 3HG2 ILE 82 24.212 0.728 7.764 569 HD11 ILE 82 3HD1 ILE 82 22.421 3.955 7.753 570 HD12 ILE 82 1HD1 ILE 82 21.240 4.493 6.559 571 HD13 ILE 82 2HD1 ILE 82 20.697 3.805 8.089 572 H GLN 83 H GLN 83 25.829 2.657 7.013 573 HA GLN 83 HA GLN 83 27.145 0.613 5.438 574 HB2 GLN 83 2HB GLN 83 29.102 1.920 4.908 575 HB3 GLN 83 3HB GLN 83 27.683 2.732 4.260 576 HG2 GLN 83 2HG GLN 83 27.803 3.988 6.589 577 HG3 GLN 83 3HG GLN 83 29.504 3.544 6.449 578 HE21 GLN 83 1HE2 GLN 83 26.991 5.583 5.336 579 HE22 GLN 83 2HE2 GLN 83 27.930 6.515 4.226 580 H GLY 84 H GLY 84 29.219 -0.068 6.418 581 HA2 GLY 84 2HA GLY 84 29.329 0.573 9.299 582 HA3 GLY 84 3HA GLY 84 29.410 -1.086 8.725 583 H SER 85 H SER 85 31.360 0.295 10.327 584 HA SER 85 HA SER 85 33.678 -0.137 8.609 585 HB2 SER 85 2HB SER 85 33.124 2.423 10.110 586 HB3 SER 85 3HB SER 85 34.747 1.957 9.600 587 HG SER 85 HG SER 85 34.160 2.151 7.508 588 H THR 86 H THR 86 35.330 -1.118 9.636 589 HA THR 86 HA THR 86 35.332 -1.178 12.571 590 HB THR 86 HB THR 86 34.283 -3.235 12.142 591 HG1 THR 86 HG1 THR 86 36.252 -3.374 13.440 592 HG21 THR 86 3HG2 THR 86 34.299 -3.828 9.964 593 HG22 THR 86 1HG2 THR 86 35.703 -4.788 10.429 594 HG23 THR 86 2HG2 THR 86 35.924 -3.198 9.698 595 H ASP 87 H ASP 87 37.369 -1.692 13.520 596 HA ASP 87 HA ASP 87 39.637 -1.237 11.696 597 HB2 ASP 87 2HB ASP 87 39.592 0.609 13.140 598 HB3 ASP 87 3HB ASP 87 39.136 -0.373 14.530 599 H PHE 88 H PHE 88 41.262 -2.676 11.634 600 HA PHE 88 HA PHE 88 41.278 -4.822 13.651 601 HB2 PHE 88 2HB PHE 88 41.021 -4.997 10.743 602 HB3 PHE 88 3HB PHE 88 42.329 -5.990 11.378 603 HD1 PHE 88 HD2 PHE 88 38.959 -5.145 12.729 604 HD2 PHE 88 HD1 PHE 88 41.635 -8.180 11.408 605 HE1 PHE 88 HE2 PHE 88 37.328 -6.865 13.388 606 HE2 PHE 88 HE1 PHE 88 40.008 -9.905 12.064 607 HZ PHE 88 HZ PHE 88 37.852 -9.248 13.057 608 H LYS 89 H LYS 89 43.218 -5.366 14.490 609 HA LYS 89 HA LYS 89 45.621 -4.164 13.286 610 HB2 LYS 89 2HB LYS 89 44.557 -3.912 16.033 611 HB3 LYS 89 3HB LYS 89 46.284 -4.220 15.913 612 HG2 LYS 89 2HG LYS 89 45.868 -2.236 14.050 613 HG3 LYS 89 3HG LYS 89 44.777 -1.799 15.367 614 HD2 LYS 89 2HD LYS 89 46.893 -2.339 16.844 615 HD3 LYS 89 3HD LYS 89 47.751 -1.995 15.340 616 HE2 LYS 89 2HE LYS 89 45.652 -0.083 16.209 617 HE3 LYS 89 3HE LYS 89 47.167 -0.100 17.110 618 HZ1 LYS 89 3HZ LYS 89 46.630 0.815 14.417 619 HZ2 LYS 89 1HZ LYS 89 48.053 -0.084 14.590 620 HZ3 LYS 89 2HZ LYS 89 47.818 1.312 15.514 621 H VAL 90 H VAL 90 46.781 -5.813 12.533 622 HA VAL 90 HA VAL 90 46.830 -8.341 14.012 623 HB VAL 90 HB VAL 90 47.849 -7.690 11.243 624 HG11 VAL 90 1HG1 VAL 90 47.703 -10.359 11.271 625 HG12 VAL 90 2HG1 VAL 90 49.167 -9.476 11.712 626 HG13 VAL 90 3HG1 VAL 90 48.088 -10.082 12.969 627 HG21 VAL 90 3HG2 VAL 90 45.425 -7.639 11.367 628 HG22 VAL 90 1HG2 VAL 90 45.959 -9.071 10.487 629 HG23 VAL 90 2HG2 VAL 90 45.411 -9.216 12.157 630 H THR 91 H THR 91 48.330 -8.330 15.572 631 HA THR 91 HA THR 91 51.055 -7.474 14.844 632 HB THR 91 HB THR 91 51.443 -6.691 17.088 633 HG1 THR 91 HG1 THR 91 50.145 -7.178 18.710 634 HG21 THR 91 3HG2 THR 91 48.878 -5.356 16.854 635 HG22 THR 91 1HG2 THR 91 49.701 -5.478 15.300 636 HG23 THR 91 2HG2 THR 91 50.506 -4.706 16.666 637 H GLN 92 H GLN 92 52.749 -8.749 15.531 638 HA GLN 92 HA GLN 92 52.000 -11.437 16.401 639 HB2 GLN 92 2HB GLN 92 54.259 -12.082 15.690 640 HB3 GLN 92 3HB GLN 92 53.385 -11.269 14.399 641 HG2 GLN 92 2HG GLN 92 54.583 -9.183 14.950 642 HG3 GLN 92 3HG GLN 92 55.512 -10.070 16.157 643 HE21 GLN 92 1HE2 GLN 92 55.987 -8.716 13.401 644 HE22 GLN 92 2HE2 GLN 92 57.005 -9.854 12.592 Start of MODEL 11 1 H1 MET 1 H MET 1 3.222 -1.728 -7.133 2 HA MET 1 HA MET 1 1.992 -2.623 -4.788 3 HB2 MET 1 2HB MET 1 3.363 -3.844 -7.080 4 HB3 MET 1 3HB MET 1 3.450 -4.796 -5.604 5 HG2 MET 1 2HG MET 1 0.780 -3.815 -6.015 6 HG3 MET 1 3HG MET 1 1.353 -4.682 -7.438 7 HE1 MET 1 3HE MET 1 2.464 -6.857 -7.399 8 HE2 MET 1 1HE MET 1 3.294 -7.136 -5.867 9 HE3 MET 1 2HE MET 1 1.977 -8.199 -6.362 10 HA PRO 2 HA PRO 2 6.359 -3.835 -3.129 11 HB2 PRO 2 2HB PRO 2 8.519 -2.936 -4.507 12 HB3 PRO 2 3HB PRO 2 7.733 -4.481 -4.854 13 HG2 PRO 2 2HG PRO 2 7.437 -1.850 -6.250 14 HG3 PRO 2 3HG PRO 2 7.588 -3.474 -6.945 15 HD2 PRO 2 2HD PRO 2 5.207 -2.206 -6.710 16 HD3 PRO 2 3HD PRO 2 5.366 -3.970 -6.589 17 H ALA 3 H ALA 3 7.847 -2.692 -1.767 18 HA ALA 3 HA ALA 3 7.202 0.162 -1.559 19 HB1 ALA 3 1HB ALA 3 8.589 -1.495 0.530 20 HB2 ALA 3 2HB ALA 3 7.734 0.036 0.730 21 HB3 ALA 3 3HB ALA 3 6.832 -1.438 0.377 22 H ALA 4 H ALA 4 9.283 1.114 -0.098 23 HA ALA 4 HA ALA 4 11.562 0.838 -1.947 24 HB1 ALA 4 1HB ALA 4 11.842 3.249 -0.552 25 HB2 ALA 4 2HB ALA 4 11.396 3.031 -2.245 26 HB3 ALA 4 3HB ALA 4 10.142 3.153 -1.011 27 H LEU 5 H LEU 5 13.642 0.726 -1.116 28 HA LEU 5 HA LEU 5 14.016 -0.641 1.276 29 HB2 LEU 5 2HB LEU 5 15.776 0.777 -0.639 30 HB3 LEU 5 3HB LEU 5 16.448 0.404 0.947 31 HG LEU 5 HG LEU 5 15.586 -2.015 0.392 32 HD11 LEU 5 1HD1 LEU 5 14.762 -0.790 -1.895 33 HD12 LEU 5 2HD1 LEU 5 15.081 -2.516 -1.730 34 HD13 LEU 5 3HD1 LEU 5 16.323 -1.449 -2.383 35 HD21 LEU 5 3HD2 LEU 5 17.957 -1.120 0.693 36 HD22 LEU 5 1HD2 LEU 5 18.019 -1.031 -1.068 37 HD23 LEU 5 2HD2 LEU 5 17.761 -2.584 -0.273 38 H VAL 6 H VAL 6 15.741 0.275 2.942 39 HA VAL 6 HA VAL 6 15.001 3.000 3.737 40 HB VAL 6 HB VAL 6 14.912 0.611 5.585 41 HG11 VAL 6 1HG1 VAL 6 15.052 3.517 6.063 42 HG12 VAL 6 2HG1 VAL 6 13.854 2.633 7.011 43 HG13 VAL 6 3HG1 VAL 6 15.555 2.171 7.085 44 HG21 VAL 6 3HG2 VAL 6 12.497 1.486 5.839 45 HG22 VAL 6 1HG2 VAL 6 12.799 2.309 4.309 46 HG23 VAL 6 2HG2 VAL 6 12.909 0.551 4.402 47 H SER 7 H SER 7 16.817 0.365 5.292 48 HA SER 7 HA SER 7 19.386 1.268 4.667 49 HB2 SER 7 2HB SER 7 19.629 2.022 7.305 50 HB3 SER 7 3HB SER 7 19.521 3.129 5.936 51 HG SER 7 HG SER 7 17.956 3.282 7.836 52 H ILE 8 H ILE 8 20.978 0.515 6.584 53 HA ILE 8 HA ILE 8 19.965 -1.991 7.723 54 HB ILE 8 HB ILE 8 21.869 -3.255 6.988 55 HG12 ILE 8 2HG1 ILE 8 23.166 -1.698 5.074 56 HG13 ILE 8 3HG1 ILE 8 22.954 -0.612 6.444 57 HG21 ILE 8 1HG2 ILE 8 21.323 -2.095 4.376 58 HG22 ILE 8 2HG2 ILE 8 20.961 -3.704 4.999 59 HG23 ILE 8 3HG2 ILE 8 19.864 -2.363 5.330 60 HD11 ILE 8 3HD1 ILE 8 24.434 -3.213 6.334 61 HD12 ILE 8 1HD1 ILE 8 25.039 -1.613 6.763 62 HD13 ILE 8 2HD1 ILE 8 23.954 -2.469 7.860 63 H SER 9 H SER 9 21.215 -2.813 9.489 64 HA SER 9 HA SER 9 22.806 -0.719 10.816 65 HB2 SER 9 2HB SER 9 20.615 -2.340 11.728 66 HB3 SER 9 3HB SER 9 22.043 -2.685 12.703 67 HG SER 9 HG SER 9 20.440 -0.614 12.899 68 H VAL 10 H VAL 10 24.909 -1.110 10.635 69 HA VAL 10 HA VAL 10 25.866 -3.881 10.604 70 HB VAL 10 HB VAL 10 26.606 -2.360 8.784 71 HG11 VAL 10 1HG1 VAL 10 27.588 -0.372 9.129 72 HG12 VAL 10 2HG1 VAL 10 26.876 -0.485 10.739 73 HG13 VAL 10 3HG1 VAL 10 28.552 -0.970 10.478 74 HG21 VAL 10 3HG2 VAL 10 29.205 -2.761 9.849 75 HG22 VAL 10 1HG2 VAL 10 28.183 -4.092 10.393 76 HG23 VAL 10 2HG2 VAL 10 28.338 -3.746 8.671 77 H SER 11 H SER 11 27.080 -4.727 12.197 78 HA SER 11 HA SER 11 27.821 -2.945 14.425 79 HB2 SER 11 2HB SER 11 27.361 -5.899 14.754 80 HB3 SER 11 3HB SER 11 27.294 -4.626 15.973 81 HG SER 11 HG SER 11 25.206 -5.080 15.527 82 HA PRO 12 HA PRO 12 31.700 -4.782 12.607 83 HB2 PRO 12 2HB PRO 12 33.055 -2.433 12.498 84 HB3 PRO 12 3HB PRO 12 32.004 -2.997 11.194 85 HG2 PRO 12 2HG PRO 12 31.433 -1.014 13.363 86 HG3 PRO 12 3HG PRO 12 31.027 -0.934 11.638 87 HD2 PRO 12 2HD PRO 12 29.224 -1.649 13.529 88 HD3 PRO 12 3HD PRO 12 29.189 -2.305 11.880 89 H THR 13 H THR 13 33.709 -5.065 13.646 90 HA THR 13 HA THR 13 33.771 -4.136 16.444 91 HB THR 13 HB THR 13 35.123 -6.178 16.929 92 HG1 THR 13 HG1 THR 13 35.610 -7.536 15.362 93 HG21 THR 13 3HG2 THR 13 33.060 -6.709 17.653 94 HG22 THR 13 1HG2 THR 13 32.993 -7.733 16.219 95 HG23 THR 13 2HG2 THR 13 32.287 -6.117 16.183 96 H ASN 14 H ASN 14 35.259 -2.614 16.723 97 HA ASN 14 HA ASN 14 37.641 -2.589 15.027 98 HB2 ASN 14 2HB ASN 14 37.989 -0.316 16.132 99 HB3 ASN 14 3HB ASN 14 36.588 -0.469 15.077 100 HD21 ASN 14 1HD2 ASN 14 34.525 -0.520 15.975 101 HD22 ASN 14 2HD2 ASN 14 34.220 0.008 17.592 102 H SER 15 H SER 15 39.179 -3.899 15.814 103 HA SER 15 HA SER 15 40.458 -3.232 18.281 104 HB2 SER 15 2HB SER 15 38.376 -4.966 18.621 105 HB3 SER 15 3HB SER 15 39.716 -6.084 18.364 106 HG SER 15 HG SER 15 40.642 -5.424 20.179 107 H THR 16 H THR 16 41.966 -5.444 18.746 108 HA THR 16 HA THR 16 43.475 -5.685 16.237 109 HB THR 16 HB THR 16 45.427 -6.181 17.566 110 HG1 THR 16 HG1 THR 16 45.036 -7.148 19.409 111 HG21 THR 16 3HG2 THR 16 44.626 -4.005 19.279 112 HG22 THR 16 1HG2 THR 16 44.052 -3.743 17.633 113 HG23 THR 16 2HG2 THR 16 45.769 -4.008 17.937 114 H VAL 17 H VAL 17 44.288 -7.691 15.556 115 HA VAL 17 HA VAL 17 43.216 -10.067 16.910 116 HB VAL 17 HB VAL 17 41.737 -9.454 14.992 117 HG11 VAL 17 1HG1 VAL 17 44.148 -10.143 13.315 118 HG12 VAL 17 2HG1 VAL 17 42.534 -9.746 12.723 119 HG13 VAL 17 3HG1 VAL 17 43.500 -8.520 13.545 120 HG21 VAL 17 3HG2 VAL 17 41.577 -11.691 14.112 121 HG22 VAL 17 1HG2 VAL 17 43.235 -12.042 14.600 122 HG23 VAL 17 2HG2 VAL 17 41.993 -11.778 15.824 123 H ALA 18 H ALA 18 44.367 -12.014 16.504 124 HA ALA 18 HA ALA 18 47.177 -11.654 16.252 125 HB1 ALA 18 1HB ALA 18 45.353 -13.938 16.739 126 HB2 ALA 18 2HB ALA 18 46.970 -14.305 16.135 127 HB3 ALA 18 3HB ALA 18 46.773 -13.406 17.640 128 H LYS 19 H LYS 19 48.584 -12.598 14.687 129 HA LYS 19 HA LYS 19 47.935 -12.076 12.040 130 HB2 LYS 19 2HB LYS 19 50.003 -13.199 11.451 131 HB3 LYS 19 3HB LYS 19 50.242 -12.244 12.908 132 HG2 LYS 19 2HG LYS 19 49.455 -14.841 13.710 133 HG3 LYS 19 3HG LYS 19 50.721 -15.011 12.492 134 HD2 LYS 19 2HD LYS 19 52.280 -13.867 13.767 135 HD3 LYS 19 3HD LYS 19 51.045 -13.040 14.719 136 HE2 LYS 19 2HE LYS 19 50.498 -15.121 15.850 137 HE3 LYS 19 3HE LYS 19 51.668 -15.989 14.858 138 HZ1 LYS 19 3HZ LYS 19 52.924 -15.604 16.691 139 HZ2 LYS 19 1HZ LYS 19 52.118 -14.175 17.104 140 HZ3 LYS 19 2HZ LYS 19 53.262 -14.170 15.859 141 H GLY 20 H GLY 20 47.244 -13.291 10.318 142 HA2 GLY 20 2HA GLY 20 46.032 -14.933 9.264 143 HA3 GLY 20 3HA GLY 20 47.086 -16.047 10.122 144 H LEU 21 H LEU 21 43.995 -14.421 10.139 145 HA LEU 21 HA LEU 21 42.811 -16.552 11.640 146 HB2 LEU 21 2HB LEU 21 43.886 -14.514 13.150 147 HB3 LEU 21 3HB LEU 21 42.190 -14.057 13.009 148 HG LEU 21 HG LEU 21 41.768 -16.521 13.784 149 HD11 LEU 21 1HD1 LEU 21 43.523 -17.233 15.404 150 HD12 LEU 21 2HD1 LEU 21 44.582 -16.000 14.722 151 HD13 LEU 21 3HD1 LEU 21 44.014 -17.330 13.713 152 HD21 LEU 21 3HD2 LEU 21 40.920 -14.996 15.239 153 HD22 LEU 21 1HD2 LEU 21 42.421 -14.074 15.323 154 HD23 LEU 21 2HD2 LEU 21 42.260 -15.582 16.225 155 H GLN 22 H GLN 22 40.424 -15.906 12.178 156 HA GLN 22 HA GLN 22 39.378 -14.291 9.948 157 HB2 GLN 22 2HB GLN 22 38.653 -17.035 10.851 158 HB3 GLN 22 3HB GLN 22 37.361 -15.997 10.263 159 HG2 GLN 22 2HG GLN 22 38.016 -16.174 8.135 160 HG3 GLN 22 3HG GLN 22 39.726 -16.048 8.547 161 HE21 GLN 22 1HE2 GLN 22 37.154 -18.125 7.741 162 HE22 GLN 22 2HE2 GLN 22 38.016 -19.618 7.845 163 H GLU 23 H GLU 23 37.738 -12.898 10.392 164 HA GLU 23 HA GLU 23 36.766 -12.839 13.174 165 HB2 GLU 23 2HB GLU 23 38.312 -10.920 11.980 166 HB3 GLU 23 3HB GLU 23 36.691 -10.302 11.693 167 HG2 GLU 23 2HG GLU 23 36.972 -9.358 13.703 168 HG3 GLU 23 3HG GLU 23 36.495 -10.948 14.298 169 H ASN 24 H ASN 24 34.665 -13.202 13.353 170 HA ASN 24 HA ASN 24 32.952 -13.126 11.030 171 HB2 ASN 24 2HB ASN 24 31.203 -13.903 12.697 172 HB3 ASN 24 3HB ASN 24 32.592 -14.967 12.494 173 HD21 ASN 24 1HD2 ASN 24 33.659 -15.575 14.245 174 HD22 ASN 24 2HD2 ASN 24 33.497 -14.874 15.815 175 H PHE 25 H PHE 25 31.313 -11.715 10.613 176 HA PHE 25 HA PHE 25 31.067 -9.411 12.436 177 HB2 PHE 25 2HB PHE 25 31.216 -9.564 9.450 178 HB3 PHE 25 3HB PHE 25 30.304 -8.258 10.198 179 HD1 PHE 25 HD2 PHE 25 33.629 -9.727 9.740 180 HD2 PHE 25 HD1 PHE 25 31.407 -6.492 11.388 181 HE1 PHE 25 HE2 PHE 25 35.715 -8.465 10.067 182 HE2 PHE 25 HE1 PHE 25 33.490 -5.225 11.717 183 HZ PHE 25 HZ PHE 25 35.648 -6.211 11.057 184 H LYS 26 H LYS 26 28.928 -8.140 11.703 185 HA LYS 26 HA LYS 26 26.735 -10.010 11.238 186 HB2 LYS 26 2HB LYS 26 27.350 -8.731 13.810 187 HB3 LYS 26 3HB LYS 26 25.690 -8.503 13.276 188 HG2 LYS 26 2HG LYS 26 25.467 -10.946 13.026 189 HG3 LYS 26 3HG LYS 26 27.105 -11.134 13.656 190 HD2 LYS 26 2HD LYS 26 26.353 -9.926 15.719 191 HD3 LYS 26 3HD LYS 26 24.706 -10.003 15.090 192 HE2 LYS 26 2HE LYS 26 25.389 -12.583 14.853 193 HE3 LYS 26 3HE LYS 26 26.420 -12.138 16.212 194 HZ1 LYS 26 3HZ LYS 26 24.584 -11.561 17.505 195 HZ2 LYS 26 1HZ LYS 26 24.101 -12.987 16.734 196 HZ3 LYS 26 2HZ LYS 26 23.535 -11.493 16.179 197 H ALA 27 H ALA 27 25.280 -9.155 9.904 198 HA ALA 27 HA ALA 27 24.914 -6.245 9.850 199 HB1 ALA 27 1HB ALA 27 26.536 -7.017 8.058 200 HB2 ALA 27 2HB ALA 27 25.161 -7.824 7.304 201 HB3 ALA 27 3HB ALA 27 25.149 -6.073 7.513 202 H THR 28 H THR 28 22.837 -5.851 10.182 203 HA THR 28 HA THR 28 20.851 -7.752 9.114 204 HB THR 28 HB THR 28 19.337 -6.873 10.946 205 HG1 THR 28 HG1 THR 28 21.818 -5.905 11.971 206 HG21 THR 28 3HG2 THR 28 20.353 -9.066 11.123 207 HG22 THR 28 1HG2 THR 28 20.371 -8.280 12.701 208 HG23 THR 28 2HG2 THR 28 21.846 -8.357 11.737 209 H GLY 29 H GLY 29 20.168 -6.838 7.256 210 HA2 GLY 29 2HA GLY 29 19.728 -3.962 7.111 211 HA3 GLY 29 3HA GLY 29 19.605 -5.104 5.781 212 H ILE 30 H ILE 30 17.786 -2.948 6.876 213 HA ILE 30 HA ILE 30 15.378 -4.633 7.089 214 HB ILE 30 HB ILE 30 15.794 -1.960 8.432 215 HG12 ILE 30 2HG1 ILE 30 15.288 -3.851 10.386 216 HG13 ILE 30 3HG1 ILE 30 16.350 -4.706 9.272 217 HG21 ILE 30 1HG2 ILE 30 13.470 -3.854 8.295 218 HG22 ILE 30 2HG2 ILE 30 13.643 -2.686 9.604 219 HG23 ILE 30 3HG2 ILE 30 13.511 -2.128 7.937 220 HD11 ILE 30 3HD1 ILE 30 17.083 -1.966 10.176 221 HD12 ILE 30 1HD1 ILE 30 17.335 -3.340 11.252 222 HD13 ILE 30 2HD1 ILE 30 18.117 -3.302 9.672 223 H PHE 31 H PHE 31 14.371 -4.483 5.192 224 HA PHE 31 HA PHE 31 13.987 -1.800 4.041 225 HB2 PHE 31 2HB PHE 31 14.198 -4.301 2.373 226 HB3 PHE 31 3HB PHE 31 14.268 -2.626 1.836 227 HD1 PHE 31 HD1 PHE 31 16.190 -1.460 3.706 228 HD2 PHE 31 HD2 PHE 31 16.217 -5.237 1.745 229 HE1 PHE 31 HE1 PHE 31 18.646 -1.515 3.853 230 HE2 PHE 31 HE2 PHE 31 18.672 -5.299 1.889 231 HZ PHE 31 HZ PHE 31 19.890 -3.436 2.945 232 H THR 32 H THR 32 11.950 -1.260 3.500 233 HA THR 32 HA THR 32 9.791 -2.840 4.433 234 HB THR 32 HB THR 32 9.486 -0.554 2.497 235 HG1 THR 32 HG1 THR 32 9.431 0.712 4.550 236 HG21 THR 32 3HG2 THR 32 7.338 -1.033 2.924 237 HG22 THR 32 1HG2 THR 32 7.622 -0.332 4.516 238 HG23 THR 32 2HG2 THR 32 7.754 -2.076 4.283 239 H ASP 33 H ASP 33 11.498 -2.772 1.474 240 HA ASP 33 HA ASP 33 9.317 -4.115 0.045 241 HB2 ASP 33 2HB ASP 33 10.343 -3.518 -1.960 242 HB3 ASP 33 3HB ASP 33 10.694 -2.136 -0.926 243 H ASN 34 H ASN 34 11.794 -4.939 2.001 244 HA ASN 34 HA ASN 34 11.709 -7.668 1.424 245 HB2 ASN 34 2HB ASN 34 13.511 -6.192 -0.266 246 HB3 ASN 34 3HB ASN 34 14.427 -7.292 0.759 247 HD21 ASN 34 1HD2 ASN 34 12.973 -7.019 -2.135 248 HD22 ASN 34 2HD2 ASN 34 12.627 -8.680 -2.460 249 H SER 35 H SER 35 11.543 -7.757 3.659 250 HA SER 35 HA SER 35 13.531 -6.622 5.379 251 HB2 SER 35 2HB SER 35 12.340 -7.886 7.168 252 HB3 SER 35 3HB SER 35 11.261 -6.884 6.197 253 HG SER 35 HG SER 35 10.926 -9.376 6.682 254 H ASN 36 H ASN 36 15.317 -7.684 4.106 255 HA ASN 36 HA ASN 36 15.894 -10.336 5.254 256 HB2 ASN 36 2HB ASN 36 15.919 -9.448 2.474 257 HB3 ASN 36 3HB ASN 36 17.451 -10.167 2.965 258 HD21 ASN 36 1HD2 ASN 36 17.320 -12.056 1.892 259 HD22 ASN 36 2HD2 ASN 36 16.110 -13.256 2.178 260 H SER 37 H SER 37 18.281 -10.814 5.301 261 HA SER 37 HA SER 37 19.633 -8.564 6.521 262 HB2 SER 37 2HB SER 37 21.139 -10.124 7.424 263 HB3 SER 37 3HB SER 37 19.612 -11.006 7.376 264 HG SER 37 HG SER 37 20.634 -12.409 6.209 265 H ASP 38 H ASP 38 21.952 -8.157 6.017 266 HA ASP 38 HA ASP 38 22.263 -7.501 3.287 267 HB2 ASP 38 2HB ASP 38 24.327 -7.589 5.499 268 HB3 ASP 38 3HB ASP 38 24.553 -6.821 3.929 269 H ILE 39 H ILE 39 22.405 -9.072 1.803 270 HA ILE 39 HA ILE 39 24.739 -10.599 1.516 271 HB ILE 39 HB ILE 39 23.856 -11.948 3.347 272 HG12 ILE 39 2HG1 ILE 39 23.853 -14.144 2.201 273 HG13 ILE 39 3HG1 ILE 39 23.654 -13.323 0.657 274 HG21 ILE 39 1HG2 ILE 39 21.584 -13.004 1.807 275 HG22 ILE 39 2HG2 ILE 39 21.731 -12.665 3.531 276 HG23 ILE 39 3HG2 ILE 39 21.396 -11.354 2.400 277 HD11 ILE 39 3HD1 ILE 39 25.892 -12.177 1.943 278 HD12 ILE 39 1HD1 ILE 39 26.043 -13.930 2.061 279 HD13 ILE 39 2HD1 ILE 39 25.848 -13.165 0.483 280 H THR 40 H THR 40 21.318 -10.259 0.791 281 HA THR 40 HA THR 40 21.326 -11.671 -1.660 282 HB THR 40 HB THR 40 19.488 -9.452 -0.742 283 HG1 THR 40 HG1 THR 40 18.219 -11.099 0.027 284 HG21 THR 40 3HG2 THR 40 19.021 -9.538 -2.992 285 HG22 THR 40 1HG2 THR 40 17.949 -10.805 -2.398 286 HG23 THR 40 2HG2 THR 40 19.493 -11.231 -3.136 287 H ASP 41 H ASP 41 22.146 -8.389 -0.785 288 HA ASP 41 HA ASP 41 22.281 -7.514 -3.548 289 HB2 ASP 41 2HB ASP 41 22.391 -6.239 -0.898 290 HB3 ASP 41 3HB ASP 41 23.461 -5.519 -2.098 291 H GLN 42 H GLN 42 24.147 -9.504 -1.889 292 HA GLN 42 HA GLN 42 26.254 -10.298 -2.306 293 HB2 GLN 42 2HB GLN 42 25.801 -9.022 -4.586 294 HB3 GLN 42 3HB GLN 42 27.016 -7.925 -3.942 295 HG2 GLN 42 2HG GLN 42 28.373 -10.120 -3.556 296 HG3 GLN 42 3HG GLN 42 27.284 -10.769 -4.781 297 HE21 GLN 42 1HE2 GLN 42 29.669 -8.281 -4.118 298 HE22 GLN 42 2HE2 GLN 42 30.130 -8.021 -5.762 299 H VAL 43 H VAL 43 26.167 -6.754 -2.000 300 HA VAL 43 HA VAL 43 27.182 -5.337 -0.531 301 HB VAL 43 HB VAL 43 28.052 -7.748 1.055 302 HG11 VAL 43 1HG1 VAL 43 28.755 -6.278 2.565 303 HG12 VAL 43 2HG1 VAL 43 28.446 -4.998 1.391 304 HG13 VAL 43 3HG1 VAL 43 27.200 -5.448 2.555 305 HG21 VAL 43 3HG2 VAL 43 25.760 -6.797 2.253 306 HG22 VAL 43 1HG2 VAL 43 25.369 -6.752 0.534 307 HG23 VAL 43 2HG2 VAL 43 25.890 -8.262 1.281 308 H THR 44 H THR 44 29.007 -4.292 -0.948 309 HA THR 44 HA THR 44 31.318 -5.802 -1.911 310 HB THR 44 HB THR 44 31.486 -2.860 -1.884 311 HG1 THR 44 HG1 THR 44 29.329 -2.962 -2.427 312 HG21 THR 44 3HG2 THR 44 31.939 -5.033 -3.925 313 HG22 THR 44 1HG2 THR 44 33.157 -4.114 -3.044 314 HG23 THR 44 2HG2 THR 44 32.162 -3.317 -4.263 315 H TRP 45 H TRP 45 33.065 -6.128 -0.704 316 HA TRP 45 HA TRP 45 33.443 -4.449 1.689 317 HB2 TRP 45 2HB TRP 45 33.626 -7.396 1.300 318 HB3 TRP 45 3HB TRP 45 34.769 -6.648 2.411 319 HD1 TRP 45 HD1 TRP 45 30.925 -6.304 1.884 320 HE1 TRP 45 HE1 TRP 45 29.807 -6.396 4.201 321 HE3 TRP 45 HE3 TRP 45 35.101 -6.874 4.777 322 HZ2 TRP 45 HZ2 TRP 45 30.593 -6.673 6.898 323 HZ3 TRP 45 HZ3 TRP 45 34.831 -7.044 7.217 324 HH2 TRP 45 HH2 TRP 45 32.623 -6.945 8.253 325 H ASP 46 H ASP 46 35.423 -3.584 2.052 326 HA ASP 46 HA ASP 46 37.543 -4.239 0.111 327 HB2 ASP 46 2HB ASP 46 36.283 -1.729 0.658 328 HB3 ASP 46 3HB ASP 46 37.970 -1.632 1.155 329 H SER 47 H SER 47 39.654 -4.349 0.853 330 HA SER 47 HA SER 47 40.012 -4.194 3.772 331 HB2 SER 47 2HB SER 47 39.862 -6.564 2.605 332 HB3 SER 47 3HB SER 47 41.541 -6.220 2.190 333 HG SER 47 HG SER 47 40.392 -6.765 4.650 334 H SER 48 H SER 48 42.076 -3.600 4.508 335 HA SER 48 HA SER 48 43.377 -1.599 3.127 336 HB2 SER 48 2HB SER 48 43.690 -2.908 5.613 337 HB3 SER 48 3HB SER 48 45.271 -2.933 4.832 338 HG SER 48 HG SER 48 45.131 -0.686 4.597 339 H ASN 49 H ASN 49 45.239 -1.457 1.894 340 HA ASN 49 HA ASN 49 45.812 -3.743 0.260 341 HB2 ASN 49 2HB ASN 49 47.215 -1.063 0.301 342 HB3 ASN 49 3HB ASN 49 47.254 -2.254 -0.997 343 HD21 ASN 49 1HD2 ASN 49 45.263 -2.694 -2.122 344 HD22 ASN 49 2HD2 ASN 49 44.073 -1.450 -2.265 345 H THR 50 H THR 50 46.496 -4.904 2.362 346 HA THR 50 HA THR 50 49.289 -4.363 3.053 347 HB THR 50 HB THR 50 48.159 -6.629 4.442 348 HG1 THR 50 HG1 THR 50 46.592 -4.304 4.215 349 HG21 THR 50 3HG2 THR 50 49.802 -5.708 5.687 350 HG22 THR 50 1HG2 THR 50 48.502 -4.691 6.308 351 HG23 THR 50 2HG2 THR 50 49.547 -4.097 5.018 352 H ASP 51 H ASP 51 50.202 -6.814 3.779 353 HA ASP 51 HA ASP 51 51.227 -7.905 1.481 354 HB2 ASP 51 2HB ASP 51 50.685 -9.301 4.110 355 HB3 ASP 51 3HB ASP 51 51.728 -9.931 2.839 356 H ILE 52 H ILE 52 48.641 -9.437 3.409 357 HA ILE 52 HA ILE 52 47.330 -10.272 0.938 358 HB ILE 52 HB ILE 52 48.677 -12.188 1.334 359 HG12 ILE 52 2HG1 ILE 52 47.013 -13.919 1.767 360 HG13 ILE 52 3HG1 ILE 52 45.958 -12.743 2.542 361 HG21 ILE 52 1HG2 ILE 52 49.551 -12.410 3.374 362 HG22 ILE 52 2HG2 ILE 52 48.236 -11.507 4.123 363 HG23 ILE 52 3HG2 ILE 52 48.053 -13.232 3.808 364 HD11 ILE 52 3HD1 ILE 52 46.761 -12.107 -0.213 365 HD12 ILE 52 1HD1 ILE 52 45.726 -13.522 -0.017 366 HD13 ILE 52 2HD1 ILE 52 45.196 -11.951 0.585 367 H LEU 53 H LEU 53 45.503 -9.118 1.320 368 HA LEU 53 HA LEU 53 44.008 -9.782 3.770 369 HB2 LEU 53 2HB LEU 53 44.471 -7.181 2.409 370 HB3 LEU 53 3HB LEU 53 42.906 -7.451 3.173 371 HG LEU 53 HG LEU 53 44.635 -6.220 4.546 372 HD11 LEU 53 1HD1 LEU 53 42.598 -7.767 5.299 373 HD12 LEU 53 2HD1 LEU 53 43.661 -6.960 6.451 374 HD13 LEU 53 3HD1 LEU 53 43.917 -8.660 6.056 375 HD21 LEU 53 3HD2 LEU 53 46.435 -7.936 3.777 376 HD22 LEU 53 1HD2 LEU 53 45.823 -8.901 5.121 377 HD23 LEU 53 2HD2 LEU 53 46.483 -7.292 5.419 378 H SER 54 H SER 54 42.080 -10.686 3.469 379 HA SER 54 HA SER 54 40.699 -10.275 0.908 380 HB2 SER 54 2HB SER 54 41.939 -12.690 1.719 381 HB3 SER 54 3HB SER 54 40.199 -12.939 1.855 382 HG SER 54 HG SER 54 40.071 -12.956 -0.237 383 H ILE 55 H ILE 55 38.499 -10.143 1.020 384 HA ILE 55 HA ILE 55 37.303 -10.393 3.704 385 HB ILE 55 HB ILE 55 35.663 -8.625 2.889 386 HG12 ILE 55 2HG1 ILE 55 36.681 -8.946 0.469 387 HG13 ILE 55 3HG1 ILE 55 36.077 -7.379 0.997 388 HG21 ILE 55 1HG2 ILE 55 37.110 -7.925 4.557 389 HG22 ILE 55 2HG2 ILE 55 38.537 -8.114 3.539 390 HG23 ILE 55 3HG2 ILE 55 37.429 -6.769 3.264 391 HD11 ILE 55 3HD1 ILE 55 38.168 -6.474 1.150 392 HD12 ILE 55 1HD1 ILE 55 38.944 -8.031 1.436 393 HD13 ILE 55 2HD1 ILE 55 38.396 -7.604 -0.185 394 H SER 56 H SER 56 35.574 -11.672 3.889 395 HA SER 56 HA SER 56 34.201 -12.520 1.423 396 HB2 SER 56 2HB SER 56 35.351 -14.127 3.640 397 HB3 SER 56 3HB SER 56 33.795 -14.659 3.003 398 HG SER 56 HG SER 56 36.201 -14.270 1.551 399 H ASN 57 H ASN 57 32.074 -12.207 1.397 400 HA ASN 57 HA ASN 57 30.488 -12.335 3.802 401 HB2 ASN 57 2HB ASN 57 29.509 -9.986 3.224 402 HB3 ASN 57 3HB ASN 57 30.999 -10.093 4.158 403 HD21 ASN 57 1HD2 ASN 57 29.523 -9.007 1.285 404 HD22 ASN 57 2HD2 ASN 57 30.924 -8.307 0.556 405 H ALA 58 H ALA 58 30.406 -13.946 1.595 406 HA ALA 58 HA ALA 58 27.948 -13.083 0.213 407 HB1 ALA 58 1HB ALA 58 30.171 -13.511 -1.094 408 HB2 ALA 58 2HB ALA 58 29.713 -15.205 -0.916 409 HB3 ALA 58 3HB ALA 58 28.632 -14.082 -1.741 410 H SER 59 H SER 59 29.380 -15.386 2.287 411 HA SER 59 HA SER 59 27.758 -17.633 1.752 412 HB2 SER 59 2HB SER 59 29.754 -16.878 3.684 413 HB3 SER 59 3HB SER 59 28.398 -17.651 4.503 414 HG SER 59 HG SER 59 28.750 -19.479 3.407 415 H ASP 60 H ASP 60 27.386 -14.896 3.958 416 HA ASP 60 HA ASP 60 24.576 -14.964 3.883 417 HB2 ASP 60 2HB ASP 60 25.573 -16.926 5.558 418 HB3 ASP 60 3HB ASP 60 25.218 -15.600 6.662 419 H SER 61 H SER 61 23.890 -13.838 6.286 420 HA SER 61 HA SER 61 24.535 -11.181 5.991 421 HB2 SER 61 2HB SER 61 22.793 -11.266 7.432 422 HB3 SER 61 3HB SER 61 23.299 -12.820 8.095 423 HG SER 61 HG SER 61 23.451 -11.173 9.656 424 H HIS 62 H HIS 62 25.854 -13.316 8.530 425 HA HIS 62 HA HIS 62 27.790 -11.529 9.461 426 HB2 HIS 62 2HB HIS 62 28.740 -13.370 10.637 427 HB3 HIS 62 3HB HIS 62 27.004 -13.659 10.583 428 HD1 HIS 62 HD1 HIS 62 26.185 -15.528 8.898 429 HD2 HIS 62 HD2 HIS 62 30.297 -15.305 9.450 430 HE1 HIS 62 HE1 HIS 62 27.103 -17.684 7.987 431 H GLY 63 H GLY 63 29.805 -10.996 8.823 432 HA2 GLY 63 2HA GLY 63 30.748 -12.195 6.304 433 HA3 GLY 63 3HA GLY 63 31.183 -10.598 6.896 434 H LEU 64 H LEU 64 32.712 -13.134 6.108 435 HA LEU 64 HA LEU 64 34.245 -13.486 8.590 436 HB2 LEU 64 2HB LEU 64 35.284 -15.403 7.232 437 HB3 LEU 64 3HB LEU 64 33.647 -15.597 7.856 438 HG LEU 64 HG LEU 64 33.704 -14.514 5.151 439 HD11 LEU 64 1HD1 LEU 64 34.417 -16.548 4.043 440 HD12 LEU 64 2HD1 LEU 64 34.808 -17.284 5.598 441 HD13 LEU 64 3HD1 LEU 64 35.730 -15.894 5.024 442 HD21 LEU 64 3HD2 LEU 64 31.743 -15.438 6.420 443 HD22 LEU 64 1HD2 LEU 64 32.460 -17.037 6.226 444 HD23 LEU 64 2HD2 LEU 64 31.976 -16.111 4.805 445 H ALA 65 H ALA 65 35.664 -11.812 8.620 446 HA ALA 65 HA ALA 65 37.117 -11.038 6.240 447 HB1 ALA 65 1HB ALA 65 38.271 -9.472 7.892 448 HB2 ALA 65 2HB ALA 65 36.547 -9.224 7.609 449 HB3 ALA 65 3HB ALA 65 37.091 -10.045 9.073 450 H SER 66 H SER 66 39.039 -11.790 5.634 451 HA SER 66 HA SER 66 40.578 -13.389 7.571 452 HB2 SER 66 2HB SER 66 39.732 -14.709 5.681 453 HB3 SER 66 3HB SER 66 40.517 -13.606 4.551 454 HG SER 66 HG SER 66 42.268 -14.716 4.814 455 H THR 67 H THR 67 42.210 -12.228 8.350 456 HA THR 67 HA THR 67 43.790 -10.604 6.463 457 HB THR 67 HB THR 67 42.736 -9.043 7.907 458 HG1 THR 67 HG1 THR 67 44.665 -8.183 8.020 459 HG21 THR 67 3HG2 THR 67 43.503 -9.594 10.510 460 HG22 THR 67 1HG2 THR 67 43.025 -11.166 9.872 461 HG23 THR 67 2HG2 THR 67 41.892 -9.816 9.829 462 H LEU 68 H LEU 68 45.909 -11.031 6.346 463 HA LEU 68 HA LEU 68 47.231 -12.431 8.543 464 HB2 LEU 68 2HB LEU 68 46.306 -13.988 6.662 465 HB3 LEU 68 3HB LEU 68 47.696 -13.396 5.754 466 HG LEU 68 HG LEU 68 48.323 -14.409 8.440 467 HD11 LEU 68 1HD1 LEU 68 47.896 -16.651 8.108 468 HD12 LEU 68 2HD1 LEU 68 47.723 -16.470 6.363 469 HD13 LEU 68 3HD1 LEU 68 46.446 -15.901 7.438 470 HD21 LEU 68 3HD2 LEU 68 49.449 -14.505 5.677 471 HD22 LEU 68 1HD2 LEU 68 49.996 -15.670 6.883 472 HD23 LEU 68 2HD2 LEU 68 50.190 -13.942 7.177 473 H ASN 69 H ASN 69 47.923 -10.059 8.538 474 HA ASN 69 HA ASN 69 50.389 -9.850 6.954 475 HB2 ASN 69 2HB ASN 69 50.012 -7.505 6.533 476 HB3 ASN 69 3HB ASN 69 48.600 -8.399 5.980 477 HD21 ASN 69 1HD2 ASN 69 46.866 -8.635 7.717 478 HD22 ASN 69 2HD2 ASN 69 46.502 -7.205 8.616 479 H GLN 70 H GLN 70 51.757 -7.943 7.881 480 HA GLN 70 HA GLN 70 51.726 -8.192 10.816 481 HB2 GLN 70 2HB GLN 70 53.962 -8.144 8.830 482 HB3 GLN 70 3HB GLN 70 54.247 -7.536 10.455 483 HG2 GLN 70 2HG GLN 70 53.468 -9.708 11.353 484 HG3 GLN 70 3HG GLN 70 53.340 -10.302 9.698 485 HE21 GLN 70 1HE2 GLN 70 55.020 -11.379 8.974 486 HE22 GLN 70 2HE2 GLN 70 56.645 -11.241 9.544 487 H GLY 71 H GLY 71 50.276 -6.342 10.858 488 HA2 GLY 71 2HA GLY 71 51.492 -3.963 11.549 489 HA3 GLY 71 3HA GLY 71 51.097 -3.805 9.844 490 H ASN 72 H ASN 72 49.332 -2.610 9.621 491 HA ASN 72 HA ASN 72 47.014 -3.229 11.321 492 HB2 ASN 72 2HB ASN 72 46.518 -0.953 11.691 493 HB3 ASN 72 3HB ASN 72 48.255 -1.077 11.959 494 HD21 ASN 72 1HD2 ASN 72 45.754 0.274 10.046 495 HD22 ASN 72 2HD2 ASN 72 46.754 1.245 9.025 496 H VAL 73 H VAL 73 45.078 -3.334 10.297 497 HA VAL 73 HA VAL 73 44.935 -2.458 7.496 498 HB VAL 73 HB VAL 73 43.824 -4.493 6.815 499 HG11 VAL 73 1HG1 VAL 73 45.677 -5.997 6.841 500 HG12 VAL 73 2HG1 VAL 73 46.325 -4.356 6.792 501 HG13 VAL 73 3HG1 VAL 73 46.327 -5.261 8.306 502 HG21 VAL 73 3HG2 VAL 73 44.175 -5.343 9.685 503 HG22 VAL 73 1HG2 VAL 73 42.661 -5.103 8.813 504 HG23 VAL 73 2HG2 VAL 73 43.726 -6.440 8.379 505 H LYS 74 H LYS 74 43.013 -1.598 6.881 506 HA LYS 74 HA LYS 74 40.853 -1.591 8.888 507 HB2 LYS 74 2HB LYS 74 42.244 0.593 8.211 508 HB3 LYS 74 3HB LYS 74 41.052 0.628 6.918 509 HG2 LYS 74 2HG LYS 74 40.128 0.289 9.729 510 HG3 LYS 74 3HG LYS 74 40.627 1.886 9.168 511 HD2 LYS 74 2HD LYS 74 38.936 1.984 7.564 512 HD3 LYS 74 3HD LYS 74 38.682 0.237 7.590 513 HE2 LYS 74 2HE LYS 74 36.904 0.784 8.864 514 HE3 LYS 74 3HE LYS 74 38.106 0.842 10.152 515 HZ1 LYS 74 3HZ LYS 74 36.702 2.813 10.141 516 HZ2 LYS 74 1HZ LYS 74 37.182 3.172 8.558 517 HZ3 LYS 74 2HZ LYS 74 38.312 3.219 9.815 518 H VAL 75 H VAL 75 39.161 -2.722 8.222 519 HA VAL 75 HA VAL 75 38.693 -3.097 5.364 520 HB VAL 75 HB VAL 75 37.215 -4.382 7.661 521 HG11 VAL 75 1HG1 VAL 75 37.521 -5.372 4.838 522 HG12 VAL 75 2HG1 VAL 75 36.396 -5.930 6.078 523 HG13 VAL 75 3HG1 VAL 75 36.186 -4.339 5.346 524 HG21 VAL 75 3HG2 VAL 75 38.672 -6.335 7.278 525 HG22 VAL 75 1HG2 VAL 75 39.626 -5.377 6.146 526 HG23 VAL 75 2HG2 VAL 75 39.568 -4.928 7.850 527 H THR 76 H THR 76 37.282 -1.885 4.305 528 HA THR 76 HA THR 76 35.053 -0.673 5.808 529 HB THR 76 HB THR 76 35.137 1.230 4.215 530 HG1 THR 76 HG1 THR 76 36.305 0.068 2.550 531 HG21 THR 76 3HG2 THR 76 37.780 0.825 5.614 532 HG22 THR 76 1HG2 THR 76 36.289 1.274 6.440 533 HG23 THR 76 2HG2 THR 76 36.990 2.356 5.237 534 H ALA 77 H ALA 77 33.067 -1.068 5.058 535 HA ALA 77 HA ALA 77 32.712 -1.869 2.264 536 HB1 ALA 77 1HB ALA 77 31.336 -3.773 2.865 537 HB2 ALA 77 2HB ALA 77 32.948 -3.942 3.562 538 HB3 ALA 77 3HB ALA 77 31.595 -3.446 4.579 539 H SER 78 H SER 78 30.535 -1.657 1.492 540 HA SER 78 HA SER 78 28.708 -0.152 3.219 541 HB2 SER 78 2HB SER 78 30.271 1.182 1.429 542 HB3 SER 78 3HB SER 78 28.849 0.841 0.444 543 HG SER 78 HG SER 78 27.636 1.725 2.305 544 H ILE 79 H ILE 79 26.576 -0.555 2.869 545 HA ILE 79 HA ILE 79 25.827 -2.142 0.517 546 HB ILE 79 HB ILE 79 26.115 -3.802 2.218 547 HG12 ILE 79 2HG1 ILE 79 23.851 -4.717 2.374 548 HG13 ILE 79 3HG1 ILE 79 23.170 -3.140 1.990 549 HG21 ILE 79 1HG2 ILE 79 24.208 -3.156 4.189 550 HG22 ILE 79 2HG2 ILE 79 25.958 -3.265 4.364 551 HG23 ILE 79 3HG2 ILE 79 25.208 -1.723 3.953 552 HD11 ILE 79 3HD1 ILE 79 23.108 -4.563 0.053 553 HD12 ILE 79 1HD1 ILE 79 24.247 -3.244 -0.216 554 HD13 ILE 79 2HD1 ILE 79 24.842 -4.858 0.175 555 H GLY 80 H GLY 80 24.289 -1.052 -0.507 556 HA2 GLY 80 2HA GLY 80 22.415 0.210 -0.910 557 HA3 GLY 80 3HA GLY 80 21.822 -0.378 0.636 558 H GLY 81 H GLY 81 21.667 1.012 2.300 559 HA2 GLY 81 2HA GLY 81 22.444 3.780 1.786 560 HA3 GLY 81 3HA GLY 81 21.365 3.221 3.056 561 H ILE 82 H ILE 82 22.205 2.555 5.025 562 HA ILE 82 HA ILE 82 24.441 3.846 5.994 563 HB ILE 82 HB ILE 82 23.331 1.246 7.056 564 HG12 ILE 82 2HG1 ILE 82 21.544 2.873 6.820 565 HG13 ILE 82 3HG1 ILE 82 21.954 2.701 8.523 566 HG21 ILE 82 1HG2 ILE 82 25.425 1.716 8.084 567 HG22 ILE 82 2HG2 ILE 82 25.003 3.413 8.308 568 HG23 ILE 82 3HG2 ILE 82 24.166 2.167 9.234 569 HD11 ILE 82 3HD1 ILE 82 23.242 4.763 8.427 570 HD12 ILE 82 1HD1 ILE 82 22.852 4.932 6.716 571 HD13 ILE 82 2HD1 ILE 82 21.572 5.024 7.925 572 H GLN 83 H GLN 83 26.554 3.225 6.483 573 HA GLN 83 HA GLN 83 27.532 0.883 4.987 574 HB2 GLN 83 2HB GLN 83 29.533 2.050 4.470 575 HB3 GLN 83 3HB GLN 83 28.214 3.158 4.117 576 HG2 GLN 83 2HG GLN 83 28.677 3.942 6.593 577 HG3 GLN 83 3HG GLN 83 30.271 3.269 6.251 578 HE21 GLN 83 1HE2 GLN 83 30.873 3.911 3.801 579 HE22 GLN 83 2HE2 GLN 83 30.823 5.617 3.530 580 H GLY 84 H GLY 84 29.543 -0.084 5.848 581 HA2 GLY 84 2HA GLY 84 29.622 0.119 8.796 582 HA3 GLY 84 3HA GLY 84 29.775 -1.406 7.937 583 H SER 85 H SER 85 31.590 0.014 9.831 584 HA SER 85 HA SER 85 34.003 -0.241 8.202 585 HB2 SER 85 2HB SER 85 34.015 2.011 10.140 586 HB3 SER 85 3HB SER 85 34.822 1.861 8.579 587 HG SER 85 HG SER 85 32.796 2.221 7.585 588 H THR 86 H THR 86 35.641 -1.235 9.236 589 HA THR 86 HA THR 86 35.512 -1.502 12.157 590 HB THR 86 HB THR 86 34.565 -3.560 11.486 591 HG1 THR 86 HG1 THR 86 35.927 -4.528 12.772 592 HG21 THR 86 3HG2 THR 86 36.388 -4.837 9.808 593 HG22 THR 86 1HG2 THR 86 36.241 -3.206 9.156 594 HG23 THR 86 2HG2 THR 86 34.803 -4.206 9.362 595 H ASP 87 H ASP 87 37.522 -1.993 13.169 596 HA ASP 87 HA ASP 87 39.860 -1.380 11.482 597 HB2 ASP 87 2HB ASP 87 39.656 0.453 12.931 598 HB3 ASP 87 3HB ASP 87 39.170 -0.557 14.290 599 H PHE 88 H PHE 88 41.395 -2.879 11.364 600 HA PHE 88 HA PHE 88 41.521 -4.929 13.474 601 HB2 PHE 88 2HB PHE 88 41.577 -5.264 10.486 602 HB3 PHE 88 3HB PHE 88 42.303 -6.466 11.547 603 HD1 PHE 88 HD1 PHE 88 40.499 -6.719 13.745 604 HD2 PHE 88 HD2 PHE 88 39.619 -6.095 9.628 605 HE1 PHE 88 HE1 PHE 88 38.298 -7.771 14.060 606 HE2 PHE 88 HE2 PHE 88 37.416 -7.146 9.936 607 HZ PHE 88 HZ PHE 88 36.752 -7.985 12.154 608 H LYS 89 H LYS 89 43.382 -4.776 14.517 609 HA LYS 89 HA LYS 89 45.768 -3.893 13.033 610 HB2 LYS 89 2HB LYS 89 44.796 -3.395 15.795 611 HB3 LYS 89 3HB LYS 89 46.532 -3.577 15.584 612 HG2 LYS 89 2HG LYS 89 45.834 -1.849 13.560 613 HG3 LYS 89 3HG LYS 89 44.790 -1.358 14.895 614 HD2 LYS 89 2HD LYS 89 47.160 -1.691 16.177 615 HD3 LYS 89 3HD LYS 89 47.706 -1.140 14.592 616 HE2 LYS 89 2HE LYS 89 46.135 0.777 14.784 617 HE3 LYS 89 3HE LYS 89 45.756 0.251 16.424 618 HZ1 LYS 89 3HZ LYS 89 47.565 1.256 17.177 619 HZ2 LYS 89 1HZ LYS 89 47.819 1.907 15.636 620 HZ3 LYS 89 2HZ LYS 89 48.558 0.449 16.071 621 H VAL 90 H VAL 90 46.956 -5.591 12.451 622 HA VAL 90 HA VAL 90 47.074 -7.948 14.176 623 HB VAL 90 HB VAL 90 48.297 -7.601 11.438 624 HG11 VAL 90 1HG1 VAL 90 47.648 -10.053 13.071 625 HG12 VAL 90 2HG1 VAL 90 48.271 -10.059 11.420 626 HG13 VAL 90 3HG1 VAL 90 49.257 -9.416 12.734 627 HG21 VAL 90 3HG2 VAL 90 45.533 -8.349 12.282 628 HG22 VAL 90 1HG2 VAL 90 46.066 -7.344 10.934 629 HG23 VAL 90 2HG2 VAL 90 46.234 -9.097 10.847 630 H THR 91 H THR 91 48.569 -7.877 15.721 631 HA THR 91 HA THR 91 51.256 -6.895 15.011 632 HB THR 91 HB THR 91 51.506 -6.276 17.445 633 HG1 THR 91 HG1 THR 91 48.667 -6.342 17.495 634 HG21 THR 91 3HG2 THR 91 49.474 -4.857 15.729 635 HG22 THR 91 1HG2 THR 91 51.197 -4.512 15.871 636 HG23 THR 91 2HG2 THR 91 50.117 -4.183 17.226 637 H GLN 92 H GLN 92 53.009 -7.837 16.313 638 HA GLN 92 HA GLN 92 52.483 -10.289 17.734 639 HB2 GLN 92 2HB GLN 92 53.736 -11.751 16.272 640 HB3 GLN 92 3HB GLN 92 52.422 -11.014 15.366 641 HG2 GLN 92 2HG GLN 92 53.834 -10.182 13.885 642 HG3 GLN 92 3HG GLN 92 54.772 -9.394 15.153 643 HE21 GLN 92 1HE2 GLN 92 54.276 -12.517 13.574 644 HE22 GLN 92 2HE2 GLN 92 55.911 -13.054 13.726 Start of MODEL 12 1 H1 MET 1 H MET 1 9.457 -0.994 -7.568 2 HA MET 1 HA MET 1 8.392 -0.260 -5.668 3 HB2 MET 1 2HB MET 1 6.664 -2.044 -7.206 4 HB3 MET 1 3HB MET 1 6.168 -1.896 -5.525 5 HG2 MET 1 2HG MET 1 6.490 0.669 -6.004 6 HG3 MET 1 3HG MET 1 6.243 0.154 -7.671 7 HE1 MET 1 3HE MET 1 2.741 1.622 -6.886 8 HE2 MET 1 1HE MET 1 4.293 2.258 -6.340 9 HE3 MET 1 2HE MET 1 4.128 1.620 -7.976 10 HA PRO 2 HA PRO 2 7.908 -4.124 -2.817 11 HB2 PRO 2 2HB PRO 2 8.500 -6.551 -3.881 12 HB3 PRO 2 3HB PRO 2 6.882 -5.843 -3.945 13 HG2 PRO 2 2HG PRO 2 9.007 -5.904 -6.052 14 HG3 PRO 2 3HG PRO 2 7.264 -6.187 -6.213 15 HD2 PRO 2 2HD PRO 2 8.425 -3.831 -6.873 16 HD3 PRO 2 3HD PRO 2 6.773 -3.935 -6.230 17 H ALA 3 H ALA 3 9.460 -5.092 -1.471 18 HA ALA 3 HA ALA 3 11.529 -5.450 -0.594 19 HB1 ALA 3 1HB ALA 3 12.504 -5.807 -3.419 20 HB2 ALA 3 2HB ALA 3 13.179 -6.493 -1.940 21 HB3 ALA 3 3HB ALA 3 11.616 -7.051 -2.538 22 H ALA 4 H ALA 4 10.690 -2.761 -1.337 23 HA ALA 4 HA ALA 4 12.913 -1.340 -2.418 24 HB1 ALA 4 1HB ALA 4 10.699 -0.200 -0.726 25 HB2 ALA 4 2HB ALA 4 11.704 0.643 -1.905 26 HB3 ALA 4 3HB ALA 4 10.530 -0.557 -2.445 27 H LEU 5 H LEU 5 14.806 -1.191 -1.412 28 HA LEU 5 HA LEU 5 15.363 -1.748 1.230 29 HB2 LEU 5 2HB LEU 5 16.840 0.255 -0.468 30 HB3 LEU 5 3HB LEU 5 17.478 -0.646 0.907 31 HG LEU 5 HG LEU 5 16.467 -2.289 -1.320 32 HD11 LEU 5 1HD1 LEU 5 17.506 -0.437 -2.548 33 HD12 LEU 5 2HD1 LEU 5 18.423 -1.934 -2.711 34 HD13 LEU 5 3HD1 LEU 5 18.991 -0.667 -1.624 35 HD21 LEU 5 3HD2 LEU 5 18.857 -2.279 0.504 36 HD22 LEU 5 1HD2 LEU 5 18.689 -3.411 -0.838 37 HD23 LEU 5 2HD2 LEU 5 17.506 -3.414 0.471 38 H VAL 6 H VAL 6 16.284 -0.158 2.856 39 HA VAL 6 HA VAL 6 15.021 2.460 2.856 40 HB VAL 6 HB VAL 6 14.436 0.441 5.027 41 HG11 VAL 6 1HG1 VAL 6 12.888 2.369 5.775 42 HG12 VAL 6 2HG1 VAL 6 14.609 2.465 6.156 43 HG13 VAL 6 3HG1 VAL 6 13.950 3.388 4.804 44 HG21 VAL 6 3HG2 VAL 6 12.082 0.759 4.322 45 HG22 VAL 6 1HG2 VAL 6 12.652 1.733 2.966 46 HG23 VAL 6 2HG2 VAL 6 13.085 0.026 3.071 47 H SER 7 H SER 7 16.725 0.133 4.955 48 HA SER 7 HA SER 7 19.049 1.704 5.192 49 HB2 SER 7 2HB SER 7 18.715 2.216 7.700 50 HB3 SER 7 3HB SER 7 17.908 3.265 6.534 51 HG SER 7 HG SER 7 16.596 2.468 8.342 52 H ILE 8 H ILE 8 20.563 0.830 6.825 53 HA ILE 8 HA ILE 8 19.875 -1.840 7.806 54 HB ILE 8 HB ILE 8 22.402 -1.335 6.238 55 HG12 ILE 8 2HG1 ILE 8 21.105 -3.077 4.694 56 HG13 ILE 8 3HG1 ILE 8 19.702 -2.281 5.400 57 HG21 ILE 8 1HG2 ILE 8 21.355 -3.551 7.849 58 HG22 ILE 8 2HG2 ILE 8 21.993 -4.019 6.274 59 HG23 ILE 8 3HG2 ILE 8 23.016 -3.146 7.415 60 HD11 ILE 8 3HD1 ILE 8 21.829 -0.540 4.315 61 HD12 ILE 8 1HD1 ILE 8 20.856 -1.450 3.159 62 HD13 ILE 8 2HD1 ILE 8 20.076 -0.347 4.293 63 H SER 9 H SER 9 21.169 -2.579 9.527 64 HA SER 9 HA SER 9 22.768 -0.463 10.810 65 HB2 SER 9 2HB SER 9 20.689 -2.264 11.824 66 HB3 SER 9 3HB SER 9 22.141 -2.237 12.824 67 HG SER 9 HG SER 9 20.269 -0.255 12.355 68 H VAL 10 H VAL 10 24.865 -0.862 10.565 69 HA VAL 10 HA VAL 10 25.818 -3.630 10.508 70 HB VAL 10 HB VAL 10 26.546 -2.110 8.697 71 HG11 VAL 10 1HG1 VAL 10 28.487 -0.676 10.343 72 HG12 VAL 10 2HG1 VAL 10 27.452 -0.092 9.039 73 HG13 VAL 10 3HG1 VAL 10 26.812 -0.238 10.676 74 HG21 VAL 10 3HG2 VAL 10 29.160 -2.447 9.678 75 HG22 VAL 10 1HG2 VAL 10 28.198 -3.762 10.355 76 HG23 VAL 10 2HG2 VAL 10 28.260 -3.523 8.609 77 H SER 11 H SER 11 27.042 -4.503 12.076 78 HA SER 11 HA SER 11 27.785 -2.764 14.336 79 HB2 SER 11 2HB SER 11 26.711 -5.552 14.213 80 HB3 SER 11 3HB SER 11 27.787 -5.119 15.541 81 HG SER 11 HG SER 11 26.346 -3.639 16.245 82 HA PRO 12 HA PRO 12 31.715 -4.366 12.444 83 HB2 PRO 12 2HB PRO 12 33.009 -1.981 12.542 84 HB3 PRO 12 3HB PRO 12 31.979 -2.460 11.188 85 HG2 PRO 12 2HG PRO 12 31.348 -0.683 13.513 86 HG3 PRO 12 3HG PRO 12 30.946 -0.468 11.799 87 HD2 PRO 12 2HD PRO 12 29.156 -1.386 13.612 88 HD3 PRO 12 3HD PRO 12 29.144 -1.901 11.913 89 H THR 13 H THR 13 33.706 -4.718 13.478 90 HA THR 13 HA THR 13 33.749 -3.999 16.337 91 HB THR 13 HB THR 13 33.494 -6.342 16.264 92 HG1 THR 13 HG1 THR 13 35.317 -6.947 17.315 93 HG21 THR 13 3HG2 THR 13 34.817 -7.826 14.861 94 HG22 THR 13 1HG2 THR 13 35.703 -6.449 14.206 95 HG23 THR 13 2HG2 THR 13 33.982 -6.633 13.866 96 H ASN 14 H ASN 14 35.224 -2.493 16.741 97 HA ASN 14 HA ASN 14 37.603 -2.303 15.054 98 HB2 ASN 14 2HB ASN 14 37.942 -0.132 16.324 99 HB3 ASN 14 3HB ASN 14 36.500 -0.210 15.316 100 HD21 ASN 14 1HD2 ASN 14 34.471 -0.442 16.306 101 HD22 ASN 14 2HD2 ASN 14 34.230 -0.029 17.967 102 H SER 15 H SER 15 38.858 -3.998 15.819 103 HA SER 15 HA SER 15 40.288 -3.438 18.269 104 HB2 SER 15 2HB SER 15 38.146 -5.048 18.594 105 HB3 SER 15 3HB SER 15 39.353 -6.250 18.139 106 HG SER 15 HG SER 15 39.100 -5.618 20.473 107 H THR 16 H THR 16 41.710 -5.727 18.580 108 HA THR 16 HA THR 16 43.130 -5.935 16.011 109 HB THR 16 HB THR 16 45.145 -6.367 17.201 110 HG1 THR 16 HG1 THR 16 43.466 -6.614 19.487 111 HG21 THR 16 3HG2 THR 16 45.439 -4.225 17.757 112 HG22 THR 16 1HG2 THR 16 44.355 -4.373 19.140 113 HG23 THR 16 2HG2 THR 16 43.703 -4.002 17.544 114 H VAL 17 H VAL 17 44.137 -7.997 15.495 115 HA VAL 17 HA VAL 17 42.863 -10.320 16.764 116 HB VAL 17 HB VAL 17 42.429 -11.360 14.616 117 HG11 VAL 17 1HG1 VAL 17 40.427 -10.384 14.467 118 HG12 VAL 17 2HG1 VAL 17 41.003 -9.269 15.707 119 HG13 VAL 17 3HG1 VAL 17 41.125 -8.834 14.002 120 HG21 VAL 17 3HG2 VAL 17 44.126 -9.227 13.652 121 HG22 VAL 17 1HG2 VAL 17 43.655 -10.734 12.866 122 HG23 VAL 17 2HG2 VAL 17 42.619 -9.313 12.741 123 H ALA 18 H ALA 18 43.997 -12.317 16.476 124 HA ALA 18 HA ALA 18 46.823 -12.027 16.602 125 HB1 ALA 18 1HB ALA 18 46.357 -14.728 16.296 126 HB2 ALA 18 2HB ALA 18 46.432 -13.850 17.824 127 HB3 ALA 18 3HB ALA 18 44.875 -14.135 17.047 128 H LYS 19 H LYS 19 48.354 -13.272 15.266 129 HA LYS 19 HA LYS 19 48.275 -12.572 12.597 130 HB2 LYS 19 2HB LYS 19 50.255 -13.399 14.000 131 HB3 LYS 19 3HB LYS 19 49.724 -15.022 13.583 132 HG2 LYS 19 2HG LYS 19 50.062 -13.132 11.341 133 HG3 LYS 19 3HG LYS 19 51.531 -13.659 12.166 134 HD2 LYS 19 2HD LYS 19 50.971 -15.975 11.766 135 HD3 LYS 19 3HD LYS 19 49.421 -15.512 11.060 136 HE2 LYS 19 2HE LYS 19 50.361 -14.836 9.101 137 HE3 LYS 19 3HE LYS 19 51.860 -14.319 9.873 138 HZ1 LYS 19 3HZ LYS 19 51.675 -16.501 8.386 139 HZ2 LYS 19 1HZ LYS 19 51.317 -17.176 9.895 140 HZ3 LYS 19 2HZ LYS 19 52.776 -16.352 9.661 141 H GLY 20 H GLY 20 47.257 -13.320 10.850 142 HA2 GLY 20 2HA GLY 20 45.854 -14.598 9.554 143 HA3 GLY 20 3HA GLY 20 46.791 -15.955 10.160 144 H LEU 21 H LEU 21 43.911 -14.018 10.617 145 HA LEU 21 HA LEU 21 42.659 -16.276 11.974 146 HB2 LEU 21 2HB LEU 21 43.563 -14.037 13.379 147 HB3 LEU 21 3HB LEU 21 41.823 -13.810 13.215 148 HG LEU 21 HG LEU 21 41.683 -16.242 14.126 149 HD11 LEU 21 1HD1 LEU 21 43.779 -16.139 15.894 150 HD12 LEU 21 2HD1 LEU 21 44.520 -15.630 14.377 151 HD13 LEU 21 3HD1 LEU 21 43.678 -17.177 14.472 152 HD21 LEU 21 3HD2 LEU 21 40.723 -14.653 15.478 153 HD22 LEU 21 1HD2 LEU 21 42.206 -13.706 15.605 154 HD23 LEU 21 2HD2 LEU 21 42.042 -15.212 16.509 155 H GLN 22 H GLN 22 40.234 -15.274 12.563 156 HA GLN 22 HA GLN 22 39.219 -13.769 10.296 157 HB2 GLN 22 2HB GLN 22 39.253 -16.137 9.538 158 HB3 GLN 22 3HB GLN 22 38.204 -16.554 10.886 159 HG2 GLN 22 2HG GLN 22 37.258 -14.385 9.129 160 HG3 GLN 22 3HG GLN 22 37.315 -15.999 8.421 161 HE21 GLN 22 1HE2 GLN 22 35.757 -17.415 8.905 162 HE22 GLN 22 2HE2 GLN 22 34.496 -17.145 10.055 163 H GLU 23 H GLU 23 37.396 -12.638 10.766 164 HA GLU 23 HA GLU 23 36.132 -13.160 13.375 165 HB2 GLU 23 2HB GLU 23 37.570 -10.862 12.575 166 HB3 GLU 23 3HB GLU 23 35.873 -10.403 12.611 167 HG2 GLU 23 2HG GLU 23 37.300 -11.753 14.888 168 HG3 GLU 23 3HG GLU 23 37.101 -10.009 14.736 169 H ASN 24 H ASN 24 33.947 -13.169 13.442 170 HA ASN 24 HA ASN 24 32.553 -12.943 10.885 171 HB2 ASN 24 2HB ASN 24 30.650 -13.995 12.172 172 HB3 ASN 24 3HB ASN 24 32.100 -14.986 12.039 173 HD21 ASN 24 1HD2 ASN 24 33.162 -15.591 13.844 174 HD22 ASN 24 2HD2 ASN 24 32.661 -15.187 15.447 175 H PHE 25 H PHE 25 30.929 -11.510 10.481 176 HA PHE 25 HA PHE 25 30.432 -9.478 12.556 177 HB2 PHE 25 2HB PHE 25 30.663 -9.221 9.562 178 HB3 PHE 25 3HB PHE 25 29.896 -7.979 10.547 179 HD1 PHE 25 HD2 PHE 25 33.036 -10.000 10.573 180 HD2 PHE 25 HD1 PHE 25 31.204 -6.201 11.139 181 HE1 PHE 25 HE2 PHE 25 35.241 -9.010 11.033 182 HE2 PHE 25 HE1 PHE 25 33.406 -5.204 11.599 183 HZ PHE 25 HZ PHE 25 35.428 -6.609 11.548 184 H LYS 26 H LYS 26 28.316 -8.190 11.886 185 HA LYS 26 HA LYS 26 26.231 -10.004 10.948 186 HB2 LYS 26 2HB LYS 26 26.511 -10.190 13.485 187 HB3 LYS 26 3HB LYS 26 25.894 -8.545 13.563 188 HG2 LYS 26 2HG LYS 26 23.804 -9.207 12.619 189 HG3 LYS 26 3HG LYS 26 24.416 -10.827 12.274 190 HD2 LYS 26 2HD LYS 26 24.126 -11.525 14.400 191 HD3 LYS 26 3HD LYS 26 24.626 -9.977 15.085 192 HE2 LYS 26 2HE LYS 26 22.500 -9.464 15.460 193 HE3 LYS 26 3HE LYS 26 22.171 -9.568 13.731 194 HZ1 LYS 26 3HZ LYS 26 22.126 -12.125 14.315 195 HZ2 LYS 26 1HZ LYS 26 20.753 -11.150 14.478 196 HZ3 LYS 26 2HZ LYS 26 21.685 -11.532 15.836 197 H ALA 27 H ALA 27 24.853 -8.970 9.658 198 HA ALA 27 HA ALA 27 24.387 -6.103 10.055 199 HB1 ALA 27 1HB ALA 27 24.408 -6.136 7.381 200 HB2 ALA 27 2HB ALA 27 25.834 -5.762 8.349 201 HB3 ALA 27 3HB ALA 27 25.615 -7.384 7.692 202 H THR 28 H THR 28 22.282 -5.715 10.144 203 HA THR 28 HA THR 28 20.453 -7.539 8.721 204 HB THR 28 HB THR 28 18.835 -6.440 10.588 205 HG1 THR 28 HG1 THR 28 19.988 -5.621 12.151 206 HG21 THR 28 3HG2 THR 28 20.347 -8.945 10.338 207 HG22 THR 28 1HG2 THR 28 18.628 -8.683 10.629 208 HG23 THR 28 2HG2 THR 28 19.772 -8.594 11.968 209 H GLY 29 H GLY 29 19.936 -6.469 6.892 210 HA2 GLY 29 2HA GLY 29 19.454 -3.598 6.957 211 HA3 GLY 29 3HA GLY 29 19.477 -4.620 5.528 212 H ILE 30 H ILE 30 17.529 -2.729 7.294 213 HA ILE 30 HA ILE 30 15.155 -4.402 7.228 214 HB ILE 30 HB ILE 30 15.279 -1.469 7.912 215 HG12 ILE 30 2HG1 ILE 30 16.872 -2.605 9.344 216 HG13 ILE 30 3HG1 ILE 30 15.436 -2.208 10.282 217 HG21 ILE 30 1HG2 ILE 30 13.271 -3.648 8.202 218 HG22 ILE 30 2HG2 ILE 30 13.322 -2.372 9.417 219 HG23 ILE 30 3HG2 ILE 30 13.050 -1.965 7.723 220 HD11 ILE 30 3HD1 ILE 30 14.661 -4.498 10.097 221 HD12 ILE 30 1HD1 ILE 30 16.064 -4.906 9.108 222 HD13 ILE 30 2HD1 ILE 30 16.279 -4.437 10.795 223 H PHE 31 H PHE 31 14.240 -4.703 5.302 224 HA PHE 31 HA PHE 31 13.808 -2.343 3.596 225 HB2 PHE 31 2HB PHE 31 14.163 -5.110 2.468 226 HB3 PHE 31 3HB PHE 31 14.274 -3.562 1.636 227 HD1 PHE 31 HD1 PHE 31 16.083 -2.034 3.311 228 HD2 PHE 31 HD2 PHE 31 16.206 -6.147 2.222 229 HE1 PHE 31 HE1 PHE 31 18.523 -2.040 3.623 230 HE2 PHE 31 HE2 PHE 31 18.647 -6.160 2.533 231 HZ PHE 31 HZ PHE 31 19.808 -4.105 3.235 232 H THR 32 H THR 32 12.063 -2.957 1.853 233 HA THR 32 HA THR 32 9.645 -3.378 3.243 234 HB THR 32 HB THR 32 9.972 -3.625 0.254 235 HG1 THR 32 HG1 THR 32 10.957 -1.699 0.774 236 HG21 THR 32 3HG2 THR 32 7.714 -2.836 2.083 237 HG22 THR 32 1HG2 THR 32 7.764 -4.163 0.924 238 HG23 THR 32 2HG2 THR 32 7.701 -2.496 0.353 239 H ASP 33 H ASP 33 11.922 -5.575 2.097 240 HA ASP 33 HA ASP 33 10.065 -7.716 1.516 241 HB2 ASP 33 2HB ASP 33 12.281 -7.448 0.354 242 HB3 ASP 33 3HB ASP 33 13.061 -7.894 1.870 243 H ASN 34 H ASN 34 10.207 -6.402 4.217 244 HA ASN 34 HA ASN 34 9.854 -7.063 6.369 245 HB2 ASN 34 2HB ASN 34 10.249 -9.942 5.624 246 HB3 ASN 34 3HB ASN 34 9.161 -9.243 6.820 247 HD21 ASN 34 1HD2 ASN 34 7.654 -7.514 5.634 248 HD22 ASN 34 2HD2 ASN 34 6.806 -8.174 4.281 249 H SER 35 H SER 35 12.300 -6.166 5.877 250 HA SER 35 HA SER 35 14.465 -6.152 6.580 251 HB2 SER 35 2HB SER 35 13.383 -6.354 8.785 252 HB3 SER 35 3HB SER 35 13.415 -8.111 8.638 253 HG SER 35 HG SER 35 15.177 -7.272 9.867 254 H ASN 36 H ASN 36 15.538 -7.049 4.868 255 HA ASN 36 HA ASN 36 15.752 -9.947 4.667 256 HB2 ASN 36 2HB ASN 36 15.415 -8.347 2.677 257 HB3 ASN 36 3HB ASN 36 17.121 -7.956 2.870 258 HD21 ASN 36 1HD2 ASN 36 15.265 -10.973 3.069 259 HD22 ASN 36 2HD2 ASN 36 16.218 -11.833 1.913 260 H SER 37 H SER 37 17.935 -10.893 4.259 261 HA SER 37 HA SER 37 19.776 -9.920 6.295 262 HB2 SER 37 2HB SER 37 19.211 -12.506 5.013 263 HB3 SER 37 3HB SER 37 20.925 -12.196 5.287 264 HG SER 37 HG SER 37 20.377 -12.965 7.197 265 H ASP 38 H ASP 38 22.090 -9.821 5.865 266 HA ASP 38 HA ASP 38 22.697 -8.212 3.642 267 HB2 ASP 38 2HB ASP 38 24.002 -9.040 6.006 268 HB3 ASP 38 3HB ASP 38 25.066 -9.475 4.671 269 H ILE 39 H ILE 39 22.495 -8.985 1.628 270 HA ILE 39 HA ILE 39 24.370 -10.783 0.567 271 HB ILE 39 HB ILE 39 23.075 -12.508 1.703 272 HG12 ILE 39 2HG1 ILE 39 22.548 -13.918 -0.266 273 HG13 ILE 39 3HG1 ILE 39 22.659 -12.494 -1.295 274 HG21 ILE 39 1HG2 ILE 39 20.836 -12.624 1.748 275 HG22 ILE 39 2HG2 ILE 39 20.903 -10.942 1.224 276 HG23 ILE 39 3HG2 ILE 39 20.682 -12.227 0.037 277 HD11 ILE 39 3HD1 ILE 39 24.974 -13.243 0.422 278 HD12 ILE 39 1HD1 ILE 39 24.671 -14.124 -1.076 279 HD13 ILE 39 2HD1 ILE 39 24.943 -12.381 -1.116 280 H THR 40 H THR 40 21.222 -9.263 0.288 281 HA THR 40 HA THR 40 20.726 -9.489 -2.417 282 HB THR 40 HB THR 40 20.178 -7.133 -0.605 283 HG1 THR 40 HG1 THR 40 18.600 -9.350 -1.457 284 HG21 THR 40 3HG2 THR 40 20.015 -6.247 -2.781 285 HG22 THR 40 1HG2 THR 40 18.362 -6.675 -2.344 286 HG23 THR 40 2HG2 THR 40 19.290 -7.722 -3.418 287 H ASP 41 H ASP 41 22.762 -7.117 -0.747 288 HA ASP 41 HA ASP 41 23.595 -5.988 -3.308 289 HB2 ASP 41 2HB ASP 41 23.005 -4.544 -1.304 290 HB3 ASP 41 3HB ASP 41 24.489 -5.127 -0.556 291 H GLN 42 H GLN 42 24.414 -8.632 -1.716 292 HA GLN 42 HA GLN 42 26.224 -10.012 -1.762 293 HB2 GLN 42 2HB GLN 42 26.417 -8.769 -4.095 294 HB3 GLN 42 3HB GLN 42 27.844 -8.070 -3.342 295 HG2 GLN 42 2HG GLN 42 29.015 -9.959 -3.525 296 HG3 GLN 42 3HG GLN 42 27.654 -10.965 -3.033 297 HE21 GLN 42 1HE2 GLN 42 29.533 -9.825 -5.622 298 HE22 GLN 42 2HE2 GLN 42 28.649 -10.570 -6.905 299 H VAL 43 H VAL 43 25.989 -7.368 -0.085 300 HA VAL 43 HA VAL 43 27.166 -6.298 1.552 301 HB VAL 43 HB VAL 43 28.716 -8.882 1.726 302 HG11 VAL 43 1HG1 VAL 43 29.579 -6.991 3.052 303 HG12 VAL 43 2HG1 VAL 43 28.008 -6.853 3.844 304 HG13 VAL 43 3HG1 VAL 43 28.982 -8.308 4.062 305 HG21 VAL 43 3HG2 VAL 43 26.427 -9.511 1.731 306 HG22 VAL 43 1HG2 VAL 43 26.953 -9.508 3.415 307 HG23 VAL 43 2HG2 VAL 43 25.990 -8.169 2.788 308 H THR 44 H THR 44 28.208 -4.724 0.329 309 HA THR 44 HA THR 44 30.687 -5.223 -1.012 310 HB THR 44 HB THR 44 29.983 -2.441 -0.257 311 HG1 THR 44 HG1 THR 44 28.143 -2.395 -1.384 312 HG21 THR 44 3HG2 THR 44 31.789 -3.380 -1.921 313 HG22 THR 44 1HG2 THR 44 30.893 -1.911 -2.305 314 HG23 THR 44 2HG2 THR 44 30.421 -3.446 -3.032 315 H TRP 45 H TRP 45 32.509 -5.622 0.053 316 HA TRP 45 HA TRP 45 33.189 -3.913 2.343 317 HB2 TRP 45 2HB TRP 45 32.522 -6.604 2.582 318 HB3 TRP 45 3HB TRP 45 34.284 -6.598 2.598 319 HD1 TRP 45 HD1 TRP 45 35.024 -4.178 4.309 320 HE1 TRP 45 HE1 TRP 45 34.359 -4.002 6.789 321 HE3 TRP 45 HE3 TRP 45 31.107 -7.463 4.334 322 HZ2 TRP 45 HZ2 TRP 45 32.430 -5.110 8.527 323 HZ3 TRP 45 HZ3 TRP 45 29.905 -7.850 6.446 324 HH2 TRP 45 HH2 TRP 45 30.555 -6.697 8.498 325 H ASP 46 H ASP 46 35.355 -3.394 2.557 326 HA ASP 46 HA ASP 46 37.174 -4.413 0.485 327 HB2 ASP 46 2HB ASP 46 36.136 -1.762 0.669 328 HB3 ASP 46 3HB ASP 46 37.856 -1.705 1.044 329 H SER 47 H SER 47 39.331 -4.577 1.065 330 HA SER 47 HA SER 47 39.962 -3.983 3.880 331 HB2 SER 47 2HB SER 47 39.563 -6.485 3.152 332 HB3 SER 47 3HB SER 47 41.202 -6.342 2.515 333 HG SER 47 HG SER 47 40.298 -6.267 5.161 334 H SER 48 H SER 48 42.111 -3.424 4.345 335 HA SER 48 HA SER 48 43.403 -1.821 2.468 336 HB2 SER 48 2HB SER 48 43.672 -2.256 5.159 337 HB3 SER 48 3HB SER 48 45.165 -2.957 4.534 338 HG SER 48 HG SER 48 45.671 -0.869 4.762 339 H ASN 49 H ASN 49 45.944 -2.238 2.145 340 HA ASN 49 HA ASN 49 46.320 -4.970 1.137 341 HB2 ASN 49 2HB ASN 49 46.579 -2.400 -0.397 342 HB3 ASN 49 3HB ASN 49 47.537 -3.807 -0.847 343 HD21 ASN 49 1HD2 ASN 49 45.845 -2.818 -2.664 344 HD22 ASN 49 2HD2 ASN 49 44.480 -3.857 -2.868 345 H THR 50 H THR 50 47.384 -4.346 3.477 346 HA THR 50 HA THR 50 49.980 -3.143 3.282 347 HB THR 50 HB THR 50 48.943 -4.884 5.523 348 HG1 THR 50 HG1 THR 50 47.612 -2.969 4.899 349 HG21 THR 50 3HG2 THR 50 51.380 -3.403 5.068 350 HG22 THR 50 1HG2 THR 50 50.971 -4.510 6.377 351 HG23 THR 50 2HG2 THR 50 50.536 -2.805 6.495 352 H ASP 51 H ASP 51 48.688 -6.349 2.970 353 HA ASP 51 HA ASP 51 51.028 -7.381 1.805 354 HB2 ASP 51 2HB ASP 51 51.495 -7.225 4.418 355 HB3 ASP 51 3HB ASP 51 50.605 -8.746 4.422 356 H ILE 52 H ILE 52 48.592 -8.715 4.047 357 HA ILE 52 HA ILE 52 47.403 -10.179 1.805 358 HB ILE 52 HB ILE 52 48.143 -11.492 4.422 359 HG12 ILE 52 2HG1 ILE 52 49.266 -11.989 1.658 360 HG13 ILE 52 3HG1 ILE 52 50.074 -11.037 2.898 361 HG21 ILE 52 1HG2 ILE 52 46.809 -12.566 1.942 362 HG22 ILE 52 2HG2 ILE 52 47.395 -13.560 3.274 363 HG23 ILE 52 3HG2 ILE 52 46.096 -12.399 3.546 364 HD11 ILE 52 3HD1 ILE 52 50.280 -13.776 2.461 365 HD12 ILE 52 1HD1 ILE 52 50.913 -12.859 3.828 366 HD13 ILE 52 2HD1 ILE 52 49.320 -13.610 3.931 367 H LEU 53 H LEU 53 45.322 -9.680 1.769 368 HA LEU 53 HA LEU 53 43.790 -9.715 4.251 369 HB2 LEU 53 2HB LEU 53 43.656 -7.412 2.312 370 HB3 LEU 53 3HB LEU 53 42.702 -7.605 3.782 371 HG LEU 53 HG LEU 53 45.077 -7.622 4.923 372 HD11 LEU 53 1HD1 LEU 53 45.952 -5.604 3.071 373 HD12 LEU 53 2HD1 LEU 53 45.787 -7.161 2.262 374 HD13 LEU 53 3HD1 LEU 53 46.815 -7.013 3.687 375 HD21 LEU 53 3HD2 LEU 53 44.812 -4.927 4.587 376 HD22 LEU 53 1HD2 LEU 53 43.905 -5.900 5.746 377 HD23 LEU 53 2HD2 LEU 53 43.196 -5.507 4.179 378 H SER 54 H SER 54 41.940 -10.782 3.990 379 HA SER 54 HA SER 54 40.689 -10.854 1.338 380 HB2 SER 54 2HB SER 54 42.020 -13.056 2.613 381 HB3 SER 54 3HB SER 54 40.296 -13.410 2.493 382 HG SER 54 HG SER 54 41.632 -13.994 0.626 383 H ILE 55 H ILE 55 38.588 -10.422 1.433 384 HA ILE 55 HA ILE 55 37.210 -10.766 4.016 385 HB ILE 55 HB ILE 55 35.645 -8.959 3.128 386 HG12 ILE 55 2HG1 ILE 55 36.829 -9.239 0.781 387 HG13 ILE 55 3HG1 ILE 55 36.210 -7.676 1.301 388 HG21 ILE 55 1HG2 ILE 55 36.997 -8.343 4.918 389 HG22 ILE 55 2HG2 ILE 55 38.478 -8.481 3.971 390 HG23 ILE 55 3HG2 ILE 55 37.374 -7.134 3.691 391 HD11 ILE 55 3HD1 ILE 55 38.604 -7.911 0.282 392 HD12 ILE 55 1HD1 ILE 55 38.295 -6.804 1.619 393 HD13 ILE 55 2HD1 ILE 55 39.028 -8.379 1.929 394 H SER 56 H SER 56 35.497 -12.070 4.064 395 HA SER 56 HA SER 56 34.231 -12.808 1.507 396 HB2 SER 56 2HB SER 56 35.509 -14.493 3.490 397 HB3 SER 56 3HB SER 56 33.822 -14.952 3.261 398 HG SER 56 HG SER 56 35.428 -15.936 1.804 399 H ASN 57 H ASN 57 32.258 -11.968 1.469 400 HA ASN 57 HA ASN 57 30.524 -12.348 3.797 401 HB2 ASN 57 2HB ASN 57 30.419 -9.740 2.316 402 HB3 ASN 57 3HB ASN 57 29.842 -10.120 3.936 403 HD21 ASN 57 1HD2 ASN 57 32.617 -9.361 1.983 404 HD22 ASN 57 2HD2 ASN 57 33.681 -8.976 3.288 405 H ALA 58 H ALA 58 30.585 -13.850 1.437 406 HA ALA 58 HA ALA 58 28.101 -12.992 0.100 407 HB1 ALA 58 1HB ALA 58 28.858 -13.741 -1.918 408 HB2 ALA 58 2HB ALA 58 30.391 -13.265 -1.186 409 HB3 ALA 58 3HB ALA 58 29.909 -14.961 -1.198 410 H SER 59 H SER 59 29.710 -15.474 1.873 411 HA SER 59 HA SER 59 28.200 -17.718 1.194 412 HB2 SER 59 2HB SER 59 29.743 -16.897 3.624 413 HB3 SER 59 3HB SER 59 28.722 -18.333 3.707 414 HG SER 59 HG SER 59 29.869 -19.115 1.857 415 H ASP 60 H ASP 60 27.576 -15.175 3.569 416 HA ASP 60 HA ASP 60 24.765 -15.502 3.390 417 HB2 ASP 60 2HB ASP 60 25.957 -17.323 5.112 418 HB3 ASP 60 3HB ASP 60 25.402 -16.039 6.183 419 H SER 61 H SER 61 23.927 -14.436 5.772 420 HA SER 61 HA SER 61 24.304 -11.727 5.462 421 HB2 SER 61 2HB SER 61 22.536 -11.999 6.853 422 HB3 SER 61 3HB SER 61 23.201 -13.468 7.567 423 HG SER 61 HG SER 61 24.271 -12.298 9.031 424 H HIS 62 H HIS 62 25.685 -13.608 8.163 425 HA HIS 62 HA HIS 62 27.419 -11.671 9.105 426 HB2 HIS 62 2HB HIS 62 28.533 -13.398 10.301 427 HB3 HIS 62 3HB HIS 62 26.849 -13.898 10.178 428 HD1 HIS 62 HD1 HIS 62 26.691 -15.293 7.557 429 HD2 HIS 62 HD2 HIS 62 29.994 -15.651 10.052 430 HE1 HIS 62 HE1 HIS 62 27.809 -17.445 6.888 431 H GLY 63 H GLY 63 29.632 -11.249 8.810 432 HA2 GLY 63 2HA GLY 63 30.696 -12.187 6.216 433 HA3 GLY 63 3HA GLY 63 30.937 -10.556 6.824 434 H LEU 64 H LEU 64 32.529 -13.293 6.286 435 HA LEU 64 HA LEU 64 34.083 -13.287 8.764 436 HB2 LEU 64 2HB LEU 64 35.221 -15.261 7.708 437 HB3 LEU 64 3HB LEU 64 33.507 -15.465 8.068 438 HG LEU 64 HG LEU 64 34.039 -14.553 5.338 439 HD11 LEU 64 1HD1 LEU 64 34.816 -16.753 4.559 440 HD12 LEU 64 2HD1 LEU 64 35.028 -17.256 6.235 441 HD13 LEU 64 3HD1 LEU 64 36.004 -15.942 5.579 442 HD21 LEU 64 3HD2 LEU 64 31.904 -15.502 6.526 443 HD22 LEU 64 1HD2 LEU 64 32.615 -17.059 6.098 444 HD23 LEU 64 2HD2 LEU 64 32.238 -15.885 4.837 445 H ALA 65 H ALA 65 35.620 -11.780 8.830 446 HA ALA 65 HA ALA 65 37.140 -11.195 6.381 447 HB1 ALA 65 1HB ALA 65 37.621 -9.067 7.239 448 HB2 ALA 65 2HB ALA 65 35.928 -9.346 7.652 449 HB3 ALA 65 3HB ALA 65 37.179 -9.534 8.882 450 H SER 66 H SER 66 39.167 -11.886 6.214 451 HA SER 66 HA SER 66 40.630 -12.564 8.681 452 HB2 SER 66 2HB SER 66 40.647 -14.060 6.049 453 HB3 SER 66 3HB SER 66 41.711 -14.410 7.411 454 HG SER 66 HG SER 66 39.845 -15.751 7.381 455 H THR 67 H THR 67 42.772 -12.010 8.782 456 HA THR 67 HA THR 67 43.999 -10.758 6.434 457 HB THR 67 HB THR 67 43.074 -8.877 7.632 458 HG1 THR 67 HG1 THR 67 45.818 -8.949 8.352 459 HG21 THR 67 3HG2 THR 67 43.478 -8.418 9.933 460 HG22 THR 67 1HG2 THR 67 44.640 -9.738 10.060 461 HG23 THR 67 2HG2 THR 67 42.925 -10.089 9.840 462 H LEU 68 H LEU 68 46.015 -11.447 6.146 463 HA LEU 68 HA LEU 68 47.460 -12.552 8.465 464 HB2 LEU 68 2HB LEU 68 47.804 -13.428 5.608 465 HB3 LEU 68 3HB LEU 68 48.458 -14.190 7.056 466 HG LEU 68 HG LEU 68 45.717 -14.265 7.448 467 HD11 LEU 68 1HD1 LEU 68 45.329 -13.603 5.137 468 HD12 LEU 68 2HD1 LEU 68 44.827 -15.271 5.407 469 HD13 LEU 68 3HD1 LEU 68 46.344 -14.931 4.575 470 HD21 LEU 68 3HD2 LEU 68 47.757 -16.258 6.522 471 HD22 LEU 68 1HD2 LEU 68 46.073 -16.719 6.774 472 HD23 LEU 68 2HD2 LEU 68 47.022 -16.077 8.116 473 H ASN 69 H ASN 69 47.604 -9.842 7.753 474 HA ASN 69 HA ASN 69 50.155 -9.554 6.350 475 HB2 ASN 69 2HB ASN 69 49.628 -7.300 6.027 476 HB3 ASN 69 3HB ASN 69 48.057 -8.090 5.920 477 HD21 ASN 69 1HD2 ASN 69 50.079 -5.969 7.738 478 HD22 ASN 69 2HD2 ASN 69 48.880 -5.447 8.866 479 H GLN 70 H GLN 70 51.564 -7.705 7.336 480 HA GLN 70 HA GLN 70 51.889 -8.301 10.201 481 HB2 GLN 70 2HB GLN 70 53.967 -7.537 8.144 482 HB3 GLN 70 3HB GLN 70 54.288 -7.736 9.861 483 HG2 GLN 70 2HG GLN 70 53.362 -10.102 9.568 484 HG3 GLN 70 3HG GLN 70 53.555 -9.818 7.839 485 HE21 GLN 70 1HE2 GLN 70 55.148 -11.312 7.523 486 HE22 GLN 70 2HE2 GLN 70 56.741 -11.156 8.171 487 H GLY 71 H GLY 71 50.389 -6.579 10.697 488 HA2 GLY 71 2HA GLY 71 51.396 -4.292 11.681 489 HA3 GLY 71 3HA GLY 71 51.149 -3.868 9.993 490 H ASN 72 H ASN 72 49.451 -2.527 10.002 491 HA ASN 72 HA ASN 72 46.976 -3.492 11.272 492 HB2 ASN 72 2HB ASN 72 46.408 -1.035 11.592 493 HB3 ASN 72 3HB ASN 72 47.680 -1.673 12.629 494 HD21 ASN 72 1HD2 ASN 72 46.890 0.488 10.066 495 HD22 ASN 72 2HD2 ASN 72 48.425 1.275 9.968 496 H VAL 73 H VAL 73 45.085 -3.236 10.133 497 HA VAL 73 HA VAL 73 45.249 -1.955 7.495 498 HB VAL 73 HB VAL 73 44.072 -3.778 6.429 499 HG11 VAL 73 1HG1 VAL 73 46.416 -4.004 6.285 500 HG12 VAL 73 2HG1 VAL 73 46.542 -4.570 7.952 501 HG13 VAL 73 3HG1 VAL 73 45.809 -5.601 6.722 502 HG21 VAL 73 3HG2 VAL 73 42.674 -4.687 8.060 503 HG22 VAL 73 1HG2 VAL 73 43.866 -5.957 7.783 504 HG23 VAL 73 2HG2 VAL 73 43.997 -4.918 9.202 505 H LYS 74 H LYS 74 43.446 -0.874 6.864 506 HA LYS 74 HA LYS 74 41.272 -0.715 8.824 507 HB2 LYS 74 2HB LYS 74 42.693 1.236 7.400 508 HB3 LYS 74 3HB LYS 74 41.097 1.200 6.661 509 HG2 LYS 74 2HG LYS 74 41.455 1.384 9.632 510 HG3 LYS 74 3HG LYS 74 41.474 2.813 8.596 511 HD2 LYS 74 2HD LYS 74 39.246 2.357 7.826 512 HD3 LYS 74 3HD LYS 74 39.228 0.801 8.659 513 HE2 LYS 74 2HE LYS 74 39.010 1.772 10.744 514 HE3 LYS 74 3HE LYS 74 39.699 3.306 10.216 515 HZ1 LYS 74 3HZ LYS 74 37.544 3.288 8.722 516 HZ2 LYS 74 1HZ LYS 74 37.523 3.882 10.305 517 HZ3 LYS 74 2HZ LYS 74 36.960 2.321 9.981 518 H VAL 75 H VAL 75 39.395 -1.669 8.426 519 HA VAL 75 HA VAL 75 38.762 -2.427 5.653 520 HB VAL 75 HB VAL 75 37.672 -3.625 8.203 521 HG11 VAL 75 1HG1 VAL 75 36.673 -5.297 6.818 522 HG12 VAL 75 2HG1 VAL 75 36.194 -3.719 6.190 523 HG13 VAL 75 3HG1 VAL 75 37.455 -4.647 5.377 524 HG21 VAL 75 3HG2 VAL 75 39.123 -5.569 6.896 525 HG22 VAL 75 1HG2 VAL 75 40.117 -4.125 6.707 526 HG23 VAL 75 2HG2 VAL 75 39.646 -4.667 8.318 527 H THR 76 H THR 76 36.849 -1.851 4.738 528 HA THR 76 HA THR 76 34.833 -0.507 6.376 529 HB THR 76 HB THR 76 35.235 0.882 3.841 530 HG1 THR 76 HG1 THR 76 37.293 0.974 5.814 531 HG21 THR 76 3HG2 THR 76 33.783 1.852 5.425 532 HG22 THR 76 1HG2 THR 76 35.239 2.845 5.471 533 HG23 THR 76 2HG2 THR 76 34.946 1.650 6.735 534 H ALA 77 H ALA 77 32.747 -0.545 5.516 535 HA ALA 77 HA ALA 77 32.375 -1.973 2.980 536 HB1 ALA 77 1HB ALA 77 31.948 -3.127 5.512 537 HB2 ALA 77 2HB ALA 77 30.356 -2.816 4.818 538 HB3 ALA 77 3HB ALA 77 31.530 -3.789 3.932 539 H SER 78 H SER 78 30.111 -1.823 2.184 540 HA SER 78 HA SER 78 28.565 0.408 3.244 541 HB2 SER 78 2HB SER 78 30.103 0.479 0.718 542 HB3 SER 78 3HB SER 78 28.440 1.058 0.613 543 HG SER 78 HG SER 78 30.548 2.338 1.564 544 H ILE 79 H ILE 79 26.405 0.213 2.899 545 HA ILE 79 HA ILE 79 25.469 -1.836 1.020 546 HB ILE 79 HB ILE 79 25.486 -3.005 3.107 547 HG12 ILE 79 2HG1 ILE 79 23.103 -3.505 3.399 548 HG13 ILE 79 3HG1 ILE 79 22.677 -2.017 2.562 549 HG21 ILE 79 1HG2 ILE 79 23.668 -1.554 4.724 550 HG22 ILE 79 2HG2 ILE 79 25.361 -1.929 5.042 551 HG23 ILE 79 3HG2 ILE 79 24.931 -0.441 4.199 552 HD11 ILE 79 3HD1 ILE 79 22.676 -4.336 1.335 553 HD12 ILE 79 1HD1 ILE 79 23.188 -2.863 0.512 554 HD13 ILE 79 2HD1 ILE 79 24.394 -3.982 1.150 555 H GLY 80 H GLY 80 24.234 -0.744 -0.365 556 HA2 GLY 80 2HA GLY 80 22.628 0.667 -1.198 557 HA3 GLY 80 3HA GLY 80 21.797 0.414 0.330 558 H GLY 81 H GLY 81 21.801 2.004 1.857 559 HA2 GLY 81 2HA GLY 81 23.009 4.551 1.014 560 HA3 GLY 81 3HA GLY 81 21.639 4.384 2.102 561 H ILE 82 H ILE 82 22.311 2.882 4.090 562 HA ILE 82 HA ILE 82 24.067 4.401 5.647 563 HB ILE 82 HB ILE 82 23.837 2.751 7.352 564 HG12 ILE 82 2HG1 ILE 82 22.392 0.630 6.276 565 HG13 ILE 82 3HG1 ILE 82 23.646 0.940 5.080 566 HG21 ILE 82 1HG2 ILE 82 21.550 2.794 7.642 567 HG22 ILE 82 2HG2 ILE 82 21.782 4.069 6.447 568 HG23 ILE 82 3HG2 ILE 82 21.222 2.476 5.938 569 HD11 ILE 82 3HD1 ILE 82 25.223 0.054 6.366 570 HD12 ILE 82 1HD1 ILE 82 24.671 0.929 7.794 571 HD13 ILE 82 2HD1 ILE 82 23.902 -0.592 7.340 572 H GLN 83 H GLN 83 26.102 3.808 6.603 573 HA GLN 83 HA GLN 83 27.670 1.841 5.095 574 HB2 GLN 83 2HB GLN 83 29.533 3.383 4.867 575 HB3 GLN 83 3HB GLN 83 28.099 4.058 4.106 576 HG2 GLN 83 2HG GLN 83 27.741 5.534 5.965 577 HG3 GLN 83 3HG GLN 83 29.061 4.785 6.862 578 HE21 GLN 83 1HE2 GLN 83 29.601 7.174 6.896 579 HE22 GLN 83 2HE2 GLN 83 30.633 7.746 5.634 580 H GLY 84 H GLY 84 29.725 1.276 6.180 581 HA2 GLY 84 2HA GLY 84 29.763 1.852 9.056 582 HA3 GLY 84 3HA GLY 84 29.646 0.174 8.548 583 H SER 85 H SER 85 31.734 1.081 10.129 584 HA SER 85 HA SER 85 33.988 0.534 8.360 585 HB2 SER 85 2HB SER 85 35.174 2.447 8.778 586 HB3 SER 85 3HB SER 85 33.550 3.115 8.939 587 HG SER 85 HG SER 85 35.215 3.466 10.696 588 H THR 86 H THR 86 35.784 -0.389 9.401 589 HA THR 86 HA THR 86 35.573 -0.940 12.260 590 HB THR 86 HB THR 86 34.450 -2.861 11.470 591 HG1 THR 86 HG1 THR 86 37.079 -3.876 11.533 592 HG21 THR 86 3HG2 THR 86 35.986 -4.252 9.700 593 HG22 THR 86 1HG2 THR 86 36.280 -2.591 9.188 594 HG23 THR 86 2HG2 THR 86 34.632 -3.215 9.252 595 H ASP 87 H ASP 87 37.540 -1.663 13.216 596 HA ASP 87 HA ASP 87 39.908 -1.044 11.578 597 HB2 ASP 87 2HB ASP 87 39.457 0.462 13.527 598 HB3 ASP 87 3HB ASP 87 39.670 -0.927 14.590 599 H PHE 88 H PHE 88 41.407 -2.566 11.263 600 HA PHE 88 HA PHE 88 41.310 -4.984 12.942 601 HB2 PHE 88 2HB PHE 88 41.048 -4.712 10.040 602 HB3 PHE 88 3HB PHE 88 42.291 -5.864 10.517 603 HD1 PHE 88 HD1 PHE 88 38.971 -5.022 11.988 604 HD2 PHE 88 HD2 PHE 88 41.467 -7.990 10.234 605 HE1 PHE 88 HE1 PHE 88 37.236 -6.718 12.397 606 HE2 PHE 88 HE2 PHE 88 39.736 -9.690 10.639 607 HZ PHE 88 HZ PHE 88 37.616 -9.055 11.721 608 H LYS 89 H LYS 89 43.119 -5.121 14.077 609 HA LYS 89 HA LYS 89 45.647 -4.304 12.799 610 HB2 LYS 89 2HB LYS 89 44.619 -3.873 15.577 611 HB3 LYS 89 3HB LYS 89 46.351 -4.024 15.316 612 HG2 LYS 89 2HG LYS 89 45.709 -2.220 13.405 613 HG3 LYS 89 3HG LYS 89 44.523 -1.827 14.653 614 HD2 LYS 89 2HD LYS 89 46.902 -2.182 16.044 615 HD3 LYS 89 3HD LYS 89 47.375 -1.317 14.580 616 HE2 LYS 89 2HE LYS 89 46.824 0.458 15.900 617 HE3 LYS 89 3HE LYS 89 45.245 0.130 15.186 618 HZ1 LYS 89 3HZ LYS 89 44.413 -0.342 17.173 619 HZ2 LYS 89 1HZ LYS 89 45.851 0.223 17.862 620 HZ3 LYS 89 2HZ LYS 89 45.663 -1.424 17.531 621 H VAL 90 H VAL 90 46.972 -5.945 12.431 622 HA VAL 90 HA VAL 90 46.751 -8.346 14.124 623 HB VAL 90 HB VAL 90 46.219 -8.797 11.792 624 HG11 VAL 90 1HG1 VAL 90 47.763 -8.438 10.000 625 HG12 VAL 90 2HG1 VAL 90 47.571 -6.912 10.866 626 HG13 VAL 90 3HG1 VAL 90 49.014 -7.894 11.118 627 HG21 VAL 90 3HG2 VAL 90 47.357 -10.531 13.088 628 HG22 VAL 90 1HG2 VAL 90 47.811 -10.603 11.386 629 HG23 VAL 90 2HG2 VAL 90 48.919 -9.902 12.564 630 H THR 91 H THR 91 48.413 -8.846 15.388 631 HA THR 91 HA THR 91 51.049 -7.677 14.770 632 HB THR 91 HB THR 91 51.508 -7.500 17.151 633 HG1 THR 91 HG1 THR 91 48.938 -8.683 17.389 634 HG21 THR 91 3HG2 THR 91 50.509 -5.552 16.170 635 HG22 THR 91 1HG2 THR 91 49.791 -5.787 17.763 636 HG23 THR 91 2HG2 THR 91 48.894 -6.245 16.315 637 H GLN 92 H GLN 92 52.877 -8.933 15.198 638 HA GLN 92 HA GLN 92 52.533 -11.732 14.859 639 HB2 GLN 92 2HB GLN 92 54.914 -9.961 15.329 640 HB3 GLN 92 3HB GLN 92 55.082 -11.711 15.318 641 HG2 GLN 92 2HG GLN 92 54.704 -11.877 13.082 642 HG3 GLN 92 3HG GLN 92 53.676 -10.446 13.036 643 HE21 GLN 92 1HE2 GLN 92 54.737 -8.361 13.231 644 HE22 GLN 92 2HE2 GLN 92 56.334 -8.167 12.600 Start of MODEL 13 1 H1 MET 1 H MET 1 1.768 0.762 0.823 2 HA MET 1 HA MET 1 3.098 2.233 -1.228 3 HB2 MET 1 2HB MET 1 2.742 2.550 1.726 4 HB3 MET 1 3HB MET 1 3.952 3.523 0.900 5 HG2 MET 1 2HG MET 1 2.376 4.955 0.325 6 HG3 MET 1 3HG MET 1 1.597 3.694 -0.628 7 HE1 MET 1 3HE MET 1 2.087 4.575 3.199 8 HE2 MET 1 1HE MET 1 1.397 5.998 2.418 9 HE3 MET 1 2HE MET 1 0.445 5.088 3.592 10 HA PRO 2 HA PRO 2 6.663 -0.591 -0.235 11 HB2 PRO 2 2HB PRO 2 7.327 -1.060 -2.825 12 HB3 PRO 2 3HB PRO 2 6.127 -2.021 -1.952 13 HG2 PRO 2 2HG PRO 2 5.711 0.235 -3.876 14 HG3 PRO 2 3HG PRO 2 4.841 -1.305 -3.752 15 HD2 PRO 2 2HD PRO 2 3.854 1.010 -2.754 16 HD3 PRO 2 3HD PRO 2 3.527 -0.568 -2.008 17 H ALA 3 H ALA 3 8.897 -0.180 -0.540 18 HA ALA 3 HA ALA 3 9.971 1.798 -2.208 19 HB1 ALA 3 1HB ALA 3 8.531 2.997 -0.236 20 HB2 ALA 3 2HB ALA 3 10.144 2.957 0.478 21 HB3 ALA 3 3HB ALA 3 9.890 3.736 -1.083 22 H ALA 4 H ALA 4 11.892 0.881 -2.492 23 HA ALA 4 HA ALA 4 13.172 -0.722 -0.514 24 HB1 ALA 4 1HB ALA 4 13.881 0.214 -3.257 25 HB2 ALA 4 2HB ALA 4 15.124 -0.508 -2.235 26 HB3 ALA 4 3HB ALA 4 13.676 -1.427 -2.646 27 H LEU 5 H LEU 5 13.994 0.180 1.267 28 HA LEU 5 HA LEU 5 15.403 2.745 1.048 29 HB2 LEU 5 2HB LEU 5 13.925 1.353 3.200 30 HB3 LEU 5 3HB LEU 5 15.318 2.315 3.690 31 HG LEU 5 HG LEU 5 13.390 3.657 1.902 32 HD11 LEU 5 1HD1 LEU 5 12.674 2.681 4.639 33 HD12 LEU 5 2HD1 LEU 5 11.707 2.682 3.164 34 HD13 LEU 5 3HD1 LEU 5 12.014 4.194 4.017 35 HD21 LEU 5 3HD2 LEU 5 15.529 4.400 3.451 36 HD22 LEU 5 1HD2 LEU 5 14.149 4.879 4.439 37 HD23 LEU 5 2HD2 LEU 5 14.308 5.490 2.792 38 H VAL 6 H VAL 6 16.049 -0.500 1.054 39 HA VAL 6 HA VAL 6 17.833 -1.808 1.718 40 HB VAL 6 HB VAL 6 19.980 -0.952 0.822 41 HG11 VAL 6 1HG1 VAL 6 17.810 -1.789 -0.545 42 HG12 VAL 6 2HG1 VAL 6 18.086 -0.224 -1.312 43 HG13 VAL 6 3HG1 VAL 6 19.367 -1.436 -1.293 44 HG21 VAL 6 3HG2 VAL 6 20.069 1.214 -0.275 45 HG22 VAL 6 1HG2 VAL 6 18.401 1.541 0.195 46 HG23 VAL 6 2HG2 VAL 6 19.655 1.411 1.428 47 H SER 7 H SER 7 16.908 -0.545 3.968 48 HA SER 7 HA SER 7 19.158 0.711 5.312 49 HB2 SER 7 2HB SER 7 16.263 0.337 5.896 50 HB3 SER 7 3HB SER 7 17.351 0.500 7.274 51 HG SER 7 HG SER 7 17.515 2.312 5.131 52 H ILE 8 H ILE 8 20.723 -0.684 5.864 53 HA ILE 8 HA ILE 8 19.932 -3.136 7.297 54 HB ILE 8 HB ILE 8 21.831 -4.267 6.481 55 HG12 ILE 8 2HG1 ILE 8 23.242 -2.620 4.773 56 HG13 ILE 8 3HG1 ILE 8 22.870 -1.554 6.123 57 HG21 ILE 8 1HG2 ILE 8 21.167 -4.549 4.348 58 HG22 ILE 8 2HG2 ILE 8 19.888 -3.426 4.808 59 HG23 ILE 8 3HG2 ILE 8 21.318 -2.835 3.962 60 HD11 ILE 8 3HD1 ILE 8 24.744 -2.396 6.997 61 HD12 ILE 8 1HD1 ILE 8 23.724 -3.770 7.425 62 HD13 ILE 8 2HD1 ILE 8 24.707 -3.823 5.961 63 H SER 9 H SER 9 21.175 -3.769 9.102 64 HA SER 9 HA SER 9 22.697 -1.563 10.325 65 HB2 SER 9 2HB SER 9 20.451 -2.506 11.349 66 HB3 SER 9 3HB SER 9 21.518 -3.764 11.973 67 HG SER 9 HG SER 9 22.109 -2.398 13.438 68 H VAL 10 H VAL 10 24.805 -1.948 10.142 69 HA VAL 10 HA VAL 10 25.799 -4.696 10.279 70 HB VAL 10 HB VAL 10 26.577 -3.268 8.421 71 HG11 VAL 10 1HG1 VAL 10 26.695 -1.267 10.259 72 HG12 VAL 10 2HG1 VAL 10 28.399 -1.698 10.098 73 HG13 VAL 10 3HG1 VAL 10 27.470 -1.224 8.676 74 HG21 VAL 10 3HG2 VAL 10 28.132 -4.872 10.145 75 HG22 VAL 10 1HG2 VAL 10 28.401 -4.534 8.435 76 HG23 VAL 10 2HG2 VAL 10 29.139 -3.506 9.663 77 H SER 11 H SER 11 27.036 -5.460 11.906 78 HA SER 11 HA SER 11 27.619 -3.609 14.124 79 HB2 SER 11 2HB SER 11 25.949 -5.358 14.667 80 HB3 SER 11 3HB SER 11 27.139 -6.596 14.266 81 HG SER 11 HG SER 11 27.617 -4.605 16.218 82 HA PRO 12 HA PRO 12 31.672 -5.134 12.412 83 HB2 PRO 12 2HB PRO 12 32.848 -2.687 12.363 84 HB3 PRO 12 3HB PRO 12 31.878 -3.314 11.025 85 HG2 PRO 12 2HG PRO 12 31.101 -1.406 13.196 86 HG3 PRO 12 3HG PRO 12 30.735 -1.336 11.463 87 HD2 PRO 12 2HD PRO 12 28.942 -2.207 13.296 88 HD3 PRO 12 3HD PRO 12 29.001 -2.844 11.640 89 H THR 13 H THR 13 33.671 -5.271 13.501 90 HA THR 13 HA THR 13 33.541 -4.481 16.335 91 HB THR 13 HB THR 13 35.463 -6.556 15.371 92 HG1 THR 13 HG1 THR 13 33.649 -8.080 15.866 93 HG21 THR 13 3HG2 THR 13 35.575 -7.150 17.555 94 HG22 THR 13 1HG2 THR 13 33.857 -6.868 17.831 95 HG23 THR 13 2HG2 THR 13 34.980 -5.509 17.808 96 H ASN 14 H ASN 14 34.732 -2.750 16.773 97 HA ASN 14 HA ASN 14 37.144 -2.223 15.197 98 HB2 ASN 14 2HB ASN 14 35.535 -0.473 17.065 99 HB3 ASN 14 3HB ASN 14 37.042 0.033 16.307 100 HD21 ASN 14 1HD2 ASN 14 37.071 0.564 14.163 101 HD22 ASN 14 2HD2 ASN 14 35.640 0.721 13.208 102 H SER 15 H SER 15 38.901 -3.172 16.009 103 HA SER 15 HA SER 15 40.042 -2.398 18.438 104 HB2 SER 15 2HB SER 15 38.053 -4.311 18.850 105 HB3 SER 15 3HB SER 15 39.559 -5.227 18.903 106 HG SER 15 HG SER 15 38.617 -3.982 20.878 107 H THR 16 H THR 16 41.694 -4.408 19.106 108 HA THR 16 HA THR 16 43.167 -4.881 16.608 109 HB THR 16 HB THR 16 45.176 -4.979 17.873 110 HG1 THR 16 HG1 THR 16 43.630 -4.816 20.260 111 HG21 THR 16 3HG2 THR 16 45.305 -2.774 18.246 112 HG22 THR 16 1HG2 THR 16 44.084 -2.833 19.516 113 HG23 THR 16 2HG2 THR 16 43.593 -2.721 17.826 114 H VAL 17 H VAL 17 44.210 -6.903 16.259 115 HA VAL 17 HA VAL 17 43.226 -9.141 17.890 116 HB VAL 17 HB VAL 17 41.813 -8.891 15.837 117 HG11 VAL 17 1HG1 VAL 17 42.641 -9.082 13.701 118 HG12 VAL 17 2HG1 VAL 17 43.951 -8.200 14.490 119 HG13 VAL 17 3HG1 VAL 17 44.091 -9.939 14.224 120 HG21 VAL 17 3HG2 VAL 17 43.384 -11.438 15.668 121 HG22 VAL 17 1HG2 VAL 17 42.383 -11.077 17.075 122 HG23 VAL 17 2HG2 VAL 17 41.649 -11.186 15.475 123 H ALA 18 H ALA 18 44.510 -11.052 17.781 124 HA ALA 18 HA ALA 18 47.302 -10.536 17.616 125 HB1 ALA 18 1HB ALA 18 46.104 -12.184 19.149 126 HB2 ALA 18 2HB ALA 18 46.076 -13.273 17.762 127 HB3 ALA 18 3HB ALA 18 47.617 -12.717 18.416 128 H LYS 19 H LYS 19 48.836 -11.762 16.307 129 HA LYS 19 HA LYS 19 48.451 -11.488 13.588 130 HB2 LYS 19 2HB LYS 19 50.652 -11.769 14.698 131 HB3 LYS 19 3HB LYS 19 50.288 -13.472 14.943 132 HG2 LYS 19 2HG LYS 19 50.329 -13.904 12.608 133 HG3 LYS 19 3HG LYS 19 50.387 -12.181 12.229 134 HD2 LYS 19 2HD LYS 19 52.601 -11.978 12.995 135 HD3 LYS 19 3HD LYS 19 52.536 -13.523 13.846 136 HE2 LYS 19 2HE LYS 19 53.524 -14.402 12.051 137 HE3 LYS 19 3HE LYS 19 51.978 -14.199 11.227 138 HZ1 LYS 19 3HZ LYS 19 53.980 -12.026 11.314 139 HZ2 LYS 19 1HZ LYS 19 52.679 -12.219 10.249 140 HZ3 LYS 19 2HZ LYS 19 54.032 -13.227 10.123 141 H GLY 20 H GLY 20 47.416 -12.609 12.062 142 HA2 GLY 20 2HA GLY 20 46.321 -14.323 10.989 143 HA3 GLY 20 3HA GLY 20 47.136 -15.434 12.080 144 H LEU 21 H LEU 21 44.249 -13.618 11.459 145 HA LEU 21 HA LEU 21 42.720 -15.353 13.152 146 HB2 LEU 21 2HB LEU 21 43.691 -12.924 14.248 147 HB3 LEU 21 3HB LEU 21 41.954 -12.748 14.007 148 HG LEU 21 HG LEU 21 42.487 -15.272 15.250 149 HD11 LEU 21 1HD1 LEU 21 43.805 -14.828 17.030 150 HD12 LEU 21 2HD1 LEU 21 43.319 -13.136 17.111 151 HD13 LEU 21 3HD1 LEU 21 44.513 -13.654 15.921 152 HD21 LEU 21 3HD2 LEU 21 40.681 -14.691 16.465 153 HD22 LEU 21 1HD2 LEU 21 40.524 -13.420 15.252 154 HD23 LEU 21 2HD2 LEU 21 41.294 -13.071 16.801 155 H GLN 22 H GLN 22 40.447 -15.125 12.846 156 HA GLN 22 HA GLN 22 39.710 -13.425 10.556 157 HB2 GLN 22 2HB GLN 22 38.437 -16.096 11.092 158 HB3 GLN 22 3HB GLN 22 38.405 -15.144 9.614 159 HG2 GLN 22 2HG GLN 22 40.022 -16.469 8.880 160 HG3 GLN 22 3HG GLN 22 41.088 -15.623 10.000 161 HE21 GLN 22 1HE2 GLN 22 42.057 -16.768 11.529 162 HE22 GLN 22 2HE2 GLN 22 41.663 -18.390 11.974 163 H GLU 23 H GLU 23 37.660 -12.502 10.571 164 HA GLU 23 HA GLU 23 36.081 -12.856 13.025 165 HB2 GLU 23 2HB GLU 23 37.621 -10.711 12.807 166 HB3 GLU 23 3HB GLU 23 36.287 -10.135 11.818 167 HG2 GLU 23 2HG GLU 23 35.517 -9.375 13.782 168 HG3 GLU 23 3HG GLU 23 34.921 -11.026 13.949 169 H ASN 24 H ASN 24 34.109 -13.500 12.503 170 HA ASN 24 HA ASN 24 33.085 -13.300 9.847 171 HB2 ASN 24 2HB ASN 24 30.977 -14.232 10.944 172 HB3 ASN 24 3HB ASN 24 32.428 -15.223 11.063 173 HD21 ASN 24 1HD2 ASN 24 33.161 -15.786 13.013 174 HD22 ASN 24 2HD2 ASN 24 32.507 -15.232 14.513 175 H PHE 25 H PHE 25 31.498 -11.997 9.024 176 HA PHE 25 HA PHE 25 30.867 -9.615 10.611 177 HB2 PHE 25 2HB PHE 25 30.499 -8.466 8.567 178 HB3 PHE 25 3HB PHE 25 31.943 -9.440 8.312 179 HD1 PHE 25 HD1 PHE 25 28.398 -9.041 7.486 180 HD2 PHE 25 HD2 PHE 25 31.944 -11.284 6.774 181 HE1 PHE 25 HE1 PHE 25 27.353 -10.056 5.503 182 HE2 PHE 25 HE2 PHE 25 30.906 -12.302 4.790 183 HZ PHE 25 HZ PHE 25 28.608 -11.688 4.151 184 H LYS 26 H LYS 26 28.680 -8.647 10.248 185 HA LYS 26 HA LYS 26 26.581 -10.600 9.688 186 HB2 LYS 26 2HB LYS 26 27.313 -9.688 12.336 187 HB3 LYS 26 3HB LYS 26 25.658 -9.234 11.953 188 HG2 LYS 26 2HG LYS 26 25.155 -11.571 11.408 189 HG3 LYS 26 3HG LYS 26 26.809 -12.015 11.833 190 HD2 LYS 26 2HD LYS 26 26.258 -10.875 14.101 191 HD3 LYS 26 3HD LYS 26 24.578 -11.094 13.605 192 HE2 LYS 26 2HE LYS 26 24.726 -13.401 13.665 193 HE3 LYS 26 3HE LYS 26 26.478 -13.396 13.473 194 HZ1 LYS 26 3HZ LYS 26 26.787 -13.259 15.666 195 HZ2 LYS 26 1HZ LYS 26 25.174 -13.749 15.807 196 HZ3 LYS 26 2HZ LYS 26 25.567 -12.106 15.880 197 H ALA 27 H ALA 27 25.036 -9.718 8.483 198 HA ALA 27 HA ALA 27 24.453 -6.858 8.754 199 HB1 ALA 27 1HB ALA 27 25.904 -7.943 6.601 200 HB2 ALA 27 2HB ALA 27 24.294 -7.565 5.987 201 HB3 ALA 27 3HB ALA 27 25.260 -6.309 6.762 202 H THR 28 H THR 28 22.334 -6.401 8.698 203 HA THR 28 HA THR 28 20.496 -8.556 7.881 204 HB THR 28 HB THR 28 18.880 -7.160 9.440 205 HG1 THR 28 HG1 THR 28 19.882 -5.744 10.639 206 HG21 THR 28 3HG2 THR 28 19.146 -9.365 10.051 207 HG22 THR 28 1HG2 THR 28 19.910 -8.553 11.417 208 HG23 THR 28 2HG2 THR 28 20.904 -9.243 10.133 209 H GLY 29 H GLY 29 19.423 -8.132 6.072 210 HA2 GLY 29 2HA GLY 29 19.232 -5.409 5.082 211 HA3 GLY 29 3HA GLY 29 18.744 -6.868 4.232 212 H ILE 30 H ILE 30 17.533 -4.110 5.260 213 HA ILE 30 HA ILE 30 14.920 -5.302 5.910 214 HB ILE 30 HB ILE 30 15.860 -2.660 7.013 215 HG12 ILE 30 2HG1 ILE 30 15.865 -5.368 8.364 216 HG13 ILE 30 3HG1 ILE 30 17.291 -4.449 7.896 217 HG21 ILE 30 1HG2 ILE 30 13.355 -3.481 6.744 218 HG22 ILE 30 2HG2 ILE 30 13.733 -4.318 8.249 219 HG23 ILE 30 3HG2 ILE 30 13.890 -2.564 8.152 220 HD11 ILE 30 3HD1 ILE 30 15.445 -4.067 10.171 221 HD12 ILE 30 1HD1 ILE 30 17.196 -3.872 10.079 222 HD13 ILE 30 2HD1 ILE 30 16.133 -2.621 9.431 223 H PHE 31 H PHE 31 13.707 -5.006 4.155 224 HA PHE 31 HA PHE 31 13.769 -2.363 2.853 225 HB2 PHE 31 2HB PHE 31 12.880 -4.877 1.461 226 HB3 PHE 31 3HB PHE 31 13.407 -3.354 0.752 227 HD1 PHE 31 HD2 PHE 31 15.916 -2.857 2.179 228 HD2 PHE 31 HD1 PHE 31 14.317 -6.477 0.612 229 HE1 PHE 31 HE2 PHE 31 18.194 -3.757 1.943 230 HE2 PHE 31 HE1 PHE 31 16.592 -7.383 0.375 231 HZ PHE 31 HZ PHE 31 18.534 -6.022 1.040 232 H THR 32 H THR 32 11.807 -1.448 2.207 233 HA THR 32 HA THR 32 9.603 -1.967 3.906 234 HB THR 32 HB THR 32 9.494 -0.366 1.350 235 HG1 THR 32 HG1 THR 32 10.283 0.559 3.928 236 HG21 THR 32 3HG2 THR 32 7.835 -0.596 3.807 237 HG22 THR 32 1HG2 THR 32 7.343 -0.358 2.131 238 HG23 THR 32 2HG2 THR 32 7.989 0.994 3.062 239 H ASP 33 H ASP 33 10.609 -3.424 1.026 240 HA ASP 33 HA ASP 33 8.000 -4.136 0.038 241 HB2 ASP 33 2HB ASP 33 9.935 -3.894 -1.478 242 HB3 ASP 33 3HB ASP 33 10.717 -5.257 -0.682 243 H ASN 34 H ASN 34 9.653 -5.085 2.691 244 HA ASN 34 HA ASN 34 9.580 -6.875 4.094 245 HB2 ASN 34 2HB ASN 34 7.130 -7.867 2.676 246 HB3 ASN 34 3HB ASN 34 7.495 -7.871 4.399 247 HD21 ASN 34 1HD2 ASN 34 7.806 -5.588 5.309 248 HD22 ASN 34 2HD2 ASN 34 6.615 -4.428 4.837 249 H SER 35 H SER 35 10.900 -7.132 1.442 250 HA SER 35 HA SER 35 10.983 -10.072 1.363 251 HB2 SER 35 2HB SER 35 9.757 -9.309 -0.612 252 HB3 SER 35 3HB SER 35 11.075 -8.214 -1.028 253 HG SER 35 HG SER 35 10.812 -10.856 -1.546 254 H ASN 36 H ASN 36 12.802 -9.832 2.794 255 HA ASN 36 HA ASN 36 15.257 -9.099 1.347 256 HB2 ASN 36 2HB ASN 36 16.218 -8.269 3.455 257 HB3 ASN 36 3HB ASN 36 14.778 -7.360 3.004 258 HD21 ASN 36 1HD2 ASN 36 12.988 -7.438 4.284 259 HD22 ASN 36 2HD2 ASN 36 12.954 -8.213 5.828 260 H SER 37 H SER 37 17.154 -10.269 1.960 261 HA SER 37 HA SER 37 16.646 -12.744 3.465 262 HB2 SER 37 2HB SER 37 17.360 -12.468 0.650 263 HB3 SER 37 3HB SER 37 18.504 -13.477 1.536 264 HG SER 37 HG SER 37 16.740 -14.738 2.237 265 H ASP 38 H ASP 38 18.700 -13.853 4.100 266 HA ASP 38 HA ASP 38 20.362 -12.094 5.523 267 HB2 ASP 38 2HB ASP 38 20.563 -15.020 4.850 268 HB3 ASP 38 3HB ASP 38 21.833 -14.203 5.755 269 H ILE 39 H ILE 39 21.602 -10.645 4.498 270 HA ILE 39 HA ILE 39 23.291 -9.777 3.244 271 HB ILE 39 HB ILE 39 24.230 -12.556 2.598 272 HG12 ILE 39 2HG1 ILE 39 23.758 -12.574 4.984 273 HG13 ILE 39 3HG1 ILE 39 25.499 -12.518 4.729 274 HG21 ILE 39 1HG2 ILE 39 25.557 -10.996 1.505 275 HG22 ILE 39 2HG2 ILE 39 25.478 -9.847 2.840 276 HG23 ILE 39 3HG2 ILE 39 26.457 -11.306 2.990 277 HD11 ILE 39 3HD1 ILE 39 25.123 -11.014 6.455 278 HD12 ILE 39 1HD1 ILE 39 25.263 -9.989 5.027 279 HD13 ILE 39 2HD1 ILE 39 23.673 -10.357 5.696 280 H THR 40 H THR 40 20.750 -10.423 2.033 281 HA THR 40 HA THR 40 20.994 -11.604 -0.496 282 HB THR 40 HB THR 40 18.832 -11.042 0.660 283 HG1 THR 40 HG1 THR 40 18.770 -9.895 -1.910 284 HG21 THR 40 3HG2 THR 40 17.959 -8.891 0.688 285 HG22 THR 40 1HG2 THR 40 19.050 -8.321 -0.574 286 HG23 THR 40 2HG2 THR 40 19.660 -8.609 1.056 287 H ASP 41 H ASP 41 21.693 -8.364 0.630 288 HA ASP 41 HA ASP 41 22.044 -7.293 -2.025 289 HB2 ASP 41 2HB ASP 41 21.437 -6.112 0.307 290 HB3 ASP 41 3HB ASP 41 23.183 -5.882 0.328 291 H GLN 42 H GLN 42 23.789 -9.448 -0.368 292 HA GLN 42 HA GLN 42 25.963 -10.133 -0.330 293 HB2 GLN 42 2HB GLN 42 25.344 -10.038 -2.829 294 HB3 GLN 42 3HB GLN 42 26.329 -8.582 -2.882 295 HG2 GLN 42 2HG GLN 42 28.173 -10.026 -1.846 296 HG3 GLN 42 3HG GLN 42 27.174 -11.398 -2.321 297 HE21 GLN 42 1HE2 GLN 42 26.424 -11.294 -4.657 298 HE22 GLN 42 2HE2 GLN 42 27.614 -10.832 -5.821 299 H VAL 43 H VAL 43 26.391 -8.756 1.514 300 HA VAL 43 HA VAL 43 27.282 -6.146 1.474 301 HB VAL 43 HB VAL 43 28.387 -8.303 3.276 302 HG11 VAL 43 1HG1 VAL 43 28.129 -5.316 3.589 303 HG12 VAL 43 2HG1 VAL 43 28.595 -6.421 4.884 304 HG13 VAL 43 3HG1 VAL 43 29.620 -6.248 3.458 305 HG21 VAL 43 3HG2 VAL 43 26.341 -8.564 4.100 306 HG22 VAL 43 1HG2 VAL 43 26.341 -6.863 4.565 307 HG23 VAL 43 2HG2 VAL 43 25.703 -7.348 2.994 308 H THR 44 H THR 44 28.946 -5.181 0.535 309 HA THR 44 HA THR 44 31.157 -6.789 -0.483 310 HB THR 44 HB THR 44 31.152 -3.863 -0.939 311 HG1 THR 44 HG1 THR 44 29.328 -3.814 -2.064 312 HG21 THR 44 3HG2 THR 44 32.728 -5.543 -1.972 313 HG22 THR 44 1HG2 THR 44 31.896 -4.487 -3.113 314 HG23 THR 44 2HG2 THR 44 31.353 -6.151 -2.893 315 H TRP 45 H TRP 45 32.824 -7.110 0.833 316 HA TRP 45 HA TRP 45 33.584 -4.977 2.709 317 HB2 TRP 45 2HB TRP 45 34.250 -7.929 2.737 318 HB3 TRP 45 3HB TRP 45 34.817 -6.756 3.922 319 HD1 TRP 45 HD1 TRP 45 31.859 -8.919 3.064 320 HE1 TRP 45 HE1 TRP 45 30.040 -8.642 4.864 321 HE3 TRP 45 HE3 TRP 45 33.803 -4.912 5.573 322 HZ2 TRP 45 HZ2 TRP 45 29.500 -6.948 7.056 323 HZ3 TRP 45 HZ3 TRP 45 32.573 -4.023 7.510 324 HH2 TRP 45 HH2 TRP 45 30.466 -5.021 8.234 325 H ASP 46 H ASP 46 35.854 -4.540 3.032 326 HA ASP 46 HA ASP 46 37.654 -5.402 0.901 327 HB2 ASP 46 2HB ASP 46 36.404 -3.159 0.376 328 HB3 ASP 46 3HB ASP 46 37.540 -2.475 1.534 329 H SER 47 H SER 47 39.816 -5.372 1.455 330 HA SER 47 HA SER 47 40.454 -4.491 4.191 331 HB2 SER 47 2HB SER 47 40.178 -7.039 3.837 332 HB3 SER 47 3HB SER 47 41.707 -6.938 2.965 333 HG SER 47 HG SER 47 41.274 -6.977 5.614 334 H SER 48 H SER 48 42.604 -3.819 4.557 335 HA SER 48 HA SER 48 43.754 -2.254 2.589 336 HB2 SER 48 2HB SER 48 44.170 -2.333 5.164 337 HB3 SER 48 3HB SER 48 45.456 -3.464 4.747 338 HG SER 48 HG SER 48 45.295 -0.741 4.347 339 H ASN 49 H ASN 49 46.163 -2.535 1.914 340 HA ASN 49 HA ASN 49 46.661 -5.297 1.050 341 HB2 ASN 49 2HB ASN 49 45.637 -4.226 -0.856 342 HB3 ASN 49 3HB ASN 49 46.710 -2.838 -0.709 343 HD21 ASN 49 1HD2 ASN 49 46.540 -6.247 -1.493 344 HD22 ASN 49 2HD2 ASN 49 47.984 -6.295 -2.441 345 H THR 50 H THR 50 48.378 -5.624 2.395 346 HA THR 50 HA THR 50 50.769 -4.011 1.838 347 HB THR 50 HB THR 50 50.157 -4.982 4.623 348 HG1 THR 50 HG1 THR 50 49.268 -3.005 5.066 349 HG21 THR 50 3HG2 THR 50 52.232 -3.299 3.321 350 HG22 THR 50 1HG2 THR 50 52.385 -4.468 4.632 351 HG23 THR 50 2HG2 THR 50 51.729 -2.863 4.954 352 H ASP 51 H ASP 51 49.927 -6.785 3.917 353 HA ASP 51 HA ASP 51 52.126 -8.276 2.647 354 HB2 ASP 51 2HB ASP 51 51.824 -7.722 5.295 355 HB3 ASP 51 3HB ASP 51 51.031 -9.292 5.191 356 H ILE 52 H ILE 52 49.018 -8.923 4.281 357 HA ILE 52 HA ILE 52 48.026 -10.443 2.072 358 HB ILE 52 HB ILE 52 49.499 -12.153 2.928 359 HG12 ILE 52 2HG1 ILE 52 47.855 -13.918 3.428 360 HG13 ILE 52 3HG1 ILE 52 46.636 -12.690 3.754 361 HG21 ILE 52 1HG2 ILE 52 48.088 -11.968 5.579 362 HG22 ILE 52 2HG2 ILE 52 49.515 -12.919 5.172 363 HG23 ILE 52 3HG2 ILE 52 49.619 -11.160 5.240 364 HD11 ILE 52 3HD1 ILE 52 46.679 -13.883 1.463 365 HD12 ILE 52 1HD1 ILE 52 46.409 -12.141 1.530 366 HD13 ILE 52 2HD1 ILE 52 48.001 -12.772 1.103 367 H LEU 53 H LEU 53 45.928 -10.022 2.059 368 HA LEU 53 HA LEU 53 44.399 -10.152 4.537 369 HB2 LEU 53 2HB LEU 53 44.148 -7.779 2.705 370 HB3 LEU 53 3HB LEU 53 43.369 -8.024 4.267 371 HG LEU 53 HG LEU 53 45.863 -8.055 5.126 372 HD11 LEU 53 1HD1 LEU 53 46.262 -7.507 2.424 373 HD12 LEU 53 2HD1 LEU 53 47.440 -7.361 3.728 374 HD13 LEU 53 3HD1 LEU 53 46.481 -5.962 3.245 375 HD21 LEU 53 3HD2 LEU 53 44.293 -5.591 4.382 376 HD22 LEU 53 1HD2 LEU 53 45.685 -5.597 5.465 377 HD23 LEU 53 2HD2 LEU 53 44.225 -6.485 5.902 378 H SER 54 H SER 54 42.573 -11.237 4.221 379 HA SER 54 HA SER 54 41.286 -11.154 1.588 380 HB2 SER 54 2HB SER 54 42.763 -13.363 2.522 381 HB3 SER 54 3HB SER 54 41.066 -13.807 2.703 382 HG SER 54 HG SER 54 41.001 -12.837 0.412 383 H ILE 55 H ILE 55 39.082 -11.254 1.625 384 HA ILE 55 HA ILE 55 37.817 -11.528 4.274 385 HB ILE 55 HB ILE 55 37.008 -9.650 2.051 386 HG12 ILE 55 2HG1 ILE 55 38.005 -9.007 4.832 387 HG13 ILE 55 3HG1 ILE 55 39.031 -9.008 3.402 388 HG21 ILE 55 1HG2 ILE 55 35.624 -8.953 4.334 389 HG22 ILE 55 2HG2 ILE 55 34.970 -9.812 2.940 390 HG23 ILE 55 3HG2 ILE 55 35.563 -10.715 4.333 391 HD11 ILE 55 3HD1 ILE 55 37.822 -6.825 4.361 392 HD12 ILE 55 1HD1 ILE 55 38.216 -7.049 2.657 393 HD13 ILE 55 2HD1 ILE 55 36.584 -7.381 3.236 394 H SER 56 H SER 56 36.229 -12.978 4.428 395 HA SER 56 HA SER 56 35.273 -14.236 1.953 396 HB2 SER 56 2HB SER 56 35.781 -15.206 4.708 397 HB3 SER 56 3HB SER 56 34.384 -15.900 3.885 398 HG SER 56 HG SER 56 35.758 -17.103 2.868 399 H ASN 57 H ASN 57 33.357 -13.593 1.249 400 HA ASN 57 HA ASN 57 31.097 -13.455 3.026 401 HB2 ASN 57 2HB ASN 57 30.494 -11.148 2.568 402 HB3 ASN 57 3HB ASN 57 32.102 -11.199 3.285 403 HD21 ASN 57 1HD2 ASN 57 30.302 -10.758 0.320 404 HD22 ASN 57 2HD2 ASN 57 31.551 -9.930 -0.541 405 H ALA 58 H ALA 58 29.189 -13.800 1.976 406 HA ALA 58 HA ALA 58 29.190 -13.716 -0.959 407 HB1 ALA 58 1HB ALA 58 27.728 -15.995 0.147 408 HB2 ALA 58 2HB ALA 58 28.811 -15.905 -1.243 409 HB3 ALA 58 3HB ALA 58 29.475 -16.076 0.383 410 H SER 59 H SER 59 26.701 -14.650 -1.480 411 HA SER 59 HA SER 59 25.063 -12.450 -0.699 412 HB2 SER 59 2HB SER 59 23.269 -13.833 -1.945 413 HB3 SER 59 3HB SER 59 24.648 -13.242 -2.873 414 HG SER 59 HG SER 59 23.929 -15.606 -2.978 415 H ASP 60 H ASP 60 25.774 -15.405 0.748 416 HA ASP 60 HA ASP 60 23.814 -14.966 2.809 417 HB2 ASP 60 2HB ASP 60 23.114 -16.687 0.696 418 HB3 ASP 60 3HB ASP 60 23.534 -17.734 2.048 419 H SER 61 H SER 61 24.285 -16.066 4.727 420 HA SER 61 HA SER 61 25.591 -17.090 6.285 421 HB2 SER 61 2HB SER 61 25.348 -18.994 4.528 422 HB3 SER 61 3HB SER 61 27.020 -18.608 4.119 423 HG SER 61 HG SER 61 26.001 -19.898 6.311 424 H HIS 62 H HIS 62 26.680 -15.178 6.798 425 HA HIS 62 HA HIS 62 28.751 -13.953 5.488 426 HB2 HIS 62 2HB HIS 62 29.487 -13.114 7.689 427 HB3 HIS 62 3HB HIS 62 27.739 -13.019 7.501 428 HD1 HIS 62 HD1 HIS 62 26.552 -13.701 9.546 429 HD2 HIS 62 HD2 HIS 62 30.134 -15.759 9.097 430 HE1 HIS 62 HE1 HIS 62 26.719 -15.206 11.553 431 H GLY 63 H GLY 63 31.030 -14.057 5.608 432 HA2 GLY 63 2HA GLY 63 32.014 -16.784 6.042 433 HA3 GLY 63 3HA GLY 63 32.819 -15.531 5.109 434 H LEU 64 H LEU 64 34.486 -14.529 6.029 435 HA LEU 64 HA LEU 64 34.652 -13.709 8.692 436 HB2 LEU 64 2HB LEU 64 36.428 -15.313 9.460 437 HB3 LEU 64 3HB LEU 64 34.788 -15.955 9.387 438 HG LEU 64 HG LEU 64 36.447 -16.420 6.994 439 HD11 LEU 64 1HD1 LEU 64 38.234 -17.060 8.205 440 HD12 LEU 64 2HD1 LEU 64 37.276 -18.518 8.465 441 HD13 LEU 64 3HD1 LEU 64 37.299 -17.248 9.688 442 HD21 LEU 64 3HD2 LEU 64 34.311 -17.746 8.558 443 HD22 LEU 64 1HD2 LEU 64 35.428 -18.788 7.676 444 HD23 LEU 64 2HD2 LEU 64 34.497 -17.564 6.813 445 H ALA 65 H ALA 65 35.822 -11.945 8.349 446 HA ALA 65 HA ALA 65 37.746 -11.730 6.254 447 HB1 ALA 65 1HB ALA 65 38.247 -9.513 7.527 448 HB2 ALA 65 2HB ALA 65 36.709 -9.717 6.687 449 HB3 ALA 65 3HB ALA 65 36.793 -9.928 8.436 450 H SER 66 H SER 66 39.681 -12.657 6.337 451 HA SER 66 HA SER 66 41.063 -12.816 8.932 452 HB2 SER 66 2HB SER 66 40.533 -14.964 7.669 453 HB3 SER 66 3HB SER 66 41.716 -14.441 6.471 454 HG SER 66 HG SER 66 42.654 -15.797 8.052 455 H THR 67 H THR 67 43.207 -12.183 9.108 456 HA THR 67 HA THR 67 44.566 -11.062 6.798 457 HB THR 67 HB THR 67 43.883 -9.353 9.198 458 HG1 THR 67 HG1 THR 67 42.173 -9.361 7.771 459 HG21 THR 67 3HG2 THR 67 45.671 -8.119 8.712 460 HG22 THR 67 1HG2 THR 67 45.048 -7.864 7.083 461 HG23 THR 67 2HG2 THR 67 46.105 -9.235 7.418 462 H LEU 68 H LEU 68 46.696 -11.409 6.919 463 HA LEU 68 HA LEU 68 47.873 -11.946 9.564 464 HB2 LEU 68 2HB LEU 68 47.465 -13.860 7.705 465 HB3 LEU 68 3HB LEU 68 49.067 -13.297 7.230 466 HG LEU 68 HG LEU 68 49.011 -13.740 10.061 467 HD11 LEU 68 1HD1 LEU 68 48.449 -16.260 8.555 468 HD12 LEU 68 2HD1 LEU 68 47.125 -15.302 9.216 469 HD13 LEU 68 3HD1 LEU 68 48.367 -15.948 10.289 470 HD21 LEU 68 3HD2 LEU 68 50.773 -15.439 9.358 471 HD22 LEU 68 1HD2 LEU 68 51.063 -13.755 8.920 472 HD23 LEU 68 2HD2 LEU 68 50.478 -14.893 7.706 473 H ASN 69 H ASN 69 47.906 -9.429 8.408 474 HA ASN 69 HA ASN 69 50.625 -9.156 7.327 475 HB2 ASN 69 2HB ASN 69 49.972 -7.163 6.308 476 HB3 ASN 69 3HB ASN 69 48.521 -8.152 6.173 477 HD21 ASN 69 1HD2 ASN 69 49.079 -5.184 6.354 478 HD22 ASN 69 2HD2 ASN 69 47.997 -4.630 7.582 479 H GLN 70 H GLN 70 52.005 -7.486 8.152 480 HA GLN 70 HA GLN 70 51.609 -7.064 11.022 481 HB2 GLN 70 2HB GLN 70 54.041 -6.434 10.984 482 HB3 GLN 70 3HB GLN 70 53.701 -8.094 10.516 483 HG2 GLN 70 2HG GLN 70 54.644 -7.813 8.533 484 HG3 GLN 70 3HG GLN 70 53.705 -6.354 8.220 485 HE21 GLN 70 1HE2 GLN 70 56.744 -7.533 8.539 486 HE22 GLN 70 2HE2 GLN 70 57.583 -6.079 8.947 487 H GLY 71 H GLY 71 50.772 -5.189 11.639 488 HA2 GLY 71 2HA GLY 71 51.583 -2.729 11.605 489 HA3 GLY 71 3HA GLY 71 51.133 -2.838 9.910 490 H ASN 72 H ASN 72 49.300 -1.775 9.588 491 HA ASN 72 HA ASN 72 47.067 -2.270 11.436 492 HB2 ASN 72 2HB ASN 72 46.443 0.012 11.478 493 HB3 ASN 72 3HB ASN 72 48.184 0.007 11.744 494 HD21 ASN 72 1HD2 ASN 72 45.647 1.175 9.859 495 HD22 ASN 72 2HD2 ASN 72 46.585 1.954 8.635 496 H VAL 73 H VAL 73 45.138 -2.678 10.498 497 HA VAL 73 HA VAL 73 44.970 -2.388 7.568 498 HB VAL 73 HB VAL 73 43.796 -4.587 9.275 499 HG11 VAL 73 1HG1 VAL 73 43.009 -5.554 7.176 500 HG12 VAL 73 2HG1 VAL 73 42.299 -3.961 7.447 501 HG13 VAL 73 3HG1 VAL 73 43.621 -4.155 6.295 502 HG21 VAL 73 3HG2 VAL 73 46.105 -5.011 8.997 503 HG22 VAL 73 1HG2 VAL 73 45.281 -6.011 7.800 504 HG23 VAL 73 2HG2 VAL 73 46.069 -4.513 7.305 505 H LYS 74 H LYS 74 43.141 -1.521 6.720 506 HA LYS 74 HA LYS 74 41.047 -0.706 8.628 507 HB2 LYS 74 2HB LYS 74 42.636 1.031 7.382 508 HB3 LYS 74 3HB LYS 74 41.461 0.806 6.093 509 HG2 LYS 74 2HG LYS 74 40.627 1.500 8.889 510 HG3 LYS 74 3HG LYS 74 41.083 2.733 7.711 511 HD2 LYS 74 2HD LYS 74 39.093 2.608 6.722 512 HD3 LYS 74 3HD LYS 74 39.235 0.858 6.545 513 HE2 LYS 74 2HE LYS 74 37.260 1.461 7.849 514 HE3 LYS 74 3HE LYS 74 38.417 0.554 8.823 515 HZ1 LYS 74 3HZ LYS 74 37.302 3.001 9.422 516 HZ2 LYS 74 1HZ LYS 74 38.908 3.340 9.013 517 HZ3 LYS 74 2HZ LYS 74 38.565 2.231 10.243 518 H VAL 75 H VAL 75 39.220 -1.777 8.312 519 HA VAL 75 HA VAL 75 38.644 -2.961 5.713 520 HB VAL 75 HB VAL 75 37.116 -3.206 8.308 521 HG11 VAL 75 1HG1 VAL 75 36.916 -4.724 5.710 522 HG12 VAL 75 2HG1 VAL 75 36.106 -5.185 7.209 523 HG13 VAL 75 3HG1 VAL 75 35.697 -3.663 6.417 524 HG21 VAL 75 3HG2 VAL 75 38.159 -5.534 8.263 525 HG22 VAL 75 1HG2 VAL 75 39.291 -4.875 7.082 526 HG23 VAL 75 2HG2 VAL 75 39.213 -4.190 8.705 527 H THR 76 H THR 76 36.941 -2.424 4.420 528 HA THR 76 HA THR 76 35.103 -0.327 5.317 529 HB THR 76 HB THR 76 36.539 -0.184 2.661 530 HG1 THR 76 HG1 THR 76 38.061 0.788 3.750 531 HG21 THR 76 3HG2 THR 76 34.454 0.871 2.418 532 HG22 THR 76 1HG2 THR 76 35.571 2.185 2.780 533 HG23 THR 76 2HG2 THR 76 34.512 1.555 4.042 534 H ALA 77 H ALA 77 33.064 -0.480 4.495 535 HA ALA 77 HA ALA 77 32.532 -2.265 2.257 536 HB1 ALA 77 1HB ALA 77 30.594 -3.168 3.891 537 HB2 ALA 77 2HB ALA 77 32.154 -3.968 3.687 538 HB3 ALA 77 3HB ALA 77 31.885 -2.897 5.062 539 H SER 78 H SER 78 30.563 -1.882 1.231 540 HA SER 78 HA SER 78 28.767 0.127 2.331 541 HB2 SER 78 2HB SER 78 30.742 0.735 0.316 542 HB3 SER 78 3HB SER 78 29.118 0.945 -0.340 543 HG SER 78 HG SER 78 29.893 2.841 0.693 544 H ILE 79 H ILE 79 26.692 -0.155 1.703 545 HA ILE 79 HA ILE 79 26.120 -1.861 -0.605 546 HB ILE 79 HB ILE 79 25.179 -2.392 2.205 547 HG12 ILE 79 2HG1 ILE 79 27.282 -3.462 1.475 548 HG13 ILE 79 3HG1 ILE 79 26.010 -4.644 1.761 549 HG21 ILE 79 1HG2 ILE 79 23.189 -2.468 0.915 550 HG22 ILE 79 2HG2 ILE 79 23.991 -3.335 -0.393 551 HG23 ILE 79 3HG2 ILE 79 23.705 -4.138 1.151 552 HD11 ILE 79 3HD1 ILE 79 27.573 -4.258 -0.559 553 HD12 ILE 79 1HD1 ILE 79 26.302 -5.446 -0.273 554 HD13 ILE 79 2HD1 ILE 79 25.901 -3.874 -0.964 555 H GLY 80 H GLY 80 24.865 -0.640 -1.853 556 HA2 GLY 80 2HA GLY 80 23.243 0.844 -2.520 557 HA3 GLY 80 3HA GLY 80 22.288 0.135 -1.226 558 H GLY 81 H GLY 81 21.828 1.331 0.539 559 HA2 GLY 81 2HA GLY 81 23.069 4.009 0.663 560 HA3 GLY 81 3HA GLY 81 21.411 3.669 1.136 561 H ILE 82 H ILE 82 24.455 2.003 1.912 562 HA ILE 82 HA ILE 82 24.186 2.813 4.703 563 HB ILE 82 HB ILE 82 24.226 0.631 5.608 564 HG12 ILE 82 2HG1 ILE 82 24.017 -1.205 3.540 565 HG13 ILE 82 3HG1 ILE 82 25.239 -0.076 2.964 566 HG21 ILE 82 1HG2 ILE 82 22.189 -0.424 4.636 567 HG22 ILE 82 2HG2 ILE 82 22.014 1.296 4.981 568 HG23 ILE 82 3HG2 ILE 82 22.267 0.751 3.323 569 HD11 ILE 82 3HD1 ILE 82 25.659 -2.220 4.624 570 HD12 ILE 82 1HD1 ILE 82 26.765 -0.872 4.366 571 HD13 ILE 82 2HD1 ILE 82 25.649 -0.847 5.731 572 H GLN 83 H GLN 83 26.103 2.481 5.956 573 HA GLN 83 HA GLN 83 28.511 1.797 4.428 574 HB2 GLN 83 2HB GLN 83 29.694 3.740 5.318 575 HB3 GLN 83 3HB GLN 83 28.298 4.238 4.371 576 HG2 GLN 83 2HG GLN 83 27.552 3.935 7.120 577 HG3 GLN 83 3HG GLN 83 28.962 4.985 6.986 578 HE21 GLN 83 1HE2 GLN 83 28.657 7.034 6.427 579 HE22 GLN 83 2HE2 GLN 83 27.181 7.702 5.829 580 H GLY 84 H GLY 84 30.284 1.084 5.683 581 HA2 GLY 84 2HA GLY 84 30.175 0.945 8.531 582 HA3 GLY 84 3HA GLY 84 29.711 -0.586 7.804 583 H SER 85 H SER 85 32.078 0.261 9.440 584 HA SER 85 HA SER 85 34.079 -1.015 7.749 585 HB2 SER 85 2HB SER 85 35.645 0.891 8.909 586 HB3 SER 85 3HB SER 85 34.996 1.003 7.273 587 HG SER 85 HG SER 85 34.579 2.873 8.585 588 H THR 86 H THR 86 35.919 -1.817 8.955 589 HA THR 86 HA THR 86 35.438 -2.048 11.849 590 HB THR 86 HB THR 86 35.747 -4.352 11.891 591 HG1 THR 86 HG1 THR 86 36.502 -5.428 9.849 592 HG21 THR 86 3HG2 THR 86 33.926 -5.075 10.771 593 HG22 THR 86 1HG2 THR 86 34.526 -4.497 9.217 594 HG23 THR 86 2HG2 THR 86 33.748 -3.376 10.335 595 H ASP 87 H ASP 87 37.203 -1.873 13.124 596 HA ASP 87 HA ASP 87 39.695 -1.112 11.854 597 HB2 ASP 87 2HB ASP 87 39.157 0.305 13.641 598 HB3 ASP 87 3HB ASP 87 38.656 -1.032 14.672 599 H PHE 88 H PHE 88 41.397 -2.395 11.584 600 HA PHE 88 HA PHE 88 41.556 -4.869 13.174 601 HB2 PHE 88 2HB PHE 88 41.668 -4.474 10.237 602 HB3 PHE 88 3HB PHE 88 42.826 -5.614 10.917 603 HD1 PHE 88 HD1 PHE 88 39.198 -4.792 11.240 604 HD2 PHE 88 HD2 PHE 88 42.188 -7.810 10.984 605 HE1 PHE 88 HE1 PHE 88 37.450 -6.523 11.298 606 HE2 PHE 88 HE2 PHE 88 40.445 -9.546 11.040 607 HZ PHE 88 HZ PHE 88 38.073 -8.903 11.197 608 H LYS 89 H LYS 89 43.263 -4.773 14.461 609 HA LYS 89 HA LYS 89 45.739 -3.555 13.425 610 HB2 LYS 89 2HB LYS 89 44.262 -3.056 15.911 611 HB3 LYS 89 3HB LYS 89 45.977 -3.359 16.154 612 HG2 LYS 89 2HG LYS 89 45.825 -1.580 14.001 613 HG3 LYS 89 3HG LYS 89 44.659 -0.999 15.193 614 HD2 LYS 89 2HD LYS 89 46.523 -1.285 16.909 615 HD3 LYS 89 3HD LYS 89 47.613 -1.455 15.531 616 HE2 LYS 89 2HE LYS 89 45.803 0.904 16.044 617 HE3 LYS 89 3HE LYS 89 47.528 0.851 16.401 618 HZ1 LYS 89 3HZ LYS 89 47.478 1.861 14.352 619 HZ2 LYS 89 1HZ LYS 89 46.179 0.935 13.789 620 HZ3 LYS 89 2HZ LYS 89 47.718 0.245 13.910 621 H VAL 90 H VAL 90 47.172 -5.111 13.065 622 HA VAL 90 HA VAL 90 47.209 -7.454 14.842 623 HB VAL 90 HB VAL 90 48.385 -7.125 12.078 624 HG11 VAL 90 1HG1 VAL 90 48.387 -9.437 14.003 625 HG12 VAL 90 2HG1 VAL 90 48.673 -9.631 12.272 626 HG13 VAL 90 3HG1 VAL 90 49.769 -8.647 13.244 627 HG21 VAL 90 3HG2 VAL 90 46.320 -7.578 11.379 628 HG22 VAL 90 1HG2 VAL 90 46.513 -9.182 12.088 629 HG23 VAL 90 2HG2 VAL 90 45.763 -7.889 13.024 630 H THR 91 H THR 91 48.598 -7.138 16.466 631 HA THR 91 HA THR 91 51.254 -6.031 15.823 632 HB THR 91 HB THR 91 51.259 -5.625 18.423 633 HG1 THR 91 HG1 THR 91 49.307 -5.510 19.337 634 HG21 THR 91 3HG2 THR 91 49.513 -3.752 16.874 635 HG22 THR 91 1HG2 THR 91 51.198 -3.973 16.405 636 HG23 THR 91 2HG2 THR 91 50.802 -3.389 18.022 637 H GLN 92 H GLN 92 53.074 -7.036 16.664 638 HA GLN 92 HA GLN 92 52.610 -9.730 17.758 639 HB2 GLN 92 2HB GLN 92 54.707 -10.403 16.737 640 HB3 GLN 92 3HB GLN 92 53.651 -9.698 15.521 641 HG2 GLN 92 2HG GLN 92 55.207 -8.231 14.975 642 HG3 GLN 92 3HG GLN 92 55.268 -7.636 16.633 643 HE21 GLN 92 1HE2 GLN 92 56.753 -8.597 18.089 644 HE22 GLN 92 2HE2 GLN 92 58.168 -9.400 17.508 Start of MODEL 14 1 H1 MET 1 H MET 1 1.997 0.932 1.126 2 HA MET 1 HA MET 1 2.012 -0.565 -1.397 3 HB2 MET 1 2HB MET 1 2.642 2.225 -0.623 4 HB3 MET 1 3HB MET 1 3.634 1.528 -1.896 5 HG2 MET 1 2HG MET 1 1.982 2.418 -3.163 6 HG3 MET 1 3HG MET 1 1.281 0.830 -2.861 7 HE1 MET 1 3HE MET 1 -1.344 3.148 -3.417 8 HE2 MET 1 1HE MET 1 -0.713 1.515 -3.630 9 HE3 MET 1 2HE MET 1 -1.985 1.821 -2.448 10 HA PRO 2 HA PRO 2 5.951 -2.375 -0.730 11 HB2 PRO 2 2HB PRO 2 7.121 -2.159 -3.171 12 HB3 PRO 2 3HB PRO 2 5.792 -3.276 -2.838 13 HG2 PRO 2 2HG PRO 2 5.719 -0.576 -4.129 14 HG3 PRO 2 3HG PRO 2 4.871 -2.062 -4.594 15 HD2 PRO 2 2HD PRO 2 3.662 -0.064 -3.223 16 HD3 PRO 2 3HD PRO 2 3.226 -1.771 -3.006 17 H ALA 3 H ALA 3 8.079 -1.917 -0.229 18 HA ALA 3 HA ALA 3 9.219 0.646 -1.007 19 HB1 ALA 3 1HB ALA 3 9.455 1.554 1.108 20 HB2 ALA 3 2HB ALA 3 7.840 0.848 1.179 21 HB3 ALA 3 3HB ALA 3 9.203 0.005 1.914 22 H ALA 4 H ALA 4 10.435 -1.159 -2.130 23 HA ALA 4 HA ALA 4 12.180 -2.814 -0.596 24 HB1 ALA 4 1HB ALA 4 13.012 -2.272 -3.344 25 HB2 ALA 4 2HB ALA 4 12.634 -3.802 -2.551 26 HB3 ALA 4 3HB ALA 4 11.335 -2.800 -3.198 27 H LEU 5 H LEU 5 14.382 -2.608 -0.228 28 HA LEU 5 HA LEU 5 16.347 -1.556 0.222 29 HB2 LEU 5 2HB LEU 5 15.513 -0.556 -2.359 30 HB3 LEU 5 3HB LEU 5 16.435 0.655 -1.471 31 HG LEU 5 HG LEU 5 17.654 -2.012 -1.489 32 HD11 LEU 5 1HD1 LEU 5 17.671 -0.466 -4.063 33 HD12 LEU 5 2HD1 LEU 5 16.554 -1.798 -3.769 34 HD13 LEU 5 3HD1 LEU 5 18.293 -2.086 -3.747 35 HD21 LEU 5 3HD2 LEU 5 18.452 0.841 -1.735 36 HD22 LEU 5 1HD2 LEU 5 19.540 -0.392 -2.373 37 HD23 LEU 5 2HD2 LEU 5 19.074 -0.421 -0.672 38 H VAL 6 H VAL 6 15.848 -0.805 2.256 39 HA VAL 6 HA VAL 6 14.951 2.000 2.408 40 HB VAL 6 HB VAL 6 14.536 -0.164 4.476 41 HG11 VAL 6 1HG1 VAL 6 14.551 1.662 5.814 42 HG12 VAL 6 2HG1 VAL 6 14.182 2.771 4.492 43 HG13 VAL 6 3HG1 VAL 6 12.896 1.813 5.227 44 HG21 VAL 6 3HG2 VAL 6 13.034 -0.627 2.727 45 HG22 VAL 6 1HG2 VAL 6 12.095 0.290 3.904 46 HG23 VAL 6 2HG2 VAL 6 12.700 1.082 2.449 47 H SER 7 H SER 7 16.670 -0.409 4.406 48 HA SER 7 HA SER 7 19.101 0.967 4.514 49 HB2 SER 7 2HB SER 7 17.050 1.919 6.386 50 HB3 SER 7 3HB SER 7 18.570 1.475 7.162 51 HG SER 7 HG SER 7 18.150 3.725 6.115 52 H ILE 8 H ILE 8 20.608 0.034 6.060 53 HA ILE 8 HA ILE 8 19.690 -2.496 7.242 54 HB ILE 8 HB ILE 8 22.314 -2.221 5.782 55 HG12 ILE 8 2HG1 ILE 8 20.938 -3.926 4.234 56 HG13 ILE 8 3HG1 ILE 8 19.598 -2.942 4.812 57 HG21 ILE 8 1HG2 ILE 8 21.690 -4.865 5.865 58 HG22 ILE 8 2HG2 ILE 8 22.726 -4.040 7.028 59 HG23 ILE 8 3HG2 ILE 8 21.021 -4.298 7.395 60 HD11 ILE 8 3HD1 ILE 8 20.089 -1.664 3.048 61 HD12 ILE 8 1HD1 ILE 8 21.370 -1.030 4.081 62 HD13 ILE 8 2HD1 ILE 8 21.728 -2.302 2.912 63 H SER 9 H SER 9 20.905 -3.246 9.027 64 HA SER 9 HA SER 9 22.417 -1.114 10.369 65 HB2 SER 9 2HB SER 9 20.371 -2.917 11.252 66 HB3 SER 9 3HB SER 9 21.839 -3.219 12.182 67 HG SER 9 HG SER 9 20.482 -1.567 13.081 68 H VAL 10 H VAL 10 24.546 -1.315 10.395 69 HA VAL 10 HA VAL 10 25.724 -4.001 10.167 70 HB VAL 10 HB VAL 10 26.357 -2.443 8.379 71 HG11 VAL 10 1HG1 VAL 10 27.059 -0.335 8.703 72 HG12 VAL 10 2HG1 VAL 10 26.321 -0.513 10.296 73 HG13 VAL 10 3HG1 VAL 10 28.054 -0.773 10.092 74 HG21 VAL 10 3HG2 VAL 10 28.397 -3.355 8.282 75 HG22 VAL 10 1HG2 VAL 10 28.919 -2.549 9.761 76 HG23 VAL 10 2HG2 VAL 10 28.023 -4.064 9.853 77 H SER 11 H SER 11 27.013 -4.794 11.727 78 HA SER 11 HA SER 11 27.576 -3.044 14.030 79 HB2 SER 11 2HB SER 11 26.592 -5.817 13.821 80 HB3 SER 11 3HB SER 11 27.847 -5.564 15.034 81 HG SER 11 HG SER 11 25.266 -4.477 14.879 82 HA PRO 12 HA PRO 12 31.666 -4.166 12.161 83 HB2 PRO 12 2HB PRO 12 32.730 -1.684 12.442 84 HB3 PRO 12 3HB PRO 12 31.769 -2.164 11.038 85 HG2 PRO 12 2HG PRO 12 30.940 -0.613 13.461 86 HG3 PRO 12 3HG PRO 12 30.546 -0.321 11.757 87 HD2 PRO 12 2HD PRO 12 28.822 -1.520 13.467 88 HD3 PRO 12 3HD PRO 12 28.884 -1.919 11.738 89 H THR 13 H THR 13 33.614 -4.498 13.231 90 HA THR 13 HA THR 13 33.590 -3.884 16.115 91 HB THR 13 HB THR 13 35.392 -5.962 15.804 92 HG1 THR 13 HG1 THR 13 34.299 -7.499 14.551 93 HG21 THR 13 3HG2 THR 13 33.231 -7.297 16.628 94 HG22 THR 13 1HG2 THR 13 32.625 -5.654 16.829 95 HG23 THR 13 2HG2 THR 13 34.093 -6.161 17.665 96 H ASN 14 H ASN 14 34.999 -2.337 16.592 97 HA ASN 14 HA ASN 14 37.427 -2.056 14.974 98 HB2 ASN 14 2HB ASN 14 37.590 0.152 16.305 99 HB3 ASN 14 3HB ASN 14 36.336 0.017 15.076 100 HD21 ASN 14 1HD2 ASN 14 35.192 1.675 16.150 101 HD22 ASN 14 2HD2 ASN 14 34.278 1.343 17.577 102 H SER 15 H SER 15 38.783 -3.597 15.825 103 HA SER 15 HA SER 15 40.050 -2.923 18.319 104 HB2 SER 15 2HB SER 15 37.968 -4.522 18.721 105 HB3 SER 15 3HB SER 15 39.120 -5.759 18.217 106 HG SER 15 HG SER 15 39.227 -5.486 20.449 107 H THR 16 H THR 16 41.531 -5.148 18.788 108 HA THR 16 HA THR 16 43.071 -5.406 16.294 109 HB THR 16 HB THR 16 45.039 -5.734 17.588 110 HG1 THR 16 HG1 THR 16 44.780 -6.804 19.394 111 HG21 THR 16 3HG2 THR 16 43.691 -3.393 17.626 112 HG22 THR 16 1HG2 THR 16 45.295 -3.610 18.324 113 HG23 THR 16 2HG2 THR 16 43.867 -3.684 19.356 114 H VAL 17 H VAL 17 44.144 -7.451 15.881 115 HA VAL 17 HA VAL 17 42.887 -9.769 17.177 116 HB VAL 17 HB VAL 17 43.297 -9.606 14.194 117 HG11 VAL 17 1HG1 VAL 17 43.279 -11.854 14.845 118 HG12 VAL 17 2HG1 VAL 17 42.016 -11.589 16.049 119 HG13 VAL 17 3HG1 VAL 17 41.623 -11.536 14.330 120 HG21 VAL 17 3HG2 VAL 17 40.846 -9.022 15.839 121 HG22 VAL 17 1HG2 VAL 17 41.625 -7.994 14.637 122 HG23 VAL 17 2HG2 VAL 17 40.771 -9.451 14.130 123 H ALA 18 H ALA 18 44.095 -11.725 17.047 124 HA ALA 18 HA ALA 18 46.904 -11.345 17.251 125 HB1 ALA 18 1HB ALA 18 46.923 -13.374 18.210 126 HB2 ALA 18 2HB ALA 18 45.168 -13.198 18.210 127 HB3 ALA 18 3HB ALA 18 45.963 -14.104 16.923 128 H LYS 19 H LYS 19 48.497 -12.689 16.043 129 HA LYS 19 HA LYS 19 48.517 -12.092 13.340 130 HB2 LYS 19 2HB LYS 19 50.374 -13.705 13.156 131 HB3 LYS 19 3HB LYS 19 50.545 -12.653 14.555 132 HG2 LYS 19 2HG LYS 19 49.227 -14.745 15.653 133 HG3 LYS 19 3HG LYS 19 50.176 -15.560 14.407 134 HD2 LYS 19 2HD LYS 19 51.776 -15.564 15.999 135 HD3 LYS 19 3HD LYS 19 52.046 -13.909 15.447 136 HE2 LYS 19 2HE LYS 19 51.766 -13.388 17.615 137 HE3 LYS 19 3HE LYS 19 50.049 -13.538 17.244 138 HZ1 LYS 19 3HZ LYS 19 50.949 -14.796 19.251 139 HZ2 LYS 19 1HZ LYS 19 51.633 -15.867 18.134 140 HZ3 LYS 19 2HZ LYS 19 49.956 -15.650 18.180 141 H GLY 20 H GLY 20 47.437 -12.870 11.656 142 HA2 GLY 20 2HA GLY 20 46.171 -14.256 10.335 143 HA3 GLY 20 3HA GLY 20 47.063 -15.578 11.073 144 H LEU 21 H LEU 21 44.107 -13.802 11.012 145 HA LEU 21 HA LEU 21 42.764 -15.906 12.445 146 HB2 LEU 21 2HB LEU 21 43.638 -13.619 13.865 147 HB3 LEU 21 3HB LEU 21 41.887 -13.501 13.704 148 HG LEU 21 HG LEU 21 42.260 -16.103 14.527 149 HD11 LEU 21 1HD1 LEU 21 44.694 -15.125 14.965 150 HD12 LEU 21 2HD1 LEU 21 43.934 -16.294 16.045 151 HD13 LEU 21 3HD1 LEU 21 43.916 -14.578 16.451 152 HD21 LEU 21 3HD2 LEU 21 41.908 -13.999 16.590 153 HD22 LEU 21 1HD2 LEU 21 40.977 -15.468 16.296 154 HD23 LEU 21 2HD2 LEU 21 40.744 -14.056 15.265 155 H GLN 22 H GLN 22 40.372 -15.473 12.563 156 HA GLN 22 HA GLN 22 39.508 -13.738 10.346 157 HB2 GLN 22 2HB GLN 22 38.525 -16.518 11.007 158 HB3 GLN 22 3HB GLN 22 37.770 -15.452 9.830 159 HG2 GLN 22 2HG GLN 22 39.094 -16.362 8.309 160 HG3 GLN 22 3HG GLN 22 40.432 -15.508 9.077 161 HE21 GLN 22 1HE2 GLN 22 39.581 -18.388 7.929 162 HE22 GLN 22 2HE2 GLN 22 40.504 -19.430 8.953 163 H GLU 23 H GLU 23 37.584 -12.644 10.600 164 HA GLU 23 HA GLU 23 36.327 -12.861 13.257 165 HB2 GLU 23 2HB GLU 23 37.585 -10.624 12.042 166 HB3 GLU 23 3HB GLU 23 35.860 -10.289 12.098 167 HG2 GLU 23 2HG GLU 23 36.754 -9.422 14.087 168 HG3 GLU 23 3HG GLU 23 35.939 -10.919 14.537 169 H ASN 24 H ASN 24 34.092 -12.661 13.390 170 HA ASN 24 HA ASN 24 32.689 -13.192 10.879 171 HB2 ASN 24 2HB ASN 24 30.776 -13.762 12.489 172 HB3 ASN 24 3HB ASN 24 32.173 -14.834 12.493 173 HD21 ASN 24 1HD2 ASN 24 33.704 -14.631 14.204 174 HD22 ASN 24 2HD2 ASN 24 33.216 -14.003 15.738 175 H PHE 25 H PHE 25 31.050 -11.937 10.100 176 HA PHE 25 HA PHE 25 30.642 -9.358 11.461 177 HB2 PHE 25 2HB PHE 25 31.521 -9.837 8.884 178 HB3 PHE 25 3HB PHE 25 29.810 -9.485 8.661 179 HD1 PHE 25 HD1 PHE 25 32.556 -8.141 10.808 180 HD2 PHE 25 HD2 PHE 25 29.399 -7.314 8.076 181 HE1 PHE 25 HE1 PHE 25 33.034 -5.735 10.990 182 HE2 PHE 25 HE2 PHE 25 29.872 -4.907 8.252 183 HZ PHE 25 HZ PHE 25 31.692 -4.114 9.711 184 H LYS 26 H LYS 26 28.489 -8.333 11.000 185 HA LYS 26 HA LYS 26 26.323 -10.251 10.590 186 HB2 LYS 26 2HB LYS 26 25.157 -9.235 12.627 187 HB3 LYS 26 3HB LYS 26 26.457 -10.378 12.936 188 HG2 LYS 26 2HG LYS 26 27.331 -7.591 12.781 189 HG3 LYS 26 3HG LYS 26 26.205 -7.931 14.098 190 HD2 LYS 26 2HD LYS 26 27.798 -10.009 14.452 191 HD3 LYS 26 3HD LYS 26 28.958 -8.965 13.628 192 HE2 LYS 26 2HE LYS 26 29.058 -7.488 15.351 193 HE3 LYS 26 3HE LYS 26 27.377 -7.747 15.813 194 HZ1 LYS 26 3HZ LYS 26 28.961 -8.590 17.466 195 HZ2 LYS 26 1HZ LYS 26 29.582 -9.669 16.320 196 HZ3 LYS 26 2HZ LYS 26 27.980 -9.819 16.841 197 H ALA 27 H ALA 27 24.797 -9.418 9.324 198 HA ALA 27 HA ALA 27 24.344 -6.521 9.334 199 HB1 ALA 27 1HB ALA 27 24.373 -6.382 6.933 200 HB2 ALA 27 2HB ALA 27 25.904 -7.063 7.485 201 HB3 ALA 27 3HB ALA 27 24.669 -8.116 6.796 202 H THR 28 H THR 28 22.270 -6.208 9.766 203 HA THR 28 HA THR 28 20.304 -8.143 8.723 204 HB THR 28 HB THR 28 19.055 -6.744 10.794 205 HG1 THR 28 HG1 THR 28 21.713 -7.499 11.496 206 HG21 THR 28 3HG2 THR 28 19.268 -8.958 11.989 207 HG22 THR 28 1HG2 THR 28 20.277 -9.496 10.647 208 HG23 THR 28 2HG2 THR 28 18.598 -9.039 10.360 209 H GLY 29 H GLY 29 19.534 -7.195 6.914 210 HA2 GLY 29 2HA GLY 29 19.000 -4.335 6.864 211 HA3 GLY 29 3HA GLY 29 18.848 -5.449 5.514 212 H ILE 30 H ILE 30 17.024 -3.369 6.738 213 HA ILE 30 HA ILE 30 14.700 -5.120 7.205 214 HB ILE 30 HB ILE 30 13.657 -3.066 8.256 215 HG12 ILE 30 2HG1 ILE 30 16.251 -1.942 8.974 216 HG13 ILE 30 3HG1 ILE 30 15.921 -1.814 7.250 217 HG21 ILE 30 1HG2 ILE 30 14.949 -5.081 9.374 218 HG22 ILE 30 2HG2 ILE 30 16.053 -3.794 9.855 219 HG23 ILE 30 3HG2 ILE 30 14.356 -3.722 10.329 220 HD11 ILE 30 3HD1 ILE 30 14.705 -0.022 7.674 221 HD12 ILE 30 1HD1 ILE 30 13.563 -1.043 8.548 222 HD13 ILE 30 2HD1 ILE 30 14.887 -0.261 9.412 223 H PHE 31 H PHE 31 13.596 -5.322 5.367 224 HA PHE 31 HA PHE 31 12.916 -2.872 3.892 225 HB2 PHE 31 2HB PHE 31 13.371 -5.473 2.455 226 HB3 PHE 31 3HB PHE 31 13.347 -3.839 1.799 227 HD1 PHE 31 HD2 PHE 31 15.192 -2.322 3.285 228 HD2 PHE 31 HD1 PHE 31 15.430 -6.436 2.218 229 HE1 PHE 31 HE2 PHE 31 17.645 -2.220 3.451 230 HE2 PHE 31 HE1 PHE 31 17.883 -6.340 2.383 231 HZ PHE 31 HZ PHE 31 18.994 -4.230 2.999 232 H THR 32 H THR 32 10.837 -2.719 3.187 233 HA THR 32 HA THR 32 8.883 -4.358 4.422 234 HB THR 32 HB THR 32 7.234 -3.074 3.132 235 HG1 THR 32 HG1 THR 32 9.521 -2.407 1.662 236 HG21 THR 32 3HG2 THR 32 8.084 -2.065 5.159 237 HG22 THR 32 1HG2 THR 32 7.859 -0.812 3.939 238 HG23 THR 32 2HG2 THR 32 9.477 -1.418 4.292 239 H ASP 33 H ASP 33 10.305 -4.292 1.214 240 HA ASP 33 HA ASP 33 8.443 -6.260 0.184 241 HB2 ASP 33 2HB ASP 33 9.878 -4.283 -1.020 242 HB3 ASP 33 3HB ASP 33 10.889 -5.684 -1.359 243 H ASN 34 H ASN 34 10.987 -6.436 2.217 244 HA ASN 34 HA ASN 34 11.254 -9.232 2.016 245 HB2 ASN 34 2HB ASN 34 13.014 -7.687 0.316 246 HB3 ASN 34 3HB ASN 34 13.940 -8.601 1.503 247 HD21 ASN 34 1HD2 ASN 34 14.747 -9.782 -0.324 248 HD22 ASN 34 2HD2 ASN 34 13.815 -11.075 -0.991 249 H SER 35 H SER 35 11.016 -9.258 4.208 250 HA SER 35 HA SER 35 12.011 -7.630 6.134 251 HB2 SER 35 2HB SER 35 11.436 -10.561 6.079 252 HB3 SER 35 3HB SER 35 12.243 -9.894 7.498 253 HG SER 35 HG SER 35 10.424 -8.261 7.345 254 H ASN 36 H ASN 36 13.650 -10.720 5.462 255 HA ASN 36 HA ASN 36 16.197 -9.406 6.124 256 HB2 ASN 36 2HB ASN 36 17.042 -11.651 6.650 257 HB3 ASN 36 3HB ASN 36 15.598 -11.282 7.589 258 HD21 ASN 36 1HD2 ASN 36 13.783 -12.483 7.317 259 HD22 ASN 36 2HD2 ASN 36 13.700 -13.880 6.303 260 H SER 37 H SER 37 17.921 -9.503 4.749 261 HA SER 37 HA SER 37 17.600 -10.983 2.235 262 HB2 SER 37 2HB SER 37 17.612 -9.148 0.929 263 HB3 SER 37 3HB SER 37 17.243 -8.239 2.395 264 HG SER 37 HG SER 37 19.515 -7.989 2.689 265 H ASP 38 H ASP 38 19.352 -12.115 1.715 266 HA ASP 38 HA ASP 38 21.779 -11.742 3.281 267 HB2 ASP 38 2HB ASP 38 21.390 -13.873 1.196 268 HB3 ASP 38 3HB ASP 38 22.390 -13.914 2.646 269 H ILE 39 H ILE 39 22.992 -10.110 2.503 270 HA ILE 39 HA ILE 39 24.172 -8.797 1.051 271 HB ILE 39 HB ILE 39 24.776 -11.242 -0.564 272 HG12 ILE 39 2HG1 ILE 39 26.615 -11.460 1.392 273 HG13 ILE 39 3HG1 ILE 39 25.263 -10.845 2.337 274 HG21 ILE 39 1HG2 ILE 39 27.080 -10.248 -0.407 275 HG22 ILE 39 2HG2 ILE 39 25.891 -9.268 -1.263 276 HG23 ILE 39 3HG2 ILE 39 26.345 -8.859 0.391 277 HD11 ILE 39 3HD1 ILE 39 24.158 -12.781 2.228 278 HD12 ILE 39 1HD1 ILE 39 24.567 -13.036 0.532 279 HD13 ILE 39 2HD1 ILE 39 25.726 -13.460 1.792 280 H THR 40 H THR 40 21.345 -9.287 0.370 281 HA THR 40 HA THR 40 20.966 -9.675 -2.375 282 HB THR 40 HB THR 40 19.328 -8.004 -0.460 283 HG1 THR 40 HG1 THR 40 19.455 -10.729 -1.092 284 HG21 THR 40 3HG2 THR 40 18.737 -7.331 -2.666 285 HG22 THR 40 1HG2 THR 40 17.492 -8.458 -2.129 286 HG23 THR 40 2HG2 THR 40 18.746 -8.996 -3.247 287 H ASP 41 H ASP 41 22.044 -6.900 -0.577 288 HA ASP 41 HA ASP 41 21.741 -5.125 -2.866 289 HB2 ASP 41 2HB ASP 41 23.106 -4.370 -0.300 290 HB3 ASP 41 3HB ASP 41 22.202 -3.350 -1.416 291 H GLN 42 H GLN 42 23.825 -7.460 -2.205 292 HA GLN 42 HA GLN 42 25.974 -7.954 -2.767 293 HB2 GLN 42 2HB GLN 42 24.970 -6.919 -4.936 294 HB3 GLN 42 3HB GLN 42 26.008 -5.550 -4.561 295 HG2 GLN 42 2HG GLN 42 27.762 -7.595 -4.324 296 HG3 GLN 42 3HG GLN 42 26.685 -8.218 -5.574 297 HE21 GLN 42 1HE2 GLN 42 27.981 -8.035 -7.313 298 HE22 GLN 42 2HE2 GLN 42 28.610 -6.541 -7.909 299 H VAL 43 H VAL 43 26.346 -7.122 -0.490 300 HA VAL 43 HA VAL 43 27.356 -4.615 0.114 301 HB VAL 43 HB VAL 43 26.812 -6.338 1.804 302 HG11 VAL 43 1HG1 VAL 43 28.314 -8.032 0.350 303 HG12 VAL 43 2HG1 VAL 43 29.477 -7.586 1.600 304 HG13 VAL 43 3HG1 VAL 43 27.922 -8.289 2.050 305 HG21 VAL 43 3HG2 VAL 43 28.976 -5.944 3.192 306 HG22 VAL 43 1HG2 VAL 43 29.445 -4.923 1.833 307 HG23 VAL 43 2HG2 VAL 43 27.972 -4.567 2.736 308 H THR 44 H THR 44 29.234 -3.582 -0.206 309 HA THR 44 HA THR 44 31.270 -4.935 -1.809 310 HB THR 44 HB THR 44 31.184 -2.000 -1.110 311 HG1 THR 44 HG1 THR 44 30.081 -3.291 -3.403 312 HG21 THR 44 3HG2 THR 44 32.238 -2.720 -3.698 313 HG22 THR 44 1HG2 THR 44 33.084 -3.583 -2.415 314 HG23 THR 44 2HG2 THR 44 33.004 -1.822 -2.388 315 H TRP 45 H TRP 45 32.869 -5.884 -0.735 316 HA TRP 45 HA TRP 45 33.750 -4.744 1.822 317 HB2 TRP 45 2HB TRP 45 34.933 -6.962 2.078 318 HB3 TRP 45 3HB TRP 45 33.175 -7.050 2.035 319 HD1 TRP 45 HD1 TRP 45 32.092 -8.511 0.172 320 HE1 TRP 45 HE1 TRP 45 33.023 -9.973 -1.731 321 HE3 TRP 45 HE3 TRP 45 36.988 -7.048 0.345 322 HZ2 TRP 45 HZ2 TRP 45 35.504 -10.444 -2.992 323 HZ3 TRP 45 HZ3 TRP 45 38.576 -8.053 -1.244 324 HH2 TRP 45 HH2 TRP 45 37.847 -9.716 -2.876 325 H ASP 46 H ASP 46 35.950 -4.376 2.248 326 HA ASP 46 HA ASP 46 37.873 -4.636 0.093 327 HB2 ASP 46 2HB ASP 46 36.551 -2.120 0.704 328 HB3 ASP 46 3HB ASP 46 38.297 -2.001 0.897 329 H SER 47 H SER 47 40.003 -4.607 0.786 330 HA SER 47 HA SER 47 40.400 -4.358 3.696 331 HB2 SER 47 2HB SER 47 40.664 -6.687 2.133 332 HB3 SER 47 3HB SER 47 42.307 -6.161 2.497 333 HG SER 47 HG SER 47 41.669 -6.083 4.719 334 H SER 48 H SER 48 42.450 -3.628 4.392 335 HA SER 48 HA SER 48 43.742 -1.871 2.460 336 HB2 SER 48 2HB SER 48 43.053 -1.495 5.077 337 HB3 SER 48 3HB SER 48 44.763 -1.900 5.224 338 HG SER 48 HG SER 48 43.577 0.212 3.764 339 H ASN 49 H ASN 49 46.274 -1.643 3.444 340 HA ASN 49 HA ASN 49 48.361 -2.525 3.253 341 HB2 ASN 49 2HB ASN 49 46.808 -4.511 4.734 342 HB3 ASN 49 3HB ASN 49 48.176 -5.213 3.875 343 HD21 ASN 49 1HD2 ASN 49 50.259 -4.632 4.449 344 HD22 ASN 49 2HD2 ASN 49 50.615 -3.810 5.927 345 H THR 50 H THR 50 49.537 -4.644 2.297 346 HA THR 50 HA THR 50 48.148 -5.536 -0.119 347 HB THR 50 HB THR 50 50.954 -4.781 -0.598 348 HG1 THR 50 HG1 THR 50 50.155 -2.525 -0.963 349 HG21 THR 50 3HG2 THR 50 48.334 -4.590 -2.055 350 HG22 THR 50 1HG2 THR 50 49.757 -5.547 -2.464 351 HG23 THR 50 2HG2 THR 50 49.786 -3.795 -2.661 352 H ASP 51 H ASP 51 49.216 -6.677 2.477 353 HA ASP 51 HA ASP 51 51.298 -8.487 1.563 354 HB2 ASP 51 2HB ASP 51 50.226 -7.624 4.144 355 HB3 ASP 51 3HB ASP 51 50.529 -9.357 4.069 356 H ILE 52 H ILE 52 48.370 -9.188 3.451 357 HA ILE 52 HA ILE 52 47.373 -11.015 1.455 358 HB ILE 52 HB ILE 52 48.951 -12.520 2.406 359 HG12 ILE 52 2HG1 ILE 52 46.528 -13.292 3.974 360 HG13 ILE 52 3HG1 ILE 52 46.382 -13.133 2.227 361 HG21 ILE 52 1HG2 ILE 52 48.281 -11.124 4.879 362 HG22 ILE 52 2HG2 ILE 52 48.418 -12.871 5.069 363 HG23 ILE 52 3HG2 ILE 52 49.767 -11.948 4.408 364 HD11 ILE 52 3HD1 ILE 52 47.927 -15.101 3.833 365 HD12 ILE 52 1HD1 ILE 52 46.877 -15.353 2.438 366 HD13 ILE 52 2HD1 ILE 52 48.490 -14.675 2.217 367 H LEU 53 H LEU 53 45.522 -9.717 1.580 368 HA LEU 53 HA LEU 53 43.939 -10.095 4.036 369 HB2 LEU 53 2HB LEU 53 43.728 -7.729 2.189 370 HB3 LEU 53 3HB LEU 53 42.954 -7.942 3.758 371 HG LEU 53 HG LEU 53 44.663 -6.422 4.179 372 HD11 LEU 53 1HD1 LEU 53 46.376 -8.720 4.820 373 HD12 LEU 53 2HD1 LEU 53 44.717 -8.832 5.408 374 HD13 LEU 53 3HD1 LEU 53 45.723 -7.458 5.865 375 HD21 LEU 53 3HD2 LEU 53 46.610 -6.226 3.049 376 HD22 LEU 53 1HD2 LEU 53 45.759 -7.210 1.858 377 HD23 LEU 53 2HD2 LEU 53 46.879 -7.969 2.990 378 H SER 54 H SER 54 42.063 -11.111 3.768 379 HA SER 54 HA SER 54 40.753 -11.039 1.145 380 HB2 SER 54 2HB SER 54 41.600 -13.488 2.671 381 HB3 SER 54 3HB SER 54 40.217 -13.544 1.579 382 HG SER 54 HG SER 54 42.084 -14.116 0.462 383 H ILE 55 H ILE 55 38.734 -10.378 1.392 384 HA ILE 55 HA ILE 55 37.356 -10.972 3.929 385 HB ILE 55 HB ILE 55 36.726 -8.665 2.094 386 HG12 ILE 55 2HG1 ILE 55 38.407 -8.659 4.610 387 HG13 ILE 55 3HG1 ILE 55 39.018 -8.439 2.974 388 HG21 ILE 55 1HG2 ILE 55 36.047 -8.958 5.003 389 HG22 ILE 55 2HG2 ILE 55 35.342 -7.867 3.811 390 HG23 ILE 55 3HG2 ILE 55 35.006 -9.597 3.731 391 HD11 ILE 55 3HD1 ILE 55 38.891 -6.286 3.825 392 HD12 ILE 55 1HD1 ILE 55 37.419 -6.440 2.866 393 HD13 ILE 55 2HD1 ILE 55 37.347 -6.587 4.622 394 H SER 56 H SER 56 35.556 -12.148 3.834 395 HA SER 56 HA SER 56 34.213 -12.440 1.227 396 HB2 SER 56 2HB SER 56 35.489 -14.452 2.779 397 HB3 SER 56 3HB SER 56 33.752 -14.749 2.853 398 HG SER 56 HG SER 56 35.458 -14.699 0.620 399 H ASN 57 H ASN 57 32.153 -11.848 1.230 400 HA ASN 57 HA ASN 57 30.520 -12.229 3.613 401 HB2 ASN 57 2HB ASN 57 30.328 -9.554 2.297 402 HB3 ASN 57 3HB ASN 57 29.953 -10.017 3.954 403 HD21 ASN 57 1HD2 ASN 57 31.382 -9.551 5.473 404 HD22 ASN 57 2HD2 ASN 57 33.017 -9.064 5.202 405 H ALA 58 H ALA 58 30.067 -13.845 1.694 406 HA ALA 58 HA ALA 58 27.618 -12.876 0.437 407 HB1 ALA 58 1HB ALA 58 29.413 -12.539 -1.227 408 HB2 ALA 58 2HB ALA 58 29.765 -14.267 -1.160 409 HB3 ALA 58 3HB ALA 58 28.200 -13.708 -1.752 410 H SER 59 H SER 59 28.798 -14.938 2.475 411 HA SER 59 HA SER 59 27.861 -17.453 1.417 412 HB2 SER 59 2HB SER 59 29.275 -16.535 3.834 413 HB3 SER 59 3HB SER 59 28.180 -17.892 4.096 414 HG SER 59 HG SER 59 29.323 -18.716 2.067 415 H ASP 60 H ASP 60 26.790 -15.141 3.885 416 HA ASP 60 HA ASP 60 24.097 -15.313 3.435 417 HB2 ASP 60 2HB ASP 60 25.089 -17.687 4.775 418 HB3 ASP 60 3HB ASP 60 23.889 -16.852 5.758 419 H SER 61 H SER 61 24.894 -13.125 3.999 420 HA SER 61 HA SER 61 24.708 -11.321 5.387 421 HB2 SER 61 2HB SER 61 23.048 -11.570 6.868 422 HB3 SER 61 3HB SER 61 23.167 -13.321 6.702 423 HG SER 61 HG SER 61 23.646 -13.089 8.771 424 H HIS 62 H HIS 62 25.943 -14.058 7.316 425 HA HIS 62 HA HIS 62 27.721 -12.685 8.908 426 HB2 HIS 62 2HB HIS 62 27.391 -14.949 9.438 427 HB3 HIS 62 3HB HIS 62 27.766 -15.481 7.801 428 HD1 HIS 62 HD1 HIS 62 30.006 -16.485 7.565 429 HD2 HIS 62 HD2 HIS 62 29.859 -13.780 10.715 430 HE1 HIS 62 HE1 HIS 62 32.281 -16.573 8.633 431 H GLY 63 H GLY 63 29.762 -11.891 8.715 432 HA2 GLY 63 2HA GLY 63 30.945 -11.994 6.009 433 HA3 GLY 63 3HA GLY 63 31.052 -10.596 7.067 434 H LEU 64 H LEU 64 32.577 -13.409 6.028 435 HA LEU 64 HA LEU 64 34.251 -13.680 8.394 436 HB2 LEU 64 2HB LEU 64 35.307 -15.526 7.122 437 HB3 LEU 64 3HB LEU 64 33.573 -15.725 7.367 438 HG LEU 64 HG LEU 64 34.067 -14.438 4.846 439 HD11 LEU 64 1HD1 LEU 64 35.696 -16.862 5.478 440 HD12 LEU 64 2HD1 LEU 64 36.141 -15.416 4.572 441 HD13 LEU 64 3HD1 LEU 64 35.066 -16.613 3.849 442 HD21 LEU 64 3HD2 LEU 64 32.019 -15.598 5.420 443 HD22 LEU 64 1HD2 LEU 64 32.904 -17.112 5.617 444 HD23 LEU 64 2HD2 LEU 64 32.777 -16.367 4.024 445 H ALA 65 H ALA 65 35.762 -12.151 8.603 446 HA ALA 65 HA ALA 65 37.263 -11.318 6.213 447 HB1 ALA 65 1HB ALA 65 36.747 -9.942 8.835 448 HB2 ALA 65 2HB ALA 65 37.988 -9.396 7.706 449 HB3 ALA 65 3HB ALA 65 36.295 -9.419 7.212 450 H SER 66 H SER 66 39.146 -12.311 5.964 451 HA SER 66 HA SER 66 40.660 -13.089 8.370 452 HB2 SER 66 2HB SER 66 41.528 -14.948 7.210 453 HB3 SER 66 3HB SER 66 39.830 -14.900 6.735 454 HG SER 66 HG SER 66 40.889 -15.098 4.850 455 H THR 67 H THR 67 42.587 -12.188 8.702 456 HA THR 67 HA THR 67 44.074 -11.055 6.454 457 HB THR 67 HB THR 67 42.921 -9.110 7.170 458 HG1 THR 67 HG1 THR 67 45.282 -8.833 8.681 459 HG21 THR 67 3HG2 THR 67 43.390 -8.529 9.761 460 HG22 THR 67 1HG2 THR 67 43.281 -10.286 9.855 461 HG23 THR 67 2HG2 THR 67 41.937 -9.353 9.196 462 H LEU 68 H LEU 68 46.313 -10.706 6.893 463 HA LEU 68 HA LEU 68 47.416 -11.519 9.428 464 HB2 LEU 68 2HB LEU 68 46.890 -13.622 8.026 465 HB3 LEU 68 3HB LEU 68 48.265 -13.122 7.043 466 HG LEU 68 HG LEU 68 48.575 -13.482 9.999 467 HD11 LEU 68 1HD1 LEU 68 49.083 -15.730 8.094 468 HD12 LEU 68 2HD1 LEU 68 47.489 -15.513 8.815 469 HD13 LEU 68 3HD1 LEU 68 48.895 -15.767 9.848 470 HD21 LEU 68 3HD2 LEU 68 50.877 -14.089 9.265 471 HD22 LEU 68 1HD2 LEU 68 50.407 -12.436 8.868 472 HD23 LEU 68 2HD2 LEU 68 50.409 -13.678 7.615 473 H ASN 69 H ASN 69 48.064 -9.254 9.081 474 HA ASN 69 HA ASN 69 50.458 -9.075 7.372 475 HB2 ASN 69 2HB ASN 69 49.947 -6.894 6.776 476 HB3 ASN 69 3HB ASN 69 48.342 -7.615 6.857 477 HD21 ASN 69 1HD2 ASN 69 49.816 -4.895 7.480 478 HD22 ASN 69 2HD2 ASN 69 48.996 -4.371 8.908 479 H GLN 70 H GLN 70 51.896 -7.159 8.175 480 HA GLN 70 HA GLN 70 52.303 -7.579 11.055 481 HB2 GLN 70 2HB GLN 70 54.214 -6.767 8.863 482 HB3 GLN 70 3HB GLN 70 54.634 -6.743 10.571 483 HG2 GLN 70 2HG GLN 70 54.344 -9.113 10.740 484 HG3 GLN 70 3HG GLN 70 53.710 -9.197 9.097 485 HE21 GLN 70 1HE2 GLN 70 56.550 -7.752 10.668 486 HE22 GLN 70 2HE2 GLN 70 57.705 -8.406 9.562 487 H GLY 71 H GLY 71 50.457 -5.920 11.142 488 HA2 GLY 71 2HA GLY 71 51.348 -3.550 12.216 489 HA3 GLY 71 3HA GLY 71 51.073 -3.198 10.516 490 H ASN 72 H ASN 72 49.224 -2.132 10.313 491 HA ASN 72 HA ASN 72 46.850 -3.210 11.675 492 HB2 ASN 72 2HB ASN 72 46.053 -0.981 12.167 493 HB3 ASN 72 3HB ASN 72 47.673 -1.160 12.834 494 HD21 ASN 72 1HD2 ASN 72 49.410 -0.110 11.815 495 HD22 ASN 72 2HD2 ASN 72 49.152 1.241 10.769 496 H VAL 73 H VAL 73 45.211 -3.617 10.343 497 HA VAL 73 HA VAL 73 45.188 -2.291 7.709 498 HB VAL 73 HB VAL 73 44.173 -5.077 8.273 499 HG11 VAL 73 1HG1 VAL 73 44.820 -3.853 5.608 500 HG12 VAL 73 2HG1 VAL 73 43.857 -5.290 5.958 501 HG13 VAL 73 3HG1 VAL 73 43.229 -3.689 6.350 502 HG21 VAL 73 3HG2 VAL 73 46.391 -5.201 6.567 503 HG22 VAL 73 1HG2 VAL 73 46.867 -4.146 7.898 504 HG23 VAL 73 2HG2 VAL 73 46.284 -5.777 8.230 505 H LYS 74 H LYS 74 43.299 -1.439 7.002 506 HA LYS 74 HA LYS 74 40.991 -1.652 8.820 507 HB2 LYS 74 2HB LYS 74 42.337 0.616 8.021 508 HB3 LYS 74 3HB LYS 74 40.967 0.576 6.918 509 HG2 LYS 74 2HG LYS 74 40.243 0.062 9.699 510 HG3 LYS 74 3HG LYS 74 40.959 1.653 9.427 511 HD2 LYS 74 2HD LYS 74 39.293 2.254 7.877 512 HD3 LYS 74 3HD LYS 74 38.747 0.585 7.694 513 HE2 LYS 74 2HE LYS 74 37.128 1.224 9.123 514 HE3 LYS 74 3HE LYS 74 38.367 0.943 10.345 515 HZ1 LYS 74 3HZ LYS 74 37.641 3.045 10.863 516 HZ2 LYS 74 1HZ LYS 74 37.387 3.490 9.250 517 HZ3 LYS 74 2HZ LYS 74 38.960 3.402 9.865 518 H VAL 75 H VAL 75 39.298 -2.725 8.066 519 HA VAL 75 HA VAL 75 39.061 -3.157 5.174 520 HB VAL 75 HB VAL 75 37.390 -4.917 5.832 521 HG11 VAL 75 1HG1 VAL 75 39.019 -6.520 6.091 522 HG12 VAL 75 2HG1 VAL 75 39.970 -5.168 5.473 523 HG13 VAL 75 3HG1 VAL 75 39.969 -5.530 7.200 524 HG21 VAL 75 3HG2 VAL 75 38.325 -5.284 8.514 525 HG22 VAL 75 1HG2 VAL 75 37.628 -3.673 8.343 526 HG23 VAL 75 2HG2 VAL 75 36.672 -5.095 7.928 527 H THR 76 H THR 76 37.291 -2.547 4.020 528 HA THR 76 HA THR 76 35.309 -0.896 5.443 529 HB THR 76 HB THR 76 35.582 -0.670 2.492 530 HG1 THR 76 HG1 THR 76 37.729 -0.538 2.938 531 HG21 THR 76 3HG2 THR 76 33.948 0.700 3.579 532 HG22 THR 76 1HG2 THR 76 35.277 1.749 3.085 533 HG23 THR 76 2HG2 THR 76 35.124 1.254 4.771 534 H ALA 77 H ALA 77 33.155 -1.257 5.163 535 HA ALA 77 HA ALA 77 32.248 -3.166 3.162 536 HB1 ALA 77 1HB ALA 77 31.735 -4.865 4.517 537 HB2 ALA 77 2HB ALA 77 32.833 -4.106 5.671 538 HB3 ALA 77 3HB ALA 77 31.099 -3.794 5.767 539 H SER 78 H SER 78 30.279 -2.665 2.394 540 HA SER 78 HA SER 78 28.434 -1.080 3.994 541 HB2 SER 78 2HB SER 78 29.718 0.655 2.900 542 HB3 SER 78 3HB SER 78 29.535 -0.140 1.336 543 HG SER 78 HG SER 78 27.858 1.564 2.597 544 H ILE 79 H ILE 79 26.318 -1.425 3.491 545 HA ILE 79 HA ILE 79 25.733 -3.056 1.113 546 HB ILE 79 HB ILE 79 25.766 -4.525 3.084 547 HG12 ILE 79 2HG1 ILE 79 22.991 -4.012 1.992 548 HG13 ILE 79 3HG1 ILE 79 24.227 -5.009 1.232 549 HG21 ILE 79 1HG2 ILE 79 24.092 -4.253 4.852 550 HG22 ILE 79 2HG2 ILE 79 25.201 -2.884 4.787 551 HG23 ILE 79 3HG2 ILE 79 23.574 -2.734 4.122 552 HD11 ILE 79 3HD1 ILE 79 23.009 -6.628 2.243 553 HD12 ILE 79 1HD1 ILE 79 24.124 -6.258 3.559 554 HD13 ILE 79 2HD1 ILE 79 22.497 -5.577 3.563 555 H GLY 80 H GLY 80 23.844 -2.603 0.055 556 HA2 GLY 80 2HA GLY 80 22.078 -1.312 -0.644 557 HA3 GLY 80 3HA GLY 80 21.608 -1.294 1.050 558 H GLY 81 H GLY 81 21.692 0.582 2.135 559 HA2 GLY 81 2HA GLY 81 22.983 2.855 0.759 560 HA3 GLY 81 3HA GLY 81 21.534 2.993 1.743 561 H ILE 82 H ILE 82 22.754 1.084 3.730 562 HA ILE 82 HA ILE 82 23.965 3.084 5.380 563 HB ILE 82 HB ILE 82 22.508 1.154 6.179 564 HG12 ILE 82 2HG1 ILE 82 23.803 0.914 8.296 565 HG13 ILE 82 3HG1 ILE 82 25.180 1.671 7.503 566 HG21 ILE 82 1HG2 ILE 82 23.592 -0.953 6.654 567 HG22 ILE 82 2HG2 ILE 82 23.707 -0.602 4.931 568 HG23 ILE 82 3HG2 ILE 82 25.107 -0.360 5.975 569 HD11 ILE 82 3HD1 ILE 82 23.018 2.897 8.849 570 HD12 ILE 82 1HD1 ILE 82 24.406 3.657 8.070 571 HD13 ILE 82 2HD1 ILE 82 22.932 3.356 7.148 572 H GLN 83 H GLN 83 26.070 3.064 6.264 573 HA GLN 83 HA GLN 83 28.040 1.599 4.634 574 HB2 GLN 83 2HB GLN 83 29.583 3.462 4.988 575 HB3 GLN 83 3HB GLN 83 28.101 4.013 4.219 576 HG2 GLN 83 2HG GLN 83 27.323 4.633 6.570 577 HG3 GLN 83 3HG GLN 83 29.009 4.428 7.042 578 HE21 GLN 83 1HE2 GLN 83 29.396 6.544 7.525 579 HE22 GLN 83 2HE2 GLN 83 29.417 7.803 6.343 580 H GLY 84 H GLY 84 29.835 0.702 5.656 581 HA2 GLY 84 2HA GLY 84 29.786 0.739 8.606 582 HA3 GLY 84 3HA GLY 84 29.892 -0.780 7.729 583 H SER 85 H SER 85 31.745 0.546 9.650 584 HA SER 85 HA SER 85 34.156 0.228 8.031 585 HB2 SER 85 2HB SER 85 34.535 2.385 9.927 586 HB3 SER 85 3HB SER 85 34.846 2.358 8.191 587 HG SER 85 HG SER 85 32.676 3.330 9.586 588 H THR 86 H THR 86 35.758 -0.824 9.067 589 HA THR 86 HA THR 86 35.681 -1.047 11.983 590 HB THR 86 HB THR 86 34.577 -3.036 11.626 591 HG1 THR 86 HG1 THR 86 36.682 -3.427 12.601 592 HG21 THR 86 3HG2 THR 86 35.536 -4.545 9.621 593 HG22 THR 86 1HG2 THR 86 35.890 -2.943 8.975 594 HG23 THR 86 2HG2 THR 86 34.235 -3.375 9.407 595 H ASP 87 H ASP 87 37.670 -1.718 12.928 596 HA ASP 87 HA ASP 87 39.982 -1.444 11.118 597 HB2 ASP 87 2HB ASP 87 39.846 0.489 12.559 598 HB3 ASP 87 3HB ASP 87 39.667 -0.532 13.983 599 H PHE 88 H PHE 88 41.470 -3.017 11.125 600 HA PHE 88 HA PHE 88 41.352 -5.026 13.274 601 HB2 PHE 88 2HB PHE 88 41.329 -5.387 10.311 602 HB3 PHE 88 3HB PHE 88 42.174 -6.582 11.290 603 HD1 PHE 88 HD2 PHE 88 38.896 -4.950 10.764 604 HD2 PHE 88 HD1 PHE 88 41.000 -8.242 12.453 605 HE1 PHE 88 HE2 PHE 88 36.757 -6.073 11.231 606 HE2 PHE 88 HE1 PHE 88 38.864 -9.371 12.922 607 HZ PHE 88 HZ PHE 88 36.739 -8.286 12.312 608 H LYS 89 H LYS 89 43.176 -4.957 14.393 609 HA LYS 89 HA LYS 89 45.669 -4.229 13.015 610 HB2 LYS 89 2HB LYS 89 44.682 -3.906 15.814 611 HB3 LYS 89 3HB LYS 89 46.413 -4.076 15.555 612 HG2 LYS 89 2HG LYS 89 45.525 -2.184 13.681 613 HG3 LYS 89 3HG LYS 89 44.746 -1.778 15.212 614 HD2 LYS 89 2HD LYS 89 47.692 -2.349 14.997 615 HD3 LYS 89 3HD LYS 89 47.020 -0.732 14.776 616 HE2 LYS 89 2HE LYS 89 46.672 -0.453 16.973 617 HE3 LYS 89 3HE LYS 89 46.061 -2.094 17.179 618 HZ1 LYS 89 3HZ LYS 89 48.667 -2.538 16.757 619 HZ2 LYS 89 1HZ LYS 89 47.968 -2.384 18.290 620 HZ3 LYS 89 2HZ LYS 89 48.732 -1.057 17.571 621 H VAL 90 H VAL 90 46.762 -5.962 12.356 622 HA VAL 90 HA VAL 90 46.753 -8.380 14.021 623 HB VAL 90 HB VAL 90 47.646 -8.028 11.156 624 HG11 VAL 90 1HG1 VAL 90 48.894 -9.794 12.234 625 HG12 VAL 90 2HG1 VAL 90 47.405 -10.504 12.862 626 HG13 VAL 90 3HG1 VAL 90 47.716 -10.496 11.126 627 HG21 VAL 90 3HG2 VAL 90 45.603 -9.586 10.830 628 HG22 VAL 90 1HG2 VAL 90 45.101 -8.981 12.409 629 HG23 VAL 90 2HG2 VAL 90 45.333 -7.860 11.068 630 H THR 91 H THR 91 48.370 -8.432 15.439 631 HA THR 91 HA THR 91 50.904 -7.137 14.857 632 HB THR 91 HB THR 91 51.520 -7.762 17.167 633 HG1 THR 91 HG1 THR 91 50.001 -8.825 18.458 634 HG21 THR 91 3HG2 THR 91 49.452 -6.539 18.253 635 HG22 THR 91 1HG2 THR 91 49.018 -6.255 16.568 636 HG23 THR 91 2HG2 THR 91 50.562 -5.673 17.191 637 H GLN 92 H GLN 92 52.941 -8.349 15.461 638 HA GLN 92 HA GLN 92 53.130 -10.683 13.847 639 HB2 GLN 92 2HB GLN 92 54.913 -8.828 14.518 640 HB3 GLN 92 3HB GLN 92 55.289 -9.993 15.782 641 HG2 GLN 92 2HG GLN 92 55.440 -11.701 13.867 642 HG3 GLN 92 3HG GLN 92 55.539 -10.289 12.817 643 HE21 GLN 92 1HE2 GLN 92 57.271 -8.770 13.221 644 HE22 GLN 92 2HE2 GLN 92 58.767 -9.342 13.868 Start of MODEL 15 1 H1 MET 1 H MET 1 10.327 -8.037 -8.773 2 HA MET 1 HA MET 1 10.058 -5.807 -7.988 3 HB2 MET 1 2HB MET 1 8.015 -6.850 -9.084 4 HB3 MET 1 3HB MET 1 7.375 -7.082 -7.462 5 HG2 MET 1 2HG MET 1 6.600 -5.017 -7.456 6 HG3 MET 1 3HG MET 1 8.229 -4.388 -7.696 7 HE1 MET 1 3HE MET 1 5.079 -3.546 -8.750 8 HE2 MET 1 1HE MET 1 6.419 -2.399 -8.810 9 HE3 MET 1 2HE MET 1 5.496 -2.754 -10.270 10 HA PRO 2 HA PRO 2 10.307 -6.714 -3.419 11 HB2 PRO 2 2HB PRO 2 12.617 -5.344 -3.018 12 HB3 PRO 2 3HB PRO 2 12.579 -7.045 -3.497 13 HG2 PRO 2 2HG PRO 2 13.008 -4.611 -5.186 14 HG3 PRO 2 3HG PRO 2 13.861 -6.165 -5.227 15 HD2 PRO 2 2HD PRO 2 11.914 -5.525 -6.997 16 HD3 PRO 2 3HD PRO 2 12.196 -7.189 -6.448 17 H ALA 3 H ALA 3 9.906 -5.264 -1.728 18 HA ALA 3 HA ALA 3 8.509 -2.923 -2.373 19 HB1 ALA 3 1HB ALA 3 9.587 -2.972 0.339 20 HB2 ALA 3 2HB ALA 3 7.913 -2.942 -0.218 21 HB3 ALA 3 3HB ALA 3 8.787 -4.472 -0.133 22 H ALA 4 H ALA 4 9.285 -0.928 -0.699 23 HA ALA 4 HA ALA 4 11.505 0.208 -2.141 24 HB1 ALA 4 1HB ALA 4 11.032 2.172 -0.555 25 HB2 ALA 4 2HB ALA 4 9.796 1.741 -1.738 26 HB3 ALA 4 3HB ALA 4 9.618 1.244 -0.055 27 H LEU 5 H LEU 5 13.489 0.841 -1.311 28 HA LEU 5 HA LEU 5 14.467 -0.760 0.876 29 HB2 LEU 5 2HB LEU 5 15.673 1.080 -1.134 30 HB3 LEU 5 3HB LEU 5 16.591 0.685 0.317 31 HG LEU 5 HG LEU 5 17.238 -0.726 -1.563 32 HD11 LEU 5 1HD1 LEU 5 15.845 -2.746 0.011 33 HD12 LEU 5 2HD1 LEU 5 16.679 -1.542 0.992 34 HD13 LEU 5 3HD1 LEU 5 17.573 -2.470 -0.211 35 HD21 LEU 5 3HD2 LEU 5 15.740 -2.241 -2.624 36 HD22 LEU 5 1HD2 LEU 5 14.994 -0.644 -2.679 37 HD23 LEU 5 2HD2 LEU 5 14.439 -1.836 -1.503 38 H VAL 6 H VAL 6 16.080 0.428 2.416 39 HA VAL 6 HA VAL 6 15.156 3.054 3.247 40 HB VAL 6 HB VAL 6 14.948 0.664 5.083 41 HG11 VAL 6 1HG1 VAL 6 15.440 2.157 6.678 42 HG12 VAL 6 2HG1 VAL 6 15.191 3.533 5.601 43 HG13 VAL 6 3HG1 VAL 6 13.812 2.772 6.395 44 HG21 VAL 6 3HG2 VAL 6 12.545 1.390 5.200 45 HG22 VAL 6 1HG2 VAL 6 12.880 2.472 3.849 46 HG23 VAL 6 2HG2 VAL 6 13.050 0.729 3.646 47 H SER 7 H SER 7 16.866 0.447 4.954 48 HA SER 7 HA SER 7 19.473 1.340 4.474 49 HB2 SER 7 2HB SER 7 19.533 2.125 7.121 50 HB3 SER 7 3HB SER 7 19.543 3.211 5.731 51 HG SER 7 HG SER 7 17.653 2.898 7.606 52 H ILE 8 H ILE 8 21.040 0.447 6.165 53 HA ILE 8 HA ILE 8 19.926 -1.941 7.470 54 HB ILE 8 HB ILE 8 20.908 -2.724 5.408 55 HG12 ILE 8 2HG1 ILE 8 23.061 -3.406 7.353 56 HG13 ILE 8 3HG1 ILE 8 21.402 -3.786 7.802 57 HG21 ILE 8 1HG2 ILE 8 23.478 -2.397 5.200 58 HG22 ILE 8 2HG2 ILE 8 22.390 -1.112 4.676 59 HG23 ILE 8 3HG2 ILE 8 23.201 -0.998 6.238 60 HD11 ILE 8 3HD1 ILE 8 21.390 -4.840 5.372 61 HD12 ILE 8 1HD1 ILE 8 23.119 -4.960 5.699 62 HD13 ILE 8 2HD1 ILE 8 21.961 -5.729 6.785 63 H SER 9 H SER 9 20.944 -2.602 9.351 64 HA SER 9 HA SER 9 22.665 -0.580 10.577 65 HB2 SER 9 2HB SER 9 21.854 -2.798 12.293 66 HB3 SER 9 3HB SER 9 21.625 -1.063 12.515 67 HG SER 9 HG SER 9 19.720 -2.609 12.122 68 H VAL 10 H VAL 10 24.776 -0.889 10.351 69 HA VAL 10 HA VAL 10 25.841 -3.604 10.148 70 HB VAL 10 HB VAL 10 26.561 -1.908 8.493 71 HG11 VAL 10 1HG1 VAL 10 26.688 -0.193 10.605 72 HG12 VAL 10 2HG1 VAL 10 28.393 -0.569 10.346 73 HG13 VAL 10 3HG1 VAL 10 27.424 0.092 9.028 74 HG21 VAL 10 3HG2 VAL 10 29.098 -2.379 9.855 75 HG22 VAL 10 1HG2 VAL 10 28.073 -3.811 9.765 76 HG23 VAL 10 2HG2 VAL 10 28.527 -2.958 8.290 77 H SER 11 H SER 11 27.071 -4.550 11.673 78 HA SER 11 HA SER 11 27.638 -2.986 14.104 79 HB2 SER 11 2HB SER 11 26.746 -5.805 13.680 80 HB3 SER 11 3HB SER 11 27.769 -5.452 15.072 81 HG SER 11 HG SER 11 26.218 -3.837 15.657 82 HA PRO 12 HA PRO 12 31.731 -4.119 12.232 83 HB2 PRO 12 2HB PRO 12 32.859 -1.686 12.660 84 HB3 PRO 12 3HB PRO 12 31.911 -2.065 11.217 85 HG2 PRO 12 2HG PRO 12 31.081 -0.617 13.702 86 HG3 PRO 12 3HG PRO 12 30.726 -0.228 12.008 87 HD2 PRO 12 2HD PRO 12 28.938 -1.462 13.624 88 HD3 PRO 12 3HD PRO 12 29.021 -1.773 11.878 89 H THR 13 H THR 13 33.625 -4.598 13.324 90 HA THR 13 HA THR 13 33.583 -4.102 16.230 91 HB THR 13 HB THR 13 35.193 -6.362 15.183 92 HG1 THR 13 HG1 THR 13 32.369 -6.243 15.088 93 HG21 THR 13 3HG2 THR 13 35.226 -6.065 17.524 94 HG22 THR 13 1HG2 THR 13 34.132 -7.420 17.246 95 HG23 THR 13 2HG2 THR 13 33.481 -5.819 17.598 96 H ASN 14 H ASN 14 35.048 -2.633 16.780 97 HA ASN 14 HA ASN 14 37.522 -2.419 15.221 98 HB2 ASN 14 2HB ASN 14 37.773 -0.246 16.535 99 HB3 ASN 14 3HB ASN 14 36.447 -0.313 15.377 100 HD21 ASN 14 1HD2 ASN 14 37.322 0.361 18.528 101 HD22 ASN 14 2HD2 ASN 14 35.744 0.435 19.229 102 H SER 15 H SER 15 38.827 -4.001 16.048 103 HA SER 15 HA SER 15 39.992 -3.476 18.635 104 HB2 SER 15 2HB SER 15 37.890 -5.170 18.723 105 HB3 SER 15 3HB SER 15 39.181 -6.314 18.356 106 HG SER 15 HG SER 15 39.282 -4.430 20.475 107 H THR 16 H THR 16 41.449 -5.744 19.012 108 HA THR 16 HA THR 16 43.135 -5.789 16.603 109 HB THR 16 HB THR 16 44.998 -6.379 18.025 110 HG1 THR 16 HG1 THR 16 43.061 -6.426 20.117 111 HG21 THR 16 3HG2 THR 16 45.244 -4.192 18.370 112 HG22 THR 16 1HG2 THR 16 44.275 -4.334 19.835 113 HG23 THR 16 2HG2 THR 16 43.498 -3.957 18.297 114 H VAL 17 H VAL 17 44.145 -7.776 15.974 115 HA VAL 17 HA VAL 17 42.871 -10.214 17.006 116 HB VAL 17 HB VAL 17 41.727 -9.466 14.904 117 HG11 VAL 17 1HG1 VAL 17 42.806 -9.411 12.842 118 HG12 VAL 17 2HG1 VAL 17 43.962 -8.635 13.926 119 HG13 VAL 17 3HG1 VAL 17 44.199 -10.313 13.438 120 HG21 VAL 17 3HG2 VAL 17 41.954 -11.868 15.721 121 HG22 VAL 17 1HG2 VAL 17 41.543 -11.639 14.022 122 HG23 VAL 17 2HG2 VAL 17 43.194 -12.056 14.481 123 H ALA 18 H ALA 18 44.062 -12.160 16.615 124 HA ALA 18 HA ALA 18 46.872 -11.826 16.888 125 HB1 ALA 18 1HB ALA 18 45.107 -13.782 17.572 126 HB2 ALA 18 2HB ALA 18 45.938 -14.516 16.200 127 HB3 ALA 18 3HB ALA 18 46.863 -13.954 17.593 128 H LYS 19 H LYS 19 48.432 -13.134 15.528 129 HA LYS 19 HA LYS 19 48.442 -12.166 12.901 130 HB2 LYS 19 2HB LYS 19 50.464 -12.844 14.170 131 HB3 LYS 19 3HB LYS 19 49.979 -14.526 14.001 132 HG2 LYS 19 2HG LYS 19 50.007 -13.308 11.423 133 HG3 LYS 19 3HG LYS 19 51.534 -12.971 12.241 134 HD2 LYS 19 2HD LYS 19 51.372 -15.539 12.841 135 HD3 LYS 19 3HD LYS 19 50.354 -15.573 11.399 136 HE2 LYS 19 2HE LYS 19 52.242 -15.740 10.226 137 HE3 LYS 19 3HE LYS 19 52.532 -14.050 10.635 138 HZ1 LYS 19 3HZ LYS 19 53.439 -16.336 12.296 139 HZ2 LYS 19 1HZ LYS 19 53.837 -14.705 12.502 140 HZ3 LYS 19 2HZ LYS 19 54.411 -15.551 11.155 141 H GLY 20 H GLY 20 47.386 -12.807 11.144 142 HA2 GLY 20 2HA GLY 20 46.150 -14.090 9.697 143 HA3 GLY 20 3HA GLY 20 47.116 -15.442 10.270 144 H LEU 21 H LEU 21 44.088 -13.786 10.485 145 HA LEU 21 HA LEU 21 42.900 -16.107 11.746 146 HB2 LEU 21 2HB LEU 21 43.639 -13.929 13.322 147 HB3 LEU 21 3HB LEU 21 41.905 -13.741 13.072 148 HG LEU 21 HG LEU 21 41.806 -16.235 13.831 149 HD11 LEU 21 1HD1 LEU 21 44.586 -15.607 14.193 150 HD12 LEU 21 2HD1 LEU 21 43.748 -17.146 14.392 151 HD13 LEU 21 3HD1 LEU 21 43.838 -16.010 15.738 152 HD21 LEU 21 3HD2 LEU 21 41.276 -15.526 15.991 153 HD22 LEU 21 1HD2 LEU 21 41.003 -14.095 14.996 154 HD23 LEU 21 2HD2 LEU 21 42.473 -14.230 15.961 155 H GLN 22 H GLN 22 40.407 -15.372 12.205 156 HA GLN 22 HA GLN 22 39.465 -13.835 9.896 157 HB2 GLN 22 2HB GLN 22 38.890 -16.704 10.501 158 HB3 GLN 22 3HB GLN 22 37.628 -15.722 9.768 159 HG2 GLN 22 2HG GLN 22 38.549 -15.955 7.776 160 HG3 GLN 22 3HG GLN 22 40.074 -15.295 8.365 161 HE21 GLN 22 1HE2 GLN 22 41.116 -17.058 9.969 162 HE22 GLN 22 2HE2 GLN 22 41.329 -18.599 9.218 163 H GLU 23 H GLU 23 37.641 -12.662 10.254 164 HA GLU 23 HA GLU 23 36.371 -12.962 12.897 165 HB2 GLU 23 2HB GLU 23 37.827 -10.804 12.089 166 HB3 GLU 23 3HB GLU 23 36.207 -10.317 11.610 167 HG2 GLU 23 2HG GLU 23 36.150 -9.513 13.708 168 HG3 GLU 23 3HG GLU 23 35.680 -11.169 14.087 169 H ASN 24 H ASN 24 34.144 -12.690 13.037 170 HA ASN 24 HA ASN 24 32.733 -12.994 10.487 171 HB2 ASN 24 2HB ASN 24 30.813 -13.684 12.043 172 HB3 ASN 24 3HB ASN 24 32.189 -14.777 11.930 173 HD21 ASN 24 1HD2 ASN 24 33.055 -15.443 13.757 174 HD22 ASN 24 2HD2 ASN 24 32.848 -14.704 15.305 175 H PHE 25 H PHE 25 31.124 -11.636 9.834 176 HA PHE 25 HA PHE 25 30.761 -9.196 11.441 177 HB2 PHE 25 2HB PHE 25 30.954 -9.691 8.508 178 HB3 PHE 25 3HB PHE 25 29.913 -8.380 9.054 179 HD1 PHE 25 HD2 PHE 25 33.199 -9.598 10.316 180 HD2 PHE 25 HD1 PHE 25 30.988 -6.399 8.585 181 HE1 PHE 25 HE2 PHE 25 35.163 -8.131 10.526 182 HE2 PHE 25 HE1 PHE 25 32.949 -4.928 8.791 183 HZ PHE 25 HZ PHE 25 35.040 -5.793 9.763 184 H LYS 26 H LYS 26 28.608 -8.070 10.922 185 HA LYS 26 HA LYS 26 26.422 -9.943 10.452 186 HB2 LYS 26 2HB LYS 26 26.897 -8.457 13.022 187 HB3 LYS 26 3HB LYS 26 25.272 -8.912 12.529 188 HG2 LYS 26 2HG LYS 26 25.876 -11.245 12.526 189 HG3 LYS 26 3HG LYS 26 27.557 -10.841 12.880 190 HD2 LYS 26 2HD LYS 26 27.129 -10.380 15.069 191 HD3 LYS 26 3HD LYS 26 25.492 -9.807 14.740 192 HE2 LYS 26 2HE LYS 26 24.941 -12.249 14.217 193 HE3 LYS 26 3HE LYS 26 26.476 -12.634 14.993 194 HZ1 LYS 26 3HZ LYS 26 25.726 -11.825 17.034 195 HZ2 LYS 26 1HZ LYS 26 24.402 -12.686 16.427 196 HZ3 LYS 26 2HZ LYS 26 24.421 -10.996 16.348 197 H ALA 27 H ALA 27 24.914 -9.042 9.211 198 HA ALA 27 HA ALA 27 24.495 -6.143 9.331 199 HB1 ALA 27 1HB ALA 27 24.218 -6.709 6.638 200 HB2 ALA 27 2HB ALA 27 25.565 -5.862 7.398 201 HB3 ALA 27 3HB ALA 27 25.665 -7.600 7.113 202 H THR 28 H THR 28 22.421 -5.829 9.759 203 HA THR 28 HA THR 28 20.444 -7.689 8.608 204 HB THR 28 HB THR 28 20.369 -8.006 10.957 205 HG1 THR 28 HG1 THR 28 18.263 -7.460 11.328 206 HG21 THR 28 3HG2 THR 28 19.715 -5.549 12.109 207 HG22 THR 28 1HG2 THR 28 21.068 -5.203 11.033 208 HG23 THR 28 2HG2 THR 28 21.230 -6.433 12.287 209 H GLY 29 H GLY 29 19.648 -6.658 6.864 210 HA2 GLY 29 2HA GLY 29 19.223 -3.790 6.889 211 HA3 GLY 29 3HA GLY 29 18.933 -4.878 5.540 212 H ILE 30 H ILE 30 17.318 -2.720 6.985 213 HA ILE 30 HA ILE 30 14.880 -4.343 7.307 214 HB ILE 30 HB ILE 30 14.072 -2.530 8.868 215 HG12 ILE 30 2HG1 ILE 30 16.727 -1.768 9.732 216 HG13 ILE 30 3HG1 ILE 30 16.456 -1.292 8.059 217 HG21 ILE 30 1HG2 ILE 30 14.561 -4.484 9.971 218 HG22 ILE 30 2HG2 ILE 30 16.256 -4.461 9.487 219 HG23 ILE 30 3HG2 ILE 30 15.686 -3.373 10.753 220 HD11 ILE 30 3HD1 ILE 30 14.144 -0.615 9.551 221 HD12 ILE 30 1HD1 ILE 30 15.561 -0.030 10.423 222 HD13 ILE 30 2HD1 ILE 30 15.294 0.452 8.747 223 H PHE 31 H PHE 31 13.694 -4.005 5.542 224 HA PHE 31 HA PHE 31 13.159 -1.232 4.748 225 HB2 PHE 31 2HB PHE 31 13.325 -3.261 2.578 226 HB3 PHE 31 3HB PHE 31 13.684 -1.538 2.536 227 HD1 PHE 31 HD2 PHE 31 15.795 -0.807 3.902 228 HD2 PHE 31 HD1 PHE 31 15.061 -4.766 2.522 229 HE1 PHE 31 HE2 PHE 31 18.200 -1.304 4.059 230 HE2 PHE 31 HE1 PHE 31 17.465 -5.269 2.677 231 HZ PHE 31 HZ PHE 31 19.038 -3.537 3.445 232 H THR 32 H THR 32 11.280 -1.260 3.057 233 HA THR 32 HA THR 32 9.004 -2.276 4.357 234 HB THR 32 HB THR 32 9.197 -1.379 1.476 235 HG1 THR 32 HG1 THR 32 9.774 0.416 2.503 236 HG21 THR 32 3HG2 THR 32 6.973 -2.095 3.276 237 HG22 THR 32 1HG2 THR 32 7.065 -2.137 1.516 238 HG23 THR 32 2HG2 THR 32 6.757 -0.612 2.347 239 H ASP 33 H ASP 33 11.210 -3.777 2.259 240 HA ASP 33 HA ASP 33 9.312 -5.771 1.308 241 HB2 ASP 33 2HB ASP 33 11.160 -6.651 0.001 242 HB3 ASP 33 3HB ASP 33 11.069 -4.904 -0.212 243 H ASN 34 H ASN 34 10.019 -5.478 4.181 244 HA ASN 34 HA ASN 34 10.172 -6.926 5.942 245 HB2 ASN 34 2HB ASN 34 10.853 -9.191 4.089 246 HB3 ASN 34 3HB ASN 34 9.997 -9.240 5.628 247 HD21 ASN 34 1HD2 ASN 34 9.404 -10.071 2.752 248 HD22 ASN 34 2HD2 ASN 34 7.816 -9.449 2.471 249 H SER 35 H SER 35 11.917 -6.456 7.103 250 HA SER 35 HA SER 35 14.486 -6.082 6.331 251 HB2 SER 35 2HB SER 35 15.169 -6.506 8.639 252 HB3 SER 35 3HB SER 35 13.635 -5.636 8.613 253 HG SER 35 HG SER 35 13.624 -7.394 10.090 254 H ASN 36 H ASN 36 15.741 -7.341 5.127 255 HA ASN 36 HA ASN 36 15.740 -10.239 5.633 256 HB2 ASN 36 2HB ASN 36 15.869 -8.618 3.198 257 HB3 ASN 36 3HB ASN 36 17.108 -9.869 3.264 258 HD21 ASN 36 1HD2 ASN 36 14.009 -9.196 2.363 259 HD22 ASN 36 2HD2 ASN 36 13.384 -10.804 2.276 260 H SER 37 H SER 37 17.897 -11.305 5.141 261 HA SER 37 HA SER 37 19.912 -9.996 6.745 262 HB2 SER 37 2HB SER 37 20.991 -12.367 5.703 263 HB3 SER 37 3HB SER 37 20.281 -12.137 7.301 264 HG SER 37 HG SER 37 19.085 -13.728 6.445 265 H ASP 38 H ASP 38 22.207 -9.990 6.028 266 HA ASP 38 HA ASP 38 22.481 -8.536 3.619 267 HB2 ASP 38 2HB ASP 38 24.004 -8.851 5.874 268 HB3 ASP 38 3HB ASP 38 24.938 -9.752 4.682 269 H ILE 39 H ILE 39 22.077 -9.517 1.728 270 HA ILE 39 HA ILE 39 23.899 -11.319 0.605 271 HB ILE 39 HB ILE 39 22.934 -13.008 2.043 272 HG12 ILE 39 2HG1 ILE 39 22.219 -14.629 0.350 273 HG13 ILE 39 3HG1 ILE 39 21.917 -13.322 -0.790 274 HG21 ILE 39 1HG2 ILE 39 20.272 -12.358 0.786 275 HG22 ILE 39 2HG2 ILE 39 20.591 -13.584 2.011 276 HG23 ILE 39 3HG2 ILE 39 20.768 -11.875 2.409 277 HD11 ILE 39 3HD1 ILE 39 24.201 -14.775 -0.650 278 HD12 ILE 39 1HD1 ILE 39 24.070 -13.164 -1.355 279 HD13 ILE 39 2HD1 ILE 39 24.625 -13.357 0.308 280 H THR 40 H THR 40 20.570 -10.157 0.616 281 HA THR 40 HA THR 40 20.028 -10.616 -2.118 282 HB THR 40 HB THR 40 18.796 -8.387 -0.508 283 HG1 THR 40 HG1 THR 40 18.024 -9.850 0.799 284 HG21 THR 40 3HG2 THR 40 17.366 -8.256 -2.211 285 HG22 THR 40 1HG2 THR 40 16.994 -9.974 -2.077 286 HG23 THR 40 2HG2 THR 40 18.341 -9.439 -3.082 287 H ASP 41 H ASP 41 21.262 -7.786 -0.374 288 HA ASP 41 HA ASP 41 21.640 -6.365 -2.898 289 HB2 ASP 41 2HB ASP 41 22.424 -4.507 -1.315 290 HB3 ASP 41 3HB ASP 41 20.720 -4.952 -1.250 291 H GLN 42 H GLN 42 23.384 -8.270 -0.670 292 HA GLN 42 HA GLN 42 25.594 -8.763 -0.392 293 HB2 GLN 42 2HB GLN 42 25.022 -9.398 -2.842 294 HB3 GLN 42 3HB GLN 42 25.990 -7.993 -3.268 295 HG2 GLN 42 2HG GLN 42 27.927 -9.006 -2.764 296 HG3 GLN 42 3HG GLN 42 27.248 -9.844 -1.369 297 HE21 GLN 42 1HE2 GLN 42 26.417 -11.877 -1.607 298 HE22 GLN 42 2HE2 GLN 42 26.574 -12.803 -3.057 299 H VAL 43 H VAL 43 25.866 -6.869 0.973 300 HA VAL 43 HA VAL 43 26.627 -4.342 0.175 301 HB VAL 43 HB VAL 43 27.632 -5.871 2.579 302 HG11 VAL 43 1HG1 VAL 43 27.698 -2.933 1.917 303 HG12 VAL 43 2HG1 VAL 43 27.961 -3.581 3.538 304 HG13 VAL 43 3HG1 VAL 43 29.068 -3.998 2.229 305 HG21 VAL 43 3HG2 VAL 43 25.726 -5.335 3.671 306 HG22 VAL 43 1HG2 VAL 43 25.551 -3.794 2.830 307 HG23 VAL 43 2HG2 VAL 43 25.061 -5.292 2.038 308 H THR 44 H THR 44 28.537 -3.335 -0.343 309 HA THR 44 HA THR 44 30.669 -5.101 -1.282 310 HB THR 44 HB THR 44 31.537 -3.063 -2.432 311 HG1 THR 44 HG1 THR 44 29.076 -1.851 -1.685 312 HG21 THR 44 3HG2 THR 44 29.072 -4.480 -2.977 313 HG22 THR 44 1HG2 THR 44 30.345 -3.974 -4.088 314 HG23 THR 44 2HG2 THR 44 29.048 -2.856 -3.666 315 H TRP 45 H TRP 45 32.250 -5.509 0.113 316 HA TRP 45 HA TRP 45 33.390 -3.265 1.626 317 HB2 TRP 45 2HB TRP 45 33.456 -4.448 3.656 318 HB3 TRP 45 3HB TRP 45 31.847 -4.780 3.019 319 HD1 TRP 45 HD1 TRP 45 32.686 -7.111 0.974 320 HE1 TRP 45 HE1 TRP 45 33.339 -9.414 1.918 321 HE3 TRP 45 HE3 TRP 45 33.892 -5.721 5.743 322 HZ2 TRP 45 HZ2 TRP 45 34.245 -10.499 4.361 323 HZ3 TRP 45 HZ3 TRP 45 34.643 -7.452 7.322 324 HH2 TRP 45 HH2 TRP 45 34.814 -9.791 6.644 325 H ASP 46 H ASP 46 35.609 -3.594 2.289 326 HA ASP 46 HA ASP 46 37.054 -5.821 1.123 327 HB2 ASP 46 2HB ASP 46 37.026 -3.128 -0.065 328 HB3 ASP 46 3HB ASP 46 38.636 -3.789 0.207 329 H SER 47 H SER 47 39.439 -5.646 1.635 330 HA SER 47 HA SER 47 39.859 -4.189 4.159 331 HB2 SER 47 2HB SER 47 39.781 -6.262 5.098 332 HB3 SER 47 3HB SER 47 40.137 -7.078 3.576 333 HG SER 47 HG SER 47 42.008 -7.346 4.537 334 H SER 48 H SER 48 41.991 -3.521 4.597 335 HA SER 48 HA SER 48 43.793 -3.583 2.264 336 HB2 SER 48 2HB SER 48 42.613 -1.345 2.949 337 HB3 SER 48 3HB SER 48 43.828 -1.314 4.227 338 HG SER 48 HG SER 48 45.301 -0.835 2.802 339 H ASN 49 H ASN 49 45.656 -4.569 2.635 340 HA ASN 49 HA ASN 49 46.772 -4.514 5.358 341 HB2 ASN 49 2HB ASN 49 46.388 -6.863 3.524 342 HB3 ASN 49 3HB ASN 49 47.683 -6.867 4.718 343 HD21 ASN 49 1HD2 ASN 49 44.202 -6.526 4.319 344 HD22 ASN 49 2HD2 ASN 49 43.781 -7.121 5.885 345 H THR 50 H THR 50 49.134 -5.103 5.371 346 HA THR 50 HA THR 50 50.451 -3.689 3.172 347 HB THR 50 HB THR 50 51.954 -4.564 5.596 348 HG1 THR 50 HG1 THR 50 49.899 -2.620 5.529 349 HG21 THR 50 3HG2 THR 50 52.943 -2.274 5.265 350 HG22 THR 50 1HG2 THR 50 51.965 -2.137 3.805 351 HG23 THR 50 2HG2 THR 50 53.196 -3.394 3.926 352 H ASP 51 H ASP 51 49.518 -6.585 3.208 353 HA ASP 51 HA ASP 51 51.836 -7.651 1.880 354 HB2 ASP 51 2HB ASP 51 52.267 -8.156 4.300 355 HB3 ASP 51 3HB ASP 51 50.799 -9.130 4.304 356 H ILE 52 H ILE 52 48.961 -9.015 3.492 357 HA ILE 52 HA ILE 52 47.844 -9.680 0.873 358 HB ILE 52 HB ILE 52 48.222 -11.722 3.067 359 HG12 ILE 52 2HG1 ILE 52 50.266 -11.230 1.749 360 HG13 ILE 52 3HG1 ILE 52 49.679 -12.870 1.497 361 HG21 ILE 52 1HG2 ILE 52 46.560 -11.665 0.610 362 HG22 ILE 52 2HG2 ILE 52 47.360 -13.179 1.026 363 HG23 ILE 52 3HG2 ILE 52 46.250 -12.425 2.170 364 HD11 ILE 52 3HD1 ILE 52 48.549 -11.054 -0.433 365 HD12 ILE 52 1HD1 ILE 52 50.311 -10.996 -0.446 366 HD13 ILE 52 2HD1 ILE 52 49.477 -12.533 -0.681 367 H LEU 53 H LEU 53 45.619 -9.799 0.817 368 HA LEU 53 HA LEU 53 44.130 -9.595 3.317 369 HB2 LEU 53 2HB LEU 53 42.946 -7.624 2.683 370 HB3 LEU 53 3HB LEU 53 44.673 -7.283 2.602 371 HG LEU 53 HG LEU 53 44.204 -7.953 0.033 372 HD11 LEU 53 1HD1 LEU 53 42.042 -8.001 -0.453 373 HD12 LEU 53 2HD1 LEU 53 41.948 -6.294 -0.022 374 HD13 LEU 53 3HD1 LEU 53 41.613 -7.530 1.191 375 HD21 LEU 53 3HD2 LEU 53 43.747 -5.346 -0.157 376 HD22 LEU 53 1HD2 LEU 53 45.326 -5.990 0.294 377 HD23 LEU 53 2HD2 LEU 53 44.227 -5.396 1.540 378 H SER 54 H SER 54 42.399 -10.861 3.241 379 HA SER 54 HA SER 54 41.051 -11.309 0.678 380 HB2 SER 54 2HB SER 54 40.886 -13.753 1.218 381 HB3 SER 54 3HB SER 54 42.526 -13.209 0.866 382 HG SER 54 HG SER 54 42.505 -12.911 3.340 383 H ILE 55 H ILE 55 38.998 -10.772 0.948 384 HA ILE 55 HA ILE 55 37.696 -11.419 3.511 385 HB ILE 55 HB ILE 55 36.179 -9.365 2.633 386 HG12 ILE 55 2HG1 ILE 55 37.809 -7.548 1.985 387 HG13 ILE 55 3HG1 ILE 55 39.011 -8.810 1.735 388 HG21 ILE 55 1HG2 ILE 55 38.535 -9.488 4.464 389 HG22 ILE 55 2HG2 ILE 55 37.709 -7.954 4.196 390 HG23 ILE 55 3HG2 ILE 55 36.821 -9.330 4.849 391 HD11 ILE 55 3HD1 ILE 55 36.410 -9.076 0.340 392 HD12 ILE 55 1HD1 ILE 55 37.548 -7.860 -0.238 393 HD13 ILE 55 2HD1 ILE 55 38.028 -9.556 -0.171 394 H SER 56 H SER 56 35.973 -12.690 3.352 395 HA SER 56 HA SER 56 34.540 -12.809 0.781 396 HB2 SER 56 2HB SER 56 34.148 -15.293 1.465 397 HB3 SER 56 3HB SER 56 35.694 -14.839 0.748 398 HG SER 56 HG SER 56 36.494 -15.705 2.488 399 H ASN 57 H ASN 57 32.588 -11.981 1.111 400 HA ASN 57 HA ASN 57 31.333 -12.031 3.704 401 HB2 ASN 57 2HB ASN 57 30.865 -10.702 1.115 402 HB3 ASN 57 3HB ASN 57 29.403 -11.101 2.012 403 HD21 ASN 57 1HD2 ASN 57 29.869 -8.526 1.595 404 HD22 ASN 57 2HD2 ASN 57 30.401 -7.737 3.038 405 H ALA 58 H ALA 58 30.560 -13.947 4.357 406 HA ALA 58 HA ALA 58 29.722 -16.082 2.835 407 HB1 ALA 58 1HB ALA 58 28.185 -15.689 5.310 408 HB2 ALA 58 2HB ALA 58 29.183 -17.049 4.793 409 HB3 ALA 58 3HB ALA 58 29.938 -15.616 5.491 410 H SER 59 H SER 59 28.047 -16.464 1.546 411 HA SER 59 HA SER 59 26.155 -14.555 0.849 412 HB2 SER 59 2HB SER 59 24.873 -16.772 0.069 413 HB3 SER 59 3HB SER 59 26.296 -16.163 -0.777 414 HG SER 59 HG SER 59 26.268 -18.473 -0.145 415 H ASP 60 H ASP 60 26.155 -16.846 3.446 416 HA ASP 60 HA ASP 60 23.463 -17.118 4.016 417 HB2 ASP 60 2HB ASP 60 25.391 -18.257 5.183 418 HB3 ASP 60 3HB ASP 60 25.619 -16.773 6.104 419 H SER 61 H SER 61 25.583 -14.853 5.771 420 HA SER 61 HA SER 61 24.030 -12.561 5.353 421 HB2 SER 61 2HB SER 61 22.526 -12.459 7.069 422 HB3 SER 61 3HB SER 61 22.597 -14.215 6.920 423 HG SER 61 HG SER 61 23.365 -12.636 8.978 424 H HIS 62 H HIS 62 25.969 -14.297 7.759 425 HA HIS 62 HA HIS 62 27.213 -11.861 8.693 426 HB2 HIS 62 2HB HIS 62 28.575 -13.422 10.098 427 HB3 HIS 62 3HB HIS 62 26.837 -13.588 10.325 428 HD1 HIS 62 HD1 HIS 62 29.831 -15.399 9.038 429 HD2 HIS 62 HD2 HIS 62 25.743 -16.021 9.438 430 HE1 HIS 62 HE1 HIS 62 29.480 -17.853 8.616 431 H GLY 63 H GLY 63 28.995 -10.961 7.890 432 HA2 GLY 63 2HA GLY 63 30.321 -12.150 5.635 433 HA3 GLY 63 3HA GLY 63 30.711 -10.607 6.381 434 H LEU 64 H LEU 64 32.740 -12.191 5.518 435 HA LEU 64 HA LEU 64 33.996 -12.961 8.050 436 HB2 LEU 64 2HB LEU 64 34.697 -14.625 5.721 437 HB3 LEU 64 3HB LEU 64 34.548 -15.060 7.422 438 HG LEU 64 HG LEU 64 32.186 -14.616 5.602 439 HD11 LEU 64 1HD1 LEU 64 33.872 -17.019 6.084 440 HD12 LEU 64 2HD1 LEU 64 33.060 -16.482 4.614 441 HD13 LEU 64 3HD1 LEU 64 32.128 -17.227 5.913 442 HD21 LEU 64 3HD2 LEU 64 32.525 -15.075 8.432 443 HD22 LEU 64 1HD2 LEU 64 31.566 -16.353 7.686 444 HD23 LEU 64 2HD2 LEU 64 31.069 -14.669 7.523 445 H ALA 65 H ALA 65 35.829 -11.883 8.292 446 HA ALA 65 HA ALA 65 37.261 -10.980 5.880 447 HB1 ALA 65 1HB ALA 65 36.288 -9.482 8.017 448 HB2 ALA 65 2HB ALA 65 38.029 -9.579 8.282 449 HB3 ALA 65 3HB ALA 65 37.403 -8.944 6.760 450 H SER 66 H SER 66 39.222 -11.784 5.531 451 HA SER 66 HA SER 66 40.678 -12.968 7.804 452 HB2 SER 66 2HB SER 66 39.713 -14.648 6.179 453 HB3 SER 66 3HB SER 66 40.793 -13.978 4.957 454 HG SER 66 HG SER 66 42.542 -14.643 6.154 455 H THR 67 H THR 67 42.688 -12.257 8.120 456 HA THR 67 HA THR 67 44.165 -11.038 5.909 457 HB THR 67 HB THR 67 44.690 -9.032 7.062 458 HG1 THR 67 HG1 THR 67 43.152 -9.799 9.311 459 HG21 THR 67 3HG2 THR 67 42.436 -9.121 6.004 460 HG22 THR 67 1HG2 THR 67 42.546 -7.964 7.330 461 HG23 THR 67 2HG2 THR 67 41.756 -9.520 7.581 462 H LEU 68 H LEU 68 46.376 -11.214 6.070 463 HA LEU 68 HA LEU 68 47.528 -12.288 8.528 464 HB2 LEU 68 2HB LEU 68 46.812 -14.139 6.899 465 HB3 LEU 68 3HB LEU 68 48.151 -13.586 5.896 466 HG LEU 68 HG LEU 68 48.686 -14.311 8.739 467 HD11 LEU 68 1HD1 LEU 68 48.545 -16.358 6.538 468 HD12 LEU 68 2HD1 LEU 68 47.277 -16.129 7.740 469 HD13 LEU 68 3HD1 LEU 68 48.891 -16.626 8.246 470 HD21 LEU 68 3HD2 LEU 68 50.714 -15.287 7.302 471 HD22 LEU 68 1HD2 LEU 68 50.643 -13.608 7.838 472 HD23 LEU 68 2HD2 LEU 68 50.168 -14.028 6.193 473 H ASN 69 H ASN 69 48.401 -10.111 8.558 474 HA ASN 69 HA ASN 69 50.927 -9.984 7.118 475 HB2 ASN 69 2HB ASN 69 50.563 -8.019 5.991 476 HB3 ASN 69 3HB ASN 69 48.929 -8.674 5.950 477 HD21 ASN 69 1HD2 ASN 69 50.571 -5.945 6.404 478 HD22 ASN 69 2HD2 ASN 69 49.515 -5.112 7.489 479 H GLN 70 H GLN 70 52.153 -7.915 7.892 480 HA GLN 70 HA GLN 70 51.902 -7.856 10.816 481 HB2 GLN 70 2HB GLN 70 54.264 -6.969 10.719 482 HB3 GLN 70 3HB GLN 70 54.054 -8.624 10.161 483 HG2 GLN 70 2HG GLN 70 53.801 -6.676 8.020 484 HG3 GLN 70 3HG GLN 70 55.366 -6.611 8.830 485 HE21 GLN 70 1HE2 GLN 70 53.858 -7.892 6.287 486 HE22 GLN 70 2HE2 GLN 70 54.747 -9.361 6.094 487 H GLY 71 H GLY 71 50.387 -6.247 11.113 488 HA2 GLY 71 2HA GLY 71 51.089 -3.677 11.509 489 HA3 GLY 71 3HA GLY 71 50.694 -3.684 9.796 490 H ASN 72 H ASN 72 48.954 -2.266 10.111 491 HA ASN 72 HA ASN 72 46.655 -3.429 11.541 492 HB2 ASN 72 2HB ASN 72 45.838 -1.204 11.936 493 HB3 ASN 72 3HB ASN 72 47.527 -1.251 12.433 494 HD21 ASN 72 1HD2 ASN 72 45.371 0.657 11.042 495 HD22 ASN 72 2HD2 ASN 72 46.373 1.549 9.952 496 H VAL 73 H VAL 73 44.631 -3.411 10.556 497 HA VAL 73 HA VAL 73 44.625 -2.760 7.681 498 HB VAL 73 HB VAL 73 44.618 -5.130 7.787 499 HG11 VAL 73 1HG1 VAL 73 44.100 -6.000 9.787 500 HG12 VAL 73 2HG1 VAL 73 42.992 -4.684 10.180 501 HG13 VAL 73 3HG1 VAL 73 42.446 -6.027 9.175 502 HG21 VAL 73 3HG2 VAL 73 42.721 -3.793 6.494 503 HG22 VAL 73 1HG2 VAL 73 42.803 -5.555 6.479 504 HG23 VAL 73 2HG2 VAL 73 41.685 -4.732 7.568 505 H LYS 74 H LYS 74 42.849 -1.734 6.865 506 HA LYS 74 HA LYS 74 40.758 -0.993 8.806 507 HB2 LYS 74 2HB LYS 74 42.510 0.684 7.422 508 HB3 LYS 74 3HB LYS 74 40.988 0.820 6.551 509 HG2 LYS 74 2HG LYS 74 41.146 2.528 8.254 510 HG3 LYS 74 3HG LYS 74 39.849 1.395 8.641 511 HD2 LYS 74 2HD LYS 74 41.238 0.283 10.264 512 HD3 LYS 74 3HD LYS 74 42.632 1.261 9.799 513 HE2 LYS 74 2HE LYS 74 41.507 1.999 11.902 514 HE3 LYS 74 3HE LYS 74 41.616 3.244 10.659 515 HZ1 LYS 74 3HZ LYS 74 39.202 1.565 10.977 516 HZ2 LYS 74 1HZ LYS 74 39.355 3.040 10.163 517 HZ3 LYS 74 2HZ LYS 74 39.413 2.996 11.853 518 H VAL 75 H VAL 75 38.836 -1.819 8.351 519 HA VAL 75 HA VAL 75 38.230 -2.551 5.568 520 HB VAL 75 HB VAL 75 36.914 -3.526 8.107 521 HG11 VAL 75 1HG1 VAL 75 36.285 -3.823 5.251 522 HG12 VAL 75 2HG1 VAL 75 36.272 -5.322 6.184 523 HG13 VAL 75 3HG1 VAL 75 35.243 -3.972 6.666 524 HG21 VAL 75 3HG2 VAL 75 38.066 -5.628 7.693 525 HG22 VAL 75 1HG2 VAL 75 38.838 -4.941 6.264 526 HG23 VAL 75 2HG2 VAL 75 39.229 -4.313 7.865 527 H THR 76 H THR 76 36.540 -1.672 4.513 528 HA THR 76 HA THR 76 34.554 -0.128 6.004 529 HB THR 76 HB THR 76 35.099 1.394 3.685 530 HG1 THR 76 HG1 THR 76 37.186 0.689 3.552 531 HG21 THR 76 3HG2 THR 76 35.460 3.174 5.242 532 HG22 THR 76 1HG2 THR 76 35.856 2.041 6.533 533 HG23 THR 76 2HG2 THR 76 34.208 2.130 5.913 534 H ALA 77 H ALA 77 32.557 0.025 5.009 535 HA ALA 77 HA ALA 77 32.224 -1.025 2.314 536 HB1 ALA 77 1HB ALA 77 30.436 -2.221 4.367 537 HB2 ALA 77 2HB ALA 77 30.971 -2.868 2.815 538 HB3 ALA 77 3HB ALA 77 32.068 -2.867 4.197 539 H SER 78 H SER 78 30.364 -0.321 1.294 540 HA SER 78 HA SER 78 28.563 1.406 2.850 541 HB2 SER 78 2HB SER 78 30.258 2.129 0.532 542 HB3 SER 78 3HB SER 78 28.595 2.715 0.479 543 HG SER 78 HG SER 78 30.441 3.932 1.663 544 H ILE 79 H ILE 79 26.441 1.236 2.358 545 HA ILE 79 HA ILE 79 25.658 -0.178 -0.084 546 HB ILE 79 HB ILE 79 25.700 -1.929 1.568 547 HG12 ILE 79 2HG1 ILE 79 22.854 -0.998 1.128 548 HG13 ILE 79 3HG1 ILE 79 23.818 -1.899 -0.037 549 HG21 ILE 79 1HG2 ILE 79 23.788 -0.339 3.260 550 HG22 ILE 79 2HG2 ILE 79 24.625 -1.835 3.672 551 HG23 ILE 79 3HG2 ILE 79 25.533 -0.331 3.518 552 HD11 ILE 79 3HD1 ILE 79 22.158 -3.235 1.281 553 HD12 ILE 79 1HD1 ILE 79 23.818 -3.829 1.325 554 HD13 ILE 79 2HD1 ILE 79 23.162 -2.941 2.701 555 H GLY 80 H GLY 80 24.209 1.017 -1.117 556 HA2 GLY 80 2HA GLY 80 22.586 2.592 -1.531 557 HA3 GLY 80 3HA GLY 80 21.784 1.889 -0.134 558 H GLY 81 H GLY 81 21.326 3.261 1.448 559 HA2 GLY 81 2HA GLY 81 22.843 5.784 1.571 560 HA3 GLY 81 3HA GLY 81 21.202 5.559 2.158 561 H ILE 82 H ILE 82 24.277 3.839 2.700 562 HA ILE 82 HA ILE 82 24.625 4.716 5.348 563 HB ILE 82 HB ILE 82 22.555 3.339 5.673 564 HG12 ILE 82 2HG1 ILE 82 24.665 1.906 7.186 565 HG13 ILE 82 3HG1 ILE 82 24.681 3.662 7.299 566 HG21 ILE 82 1HG2 ILE 82 24.412 1.087 4.923 567 HG22 ILE 82 2HG2 ILE 82 22.829 0.879 5.669 568 HG23 ILE 82 3HG2 ILE 82 22.960 1.594 4.062 569 HD11 ILE 82 3HD1 ILE 82 22.103 2.255 7.716 570 HD12 ILE 82 1HD1 ILE 82 23.322 2.178 8.988 571 HD13 ILE 82 2HD1 ILE 82 22.715 3.742 8.441 572 H GLN 83 H GLN 83 26.416 3.693 6.410 573 HA GLN 83 HA GLN 83 27.878 1.640 4.985 574 HB2 GLN 83 2HB GLN 83 29.842 2.897 4.553 575 HB3 GLN 83 3HB GLN 83 28.505 3.849 3.922 576 HG2 GLN 83 2HG GLN 83 28.548 5.204 5.987 577 HG3 GLN 83 3HG GLN 83 29.961 4.294 6.517 578 HE21 GLN 83 1HE2 GLN 83 31.298 6.073 6.553 579 HE22 GLN 83 2HE2 GLN 83 31.840 6.865 5.117 580 H GLY 84 H GLY 84 29.833 0.949 6.180 581 HA2 GLY 84 2HA GLY 84 29.596 1.555 9.063 582 HA3 GLY 84 3HA GLY 84 29.826 -0.082 8.467 583 H SER 85 H SER 85 31.532 1.076 10.334 584 HA SER 85 HA SER 85 34.031 1.067 8.812 585 HB2 SER 85 2HB SER 85 34.850 2.912 10.421 586 HB3 SER 85 3HB SER 85 33.802 3.393 9.087 587 HG SER 85 HG SER 85 32.853 4.329 10.780 588 H THR 86 H THR 86 35.624 -0.073 9.758 589 HA THR 86 HA THR 86 35.440 -0.718 12.605 590 HB THR 86 HB THR 86 34.407 -2.659 11.896 591 HG1 THR 86 HG1 THR 86 35.888 -4.178 12.344 592 HG21 THR 86 3HG2 THR 86 34.231 -2.707 9.633 593 HG22 THR 86 1HG2 THR 86 35.556 -3.861 9.785 594 HG23 THR 86 2HG2 THR 86 35.894 -2.177 9.384 595 H ASP 87 H ASP 87 37.414 -1.454 13.532 596 HA ASP 87 HA ASP 87 39.786 -0.936 11.861 597 HB2 ASP 87 2HB ASP 87 39.747 0.895 13.318 598 HB3 ASP 87 3HB ASP 87 39.161 -0.072 14.669 599 H PHE 88 H PHE 88 41.191 -2.555 11.725 600 HA PHE 88 HA PHE 88 41.164 -4.620 13.824 601 HB2 PHE 88 2HB PHE 88 41.066 -4.918 10.846 602 HB3 PHE 88 3HB PHE 88 41.858 -6.159 11.812 603 HD1 PHE 88 HD2 PHE 88 40.328 -6.697 14.046 604 HD2 PHE 88 HD1 PHE 88 38.938 -5.454 10.221 605 HE1 PHE 88 HE2 PHE 88 38.144 -7.731 14.508 606 HE2 PHE 88 HE1 PHE 88 36.751 -6.484 10.677 607 HZ PHE 88 HZ PHE 88 36.352 -7.626 12.823 608 H LYS 89 H LYS 89 43.108 -5.329 14.542 609 HA LYS 89 HA LYS 89 45.515 -4.322 13.177 610 HB2 LYS 89 2HB LYS 89 44.723 -4.101 16.049 611 HB3 LYS 89 3HB LYS 89 46.427 -4.294 15.658 612 HG2 LYS 89 2HG LYS 89 45.790 -2.320 13.953 613 HG3 LYS 89 3HG LYS 89 44.633 -1.994 15.246 614 HD2 LYS 89 2HD LYS 89 47.412 -2.564 16.080 615 HD3 LYS 89 3HD LYS 89 47.144 -1.039 15.233 616 HE2 LYS 89 2HE LYS 89 45.058 -1.125 17.021 617 HE3 LYS 89 3HE LYS 89 46.383 -1.850 17.931 618 HZ1 LYS 89 3HZ LYS 89 46.355 0.821 16.640 619 HZ2 LYS 89 1HZ LYS 89 47.737 0.116 17.316 620 HZ3 LYS 89 2HZ LYS 89 46.411 0.488 18.297 621 H VAL 90 H VAL 90 46.500 -6.062 12.379 622 HA VAL 90 HA VAL 90 46.521 -8.539 13.959 623 HB VAL 90 HB VAL 90 45.669 -8.913 11.757 624 HG11 VAL 90 1HG1 VAL 90 46.960 -8.365 9.735 625 HG12 VAL 90 2HG1 VAL 90 46.526 -6.926 10.659 626 HG13 VAL 90 3HG1 VAL 90 48.168 -7.565 10.738 627 HG21 VAL 90 3HG2 VAL 90 47.232 -10.559 10.900 628 HG22 VAL 90 1HG2 VAL 90 48.542 -9.832 11.830 629 HG23 VAL 90 2HG2 VAL 90 47.200 -10.618 12.662 630 H THR 91 H THR 91 48.325 -9.178 14.933 631 HA THR 91 HA THR 91 50.771 -7.667 14.538 632 HB THR 91 HB THR 91 51.560 -9.373 16.381 633 HG1 THR 91 HG1 THR 91 49.977 -10.434 17.385 634 HG21 THR 91 3HG2 THR 91 49.481 -7.318 17.113 635 HG22 THR 91 1HG2 THR 91 51.115 -6.896 16.603 636 HG23 THR 91 2HG2 THR 91 50.866 -7.846 18.068 637 H GLN 92 H GLN 92 52.867 -8.837 14.401 638 HA GLN 92 HA GLN 92 54.284 -10.111 13.153 639 HB2 GLN 92 2HB GLN 92 52.349 -11.993 14.371 640 HB3 GLN 92 3HB GLN 92 53.336 -12.634 13.064 641 HG2 GLN 92 2HG GLN 92 54.694 -13.124 14.804 642 HG3 GLN 92 3HG GLN 92 55.270 -11.493 14.463 643 HE21 GLN 92 1HE2 GLN 92 55.935 -11.009 16.504 644 HE22 GLN 92 2HE2 GLN 92 54.860 -10.833 17.844 Start of MODEL 16 1 H1 MET 1 H MET 1 2.315 -4.355 -1.033 2 HA MET 1 HA MET 1 3.670 -2.792 -3.103 3 HB2 MET 1 2HB MET 1 2.763 -2.036 -0.321 4 HB3 MET 1 3HB MET 1 3.569 -0.946 -1.440 5 HG2 MET 1 2HG MET 1 1.533 -1.792 -2.984 6 HG3 MET 1 3HG MET 1 0.789 -1.898 -1.390 7 HE1 MET 1 3HE MET 1 2.593 0.321 -3.973 8 HE2 MET 1 1HE MET 1 2.481 1.944 -3.290 9 HE3 MET 1 2HE MET 1 3.560 0.754 -2.562 10 HA PRO 2 HA PRO 2 7.175 -4.701 -0.707 11 HB2 PRO 2 2HB PRO 2 8.619 -5.389 -2.900 12 HB3 PRO 2 3HB PRO 2 7.376 -6.433 -2.203 13 HG2 PRO 2 2HG PRO 2 7.202 -4.594 -4.558 14 HG3 PRO 2 3HG PRO 2 6.571 -6.241 -4.376 15 HD2 PRO 2 2HD PRO 2 5.006 -4.046 -4.122 16 HD3 PRO 2 3HD PRO 2 4.717 -5.537 -3.203 17 H ALA 3 H ALA 3 9.260 -3.856 -0.420 18 HA ALA 3 HA ALA 3 10.127 -1.653 -2.115 19 HB1 ALA 3 1HB ALA 3 8.816 -1.226 0.387 20 HB2 ALA 3 2HB ALA 3 10.496 -0.700 0.510 21 HB3 ALA 3 3HB ALA 3 9.455 -0.039 -0.751 22 H ALA 4 H ALA 4 11.879 -2.977 -2.661 23 HA ALA 4 HA ALA 4 13.574 -4.174 -0.705 24 HB1 ALA 4 1HB ALA 4 14.484 -3.566 -3.487 25 HB2 ALA 4 2HB ALA 4 14.837 -4.966 -2.473 26 HB3 ALA 4 3HB ALA 4 13.242 -4.787 -3.205 27 H LEU 5 H LEU 5 15.601 -3.539 0.010 28 HA LEU 5 HA LEU 5 17.247 -2.116 0.672 29 HB2 LEU 5 2HB LEU 5 17.469 -1.933 -1.858 30 HB3 LEU 5 3HB LEU 5 16.584 -0.416 -1.715 31 HG LEU 5 HG LEU 5 19.068 -0.815 -0.107 32 HD11 LEU 5 1HD1 LEU 5 19.181 -1.291 -2.772 33 HD12 LEU 5 2HD1 LEU 5 20.502 -0.612 -1.822 34 HD13 LEU 5 3HD1 LEU 5 19.430 0.454 -2.729 35 HD21 LEU 5 3HD2 LEU 5 18.153 1.195 0.464 36 HD22 LEU 5 1HD2 LEU 5 17.408 1.433 -1.117 37 HD23 LEU 5 2HD2 LEU 5 19.138 1.703 -0.909 38 H VAL 6 H VAL 6 16.728 -1.085 2.488 39 HA VAL 6 HA VAL 6 15.288 1.456 2.280 40 HB VAL 6 HB VAL 6 14.622 -0.613 4.378 41 HG11 VAL 6 1HG1 VAL 6 12.605 1.170 4.434 42 HG12 VAL 6 2HG1 VAL 6 14.036 1.280 5.462 43 HG13 VAL 6 3HG1 VAL 6 13.940 2.228 3.977 44 HG21 VAL 6 3HG2 VAL 6 13.620 -1.494 2.488 45 HG22 VAL 6 1HG2 VAL 6 12.342 -0.465 3.136 46 HG23 VAL 6 2HG2 VAL 6 13.321 0.093 1.779 47 H SER 7 H SER 7 17.064 -0.744 4.435 48 HA SER 7 HA SER 7 18.976 1.207 5.152 49 HB2 SER 7 2HB SER 7 16.561 0.994 6.847 50 HB3 SER 7 3HB SER 7 18.100 0.983 7.709 51 HG SER 7 HG SER 7 16.883 3.012 6.261 52 H ILE 8 H ILE 8 20.681 0.336 6.320 53 HA ILE 8 HA ILE 8 20.427 -2.518 7.013 54 HB ILE 8 HB ILE 8 22.966 -1.269 5.984 55 HG12 ILE 8 2HG1 ILE 8 21.284 -1.053 4.228 56 HG13 ILE 8 3HG1 ILE 8 22.447 -2.303 3.802 57 HG21 ILE 8 1HG2 ILE 8 23.338 -3.756 5.410 58 HG22 ILE 8 2HG2 ILE 8 23.493 -3.242 7.088 59 HG23 ILE 8 3HG2 ILE 8 22.024 -4.054 6.548 60 HD11 ILE 8 3HD1 ILE 8 20.582 -3.802 5.018 61 HD12 ILE 8 1HD1 ILE 8 19.572 -2.506 4.378 62 HD13 ILE 8 2HD1 ILE 8 20.588 -3.452 3.290 63 H SER 9 H SER 9 21.780 -3.282 8.716 64 HA SER 9 HA SER 9 22.720 -1.148 10.519 65 HB2 SER 9 2HB SER 9 20.768 -2.124 11.506 66 HB3 SER 9 3HB SER 9 21.342 -3.758 11.173 67 HG SER 9 HG SER 9 22.306 -1.899 13.069 68 H VAL 10 H VAL 10 24.869 -1.140 10.489 69 HA VAL 10 HA VAL 10 26.286 -3.724 10.450 70 HB VAL 10 HB VAL 10 28.225 -2.532 9.556 71 HG11 VAL 10 1HG1 VAL 10 26.180 -1.576 7.682 72 HG12 VAL 10 2HG1 VAL 10 27.496 -2.727 7.440 73 HG13 VAL 10 3HG1 VAL 10 25.989 -3.254 8.190 74 HG21 VAL 10 3HG2 VAL 10 26.418 -0.120 9.646 75 HG22 VAL 10 1HG2 VAL 10 27.921 -0.361 10.536 76 HG23 VAL 10 2HG2 VAL 10 27.954 -0.184 8.782 77 H SER 11 H SER 11 27.631 -4.236 12.079 78 HA SER 11 HA SER 11 28.025 -2.216 14.188 79 HB2 SER 11 2HB SER 11 26.623 -4.217 14.792 80 HB3 SER 11 3HB SER 11 28.050 -5.221 14.536 81 HG SER 11 HG SER 11 27.549 -3.309 16.533 82 HA PRO 12 HA PRO 12 32.203 -3.205 12.420 83 HB2 PRO 12 2HB PRO 12 33.041 -0.624 12.350 84 HB3 PRO 12 3HB PRO 12 32.131 -1.374 11.034 85 HG2 PRO 12 2HG PRO 12 31.160 0.414 13.230 86 HG3 PRO 12 3HG PRO 12 30.746 0.434 11.506 87 HD2 PRO 12 2HD PRO 12 29.131 -0.668 13.379 88 HD3 PRO 12 3HD PRO 12 29.233 -1.292 11.721 89 H THR 13 H THR 13 33.730 -3.801 13.814 90 HA THR 13 HA THR 13 33.993 -2.305 16.341 91 HB THR 13 HB THR 13 34.832 -5.175 15.993 92 HG1 THR 13 HG1 THR 13 32.349 -4.357 17.100 93 HG21 THR 13 3HG2 THR 13 35.767 -4.297 17.947 94 HG22 THR 13 1HG2 THR 13 34.295 -5.085 18.513 95 HG23 THR 13 2HG2 THR 13 34.336 -3.333 18.311 96 H ASN 14 H ASN 14 35.759 -1.085 16.334 97 HA ASN 14 HA ASN 14 38.040 -1.785 14.682 98 HB2 ASN 14 2HB ASN 14 38.938 0.420 15.619 99 HB3 ASN 14 3HB ASN 14 37.505 0.516 14.601 100 HD21 ASN 14 1HD2 ASN 14 37.226 2.591 15.649 101 HD22 ASN 14 2HD2 ASN 14 36.436 2.661 17.184 102 H SER 15 H SER 15 38.844 -3.627 15.731 103 HA SER 15 HA SER 15 40.354 -3.026 18.172 104 HB2 SER 15 2HB SER 15 38.076 -4.629 18.179 105 HB3 SER 15 3HB SER 15 39.411 -5.780 18.142 106 HG SER 15 HG SER 15 38.883 -3.759 20.048 107 H THR 16 H THR 16 41.577 -5.420 18.576 108 HA THR 16 HA THR 16 43.195 -5.690 16.139 109 HB THR 16 HB THR 16 44.890 -6.736 17.710 110 HG1 THR 16 HG1 THR 16 43.211 -5.567 19.696 111 HG21 THR 16 3HG2 THR 16 44.078 -3.925 17.521 112 HG22 THR 16 1HG2 THR 16 45.663 -4.664 17.296 113 HG23 THR 16 2HG2 THR 16 45.086 -4.294 18.921 114 H VAL 17 H VAL 17 43.876 -7.753 15.427 115 HA VAL 17 HA VAL 17 42.428 -10.050 16.546 116 HB VAL 17 HB VAL 17 41.209 -9.161 14.543 117 HG11 VAL 17 1HG1 VAL 17 42.136 -9.355 12.362 118 HG12 VAL 17 2HG1 VAL 17 43.311 -8.476 13.343 119 HG13 VAL 17 3HG1 VAL 17 43.567 -10.182 12.974 120 HG21 VAL 17 3HG2 VAL 17 41.357 -11.624 15.349 121 HG22 VAL 17 1HG2 VAL 17 40.650 -11.272 13.772 122 HG23 VAL 17 2HG2 VAL 17 42.308 -11.865 13.883 123 H ALA 18 H ALA 18 43.367 -12.108 16.059 124 HA ALA 18 HA ALA 18 46.210 -12.080 16.109 125 HB1 ALA 18 1HB ALA 18 44.090 -14.039 16.442 126 HB2 ALA 18 2HB ALA 18 45.493 -14.694 15.595 127 HB3 ALA 18 3HB ALA 18 45.687 -13.960 17.187 128 H LYS 19 H LYS 19 47.680 -12.914 14.595 129 HA LYS 19 HA LYS 19 47.143 -12.261 11.901 130 HB2 LYS 19 2HB LYS 19 49.366 -12.938 11.439 131 HB3 LYS 19 3HB LYS 19 49.398 -12.258 13.060 132 HG2 LYS 19 2HG LYS 19 49.215 -14.607 13.935 133 HG3 LYS 19 3HG LYS 19 49.475 -15.159 12.279 134 HD2 LYS 19 2HD LYS 19 51.661 -15.056 12.713 135 HD3 LYS 19 3HD LYS 19 51.490 -13.300 12.699 136 HE2 LYS 19 2HE LYS 19 50.984 -13.375 15.121 137 HE3 LYS 19 3HE LYS 19 51.276 -15.114 15.100 138 HZ1 LYS 19 3HZ LYS 19 53.201 -13.769 15.848 139 HZ2 LYS 19 1HZ LYS 19 53.293 -13.089 14.301 140 HZ3 LYS 19 2HZ LYS 19 53.542 -14.748 14.511 141 H GLY 20 H GLY 20 46.718 -13.511 10.119 142 HA2 GLY 20 2HA GLY 20 45.833 -15.274 8.945 143 HA3 GLY 20 3HA GLY 20 46.897 -16.280 9.917 144 H LEU 21 H LEU 21 43.669 -15.075 9.502 145 HA LEU 21 HA LEU 21 42.453 -17.279 10.704 146 HB2 LEU 21 2HB LEU 21 43.442 -15.517 12.610 147 HB3 LEU 21 3HB LEU 21 41.725 -15.134 12.510 148 HG LEU 21 HG LEU 21 42.066 -17.976 12.675 149 HD11 LEU 21 1HD1 LEU 21 43.049 -16.751 15.181 150 HD12 LEU 21 2HD1 LEU 21 44.203 -16.901 13.857 151 HD13 LEU 21 3HD1 LEU 21 43.385 -18.334 14.479 152 HD21 LEU 21 3HD2 LEU 21 40.716 -15.798 14.203 153 HD22 LEU 21 1HD2 LEU 21 40.822 -17.413 14.904 154 HD23 LEU 21 2HD2 LEU 21 40.019 -17.177 13.351 155 H GLN 22 H GLN 22 40.072 -16.307 11.601 156 HA GLN 22 HA GLN 22 39.114 -14.424 9.576 157 HB2 GLN 22 2HB GLN 22 37.896 -17.146 10.075 158 HB3 GLN 22 3HB GLN 22 37.193 -15.894 9.059 159 HG2 GLN 22 2HG GLN 22 38.226 -17.027 7.422 160 HG3 GLN 22 3HG GLN 22 39.622 -16.079 7.935 161 HE21 GLN 22 1HE2 GLN 22 39.849 -18.507 6.610 162 HE22 GLN 22 2HE2 GLN 22 40.547 -19.667 7.683 163 H GLU 23 H GLU 23 37.350 -13.209 10.187 164 HA GLU 23 HA GLU 23 36.204 -13.742 12.839 165 HB2 GLU 23 2HB GLU 23 38.075 -11.813 12.503 166 HB3 GLU 23 3HB GLU 23 36.616 -10.899 12.146 167 HG2 GLU 23 2HG GLU 23 36.873 -10.566 14.408 168 HG3 GLU 23 3HG GLU 23 35.725 -11.903 14.350 169 H ASN 24 H ASN 24 34.086 -13.958 12.625 170 HA ASN 24 HA ASN 24 32.679 -13.058 10.308 171 HB2 ASN 24 2HB ASN 24 30.653 -13.864 11.634 172 HB3 ASN 24 3HB ASN 24 31.887 -15.069 11.277 173 HD21 ASN 24 1HD2 ASN 24 30.373 -13.153 13.735 174 HD22 ASN 24 2HD2 ASN 24 31.053 -13.982 15.090 175 H PHE 25 H PHE 25 31.246 -11.388 10.073 176 HA PHE 25 HA PHE 25 31.302 -9.360 12.199 177 HB2 PHE 25 2HB PHE 25 31.108 -9.217 9.218 178 HB3 PHE 25 3HB PHE 25 30.405 -7.921 10.180 179 HD1 PHE 25 HD1 PHE 25 32.164 -7.348 12.273 180 HD2 PHE 25 HD2 PHE 25 33.134 -8.640 8.335 181 HE1 PHE 25 HE1 PHE 25 34.380 -6.298 12.478 182 HE2 PHE 25 HE2 PHE 25 35.352 -7.593 8.535 183 HZ PHE 25 HZ PHE 25 35.977 -6.421 10.608 184 H LYS 26 H LYS 26 29.220 -7.807 11.735 185 HA LYS 26 HA LYS 26 26.868 -9.581 11.816 186 HB2 LYS 26 2HB LYS 26 27.880 -7.765 13.821 187 HB3 LYS 26 3HB LYS 26 26.263 -7.287 13.321 188 HG2 LYS 26 2HG LYS 26 25.326 -9.317 14.004 189 HG3 LYS 26 3HG LYS 26 26.898 -10.115 14.086 190 HD2 LYS 26 2HD LYS 26 27.357 -9.289 16.142 191 HD3 LYS 26 3HD LYS 26 26.559 -7.748 15.816 192 HE2 LYS 26 2HE LYS 26 24.724 -8.425 16.870 193 HE3 LYS 26 3HE LYS 26 24.620 -9.858 15.849 194 HZ1 LYS 26 3HZ LYS 26 25.043 -10.995 17.696 195 HZ2 LYS 26 1HZ LYS 26 25.512 -9.616 18.556 196 HZ3 LYS 26 2HZ LYS 26 26.634 -10.432 17.589 197 H ALA 27 H ALA 27 25.309 -9.098 10.415 198 HA ALA 27 HA ALA 27 25.040 -6.340 9.455 199 HB1 ALA 27 1HB ALA 27 25.333 -6.807 7.258 200 HB2 ALA 27 2HB ALA 27 26.368 -8.074 7.919 201 HB3 ALA 27 3HB ALA 27 24.722 -8.455 7.411 202 H THR 28 H THR 28 23.027 -5.732 9.854 203 HA THR 28 HA THR 28 20.873 -7.731 9.610 204 HB THR 28 HB THR 28 19.981 -5.526 11.170 205 HG1 THR 28 HG1 THR 28 22.440 -6.665 12.060 206 HG21 THR 28 3HG2 THR 28 19.653 -7.256 12.877 207 HG22 THR 28 1HG2 THR 28 20.659 -8.366 11.947 208 HG23 THR 28 2HG2 THR 28 19.118 -7.811 11.291 209 H GLY 29 H GLY 29 20.024 -7.364 7.634 210 HA2 GLY 29 2HA GLY 29 19.580 -4.603 6.761 211 HA3 GLY 29 3HA GLY 29 19.464 -6.037 5.753 212 H ILE 30 H ILE 30 17.602 -3.726 6.349 213 HA ILE 30 HA ILE 30 15.251 -5.377 6.996 214 HB ILE 30 HB ILE 30 14.229 -3.194 7.864 215 HG12 ILE 30 2HG1 ILE 30 17.166 -2.481 8.027 216 HG13 ILE 30 3HG1 ILE 30 15.963 -1.682 7.019 217 HG21 ILE 30 1HG2 ILE 30 14.780 -3.761 10.033 218 HG22 ILE 30 2HG2 ILE 30 15.163 -5.244 9.161 219 HG23 ILE 30 3HG2 ILE 30 16.454 -4.134 9.622 220 HD11 ILE 30 3HD1 ILE 30 16.643 -1.236 9.779 221 HD12 ILE 30 1HD1 ILE 30 15.671 -0.254 8.682 222 HD13 ILE 30 2HD1 ILE 30 14.921 -1.567 9.590 223 H PHE 31 H PHE 31 14.012 -5.573 5.263 224 HA PHE 31 HA PHE 31 13.546 -3.215 3.580 225 HB2 PHE 31 2HB PHE 31 13.835 -5.926 2.320 226 HB3 PHE 31 3HB PHE 31 13.949 -4.338 1.568 227 HD1 PHE 31 HD1 PHE 31 15.916 -2.841 2.632 228 HD2 PHE 31 HD2 PHE 31 15.785 -7.095 2.547 229 HE1 PHE 31 HE1 PHE 31 18.366 -2.917 2.840 230 HE2 PHE 31 HE2 PHE 31 18.235 -7.178 2.756 231 HZ PHE 31 HZ PHE 31 19.529 -5.088 2.904 232 H THR 32 H THR 32 11.510 -3.082 2.653 233 HA THR 32 HA THR 32 9.413 -4.381 4.050 234 HB THR 32 HB THR 32 9.003 -2.980 1.424 235 HG1 THR 32 HG1 THR 32 9.046 -1.010 2.605 236 HG21 THR 32 3HG2 THR 32 7.192 -2.165 3.421 237 HG22 THR 32 1HG2 THR 32 7.346 -3.915 3.570 238 HG23 THR 32 2HG2 THR 32 6.871 -3.200 2.030 239 H ASP 33 H ASP 33 10.937 -4.908 0.931 240 HA ASP 33 HA ASP 33 9.002 -6.935 0.176 241 HB2 ASP 33 2HB ASP 33 10.060 -5.359 -1.481 242 HB3 ASP 33 3HB ASP 33 11.580 -6.211 -1.224 243 H ASN 34 H ASN 34 11.506 -6.880 2.265 244 HA ASN 34 HA ASN 34 11.655 -9.670 2.547 245 HB2 ASN 34 2HB ASN 34 13.459 -8.549 0.588 246 HB3 ASN 34 3HB ASN 34 14.364 -9.262 1.920 247 HD21 ASN 34 1HD2 ASN 34 15.109 -10.819 0.392 248 HD22 ASN 34 2HD2 ASN 34 14.114 -12.166 -0.034 249 H SER 35 H SER 35 11.530 -9.432 4.710 250 HA SER 35 HA SER 35 12.466 -7.547 6.383 251 HB2 SER 35 2HB SER 35 12.965 -9.640 7.972 252 HB3 SER 35 3HB SER 35 11.323 -9.153 7.553 253 HG SER 35 HG SER 35 12.583 -11.455 7.012 254 H ASN 36 H ASN 36 14.352 -10.550 6.178 255 HA ASN 36 HA ASN 36 16.801 -8.909 6.206 256 HB2 ASN 36 2HB ASN 36 17.837 -10.863 7.451 257 HB3 ASN 36 3HB ASN 36 16.654 -9.922 8.354 258 HD21 ASN 36 1HD2 ASN 36 17.491 -12.978 7.108 259 HD22 ASN 36 2HD2 ASN 36 16.092 -13.839 7.644 260 H SER 37 H SER 37 18.408 -9.435 4.807 261 HA SER 37 HA SER 37 18.140 -11.893 3.229 262 HB2 SER 37 2HB SER 37 17.977 -9.107 2.242 263 HB3 SER 37 3HB SER 37 18.999 -10.194 1.303 264 HG SER 37 HG SER 37 17.125 -11.652 1.334 265 H ASP 38 H ASP 38 20.092 -12.600 2.223 266 HA ASP 38 HA ASP 38 22.453 -11.821 3.732 267 HB2 ASP 38 2HB ASP 38 21.992 -14.061 1.752 268 HB3 ASP 38 3HB ASP 38 23.496 -13.795 2.630 269 H ILE 39 H ILE 39 23.355 -9.999 2.958 270 HA ILE 39 HA ILE 39 24.197 -8.461 1.479 271 HB ILE 39 HB ILE 39 25.325 -10.882 0.084 272 HG12 ILE 39 2HG1 ILE 39 25.626 -11.159 2.501 273 HG13 ILE 39 3HG1 ILE 39 27.163 -10.815 1.716 274 HG21 ILE 39 1HG2 ILE 39 25.596 -8.271 -0.539 275 HG22 ILE 39 2HG2 ILE 39 26.945 -8.475 0.578 276 HG23 ILE 39 3HG2 ILE 39 26.828 -9.492 -0.858 277 HD11 ILE 39 3HD1 ILE 39 25.782 -8.430 2.661 278 HD12 ILE 39 1HD1 ILE 39 26.197 -9.569 3.941 279 HD13 ILE 39 2HD1 ILE 39 27.456 -8.939 2.878 280 H THR 40 H THR 40 21.688 -8.614 0.790 281 HA THR 40 HA THR 40 21.129 -9.594 -1.811 282 HB THR 40 HB THR 40 19.361 -7.468 -1.333 283 HG1 THR 40 HG1 THR 40 19.212 -7.279 0.767 284 HG21 THR 40 3HG2 THR 40 17.795 -9.333 -0.712 285 HG22 THR 40 1HG2 THR 40 19.173 -10.430 -0.790 286 HG23 THR 40 2HG2 THR 40 18.652 -9.565 -2.236 287 H ASP 41 H ASP 41 22.020 -6.394 -0.575 288 HA ASP 41 HA ASP 41 21.903 -5.154 -3.160 289 HB2 ASP 41 2HB ASP 41 23.233 -4.148 -0.636 290 HB3 ASP 41 3HB ASP 41 22.799 -3.188 -2.048 291 H GLN 42 H GLN 42 24.019 -7.313 -1.854 292 HA GLN 42 HA GLN 42 26.084 -8.054 -2.454 293 HB2 GLN 42 2HB GLN 42 26.021 -6.065 -4.717 294 HB3 GLN 42 3HB GLN 42 26.900 -7.586 -4.637 295 HG2 GLN 42 2HG GLN 42 24.590 -8.686 -4.485 296 HG3 GLN 42 3HG GLN 42 23.971 -7.132 -5.042 297 HE21 GLN 42 1HE2 GLN 42 23.761 -9.608 -6.414 298 HE22 GLN 42 2HE2 GLN 42 24.619 -9.453 -7.905 299 H VAL 43 H VAL 43 26.244 -6.463 -0.399 300 HA VAL 43 HA VAL 43 27.551 -4.043 -0.502 301 HB VAL 43 HB VAL 43 28.128 -6.182 1.549 302 HG11 VAL 43 1HG1 VAL 43 28.487 -4.273 3.047 303 HG12 VAL 43 2HG1 VAL 43 29.596 -4.245 1.675 304 HG13 VAL 43 3HG1 VAL 43 28.198 -3.170 1.703 305 HG21 VAL 43 3HG2 VAL 43 25.844 -6.138 1.693 306 HG22 VAL 43 1HG2 VAL 43 26.239 -4.785 2.754 307 HG23 VAL 43 2HG2 VAL 43 25.727 -4.483 1.094 308 H THR 44 H THR 44 29.598 -3.350 -0.819 309 HA THR 44 HA THR 44 31.517 -5.314 -1.823 310 HB THR 44 HB THR 44 31.777 -2.307 -1.902 311 HG1 THR 44 HG1 THR 44 30.587 -4.103 -3.766 312 HG21 THR 44 3HG2 THR 44 33.809 -2.815 -2.677 313 HG22 THR 44 1HG2 THR 44 33.013 -3.471 -4.106 314 HG23 THR 44 2HG2 THR 44 33.422 -4.533 -2.759 315 H TRP 45 H TRP 45 32.881 -6.139 -0.384 316 HA TRP 45 HA TRP 45 33.941 -4.366 1.718 317 HB2 TRP 45 2HB TRP 45 33.096 -7.229 1.770 318 HB3 TRP 45 3HB TRP 45 34.430 -6.733 2.808 319 HD1 TRP 45 HD1 TRP 45 30.718 -5.832 2.175 320 HE1 TRP 45 HE1 TRP 45 29.724 -4.957 4.382 321 HE3 TRP 45 HE3 TRP 45 34.954 -5.854 5.036 322 HZ2 TRP 45 HZ2 TRP 45 30.618 -4.356 6.991 323 HZ3 TRP 45 HZ3 TRP 45 34.799 -5.113 7.378 324 HH2 TRP 45 HH2 TRP 45 32.676 -4.380 8.333 325 H ASP 46 H ASP 46 36.065 -4.011 1.727 326 HA ASP 46 HA ASP 46 37.850 -5.942 0.435 327 HB2 ASP 46 2HB ASP 46 37.247 -3.253 -0.512 328 HB3 ASP 46 3HB ASP 46 38.969 -3.487 -0.221 329 H SER 47 H SER 47 39.871 -6.102 1.336 330 HA SER 47 HA SER 47 40.479 -4.307 3.587 331 HB2 SER 47 2HB SER 47 39.558 -6.491 4.395 332 HB3 SER 47 3HB SER 47 40.916 -7.302 3.616 333 HG SER 47 HG SER 47 40.929 -6.462 6.012 334 H SER 48 H SER 48 42.563 -3.665 3.763 335 HA SER 48 HA SER 48 44.861 -4.920 2.965 336 HB2 SER 48 2HB SER 48 44.591 -5.025 0.711 337 HB3 SER 48 3HB SER 48 43.394 -3.731 0.692 338 HG SER 48 HG SER 48 44.946 -2.269 0.491 339 H ASN 49 H ASN 49 46.656 -3.707 3.435 340 HA ASN 49 HA ASN 49 46.903 -0.945 3.355 341 HB2 ASN 49 2HB ASN 49 45.156 -1.690 5.406 342 HB3 ASN 49 3HB ASN 49 46.684 -1.360 6.219 343 HD21 ASN 49 1HD2 ASN 49 44.496 0.000 3.791 344 HD22 ASN 49 2HD2 ASN 49 44.737 1.649 4.246 345 H THR 50 H THR 50 47.704 -3.926 5.010 346 HA THR 50 HA THR 50 50.441 -2.942 5.456 347 HB THR 50 HB THR 50 49.014 -5.304 6.694 348 HG1 THR 50 HG1 THR 50 50.025 -3.011 8.020 349 HG21 THR 50 3HG2 THR 50 51.381 -4.647 8.090 350 HG22 THR 50 1HG2 THR 50 51.810 -4.780 6.385 351 HG23 THR 50 2HG2 THR 50 51.020 -6.128 7.204 352 H ASP 51 H ASP 51 49.132 -6.212 4.985 353 HA ASP 51 HA ASP 51 51.103 -6.590 2.826 354 HB2 ASP 51 2HB ASP 51 50.352 -8.295 5.141 355 HB3 ASP 51 3HB ASP 51 50.678 -9.118 3.618 356 H ILE 52 H ILE 52 48.404 -8.603 3.938 357 HA ILE 52 HA ILE 52 46.861 -8.022 1.557 358 HB ILE 52 HB ILE 52 46.679 -10.494 1.006 359 HG12 ILE 52 2HG1 ILE 52 49.240 -10.589 2.615 360 HG13 ILE 52 3HG1 ILE 52 47.714 -11.335 3.078 361 HG21 ILE 52 1HG2 ILE 52 49.465 -9.576 0.483 362 HG22 ILE 52 2HG2 ILE 52 48.294 -10.305 -0.614 363 HG23 ILE 52 3HG2 ILE 52 48.116 -8.619 -0.129 364 HD11 ILE 52 3HD1 ILE 52 49.264 -12.964 2.160 365 HD12 ILE 52 1HD1 ILE 52 47.837 -12.798 1.137 366 HD13 ILE 52 2HD1 ILE 52 49.357 -12.043 0.659 367 H LEU 53 H LEU 53 44.704 -8.504 1.774 368 HA LEU 53 HA LEU 53 43.751 -10.182 3.915 369 HB2 LEU 53 2HB LEU 53 43.532 -7.200 4.012 370 HB3 LEU 53 3HB LEU 53 42.282 -8.208 4.738 371 HG LEU 53 HG LEU 53 44.605 -9.234 5.805 372 HD11 LEU 53 1HD1 LEU 53 45.034 -6.440 5.038 373 HD12 LEU 53 2HD1 LEU 53 46.197 -7.696 5.463 374 HD13 LEU 53 3HD1 LEU 53 45.368 -6.795 6.733 375 HD21 LEU 53 3HD2 LEU 53 42.635 -8.946 7.089 376 HD22 LEU 53 1HD2 LEU 53 42.643 -7.200 6.839 377 HD23 LEU 53 2HD2 LEU 53 43.878 -7.952 7.849 378 H SER 54 H SER 54 41.890 -11.115 3.340 379 HA SER 54 HA SER 54 40.345 -9.878 1.155 380 HB2 SER 54 2HB SER 54 41.580 -12.445 1.272 381 HB3 SER 54 3HB SER 54 39.833 -12.683 1.277 382 HG SER 54 HG SER 54 41.484 -11.613 -0.691 383 H ILE 55 H ILE 55 38.141 -9.820 1.324 384 HA ILE 55 HA ILE 55 37.018 -10.731 3.893 385 HB ILE 55 HB ILE 55 35.986 -8.450 2.209 386 HG12 ILE 55 2HG1 ILE 55 38.229 -7.929 3.073 387 HG13 ILE 55 3HG1 ILE 55 36.998 -6.955 3.870 388 HG21 ILE 55 1HG2 ILE 55 34.206 -9.139 3.503 389 HG22 ILE 55 2HG2 ILE 55 35.236 -9.635 4.845 390 HG23 ILE 55 3HG2 ILE 55 34.951 -7.922 4.539 391 HD11 ILE 55 3HD1 ILE 55 38.450 -7.625 5.570 392 HD12 ILE 55 1HD1 ILE 55 37.056 -8.694 5.721 393 HD13 ILE 55 2HD1 ILE 55 38.537 -9.279 4.964 394 H SER 56 H SER 56 35.412 -12.162 3.830 395 HA SER 56 HA SER 56 34.122 -12.678 1.232 396 HB2 SER 56 2HB SER 56 34.107 -14.690 3.451 397 HB3 SER 56 3HB SER 56 34.060 -14.948 1.707 398 HG SER 56 HG SER 56 36.287 -14.153 3.273 399 H ASN 57 H ASN 57 31.985 -12.431 1.059 400 HA ASN 57 HA ASN 57 30.173 -12.797 3.228 401 HB2 ASN 57 2HB ASN 57 31.241 -10.492 3.642 402 HB3 ASN 57 3HB ASN 57 30.328 -9.958 2.233 403 HD21 ASN 57 1HD2 ASN 57 29.852 -8.728 4.553 404 HD22 ASN 57 2HD2 ASN 57 28.320 -9.196 5.201 405 H ALA 58 H ALA 58 29.247 -14.180 1.671 406 HA ALA 58 HA ALA 58 27.377 -12.836 -0.087 407 HB1 ALA 58 1HB ALA 58 29.579 -13.261 -1.354 408 HB2 ALA 58 2HB ALA 58 29.085 -14.954 -1.339 409 HB3 ALA 58 3HB ALA 58 28.063 -13.744 -2.115 410 H SER 59 H SER 59 28.737 -15.980 0.872 411 HA SER 59 HA SER 59 26.457 -17.513 0.274 412 HB2 SER 59 2HB SER 59 29.005 -17.915 1.621 413 HB3 SER 59 3HB SER 59 27.703 -18.814 2.400 414 HG SER 59 HG SER 59 28.973 -19.634 0.371 415 H ASP 60 H ASP 60 27.061 -15.286 2.773 416 HA ASP 60 HA ASP 60 24.508 -15.957 4.012 417 HB2 ASP 60 2HB ASP 60 26.743 -16.908 5.206 418 HB3 ASP 60 3HB ASP 60 26.651 -15.314 5.949 419 H SER 61 H SER 61 24.512 -14.202 6.096 420 HA SER 61 HA SER 61 24.650 -11.629 4.691 421 HB2 SER 61 2HB SER 61 22.797 -10.963 5.851 422 HB3 SER 61 3HB SER 61 22.539 -12.704 5.967 423 HG SER 61 HG SER 61 22.667 -12.457 8.038 424 H HIS 62 H HIS 62 25.995 -13.402 7.318 425 HA HIS 62 HA HIS 62 27.044 -11.080 8.684 426 HB2 HIS 62 2HB HIS 62 26.982 -13.997 9.151 427 HB3 HIS 62 3HB HIS 62 28.408 -13.164 9.763 428 HD1 HIS 62 HD1 HIS 62 27.640 -13.614 12.204 429 HD2 HIS 62 HD2 HIS 62 25.016 -11.284 9.980 430 HE1 HIS 62 HE1 HIS 62 26.052 -12.609 13.875 431 H GLY 63 H GLY 63 28.901 -10.089 8.239 432 HA2 GLY 63 2HA GLY 63 30.498 -10.772 6.031 433 HA3 GLY 63 3HA GLY 63 30.935 -9.621 7.285 434 H LEU 64 H LEU 64 32.968 -10.960 6.267 435 HA LEU 64 HA LEU 64 33.927 -12.487 8.502 436 HB2 LEU 64 2HB LEU 64 32.845 -14.302 7.450 437 HB3 LEU 64 3HB LEU 64 33.398 -13.801 5.853 438 HG LEU 64 HG LEU 64 35.611 -14.404 7.635 439 HD11 LEU 64 1HD1 LEU 64 34.924 -16.976 7.164 440 HD12 LEU 64 2HD1 LEU 64 33.346 -16.274 7.521 441 HD13 LEU 64 3HD1 LEU 64 34.656 -16.141 8.694 442 HD21 LEU 64 3HD2 LEU 64 36.524 -15.255 5.737 443 HD22 LEU 64 1HD2 LEU 64 35.286 -14.238 4.999 444 HD23 LEU 64 2HD2 LEU 64 35.006 -15.969 5.191 445 H ALA 65 H ALA 65 35.705 -11.262 8.746 446 HA ALA 65 HA ALA 65 37.314 -10.537 6.427 447 HB1 ALA 65 1HB ALA 65 37.029 -9.560 9.184 448 HB2 ALA 65 2HB ALA 65 38.669 -9.517 8.535 449 HB3 ALA 65 3HB ALA 65 37.366 -8.679 7.693 450 H SER 66 H SER 66 38.968 -11.732 5.774 451 HA SER 66 HA SER 66 40.310 -13.473 7.739 452 HB2 SER 66 2HB SER 66 39.069 -14.878 6.228 453 HB3 SER 66 3HB SER 66 39.694 -14.010 4.826 454 HG SER 66 HG SER 66 41.468 -15.255 6.616 455 H THR 67 H THR 67 42.315 -12.841 8.122 456 HA THR 67 HA THR 67 43.762 -11.340 6.052 457 HB THR 67 HB THR 67 43.476 -10.284 8.310 458 HG1 THR 67 HG1 THR 67 45.433 -9.382 8.119 459 HG21 THR 67 3HG2 THR 67 44.033 -11.344 10.192 460 HG22 THR 67 1HG2 THR 67 45.639 -11.722 9.571 461 HG23 THR 67 2HG2 THR 67 44.284 -12.797 9.226 462 H LEU 68 H LEU 68 46.006 -11.792 5.679 463 HA LEU 68 HA LEU 68 46.702 -14.604 6.215 464 HB2 LEU 68 2HB LEU 68 46.474 -13.250 3.791 465 HB3 LEU 68 3HB LEU 68 48.208 -13.374 4.076 466 HG LEU 68 HG LEU 68 46.252 -15.667 3.936 467 HD11 LEU 68 1HD1 LEU 68 47.345 -16.242 1.882 468 HD12 LEU 68 2HD1 LEU 68 48.505 -14.928 2.077 469 HD13 LEU 68 3HD1 LEU 68 46.805 -14.566 1.779 470 HD21 LEU 68 3HD2 LEU 68 48.337 -17.049 4.003 471 HD22 LEU 68 1HD2 LEU 68 47.944 -16.234 5.516 472 HD23 LEU 68 2HD2 LEU 68 49.215 -15.593 4.475 473 H ASN 69 H ASN 69 47.732 -11.299 6.410 474 HA ASN 69 HA ASN 69 50.206 -12.191 7.732 475 HB2 ASN 69 2HB ASN 69 49.869 -10.350 5.477 476 HB3 ASN 69 3HB ASN 69 50.823 -9.674 6.795 477 HD21 ASN 69 1HD2 ASN 69 50.509 -12.584 4.806 478 HD22 ASN 69 2HD2 ASN 69 52.200 -12.929 4.736 479 H GLN 70 H GLN 70 51.158 -10.289 9.058 480 HA GLN 70 HA GLN 70 49.054 -9.404 10.842 481 HB2 GLN 70 2HB GLN 70 50.829 -8.784 12.353 482 HB3 GLN 70 3HB GLN 70 51.166 -10.384 11.706 483 HG2 GLN 70 2HG GLN 70 52.718 -9.352 10.081 484 HG3 GLN 70 3HG GLN 70 52.438 -7.794 10.856 485 HE21 GLN 70 1HE2 GLN 70 54.319 -10.559 10.817 486 HE22 GLN 70 2HE2 GLN 70 55.139 -10.339 12.322 487 H GLY 71 H GLY 71 49.997 -7.072 11.882 488 HA2 GLY 71 2HA GLY 71 50.593 -4.835 11.311 489 HA3 GLY 71 3HA GLY 71 50.251 -5.207 9.628 490 H ASN 72 H ASN 72 49.179 -2.976 10.205 491 HA ASN 72 HA ASN 72 46.483 -3.385 11.272 492 HB2 ASN 72 2HB ASN 72 46.324 -0.971 11.392 493 HB3 ASN 72 3HB ASN 72 47.841 -1.481 12.127 494 HD21 ASN 72 1HD2 ASN 72 49.780 -1.039 11.084 495 HD22 ASN 72 2HD2 ASN 72 49.892 0.125 9.812 496 H VAL 73 H VAL 73 44.697 -3.329 10.036 497 HA VAL 73 HA VAL 73 44.951 -2.440 7.244 498 HB VAL 73 HB VAL 73 45.071 -4.902 7.295 499 HG11 VAL 73 1HG1 VAL 73 43.091 -4.638 9.274 500 HG12 VAL 73 2HG1 VAL 73 42.334 -5.472 7.916 501 HG13 VAL 73 3HG1 VAL 73 43.801 -6.125 8.645 502 HG21 VAL 73 3HG2 VAL 73 42.420 -4.029 6.169 503 HG22 VAL 73 1HG2 VAL 73 43.966 -3.599 5.438 504 HG23 VAL 73 2HG2 VAL 73 43.493 -5.293 5.569 505 H LYS 74 H LYS 74 43.183 -1.418 6.388 506 HA LYS 74 HA LYS 74 40.909 -1.000 8.217 507 HB2 LYS 74 2HB LYS 74 41.668 0.998 6.117 508 HB3 LYS 74 3HB LYS 74 40.782 1.246 7.616 509 HG2 LYS 74 2HG LYS 74 43.730 0.681 7.380 510 HG3 LYS 74 3HG LYS 74 42.992 2.247 7.724 511 HD2 LYS 74 2HD LYS 74 42.614 -0.195 9.451 512 HD3 LYS 74 3HD LYS 74 43.866 1.018 9.732 513 HE2 LYS 74 2HE LYS 74 40.883 1.468 9.727 514 HE3 LYS 74 3HE LYS 74 41.945 1.470 11.134 515 HZ1 LYS 74 3HZ LYS 74 42.012 3.663 10.787 516 HZ2 LYS 74 1HZ LYS 74 41.462 3.545 9.191 517 HZ3 LYS 74 2HZ LYS 74 43.099 3.306 9.541 518 H VAL 75 H VAL 75 39.134 -1.962 7.503 519 HA VAL 75 HA VAL 75 38.788 -2.390 4.623 520 HB VAL 75 HB VAL 75 37.140 -4.050 5.170 521 HG11 VAL 75 1HG1 VAL 75 38.558 -5.669 5.942 522 HG12 VAL 75 2HG1 VAL 75 39.726 -4.404 5.554 523 HG13 VAL 75 3HG1 VAL 75 39.208 -4.646 7.222 524 HG21 VAL 75 3HG2 VAL 75 36.709 -4.570 7.622 525 HG22 VAL 75 1HG2 VAL 75 37.406 -2.987 7.969 526 HG23 VAL 75 2HG2 VAL 75 35.953 -3.113 6.977 527 H THR 76 H THR 76 37.147 -1.511 3.478 528 HA THR 76 HA THR 76 35.194 0.140 4.942 529 HB THR 76 HB THR 76 35.890 1.015 2.207 530 HG1 THR 76 HG1 THR 76 37.934 0.438 3.412 531 HG21 THR 76 3HG2 THR 76 35.274 3.079 2.984 532 HG22 THR 76 1HG2 THR 76 35.892 2.775 4.607 533 HG23 THR 76 2HG2 THR 76 34.360 2.063 4.099 534 H ALA 77 H ALA 77 33.100 0.013 4.296 535 HA ALA 77 HA ALA 77 32.429 -1.295 1.782 536 HB1 ALA 77 1HB ALA 77 30.856 -2.852 2.933 537 HB2 ALA 77 2HB ALA 77 32.561 -3.191 3.232 538 HB3 ALA 77 3HB ALA 77 31.594 -2.382 4.465 539 H SER 78 H SER 78 30.256 -0.956 1.117 540 HA SER 78 HA SER 78 28.613 0.831 2.732 541 HB2 SER 78 2HB SER 78 30.118 2.260 1.303 542 HB3 SER 78 3HB SER 78 29.343 1.552 -0.113 543 HG SER 78 HG SER 78 27.441 2.502 0.446 544 H ILE 79 H ILE 79 26.454 0.593 2.388 545 HA ILE 79 HA ILE 79 25.579 -1.021 0.099 546 HB ILE 79 HB ILE 79 25.723 -2.633 1.860 547 HG12 ILE 79 2HG1 ILE 79 22.817 -1.837 1.824 548 HG13 ILE 79 3HG1 ILE 79 23.617 -2.482 0.395 549 HG21 ILE 79 1HG2 ILE 79 25.775 -0.981 3.715 550 HG22 ILE 79 2HG2 ILE 79 24.027 -0.818 3.564 551 HG23 ILE 79 3HG2 ILE 79 24.730 -2.367 4.029 552 HD11 ILE 79 3HD1 ILE 79 22.302 -4.016 2.098 553 HD12 ILE 79 1HD1 ILE 79 23.738 -4.579 1.244 554 HD13 ILE 79 2HD1 ILE 79 23.866 -4.020 2.912 555 H GLY 80 H GLY 80 24.030 0.021 -0.956 556 HA2 GLY 80 2HA GLY 80 22.328 1.491 -1.425 557 HA3 GLY 80 3HA GLY 80 21.656 0.961 0.110 558 H GLY 81 H GLY 81 21.645 2.333 1.813 559 HA2 GLY 81 2HA GLY 81 22.868 4.980 1.348 560 HA3 GLY 81 3HA GLY 81 21.403 4.712 2.281 561 H ILE 82 H ILE 82 22.911 2.235 3.381 562 HA ILE 82 HA ILE 82 24.275 3.733 5.511 563 HB ILE 82 HB ILE 82 22.980 1.012 5.506 564 HG12 ILE 82 2HG1 ILE 82 21.788 2.124 7.498 565 HG13 ILE 82 3HG1 ILE 82 22.451 3.637 6.888 566 HG21 ILE 82 1HG2 ILE 82 24.964 2.193 7.389 567 HG22 ILE 82 2HG2 ILE 82 23.676 1.173 8.027 568 HG23 ILE 82 3HG2 ILE 82 24.796 0.531 6.826 569 HD11 ILE 82 3HD1 ILE 82 21.005 3.728 5.177 570 HD12 ILE 82 1HD1 ILE 82 21.049 1.986 4.905 571 HD13 ILE 82 2HD1 ILE 82 20.049 2.652 6.196 572 H GLN 83 H GLN 83 26.321 3.171 6.201 573 HA GLN 83 HA GLN 83 27.710 0.983 4.868 574 HB2 GLN 83 2HB GLN 83 29.645 2.546 4.369 575 HB3 GLN 83 3HB GLN 83 28.227 2.718 3.344 576 HG2 GLN 83 2HG GLN 83 27.522 4.668 4.571 577 HG3 GLN 83 3HG GLN 83 28.851 4.467 5.711 578 HE21 GLN 83 1HE2 GLN 83 28.325 6.785 4.175 579 HE22 GLN 83 2HE2 GLN 83 29.667 7.030 3.115 580 H GLY 84 H GLY 84 29.874 0.583 5.821 581 HA2 GLY 84 2HA GLY 84 30.391 1.782 8.414 582 HA3 GLY 84 3HA GLY 84 29.907 0.093 8.457 583 H SER 85 H SER 85 32.375 1.005 9.410 584 HA SER 85 HA SER 85 34.157 -0.522 7.677 585 HB2 SER 85 2HB SER 85 35.731 1.631 8.598 586 HB3 SER 85 3HB SER 85 35.263 1.279 6.935 587 HG SER 85 HG SER 85 34.643 3.396 7.679 588 H THR 86 H THR 86 35.566 -1.761 8.783 589 HA THR 86 HA THR 86 35.648 -1.410 11.708 590 HB THR 86 HB THR 86 35.881 -3.750 11.984 591 HG1 THR 86 HG1 THR 86 37.254 -4.393 10.397 592 HG21 THR 86 3HG2 THR 86 33.993 -4.139 9.819 593 HG22 THR 86 1HG2 THR 86 33.656 -2.663 10.722 594 HG23 THR 86 2HG2 THR 86 33.736 -4.213 11.562 595 H ASP 87 H ASP 87 37.626 -1.887 12.800 596 HA ASP 87 HA ASP 87 39.995 -1.508 11.092 597 HB2 ASP 87 2HB ASP 87 39.431 0.331 12.722 598 HB3 ASP 87 3HB ASP 87 39.748 -0.814 14.022 599 H PHE 88 H PHE 88 41.451 -3.085 11.022 600 HA PHE 88 HA PHE 88 41.448 -5.087 13.184 601 HB2 PHE 88 2HB PHE 88 41.335 -5.414 10.244 602 HB3 PHE 88 3HB PHE 88 42.415 -6.510 11.100 603 HD1 PHE 88 HD1 PHE 88 41.155 -7.279 13.474 604 HD2 PHE 88 HD2 PHE 88 39.339 -6.398 9.726 605 HE1 PHE 88 HE1 PHE 88 39.238 -8.701 14.072 606 HE2 PHE 88 HE2 PHE 88 37.419 -7.818 10.319 607 HZ PHE 88 HZ PHE 88 37.367 -8.971 12.494 608 H LYS 89 H LYS 89 43.255 -4.926 14.322 609 HA LYS 89 HA LYS 89 45.763 -4.318 12.897 610 HB2 LYS 89 2HB LYS 89 44.740 -3.403 15.564 611 HB3 LYS 89 3HB LYS 89 46.472 -3.507 15.278 612 HG2 LYS 89 2HG LYS 89 45.592 -2.145 13.071 613 HG3 LYS 89 3HG LYS 89 44.532 -1.543 14.348 614 HD2 LYS 89 2HD LYS 89 46.557 -1.083 15.723 615 HD3 LYS 89 3HD LYS 89 47.550 -1.543 14.338 616 HE2 LYS 89 2HE LYS 89 45.797 0.279 13.260 617 HE3 LYS 89 3HE LYS 89 46.096 0.932 14.870 618 HZ1 LYS 89 3HZ LYS 89 48.541 0.108 13.789 619 HZ2 LYS 89 1HZ LYS 89 48.039 1.679 14.163 620 HZ3 LYS 89 2HZ LYS 89 47.755 1.045 12.621 621 H VAL 90 H VAL 90 47.002 -6.062 12.768 622 HA VAL 90 HA VAL 90 46.770 -8.174 14.768 623 HB VAL 90 HB VAL 90 48.324 -8.107 12.178 624 HG11 VAL 90 1HG1 VAL 90 48.574 -10.525 12.502 625 HG12 VAL 90 2HG1 VAL 90 49.346 -9.610 13.799 626 HG13 VAL 90 3HG1 VAL 90 47.788 -10.391 14.074 627 HG21 VAL 90 3HG2 VAL 90 45.640 -9.239 12.921 628 HG22 VAL 90 1HG2 VAL 90 46.033 -8.104 11.629 629 HG23 VAL 90 2HG2 VAL 90 46.541 -9.789 11.508 630 H THR 91 H THR 91 48.158 -8.394 16.387 631 HA THR 91 HA THR 91 50.869 -7.289 16.103 632 HB THR 91 HB THR 91 50.752 -6.635 18.540 633 HG1 THR 91 HG1 THR 91 48.065 -7.352 18.070 634 HG21 THR 91 3HG2 THR 91 50.014 -4.498 18.048 635 HG22 THR 91 1HG2 THR 91 48.707 -5.073 17.015 636 HG23 THR 91 2HG2 THR 91 50.373 -5.128 16.441 637 H GLN 92 H GLN 92 52.497 -8.457 17.050 638 HA GLN 92 HA GLN 92 51.916 -11.198 17.664 639 HB2 GLN 92 2HB GLN 92 53.921 -10.648 16.414 640 HB3 GLN 92 3HB GLN 92 54.503 -9.639 17.732 641 HG2 GLN 92 2HG GLN 92 53.934 -12.513 18.256 642 HG3 GLN 92 3HG GLN 92 55.406 -12.067 17.394 643 HE21 GLN 92 1HE2 GLN 92 54.015 -12.531 20.385 644 HE22 GLN 92 2HE2 GLN 92 55.214 -11.760 21.361 Start of MODEL 17 1 H1 MET 1 H MET 1 3.171 -3.804 -2.016 2 HA MET 1 HA MET 1 4.923 -4.131 -4.346 3 HB2 MET 1 2HB MET 1 3.971 -1.684 -2.858 4 HB3 MET 1 3HB MET 1 5.209 -1.627 -4.106 5 HG2 MET 1 2HG MET 1 3.339 -2.910 -5.480 6 HG3 MET 1 3HG MET 1 2.292 -2.068 -4.339 7 HE1 MET 1 3HE MET 1 1.650 -0.121 -7.368 8 HE2 MET 1 1HE MET 1 2.911 -1.138 -8.064 9 HE3 MET 1 2HE MET 1 1.739 -1.831 -6.943 10 HA PRO 2 HA PRO 2 7.742 -4.559 -0.659 11 HB2 PRO 2 2HB PRO 2 9.062 -6.732 -1.610 12 HB3 PRO 2 3HB PRO 2 7.572 -6.850 -0.666 13 HG2 PRO 2 2HG PRO 2 7.953 -7.000 -3.631 14 HG3 PRO 2 3HG PRO 2 6.930 -7.999 -2.583 15 HD2 PRO 2 2HD PRO 2 5.944 -5.959 -4.065 16 HD3 PRO 2 3HD PRO 2 5.259 -6.415 -2.492 17 H ALA 3 H ALA 3 10.043 -4.275 -0.602 18 HA ALA 3 HA ALA 3 11.661 -4.070 -2.901 19 HB1 ALA 3 1HB ALA 3 9.997 -1.793 -2.390 20 HB2 ALA 3 2HB ALA 3 11.694 -1.353 -2.196 21 HB3 ALA 3 3HB ALA 3 11.137 -2.070 -3.707 22 H ALA 4 H ALA 4 13.807 -3.195 -2.422 23 HA ALA 4 HA ALA 4 14.381 -3.009 0.458 24 HB1 ALA 4 1HB ALA 4 15.583 -4.861 -1.550 25 HB2 ALA 4 2HB ALA 4 16.562 -4.282 -0.202 26 HB3 ALA 4 3HB ALA 4 15.074 -5.176 0.109 27 H LEU 5 H LEU 5 15.052 -0.971 0.704 28 HA LEU 5 HA LEU 5 17.505 -0.070 -0.266 29 HB2 LEU 5 2HB LEU 5 15.602 0.102 -2.237 30 HB3 LEU 5 3HB LEU 5 15.577 1.718 -1.535 31 HG LEU 5 HG LEU 5 18.222 1.428 -1.865 32 HD11 LEU 5 1HD1 LEU 5 18.431 0.430 -4.219 33 HD12 LEU 5 2HD1 LEU 5 16.914 -0.391 -3.855 34 HD13 LEU 5 3HD1 LEU 5 18.335 -0.679 -2.851 35 HD21 LEU 5 3HD2 LEU 5 17.962 2.702 -3.948 36 HD22 LEU 5 1HD2 LEU 5 16.884 3.284 -2.679 37 HD23 LEU 5 2HD2 LEU 5 16.249 2.281 -3.983 38 H VAL 6 H VAL 6 15.955 -0.147 2.148 39 HA VAL 6 HA VAL 6 15.382 2.662 2.725 40 HB VAL 6 HB VAL 6 14.982 0.201 4.432 41 HG11 VAL 6 1HG1 VAL 6 13.391 2.272 5.386 42 HG12 VAL 6 2HG1 VAL 6 14.845 1.618 6.143 43 HG13 VAL 6 3HG1 VAL 6 14.958 3.018 5.075 44 HG21 VAL 6 3HG2 VAL 6 12.534 0.842 4.014 45 HG22 VAL 6 1HG2 VAL 6 13.156 1.807 2.675 46 HG23 VAL 6 2HG2 VAL 6 13.415 0.063 2.700 47 H SER 7 H SER 7 16.907 0.120 4.694 48 HA SER 7 HA SER 7 19.438 1.367 4.852 49 HB2 SER 7 2HB SER 7 19.155 1.931 7.381 50 HB3 SER 7 3HB SER 7 18.587 3.089 6.179 51 HG SER 7 HG SER 7 17.095 1.324 7.790 52 H ILE 8 H ILE 8 20.785 0.392 6.642 53 HA ILE 8 HA ILE 8 19.782 -2.222 7.513 54 HB ILE 8 HB ILE 8 21.773 -3.375 6.807 55 HG12 ILE 8 2HG1 ILE 8 23.020 -1.497 5.072 56 HG13 ILE 8 3HG1 ILE 8 22.847 -0.729 6.647 57 HG21 ILE 8 1HG2 ILE 8 19.801 -2.697 5.172 58 HG22 ILE 8 2HG2 ILE 8 21.118 -1.888 4.324 59 HG23 ILE 8 3HG2 ILE 8 21.195 -3.625 4.618 60 HD11 ILE 8 3HD1 ILE 8 24.076 -3.441 6.241 61 HD12 ILE 8 1HD1 ILE 8 24.996 -1.937 6.289 62 HD13 ILE 8 2HD1 ILE 8 24.084 -2.460 7.706 63 H SER 9 H SER 9 20.841 -3.096 9.335 64 HA SER 9 HA SER 9 22.284 -1.082 10.914 65 HB2 SER 9 2HB SER 9 20.335 -3.209 11.568 66 HB3 SER 9 3HB SER 9 21.652 -3.003 12.722 67 HG SER 9 HG SER 9 20.980 -0.995 13.163 68 H VAL 10 H VAL 10 24.417 -1.313 10.829 69 HA VAL 10 HA VAL 10 25.551 -4.025 10.708 70 HB VAL 10 HB VAL 10 26.217 -2.533 8.871 71 HG11 VAL 10 1HG1 VAL 10 27.934 -0.854 10.564 72 HG12 VAL 10 2HG1 VAL 10 26.992 -0.437 9.132 73 HG13 VAL 10 3HG1 VAL 10 26.205 -0.540 10.707 74 HG21 VAL 10 3HG2 VAL 10 28.239 -3.487 8.807 75 HG22 VAL 10 1HG2 VAL 10 28.771 -2.658 10.270 76 HG23 VAL 10 2HG2 VAL 10 27.839 -4.151 10.391 77 H SER 11 H SER 11 26.824 -4.781 12.301 78 HA SER 11 HA SER 11 27.398 -2.960 14.545 79 HB2 SER 11 2HB SER 11 27.045 -5.966 14.634 80 HB3 SER 11 3HB SER 11 27.299 -4.902 16.018 81 HG SER 11 HG SER 11 25.303 -3.941 15.585 82 HA PRO 12 HA PRO 12 31.477 -4.226 12.729 83 HB2 PRO 12 2HB PRO 12 32.571 -1.745 12.871 84 HB3 PRO 12 3HB PRO 12 31.606 -2.292 11.495 85 HG2 PRO 12 2HG PRO 12 30.793 -0.596 13.824 86 HG3 PRO 12 3HG PRO 12 30.403 -0.397 12.105 87 HD2 PRO 12 2HD PRO 12 28.664 -1.476 13.878 88 HD3 PRO 12 3HD PRO 12 28.723 -1.973 12.175 89 H THR 13 H THR 13 33.206 -4.814 13.928 90 HA THR 13 HA THR 13 33.354 -3.791 16.689 91 HB THR 13 HB THR 13 34.427 -5.958 17.282 92 HG1 THR 13 HG1 THR 13 34.564 -7.563 15.801 93 HG21 THR 13 3HG2 THR 13 31.700 -6.285 16.027 94 HG22 THR 13 1HG2 THR 13 31.997 -5.556 17.605 95 HG23 THR 13 2HG2 THR 13 32.387 -7.254 17.330 96 H ASN 14 H ASN 14 35.015 -2.454 16.937 97 HA ASN 14 HA ASN 14 37.407 -2.804 15.285 98 HB2 ASN 14 2HB ASN 14 36.449 -0.503 16.996 99 HB3 ASN 14 3HB ASN 14 38.014 -0.529 16.188 100 HD21 ASN 14 1HD2 ASN 14 37.616 1.170 14.843 101 HD22 ASN 14 2HD2 ASN 14 36.461 1.117 13.559 102 H SER 15 H SER 15 39.224 -3.625 16.084 103 HA SER 15 HA SER 15 40.213 -3.177 18.676 104 HB2 SER 15 2HB SER 15 38.203 -5.121 18.649 105 HB3 SER 15 3HB SER 15 39.710 -6.035 18.702 106 HG SER 15 HG SER 15 40.280 -4.504 20.465 107 H THR 16 H THR 16 41.844 -5.221 19.170 108 HA THR 16 HA THR 16 43.463 -5.389 16.723 109 HB THR 16 HB THR 16 45.395 -5.703 18.123 110 HG1 THR 16 HG1 THR 16 43.522 -5.795 20.270 111 HG21 THR 16 3HG2 THR 16 44.339 -3.604 19.802 112 HG22 THR 16 1HG2 THR 16 43.833 -3.388 18.127 113 HG23 THR 16 2HG2 THR 16 45.547 -3.513 18.521 114 H VAL 17 H VAL 17 44.526 -7.347 16.179 115 HA VAL 17 HA VAL 17 43.503 -9.769 17.489 116 HB VAL 17 HB VAL 17 43.687 -9.528 14.490 117 HG11 VAL 17 1HG1 VAL 17 42.099 -11.530 14.720 118 HG12 VAL 17 2HG1 VAL 17 43.805 -11.784 15.090 119 HG13 VAL 17 3HG1 VAL 17 42.638 -11.592 16.398 120 HG21 VAL 17 3HG2 VAL 17 41.964 -8.033 14.953 121 HG22 VAL 17 1HG2 VAL 17 41.115 -9.557 14.696 122 HG23 VAL 17 2HG2 VAL 17 41.392 -8.967 16.335 123 H ALA 18 H ALA 18 44.804 -11.655 17.178 124 HA ALA 18 HA ALA 18 47.598 -11.101 17.193 125 HB1 ALA 18 1HB ALA 18 47.807 -13.140 18.104 126 HB2 ALA 18 2HB ALA 18 46.048 -13.082 18.226 127 HB3 ALA 18 3HB ALA 18 46.810 -13.906 16.866 128 H LYS 19 H LYS 19 49.122 -12.514 15.854 129 HA LYS 19 HA LYS 19 48.947 -11.788 13.171 130 HB2 LYS 19 2HB LYS 19 50.799 -13.418 12.815 131 HB3 LYS 19 3HB LYS 19 51.079 -12.311 14.153 132 HG2 LYS 19 2HG LYS 19 50.237 -14.128 15.681 133 HG3 LYS 19 3HG LYS 19 50.296 -15.209 14.287 134 HD2 LYS 19 2HD LYS 19 52.692 -13.590 15.074 135 HD3 LYS 19 3HD LYS 19 52.327 -15.113 15.887 136 HE2 LYS 19 2HE LYS 19 52.109 -15.447 13.048 137 HE3 LYS 19 3HE LYS 19 53.671 -14.732 13.445 138 HZ1 LYS 19 3HZ LYS 19 54.341 -16.758 13.988 139 HZ2 LYS 19 1HZ LYS 19 52.785 -17.399 13.809 140 HZ3 LYS 19 2HZ LYS 19 53.263 -16.740 15.292 141 H GLY 20 H GLY 20 47.767 -12.544 11.544 142 HA2 GLY 20 2HA GLY 20 46.496 -13.945 10.244 143 HA3 GLY 20 3HA GLY 20 47.392 -15.272 10.968 144 H LEU 21 H LEU 21 44.416 -13.629 10.815 145 HA LEU 21 HA LEU 21 43.103 -15.648 12.344 146 HB2 LEU 21 2HB LEU 21 44.065 -13.455 13.789 147 HB3 LEU 21 3HB LEU 21 42.338 -13.166 13.592 148 HG LEU 21 HG LEU 21 42.897 -15.883 14.449 149 HD11 LEU 21 1HD1 LEU 21 44.782 -14.349 15.467 150 HD12 LEU 21 2HD1 LEU 21 43.971 -15.576 16.439 151 HD13 LEU 21 3HD1 LEU 21 43.486 -13.886 16.570 152 HD21 LEU 21 3HD2 LEU 21 40.714 -15.231 14.731 153 HD22 LEU 21 1HD2 LEU 21 41.150 -13.593 15.218 154 HD23 LEU 21 2HD2 LEU 21 41.358 -14.933 16.346 155 H GLN 22 H GLN 22 40.710 -15.144 12.552 156 HA GLN 22 HA GLN 22 39.774 -13.296 10.479 157 HB2 GLN 22 2HB GLN 22 38.122 -15.120 9.786 158 HB3 GLN 22 3HB GLN 22 39.788 -15.302 9.253 159 HG2 GLN 22 2HG GLN 22 38.995 -17.425 9.983 160 HG3 GLN 22 3HG GLN 22 40.173 -16.841 11.156 161 HE21 GLN 22 1HE2 GLN 22 36.687 -16.456 10.589 162 HE22 GLN 22 2HE2 GLN 22 36.214 -16.790 12.217 163 H GLU 23 H GLU 23 37.592 -12.623 10.710 164 HA GLU 23 HA GLU 23 36.242 -13.390 13.191 165 HB2 GLU 23 2HB GLU 23 37.728 -11.214 13.323 166 HB3 GLU 23 3HB GLU 23 36.355 -10.485 12.501 167 HG2 GLU 23 2HG GLU 23 35.819 -10.089 14.685 168 HG3 GLU 23 3HG GLU 23 34.979 -11.614 14.407 169 H ASN 24 H ASN 24 34.007 -13.146 13.163 170 HA ASN 24 HA ASN 24 32.866 -12.510 10.522 171 HB2 ASN 24 2HB ASN 24 31.001 -14.055 11.178 172 HB3 ASN 24 3HB ASN 24 32.563 -14.848 10.993 173 HD21 ASN 24 1HD2 ASN 24 30.095 -13.854 13.210 174 HD22 ASN 24 2HD2 ASN 24 30.671 -14.746 14.573 175 H PHE 25 H PHE 25 31.128 -11.158 10.388 176 HA PHE 25 HA PHE 25 30.264 -9.894 12.905 177 HB2 PHE 25 2HB PHE 25 30.217 -8.591 10.183 178 HB3 PHE 25 3HB PHE 25 30.015 -7.820 11.752 179 HD1 PHE 25 HD2 PHE 25 32.241 -8.966 13.277 180 HD2 PHE 25 HD1 PHE 25 32.084 -7.590 9.252 181 HE1 PHE 25 HE2 PHE 25 34.652 -8.485 13.351 182 HE2 PHE 25 HE1 PHE 25 34.495 -7.108 9.319 183 HZ PHE 25 HZ PHE 25 35.783 -7.554 11.371 184 H LYS 26 H LYS 26 28.123 -8.461 12.043 185 HA LYS 26 HA LYS 26 26.309 -10.294 10.677 186 HB2 LYS 26 2HB LYS 26 26.399 -10.185 13.460 187 HB3 LYS 26 3HB LYS 26 25.030 -9.168 13.032 188 HG2 LYS 26 2HG LYS 26 24.400 -11.196 11.498 189 HG3 LYS 26 3HG LYS 26 25.428 -12.088 12.620 190 HD2 LYS 26 2HD LYS 26 23.997 -10.827 14.428 191 HD3 LYS 26 3HD LYS 26 22.833 -10.699 13.107 192 HE2 LYS 26 2HE LYS 26 22.731 -13.070 12.871 193 HE3 LYS 26 3HE LYS 26 24.092 -13.297 13.968 194 HZ1 LYS 26 3HZ LYS 26 21.304 -12.624 14.581 195 HZ2 LYS 26 1HZ LYS 26 22.517 -12.061 15.617 196 HZ3 LYS 26 2HZ LYS 26 22.340 -13.721 15.347 197 H ALA 27 H ALA 27 25.035 -9.225 9.313 198 HA ALA 27 HA ALA 27 24.348 -6.430 9.886 199 HB1 ALA 27 1HB ALA 27 26.238 -6.303 8.397 200 HB2 ALA 27 2HB ALA 27 25.478 -7.436 7.278 201 HB3 ALA 27 3HB ALA 27 24.778 -5.836 7.524 202 H THR 28 H THR 28 22.212 -6.282 9.904 203 HA THR 28 HA THR 28 20.664 -7.964 8.041 204 HB THR 28 HB THR 28 19.376 -6.858 10.493 205 HG1 THR 28 HG1 THR 28 20.391 -8.200 11.811 206 HG21 THR 28 3HG2 THR 28 18.953 -9.647 9.725 207 HG22 THR 28 1HG2 THR 28 18.564 -8.498 8.446 208 HG23 THR 28 2HG2 THR 28 17.780 -8.364 10.020 209 H GLY 29 H GLY 29 19.663 -6.869 6.491 210 HA2 GLY 29 2HA GLY 29 19.386 -3.987 6.691 211 HA3 GLY 29 3HA GLY 29 19.049 -4.973 5.277 212 H ILE 30 H ILE 30 17.565 -2.861 7.015 213 HA ILE 30 HA ILE 30 15.101 -4.396 7.465 214 HB ILE 30 HB ILE 30 15.776 -1.598 8.380 215 HG12 ILE 30 2HG1 ILE 30 15.399 -3.494 10.502 216 HG13 ILE 30 3HG1 ILE 30 16.621 -4.104 9.392 217 HG21 ILE 30 1HG2 ILE 30 13.782 -1.951 9.861 218 HG22 ILE 30 2HG2 ILE 30 13.418 -1.801 8.142 219 HG23 ILE 30 3HG2 ILE 30 13.416 -3.389 8.909 220 HD11 ILE 30 3HD1 ILE 30 16.746 -1.910 11.299 221 HD12 ILE 30 1HD1 ILE 30 18.040 -2.863 10.574 222 HD13 ILE 30 2HD1 ILE 30 17.360 -1.491 9.700 223 H PHE 31 H PHE 31 13.850 -4.447 5.713 224 HA PHE 31 HA PHE 31 13.305 -1.907 4.334 225 HB2 PHE 31 2HB PHE 31 13.406 -4.532 2.863 226 HB3 PHE 31 3HB PHE 31 13.418 -2.903 2.197 227 HD1 PHE 31 HD2 PHE 31 15.494 -1.516 3.544 228 HD2 PHE 31 HD1 PHE 31 15.367 -5.605 2.370 229 HE1 PHE 31 HE2 PHE 31 17.952 -1.567 3.467 230 HE2 PHE 31 HE1 PHE 31 17.826 -5.663 2.292 231 HZ PHE 31 HZ PHE 31 19.121 -3.641 2.839 232 H THR 32 H THR 32 11.304 -2.290 2.806 233 HA THR 32 HA THR 32 9.099 -2.810 4.483 234 HB THR 32 HB THR 32 8.497 -2.980 1.625 235 HG1 THR 32 HG1 THR 32 10.227 -1.672 1.267 236 HG21 THR 32 3HG2 THR 32 7.751 -0.797 3.552 237 HG22 THR 32 1HG2 THR 32 6.982 -2.383 3.607 238 HG23 THR 32 2HG2 THR 32 6.853 -1.390 2.155 239 H ASP 33 H ASP 33 11.109 -4.921 2.800 240 HA ASP 33 HA ASP 33 9.113 -6.954 2.294 241 HB2 ASP 33 2HB ASP 33 11.130 -8.341 1.670 242 HB3 ASP 33 3HB ASP 33 10.913 -6.868 0.728 243 H ASN 34 H ASN 34 9.709 -5.927 5.061 244 HA ASN 34 HA ASN 34 9.664 -6.795 7.166 245 HB2 ASN 34 2HB ASN 34 9.804 -9.591 6.088 246 HB3 ASN 34 3HB ASN 34 8.949 -8.989 7.505 247 HD21 ASN 34 1HD2 ASN 34 7.148 -7.454 7.030 248 HD22 ASN 34 2HD2 ASN 34 6.153 -7.802 5.661 249 H SER 35 H SER 35 12.056 -5.944 6.332 250 HA SER 35 HA SER 35 14.302 -6.075 6.679 251 HB2 SER 35 2HB SER 35 13.712 -8.255 8.681 252 HB3 SER 35 3HB SER 35 15.027 -7.080 8.704 253 HG SER 35 HG SER 35 13.747 -5.881 9.843 254 H ASN 36 H ASN 36 15.053 -6.870 4.761 255 HA ASN 36 HA ASN 36 15.075 -9.750 4.311 256 HB2 ASN 36 2HB ASN 36 14.879 -7.521 2.624 257 HB3 ASN 36 3HB ASN 36 16.471 -8.201 2.302 258 HD21 ASN 36 1HD2 ASN 36 14.381 -8.151 0.449 259 HD22 ASN 36 2HD2 ASN 36 13.910 -9.779 0.113 260 H SER 37 H SER 37 17.143 -10.689 3.401 261 HA SER 37 HA SER 37 19.273 -10.143 5.278 262 HB2 SER 37 2HB SER 37 20.306 -12.074 3.705 263 HB3 SER 37 3HB SER 37 19.203 -12.410 5.039 264 HG SER 37 HG SER 37 18.698 -12.366 2.275 265 H ASP 38 H ASP 38 21.257 -9.302 4.838 266 HA ASP 38 HA ASP 38 21.528 -7.548 2.648 267 HB2 ASP 38 2HB ASP 38 23.449 -8.572 4.726 268 HB3 ASP 38 3HB ASP 38 23.988 -7.505 3.432 269 H ILE 39 H ILE 39 21.590 -8.313 0.624 270 HA ILE 39 HA ILE 39 23.866 -9.619 -0.371 271 HB ILE 39 HB ILE 39 22.970 -11.615 0.692 272 HG12 ILE 39 2HG1 ILE 39 22.782 -11.524 -2.318 273 HG13 ILE 39 3HG1 ILE 39 24.145 -12.044 -1.334 274 HG21 ILE 39 1HG2 ILE 39 20.822 -12.361 0.534 275 HG22 ILE 39 2HG2 ILE 39 20.535 -10.630 0.359 276 HG23 ILE 39 3HG2 ILE 39 20.580 -11.665 -1.068 277 HD11 ILE 39 3HD1 ILE 39 22.724 -13.943 -0.539 278 HD12 ILE 39 1HD1 ILE 39 21.534 -13.467 -1.750 279 HD13 ILE 39 2HD1 ILE 39 23.145 -13.982 -2.252 280 H THR 40 H THR 40 20.396 -9.101 -0.833 281 HA THR 40 HA THR 40 20.246 -9.269 -3.593 282 HB THR 40 HB THR 40 18.726 -7.289 -1.887 283 HG1 THR 40 HG1 THR 40 18.471 -10.070 -2.264 284 HG21 THR 40 3HG2 THR 40 18.405 -8.364 -4.651 285 HG22 THR 40 1HG2 THR 40 18.149 -6.729 -4.043 286 HG23 THR 40 2HG2 THR 40 16.961 -7.990 -3.711 287 H ASP 41 H ASP 41 21.577 -6.750 -1.595 288 HA ASP 41 HA ASP 41 21.832 -4.936 -3.871 289 HB2 ASP 41 2HB ASP 41 21.851 -4.655 -0.951 290 HB3 ASP 41 3HB ASP 41 23.091 -3.701 -1.762 291 H GLN 42 H GLN 42 23.614 -7.303 -2.200 292 HA GLN 42 HA GLN 42 25.743 -8.077 -2.400 293 HB2 GLN 42 2HB GLN 42 25.248 -6.648 -4.925 294 HB3 GLN 42 3HB GLN 42 26.947 -6.854 -4.521 295 HG2 GLN 42 2HG GLN 42 26.905 -8.982 -5.122 296 HG3 GLN 42 3HG GLN 42 25.506 -9.304 -4.099 297 HE21 GLN 42 1HE2 GLN 42 26.534 -8.201 -7.265 298 HE22 GLN 42 2HE2 GLN 42 25.063 -8.584 -8.085 299 H VAL 43 H VAL 43 26.162 -6.896 -0.408 300 HA VAL 43 HA VAL 43 27.159 -4.302 -0.253 301 HB VAL 43 HB VAL 43 26.491 -5.674 1.706 302 HG11 VAL 43 1HG1 VAL 43 27.633 -7.493 2.448 303 HG12 VAL 43 2HG1 VAL 43 28.020 -7.626 0.732 304 HG13 VAL 43 3HG1 VAL 43 29.183 -6.905 1.845 305 HG21 VAL 43 3HG2 VAL 43 27.532 -3.954 2.680 306 HG22 VAL 43 1HG2 VAL 43 28.900 -5.047 2.891 307 HG23 VAL 43 2HG2 VAL 43 28.840 -3.969 1.496 308 H THR 44 H THR 44 29.086 -3.373 -0.630 309 HA THR 44 HA THR 44 31.103 -4.931 -2.004 310 HB THR 44 HB THR 44 31.820 -2.163 -1.422 311 HG1 THR 44 HG1 THR 44 30.134 -1.211 -2.540 312 HG21 THR 44 3HG2 THR 44 32.994 -2.880 -3.216 313 HG22 THR 44 1HG2 THR 44 31.568 -2.353 -4.110 314 HG23 THR 44 2HG2 THR 44 31.763 -4.053 -3.684 315 H TRP 45 H TRP 45 32.569 -6.013 -0.868 316 HA TRP 45 HA TRP 45 33.443 -4.955 1.724 317 HB2 TRP 45 2HB TRP 45 34.403 -7.231 2.064 318 HB3 TRP 45 3HB TRP 45 32.661 -7.240 1.803 319 HD1 TRP 45 HD1 TRP 45 31.752 -8.592 -0.237 320 HE1 TRP 45 HE1 TRP 45 32.850 -10.091 -2.018 321 HE3 TRP 45 HE3 TRP 45 36.656 -7.447 0.647 322 HZ2 TRP 45 HZ2 TRP 45 35.450 -10.707 -2.928 323 HZ3 TRP 45 HZ3 TRP 45 38.386 -8.535 -0.722 324 HH2 TRP 45 HH2 TRP 45 37.794 -10.131 -2.472 325 H ASP 46 H ASP 46 35.587 -4.568 2.197 326 HA ASP 46 HA ASP 46 37.628 -5.060 0.196 327 HB2 ASP 46 2HB ASP 46 36.346 -2.490 0.459 328 HB3 ASP 46 3HB ASP 46 38.051 -2.363 0.883 329 H SER 47 H SER 47 39.706 -5.068 1.024 330 HA SER 47 HA SER 47 39.897 -4.717 3.945 331 HB2 SER 47 2HB SER 47 40.197 -7.073 2.654 332 HB3 SER 47 3HB SER 47 41.858 -6.483 2.594 333 HG SER 47 HG SER 47 41.672 -6.167 4.902 334 H SER 48 H SER 48 41.847 -3.890 4.796 335 HA SER 48 HA SER 48 43.439 -2.367 2.839 336 HB2 SER 48 2HB SER 48 41.995 -1.460 5.076 337 HB3 SER 48 3HB SER 48 43.694 -1.371 5.538 338 HG SER 48 HG SER 48 44.079 -0.117 3.699 339 H ASN 49 H ASN 49 45.523 -2.852 2.673 340 HA ASN 49 HA ASN 49 47.240 -3.437 4.807 341 HB2 ASN 49 2HB ASN 49 45.794 -5.730 3.691 342 HB3 ASN 49 3HB ASN 49 47.543 -5.934 3.686 343 HD21 ASN 49 1HD2 ASN 49 45.551 -7.340 5.241 344 HD22 ASN 49 2HD2 ASN 49 45.950 -7.077 6.901 345 H THR 50 H THR 50 49.312 -4.651 3.859 346 HA THR 50 HA THR 50 49.789 -3.672 1.127 347 HB THR 50 HB THR 50 51.958 -3.465 3.186 348 HG1 THR 50 HG1 THR 50 49.701 -1.825 2.911 349 HG21 THR 50 3HG2 THR 50 51.572 -2.748 0.424 350 HG22 THR 50 1HG2 THR 50 53.047 -2.718 1.389 351 HG23 THR 50 2HG2 THR 50 51.971 -1.321 1.379 352 H ASP 51 H ASP 51 49.449 -6.338 2.715 353 HA ASP 51 HA ASP 51 51.668 -7.692 1.346 354 HB2 ASP 51 2HB ASP 51 51.185 -7.593 4.195 355 HB3 ASP 51 3HB ASP 51 51.093 -9.251 3.607 356 H ILE 52 H ILE 52 48.985 -8.814 3.391 357 HA ILE 52 HA ILE 52 47.712 -10.024 1.054 358 HB ILE 52 HB ILE 52 48.317 -11.629 3.538 359 HG12 ILE 52 2HG1 ILE 52 49.580 -11.810 0.794 360 HG13 ILE 52 3HG1 ILE 52 50.361 -11.157 2.230 361 HG21 ILE 52 1HG2 ILE 52 47.056 -12.350 0.898 362 HG22 ILE 52 2HG2 ILE 52 47.545 -13.522 2.120 363 HG23 ILE 52 3HG2 ILE 52 46.285 -12.343 2.484 364 HD11 ILE 52 3HD1 ILE 52 51.163 -13.359 1.929 365 HD12 ILE 52 1HD1 ILE 52 50.051 -13.401 3.296 366 HD13 ILE 52 2HD1 ILE 52 49.532 -13.996 1.719 367 H LEU 53 H LEU 53 45.505 -10.415 1.287 368 HA LEU 53 HA LEU 53 44.183 -9.974 3.808 369 HB2 LEU 53 2HB LEU 53 42.910 -8.056 3.177 370 HB3 LEU 53 3HB LEU 53 44.621 -7.679 2.982 371 HG LEU 53 HG LEU 53 43.557 -6.702 1.135 372 HD11 LEU 53 1HD1 LEU 53 44.536 -7.780 -0.723 373 HD12 LEU 53 2HD1 LEU 53 44.448 -9.362 0.052 374 HD13 LEU 53 3HD1 LEU 53 45.573 -8.145 0.656 375 HD21 LEU 53 3HD2 LEU 53 41.616 -8.672 1.533 376 HD22 LEU 53 1HD2 LEU 53 42.248 -8.956 -0.089 377 HD23 LEU 53 2HD2 LEU 53 41.595 -7.374 0.338 378 H SER 54 H SER 54 42.151 -10.846 3.863 379 HA SER 54 HA SER 54 40.924 -11.709 1.351 380 HB2 SER 54 2HB SER 54 42.326 -13.469 3.092 381 HB3 SER 54 3HB SER 54 40.607 -13.834 3.237 382 HG SER 54 HG SER 54 42.005 -14.818 1.444 383 H ILE 55 H ILE 55 38.918 -10.970 1.373 384 HA ILE 55 HA ILE 55 37.345 -11.195 3.840 385 HB ILE 55 HB ILE 55 37.544 -8.717 2.127 386 HG12 ILE 55 2HG1 ILE 55 38.172 -9.273 5.033 387 HG13 ILE 55 3HG1 ILE 55 39.323 -8.875 3.763 388 HG21 ILE 55 1HG2 ILE 55 35.218 -9.143 2.688 389 HG22 ILE 55 2HG2 ILE 55 35.645 -9.324 4.389 390 HG23 ILE 55 3HG2 ILE 55 35.828 -7.760 3.596 391 HD11 ILE 55 3HD1 ILE 55 38.927 -6.965 5.184 392 HD12 ILE 55 1HD1 ILE 55 38.308 -6.655 3.562 393 HD13 ILE 55 2HD1 ILE 55 37.195 -7.060 4.869 394 H SER 56 H SER 56 35.443 -12.134 3.501 395 HA SER 56 HA SER 56 34.292 -12.041 0.790 396 HB2 SER 56 2HB SER 56 33.504 -14.421 2.230 397 HB3 SER 56 3HB SER 56 34.278 -14.279 0.652 398 HG SER 56 HG SER 56 35.926 -15.118 1.654 399 H ASN 57 H ASN 57 32.510 -10.850 0.885 400 HA ASN 57 HA ASN 57 30.675 -11.263 3.152 401 HB2 ASN 57 2HB ASN 57 31.247 -8.667 1.703 402 HB3 ASN 57 3HB ASN 57 30.015 -8.884 2.943 403 HD21 ASN 57 1HD2 ASN 57 31.408 -7.031 3.758 404 HD22 ASN 57 2HD2 ASN 57 32.698 -7.462 4.823 405 H ALA 58 H ALA 58 30.081 -12.927 1.346 406 HA ALA 58 HA ALA 58 27.739 -11.839 0.007 407 HB1 ALA 58 1HB ALA 58 29.352 -11.588 -1.734 408 HB2 ALA 58 2HB ALA 58 29.960 -13.225 -1.483 409 HB3 ALA 58 3HB ALA 58 28.340 -12.976 -2.134 410 H SER 59 H SER 59 28.632 -13.839 2.161 411 HA SER 59 HA SER 59 27.714 -16.381 1.170 412 HB2 SER 59 2HB SER 59 28.435 -15.398 3.936 413 HB3 SER 59 3HB SER 59 27.892 -17.044 3.609 414 HG SER 59 HG SER 59 30.230 -16.693 3.617 415 H ASP 60 H ASP 60 26.427 -13.814 3.232 416 HA ASP 60 HA ASP 60 23.752 -14.323 2.511 417 HB2 ASP 60 2HB ASP 60 24.295 -16.297 4.063 418 HB3 ASP 60 3HB ASP 60 24.315 -15.109 5.364 419 H SER 61 H SER 61 25.930 -13.068 4.992 420 HA SER 61 HA SER 61 25.084 -10.416 4.727 421 HB2 SER 61 2HB SER 61 24.058 -10.400 7.187 422 HB3 SER 61 3HB SER 61 23.051 -10.677 5.767 423 HG SER 61 HG SER 61 22.531 -12.412 6.863 424 H HIS 62 H HIS 62 26.105 -12.734 7.229 425 HA HIS 62 HA HIS 62 27.659 -11.066 8.782 426 HB2 HIS 62 2HB HIS 62 28.910 -13.090 9.445 427 HB3 HIS 62 3HB HIS 62 27.171 -13.365 9.426 428 HD1 HIS 62 HD1 HIS 62 30.329 -14.574 7.999 429 HD2 HIS 62 HD2 HIS 62 26.271 -14.944 7.184 430 HE1 HIS 62 HE1 HIS 62 30.134 -16.530 6.430 431 H GLY 63 H GLY 63 29.485 -9.966 8.476 432 HA2 GLY 63 2HA GLY 63 30.932 -10.347 5.966 433 HA3 GLY 63 3HA GLY 63 31.083 -8.975 7.054 434 H LEU 64 H LEU 64 32.475 -11.858 6.017 435 HA LEU 64 HA LEU 64 34.039 -12.272 8.437 436 HB2 LEU 64 2HB LEU 64 34.746 -14.279 7.514 437 HB3 LEU 64 3HB LEU 64 33.089 -14.118 6.938 438 HG LEU 64 HG LEU 64 34.373 -13.033 4.854 439 HD11 LEU 64 1HD1 LEU 64 36.514 -13.623 4.586 440 HD12 LEU 64 2HD1 LEU 64 36.255 -15.236 5.247 441 HD13 LEU 64 3HD1 LEU 64 36.507 -13.870 6.333 442 HD21 LEU 64 3HD2 LEU 64 32.973 -14.695 4.228 443 HD22 LEU 64 1HD2 LEU 64 33.477 -15.764 5.536 444 HD23 LEU 64 2HD2 LEU 64 34.480 -15.602 4.095 445 H ALA 65 H ALA 65 36.082 -11.610 8.729 446 HA ALA 65 HA ALA 65 37.576 -10.586 6.414 447 HB1 ALA 65 1HB ALA 65 38.425 -8.760 7.979 448 HB2 ALA 65 2HB ALA 65 36.779 -8.597 7.365 449 HB3 ALA 65 3HB ALA 65 37.053 -9.170 9.010 450 H SER 66 H SER 66 39.607 -11.307 6.305 451 HA SER 66 HA SER 66 40.987 -12.146 8.739 452 HB2 SER 66 2HB SER 66 39.775 -14.125 7.638 453 HB3 SER 66 3HB SER 66 40.952 -13.966 6.335 454 HG SER 66 HG SER 66 41.546 -15.470 8.025 455 H THR 67 H THR 67 43.276 -12.296 8.511 456 HA THR 67 HA THR 67 44.463 -11.410 6.009 457 HB THR 67 HB THR 67 45.670 -9.541 6.997 458 HG1 THR 67 HG1 THR 67 45.742 -9.312 9.096 459 HG21 THR 67 3HG2 THR 67 42.697 -9.344 7.496 460 HG22 THR 67 1HG2 THR 67 43.507 -9.070 5.954 461 HG23 THR 67 2HG2 THR 67 43.802 -7.983 7.312 462 H LEU 68 H LEU 68 46.975 -11.054 6.513 463 HA LEU 68 HA LEU 68 48.083 -12.713 8.553 464 HB2 LEU 68 2HB LEU 68 47.216 -14.387 6.914 465 HB3 LEU 68 3HB LEU 68 48.324 -13.712 5.721 466 HG LEU 68 HG LEU 68 50.018 -14.306 7.778 467 HD11 LEU 68 1HD1 LEU 68 47.686 -16.163 7.879 468 HD12 LEU 68 2HD1 LEU 68 48.648 -15.491 9.195 469 HD13 LEU 68 3HD1 LEU 68 49.308 -16.781 8.190 470 HD21 LEU 68 3HD2 LEU 68 49.215 -15.619 5.244 471 HD22 LEU 68 1HD2 LEU 68 50.255 -16.527 6.341 472 HD23 LEU 68 2HD2 LEU 68 50.773 -14.954 5.734 473 H ASN 69 H ASN 69 48.767 -10.268 8.378 474 HA ASN 69 HA ASN 69 51.458 -10.301 7.265 475 HB2 ASN 69 2HB ASN 69 51.237 -8.219 6.088 476 HB3 ASN 69 3HB ASN 69 49.956 -9.289 5.525 477 HD21 ASN 69 1HD2 ASN 69 50.555 -6.222 6.240 478 HD22 ASN 69 2HD2 ASN 69 49.004 -5.710 6.802 479 H GLN 70 H GLN 70 52.576 -8.122 7.895 480 HA GLN 70 HA GLN 70 52.009 -7.716 10.741 481 HB2 GLN 70 2HB GLN 70 54.473 -7.248 9.068 482 HB3 GLN 70 3HB GLN 70 54.326 -6.667 10.722 483 HG2 GLN 70 2HG GLN 70 55.515 -8.704 10.810 484 HG3 GLN 70 3HG GLN 70 53.893 -9.033 11.416 485 HE21 GLN 70 1HE2 GLN 70 53.609 -11.110 10.909 486 HE22 GLN 70 2HE2 GLN 70 53.719 -11.768 9.316 487 H GLY 71 H GLY 71 50.991 -5.933 11.355 488 HA2 GLY 71 2HA GLY 71 51.468 -3.376 11.151 489 HA3 GLY 71 3HA GLY 71 50.899 -3.652 9.511 490 H ASN 72 H ASN 72 48.988 -2.627 9.450 491 HA ASN 72 HA ASN 72 46.941 -3.508 11.369 492 HB2 ASN 72 2HB ASN 72 46.089 -1.310 11.639 493 HB3 ASN 72 3HB ASN 72 47.833 -1.170 11.839 494 HD21 ASN 72 1HD2 ASN 72 49.028 -0.056 10.344 495 HD22 ASN 72 2HD2 ASN 72 48.317 0.904 9.096 496 H VAL 73 H VAL 73 44.838 -3.669 10.570 497 HA VAL 73 HA VAL 73 44.498 -3.249 7.679 498 HB VAL 73 HB VAL 73 44.939 -5.608 7.924 499 HG11 VAL 73 1HG1 VAL 73 42.694 -6.501 9.426 500 HG12 VAL 73 2HG1 VAL 73 44.411 -6.721 9.770 501 HG13 VAL 73 3HG1 VAL 73 43.563 -5.300 10.380 502 HG21 VAL 73 3HG2 VAL 73 42.751 -4.553 6.682 503 HG22 VAL 73 1HG2 VAL 73 43.305 -6.219 6.513 504 HG23 VAL 73 2HG2 VAL 73 42.029 -5.827 7.665 505 H LYS 74 H LYS 74 42.534 -2.493 7.055 506 HA LYS 74 HA LYS 74 40.479 -2.197 9.146 507 HB2 LYS 74 2HB LYS 74 41.534 -0.043 8.738 508 HB3 LYS 74 3HB LYS 74 41.261 -0.207 7.009 509 HG2 LYS 74 2HG LYS 74 39.607 1.268 7.788 510 HG3 LYS 74 3HG LYS 74 38.791 -0.276 7.534 511 HD2 LYS 74 2HD LYS 74 38.021 -0.052 9.619 512 HD3 LYS 74 3HD LYS 74 39.662 -0.429 10.150 513 HE2 LYS 74 2HE LYS 74 38.918 1.586 11.241 514 HE3 LYS 74 3HE LYS 74 40.192 1.986 10.090 515 HZ1 LYS 74 3HZ LYS 74 37.713 2.153 8.787 516 HZ2 LYS 74 1HZ LYS 74 38.822 3.392 9.101 517 HZ3 LYS 74 2HZ LYS 74 37.612 3.035 10.227 518 H VAL 75 H VAL 75 38.603 -3.115 8.660 519 HA VAL 75 HA VAL 75 38.117 -4.017 5.932 520 HB VAL 75 HB VAL 75 36.488 -4.549 8.419 521 HG11 VAL 75 1HG1 VAL 75 36.070 -5.115 5.629 522 HG12 VAL 75 2HG1 VAL 75 36.190 -6.611 6.557 523 HG13 VAL 75 3HG1 VAL 75 34.998 -5.390 7.001 524 HG21 VAL 75 3HG2 VAL 75 38.834 -5.386 8.539 525 HG22 VAL 75 1HG2 VAL 75 37.614 -6.658 8.587 526 HG23 VAL 75 2HG2 VAL 75 38.512 -6.353 7.100 527 H THR 76 H THR 76 36.545 -3.265 4.618 528 HA THR 76 HA THR 76 34.739 -1.197 5.687 529 HB THR 76 HB THR 76 35.231 -0.762 2.893 530 HG1 THR 76 HG1 THR 76 37.446 -0.271 3.008 531 HG21 THR 76 3HG2 THR 76 34.407 1.024 4.157 532 HG22 THR 76 1HG2 THR 76 36.094 1.456 3.882 533 HG23 THR 76 2HG2 THR 76 35.596 0.789 5.437 534 H ALA 77 H ALA 77 32.650 -1.557 5.318 535 HA ALA 77 HA ALA 77 31.799 -3.029 2.955 536 HB1 ALA 77 1HB ALA 77 31.942 -4.237 5.554 537 HB2 ALA 77 2HB ALA 77 30.266 -4.158 5.011 538 HB3 ALA 77 3HB ALA 77 31.480 -4.955 4.011 539 H SER 78 H SER 78 29.916 -2.288 2.165 540 HA SER 78 HA SER 78 28.042 -0.888 3.899 541 HB2 SER 78 2HB SER 78 27.976 1.111 2.495 542 HB3 SER 78 3HB SER 78 29.606 0.867 3.121 543 HG SER 78 HG SER 78 29.898 -0.310 1.003 544 H ILE 79 H ILE 79 25.954 -1.025 3.219 545 HA ILE 79 HA ILE 79 25.435 -2.085 0.532 546 HB ILE 79 HB ILE 79 25.394 -4.027 1.974 547 HG12 ILE 79 2HG1 ILE 79 22.587 -3.124 1.291 548 HG13 ILE 79 3HG1 ILE 79 23.716 -3.887 0.176 549 HG21 ILE 79 1HG2 ILE 79 24.449 -2.255 3.902 550 HG22 ILE 79 2HG2 ILE 79 23.112 -3.367 3.612 551 HG23 ILE 79 3HG2 ILE 79 24.692 -3.992 4.084 552 HD11 ILE 79 3HD1 ILE 79 22.352 -5.633 0.806 553 HD12 ILE 79 1HD1 ILE 79 23.728 -5.816 1.893 554 HD13 ILE 79 2HD1 ILE 79 22.236 -5.078 2.476 555 H GLY 80 H GLY 80 23.970 -0.889 -0.482 556 HA2 GLY 80 2HA GLY 80 22.137 0.443 -0.869 557 HA3 GLY 80 3HA GLY 80 21.538 -0.041 0.711 558 H GLY 81 H GLY 81 21.771 1.314 2.441 559 HA2 GLY 81 2HA GLY 81 22.857 3.979 1.802 560 HA3 GLY 81 3HA GLY 81 21.600 3.659 2.988 561 H ILE 82 H ILE 82 22.184 2.706 5.002 562 HA ILE 82 HA ILE 82 24.406 3.777 6.231 563 HB ILE 82 HB ILE 82 23.025 1.214 7.036 564 HG12 ILE 82 2HG1 ILE 82 21.396 2.998 6.756 565 HG13 ILE 82 3HG1 ILE 82 21.636 2.684 8.471 566 HG21 ILE 82 1HG2 ILE 82 24.971 3.026 8.368 567 HG22 ILE 82 2HG2 ILE 82 23.720 2.265 9.350 568 HG23 ILE 82 3HG2 ILE 82 24.841 1.268 8.424 569 HD11 ILE 82 3HD1 ILE 82 21.505 5.046 8.104 570 HD12 ILE 82 1HD1 ILE 82 23.154 4.629 8.569 571 HD13 ILE 82 2HD1 ILE 82 22.773 4.968 6.880 572 H GLN 83 H GLN 83 26.427 2.997 6.840 573 HA GLN 83 HA GLN 83 27.327 0.531 5.514 574 HB2 GLN 83 2HB GLN 83 29.478 1.656 5.001 575 HB3 GLN 83 3HB GLN 83 28.111 2.361 4.148 576 HG2 GLN 83 2HG GLN 83 28.321 3.800 6.530 577 HG3 GLN 83 3HG GLN 83 29.974 3.589 5.956 578 HE21 GLN 83 1HE2 GLN 83 30.656 5.163 4.712 579 HE22 GLN 83 2HE2 GLN 83 29.689 6.124 3.650 580 H GLY 84 H GLY 84 29.353 -0.345 6.436 581 HA2 GLY 84 2HA GLY 84 29.821 0.481 9.220 582 HA3 GLY 84 3HA GLY 84 29.414 -1.194 8.880 583 H SER 85 H SER 85 31.855 0.070 10.029 584 HA SER 85 HA SER 85 33.769 -1.328 8.319 585 HB2 SER 85 2HB SER 85 35.367 0.488 8.357 586 HB3 SER 85 3HB SER 85 33.844 1.097 7.710 587 HG SER 85 HG SER 85 35.159 1.741 10.047 588 H THR 86 H THR 86 35.349 -2.378 9.421 589 HA THR 86 HA THR 86 35.348 -2.064 12.352 590 HB THR 86 HB THR 86 35.763 -4.372 12.629 591 HG1 THR 86 HG1 THR 86 35.929 -5.620 10.475 592 HG21 THR 86 3HG2 THR 86 33.717 -5.128 12.077 593 HG22 THR 86 1HG2 THR 86 33.953 -4.804 10.360 594 HG23 THR 86 2HG2 THR 86 33.463 -3.502 11.444 595 H ASP 87 H ASP 87 37.318 -2.169 13.453 596 HA ASP 87 HA ASP 87 39.669 -1.658 11.761 597 HB2 ASP 87 2HB ASP 87 38.987 0.164 13.307 598 HB3 ASP 87 3HB ASP 87 39.242 -0.927 14.665 599 H PHE 88 H PHE 88 41.271 -3.088 11.725 600 HA PHE 88 HA PHE 88 41.482 -5.019 13.938 601 HB2 PHE 88 2HB PHE 88 41.446 -5.489 10.983 602 HB3 PHE 88 3HB PHE 88 42.411 -6.550 12.004 603 HD1 PHE 88 HD1 PHE 88 38.995 -5.040 12.071 604 HD2 PHE 88 HD2 PHE 88 41.402 -8.508 12.611 605 HE1 PHE 88 HE1 PHE 88 36.981 -6.350 12.601 606 HE2 PHE 88 HE2 PHE 88 39.392 -9.825 13.141 607 HZ PHE 88 HZ PHE 88 37.178 -8.746 13.136 608 H LYS 89 H LYS 89 43.462 -5.305 14.780 609 HA LYS 89 HA LYS 89 45.744 -4.092 13.364 610 HB2 LYS 89 2HB LYS 89 44.735 -3.655 16.079 611 HB3 LYS 89 3HB LYS 89 46.453 -4.027 16.025 612 HG2 LYS 89 2HG LYS 89 46.134 -2.175 14.007 613 HG3 LYS 89 3HG LYS 89 45.047 -1.604 15.275 614 HD2 LYS 89 2HD LYS 89 46.746 -1.143 16.709 615 HD3 LYS 89 3HD LYS 89 47.739 -2.483 16.133 616 HE2 LYS 89 2HE LYS 89 47.660 -0.842 13.948 617 HE3 LYS 89 3HE LYS 89 47.663 0.317 15.277 618 HZ1 LYS 89 3HZ LYS 89 49.882 -0.639 14.286 619 HZ2 LYS 89 1HZ LYS 89 49.578 -1.893 15.380 620 HZ3 LYS 89 2HZ LYS 89 49.733 -0.304 15.937 621 H VAL 90 H VAL 90 47.038 -5.664 12.684 622 HA VAL 90 HA VAL 90 47.252 -8.139 14.233 623 HB VAL 90 HB VAL 90 46.823 -8.504 11.905 624 HG11 VAL 90 1HG1 VAL 90 47.560 -6.384 11.007 625 HG12 VAL 90 2HG1 VAL 90 49.240 -6.780 11.374 626 HG13 VAL 90 3HG1 VAL 90 48.362 -7.700 10.152 627 HG21 VAL 90 3HG2 VAL 90 49.748 -9.066 12.024 628 HG22 VAL 90 1HG2 VAL 90 48.683 -9.811 13.216 629 HG23 VAL 90 2HG2 VAL 90 48.422 -10.102 11.497 630 H THR 91 H THR 91 48.954 -8.565 15.471 631 HA THR 91 HA THR 91 51.447 -7.063 15.008 632 HB THR 91 HB THR 91 51.701 -7.443 17.611 633 HG1 THR 91 HG1 THR 91 48.894 -7.078 17.436 634 HG21 THR 91 3HG2 THR 91 51.080 -5.291 15.988 635 HG22 THR 91 1HG2 THR 91 51.542 -5.211 17.688 636 HG23 THR 91 2HG2 THR 91 49.837 -5.240 17.238 637 H GLN 92 H GLN 92 53.340 -8.186 15.155 638 HA GLN 92 HA GLN 92 53.343 -10.938 14.716 639 HB2 GLN 92 2HB GLN 92 55.786 -10.811 15.120 640 HB3 GLN 92 3HB GLN 92 55.206 -9.564 14.025 641 HG2 GLN 92 2HG GLN 92 55.230 -7.949 15.868 642 HG3 GLN 92 3HG GLN 92 55.849 -9.201 16.943 643 HE21 GLN 92 1HE2 GLN 92 57.281 -6.968 16.752 644 HE22 GLN 92 2HE2 GLN 92 58.719 -7.220 15.829 Start of MODEL 18 1 H1 MET 1 H MET 1 4.990 -2.704 -2.020 2 HA MET 1 HA MET 1 4.403 0.172 -1.757 3 HB2 MET 1 2HB MET 1 3.955 -2.046 0.244 4 HB3 MET 1 3HB MET 1 3.851 -0.336 0.642 5 HG2 MET 1 2HG MET 1 2.158 -0.330 -1.380 6 HG3 MET 1 3HG MET 1 2.013 -2.033 -0.951 7 HE1 MET 1 3HE MET 1 0.472 1.395 -0.324 8 HE2 MET 1 1HE MET 1 0.585 1.598 1.424 9 HE3 MET 1 2HE MET 1 2.051 1.564 0.444 10 HA PRO 2 HA PRO 2 8.872 -0.636 -0.743 11 HB2 PRO 2 2HB PRO 2 9.831 1.429 -2.221 12 HB3 PRO 2 3HB PRO 2 9.536 -0.179 -2.894 13 HG2 PRO 2 2HG PRO 2 7.830 2.277 -3.038 14 HG3 PRO 2 3HG PRO 2 8.211 1.103 -4.311 15 HD2 PRO 2 2HD PRO 2 5.870 1.068 -2.952 16 HD3 PRO 2 3HD PRO 2 6.642 -0.410 -3.561 17 H ALA 3 H ALA 3 9.936 0.357 0.892 18 HA ALA 3 HA ALA 3 9.368 3.139 1.537 19 HB1 ALA 3 1HB ALA 3 7.649 2.028 2.787 20 HB2 ALA 3 2HB ALA 3 8.811 0.879 3.452 21 HB3 ALA 3 3HB ALA 3 8.890 2.579 3.912 22 H ALA 4 H ALA 4 10.747 0.514 3.487 23 HA ALA 4 HA ALA 4 13.064 2.047 4.122 24 HB1 ALA 4 1HB ALA 4 12.978 -0.903 4.536 25 HB2 ALA 4 2HB ALA 4 13.613 0.365 5.584 26 HB3 ALA 4 3HB ALA 4 11.871 0.126 5.445 27 H LEU 5 H LEU 5 14.531 2.484 2.597 28 HA LEU 5 HA LEU 5 15.122 0.585 0.493 29 HB2 LEU 5 2HB LEU 5 16.678 2.347 -0.299 30 HB3 LEU 5 3HB LEU 5 15.006 2.881 -0.139 31 HG LEU 5 HG LEU 5 16.486 3.448 2.269 32 HD11 LEU 5 1HD1 LEU 5 17.602 4.568 -0.297 33 HD12 LEU 5 2HD1 LEU 5 18.441 3.523 0.848 34 HD13 LEU 5 3HD1 LEU 5 17.980 5.158 1.321 35 HD21 LEU 5 3HD2 LEU 5 15.589 5.648 1.926 36 HD22 LEU 5 1HD2 LEU 5 14.349 4.465 1.512 37 HD23 LEU 5 2HD2 LEU 5 15.241 5.291 0.234 38 H VAL 6 H VAL 6 16.449 -1.052 0.893 39 HA VAL 6 HA VAL 6 18.050 -2.313 1.984 40 HB VAL 6 HB VAL 6 20.370 -1.290 1.599 41 HG11 VAL 6 1HG1 VAL 6 20.386 -2.091 -0.554 42 HG12 VAL 6 2HG1 VAL 6 18.898 -2.817 0.057 43 HG13 VAL 6 3HG1 VAL 6 18.827 -1.371 -0.951 44 HG21 VAL 6 3HG2 VAL 6 18.697 0.752 0.137 45 HG22 VAL 6 1HG2 VAL 6 19.672 1.050 1.576 46 HG23 VAL 6 2HG2 VAL 6 20.453 0.608 0.058 47 H SER 7 H SER 7 17.064 -1.835 4.123 48 HA SER 7 HA SER 7 18.650 0.003 5.765 49 HB2 SER 7 2HB SER 7 16.122 0.097 5.801 50 HB3 SER 7 3HB SER 7 16.147 -1.487 6.576 51 HG SER 7 HG SER 7 16.072 0.429 7.994 52 H ILE 8 H ILE 8 20.524 -1.209 6.037 53 HA ILE 8 HA ILE 8 20.207 -3.701 7.579 54 HB ILE 8 HB ILE 8 21.276 -4.128 5.439 55 HG12 ILE 8 2HG1 ILE 8 23.671 -4.305 7.132 56 HG13 ILE 8 3HG1 ILE 8 22.209 -4.917 7.896 57 HG21 ILE 8 1HG2 ILE 8 22.178 -1.998 4.884 58 HG22 ILE 8 2HG2 ILE 8 23.214 -1.996 6.310 59 HG23 ILE 8 3HG2 ILE 8 23.532 -3.123 4.991 60 HD11 ILE 8 3HD1 ILE 8 22.646 -6.825 6.855 61 HD12 ILE 8 1HD1 ILE 8 22.116 -6.020 5.378 62 HD13 ILE 8 2HD1 ILE 8 23.830 -6.067 5.790 63 H SER 9 H SER 9 21.323 -3.948 9.467 64 HA SER 9 HA SER 9 22.815 -1.589 10.411 65 HB2 SER 9 2HB SER 9 21.911 -3.340 12.538 66 HB3 SER 9 3HB SER 9 21.606 -1.619 12.302 67 HG SER 9 HG SER 9 19.953 -2.281 10.778 68 H VAL 10 H VAL 10 24.927 -1.976 10.342 69 HA VAL 10 HA VAL 10 25.910 -4.681 10.921 70 HB VAL 10 HB VAL 10 26.659 -3.706 8.799 71 HG11 VAL 10 1HG1 VAL 10 26.779 -1.337 10.180 72 HG12 VAL 10 2HG1 VAL 10 28.481 -1.756 9.972 73 HG13 VAL 10 3HG1 VAL 10 27.426 -1.620 8.565 74 HG21 VAL 10 3HG2 VAL 10 29.134 -3.938 9.200 75 HG22 VAL 10 1HG2 VAL 10 28.764 -4.082 10.919 76 HG23 VAL 10 2HG2 VAL 10 28.146 -5.279 9.780 77 H SER 11 H SER 11 27.154 -5.117 12.653 78 HA SER 11 HA SER 11 27.815 -2.865 14.433 79 HB2 SER 11 2HB SER 11 27.196 -5.751 15.103 80 HB3 SER 11 3HB SER 11 27.746 -4.554 16.276 81 HG SER 11 HG SER 11 25.393 -4.892 16.066 82 HA PRO 12 HA PRO 12 31.842 -4.638 12.979 83 HB2 PRO 12 2HB PRO 12 33.040 -2.225 12.641 84 HB3 PRO 12 3HB PRO 12 32.057 -2.993 11.388 85 HG2 PRO 12 2HG PRO 12 31.310 -0.838 13.327 86 HG3 PRO 12 3HG PRO 12 30.935 -0.967 11.599 87 HD2 PRO 12 2HD PRO 12 29.145 -1.602 13.528 88 HD3 PRO 12 3HD PRO 12 29.188 -2.428 11.958 89 H THR 13 H THR 13 33.834 -4.686 14.077 90 HA THR 13 HA THR 13 33.785 -3.449 16.753 91 HB THR 13 HB THR 13 35.565 -5.754 16.448 92 HG1 THR 13 HG1 THR 13 33.637 -7.194 16.609 93 HG21 THR 13 3HG2 THR 13 34.696 -4.457 18.547 94 HG22 THR 13 1HG2 THR 13 34.922 -6.204 18.622 95 HG23 THR 13 2HG2 THR 13 33.307 -5.533 18.395 96 H ASN 14 H ASN 14 35.197 -1.842 16.907 97 HA ASN 14 HA ASN 14 37.565 -1.812 15.204 98 HB2 ASN 14 2HB ASN 14 37.834 0.519 16.203 99 HB3 ASN 14 3HB ASN 14 36.415 0.260 15.192 100 HD21 ASN 14 1HD2 ASN 14 37.533 1.369 18.134 101 HD22 ASN 14 2HD2 ASN 14 36.022 1.481 18.965 102 H SER 15 H SER 15 39.081 -3.141 16.060 103 HA SER 15 HA SER 15 40.416 -2.277 18.452 104 HB2 SER 15 2HB SER 15 38.414 -3.959 19.015 105 HB3 SER 15 3HB SER 15 39.646 -5.150 18.598 106 HG SER 15 HG SER 15 39.709 -4.640 20.815 107 H THR 16 H THR 16 41.982 -4.452 18.982 108 HA THR 16 HA THR 16 43.476 -4.728 16.468 109 HB THR 16 HB THR 16 44.818 -3.701 18.155 110 HG1 THR 16 HG1 THR 16 46.511 -5.081 18.053 111 HG21 THR 16 3HG2 THR 16 43.889 -5.959 19.919 112 HG22 THR 16 1HG2 THR 16 43.676 -4.227 20.167 113 HG23 THR 16 2HG2 THR 16 45.279 -4.947 20.313 114 H VAL 17 H VAL 17 44.290 -6.727 15.804 115 HA VAL 17 HA VAL 17 43.144 -9.078 17.165 116 HB VAL 17 HB VAL 17 41.975 -8.523 15.020 117 HG11 VAL 17 1HG1 VAL 17 43.881 -7.658 13.779 118 HG12 VAL 17 2HG1 VAL 17 44.637 -9.252 13.803 119 HG13 VAL 17 3HG1 VAL 17 43.134 -9.001 12.914 120 HG21 VAL 17 3HG2 VAL 17 43.298 -11.108 14.483 121 HG22 VAL 17 1HG2 VAL 17 42.564 -10.920 16.076 122 HG23 VAL 17 2HG2 VAL 17 41.584 -10.717 14.624 123 H ALA 18 H ALA 18 44.332 -11.048 16.956 124 HA ALA 18 HA ALA 18 47.147 -10.691 17.148 125 HB1 ALA 18 1HB ALA 18 46.095 -13.422 16.756 126 HB2 ALA 18 2HB ALA 18 47.195 -12.791 17.983 127 HB3 ALA 18 3HB ALA 18 45.458 -12.525 18.134 128 H LYS 19 H LYS 19 48.659 -12.202 15.906 129 HA LYS 19 HA LYS 19 48.531 -11.522 13.155 130 HB2 LYS 19 2HB LYS 19 50.609 -11.932 14.612 131 HB3 LYS 19 3HB LYS 19 50.326 -13.643 14.314 132 HG2 LYS 19 2HG LYS 19 50.265 -12.810 11.799 133 HG3 LYS 19 3HG LYS 19 51.267 -11.522 12.472 134 HD2 LYS 19 2HD LYS 19 52.944 -12.973 12.048 135 HD3 LYS 19 3HD LYS 19 52.444 -13.677 13.587 136 HE2 LYS 19 2HE LYS 19 50.795 -14.744 11.527 137 HE3 LYS 19 3HE LYS 19 52.478 -14.880 11.018 138 HZ1 LYS 19 3HZ LYS 19 51.075 -16.252 13.142 139 HZ2 LYS 19 1HZ LYS 19 52.616 -15.694 13.565 140 HZ3 LYS 19 2HZ LYS 19 52.426 -16.736 12.246 141 H GLY 20 H GLY 20 47.494 -12.516 11.559 142 HA2 GLY 20 2HA GLY 20 46.445 -14.144 10.325 143 HA3 GLY 20 3HA GLY 20 47.436 -15.310 11.189 144 H LEU 21 H LEU 21 44.318 -14.060 10.751 145 HA LEU 21 HA LEU 21 43.058 -16.079 12.212 146 HB2 LEU 21 2HB LEU 21 43.937 -13.889 13.810 147 HB3 LEU 21 3HB LEU 21 42.175 -13.868 13.748 148 HG LEU 21 HG LEU 21 43.185 -16.527 14.289 149 HD11 LEU 21 1HD1 LEU 21 45.037 -15.657 15.393 150 HD12 LEU 21 2HD1 LEU 21 43.847 -15.851 16.679 151 HD13 LEU 21 3HD1 LEU 21 44.147 -14.256 15.990 152 HD21 LEU 21 3HD2 LEU 21 41.525 -14.736 16.044 153 HD22 LEU 21 1HD2 LEU 21 41.527 -16.498 15.964 154 HD23 LEU 21 2HD2 LEU 21 40.868 -15.556 14.627 155 H GLN 22 H GLN 22 40.652 -15.561 12.544 156 HA GLN 22 HA GLN 22 39.743 -13.726 10.427 157 HB2 GLN 22 2HB GLN 22 38.452 -16.364 11.133 158 HB3 GLN 22 3HB GLN 22 38.015 -15.291 9.810 159 HG2 GLN 22 2HG GLN 22 39.341 -16.489 8.509 160 HG3 GLN 22 3HG GLN 22 40.709 -15.842 9.412 161 HE21 GLN 22 1HE2 GLN 22 38.376 -18.478 9.312 162 HE22 GLN 22 2HE2 GLN 22 39.386 -19.645 10.088 163 H GLU 23 H GLU 23 37.950 -12.495 10.839 164 HA GLU 23 HA GLU 23 36.807 -12.728 13.546 165 HB2 GLU 23 2HB GLU 23 36.541 -10.295 13.561 166 HB3 GLU 23 3HB GLU 23 38.227 -10.746 13.352 167 HG2 GLU 23 2HG GLU 23 38.304 -9.427 11.584 168 HG3 GLU 23 3HG GLU 23 37.184 -10.517 10.769 169 H ASN 24 H ASN 24 34.704 -13.135 13.605 170 HA ASN 24 HA ASN 24 33.134 -12.867 11.160 171 HB2 ASN 24 2HB ASN 24 31.400 -14.126 12.531 172 HB3 ASN 24 3HB ASN 24 32.890 -14.997 12.180 173 HD21 ASN 24 1HD2 ASN 24 33.468 -16.186 13.835 174 HD22 ASN 24 2HD2 ASN 24 33.376 -15.735 15.501 175 H PHE 25 H PHE 25 31.359 -11.573 10.943 176 HA PHE 25 HA PHE 25 30.758 -9.766 13.192 177 HB2 PHE 25 2HB PHE 25 30.296 -7.999 11.525 178 HB3 PHE 25 3HB PHE 25 31.968 -8.547 11.467 179 HD1 PHE 25 HD1 PHE 25 28.683 -8.826 9.793 180 HD2 PHE 25 HD2 PHE 25 32.885 -9.436 9.498 181 HE1 PHE 25 HE1 PHE 25 28.446 -9.274 7.385 182 HE2 PHE 25 HE2 PHE 25 32.655 -9.884 7.090 183 HZ PHE 25 HZ PHE 25 30.433 -9.803 6.030 184 H LYS 26 H LYS 26 28.588 -8.474 12.341 185 HA LYS 26 HA LYS 26 26.649 -10.532 11.538 186 HB2 LYS 26 2HB LYS 26 26.543 -8.724 13.939 187 HB3 LYS 26 3HB LYS 26 25.073 -9.376 13.227 188 HG2 LYS 26 2HG LYS 26 25.936 -11.651 13.578 189 HG3 LYS 26 3HG LYS 26 27.370 -10.969 14.347 190 HD2 LYS 26 2HD LYS 26 25.626 -9.764 15.872 191 HD3 LYS 26 3HD LYS 26 24.545 -11.046 15.321 192 HE2 LYS 26 2HE LYS 26 25.850 -12.722 16.289 193 HE3 LYS 26 3HE LYS 26 27.266 -11.678 16.411 194 HZ1 LYS 26 3HZ LYS 26 25.165 -12.082 18.285 195 HZ2 LYS 26 1HZ LYS 26 25.324 -10.441 17.907 196 HZ3 LYS 26 2HZ LYS 26 26.653 -11.305 18.495 197 H ALA 27 H ALA 27 25.367 -9.895 9.935 198 HA ALA 27 HA ALA 27 24.767 -7.043 9.617 199 HB1 ALA 27 1HB ALA 27 25.046 -7.903 7.011 200 HB2 ALA 27 2HB ALA 27 26.188 -6.900 7.906 201 HB3 ALA 27 3HB ALA 27 26.413 -8.648 7.841 202 H THR 28 H THR 28 22.635 -6.848 9.609 203 HA THR 28 HA THR 28 21.028 -8.979 8.356 204 HB THR 28 HB THR 28 19.527 -7.299 10.188 205 HG1 THR 28 HG1 THR 28 20.550 -8.068 12.088 206 HG21 THR 28 3HG2 THR 28 19.338 -9.784 11.181 207 HG22 THR 28 1HG2 THR 28 19.913 -10.166 9.559 208 HG23 THR 28 2HG2 THR 28 18.425 -9.243 9.773 209 H GLY 29 H GLY 29 20.336 -8.296 6.431 210 HA2 GLY 29 2HA GLY 29 19.895 -5.474 5.921 211 HA3 GLY 29 3HA GLY 29 19.777 -6.779 4.750 212 H ILE 30 H ILE 30 17.996 -4.442 5.767 213 HA ILE 30 HA ILE 30 15.537 -6.057 5.903 214 HB ILE 30 HB ILE 30 15.884 -3.397 7.281 215 HG12 ILE 30 2HG1 ILE 30 17.370 -5.069 8.307 216 HG13 ILE 30 3HG1 ILE 30 16.044 -4.644 9.384 217 HG21 ILE 30 1HG2 ILE 30 13.597 -3.919 6.715 218 HG22 ILE 30 2HG2 ILE 30 13.751 -5.521 7.433 219 HG23 ILE 30 3HG2 ILE 30 13.822 -4.087 8.456 220 HD11 ILE 30 3HD1 ILE 30 15.578 -6.790 9.589 221 HD12 ILE 30 1HD1 ILE 30 15.181 -6.851 7.872 222 HD13 ILE 30 2HD1 ILE 30 16.823 -7.203 8.411 223 H PHE 31 H PHE 31 14.592 -5.823 3.981 224 HA PHE 31 HA PHE 31 14.412 -3.109 2.847 225 HB2 PHE 31 2HB PHE 31 15.656 -5.225 1.662 226 HB3 PHE 31 3HB PHE 31 14.032 -5.374 0.999 227 HD1 PHE 31 HD2 PHE 31 13.283 -2.501 0.836 228 HD2 PHE 31 HD1 PHE 31 16.898 -4.509 -0.172 229 HE1 PHE 31 HE2 PHE 31 13.796 -0.745 -0.809 230 HE2 PHE 31 HE1 PHE 31 17.417 -2.755 -1.818 231 HZ PHE 31 HZ PHE 31 15.865 -0.871 -2.140 232 H THR 32 H THR 32 12.432 -2.309 2.576 233 HA THR 32 HA THR 32 10.142 -3.815 3.394 234 HB THR 32 HB THR 32 10.331 -1.061 2.157 235 HG1 THR 32 HG1 THR 32 11.101 -1.809 4.482 236 HG21 THR 32 3HG2 THR 32 7.997 -1.321 3.702 237 HG22 THR 32 1HG2 THR 32 8.056 -2.744 2.663 238 HG23 THR 32 2HG2 THR 32 8.112 -1.130 1.953 239 H ASP 33 H ASP 33 11.495 -2.787 0.320 240 HA ASP 33 HA ASP 33 9.211 -3.893 -1.129 241 HB2 ASP 33 2HB ASP 33 10.198 -1.679 -1.779 242 HB3 ASP 33 3HB ASP 33 11.665 -2.531 -2.253 243 H ASN 34 H ASN 34 11.275 -5.493 0.373 244 HA ASN 34 HA ASN 34 11.690 -7.470 -1.706 245 HB2 ASN 34 2HB ASN 34 13.795 -5.732 -0.977 246 HB3 ASN 34 3HB ASN 34 14.157 -7.289 -0.239 247 HD21 ASN 34 1HD2 ASN 34 14.931 -8.881 -1.472 248 HD22 ASN 34 2HD2 ASN 34 15.104 -8.807 -3.190 249 H SER 35 H SER 35 12.910 -6.813 1.583 250 HA SER 35 HA SER 35 12.680 -7.954 3.542 251 HB2 SER 35 2HB SER 35 10.212 -8.029 2.648 252 HB3 SER 35 3HB SER 35 10.571 -9.733 2.368 253 HG SER 35 HG SER 35 10.574 -8.309 4.809 254 H ASN 36 H ASN 36 14.823 -8.745 2.680 255 HA ASN 36 HA ASN 36 14.826 -11.655 2.797 256 HB2 ASN 36 2HB ASN 36 15.803 -10.045 0.465 257 HB3 ASN 36 3HB ASN 36 16.617 -11.549 0.884 258 HD21 ASN 36 1HD2 ASN 36 15.278 -13.485 1.009 259 HD22 ASN 36 2HD2 ASN 36 13.925 -13.630 -0.055 260 H SER 37 H SER 37 17.112 -12.497 2.997 261 HA SER 37 HA SER 37 18.490 -10.888 4.967 262 HB2 SER 37 2HB SER 37 18.514 -13.721 4.117 263 HB3 SER 37 3HB SER 37 20.051 -13.090 4.708 264 HG SER 37 HG SER 37 19.130 -13.634 6.553 265 H ASP 38 H ASP 38 20.893 -10.715 4.892 266 HA ASP 38 HA ASP 38 21.712 -9.350 2.574 267 HB2 ASP 38 2HB ASP 38 22.757 -8.741 4.612 268 HB3 ASP 38 3HB ASP 38 23.221 -10.405 4.960 269 H ILE 39 H ILE 39 21.846 -10.387 0.676 270 HA ILE 39 HA ILE 39 23.971 -12.083 0.073 271 HB ILE 39 HB ILE 39 22.930 -13.845 1.289 272 HG12 ILE 39 2HG1 ILE 39 23.660 -14.111 -1.280 273 HG13 ILE 39 3HG1 ILE 39 23.078 -15.462 -0.314 274 HG21 ILE 39 1HG2 ILE 39 20.708 -13.039 1.541 275 HG22 ILE 39 2HG2 ILE 39 20.423 -13.098 -0.198 276 HG23 ILE 39 3HG2 ILE 39 20.602 -14.594 0.717 277 HD11 ILE 39 3HD1 ILE 39 22.117 -15.115 -2.666 278 HD12 ILE 39 1HD1 ILE 39 21.003 -15.462 -1.343 279 HD13 ILE 39 2HD1 ILE 39 21.186 -13.809 -1.932 280 H THR 40 H THR 40 20.706 -11.059 -0.686 281 HA THR 40 HA THR 40 20.737 -11.712 -3.437 282 HB THR 40 HB THR 40 19.161 -9.512 -2.088 283 HG1 THR 40 HG1 THR 40 17.522 -11.213 -2.039 284 HG21 THR 40 3HG2 THR 40 19.078 -9.262 -4.469 285 HG22 THR 40 1HG2 THR 40 17.553 -9.980 -3.954 286 HG23 THR 40 2HG2 THR 40 18.797 -10.988 -4.694 287 H ASP 41 H ASP 41 21.555 -8.749 -1.672 288 HA ASP 41 HA ASP 41 22.386 -7.450 -4.146 289 HB2 ASP 41 2HB ASP 41 21.289 -6.513 -1.758 290 HB3 ASP 41 3HB ASP 41 22.966 -5.975 -1.712 291 H GLN 42 H GLN 42 23.728 -9.261 -1.590 292 HA GLN 42 HA GLN 42 25.857 -9.766 -0.953 293 HB2 GLN 42 2HB GLN 42 26.622 -8.988 -3.765 294 HB3 GLN 42 3HB GLN 42 27.422 -10.151 -2.716 295 HG2 GLN 42 2HG GLN 42 25.475 -11.615 -2.848 296 HG3 GLN 42 3HG GLN 42 24.669 -10.449 -3.895 297 HE21 GLN 42 1HE2 GLN 42 24.802 -12.822 -4.933 298 HE22 GLN 42 2HE2 GLN 42 26.041 -12.963 -6.128 299 H VAL 43 H VAL 43 26.160 -8.089 0.528 300 HA VAL 43 HA VAL 43 26.819 -5.461 0.038 301 HB VAL 43 HB VAL 43 27.861 -7.207 2.273 302 HG11 VAL 43 1HG1 VAL 43 27.895 -4.893 3.440 303 HG12 VAL 43 2HG1 VAL 43 29.226 -5.336 2.369 304 HG13 VAL 43 3HG1 VAL 43 27.955 -4.254 1.797 305 HG21 VAL 43 3HG2 VAL 43 25.612 -5.265 2.546 306 HG22 VAL 43 1HG2 VAL 43 25.306 -6.849 1.834 307 HG23 VAL 43 2HG2 VAL 43 25.954 -6.728 3.470 308 H THR 44 H THR 44 28.696 -4.311 -0.293 309 HA THR 44 HA THR 44 30.898 -5.835 -1.450 310 HB THR 44 HB THR 44 30.677 -2.831 -1.398 311 HG1 THR 44 HG1 THR 44 29.523 -2.988 -3.334 312 HG21 THR 44 3HG2 THR 44 31.743 -3.762 -3.808 313 HG22 THR 44 1HG2 THR 44 32.478 -4.767 -2.559 314 HG23 THR 44 2HG2 THR 44 32.622 -3.011 -2.476 315 H TRP 45 H TRP 45 32.488 -6.429 -0.137 316 HA TRP 45 HA TRP 45 33.236 -4.640 2.078 317 HB2 TRP 45 2HB TRP 45 32.631 -7.345 2.120 318 HB3 TRP 45 3HB TRP 45 34.392 -7.318 2.156 319 HD1 TRP 45 HD1 TRP 45 35.519 -5.899 4.239 320 HE1 TRP 45 HE1 TRP 45 34.659 -5.570 6.643 321 HE3 TRP 45 HE3 TRP 45 30.609 -7.128 3.521 322 HZ2 TRP 45 HZ2 TRP 45 32.222 -5.801 8.049 323 HZ3 TRP 45 HZ3 TRP 45 29.079 -7.050 5.447 324 HH2 TRP 45 HH2 TRP 45 29.871 -6.400 7.663 325 H ASP 46 H ASP 46 35.446 -4.250 2.506 326 HA ASP 46 HA ASP 46 37.376 -5.066 0.471 327 HB2 ASP 46 2HB ASP 46 36.224 -2.754 -0.013 328 HB3 ASP 46 3HB ASP 46 37.317 -2.173 1.240 329 H SER 47 H SER 47 39.502 -5.097 1.173 330 HA SER 47 HA SER 47 39.944 -4.407 4.002 331 HB2 SER 47 2HB SER 47 39.682 -6.927 3.421 332 HB3 SER 47 3HB SER 47 41.293 -6.769 2.722 333 HG SER 47 HG SER 47 40.834 -5.804 5.312 334 H SER 48 H SER 48 42.040 -3.742 4.566 335 HA SER 48 HA SER 48 43.350 -2.076 2.800 336 HB2 SER 48 2HB SER 48 43.672 -2.844 5.483 337 HB3 SER 48 3HB SER 48 45.230 -3.153 4.716 338 HG SER 48 HG SER 48 45.492 -1.066 4.365 339 H ASN 49 H ASN 49 45.727 -2.291 2.170 340 HA ASN 49 HA ASN 49 46.306 -5.008 1.202 341 HB2 ASN 49 2HB ASN 49 45.449 -2.982 -0.444 342 HB3 ASN 49 3HB ASN 49 47.200 -2.851 -0.578 343 HD21 ASN 49 1HD2 ASN 49 44.750 -4.003 -2.174 344 HD22 ASN 49 2HD2 ASN 49 45.401 -5.467 -2.820 345 H THR 50 H THR 50 48.119 -5.631 2.164 346 HA THR 50 HA THR 50 50.457 -3.898 2.057 347 HB THR 50 HB THR 50 50.610 -5.039 4.620 348 HG1 THR 50 HG1 THR 50 48.329 -5.253 4.597 349 HG21 THR 50 3HG2 THR 50 50.203 -2.506 5.223 350 HG22 THR 50 1HG2 THR 50 50.326 -2.299 3.477 351 HG23 THR 50 2HG2 THR 50 51.665 -3.010 4.377 352 H ASP 51 H ASP 51 49.549 -6.904 3.748 353 HA ASP 51 HA ASP 51 51.728 -8.258 2.295 354 HB2 ASP 51 2HB ASP 51 50.700 -9.003 5.037 355 HB3 ASP 51 3HB ASP 51 52.131 -9.630 4.223 356 H ILE 52 H ILE 52 48.543 -8.691 3.793 357 HA ILE 52 HA ILE 52 47.511 -10.202 1.664 358 HB ILE 52 HB ILE 52 48.978 -11.979 2.398 359 HG12 ILE 52 2HG1 ILE 52 47.314 -13.735 2.827 360 HG13 ILE 52 3HG1 ILE 52 46.127 -12.511 3.266 361 HG21 ILE 52 1HG2 ILE 52 49.501 -12.347 4.526 362 HG22 ILE 52 2HG2 ILE 52 48.509 -10.953 4.949 363 HG23 ILE 52 3HG2 ILE 52 47.807 -12.571 4.961 364 HD11 ILE 52 3HD1 ILE 52 45.737 -13.321 1.024 365 HD12 ILE 52 1HD1 ILE 52 46.219 -11.626 0.987 366 HD13 ILE 52 2HD1 ILE 52 47.380 -12.882 0.556 367 H LEU 53 H LEU 53 45.406 -9.810 1.741 368 HA LEU 53 HA LEU 53 43.983 -9.962 4.281 369 HB2 LEU 53 2HB LEU 53 43.874 -7.547 2.479 370 HB3 LEU 53 3HB LEU 53 42.844 -7.823 3.883 371 HG LEU 53 HG LEU 53 45.158 -7.944 5.138 372 HD11 LEU 53 1HD1 LEU 53 46.962 -7.232 4.055 373 HD12 LEU 53 2HD1 LEU 53 46.114 -5.814 3.439 374 HD13 LEU 53 3HD1 LEU 53 46.023 -7.344 2.566 375 HD21 LEU 53 3HD2 LEU 53 43.335 -5.760 4.444 376 HD22 LEU 53 1HD2 LEU 53 44.930 -5.232 4.980 377 HD23 LEU 53 2HD2 LEU 53 43.952 -6.272 6.016 378 H SER 54 H SER 54 42.118 -11.007 4.044 379 HA SER 54 HA SER 54 40.826 -11.013 1.400 380 HB2 SER 54 2HB SER 54 42.059 -13.235 2.693 381 HB3 SER 54 3HB SER 54 40.316 -13.506 2.693 382 HG SER 54 HG SER 54 42.047 -13.701 0.657 383 H ILE 55 H ILE 55 38.621 -10.932 1.393 384 HA ILE 55 HA ILE 55 37.290 -10.840 4.021 385 HB ILE 55 HB ILE 55 35.690 -9.197 2.910 386 HG12 ILE 55 2HG1 ILE 55 36.862 -9.778 0.611 387 HG13 ILE 55 3HG1 ILE 55 36.218 -8.169 0.918 388 HG21 ILE 55 1HG2 ILE 55 37.436 -7.293 3.173 389 HG22 ILE 55 2HG2 ILE 55 37.012 -8.282 4.569 390 HG23 ILE 55 3HG2 ILE 55 38.510 -8.592 3.692 391 HD11 ILE 55 3HD1 ILE 55 39.054 -8.735 1.609 392 HD12 ILE 55 1HD1 ILE 55 38.609 -8.499 -0.081 393 HD13 ILE 55 2HD1 ILE 55 38.292 -7.228 1.100 394 H SER 56 H SER 56 35.578 -12.127 4.261 395 HA SER 56 HA SER 56 34.329 -13.252 1.840 396 HB2 SER 56 2HB SER 56 35.594 -14.605 4.080 397 HB3 SER 56 3HB SER 56 33.919 -15.117 3.876 398 HG SER 56 HG SER 56 35.838 -16.092 2.573 399 H ASN 57 H ASN 57 32.319 -12.539 1.660 400 HA ASN 57 HA ASN 57 30.550 -12.622 3.969 401 HB2 ASN 57 2HB ASN 57 30.371 -10.129 2.354 402 HB3 ASN 57 3HB ASN 57 30.017 -10.393 4.059 403 HD21 ASN 57 1HD2 ASN 57 32.557 -9.893 1.708 404 HD22 ASN 57 2HD2 ASN 57 33.753 -9.351 2.831 405 H ALA 58 H ALA 58 28.348 -11.385 2.889 406 HA ALA 58 HA ALA 58 26.584 -11.691 1.482 407 HB1 ALA 58 1HB ALA 58 27.807 -12.870 -0.808 408 HB2 ALA 58 2HB ALA 58 27.161 -11.241 -0.611 409 HB3 ALA 58 3HB ALA 58 28.844 -11.577 -0.206 410 H SER 59 H SER 59 27.942 -13.938 3.093 411 HA SER 59 HA SER 59 27.187 -16.336 1.691 412 HB2 SER 59 2HB SER 59 28.668 -15.664 4.088 413 HB3 SER 59 3HB SER 59 27.526 -16.971 4.399 414 HG SER 59 HG SER 59 29.534 -17.757 3.639 415 H ASP 60 H ASP 60 25.898 -14.406 4.356 416 HA ASP 60 HA ASP 60 23.224 -15.004 3.824 417 HB2 ASP 60 2HB ASP 60 24.512 -17.146 5.099 418 HB3 ASP 60 3HB ASP 60 23.574 -16.350 6.359 419 H SER 61 H SER 61 25.645 -14.171 6.221 420 HA SER 61 HA SER 61 24.396 -11.737 6.895 421 HB2 SER 61 2HB SER 61 22.776 -13.048 8.102 422 HB3 SER 61 3HB SER 61 24.045 -13.996 8.876 423 HG SER 61 HG SER 61 23.096 -12.237 10.153 424 H HIS 62 H HIS 62 26.121 -14.144 8.878 425 HA HIS 62 HA HIS 62 28.094 -12.168 9.621 426 HB2 HIS 62 2HB HIS 62 28.998 -13.903 11.075 427 HB3 HIS 62 3HB HIS 62 27.251 -13.802 11.269 428 HD1 HIS 62 HD1 HIS 62 25.838 -15.772 10.259 429 HD2 HIS 62 HD2 HIS 62 29.954 -16.332 10.161 430 HE1 HIS 62 HE1 HIS 62 26.173 -18.220 9.788 431 H GLY 63 H GLY 63 29.993 -11.844 8.660 432 HA2 GLY 63 2HA GLY 63 30.791 -13.676 6.519 433 HA3 GLY 63 3HA GLY 63 31.389 -12.041 6.759 434 H LEU 64 H LEU 64 33.547 -12.382 6.834 435 HA LEU 64 HA LEU 64 34.746 -13.243 9.202 436 HB2 LEU 64 2HB LEU 64 35.921 -15.279 8.273 437 HB3 LEU 64 3HB LEU 64 34.225 -15.474 8.708 438 HG LEU 64 HG LEU 64 34.355 -14.777 5.954 439 HD11 LEU 64 1HD1 LEU 64 35.569 -16.912 5.239 440 HD12 LEU 64 2HD1 LEU 64 36.322 -16.863 6.833 441 HD13 LEU 64 3HD1 LEU 64 36.553 -15.525 5.708 442 HD21 LEU 64 3HD2 LEU 64 32.526 -16.000 6.759 443 HD22 LEU 64 1HD2 LEU 64 33.557 -17.201 7.537 444 HD23 LEU 64 2HD2 LEU 64 33.432 -17.152 5.778 445 H ALA 65 H ALA 65 36.090 -11.525 9.040 446 HA ALA 65 HA ALA 65 37.601 -11.071 6.595 447 HB1 ALA 65 1HB ALA 65 38.423 -9.322 8.679 448 HB2 ALA 65 2HB ALA 65 37.491 -8.950 7.228 449 HB3 ALA 65 3HB ALA 65 36.663 -9.435 8.708 450 H SER 66 H SER 66 39.541 -11.919 6.262 451 HA SER 66 HA SER 66 41.092 -12.839 8.590 452 HB2 SER 66 2HB SER 66 40.439 -14.651 7.077 453 HB3 SER 66 3HB SER 66 41.180 -13.803 5.720 454 HG SER 66 HG SER 66 42.460 -15.507 6.815 455 H THR 67 H THR 67 42.912 -11.805 9.045 456 HA THR 67 HA THR 67 44.360 -10.436 6.886 457 HB THR 67 HB THR 67 44.833 -8.536 8.410 458 HG1 THR 67 HG1 THR 67 43.582 -8.352 10.307 459 HG21 THR 67 3HG2 THR 67 42.655 -8.915 6.837 460 HG22 THR 67 1HG2 THR 67 43.025 -7.404 7.668 461 HG23 THR 67 2HG2 THR 67 41.889 -8.549 8.383 462 H LEU 68 H LEU 68 46.472 -10.869 6.874 463 HA LEU 68 HA LEU 68 47.774 -11.708 9.366 464 HB2 LEU 68 2HB LEU 68 48.414 -13.091 6.793 465 HB3 LEU 68 3HB LEU 68 48.725 -13.616 8.446 466 HG LEU 68 HG LEU 68 46.026 -13.626 8.441 467 HD11 LEU 68 1HD1 LEU 68 46.745 -14.591 5.687 468 HD12 LEU 68 2HD1 LEU 68 46.098 -12.981 5.997 469 HD13 LEU 68 3HD1 LEU 68 45.142 -14.407 6.400 470 HD21 LEU 68 3HD2 LEU 68 47.617 -15.939 7.365 471 HD22 LEU 68 1HD2 LEU 68 46.176 -15.976 8.381 472 HD23 LEU 68 2HD2 LEU 68 47.711 -15.422 9.049 473 H ASN 69 H ASN 69 48.132 -9.225 8.679 474 HA ASN 69 HA ASN 69 50.717 -9.151 7.265 475 HB2 ASN 69 2HB ASN 69 50.197 -7.080 6.309 476 HB3 ASN 69 3HB ASN 69 48.678 -7.964 6.197 477 HD21 ASN 69 1HD2 ASN 69 49.713 -5.035 6.642 478 HD22 ASN 69 2HD2 ASN 69 48.601 -4.436 7.821 479 H GLN 70 H GLN 70 52.275 -7.623 8.040 480 HA GLN 70 HA GLN 70 52.183 -7.348 10.926 481 HB2 GLN 70 2HB GLN 70 54.316 -6.996 8.842 482 HB3 GLN 70 3HB GLN 70 54.552 -6.383 10.473 483 HG2 GLN 70 2HG GLN 70 55.280 -8.387 11.051 484 HG3 GLN 70 3HG GLN 70 53.647 -9.001 10.797 485 HE21 GLN 70 1HE2 GLN 70 53.825 -10.862 9.771 486 HE22 GLN 70 2HE2 GLN 70 54.789 -11.158 8.368 487 H GLY 71 H GLY 71 50.796 -5.697 11.428 488 HA2 GLY 71 2HA GLY 71 51.477 -3.183 11.828 489 HA3 GLY 71 3HA GLY 71 51.141 -3.112 10.105 490 H ASN 72 H ASN 72 49.275 -2.070 9.863 491 HA ASN 72 HA ASN 72 46.961 -3.034 11.400 492 HB2 ASN 72 2HB ASN 72 46.115 -0.665 11.419 493 HB3 ASN 72 3HB ASN 72 47.539 -0.941 12.418 494 HD21 ASN 72 1HD2 ASN 72 46.341 0.454 9.456 495 HD22 ASN 72 2HD2 ASN 72 47.694 1.488 9.165 496 H VAL 73 H VAL 73 44.962 -2.962 10.331 497 HA VAL 73 HA VAL 73 45.038 -2.272 7.474 498 HB VAL 73 HB VAL 73 43.825 -4.275 6.871 499 HG11 VAL 73 1HG1 VAL 73 46.237 -4.428 6.813 500 HG12 VAL 73 2HG1 VAL 73 46.278 -4.884 8.518 501 HG13 VAL 73 3HG1 VAL 73 45.558 -5.971 7.329 502 HG21 VAL 73 3HG2 VAL 73 42.528 -5.197 8.438 503 HG22 VAL 73 1HG2 VAL 73 43.987 -5.998 9.021 504 HG23 VAL 73 2HG2 VAL 73 43.464 -4.479 9.749 505 H LYS 74 H LYS 74 43.218 -1.340 6.677 506 HA LYS 74 HA LYS 74 41.036 -0.879 8.597 507 HB2 LYS 74 2HB LYS 74 42.506 1.015 7.432 508 HB3 LYS 74 3HB LYS 74 41.322 0.794 6.150 509 HG2 LYS 74 2HG LYS 74 40.450 1.237 8.977 510 HG3 LYS 74 3HG LYS 74 40.900 2.592 7.939 511 HD2 LYS 74 2HD LYS 74 39.033 2.413 6.686 512 HD3 LYS 74 3HD LYS 74 39.051 0.648 6.730 513 HE2 LYS 74 2HE LYS 74 37.423 0.698 8.238 514 HE3 LYS 74 3HE LYS 74 38.507 1.529 9.353 515 HZ1 LYS 74 3HZ LYS 74 37.763 3.627 8.553 516 HZ2 LYS 74 1HZ LYS 74 36.387 2.710 8.912 517 HZ3 LYS 74 2HZ LYS 74 36.870 2.916 7.305 518 H VAL 75 H VAL 75 39.252 -2.005 8.231 519 HA VAL 75 HA VAL 75 38.644 -2.850 5.478 520 HB VAL 75 HB VAL 75 37.476 -3.995 8.013 521 HG11 VAL 75 1HG1 VAL 75 37.660 -5.315 5.326 522 HG12 VAL 75 2HG1 VAL 75 36.602 -5.706 6.683 523 HG13 VAL 75 3HG1 VAL 75 36.321 -4.245 5.736 524 HG21 VAL 75 3HG2 VAL 75 39.599 -4.717 8.345 525 HG22 VAL 75 1HG2 VAL 75 39.116 -5.936 7.166 526 HG23 VAL 75 2HG2 VAL 75 40.045 -4.529 6.650 527 H THR 76 H THR 76 36.807 -2.222 4.501 528 HA THR 76 HA THR 76 34.675 -0.997 6.084 529 HB THR 76 HB THR 76 34.676 0.693 3.955 530 HG1 THR 76 HG1 THR 76 36.594 0.609 3.070 531 HG21 THR 76 3HG2 THR 76 35.892 0.909 6.688 532 HG22 THR 76 1HG2 THR 76 34.387 1.601 6.082 533 HG23 THR 76 2HG2 THR 76 35.936 2.274 5.572 534 H ALA 77 H ALA 77 32.635 -0.981 5.066 535 HA ALA 77 HA ALA 77 32.388 -2.216 2.442 536 HB1 ALA 77 1HB ALA 77 32.265 -3.836 4.652 537 HB2 ALA 77 2HB ALA 77 30.567 -3.473 4.341 538 HB3 ALA 77 3HB ALA 77 31.562 -4.193 3.075 539 H SER 78 H SER 78 30.358 -1.887 1.458 540 HA SER 78 HA SER 78 28.368 -0.318 2.889 541 HB2 SER 78 2HB SER 78 28.394 1.547 1.431 542 HB3 SER 78 3HB SER 78 30.088 1.254 1.823 543 HG SER 78 HG SER 78 29.159 1.477 -0.541 544 H ILE 79 H ILE 79 26.321 -0.603 2.132 545 HA ILE 79 HA ILE 79 25.966 -2.032 -0.406 546 HB ILE 79 HB ILE 79 25.876 -3.782 1.233 547 HG12 ILE 79 2HG1 ILE 79 23.044 -3.010 0.501 548 HG13 ILE 79 3HG1 ILE 79 24.180 -3.794 -0.591 549 HG21 ILE 79 1HG2 ILE 79 24.747 -1.755 2.878 550 HG22 ILE 79 2HG2 ILE 79 23.628 -3.115 2.818 551 HG23 ILE 79 3HG2 ILE 79 25.296 -3.368 3.333 552 HD11 ILE 79 3HD1 ILE 79 24.133 -5.790 0.608 553 HD12 ILE 79 1HD1 ILE 79 23.441 -5.022 2.037 554 HD13 ILE 79 2HD1 ILE 79 22.455 -5.249 0.592 555 H GLY 80 H GLY 80 24.693 -0.814 -1.630 556 HA2 GLY 80 2HA GLY 80 22.942 0.510 -2.302 557 HA3 GLY 80 3HA GLY 80 22.083 -0.067 -0.882 558 H GLY 81 H GLY 81 22.050 1.170 0.987 559 HA2 GLY 81 2HA GLY 81 23.083 3.916 0.642 560 HA3 GLY 81 3HA GLY 81 21.607 3.520 1.510 561 H ILE 82 H ILE 82 22.446 1.410 3.078 562 HA ILE 82 HA ILE 82 23.919 2.824 5.107 563 HB ILE 82 HB ILE 82 23.069 -0.065 5.206 564 HG12 ILE 82 2HG1 ILE 82 21.129 1.303 4.591 565 HG13 ILE 82 3HG1 ILE 82 20.978 0.710 6.242 566 HG21 ILE 82 1HG2 ILE 82 24.235 0.135 7.118 567 HG22 ILE 82 2HG2 ILE 82 24.145 1.895 7.111 568 HG23 ILE 82 3HG2 ILE 82 22.782 0.945 7.702 569 HD11 ILE 82 3HD1 ILE 82 22.271 3.240 6.304 570 HD12 ILE 82 1HD1 ILE 82 20.820 3.364 5.309 571 HD13 ILE 82 2HD1 ILE 82 20.705 2.775 6.968 572 H GLN 83 H GLN 83 25.841 2.063 6.131 573 HA GLN 83 HA GLN 83 27.408 0.020 4.804 574 HB2 GLN 83 2HB GLN 83 29.343 1.545 4.449 575 HB3 GLN 83 3HB GLN 83 27.963 1.912 3.422 576 HG2 GLN 83 2HG GLN 83 27.581 3.468 5.689 577 HG3 GLN 83 3HG GLN 83 29.311 3.563 5.364 578 HE21 GLN 83 1HE2 GLN 83 26.205 4.586 4.448 579 HE22 GLN 83 2HE2 GLN 83 26.660 5.524 3.070 580 H GLY 84 H GLY 84 29.465 -0.407 5.948 581 HA2 GLY 84 2HA GLY 84 29.324 0.439 8.776 582 HA3 GLY 84 3HA GLY 84 29.626 -1.231 8.321 583 H SER 85 H SER 85 31.350 0.184 9.975 584 HA SER 85 HA SER 85 33.773 0.124 8.350 585 HB2 SER 85 2HB SER 85 34.436 2.277 8.712 586 HB3 SER 85 3HB SER 85 32.698 2.551 8.829 587 HG SER 85 HG SER 85 34.049 3.395 10.595 588 H THR 86 H THR 86 35.474 -0.758 9.386 589 HA THR 86 HA THR 86 35.396 -1.004 12.305 590 HB THR 86 HB THR 86 34.420 -3.086 11.458 591 HG1 THR 86 HG1 THR 86 35.587 -4.263 12.826 592 HG21 THR 86 3HG2 THR 86 35.127 -3.765 9.439 593 HG22 THR 86 1HG2 THR 86 36.476 -4.498 10.306 594 HG23 THR 86 2HG2 THR 86 36.656 -2.899 9.584 595 H ASP 87 H ASP 87 37.441 -1.432 13.275 596 HA ASP 87 HA ASP 87 39.732 -0.882 11.504 597 HB2 ASP 87 2HB ASP 87 39.407 1.066 12.837 598 HB3 ASP 87 3HB ASP 87 39.168 0.111 14.297 599 H PHE 88 H PHE 88 41.280 -2.370 11.485 600 HA PHE 88 HA PHE 88 41.485 -4.216 13.770 601 HB2 PHE 88 2HB PHE 88 40.911 -4.812 11.000 602 HB3 PHE 88 3HB PHE 88 42.401 -5.601 11.507 603 HD1 PHE 88 HD2 PHE 88 39.274 -4.886 13.396 604 HD2 PHE 88 HD1 PHE 88 41.898 -7.833 11.800 605 HE1 PHE 88 HE2 PHE 88 37.960 -6.649 14.499 606 HE2 PHE 88 HE1 PHE 88 40.588 -9.601 12.900 607 HZ PHE 88 HZ PHE 88 38.616 -9.010 14.253 608 H LYS 89 H LYS 89 43.492 -4.626 14.525 609 HA LYS 89 HA LYS 89 45.775 -3.564 12.997 610 HB2 LYS 89 2HB LYS 89 44.981 -3.069 15.828 611 HB3 LYS 89 3HB LYS 89 46.696 -3.192 15.462 612 HG2 LYS 89 2HG LYS 89 45.764 -1.491 13.511 613 HG3 LYS 89 3HG LYS 89 44.823 -1.035 14.934 614 HD2 LYS 89 2HD LYS 89 47.262 -1.242 16.045 615 HD3 LYS 89 3HD LYS 89 47.721 -0.780 14.405 616 HE2 LYS 89 2HE LYS 89 46.014 1.094 14.627 617 HE3 LYS 89 3HE LYS 89 45.976 0.712 16.347 618 HZ1 LYS 89 3HZ LYS 89 47.599 2.272 16.351 619 HZ2 LYS 89 1HZ LYS 89 48.093 1.950 14.765 620 HZ3 LYS 89 2HZ LYS 89 48.573 0.928 16.024 621 H VAL 90 H VAL 90 46.913 -5.282 12.376 622 HA VAL 90 HA VAL 90 47.083 -7.627 14.111 623 HB VAL 90 HB VAL 90 48.055 -7.226 11.278 624 HG11 VAL 90 1HG1 VAL 90 49.434 -8.898 12.094 625 HG12 VAL 90 2HG1 VAL 90 48.188 -9.546 13.163 626 HG13 VAL 90 3HG1 VAL 90 48.085 -9.815 11.422 627 HG21 VAL 90 3HG2 VAL 90 45.939 -9.171 11.758 628 HG22 VAL 90 1HG2 VAL 90 45.470 -7.521 12.167 629 HG23 VAL 90 2HG2 VAL 90 46.051 -7.896 10.545 630 H THR 91 H THR 91 48.604 -7.437 15.637 631 HA THR 91 HA THR 91 51.249 -6.408 14.845 632 HB THR 91 HB THR 91 51.644 -5.886 17.207 633 HG1 THR 91 HG1 THR 91 49.669 -5.998 18.578 634 HG21 THR 91 3HG2 THR 91 50.478 -3.907 17.209 635 HG22 THR 91 1HG2 THR 91 48.981 -4.662 16.666 636 HG23 THR 91 2HG2 THR 91 50.290 -4.376 15.519 637 H GLN 92 H GLN 92 53.072 -7.355 16.188 638 HA GLN 92 HA GLN 92 52.682 -10.266 16.374 639 HB2 GLN 92 2HB GLN 92 54.427 -9.010 14.781 640 HB3 GLN 92 3HB GLN 92 55.415 -9.106 16.233 641 HG2 GLN 92 2HG GLN 92 54.044 -11.579 15.362 642 HG3 GLN 92 3HG GLN 92 55.390 -11.007 14.379 643 HE21 GLN 92 1HE2 GLN 92 56.487 -12.940 15.004 644 HE22 GLN 92 2HE2 GLN 92 57.271 -13.039 16.540 Start of MODEL 19 1 H1 MET 1 H MET 1 5.117 0.165 9.092 2 HA MET 1 HA MET 1 3.172 0.606 7.458 3 HB2 MET 1 2HB MET 1 3.668 2.844 6.272 4 HB3 MET 1 3HB MET 1 2.807 2.884 7.804 5 HG2 MET 1 2HG MET 1 4.428 4.028 8.819 6 HG3 MET 1 3HG MET 1 5.700 3.044 8.099 7 HE1 MET 1 3HE MET 1 5.581 6.014 8.865 8 HE2 MET 1 1HE MET 1 5.895 7.105 7.515 9 HE3 MET 1 2HE MET 1 4.235 6.751 7.994 10 HA PRO 2 HA PRO 2 6.002 -0.917 4.472 11 HB2 PRO 2 2HB PRO 2 4.764 -0.266 2.145 12 HB3 PRO 2 3HB PRO 2 4.181 -1.543 3.219 13 HG2 PRO 2 2HG PRO 2 3.233 1.284 2.946 14 HG3 PRO 2 3HG PRO 2 2.282 -0.204 3.111 15 HD2 PRO 2 2HD PRO 2 2.747 1.467 5.191 16 HD3 PRO 2 3HD PRO 2 2.579 -0.289 5.395 17 H ALA 3 H ALA 3 7.658 -0.329 3.061 18 HA ALA 3 HA ALA 3 7.907 2.133 1.750 19 HB1 ALA 3 1HB ALA 3 8.386 2.321 4.533 20 HB2 ALA 3 2HB ALA 3 9.936 2.496 3.710 21 HB3 ALA 3 3HB ALA 3 8.594 3.563 3.298 22 H ALA 4 H ALA 4 10.219 2.542 1.044 23 HA ALA 4 HA ALA 4 11.775 0.046 0.973 24 HB1 ALA 4 1HB ALA 4 12.223 1.211 -1.498 25 HB2 ALA 4 2HB ALA 4 11.226 -0.207 -1.170 26 HB3 ALA 4 3HB ALA 4 10.486 1.392 -1.246 27 H LEU 5 H LEU 5 13.574 0.547 2.059 28 HA LEU 5 HA LEU 5 15.188 2.779 1.106 29 HB2 LEU 5 2HB LEU 5 13.856 2.668 3.702 30 HB3 LEU 5 3HB LEU 5 15.593 2.944 3.817 31 HG LEU 5 HG LEU 5 14.191 4.652 1.876 32 HD11 LEU 5 1HD1 LEU 5 13.236 6.117 3.557 33 HD12 LEU 5 2HD1 LEU 5 13.717 5.001 4.834 34 HD13 LEU 5 3HD1 LEU 5 12.502 4.516 3.651 35 HD21 LEU 5 3HD2 LEU 5 16.427 4.784 3.809 36 HD22 LEU 5 1HD2 LEU 5 15.576 6.290 3.469 37 HD23 LEU 5 2HD2 LEU 5 16.318 5.381 2.152 38 H VAL 6 H VAL 6 15.096 -0.308 1.372 39 HA VAL 6 HA VAL 6 16.498 -2.033 2.018 40 HB VAL 6 HB VAL 6 17.465 -1.455 -0.069 41 HG11 VAL 6 1HG1 VAL 6 19.132 0.332 -0.328 42 HG12 VAL 6 2HG1 VAL 6 17.573 0.955 0.216 43 HG13 VAL 6 3HG1 VAL 6 18.901 0.779 1.363 44 HG21 VAL 6 3HG2 VAL 6 19.370 -2.585 0.253 45 HG22 VAL 6 1HG2 VAL 6 20.022 -1.350 1.329 46 HG23 VAL 6 2HG2 VAL 6 18.932 -2.583 1.961 47 H SER 7 H SER 7 16.323 -1.792 4.315 48 HA SER 7 HA SER 7 18.326 -0.226 5.701 49 HB2 SER 7 2HB SER 7 15.783 -1.366 6.355 50 HB3 SER 7 3HB SER 7 16.982 -1.969 7.499 51 HG SER 7 HG SER 7 16.648 -0.104 8.422 52 H ILE 8 H ILE 8 20.307 -0.949 6.055 53 HA ILE 8 HA ILE 8 20.724 -3.856 6.308 54 HB ILE 8 HB ILE 8 22.956 -2.021 5.549 55 HG12 ILE 8 2HG1 ILE 8 22.200 -2.857 3.115 56 HG13 ILE 8 3HG1 ILE 8 20.613 -2.756 3.871 57 HG21 ILE 8 1HG2 ILE 8 24.023 -3.917 4.891 58 HG22 ILE 8 2HG2 ILE 8 22.943 -4.622 6.092 59 HG23 ILE 8 3HG2 ILE 8 22.534 -4.711 4.379 60 HD11 ILE 8 3HD1 ILE 8 22.574 -0.485 3.901 61 HD12 ILE 8 1HD1 ILE 8 21.388 -0.718 2.617 62 HD13 ILE 8 2HD1 ILE 8 20.851 -0.448 4.276 63 H SER 9 H SER 9 21.299 -4.503 8.265 64 HA SER 9 HA SER 9 22.394 -2.551 10.151 65 HB2 SER 9 2HB SER 9 20.525 -4.678 10.386 66 HB3 SER 9 3HB SER 9 21.928 -5.100 11.369 67 HG SER 9 HG SER 9 21.349 -3.631 12.744 68 H VAL 10 H VAL 10 24.541 -2.428 10.143 69 HA VAL 10 HA VAL 10 26.104 -4.897 9.805 70 HB VAL 10 HB VAL 10 26.544 -3.046 8.194 71 HG11 VAL 10 1HG1 VAL 10 27.033 -0.952 8.815 72 HG12 VAL 10 2HG1 VAL 10 26.375 -1.414 10.386 73 HG13 VAL 10 3HG1 VAL 10 28.114 -1.487 10.101 74 HG21 VAL 10 3HG2 VAL 10 28.499 -4.091 8.043 75 HG22 VAL 10 1HG2 VAL 10 29.138 -3.003 9.276 76 HG23 VAL 10 2HG2 VAL 10 28.429 -4.548 9.745 77 H SER 11 H SER 11 27.435 -5.609 11.375 78 HA SER 11 HA SER 11 27.636 -3.971 13.817 79 HB2 SER 11 2HB SER 11 27.389 -6.955 13.458 80 HB3 SER 11 3HB SER 11 27.972 -6.242 14.961 81 HG SER 11 HG SER 11 25.664 -6.653 14.872 82 HA PRO 12 HA PRO 12 31.911 -4.619 12.062 83 HB2 PRO 12 2HB PRO 12 32.644 -2.010 12.218 84 HB3 PRO 12 3HB PRO 12 31.814 -2.692 10.815 85 HG2 PRO 12 2HG PRO 12 30.691 -1.115 13.098 86 HG3 PRO 12 3HG PRO 12 30.340 -0.980 11.365 87 HD2 PRO 12 2HD PRO 12 28.704 -2.282 13.086 88 HD3 PRO 12 3HD PRO 12 28.892 -2.774 11.391 89 H THR 13 H THR 13 33.854 -4.591 13.211 90 HA THR 13 HA THR 13 33.608 -3.856 16.056 91 HB THR 13 HB THR 13 33.816 -6.202 16.020 92 HG1 THR 13 HG1 THR 13 35.280 -5.390 17.495 93 HG21 THR 13 3HG2 THR 13 36.086 -5.901 14.050 94 HG22 THR 13 1HG2 THR 13 34.450 -6.426 13.652 95 HG23 THR 13 2HG2 THR 13 35.464 -7.418 14.700 96 H ASN 14 H ASN 14 34.726 -2.072 16.480 97 HA ASN 14 HA ASN 14 37.140 -1.476 14.937 98 HB2 ASN 14 2HB ASN 14 35.482 0.226 16.810 99 HB3 ASN 14 3HB ASN 14 36.957 0.777 16.021 100 HD21 ASN 14 1HD2 ASN 14 36.238 2.260 14.637 101 HD22 ASN 14 2HD2 ASN 14 35.052 1.984 13.411 102 H SER 15 H SER 15 38.866 -2.483 15.779 103 HA SER 15 HA SER 15 40.030 -1.631 18.173 104 HB2 SER 15 2HB SER 15 38.016 -3.484 18.676 105 HB3 SER 15 3HB SER 15 39.497 -4.440 18.731 106 HG SER 15 HG SER 15 38.598 -3.053 20.666 107 H THR 16 H THR 16 41.646 -3.657 18.909 108 HA THR 16 HA THR 16 43.048 -4.323 16.405 109 HB THR 16 HB THR 16 44.449 -2.888 17.660 110 HG1 THR 16 HG1 THR 16 46.198 -4.234 18.015 111 HG21 THR 16 3HG2 THR 16 43.339 -2.932 19.797 112 HG22 THR 16 1HG2 THR 16 45.033 -3.357 20.037 113 HG23 THR 16 2HG2 THR 16 43.798 -4.616 20.048 114 H VAL 17 H VAL 17 44.199 -6.345 16.313 115 HA VAL 17 HA VAL 17 43.279 -8.386 18.215 116 HB VAL 17 HB VAL 17 42.979 -9.974 16.304 117 HG11 VAL 17 1HG1 VAL 17 40.768 -9.498 16.180 118 HG12 VAL 17 2HG1 VAL 17 41.189 -8.342 17.445 119 HG13 VAL 17 3HG1 VAL 17 41.043 -7.804 15.772 120 HG21 VAL 17 3HG2 VAL 17 44.281 -8.787 14.627 121 HG22 VAL 17 1HG2 VAL 17 42.628 -9.031 14.063 122 HG23 VAL 17 2HG2 VAL 17 43.133 -7.449 14.657 123 H ALA 18 H ALA 18 44.605 -10.280 18.310 124 HA ALA 18 HA ALA 18 47.384 -9.711 18.096 125 HB1 ALA 18 1HB ALA 18 47.441 -11.280 19.660 126 HB2 ALA 18 2HB ALA 18 45.747 -11.671 19.358 127 HB3 ALA 18 3HB ALA 18 47.017 -12.490 18.449 128 H LYS 19 H LYS 19 48.894 -11.371 17.059 129 HA LYS 19 HA LYS 19 48.717 -11.243 14.309 130 HB2 LYS 19 2HB LYS 19 50.532 -12.268 16.176 131 HB3 LYS 19 3HB LYS 19 50.144 -13.627 15.129 132 HG2 LYS 19 2HG LYS 19 50.974 -10.947 14.059 133 HG3 LYS 19 3HG LYS 19 52.130 -12.219 14.463 134 HD2 LYS 19 2HD LYS 19 50.957 -13.732 12.900 135 HD3 LYS 19 3HD LYS 19 49.882 -12.404 12.457 136 HE2 LYS 19 2HE LYS 19 51.363 -11.904 10.868 137 HE3 LYS 19 3HE LYS 19 52.413 -11.330 12.163 138 HZ1 LYS 19 3HZ LYS 19 53.641 -13.262 12.142 139 HZ2 LYS 19 1HZ LYS 19 53.293 -13.071 10.497 140 HZ3 LYS 19 2HZ LYS 19 52.414 -14.180 11.424 141 H GLY 20 H GLY 20 47.563 -12.274 12.812 142 HA2 GLY 20 2HA GLY 20 46.210 -13.826 11.797 143 HA3 GLY 20 3HA GLY 20 46.942 -15.020 12.858 144 H LEU 21 H LEU 21 44.152 -13.206 12.158 145 HA LEU 21 HA LEU 21 42.612 -14.669 14.075 146 HB2 LEU 21 2HB LEU 21 43.705 -12.287 14.980 147 HB3 LEU 21 3HB LEU 21 42.056 -11.858 14.530 148 HG LEU 21 HG LEU 21 42.067 -14.274 16.094 149 HD11 LEU 21 1HD1 LEU 21 44.117 -13.506 17.073 150 HD12 LEU 21 2HD1 LEU 21 42.807 -13.232 18.221 151 HD13 LEU 21 3HD1 LEU 21 43.459 -11.884 17.289 152 HD21 LEU 21 3HD2 LEU 21 40.084 -13.034 15.923 153 HD22 LEU 21 1HD2 LEU 21 40.893 -11.519 16.326 154 HD23 LEU 21 2HD2 LEU 21 40.650 -12.746 17.569 155 H GLN 22 H GLN 22 40.424 -14.656 13.608 156 HA GLN 22 HA GLN 22 39.616 -13.048 11.276 157 HB2 GLN 22 2HB GLN 22 38.567 -15.813 11.844 158 HB3 GLN 22 3HB GLN 22 38.419 -14.877 10.363 159 HG2 GLN 22 2HG GLN 22 40.170 -15.981 9.588 160 HG3 GLN 22 3HG GLN 22 41.156 -15.124 10.771 161 HE21 GLN 22 1HE2 GLN 22 42.572 -16.713 11.257 162 HE22 GLN 22 2HE2 GLN 22 42.133 -18.211 11.998 163 H GLU 23 H GLU 23 37.650 -12.071 11.353 164 HA GLU 23 HA GLU 23 35.963 -12.606 13.705 165 HB2 GLU 23 2HB GLU 23 37.315 -10.153 12.968 166 HB3 GLU 23 3HB GLU 23 35.575 -9.915 13.047 167 HG2 GLU 23 2HG GLU 23 36.956 -11.330 15.274 168 HG3 GLU 23 3HG GLU 23 37.063 -9.574 15.159 169 H ASN 24 H ASN 24 33.967 -13.164 13.166 170 HA ASN 24 HA ASN 24 33.043 -12.796 10.444 171 HB2 ASN 24 2HB ASN 24 31.235 -14.274 11.033 172 HB3 ASN 24 3HB ASN 24 32.724 -14.944 11.693 173 HD21 ASN 24 1HD2 ASN 24 29.686 -13.441 12.415 174 HD22 ASN 24 2HD2 ASN 24 29.704 -13.749 14.115 175 H PHE 25 H PHE 25 31.708 -11.248 9.773 176 HA PHE 25 HA PHE 25 29.592 -10.161 11.261 177 HB2 PHE 25 2HB PHE 25 32.208 -8.837 11.569 178 HB3 PHE 25 3HB PHE 25 30.879 -7.759 11.154 179 HD1 PHE 25 HD2 PHE 25 28.617 -8.826 12.568 180 HD2 PHE 25 HD1 PHE 25 32.684 -8.577 13.800 181 HE1 PHE 25 HE2 PHE 25 27.900 -8.807 14.921 182 HE2 PHE 25 HE1 PHE 25 31.973 -8.559 16.155 183 HZ PHE 25 HZ PHE 25 29.578 -8.673 16.718 184 H LYS 26 H LYS 26 28.171 -9.420 9.828 185 HA LYS 26 HA LYS 26 29.068 -8.010 7.447 186 HB2 LYS 26 2HB LYS 26 28.639 -10.715 7.261 187 HB3 LYS 26 3HB LYS 26 27.071 -10.063 6.804 188 HG2 LYS 26 2HG LYS 26 28.540 -8.511 5.266 189 HG3 LYS 26 3HG LYS 26 29.697 -9.833 5.434 190 HD2 LYS 26 2HD LYS 26 28.396 -10.255 3.477 191 HD3 LYS 26 3HD LYS 26 27.879 -11.400 4.717 192 HE2 LYS 26 2HE LYS 26 26.394 -8.871 4.692 193 HE3 LYS 26 3HE LYS 26 26.209 -9.841 3.232 194 HZ1 LYS 26 3HZ LYS 26 24.885 -10.185 5.615 195 HZ2 LYS 26 1HZ LYS 26 26.008 -11.450 5.565 196 HZ3 LYS 26 2HZ LYS 26 24.900 -11.253 4.303 197 H ALA 27 H ALA 27 27.287 -6.989 6.278 198 HA ALA 27 HA ALA 27 25.137 -6.245 8.123 199 HB1 ALA 27 1HB ALA 27 24.979 -4.216 7.022 200 HB2 ALA 27 2HB ALA 27 26.705 -4.568 6.918 201 HB3 ALA 27 3HB ALA 27 25.660 -4.857 5.526 202 H THR 28 H THR 28 23.118 -6.918 7.828 203 HA THR 28 HA THR 28 22.459 -8.331 5.348 204 HB THR 28 HB THR 28 22.016 -9.647 7.294 205 HG1 THR 28 HG1 THR 28 20.389 -9.874 5.777 206 HG21 THR 28 3HG2 THR 28 19.960 -8.285 8.654 207 HG22 THR 28 1HG2 THR 28 21.270 -7.124 8.440 208 HG23 THR 28 2HG2 THR 28 21.578 -8.662 9.245 209 H GLY 29 H GLY 29 21.525 -7.133 3.823 210 HA2 GLY 29 2HA GLY 29 20.004 -4.761 4.520 211 HA3 GLY 29 3HA GLY 29 20.412 -5.302 2.899 212 H ILE 30 H ILE 30 17.892 -4.737 4.857 213 HA ILE 30 HA ILE 30 16.231 -6.762 3.510 214 HB ILE 30 HB ILE 30 15.783 -5.719 6.309 215 HG12 ILE 30 2HG1 ILE 30 16.161 -8.526 6.268 216 HG13 ILE 30 3HG1 ILE 30 17.477 -7.823 5.335 217 HG21 ILE 30 1HG2 ILE 30 14.373 -7.937 4.835 218 HG22 ILE 30 2HG2 ILE 30 13.988 -7.308 6.436 219 HG23 ILE 30 3HG2 ILE 30 13.746 -6.298 5.011 220 HD11 ILE 30 3HD1 ILE 30 16.819 -7.515 8.218 221 HD12 ILE 30 1HD1 ILE 30 18.368 -7.837 7.441 222 HD13 ILE 30 2HD1 ILE 30 17.672 -6.217 7.384 223 H PHE 31 H PHE 31 14.387 -6.053 2.573 224 HA PHE 31 HA PHE 31 13.932 -3.161 2.596 225 HB2 PHE 31 2HB PHE 31 12.690 -5.195 0.741 226 HB3 PHE 31 3HB PHE 31 12.764 -3.449 0.525 227 HD1 PHE 31 HD1 PHE 31 14.722 -6.563 0.482 228 HD2 PHE 31 HD2 PHE 31 14.689 -2.396 -0.385 229 HE1 PHE 31 HE1 PHE 31 16.814 -6.814 -0.788 230 HE2 PHE 31 HE2 PHE 31 16.780 -2.640 -1.658 231 HZ PHE 31 HZ PHE 31 17.845 -4.852 -1.861 232 H THR 32 H THR 32 12.111 -2.243 3.358 233 HA THR 32 HA THR 32 10.446 -3.668 5.128 234 HB THR 32 HB THR 32 9.189 -1.240 4.175 235 HG1 THR 32 HG1 THR 32 11.753 -0.769 5.246 236 HG21 THR 32 3HG2 THR 32 10.427 -2.164 6.760 237 HG22 THR 32 1HG2 THR 32 8.716 -2.026 6.358 238 HG23 THR 32 2HG2 THR 32 9.691 -0.572 6.574 239 H ASP 33 H ASP 33 10.264 -3.104 1.729 240 HA ASP 33 HA ASP 33 7.495 -4.096 1.671 241 HB2 ASP 33 2HB ASP 33 8.514 -1.892 0.433 242 HB3 ASP 33 3HB ASP 33 8.675 -3.099 -0.839 243 H ASN 34 H ASN 34 10.264 -5.493 1.816 244 HA ASN 34 HA ASN 34 9.547 -7.834 0.471 245 HB2 ASN 34 2HB ASN 34 10.961 -5.858 -1.163 246 HB3 ASN 34 3HB ASN 34 11.760 -7.427 -1.126 247 HD21 ASN 34 1HD2 ASN 34 9.905 -9.250 -1.163 248 HD22 ASN 34 2HD2 ASN 34 8.849 -9.095 -2.522 249 H SER 35 H SER 35 10.210 -8.435 2.619 250 HA SER 35 HA SER 35 12.687 -8.067 3.771 251 HB2 SER 35 2HB SER 35 10.877 -10.489 3.920 252 HB3 SER 35 3HB SER 35 12.249 -10.207 4.991 253 HG SER 35 HG SER 35 11.046 -8.908 6.106 254 H ASN 36 H ASN 36 14.611 -8.397 2.879 255 HA ASN 36 HA ASN 36 15.138 -10.989 1.611 256 HB2 ASN 36 2HB ASN 36 14.828 -8.737 0.100 257 HB3 ASN 36 3HB ASN 36 16.564 -8.715 0.396 258 HD21 ASN 36 1HD2 ASN 36 17.293 -9.270 -1.573 259 HD22 ASN 36 2HD2 ASN 36 16.948 -10.771 -2.355 260 H SER 37 H SER 37 17.533 -11.366 1.355 261 HA SER 37 HA SER 37 18.945 -10.256 3.690 262 HB2 SER 37 2HB SER 37 20.253 -12.376 3.682 263 HB3 SER 37 3HB SER 37 18.529 -12.634 3.947 264 HG SER 37 HG SER 37 18.353 -13.191 1.738 265 H ASP 38 H ASP 38 21.348 -10.235 3.478 266 HA ASP 38 HA ASP 38 22.083 -8.827 1.104 267 HB2 ASP 38 2HB ASP 38 22.980 -8.361 3.414 268 HB3 ASP 38 3HB ASP 38 23.927 -9.840 3.273 269 H ILE 39 H ILE 39 22.250 -9.956 -0.738 270 HA ILE 39 HA ILE 39 24.414 -11.657 -1.221 271 HB ILE 39 HB ILE 39 23.287 -13.346 0.063 272 HG12 ILE 39 2HG1 ILE 39 23.042 -15.110 -1.623 273 HG13 ILE 39 3HG1 ILE 39 22.905 -13.895 -2.889 274 HG21 ILE 39 1HG2 ILE 39 20.907 -13.025 -1.755 275 HG22 ILE 39 2HG2 ILE 39 21.048 -14.090 -0.357 276 HG23 ILE 39 3HG2 ILE 39 21.019 -12.341 -0.134 277 HD11 ILE 39 3HD1 ILE 39 25.175 -15.142 -2.348 278 HD12 ILE 39 1HD1 ILE 39 25.128 -13.472 -2.911 279 HD13 ILE 39 2HD1 ILE 39 25.326 -13.818 -1.193 280 H THR 40 H THR 40 21.078 -10.913 -2.130 281 HA THR 40 HA THR 40 21.332 -11.551 -4.871 282 HB THR 40 HB THR 40 19.456 -9.409 -3.943 283 HG1 THR 40 HG1 THR 40 19.521 -12.088 -3.111 284 HG21 THR 40 3HG2 THR 40 19.767 -11.019 -6.253 285 HG22 THR 40 1HG2 THR 40 18.509 -9.830 -5.915 286 HG23 THR 40 2HG2 THR 40 18.274 -11.518 -5.460 287 H ASP 41 H ASP 41 21.705 -8.513 -3.083 288 HA ASP 41 HA ASP 41 22.355 -7.028 -5.470 289 HB2 ASP 41 2HB ASP 41 22.361 -6.320 -2.536 290 HB3 ASP 41 3HB ASP 41 22.877 -5.195 -3.789 291 H GLN 42 H GLN 42 24.039 -8.962 -3.230 292 HA GLN 42 HA GLN 42 26.238 -9.453 -2.917 293 HB2 GLN 42 2HB GLN 42 26.037 -8.592 -5.733 294 HB3 GLN 42 3HB GLN 42 27.659 -8.567 -5.054 295 HG2 GLN 42 2HG GLN 42 27.833 -10.778 -5.135 296 HG3 GLN 42 3HG GLN 42 26.246 -11.009 -4.403 297 HE21 GLN 42 1HE2 GLN 42 25.658 -12.673 -5.749 298 HE22 GLN 42 2HE2 GLN 42 25.314 -12.448 -7.427 299 H VAL 43 H VAL 43 26.752 -8.165 -1.194 300 HA VAL 43 HA VAL 43 27.250 -5.378 -1.376 301 HB VAL 43 HB VAL 43 26.608 -6.416 0.739 302 HG11 VAL 43 1HG1 VAL 43 27.892 -8.532 0.344 303 HG12 VAL 43 2HG1 VAL 43 29.351 -7.658 0.814 304 HG13 VAL 43 3HG1 VAL 43 28.037 -7.870 1.971 305 HG21 VAL 43 3HG2 VAL 43 28.413 -4.412 0.402 306 HG22 VAL 43 1HG2 VAL 43 27.718 -4.884 1.953 307 HG23 VAL 43 2HG2 VAL 43 29.300 -5.499 1.471 308 H THR 44 H THR 44 29.182 -4.240 -1.377 309 HA THR 44 HA THR 44 31.407 -5.628 -2.630 310 HB THR 44 HB THR 44 31.664 -2.748 -1.993 311 HG1 THR 44 HG1 THR 44 30.134 -2.123 -3.478 312 HG21 THR 44 3HG2 THR 44 32.923 -4.544 -3.657 313 HG22 THR 44 1HG2 THR 44 33.052 -2.788 -3.754 314 HG23 THR 44 2HG2 THR 44 31.884 -3.644 -4.762 315 H TRP 45 H TRP 45 32.870 -6.568 -1.372 316 HA TRP 45 HA TRP 45 33.571 -5.278 1.181 317 HB2 TRP 45 2HB TRP 45 34.356 -7.509 1.906 318 HB3 TRP 45 3HB TRP 45 32.647 -7.510 1.481 319 HD1 TRP 45 HD1 TRP 45 36.052 -8.654 0.069 320 HE1 TRP 45 HE1 TRP 45 35.630 -10.592 -1.571 321 HE3 TRP 45 HE3 TRP 45 30.940 -8.610 0.060 322 HZ2 TRP 45 HZ2 TRP 45 33.422 -11.925 -2.718 323 HZ3 TRP 45 HZ3 TRP 45 29.749 -10.250 -1.336 324 HH2 TRP 45 HH2 TRP 45 30.966 -11.872 -2.696 325 H ASP 46 H ASP 46 35.727 -4.995 1.736 326 HA ASP 46 HA ASP 46 37.808 -5.813 -0.111 327 HB2 ASP 46 2HB ASP 46 36.740 -3.087 -0.028 328 HB3 ASP 46 3HB ASP 46 38.484 -3.160 0.210 329 H SER 47 H SER 47 39.840 -5.876 0.811 330 HA SER 47 HA SER 47 40.028 -5.040 3.628 331 HB2 SER 47 2HB SER 47 39.753 -7.391 3.769 332 HB3 SER 47 3HB SER 47 40.823 -7.677 2.396 333 HG SER 47 HG SER 47 41.424 -7.277 5.047 334 H SER 48 H SER 48 42.088 -4.428 4.360 335 HA SER 48 HA SER 48 43.644 -2.942 2.626 336 HB2 SER 48 2HB SER 48 44.206 -2.296 4.721 337 HB3 SER 48 3HB SER 48 43.893 -3.894 5.398 338 HG SER 48 HG SER 48 46.090 -3.436 5.537 339 H ASN 49 H ASN 49 45.911 -3.247 2.000 340 HA ASN 49 HA ASN 49 46.536 -6.068 1.423 341 HB2 ASN 49 2HB ASN 49 46.165 -3.843 -0.398 342 HB3 ASN 49 3HB ASN 49 47.773 -4.540 -0.567 343 HD21 ASN 49 1HD2 ASN 49 44.776 -4.663 -1.765 344 HD22 ASN 49 2HD2 ASN 49 44.725 -6.299 -2.317 345 H THR 50 H THR 50 48.570 -6.740 1.835 346 HA THR 50 HA THR 50 50.831 -5.034 1.974 347 HB THR 50 HB THR 50 50.816 -5.978 4.641 348 HG1 THR 50 HG1 THR 50 48.946 -4.986 5.453 349 HG21 THR 50 3HG2 THR 50 52.036 -4.068 4.329 350 HG22 THR 50 1HG2 THR 50 50.556 -3.359 4.974 351 HG23 THR 50 2HG2 THR 50 50.849 -3.357 3.235 352 H ASP 51 H ASP 51 49.831 -7.837 3.936 353 HA ASP 51 HA ASP 51 51.966 -9.390 2.624 354 HB2 ASP 51 2HB ASP 51 51.013 -9.549 5.491 355 HB3 ASP 51 3HB ASP 51 52.180 -10.646 4.758 356 H ILE 52 H ILE 52 49.315 -10.254 4.828 357 HA ILE 52 HA ILE 52 48.124 -11.892 2.708 358 HB ILE 52 HB ILE 52 48.656 -12.935 5.491 359 HG12 ILE 52 2HG1 ILE 52 49.936 -13.766 2.880 360 HG13 ILE 52 3HG1 ILE 52 50.704 -12.726 4.074 361 HG21 ILE 52 1HG2 ILE 52 48.056 -15.048 3.813 362 HG22 ILE 52 2HG2 ILE 52 46.980 -14.320 5.005 363 HG23 ILE 52 3HG2 ILE 52 46.925 -13.785 3.325 364 HD11 ILE 52 3HD1 ILE 52 51.556 -14.913 4.375 365 HD12 ILE 52 1HD1 ILE 52 50.458 -14.595 5.718 366 HD13 ILE 52 2HD1 ILE 52 49.938 -15.614 4.375 367 H LEU 53 H LEU 53 46.369 -10.515 2.569 368 HA LEU 53 HA LEU 53 44.651 -10.400 4.961 369 HB2 LEU 53 2HB LEU 53 44.750 -8.422 2.690 370 HB3 LEU 53 3HB LEU 53 43.749 -8.310 4.136 371 HG LEU 53 HG LEU 53 45.458 -6.812 4.570 372 HD11 LEU 53 1HD1 LEU 53 45.185 -8.798 6.246 373 HD12 LEU 53 2HD1 LEU 53 46.486 -7.626 6.455 374 HD13 LEU 53 3HD1 LEU 53 46.823 -9.197 5.727 375 HD21 LEU 53 3HD2 LEU 53 47.636 -6.921 3.831 376 HD22 LEU 53 1HD2 LEU 53 46.788 -7.779 2.545 377 HD23 LEU 53 2HD2 LEU 53 47.648 -8.685 3.790 378 H SER 54 H SER 54 42.726 -11.347 4.806 379 HA SER 54 HA SER 54 41.527 -11.733 2.155 380 HB2 SER 54 2HB SER 54 42.602 -13.811 3.856 381 HB3 SER 54 3HB SER 54 40.871 -14.043 3.611 382 HG SER 54 HG SER 54 41.276 -13.878 1.347 383 H ILE 55 H ILE 55 39.325 -11.602 2.094 384 HA ILE 55 HA ILE 55 37.841 -11.487 4.609 385 HB ILE 55 HB ILE 55 38.394 -9.170 4.236 386 HG12 ILE 55 2HG1 ILE 55 35.678 -8.933 3.216 387 HG13 ILE 55 3HG1 ILE 55 35.807 -10.173 4.458 388 HG21 ILE 55 1HG2 ILE 55 37.173 -9.471 1.495 389 HG22 ILE 55 2HG2 ILE 55 37.827 -7.990 2.194 390 HG23 ILE 55 3HG2 ILE 55 38.899 -9.344 1.836 391 HD11 ILE 55 3HD1 ILE 55 37.237 -8.009 5.457 392 HD12 ILE 55 1HD1 ILE 55 35.800 -7.310 4.714 393 HD13 ILE 55 2HD1 ILE 55 35.635 -8.553 5.954 394 H SER 56 H SER 56 35.960 -12.524 4.462 395 HA SER 56 HA SER 56 34.804 -12.949 1.784 396 HB2 SER 56 2HB SER 56 34.493 -14.964 3.991 397 HB3 SER 56 3HB SER 56 34.344 -15.194 2.249 398 HG SER 56 HG SER 56 36.466 -15.360 2.069 399 H ASN 57 H ASN 57 32.728 -12.404 1.549 400 HA ASN 57 HA ASN 57 31.001 -12.230 3.902 401 HB2 ASN 57 2HB ASN 57 30.991 -9.970 1.924 402 HB3 ASN 57 3HB ASN 57 30.372 -10.001 3.572 403 HD21 ASN 57 1HD2 ASN 57 31.593 -9.167 5.113 404 HD22 ASN 57 2HD2 ASN 57 33.270 -8.778 4.971 405 H ALA 58 H ALA 58 30.185 -14.184 2.845 406 HA ALA 58 HA ALA 58 28.077 -13.501 0.945 407 HB1 ALA 58 1HB ALA 58 30.436 -14.798 0.129 408 HB2 ALA 58 2HB ALA 58 29.168 -16.025 0.154 409 HB3 ALA 58 3HB ALA 58 28.955 -14.556 -0.798 410 H SER 59 H SER 59 28.596 -14.516 3.829 411 HA SER 59 HA SER 59 27.286 -17.080 3.873 412 HB2 SER 59 2HB SER 59 28.101 -17.198 5.964 413 HB3 SER 59 3HB SER 59 28.906 -15.662 5.643 414 HG SER 59 HG SER 59 27.409 -14.619 6.765 415 H ASP 60 H ASP 60 26.242 -13.912 3.567 416 HA ASP 60 HA ASP 60 24.145 -13.019 3.439 417 HB2 ASP 60 2HB ASP 60 23.585 -15.468 2.757 418 HB3 ASP 60 3HB ASP 60 22.931 -15.596 4.388 419 H SER 61 H SER 61 25.802 -13.466 5.980 420 HA SER 61 HA SER 61 24.115 -12.022 7.731 421 HB2 SER 61 2HB SER 61 24.048 -13.809 9.547 422 HB3 SER 61 3HB SER 61 22.958 -14.052 8.181 423 HG SER 61 HG SER 61 24.068 -15.968 8.686 424 H HIS 62 H HIS 62 26.444 -14.574 8.545 425 HA HIS 62 HA HIS 62 28.069 -12.636 9.963 426 HB2 HIS 62 2HB HIS 62 29.265 -14.521 10.848 427 HB3 HIS 62 3HB HIS 62 27.547 -14.904 10.900 428 HD1 HIS 62 HD1 HIS 62 26.697 -16.766 9.316 429 HD2 HIS 62 HD2 HIS 62 30.794 -16.101 9.121 430 HE1 HIS 62 HE1 HIS 62 27.637 -18.728 8.055 431 H GLY 63 H GLY 63 29.859 -11.708 9.200 432 HA2 GLY 63 2HA GLY 63 30.735 -12.326 6.515 433 HA3 GLY 63 3HA GLY 63 31.341 -11.035 7.543 434 H LEU 64 H LEU 64 33.497 -11.479 7.075 435 HA LEU 64 HA LEU 64 34.798 -13.279 8.791 436 HB2 LEU 64 2HB LEU 64 34.223 -15.108 7.506 437 HB3 LEU 64 3HB LEU 64 34.304 -14.201 5.997 438 HG LEU 64 HG LEU 64 36.701 -14.293 6.000 439 HD11 LEU 64 1HD1 LEU 64 37.692 -15.833 7.898 440 HD12 LEU 64 2HD1 LEU 64 36.310 -15.212 8.798 441 HD13 LEU 64 3HD1 LEU 64 37.498 -14.095 8.128 442 HD21 LEU 64 3HD2 LEU 64 35.090 -16.429 5.583 443 HD22 LEU 64 1HD2 LEU 64 36.209 -17.084 6.778 444 HD23 LEU 64 2HD2 LEU 64 36.825 -16.415 5.267 445 H ALA 65 H ALA 65 36.241 -11.712 9.266 446 HA ALA 65 HA ALA 65 37.892 -10.683 7.050 447 HB1 ALA 65 1HB ALA 65 37.126 -9.321 9.628 448 HB2 ALA 65 2HB ALA 65 38.301 -8.690 8.472 449 HB3 ALA 65 3HB ALA 65 36.613 -8.883 7.998 450 H SER 66 H SER 66 39.758 -11.759 7.050 451 HA SER 66 HA SER 66 41.106 -12.199 9.635 452 HB2 SER 66 2HB SER 66 40.319 -14.301 8.512 453 HB3 SER 66 3HB SER 66 41.393 -13.923 7.165 454 HG SER 66 HG SER 66 42.377 -15.335 8.669 455 H THR 67 H THR 67 43.172 -11.528 9.835 456 HA THR 67 HA THR 67 44.681 -10.757 7.457 457 HB THR 67 HB THR 67 45.258 -8.558 8.353 458 HG1 THR 67 HG1 THR 67 45.003 -8.688 10.521 459 HG21 THR 67 3HG2 THR 67 43.362 -7.474 7.626 460 HG22 THR 67 1HG2 THR 67 42.275 -8.586 8.458 461 HG23 THR 67 2HG2 THR 67 43.083 -9.088 6.972 462 H LEU 68 H LEU 68 46.710 -11.443 7.624 463 HA LEU 68 HA LEU 68 47.878 -11.756 10.309 464 HB2 LEU 68 2HB LEU 68 47.147 -13.902 9.118 465 HB3 LEU 68 3HB LEU 68 48.491 -13.599 8.019 466 HG LEU 68 HG LEU 68 49.266 -13.544 10.834 467 HD11 LEU 68 1HD1 LEU 68 47.365 -15.314 10.603 468 HD12 LEU 68 2HD1 LEU 68 48.857 -15.723 11.447 469 HD13 LEU 68 3HD1 LEU 68 48.609 -16.259 9.785 470 HD21 LEU 68 3HD2 LEU 68 50.950 -15.191 9.887 471 HD22 LEU 68 1HD2 LEU 68 50.963 -13.565 9.204 472 HD23 LEU 68 2HD2 LEU 68 50.208 -14.889 8.316 473 H ASN 69 H ASN 69 48.799 -9.641 9.892 474 HA ASN 69 HA ASN 69 51.346 -9.871 8.500 475 HB2 ASN 69 2HB ASN 69 51.070 -8.048 7.070 476 HB3 ASN 69 3HB ASN 69 49.509 -8.858 6.968 477 HD21 ASN 69 1HD2 ASN 69 47.713 -7.926 7.949 478 HD22 ASN 69 2HD2 ASN 69 47.692 -6.267 8.431 479 H GLN 70 H GLN 70 52.610 -7.711 8.844 480 HA GLN 70 HA GLN 70 52.359 -7.065 11.694 481 HB2 GLN 70 2HB GLN 70 54.708 -6.529 9.874 482 HB3 GLN 70 3HB GLN 70 54.680 -6.433 11.629 483 HG2 GLN 70 2HG GLN 70 54.264 -8.861 11.724 484 HG3 GLN 70 3HG GLN 70 54.397 -8.925 9.967 485 HE21 GLN 70 1HE2 GLN 70 56.245 -9.858 9.473 486 HE22 GLN 70 2HE2 GLN 70 57.782 -9.508 10.179 487 H GLY 71 H GLY 71 50.550 -5.606 11.122 488 HA2 GLY 71 2HA GLY 71 51.352 -2.920 11.158 489 HA3 GLY 71 3HA GLY 71 50.883 -3.322 9.513 490 H ASN 72 H ASN 72 48.992 -2.284 9.262 491 HA ASN 72 HA ASN 72 46.820 -3.016 11.105 492 HB2 ASN 72 2HB ASN 72 45.947 -0.610 10.499 493 HB3 ASN 72 3HB ASN 72 47.121 -0.829 11.794 494 HD21 ASN 72 1HD2 ASN 72 48.908 0.333 11.715 495 HD22 ASN 72 2HD2 ASN 72 49.502 1.180 10.332 496 H VAL 73 H VAL 73 44.795 -3.290 10.185 497 HA VAL 73 HA VAL 73 44.675 -3.129 7.245 498 HB VAL 73 HB VAL 73 43.257 -5.162 7.261 499 HG11 VAL 73 1HG1 VAL 73 45.392 -6.560 8.332 500 HG12 VAL 73 2HG1 VAL 73 45.222 -6.025 6.659 501 HG13 VAL 73 3HG1 VAL 73 46.099 -5.028 7.820 502 HG21 VAL 73 3HG2 VAL 73 43.133 -4.708 9.998 503 HG22 VAL 73 1HG2 VAL 73 42.516 -6.116 9.132 504 HG23 VAL 73 2HG2 VAL 73 44.133 -6.152 9.836 505 H LYS 74 H LYS 74 42.703 -2.567 6.335 506 HA LYS 74 HA LYS 74 40.585 -1.755 8.210 507 HB2 LYS 74 2HB LYS 74 41.843 0.229 7.489 508 HB3 LYS 74 3HB LYS 74 41.550 -0.193 5.807 509 HG2 LYS 74 2HG LYS 74 40.034 1.542 6.441 510 HG3 LYS 74 3HG LYS 74 39.118 0.050 6.220 511 HD2 LYS 74 2HD LYS 74 38.241 0.497 8.231 512 HD3 LYS 74 3HD LYS 74 39.790 -0.049 8.879 513 HE2 LYS 74 2HE LYS 74 39.656 1.993 9.888 514 HE3 LYS 74 3HE LYS 74 40.467 2.460 8.394 515 HZ1 LYS 74 3HZ LYS 74 38.553 3.891 9.037 516 HZ2 LYS 74 1HZ LYS 74 37.527 2.575 8.762 517 HZ3 LYS 74 2HZ LYS 74 38.429 3.225 7.487 518 H VAL 75 H VAL 75 38.750 -2.769 7.779 519 HA VAL 75 HA VAL 75 38.256 -3.686 5.023 520 HB VAL 75 HB VAL 75 36.604 -5.270 6.142 521 HG11 VAL 75 1HG1 VAL 75 38.739 -6.008 5.226 522 HG12 VAL 75 2HG1 VAL 75 39.543 -5.594 6.741 523 HG13 VAL 75 3HG1 VAL 75 38.349 -6.892 6.701 524 HG21 VAL 75 3HG2 VAL 75 38.102 -5.289 8.630 525 HG22 VAL 75 1HG2 VAL 75 37.216 -3.783 8.388 526 HG23 VAL 75 2HG2 VAL 75 36.359 -5.324 8.360 527 H THR 76 H THR 76 36.720 -2.661 3.940 528 HA THR 76 HA THR 76 34.527 -1.397 5.452 529 HB THR 76 HB THR 76 35.655 -0.350 2.853 530 HG1 THR 76 HG1 THR 76 37.041 0.791 3.994 531 HG21 THR 76 3HG2 THR 76 33.685 0.733 4.862 532 HG22 THR 76 1HG2 THR 76 33.395 0.348 3.167 533 HG23 THR 76 2HG2 THR 76 34.423 1.715 3.597 534 H ALA 77 H ALA 77 32.491 -1.805 4.789 535 HA ALA 77 HA ALA 77 32.023 -2.953 2.148 536 HB1 ALA 77 1HB ALA 77 30.639 -4.782 3.153 537 HB2 ALA 77 2HB ALA 77 32.375 -4.936 3.421 538 HB3 ALA 77 3HB ALA 77 31.330 -4.359 4.719 539 H SER 78 H SER 78 30.147 -2.291 1.275 540 HA SER 78 HA SER 78 28.024 -1.279 3.012 541 HB2 SER 78 2HB SER 78 29.076 0.337 0.682 542 HB3 SER 78 3HB SER 78 27.829 0.814 1.834 543 HG SER 78 HG SER 78 30.519 1.019 2.034 544 H ILE 79 H ILE 79 25.999 -1.613 2.235 545 HA ILE 79 HA ILE 79 25.694 -2.485 -0.549 546 HB ILE 79 HB ILE 79 25.847 -4.555 0.654 547 HG12 ILE 79 2HG1 ILE 79 23.619 -5.514 0.214 548 HG13 ILE 79 3HG1 ILE 79 22.945 -3.892 0.102 549 HG21 ILE 79 1HG2 ILE 79 25.314 -4.683 2.802 550 HG22 ILE 79 2HG2 ILE 79 24.586 -3.079 2.732 551 HG23 ILE 79 3HG2 ILE 79 23.610 -4.505 2.385 552 HD11 ILE 79 3HD1 ILE 79 25.117 -4.009 -1.689 553 HD12 ILE 79 1HD1 ILE 79 24.161 -5.473 -1.924 554 HD13 ILE 79 2HD1 ILE 79 23.397 -3.888 -2.058 555 H GLY 80 H GLY 80 24.341 -1.039 -1.394 556 HA2 GLY 80 2HA GLY 80 22.320 0.023 -1.766 557 HA3 GLY 80 3HA GLY 80 21.692 -0.751 -0.318 558 H GLY 81 H GLY 81 21.117 0.618 1.224 559 HA2 GLY 81 2HA GLY 81 22.037 3.360 1.153 560 HA3 GLY 81 3HA GLY 81 20.837 2.688 2.247 561 H ILE 82 H ILE 82 21.519 1.666 4.167 562 HA ILE 82 HA ILE 82 23.556 2.880 5.563 563 HB ILE 82 HB ILE 82 22.517 0.084 6.037 564 HG12 ILE 82 2HG1 ILE 82 21.548 2.755 7.081 565 HG13 ILE 82 3HG1 ILE 82 20.703 1.725 5.930 566 HG21 ILE 82 1HG2 ILE 82 23.155 0.539 8.390 567 HG22 ILE 82 2HG2 ILE 82 24.531 0.472 7.290 568 HG23 ILE 82 3HG2 ILE 82 23.928 2.031 7.854 569 HD11 ILE 82 3HD1 ILE 82 19.672 1.398 8.022 570 HD12 ILE 82 1HD1 ILE 82 20.654 -0.036 7.725 571 HD13 ILE 82 2HD1 ILE 82 21.223 1.207 8.839 572 H GLN 83 H GLN 83 25.647 2.273 6.194 573 HA GLN 83 HA GLN 83 26.907 0.138 4.615 574 HB2 GLN 83 2HB GLN 83 28.940 1.711 4.500 575 HB3 GLN 83 3HB GLN 83 27.595 2.021 3.411 576 HG2 GLN 83 2HG GLN 83 27.393 3.418 5.967 577 HG3 GLN 83 3HG GLN 83 28.800 3.871 5.007 578 HE21 GLN 83 1HE2 GLN 83 26.179 5.208 5.719 579 HE22 GLN 83 2HE2 GLN 83 25.572 5.773 4.204 580 H GLY 84 H GLY 84 29.024 -0.546 5.499 581 HA2 GLY 84 2HA GLY 84 29.112 -0.177 8.431 582 HA3 GLY 84 3HA GLY 84 29.384 -1.734 7.664 583 H SER 85 H SER 85 31.099 -0.047 9.427 584 HA SER 85 HA SER 85 33.505 -0.227 7.786 585 HB2 SER 85 2HB SER 85 33.317 2.205 9.488 586 HB3 SER 85 3HB SER 85 34.154 1.964 7.955 587 HG SER 85 HG SER 85 32.456 2.677 6.953 588 H THR 86 H THR 86 35.244 -0.943 8.891 589 HA THR 86 HA THR 86 35.259 -0.828 11.808 590 HB THR 86 HB THR 86 34.366 -2.933 11.807 591 HG1 THR 86 HG1 THR 86 36.958 -3.828 11.141 592 HG21 THR 86 3HG2 THR 86 35.474 -3.097 9.054 593 HG22 THR 86 1HG2 THR 86 33.860 -3.487 9.647 594 HG23 THR 86 2HG2 THR 86 35.194 -4.608 9.919 595 H ASP 87 H ASP 87 37.330 -1.195 12.743 596 HA ASP 87 HA ASP 87 39.556 -1.043 10.817 597 HB2 ASP 87 2HB ASP 87 39.461 1.114 11.744 598 HB3 ASP 87 3HB ASP 87 39.074 0.504 13.350 599 H PHE 88 H PHE 88 41.056 -2.570 11.012 600 HA PHE 88 HA PHE 88 41.201 -4.065 13.547 601 HB2 PHE 88 2HB PHE 88 41.081 -4.987 10.729 602 HB3 PHE 88 3HB PHE 88 42.173 -5.862 11.797 603 HD1 PHE 88 HD1 PHE 88 41.289 -7.024 13.785 604 HD2 PHE 88 HD2 PHE 88 38.726 -5.209 10.913 605 HE1 PHE 88 HE1 PHE 88 39.393 -8.325 14.661 606 HE2 PHE 88 HE2 PHE 88 36.826 -6.506 11.784 607 HZ PHE 88 HZ PHE 88 37.157 -8.066 13.661 608 H LYS 89 H LYS 89 43.171 -4.405 14.438 609 HA LYS 89 HA LYS 89 45.527 -3.489 12.927 610 HB2 LYS 89 2HB LYS 89 44.539 -2.652 15.592 611 HB3 LYS 89 3HB LYS 89 46.271 -2.926 15.459 612 HG2 LYS 89 2HG LYS 89 45.604 -1.412 13.216 613 HG3 LYS 89 3HG LYS 89 44.688 -0.703 14.548 614 HD2 LYS 89 2HD LYS 89 47.633 -1.314 14.707 615 HD3 LYS 89 3HD LYS 89 46.995 0.246 14.182 616 HE2 LYS 89 2HE LYS 89 47.097 0.785 16.357 617 HE3 LYS 89 3HE LYS 89 45.617 -0.163 16.496 618 HZ1 LYS 89 3HZ LYS 89 47.483 -0.697 18.099 619 HZ2 LYS 89 1HZ LYS 89 48.290 -1.394 16.786 620 HZ3 LYS 89 2HZ LYS 89 46.793 -2.007 17.281 621 H VAL 90 H VAL 90 46.851 -5.143 12.614 622 HA VAL 90 HA VAL 90 46.926 -7.308 14.601 623 HB VAL 90 HB VAL 90 46.399 -8.138 12.422 624 HG11 VAL 90 1HG1 VAL 90 47.867 -7.777 10.483 625 HG12 VAL 90 2HG1 VAL 90 47.185 -6.266 11.089 626 HG13 VAL 90 3HG1 VAL 90 48.860 -6.688 11.451 627 HG21 VAL 90 3HG2 VAL 90 49.316 -8.677 12.978 628 HG22 VAL 90 1HG2 VAL 90 47.957 -9.481 13.764 629 HG23 VAL 90 2HG2 VAL 90 48.228 -9.694 12.034 630 H THR 91 H THR 91 48.649 -7.549 15.859 631 HA THR 91 HA THR 91 51.223 -6.427 14.984 632 HB THR 91 HB THR 91 51.503 -5.987 17.585 633 HG1 THR 91 HG1 THR 91 49.673 -5.992 18.635 634 HG21 THR 91 3HG2 THR 91 50.555 -4.355 15.344 635 HG22 THR 91 1HG2 THR 91 51.851 -4.048 16.499 636 HG23 THR 91 2HG2 THR 91 50.180 -3.686 16.932 637 H GLN 92 H GLN 92 53.024 -7.214 16.528 638 HA GLN 92 HA GLN 92 54.294 -8.983 17.192 639 HB2 GLN 92 2HB GLN 92 52.100 -8.845 18.869 640 HB3 GLN 92 3HB GLN 92 52.133 -10.536 18.389 641 HG2 GLN 92 2HG GLN 92 54.575 -10.535 19.046 642 HG3 GLN 92 3HG GLN 92 54.272 -8.965 19.787 643 HE21 GLN 92 1HE2 GLN 92 52.227 -8.997 21.219 644 HE22 GLN 92 2HE2 GLN 92 52.122 -10.324 22.321 Start of MODEL 20 1 H1 MET 1 H MET 1 0.661 1.461 2.843 2 HA MET 1 HA MET 1 0.212 0.688 0.056 3 HB2 MET 1 2HB MET 1 1.496 2.834 -0.579 4 HB3 MET 1 3HB MET 1 -0.210 2.972 -0.176 5 HG2 MET 1 2HG MET 1 0.187 4.110 1.743 6 HG3 MET 1 3HG MET 1 1.734 3.315 2.026 7 HE1 MET 1 3HE MET 1 4.199 4.936 1.377 8 HE2 MET 1 1HE MET 1 3.486 6.434 1.976 9 HE3 MET 1 2HE MET 1 3.040 4.893 2.708 10 HA PRO 2 HA PRO 2 4.270 -0.968 0.251 11 HB2 PRO 2 2HB PRO 2 5.158 -0.572 -2.284 12 HB3 PRO 2 3HB PRO 2 3.929 -1.774 -1.874 13 HG2 PRO 2 2HG PRO 2 3.585 0.977 -3.003 14 HG3 PRO 2 3HG PRO 2 2.766 -0.529 -3.456 15 HD2 PRO 2 2HD PRO 2 1.616 1.332 -1.861 16 HD3 PRO 2 3HD PRO 2 1.290 -0.405 -1.691 17 H ALA 3 H ALA 3 6.532 -0.468 0.197 18 HA ALA 3 HA ALA 3 7.445 2.162 -0.482 19 HB1 ALA 3 1HB ALA 3 6.285 2.001 1.991 20 HB2 ALA 3 2HB ALA 3 7.993 1.751 2.356 21 HB3 ALA 3 3HB ALA 3 7.478 3.203 1.496 22 H ALA 4 H ALA 4 9.657 2.266 -0.658 23 HA ALA 4 HA ALA 4 11.112 -0.217 -0.019 24 HB1 ALA 4 1HB ALA 4 10.782 0.379 -2.462 25 HB2 ALA 4 2HB ALA 4 11.888 1.724 -2.179 26 HB3 ALA 4 3HB ALA 4 12.439 0.065 -1.945 27 H LEU 5 H LEU 5 12.794 -0.083 1.323 28 HA LEU 5 HA LEU 5 14.479 2.208 1.509 29 HB2 LEU 5 2HB LEU 5 12.288 2.698 2.849 30 HB3 LEU 5 3HB LEU 5 13.022 1.640 4.053 31 HG LEU 5 HG LEU 5 15.065 3.315 3.687 32 HD11 LEU 5 1HD1 LEU 5 12.606 4.881 2.949 33 HD12 LEU 5 2HD1 LEU 5 14.111 4.724 2.043 34 HD13 LEU 5 3HD1 LEU 5 14.083 5.631 3.555 35 HD21 LEU 5 3HD2 LEU 5 12.646 3.674 5.442 36 HD22 LEU 5 1HD2 LEU 5 14.117 4.632 5.616 37 HD23 LEU 5 2HD2 LEU 5 14.173 2.883 5.839 38 H VAL 6 H VAL 6 15.399 -0.114 0.903 39 HA VAL 6 HA VAL 6 15.903 -2.083 2.746 40 HB VAL 6 HB VAL 6 16.625 -2.395 0.493 41 HG11 VAL 6 1HG1 VAL 6 18.966 -0.862 0.229 42 HG12 VAL 6 2HG1 VAL 6 17.453 -0.690 -0.664 43 HG13 VAL 6 3HG1 VAL 6 17.716 0.235 0.815 44 HG21 VAL 6 3HG2 VAL 6 17.922 -3.536 2.271 45 HG22 VAL 6 1HG2 VAL 6 18.856 -3.255 0.801 46 HG23 VAL 6 2HG2 VAL 6 19.099 -2.224 2.211 47 H SER 7 H SER 7 16.413 -1.646 4.815 48 HA SER 7 HA SER 7 18.716 0.119 5.323 49 HB2 SER 7 2HB SER 7 16.189 -0.396 6.828 50 HB3 SER 7 3HB SER 7 17.643 -0.013 7.750 51 HG SER 7 HG SER 7 17.832 1.864 6.341 52 H ILE 8 H ILE 8 20.515 -0.772 6.085 53 HA ILE 8 HA ILE 8 20.348 -3.474 7.250 54 HB ILE 8 HB ILE 8 22.439 -4.039 6.327 55 HG12 ILE 8 2HG1 ILE 8 23.487 -2.024 4.838 56 HG13 ILE 8 3HG1 ILE 8 22.780 -1.108 6.165 57 HG21 ILE 8 1HG2 ILE 8 20.316 -3.385 4.725 58 HG22 ILE 8 2HG2 ILE 8 21.657 -2.548 3.944 59 HG23 ILE 8 3HG2 ILE 8 21.743 -4.288 4.216 60 HD11 ILE 8 3HD1 ILE 8 24.120 -3.225 7.377 61 HD12 ILE 8 1HD1 ILE 8 25.191 -2.667 6.092 62 HD13 ILE 8 2HD1 ILE 8 24.618 -1.535 7.317 63 H SER 9 H SER 9 21.458 -3.913 9.116 64 HA SER 9 HA SER 9 22.721 -1.603 10.440 65 HB2 SER 9 2HB SER 9 20.520 -3.094 11.286 66 HB3 SER 9 3HB SER 9 21.860 -3.703 12.257 67 HG SER 9 HG SER 9 21.584 -1.970 13.400 68 H VAL 10 H VAL 10 24.857 -1.846 10.357 69 HA VAL 10 HA VAL 10 26.004 -4.531 10.676 70 HB VAL 10 HB VAL 10 26.698 -3.287 8.668 71 HG11 VAL 10 1HG1 VAL 10 26.662 -1.075 10.231 72 HG12 VAL 10 2HG1 VAL 10 28.394 -1.407 10.161 73 HG13 VAL 10 3HG1 VAL 10 27.478 -1.177 8.671 74 HG21 VAL 10 3HG2 VAL 10 28.346 -4.587 10.538 75 HG22 VAL 10 1HG2 VAL 10 28.621 -4.390 8.807 76 HG23 VAL 10 2HG2 VAL 10 29.265 -3.205 9.942 77 H SER 11 H SER 11 27.266 -5.051 12.373 78 HA SER 11 HA SER 11 27.761 -2.943 14.372 79 HB2 SER 11 2HB SER 11 27.360 -5.917 14.775 80 HB3 SER 11 3HB SER 11 27.757 -4.771 16.055 81 HG SER 11 HG SER 11 25.563 -4.989 16.069 82 HA PRO 12 HA PRO 12 31.898 -4.356 12.801 83 HB2 PRO 12 2HB PRO 12 32.934 -1.855 12.594 84 HB3 PRO 12 3HB PRO 12 32.006 -2.620 11.300 85 HG2 PRO 12 2HG PRO 12 31.115 -0.623 13.344 86 HG3 PRO 12 3HG PRO 12 30.752 -0.687 11.609 87 HD2 PRO 12 2HD PRO 12 29.005 -1.537 13.496 88 HD3 PRO 12 3HD PRO 12 29.105 -2.276 11.884 89 H THR 13 H THR 13 33.848 -4.402 13.935 90 HA THR 13 HA THR 13 33.743 -3.254 16.649 91 HB THR 13 HB THR 13 35.296 -5.720 15.862 92 HG1 THR 13 HG1 THR 13 33.443 -6.706 17.134 93 HG21 THR 13 3HG2 THR 13 34.603 -4.371 18.454 94 HG22 THR 13 1HG2 THR 13 36.183 -4.875 17.856 95 HG23 THR 13 2HG2 THR 13 35.019 -6.084 18.398 96 H ASN 14 H ASN 14 35.088 -1.591 16.837 97 HA ASN 14 HA ASN 14 37.486 -1.460 15.178 98 HB2 ASN 14 2HB ASN 14 37.654 0.872 16.089 99 HB3 ASN 14 3HB ASN 14 36.167 0.551 15.201 100 HD21 ASN 14 1HD2 ASN 14 34.226 0.260 16.372 101 HD22 ASN 14 2HD2 ASN 14 34.047 0.908 17.964 102 H SER 15 H SER 15 39.062 -2.697 16.043 103 HA SER 15 HA SER 15 40.378 -1.802 18.398 104 HB2 SER 15 2HB SER 15 38.308 -3.555 18.928 105 HB3 SER 15 3HB SER 15 39.718 -4.613 18.873 106 HG SER 15 HG SER 15 39.180 -3.572 20.961 107 H THR 16 H THR 16 41.905 -3.946 19.063 108 HA THR 16 HA THR 16 43.339 -4.472 16.553 109 HB THR 16 HB THR 16 44.667 -3.291 18.214 110 HG1 THR 16 HG1 THR 16 46.420 -4.681 18.152 111 HG21 THR 16 3HG2 THR 16 44.465 -3.698 20.394 112 HG22 THR 16 1HG2 THR 16 45.075 -5.336 20.160 113 HG23 THR 16 2HG2 THR 16 43.345 -5.013 20.038 114 H VAL 17 H VAL 17 44.216 -6.549 16.141 115 HA VAL 17 HA VAL 17 43.124 -8.748 17.753 116 HB VAL 17 HB VAL 17 41.686 -8.358 15.736 117 HG11 VAL 17 1HG1 VAL 17 44.159 -9.247 14.255 118 HG12 VAL 17 2HG1 VAL 17 42.555 -9.036 13.549 119 HG13 VAL 17 3HG1 VAL 17 43.429 -7.643 14.190 120 HG21 VAL 17 3HG2 VAL 17 41.364 -10.637 15.326 121 HG22 VAL 17 1HG2 VAL 17 43.076 -11.008 15.526 122 HG23 VAL 17 2HG2 VAL 17 42.094 -10.594 16.931 123 H ALA 18 H ALA 18 44.265 -10.750 17.547 124 HA ALA 18 HA ALA 18 47.082 -10.419 17.348 125 HB1 ALA 18 1HB ALA 18 46.315 -11.985 18.934 126 HB2 ALA 18 2HB ALA 18 45.331 -12.831 17.739 127 HB3 ALA 18 3HB ALA 18 47.090 -12.932 17.664 128 H LYS 19 H LYS 19 48.516 -11.103 15.805 129 HA LYS 19 HA LYS 19 47.814 -11.026 13.138 130 HB2 LYS 19 2HB LYS 19 50.099 -10.713 13.774 131 HB3 LYS 19 3HB LYS 19 50.183 -12.317 14.491 132 HG2 LYS 19 2HG LYS 19 49.909 -13.307 12.257 133 HG3 LYS 19 3HG LYS 19 49.895 -11.686 11.560 134 HD2 LYS 19 2HD LYS 19 52.112 -11.834 11.405 135 HD3 LYS 19 3HD LYS 19 52.171 -11.754 13.167 136 HE2 LYS 19 2HE LYS 19 52.222 -14.110 13.365 137 HE3 LYS 19 3HE LYS 19 51.773 -14.335 11.675 138 HZ1 LYS 19 3HZ LYS 19 54.163 -14.720 12.172 139 HZ2 LYS 19 1HZ LYS 19 54.315 -13.077 12.544 140 HZ3 LYS 19 2HZ LYS 19 53.890 -13.553 10.978 141 H GLY 20 H GLY 20 47.313 -12.514 11.572 142 HA2 GLY 20 2HA GLY 20 46.559 -14.482 10.658 143 HA3 GLY 20 3HA GLY 20 47.491 -15.316 11.892 144 H LEU 21 H LEU 21 44.372 -14.111 10.974 145 HA LEU 21 HA LEU 21 42.962 -15.985 12.490 146 HB2 LEU 21 2HB LEU 21 43.866 -13.866 14.058 147 HB3 LEU 21 3HB LEU 21 42.170 -13.504 13.744 148 HG LEU 21 HG LEU 21 42.444 -16.250 14.531 149 HD11 LEU 21 1HD1 LEU 21 44.215 -16.054 15.906 150 HD12 LEU 21 2HD1 LEU 21 43.034 -15.323 16.991 151 HD13 LEU 21 3HD1 LEU 21 44.080 -14.298 16.009 152 HD21 LEU 21 3HD2 LEU 21 41.237 -14.256 16.341 153 HD22 LEU 21 1HD2 LEU 21 40.584 -15.771 15.717 154 HD23 LEU 21 2HD2 LEU 21 40.577 -14.326 14.706 155 H GLN 22 H GLN 22 40.552 -15.364 12.636 156 HA GLN 22 HA GLN 22 39.840 -13.693 10.317 157 HB2 GLN 22 2HB GLN 22 38.553 -16.294 11.166 158 HB3 GLN 22 3HB GLN 22 37.997 -15.267 9.850 159 HG2 GLN 22 2HG GLN 22 39.209 -16.714 8.624 160 HG3 GLN 22 3HG GLN 22 40.518 -15.617 9.062 161 HE21 GLN 22 1HE2 GLN 22 39.154 -18.754 9.469 162 HE22 GLN 22 2HE2 GLN 22 40.447 -19.435 10.391 163 H GLU 23 H GLU 23 38.121 -12.334 10.534 164 HA GLU 23 HA GLU 23 36.768 -12.329 13.152 165 HB2 GLU 23 2HB GLU 23 36.555 -9.831 12.794 166 HB3 GLU 23 3HB GLU 23 38.176 -10.423 13.130 167 HG2 GLU 23 2HG GLU 23 38.961 -9.730 11.164 168 HG3 GLU 23 3HG GLU 23 37.554 -10.327 10.286 169 H ASN 24 H ASN 24 34.697 -12.837 12.978 170 HA ASN 24 HA ASN 24 33.313 -12.424 10.438 171 HB2 ASN 24 2HB ASN 24 31.574 -13.883 11.377 172 HB3 ASN 24 3HB ASN 24 33.159 -14.646 11.468 173 HD21 ASN 24 1HD2 ASN 24 34.197 -14.795 13.488 174 HD22 ASN 24 2HD2 ASN 24 33.301 -14.703 14.962 175 H PHE 25 H PHE 25 31.542 -11.132 10.187 176 HA PHE 25 HA PHE 25 30.825 -9.438 12.490 177 HB2 PHE 25 2HB PHE 25 30.433 -7.609 10.971 178 HB3 PHE 25 3HB PHE 25 32.038 -8.258 10.650 179 HD1 PHE 25 HD2 PHE 25 32.491 -9.503 8.608 180 HD2 PHE 25 HD1 PHE 25 28.663 -7.802 9.362 181 HE1 PHE 25 HE2 PHE 25 31.902 -9.787 6.237 182 HE2 PHE 25 HE1 PHE 25 28.067 -8.084 6.991 183 HZ PHE 25 HZ PHE 25 29.688 -9.077 5.425 184 H LYS 26 H LYS 26 28.619 -8.188 11.596 185 HA LYS 26 HA LYS 26 26.748 -10.236 10.667 186 HB2 LYS 26 2HB LYS 26 26.998 -9.694 13.353 187 HB3 LYS 26 3HB LYS 26 25.678 -8.634 12.876 188 HG2 LYS 26 2HG LYS 26 24.280 -10.371 12.364 189 HG3 LYS 26 3HG LYS 26 25.608 -11.475 11.999 190 HD2 LYS 26 2HD LYS 26 25.731 -10.662 14.751 191 HD3 LYS 26 3HD LYS 26 24.126 -11.294 14.379 192 HE2 LYS 26 2HE LYS 26 25.319 -13.258 13.296 193 HE3 LYS 26 3HE LYS 26 26.787 -12.659 14.065 194 HZ1 LYS 26 3HZ LYS 26 24.761 -12.757 15.993 195 HZ2 LYS 26 1HZ LYS 26 26.184 -13.670 15.921 196 HZ3 LYS 26 2HZ LYS 26 24.773 -14.243 15.184 197 H ALA 27 H ALA 27 25.399 -9.444 9.191 198 HA ALA 27 HA ALA 27 24.686 -6.601 9.274 199 HB1 ALA 27 1HB ALA 27 24.996 -6.497 6.786 200 HB2 ALA 27 2HB ALA 27 26.486 -6.620 7.721 201 HB3 ALA 27 3HB ALA 27 25.843 -8.040 6.896 202 H THR 28 H THR 28 22.549 -6.482 9.326 203 HA THR 28 HA THR 28 20.986 -8.509 7.863 204 HB THR 28 HB THR 28 19.140 -8.019 9.478 205 HG1 THR 28 HG1 THR 28 19.422 -6.561 11.002 206 HG21 THR 28 3HG2 THR 28 21.178 -9.767 9.721 207 HG22 THR 28 1HG2 THR 28 19.843 -9.665 10.868 208 HG23 THR 28 2HG2 THR 28 21.372 -8.859 11.221 209 H GLY 29 H GLY 29 20.469 -7.553 5.972 210 HA2 GLY 29 2HA GLY 29 19.473 -4.783 6.039 211 HA3 GLY 29 3HA GLY 29 20.082 -5.610 4.613 212 H ILE 30 H ILE 30 17.361 -4.456 5.977 213 HA ILE 30 HA ILE 30 15.681 -6.396 4.532 214 HB ILE 30 HB ILE 30 14.774 -4.954 7.016 215 HG12 ILE 30 2HG1 ILE 30 14.994 -7.533 7.811 216 HG13 ILE 30 3HG1 ILE 30 16.366 -7.431 6.712 217 HG21 ILE 30 1HG2 ILE 30 13.526 -7.484 6.322 218 HG22 ILE 30 2HG2 ILE 30 12.793 -5.920 6.674 219 HG23 ILE 30 3HG2 ILE 30 13.371 -6.276 5.047 220 HD11 ILE 30 3HD1 ILE 30 16.396 -6.751 9.346 221 HD12 ILE 30 1HD1 ILE 30 17.553 -6.197 8.137 222 HD13 ILE 30 2HD1 ILE 30 16.172 -5.186 8.564 223 H PHE 31 H PHE 31 14.128 -5.569 3.224 224 HA PHE 31 HA PHE 31 13.878 -2.634 3.146 225 HB2 PHE 31 2HB PHE 31 13.172 -3.357 0.635 226 HB3 PHE 31 3HB PHE 31 14.811 -2.910 1.097 227 HD1 PHE 31 HD2 PHE 31 12.573 -5.871 0.836 228 HD2 PHE 31 HD1 PHE 31 16.551 -4.367 0.680 229 HE1 PHE 31 HE2 PHE 31 13.375 -8.080 0.106 230 HE2 PHE 31 HE1 PHE 31 17.360 -6.573 -0.050 231 HZ PHE 31 HZ PHE 31 15.772 -8.433 -0.337 232 H THR 32 H THR 32 11.881 -1.776 3.187 233 HA THR 32 HA THR 32 9.674 -3.381 3.935 234 HB THR 32 HB THR 32 9.581 -0.527 2.944 235 HG1 THR 32 HG1 THR 32 9.840 -1.416 5.635 236 HG21 THR 32 3HG2 THR 32 7.710 -0.764 4.899 237 HG22 THR 32 1HG2 THR 32 7.642 -2.368 4.172 238 HG23 THR 32 2HG2 THR 32 7.374 -0.936 3.177 239 H ASP 33 H ASP 33 11.001 -2.683 0.912 240 HA ASP 33 HA ASP 33 8.582 -2.719 -0.626 241 HB2 ASP 33 2HB ASP 33 9.916 -2.378 -2.462 242 HB3 ASP 33 3HB ASP 33 11.011 -1.811 -1.204 243 H ASN 34 H ASN 34 10.154 -5.071 1.082 244 HA ASN 34 HA ASN 34 8.635 -7.168 -0.134 245 HB2 ASN 34 2HB ASN 34 11.611 -7.038 -0.557 246 HB3 ASN 34 3HB ASN 34 10.768 -8.583 -0.519 247 HD21 ASN 34 1HD2 ASN 34 12.004 -6.440 -2.548 248 HD22 ASN 34 2HD2 ASN 34 10.938 -6.612 -3.897 249 H SER 35 H SER 35 11.758 -7.718 1.351 250 HA SER 35 HA SER 35 10.752 -7.932 4.024 251 HB2 SER 35 2HB SER 35 11.660 -10.550 2.867 252 HB3 SER 35 3HB SER 35 10.705 -10.249 4.318 253 HG SER 35 HG SER 35 9.122 -10.758 3.008 254 H ASN 36 H ASN 36 12.675 -9.949 4.821 255 HA ASN 36 HA ASN 36 15.056 -8.269 4.765 256 HB2 ASN 36 2HB ASN 36 15.757 -9.378 6.700 257 HB3 ASN 36 3HB ASN 36 14.005 -9.339 6.881 258 HD21 ASN 36 1HD2 ASN 36 16.676 -11.244 7.096 259 HD22 ASN 36 2HD2 ASN 36 15.932 -12.798 6.970 260 H SER 37 H SER 37 17.014 -8.877 3.946 261 HA SER 37 HA SER 37 17.232 -11.529 2.709 262 HB2 SER 37 2HB SER 37 16.999 -9.021 1.303 263 HB3 SER 37 3HB SER 37 18.569 -9.754 0.976 264 HG SER 37 HG SER 37 17.301 -11.733 0.553 265 H ASP 38 H ASP 38 19.262 -12.411 2.717 266 HA ASP 38 HA ASP 38 21.204 -11.093 4.435 267 HB2 ASP 38 2HB ASP 38 21.459 -13.832 3.196 268 HB3 ASP 38 3HB ASP 38 22.267 -13.211 4.633 269 H ILE 39 H ILE 39 22.397 -9.613 3.387 270 HA ILE 39 HA ILE 39 23.573 -8.606 1.673 271 HB ILE 39 HB ILE 39 25.675 -9.774 1.196 272 HG12 ILE 39 2HG1 ILE 39 24.668 -12.085 2.842 273 HG13 ILE 39 3HG1 ILE 39 24.484 -12.059 1.092 274 HG21 ILE 39 1HG2 ILE 39 25.761 -8.606 3.203 275 HG22 ILE 39 2HG2 ILE 39 24.649 -9.712 4.008 276 HG23 ILE 39 3HG2 ILE 39 26.300 -10.223 3.656 277 HD11 ILE 39 3HD1 ILE 39 27.103 -11.852 2.559 278 HD12 ILE 39 1HD1 ILE 39 26.454 -13.319 1.826 279 HD13 ILE 39 2HD1 ILE 39 26.878 -11.940 0.812 280 H THR 40 H THR 40 21.288 -9.676 0.566 281 HA THR 40 HA THR 40 21.734 -11.442 -1.589 282 HB THR 40 HB THR 40 19.573 -9.362 -1.210 283 HG1 THR 40 HG1 THR 40 19.802 -11.250 0.283 284 HG21 THR 40 3HG2 THR 40 19.792 -11.622 -3.199 285 HG22 THR 40 1HG2 THR 40 19.727 -9.897 -3.558 286 HG23 THR 40 2HG2 THR 40 18.316 -10.711 -2.881 287 H ASP 41 H ASP 41 22.175 -8.010 -1.219 288 HA ASP 41 HA ASP 41 22.473 -7.560 -4.069 289 HB2 ASP 41 2HB ASP 41 21.558 -5.921 -2.205 290 HB3 ASP 41 3HB ASP 41 23.266 -5.525 -2.030 291 H GLN 42 H GLN 42 24.347 -9.076 -1.962 292 HA GLN 42 HA GLN 42 26.577 -9.478 -1.711 293 HB2 GLN 42 2HB GLN 42 26.116 -9.967 -4.186 294 HB3 GLN 42 3HB GLN 42 26.891 -8.423 -4.514 295 HG2 GLN 42 2HG GLN 42 28.890 -9.351 -4.381 296 HG3 GLN 42 3HG GLN 42 28.545 -9.952 -2.760 297 HE21 GLN 42 1HE2 GLN 42 29.256 -10.805 -5.890 298 HE22 GLN 42 2HE2 GLN 42 28.796 -12.470 -5.830 299 H VAL 43 H VAL 43 26.549 -7.603 -0.200 300 HA VAL 43 HA VAL 43 27.268 -5.014 -0.806 301 HB VAL 43 HB VAL 43 26.631 -5.630 1.441 302 HG11 VAL 43 1HG1 VAL 43 28.657 -7.637 1.097 303 HG12 VAL 43 2HG1 VAL 43 28.952 -6.718 2.574 304 HG13 VAL 43 3HG1 VAL 43 27.399 -7.518 2.327 305 HG21 VAL 43 3HG2 VAL 43 28.657 -3.881 0.791 306 HG22 VAL 43 1HG2 VAL 43 27.808 -3.955 2.335 307 HG23 VAL 43 2HG2 VAL 43 29.338 -4.807 2.127 308 H THR 44 H THR 44 29.111 -3.949 -1.299 309 HA THR 44 HA THR 44 31.392 -5.542 -2.112 310 HB THR 44 HB THR 44 31.177 -2.539 -2.273 311 HG1 THR 44 HG1 THR 44 29.742 -2.774 -3.804 312 HG21 THR 44 3HG2 THR 44 32.565 -4.419 -4.164 313 HG22 THR 44 1HG2 THR 44 33.359 -3.811 -2.713 314 HG23 THR 44 2HG2 THR 44 32.811 -2.685 -3.955 315 H TRP 45 H TRP 45 32.881 -6.066 -0.655 316 HA TRP 45 HA TRP 45 33.504 -4.145 1.485 317 HB2 TRP 45 2HB TRP 45 34.348 -6.025 2.769 318 HB3 TRP 45 3HB TRP 45 32.714 -6.381 2.213 319 HD1 TRP 45 HD1 TRP 45 36.369 -7.379 1.572 320 HE1 TRP 45 HE1 TRP 45 36.392 -9.661 0.382 321 HE3 TRP 45 HE3 TRP 45 31.350 -7.925 0.771 322 HZ2 TRP 45 HZ2 TRP 45 34.529 -11.455 -0.748 323 HZ3 TRP 45 HZ3 TRP 45 30.552 -9.953 -0.372 324 HH2 TRP 45 HH2 TRP 45 32.110 -11.680 -1.115 325 H ASP 46 H ASP 46 35.740 -3.903 2.120 326 HA ASP 46 HA ASP 46 37.711 -4.674 0.094 327 HB2 ASP 46 2HB ASP 46 36.856 -2.349 -0.377 328 HB3 ASP 46 3HB ASP 46 37.526 -1.859 1.176 329 H SER 47 H SER 47 39.797 -4.937 0.856 330 HA SER 47 HA SER 47 40.181 -4.579 3.753 331 HB2 SER 47 2HB SER 47 40.551 -6.770 4.058 332 HB3 SER 47 3HB SER 47 39.990 -7.035 2.407 333 HG SER 47 HG SER 47 41.972 -7.402 1.807 334 H SER 48 H SER 48 42.311 -4.165 4.444 335 HA SER 48 HA SER 48 43.800 -2.416 2.924 336 HB2 SER 48 2HB SER 48 44.512 -2.240 5.072 337 HB3 SER 48 3HB SER 48 44.250 -3.952 5.403 338 HG SER 48 HG SER 48 46.516 -2.641 4.501 339 H ASN 49 H ASN 49 45.989 -2.637 2.050 340 HA ASN 49 HA ASN 49 46.446 -5.291 0.855 341 HB2 ASN 49 2HB ASN 49 45.597 -3.376 -0.676 342 HB3 ASN 49 3HB ASN 49 47.230 -2.735 -0.520 343 HD21 ASN 49 1HD2 ASN 49 46.567 -3.257 -2.970 344 HD22 ASN 49 2HD2 ASN 49 47.258 -4.730 -3.551 345 H THR 50 H THR 50 47.581 -4.403 3.293 346 HA THR 50 HA THR 50 50.149 -3.293 3.013 347 HB THR 50 HB THR 50 50.400 -4.906 5.217 348 HG1 THR 50 HG1 THR 50 48.349 -4.892 6.220 349 HG21 THR 50 3HG2 THR 50 49.391 -2.134 4.766 350 HG22 THR 50 1HG2 THR 50 50.877 -2.677 5.544 351 HG23 THR 50 2HG2 THR 50 49.338 -2.807 6.395 352 H ASP 51 H ASP 51 49.537 -6.665 3.968 353 HA ASP 51 HA ASP 51 51.773 -7.467 2.222 354 HB2 ASP 51 2HB ASP 51 51.972 -7.564 4.861 355 HB3 ASP 51 3HB ASP 51 51.080 -9.068 4.647 356 H ILE 52 H ILE 52 49.127 -9.032 4.036 357 HA ILE 52 HA ILE 52 48.046 -10.132 1.582 358 HB ILE 52 HB ILE 52 49.659 -11.833 2.013 359 HG12 ILE 52 2HG1 ILE 52 47.188 -12.996 3.261 360 HG13 ILE 52 3HG1 ILE 52 47.157 -12.428 1.595 361 HG21 ILE 52 1HG2 ILE 52 49.123 -11.185 4.765 362 HG22 ILE 52 2HG2 ILE 52 49.032 -12.926 4.504 363 HG23 ILE 52 3HG2 ILE 52 50.493 -12.043 4.061 364 HD11 ILE 52 3HD1 ILE 52 49.319 -13.953 1.442 365 HD12 ILE 52 1HD1 ILE 52 48.515 -14.772 2.781 366 HD13 ILE 52 2HD1 ILE 52 47.690 -14.596 1.231 367 H LEU 53 H LEU 53 46.014 -9.437 1.856 368 HA LEU 53 HA LEU 53 44.601 -10.298 4.284 369 HB2 LEU 53 2HB LEU 53 44.185 -7.637 2.935 370 HB3 LEU 53 3HB LEU 53 43.400 -8.218 4.402 371 HG LEU 53 HG LEU 53 45.892 -8.305 5.280 372 HD11 LEU 53 1HD1 LEU 53 46.408 -7.356 2.798 373 HD12 LEU 53 2HD1 LEU 53 47.433 -7.077 4.205 374 HD13 LEU 53 3HD1 LEU 53 46.265 -5.853 3.709 375 HD21 LEU 53 3HD2 LEU 53 44.299 -7.022 6.428 376 HD22 LEU 53 1HD2 LEU 53 44.068 -5.929 5.063 377 HD23 LEU 53 2HD2 LEU 53 45.568 -5.877 5.991 378 H SER 54 H SER 54 42.802 -11.400 3.868 379 HA SER 54 HA SER 54 41.394 -10.945 1.334 380 HB2 SER 54 2HB SER 54 42.839 -13.358 2.110 381 HB3 SER 54 3HB SER 54 41.147 -13.682 1.733 382 HG SER 54 HG SER 54 41.448 -13.006 -0.298 383 H ILE 55 H ILE 55 39.292 -10.661 1.648 384 HA ILE 55 HA ILE 55 38.082 -11.753 4.105 385 HB ILE 55 HB ILE 55 37.203 -9.251 2.664 386 HG12 ILE 55 2HG1 ILE 55 38.865 -9.542 5.177 387 HG13 ILE 55 3HG1 ILE 55 39.431 -8.925 3.629 388 HG21 ILE 55 1HG2 ILE 55 35.794 -8.867 4.553 389 HG22 ILE 55 2HG2 ILE 55 35.501 -10.510 3.987 390 HG23 ILE 55 3HG2 ILE 55 36.491 -10.236 5.420 391 HD11 ILE 55 3HD1 ILE 55 37.301 -7.653 5.330 392 HD12 ILE 55 1HD1 ILE 55 38.987 -7.144 5.247 393 HD13 ILE 55 2HD1 ILE 55 37.956 -7.019 3.821 394 H SER 56 H SER 56 36.289 -12.961 3.910 395 HA SER 56 HA SER 56 35.001 -13.090 1.262 396 HB2 SER 56 2HB SER 56 36.305 -15.180 2.754 397 HB3 SER 56 3HB SER 56 34.595 -15.564 2.560 398 HG SER 56 HG SER 56 34.828 -15.606 0.410 399 H ASN 57 H ASN 57 33.039 -12.238 1.427 400 HA ASN 57 HA ASN 57 31.352 -13.039 3.694 401 HB2 ASN 57 2HB ASN 57 31.114 -10.269 2.576 402 HB3 ASN 57 3HB ASN 57 30.647 -10.874 4.163 403 HD21 ASN 57 1HD2 ASN 57 32.484 -8.679 3.038 404 HD22 ASN 57 2HD2 ASN 57 33.920 -8.846 3.985 405 H ALA 58 H ALA 58 31.050 -14.482 1.565 406 HA ALA 58 HA ALA 58 28.783 -13.319 0.081 407 HB1 ALA 58 1HB ALA 58 29.800 -13.900 -1.801 408 HB2 ALA 58 2HB ALA 58 31.153 -14.559 -0.881 409 HB3 ALA 58 3HB ALA 58 29.781 -15.588 -1.290 410 H SER 59 H SER 59 29.946 -15.961 2.002 411 HA SER 59 HA SER 59 28.083 -17.941 1.446 412 HB2 SER 59 2HB SER 59 29.358 -17.247 4.104 413 HB3 SER 59 3HB SER 59 28.524 -18.759 3.749 414 HG SER 59 HG SER 59 30.987 -17.812 2.800 415 H ASP 60 H ASP 60 27.840 -15.175 3.635 416 HA ASP 60 HA ASP 60 25.039 -14.984 3.368 417 HB2 ASP 60 2HB ASP 60 25.705 -17.002 5.098 418 HB3 ASP 60 3HB ASP 60 25.519 -15.635 6.194 419 H SER 61 H SER 61 24.319 -13.740 5.704 420 HA SER 61 HA SER 61 25.212 -11.158 5.393 421 HB2 SER 61 2HB SER 61 23.375 -11.086 6.721 422 HB3 SER 61 3HB SER 61 23.746 -12.632 7.484 423 HG SER 61 HG SER 61 24.732 -11.620 9.049 424 H HIS 62 H HIS 62 26.265 -13.437 7.926 425 HA HIS 62 HA HIS 62 28.357 -11.723 8.841 426 HB2 HIS 62 2HB HIS 62 28.924 -13.468 10.350 427 HB3 HIS 62 3HB HIS 62 27.169 -13.504 10.205 428 HD1 HIS 62 HD1 HIS 62 26.134 -15.510 8.886 429 HD2 HIS 62 HD2 HIS 62 30.241 -15.743 9.467 430 HE1 HIS 62 HE1 HIS 62 26.755 -17.888 8.350 431 H GLY 63 H GLY 63 30.457 -11.628 8.266 432 HA2 GLY 63 2HA GLY 63 31.299 -13.388 6.056 433 HA3 GLY 63 3HA GLY 63 31.932 -11.776 6.359 434 H LEU 64 H LEU 64 34.073 -12.327 6.497 435 HA LEU 64 HA LEU 64 35.085 -13.129 8.972 436 HB2 LEU 64 2HB LEU 64 36.134 -15.302 8.236 437 HB3 LEU 64 3HB LEU 64 34.404 -15.340 8.570 438 HG LEU 64 HG LEU 64 35.010 -14.848 5.760 439 HD11 LEU 64 1HD1 LEU 64 35.987 -16.877 5.177 440 HD12 LEU 64 2HD1 LEU 64 35.666 -17.597 6.754 441 HD13 LEU 64 3HD1 LEU 64 36.914 -16.363 6.586 442 HD21 LEU 64 3HD2 LEU 64 33.485 -16.996 5.743 443 HD22 LEU 64 1HD2 LEU 64 32.822 -15.407 6.124 444 HD23 LEU 64 2HD2 LEU 64 33.209 -16.536 7.424 445 H ALA 65 H ALA 65 36.344 -11.299 8.533 446 HA ALA 65 HA ALA 65 38.067 -11.196 6.234 447 HB1 ALA 65 1HB ALA 65 37.663 -9.054 6.796 448 HB2 ALA 65 2HB ALA 65 37.416 -9.435 8.500 449 HB3 ALA 65 3HB ALA 65 39.052 -9.280 7.859 450 H SER 66 H SER 66 39.936 -12.223 6.041 451 HA SER 66 HA SER 66 41.355 -13.041 8.488 452 HB2 SER 66 2HB SER 66 40.530 -14.863 6.955 453 HB3 SER 66 3HB SER 66 41.642 -14.251 5.731 454 HG SER 66 HG SER 66 42.507 -15.985 7.011 455 H THR 67 H THR 67 43.346 -12.295 8.863 456 HA THR 67 HA THR 67 44.852 -11.078 6.654 457 HB THR 67 HB THR 67 43.914 -9.163 7.689 458 HG1 THR 67 HG1 THR 67 45.919 -8.474 7.527 459 HG21 THR 67 3HG2 THR 67 43.077 -10.150 9.732 460 HG22 THR 67 1HG2 THR 67 44.082 -8.757 10.131 461 HG23 THR 67 2HG2 THR 67 44.719 -10.390 10.328 462 H LEU 68 H LEU 68 46.914 -11.704 6.593 463 HA LEU 68 HA LEU 68 48.106 -12.835 9.038 464 HB2 LEU 68 2HB LEU 68 47.536 -14.613 7.477 465 HB3 LEU 68 3HB LEU 68 48.438 -13.799 6.201 466 HG LEU 68 HG LEU 68 50.308 -14.146 8.214 467 HD11 LEU 68 1HD1 LEU 68 48.579 -16.606 7.995 468 HD12 LEU 68 2HD1 LEU 68 48.829 -15.622 9.437 469 HD13 LEU 68 3HD1 LEU 68 50.171 -16.540 8.752 470 HD21 LEU 68 3HD2 LEU 68 50.895 -16.177 6.607 471 HD22 LEU 68 1HD2 LEU 68 51.113 -14.497 6.116 472 HD23 LEU 68 2HD2 LEU 68 49.684 -15.390 5.594 473 H ASN 69 H ASN 69 48.783 -10.486 9.145 474 HA ASN 69 HA ASN 69 51.454 -10.272 8.003 475 HB2 ASN 69 2HB ASN 69 51.158 -8.173 6.989 476 HB3 ASN 69 3HB ASN 69 49.732 -9.084 6.500 477 HD21 ASN 69 1HD2 ASN 69 50.865 -6.261 7.892 478 HD22 ASN 69 2HD2 ASN 69 49.368 -5.657 8.509 479 H GLN 70 H GLN 70 52.508 -8.159 8.900 480 HA GLN 70 HA GLN 70 51.764 -7.938 11.742 481 HB2 GLN 70 2HB GLN 70 54.522 -7.691 10.530 482 HB3 GLN 70 3HB GLN 70 54.128 -7.577 12.240 483 HG2 GLN 70 2HG GLN 70 53.226 -9.938 12.038 484 HG3 GLN 70 3HG GLN 70 54.017 -9.990 10.463 485 HE21 GLN 70 1HE2 GLN 70 54.684 -9.204 13.853 486 HE22 GLN 70 2HE2 GLN 70 56.284 -9.855 13.870 487 H GLY 71 H GLY 71 50.347 -6.204 10.657 488 HA2 GLY 71 2HA GLY 71 51.644 -3.658 11.134 489 HA3 GLY 71 3HA GLY 71 51.105 -3.904 9.479 490 H ASN 72 H ASN 72 49.192 -3.055 9.048 491 HA ASN 72 HA ASN 72 47.128 -3.092 11.143 492 HB2 ASN 72 2HB ASN 72 46.473 -0.850 10.676 493 HB3 ASN 72 3HB ASN 72 48.222 -0.821 10.877 494 HD21 ASN 72 1HD2 ASN 72 49.541 -0.564 9.051 495 HD22 ASN 72 2HD2 ASN 72 48.923 0.102 7.581 496 H VAL 73 H VAL 73 44.932 -2.964 10.335 497 HA VAL 73 HA VAL 73 44.628 -3.686 7.503 498 HB VAL 73 HB VAL 73 43.319 -5.149 9.801 499 HG11 VAL 73 1HG1 VAL 73 42.719 -6.649 7.691 500 HG12 VAL 73 2HG1 VAL 73 41.689 -5.317 8.221 501 HG13 VAL 73 3HG1 VAL 73 42.810 -5.087 6.879 502 HG21 VAL 73 3HG2 VAL 73 45.689 -5.688 8.122 503 HG22 VAL 73 1HG2 VAL 73 45.323 -6.199 9.770 504 HG23 VAL 73 2HG2 VAL 73 44.604 -7.050 8.403 505 H LYS 74 H LYS 74 42.850 -2.867 6.513 506 HA LYS 74 HA LYS 74 40.918 -1.406 8.190 507 HB2 LYS 74 2HB LYS 74 42.659 -0.026 6.835 508 HB3 LYS 74 3HB LYS 74 41.676 -0.461 5.443 509 HG2 LYS 74 2HG LYS 74 40.532 0.863 7.884 510 HG3 LYS 74 3HG LYS 74 41.185 1.768 6.517 511 HD2 LYS 74 2HD LYS 74 39.186 1.597 5.551 512 HD3 LYS 74 3HD LYS 74 39.478 -0.136 5.391 513 HE2 LYS 74 2HE LYS 74 37.422 0.008 6.498 514 HE3 LYS 74 3HE LYS 74 38.587 -0.322 7.780 515 HZ1 LYS 74 3HZ LYS 74 36.957 2.018 7.331 516 HZ2 LYS 74 1HZ LYS 74 38.567 2.362 7.720 517 HZ3 LYS 74 2HZ LYS 74 37.626 1.424 8.766 518 H VAL 75 H VAL 75 39.060 -2.482 8.058 519 HA VAL 75 HA VAL 75 38.266 -3.622 5.463 520 HB VAL 75 HB VAL 75 37.086 -4.309 8.152 521 HG11 VAL 75 1HG1 VAL 75 36.844 -5.418 5.380 522 HG12 VAL 75 2HG1 VAL 75 36.530 -6.431 6.790 523 HG13 VAL 75 3HG1 VAL 75 35.573 -4.974 6.519 524 HG21 VAL 75 3HG2 VAL 75 39.269 -5.035 8.436 525 HG22 VAL 75 1HG2 VAL 75 38.481 -6.460 7.759 526 HG23 VAL 75 2HG2 VAL 75 39.470 -5.426 6.728 527 H THR 76 H THR 76 36.680 -2.665 4.385 528 HA THR 76 HA THR 76 34.561 -1.275 5.845 529 HB THR 76 HB THR 76 35.022 0.355 3.614 530 HG1 THR 76 HG1 THR 76 37.238 -0.766 3.923 531 HG21 THR 76 3HG2 THR 76 34.267 1.532 5.401 532 HG22 THR 76 1HG2 THR 76 35.986 1.844 5.634 533 HG23 THR 76 2HG2 THR 76 35.188 0.573 6.559 534 H ALA 77 H ALA 77 32.584 -1.299 4.839 535 HA ALA 77 HA ALA 77 32.377 -2.241 2.092 536 HB1 ALA 77 1HB ALA 77 30.636 -3.698 3.990 537 HB2 ALA 77 2HB ALA 77 31.373 -4.235 2.480 538 HB3 ALA 77 3HB ALA 77 32.339 -4.156 3.953 539 H SER 78 H SER 78 30.369 -1.804 1.119 540 HA SER 78 HA SER 78 28.428 -0.293 2.714 541 HB2 SER 78 2HB SER 78 29.902 1.373 1.673 542 HB3 SER 78 3HB SER 78 29.594 0.665 0.088 543 HG SER 78 HG SER 78 28.249 2.449 0.419 544 H ILE 79 H ILE 79 26.337 -0.615 2.148 545 HA ILE 79 HA ILE 79 25.757 -1.998 -0.371 546 HB ILE 79 HB ILE 79 25.863 -3.807 1.187 547 HG12 ILE 79 2HG1 ILE 79 22.933 -3.116 0.949 548 HG13 ILE 79 3HG1 ILE 79 23.902 -3.657 -0.418 549 HG21 ILE 79 1HG2 ILE 79 23.834 -3.254 3.070 550 HG22 ILE 79 2HG2 ILE 79 25.560 -3.467 3.357 551 HG23 ILE 79 3HG2 ILE 79 24.912 -1.858 3.037 552 HD11 ILE 79 3HD1 ILE 79 23.022 -5.170 1.995 553 HD12 ILE 79 1HD1 ILE 79 22.899 -5.602 0.290 554 HD13 ILE 79 2HD1 ILE 79 24.460 -5.673 1.107 555 H GLY 80 H GLY 80 24.434 -0.644 -1.397 556 HA2 GLY 80 2HA GLY 80 22.546 0.591 -1.850 557 HA3 GLY 80 3HA GLY 80 21.869 -0.012 -0.344 558 H GLY 81 H GLY 81 21.158 1.693 0.765 559 HA2 GLY 81 2HA GLY 81 22.631 4.209 0.670 560 HA3 GLY 81 3HA GLY 81 21.046 3.957 1.385 561 H ILE 82 H ILE 82 23.396 1.639 2.246 562 HA ILE 82 HA ILE 82 24.144 3.099 4.672 563 HB ILE 82 HB ILE 82 23.118 0.266 4.793 564 HG12 ILE 82 2HG1 ILE 82 21.259 1.648 6.152 565 HG13 ILE 82 3HG1 ILE 82 21.697 2.870 4.964 566 HG21 ILE 82 1HG2 ILE 82 24.379 0.442 6.670 567 HG22 ILE 82 2HG2 ILE 82 24.247 2.199 6.728 568 HG23 ILE 82 3HG2 ILE 82 22.908 1.196 7.285 569 HD11 ILE 82 3HD1 ILE 82 21.107 1.408 3.162 570 HD12 ILE 82 1HD1 ILE 82 20.835 0.072 4.280 571 HD13 ILE 82 2HD1 ILE 82 19.767 1.475 4.306 572 H GLN 83 H GLN 83 26.006 2.263 5.745 573 HA GLN 83 HA GLN 83 27.484 0.102 4.519 574 HB2 GLN 83 2HB GLN 83 29.368 1.340 3.810 575 HB3 GLN 83 3HB GLN 83 27.973 2.190 3.158 576 HG2 GLN 83 2HG GLN 83 28.109 3.811 4.980 577 HG3 GLN 83 3HG GLN 83 29.511 2.961 5.628 578 HE21 GLN 83 1HE2 GLN 83 31.368 3.857 5.140 579 HE22 GLN 83 2HE2 GLN 83 31.724 4.766 3.714 580 H GLY 84 H GLY 84 29.523 -0.356 5.695 581 HA2 GLY 84 2HA GLY 84 29.394 0.621 8.481 582 HA3 GLY 84 3HA GLY 84 29.647 -1.076 8.099 583 H SER 85 H SER 85 31.401 0.362 9.707 584 HA SER 85 HA SER 85 33.833 0.152 8.109 585 HB2 SER 85 2HB SER 85 34.724 2.277 8.934 586 HB3 SER 85 3HB SER 85 33.224 2.547 8.048 587 HG SER 85 HG SER 85 33.723 2.711 10.805 588 H THR 86 H THR 86 35.555 -0.635 9.222 589 HA THR 86 HA THR 86 35.452 -0.753 12.137 590 HB THR 86 HB THR 86 34.425 -2.827 11.714 591 HG1 THR 86 HG1 THR 86 35.888 -4.152 12.632 592 HG21 THR 86 3HG2 THR 86 36.298 -2.961 9.392 593 HG22 THR 86 1HG2 THR 86 34.561 -3.256 9.451 594 HG23 THR 86 2HG2 THR 86 35.682 -4.459 10.089 595 H ASP 87 H ASP 87 37.478 -1.204 13.124 596 HA ASP 87 HA ASP 87 39.780 -0.904 11.307 597 HB2 ASP 87 2HB ASP 87 39.698 1.139 12.445 598 HB3 ASP 87 3HB ASP 87 39.192 0.385 13.955 599 H PHE 88 H PHE 88 41.261 -2.459 11.393 600 HA PHE 88 HA PHE 88 41.375 -4.157 13.796 601 HB2 PHE 88 2HB PHE 88 40.866 -4.899 11.021 602 HB3 PHE 88 3HB PHE 88 42.222 -5.782 11.715 603 HD1 PHE 88 HD2 PHE 88 38.989 -4.609 13.156 604 HD2 PHE 88 HD1 PHE 88 41.533 -7.903 12.260 605 HE1 PHE 88 HE2 PHE 88 37.418 -6.127 14.288 606 HE2 PHE 88 HE1 PHE 88 39.964 -9.426 13.389 607 HZ PHE 88 HZ PHE 88 37.904 -8.538 14.406 608 H LYS 89 H LYS 89 43.351 -4.539 14.617 609 HA LYS 89 HA LYS 89 45.680 -3.652 13.044 610 HB2 LYS 89 2HB LYS 89 44.873 -3.059 15.839 611 HB3 LYS 89 3HB LYS 89 46.585 -3.345 15.554 612 HG2 LYS 89 2HG LYS 89 45.981 -1.618 13.541 613 HG3 LYS 89 3HG LYS 89 44.908 -1.061 14.827 614 HD2 LYS 89 2HD LYS 89 47.840 -1.577 15.270 615 HD3 LYS 89 3HD LYS 89 47.220 -0.012 14.739 616 HE2 LYS 89 2HE LYS 89 45.707 -0.980 16.983 617 HE3 LYS 89 3HE LYS 89 47.428 -0.974 17.365 618 HZ1 LYS 89 3HZ LYS 89 46.529 1.404 16.015 619 HZ2 LYS 89 1HZ LYS 89 47.481 1.242 17.405 620 HZ3 LYS 89 2HZ LYS 89 45.795 1.168 17.521 621 H VAL 90 H VAL 90 46.922 -5.315 12.515 622 HA VAL 90 HA VAL 90 46.957 -7.686 14.244 623 HB VAL 90 HB VAL 90 48.092 -8.780 12.277 624 HG11 VAL 90 1HG1 VAL 90 45.493 -7.769 11.273 625 HG12 VAL 90 2HG1 VAL 90 46.086 -9.424 11.423 626 HG13 VAL 90 3HG1 VAL 90 45.499 -8.565 12.847 627 HG21 VAL 90 3HG2 VAL 90 48.720 -7.603 10.497 628 HG22 VAL 90 1HG2 VAL 90 47.101 -6.929 10.311 629 HG23 VAL 90 2HG2 VAL 90 48.269 -6.138 11.369 630 H THR 91 H THR 91 48.567 -7.803 15.650 631 HA THR 91 HA THR 91 51.252 -6.957 14.796 632 HB THR 91 HB THR 91 51.566 -6.317 17.301 633 HG1 THR 91 HG1 THR 91 49.679 -6.775 18.261 634 HG21 THR 91 3HG2 THR 91 49.890 -4.223 16.175 635 HG22 THR 91 1HG2 THR 91 51.034 -4.873 15.001 636 HG23 THR 91 2HG2 THR 91 51.617 -4.216 16.531 637 H GLN 92 H GLN 92 52.998 -7.941 16.062 638 HA GLN 92 HA GLN 92 54.088 -9.774 16.852 639 HB2 GLN 92 2HB GLN 92 51.637 -9.589 18.504 640 HB3 GLN 92 3HB GLN 92 52.497 -11.122 18.562 641 HG2 GLN 92 2HG GLN 92 54.541 -9.951 19.211 642 HG3 GLN 92 3HG GLN 92 53.673 -8.418 19.162 643 HE21 GLN 92 1HE2 GLN 92 54.124 -11.407 20.869 644 HE22 GLN 92 2HE2 GLN 92 53.301 -10.942 22.315
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