NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
650885 | 6trp | 34469 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 -30.959 7.418 1.037 2 HA MET 1 HA MET 1 -30.972 9.143 -0.739 3 HB2 MET 1 HB2 MET 1 -30.398 10.065 2.096 4 HB3 MET 1 HB3 MET 1 -30.679 11.196 0.773 5 HG2 MET 1 HG2 MET 1 -32.779 10.842 1.883 6 HG3 MET 1 HG3 MET 1 -32.837 10.143 0.266 7 HE1 MET 1 HE1 MET 1 -32.927 7.854 4.288 8 HE2 MET 1 HE2 MET 1 -31.540 8.880 3.867 9 HE3 MET 1 HE3 MET 1 -33.156 9.601 4.067 10 H ASN 2 H ASN 2 -28.270 10.107 1.495 11 HA ASN 2 HA ASN 2 -26.927 11.429 -0.638 12 HB2 ASN 2 HB2 ASN 2 -26.025 10.496 2.123 13 HB3 ASN 2 HB3 ASN 2 -24.954 11.304 0.994 14 HD21 ASN 2 HD21 ASN 2 -27.694 11.786 3.149 15 HD22 ASN 2 HD22 ASN 2 -27.821 13.516 2.931 16 H ILE 3 H ILE 3 -25.231 10.814 -1.793 17 HA ILE 3 HA ILE 3 -25.134 8.534 -3.128 18 HB ILE 3 HB ILE 3 -23.993 10.708 -3.588 19 HG12 ILE 3 HG12 ILE 3 -22.160 9.877 -4.913 20 HG13 ILE 3 HG13 ILE 3 -22.184 8.324 -4.095 21 HG21 ILE 3 HG21 ILE 3 -21.794 11.188 -2.769 22 HG22 ILE 3 HG22 ILE 3 -22.776 10.778 -1.359 23 HG23 ILE 3 HG23 ILE 3 -21.640 9.599 -1.998 24 HD11 ILE 3 HD11 ILE 3 -23.246 8.346 -6.359 25 HD12 ILE 3 HD12 ILE 3 -24.365 7.804 -5.094 26 HD13 ILE 3 HD13 ILE 3 -24.476 9.459 -5.750 27 H ASN 4 H ASN 4 -23.907 6.778 -3.409 28 HA ASN 4 HA ASN 4 -22.640 5.516 -1.037 29 HB2 ASN 4 HB2 ASN 4 -23.369 3.367 -2.155 30 HB3 ASN 4 HB3 ASN 4 -24.641 4.363 -1.454 31 HD21 ASN 4 HD21 ASN 4 -23.302 3.153 -4.472 32 HD22 ASN 4 HD22 ASN 4 -24.505 3.900 -5.528 33 H GLU 5 H GLU 5 -22.522 5.435 -4.612 34 HA GLU 5 HA GLU 5 -20.062 4.231 -4.894 35 HB2 GLU 5 HB2 GLU 5 -21.719 6.091 -6.556 36 HB3 GLU 5 HB3 GLU 5 -20.069 5.763 -7.090 37 HG2 GLU 5 HG2 GLU 5 -20.458 3.383 -7.195 38 HG3 GLU 5 HG3 GLU 5 -22.023 3.536 -6.397 39 H GLN 6 H GLN 6 -20.610 7.686 -4.384 40 HA GLN 6 HA GLN 6 -17.774 8.397 -4.756 41 HB2 GLN 6 HB2 GLN 6 -20.137 9.975 -3.724 42 HB3 GLN 6 HB3 GLN 6 -18.503 10.623 -3.764 43 HG2 GLN 6 HG2 GLN 6 -18.402 10.592 -6.142 44 HG3 GLN 6 HG3 GLN 6 -19.847 9.581 -6.272 45 HE21 GLN 6 HE21 GLN 6 -21.217 10.967 -7.400 46 HE22 GLN 6 HE22 GLN 6 -21.887 12.404 -6.645 47 H THR 7 H THR 7 -19.820 7.277 -2.102 48 HA THR 7 HA THR 7 -18.099 8.383 -0.036 49 HB THR 7 HB THR 7 -20.157 6.152 0.042 50 HG1 THR 7 HG1 THR 7 -21.550 7.749 0.065 51 HG21 THR 7 HG21 THR 7 -20.102 6.718 2.534 52 HG22 THR 7 HG22 THR 7 -18.634 7.696 2.179 53 HG23 THR 7 HG23 THR 7 -18.636 5.959 1.885 54 H LEU 8 H LEU 8 -18.325 5.287 -1.860 55 HA LEU 8 HA LEU 8 -16.633 3.630 -0.401 56 HB2 LEU 8 HB2 LEU 8 -16.323 3.746 -3.410 57 HB3 LEU 8 HB3 LEU 8 -16.307 2.378 -2.316 58 HG LEU 8 HG LEU 8 -18.737 4.004 -3.118 59 HD11 LEU 8 HD11 LEU 8 -19.586 2.019 -4.230 60 HD12 LEU 8 HD12 LEU 8 -18.095 1.159 -3.822 61 HD13 LEU 8 HD13 LEU 8 -18.049 2.573 -4.900 62 HD21 LEU 8 HD21 LEU 8 -20.093 2.298 -1.910 63 HD22 LEU 8 HD22 LEU 8 -19.095 3.274 -0.853 64 HD23 LEU 8 HD23 LEU 8 -18.573 1.625 -1.264 65 H ASP 9 H ASP 9 -15.856 6.444 -2.408 66 HA ASP 9 HA ASP 9 -13.140 6.079 -2.943 67 HB2 ASP 9 HB2 ASP 9 -14.841 8.459 -2.593 68 HB3 ASP 9 HB3 ASP 9 -13.133 8.741 -2.489 69 H LYS 10 H LYS 10 -14.705 7.280 0.083 70 HA LYS 10 HA LYS 10 -12.140 7.889 1.367 71 HB2 LYS 10 HB2 LYS 10 -13.260 8.567 3.223 72 HB3 LYS 10 HB3 LYS 10 -14.349 8.995 1.891 73 HG2 LYS 10 HG2 LYS 10 -15.690 7.034 2.386 74 HG3 LYS 10 HG3 LYS 10 -14.660 6.593 3.741 75 HD2 LYS 10 HD2 LYS 10 -15.726 9.358 3.785 76 HD3 LYS 10 HD3 LYS 10 -16.979 8.110 3.715 77 HE2 LYS 10 HE2 LYS 10 -14.683 7.728 5.601 78 HE3 LYS 10 HE3 LYS 10 -15.938 8.913 6.043 79 HZ1 LYS 10 HZ1 LYS 10 -16.525 6.795 6.958 80 HZ2 LYS 10 HZ2 LYS 10 -16.483 6.045 5.498 81 HZ3 LYS 10 HZ3 LYS 10 -17.605 7.167 5.809 82 H LEU 11 H LEU 11 -14.143 5.092 1.007 83 HA LEU 11 HA LEU 11 -12.996 3.584 3.237 84 HB2 LEU 11 HB2 LEU 11 -14.842 2.756 0.935 85 HB3 LEU 11 HB3 LEU 11 -14.160 1.662 2.150 86 HG LEU 11 HG LEU 11 -16.316 2.035 2.792 87 HD11 LEU 11 HD11 LEU 11 -14.684 3.860 4.587 88 HD12 LEU 11 HD12 LEU 11 -14.829 2.069 4.674 89 HD13 LEU 11 HD13 LEU 11 -16.235 3.079 4.936 90 HD21 LEU 11 HD21 LEU 11 -17.242 4.333 3.267 91 HD22 LEU 11 HD22 LEU 11 -16.990 4.008 1.576 92 HD23 LEU 11 HD23 LEU 11 -15.839 4.999 2.462 93 H ARG 12 H ARG 12 -12.802 3.335 -0.345 94 HA ARG 12 HA ARG 12 -10.871 1.285 -0.348 95 HB2 ARG 12 HB2 ARG 12 -10.365 2.107 -2.698 96 HB3 ARG 12 HB3 ARG 12 -11.992 1.623 -2.332 97 HG2 ARG 12 HG2 ARG 12 -12.773 3.604 -3.094 98 HG3 ARG 12 HG3 ARG 12 -11.916 4.419 -1.775 99 HD2 ARG 12 HD2 ARG 12 -9.887 4.025 -3.364 100 HD3 ARG 12 HD3 ARG 12 -11.212 4.156 -4.575 101 HE ARG 12 HE ARG 12 -10.688 6.201 -2.464 102 HH11 ARG 12 HH11 ARG 12 -11.595 5.668 -5.889 103 HH12 ARG 12 HH12 ARG 12 -11.171 7.266 -6.332 104 HH21 ARG 12 HH21 ARG 12 -10.135 8.317 -3.135 105 HH22 ARG 12 HH22 ARG 12 -10.561 8.787 -4.735 106 H GLN 13 H GLN 13 -10.336 4.804 -0.271 107 HA GLN 13 HA GLN 13 -7.504 4.553 -0.383 108 HB2 GLN 13 HB2 GLN 13 -7.429 6.886 0.096 109 HB3 GLN 13 HB3 GLN 13 -8.791 6.529 -0.976 110 HG2 GLN 13 HG2 GLN 13 -9.818 7.961 0.444 111 HG3 GLN 13 HG3 GLN 13 -10.193 6.432 1.188 112 HE21 GLN 13 HE21 GLN 13 -10.245 6.790 3.421 113 HE22 GLN 13 HE22 GLN 13 -8.975 7.706 4.261 114 H ALA 14 H ALA 14 -9.811 4.353 2.358 115 HA ALA 14 HA ALA 14 -7.848 4.470 4.417 116 HB1 ALA 14 HB1 ALA 14 -10.711 3.460 4.203 117 HB2 ALA 14 HB2 ALA 14 -9.796 3.333 5.703 118 HB3 ALA 14 HB3 ALA 14 -10.124 4.925 4.988 119 H VAL 15 H VAL 15 -9.233 1.859 2.408 120 HA VAL 15 HA VAL 15 -7.949 -0.270 3.839 121 HB VAL 15 HB VAL 15 -9.146 -0.159 1.058 122 HG11 VAL 15 HG11 VAL 15 -8.452 -2.630 2.734 123 HG12 VAL 15 HG12 VAL 15 -9.249 -2.634 1.153 124 HG13 VAL 15 HG13 VAL 15 -7.569 -2.124 1.285 125 HG21 VAL 15 HG21 VAL 15 -10.934 0.180 2.549 126 HG22 VAL 15 HG22 VAL 15 -10.945 -1.514 2.182 127 HG23 VAL 15 HG23 VAL 15 -10.283 -0.960 3.736 128 H LEU 16 H LEU 16 -7.256 1.268 0.574 129 HA LEU 16 HA LEU 16 -4.973 -0.243 0.087 130 HB2 LEU 16 HB2 LEU 16 -4.326 1.224 -1.588 131 HB3 LEU 16 HB3 LEU 16 -6.067 1.223 -1.551 132 HG LEU 16 HG LEU 16 -5.691 3.409 -0.033 133 HD11 LEU 16 HD11 LEU 16 -3.196 3.334 -0.077 134 HD12 LEU 16 HD12 LEU 16 -3.792 4.749 -0.941 135 HD13 LEU 16 HD13 LEU 16 -3.230 3.345 -1.848 136 HD21 LEU 16 HD21 LEU 16 -6.961 3.252 -2.178 137 HD22 LEU 16 HD22 LEU 16 -5.427 3.396 -3.055 138 HD23 LEU 16 HD23 LEU 16 -6.007 4.739 -2.068 139 H GLN 17 H GLN 17 -5.215 2.569 2.269 140 HA GLN 17 HA GLN 17 -2.457 2.998 2.593 141 HB2 GLN 17 HB2 GLN 17 -4.829 3.405 4.420 142 HB3 GLN 17 HB3 GLN 17 -3.178 3.758 4.974 143 HG2 GLN 17 HG2 GLN 17 -2.790 5.341 3.218 144 HG3 GLN 17 HG3 GLN 17 -4.226 4.831 2.336 145 HE21 GLN 17 HE21 GLN 17 -5.378 6.725 2.274 146 HE22 GLN 17 HE22 GLN 17 -5.956 7.610 3.656 147 H LYS 18 H LYS 18 -4.445 0.262 4.094 148 HA LYS 18 HA LYS 18 -2.103 -0.443 5.694 149 HB2 LYS 18 HB2 LYS 18 -3.195 -2.446 6.265 150 HB3 LYS 18 HB3 LYS 18 -4.313 -1.110 6.479 151 HG2 LYS 18 HG2 LYS 18 -4.733 -2.274 3.857 152 HG3 LYS 18 HG3 LYS 18 -4.624 -3.574 4.989 153 HD2 LYS 18 HD2 LYS 18 -6.447 -1.192 5.585 154 HD3 LYS 18 HD3 LYS 18 -6.906 -2.466 4.460 155 HE2 LYS 18 HE2 LYS 18 -7.826 -3.259 6.369 156 HE3 LYS 18 HE3 LYS 18 -6.309 -4.155 6.250 157 HZ1 LYS 18 HZ1 LYS 18 -5.418 -2.868 8.009 158 HZ2 LYS 18 HZ2 LYS 18 -6.924 -3.300 8.495 159 HZ3 LYS 18 HZ3 LYS 18 -6.688 -1.789 7.981 160 H LYS 19 H LYS 19 -3.448 -1.376 2.518 161 HA LYS 19 HA LYS 19 -1.774 -3.550 1.988 162 HB2 LYS 19 HB2 LYS 19 -3.086 -1.546 0.114 163 HB3 LYS 19 HB3 LYS 19 -2.047 -2.838 -0.477 164 HG2 LYS 19 HG2 LYS 19 -3.390 -4.526 0.632 165 HG3 LYS 19 HG3 LYS 19 -4.448 -3.301 1.345 166 HD2 LYS 19 HD2 LYS 19 -5.391 -2.757 -0.836 167 HD3 LYS 19 HD3 LYS 19 -4.180 -3.769 -1.664 168 HE2 LYS 19 HE2 LYS 19 -4.963 -5.767 -0.507 169 HE3 LYS 19 HE3 LYS 19 -6.107 -4.834 0.455 170 HZ1 LYS 19 HZ1 LYS 19 -7.065 -6.000 -1.479 171 HZ2 LYS 19 HZ2 LYS 19 -6.199 -5.077 -2.489 172 HZ3 LYS 19 HZ3 LYS 19 -7.347 -4.381 -1.553 173 H ILE 20 H ILE 20 -0.961 -0.071 1.807 174 HA ILE 20 HA ILE 20 1.469 -0.504 0.400 175 HB ILE 20 HB ILE 20 1.201 1.658 2.464 176 HG12 ILE 20 HG12 ILE 20 -0.872 1.941 1.393 177 HG13 ILE 20 HG13 ILE 20 0.197 3.137 0.720 178 HG21 ILE 20 HG21 ILE 20 2.587 1.551 -0.245 179 HG22 ILE 20 HG22 ILE 20 2.536 2.954 0.839 180 HG23 ILE 20 HG23 ILE 20 3.359 1.475 1.350 181 HD11 ILE 20 HD11 ILE 20 -1.071 2.284 -1.109 182 HD12 ILE 20 HD12 ILE 20 0.521 1.526 -1.269 183 HD13 ILE 20 HD13 ILE 20 -0.834 0.599 -0.622 184 H LYS 21 H LYS 21 0.672 -0.666 3.884 185 HA LYS 21 HA LYS 21 3.362 -1.104 4.821 186 HB2 LYS 21 HB2 LYS 21 0.826 -2.000 6.209 187 HB3 LYS 21 HB3 LYS 21 2.408 -1.651 6.897 188 HG2 LYS 21 HG2 LYS 21 2.096 0.767 6.000 189 HG3 LYS 21 HG3 LYS 21 0.398 0.312 5.745 190 HD2 LYS 21 HD2 LYS 21 1.909 0.235 8.396 191 HD3 LYS 21 HD3 LYS 21 0.790 1.508 7.902 192 HE2 LYS 21 HE2 LYS 21 -1.063 -0.107 7.795 193 HE3 LYS 21 HE3 LYS 21 0.042 -1.425 8.222 194 HZ1 LYS 21 HZ1 LYS 21 -0.628 0.868 9.960 195 HZ2 LYS 21 HZ2 LYS 21 0.455 -0.315 10.341 196 HZ3 LYS 21 HZ3 LYS 21 -1.121 -0.699 10.155 197 H GLU 22 H GLU 22 0.774 -3.140 3.537 198 HA GLU 22 HA GLU 22 1.849 -5.645 4.535 199 HB2 GLU 22 HB2 GLU 22 -0.164 -4.994 2.348 200 HB3 GLU 22 HB3 GLU 22 0.241 -6.641 2.882 201 HG2 GLU 22 HG2 GLU 22 -0.423 -6.165 5.123 202 HG3 GLU 22 HG3 GLU 22 -0.757 -4.482 4.780 203 H ARG 23 H ARG 23 1.835 -4.041 1.297 204 HA ARG 23 HA ARG 23 3.547 -6.002 0.133 205 HB2 ARG 23 HB2 ARG 23 3.928 -4.401 -1.705 206 HB3 ARG 23 HB3 ARG 23 2.241 -4.592 -1.282 207 HG2 ARG 23 HG2 ARG 23 2.230 -2.361 -1.486 208 HG3 ARG 23 HG3 ARG 23 2.652 -2.449 0.192 209 HD2 ARG 23 HD2 ARG 23 4.056 -0.797 -0.872 210 HD3 ARG 23 HD3 ARG 23 5.074 -2.131 -0.359 211 HE ARG 23 HE ARG 23 5.563 -2.660 -2.538 212 HH11 ARG 23 HH11 ARG 23 2.731 -0.553 -2.507 213 HH12 ARG 23 HH12 ARG 23 2.434 -0.703 -4.204 214 HH21 ARG 23 HH21 ARG 23 5.478 -2.440 -4.829 215 HH22 ARG 23 HH22 ARG 23 4.156 -1.654 -5.577 216 H ILE 24 H ILE 24 4.430 -2.940 1.866 217 HA ILE 24 HA ILE 24 7.208 -3.263 1.217 218 HB ILE 24 HB ILE 24 6.186 -1.111 1.845 219 HG12 ILE 24 HG12 ILE 24 8.472 -2.089 3.581 220 HG13 ILE 24 HG13 ILE 24 8.570 -1.200 2.063 221 HG21 ILE 24 HG21 ILE 24 4.772 -2.163 3.693 222 HG22 ILE 24 HG22 ILE 24 6.160 -2.002 4.759 223 HG23 ILE 24 HG23 ILE 24 5.423 -0.563 4.005 224 HD11 ILE 24 HD11 ILE 24 7.641 -0.199 4.785 225 HD12 ILE 24 HD12 ILE 24 9.088 0.287 3.911 226 HD13 ILE 24 HD13 ILE 24 7.480 0.763 3.291 227 H GLN 25 H GLN 25 5.273 -4.254 4.149 228 HA GLN 25 HA GLN 25 7.631 -5.251 5.478 229 HB2 GLN 25 HB2 GLN 25 5.506 -4.432 6.556 230 HB3 GLN 25 HB3 GLN 25 4.663 -5.833 5.881 231 HG2 GLN 25 HG2 GLN 25 6.398 -7.253 7.213 232 HG3 GLN 25 HG3 GLN 25 6.817 -5.727 8.001 233 HE21 GLN 25 HE21 GLN 25 5.629 -5.517 9.968 234 HE22 GLN 25 HE22 GLN 25 3.960 -6.063 10.165 235 H ASN 26 H ASN 26 4.924 -6.913 3.755 236 HA ASN 26 HA ASN 26 6.122 -9.514 4.291 237 HB2 ASN 26 HB2 ASN 26 3.804 -8.746 2.463 238 HB3 ASN 26 HB3 ASN 26 4.269 -10.379 2.899 239 HD21 ASN 26 HD21 ASN 26 2.880 -7.411 4.148 240 HD22 ASN 26 HD22 ASN 26 2.163 -8.177 5.580 241 H SER 27 H SER 27 5.641 -7.434 1.397 242 HA SER 27 HA SER 27 6.582 -7.466 -0.673 243 HB2 SER 27 HB2 SER 27 8.738 -7.653 1.387 244 HB3 SER 27 HB3 SER 27 9.264 -7.850 -0.306 245 HG SER 27 HG SER 27 7.487 -5.792 0.401 246 H LEU 28 H LEU 28 5.705 -10.122 0.413 247 HA LEU 28 HA LEU 28 6.932 -11.868 -1.641 248 HB2 LEU 28 HB2 LEU 28 6.544 -13.735 -0.044 249 HB3 LEU 28 HB3 LEU 28 7.602 -12.495 0.588 250 HG LEU 28 HG LEU 28 5.594 -11.500 1.786 251 HD11 LEU 28 HD11 LEU 28 3.699 -12.483 0.844 252 HD12 LEU 28 HD12 LEU 28 3.838 -13.138 2.453 253 HD13 LEU 28 HD13 LEU 28 4.337 -14.139 1.064 254 HD21 LEU 28 HD21 LEU 28 5.830 -12.955 3.705 255 HD22 LEU 28 HD22 LEU 28 7.374 -12.594 2.941 256 HD23 LEU 28 HD23 LEU 28 6.628 -14.177 2.716 257 H SER 29 H SER 29 5.471 -13.846 -1.722 258 HA SER 29 HA SER 29 2.624 -13.125 -2.274 259 HB2 SER 29 HB2 SER 29 4.485 -14.894 -3.905 260 HB3 SER 29 HB3 SER 29 2.784 -14.492 -4.274 261 HG SER 29 HG SER 29 3.490 -12.266 -4.484 262 H THR 30 H THR 30 4.771 -16.048 -2.256 263 HA THR 30 HA THR 30 2.947 -17.307 -0.319 264 HB THR 30 HB THR 30 2.610 -18.043 -2.619 265 HG1 THR 30 HG1 THR 30 2.416 -19.481 -0.782 266 HG21 THR 30 HG21 THR 30 4.363 -19.462 -3.711 267 HG22 THR 30 HG22 THR 30 5.533 -18.931 -2.507 268 HG23 THR 30 HG23 THR 30 4.798 -17.752 -3.610 269 H GLU 31 H GLU 31 5.210 -15.774 0.442 270 HA GLU 31 HA GLU 31 7.126 -15.859 1.711 271 HB2 GLU 31 HB2 GLU 31 6.074 -18.563 2.599 272 HB3 GLU 31 HB3 GLU 31 7.041 -17.399 3.520 273 HG2 GLU 31 HG2 GLU 31 5.141 -15.759 3.388 274 HG3 GLU 31 HG3 GLU 31 4.160 -16.990 2.602 275 H LYS 32 H LYS 32 7.508 -16.652 -0.936 276 HA LYS 32 HA LYS 32 9.107 -18.942 -1.280 277 HB2 LYS 32 HB2 LYS 32 9.763 -18.010 -3.353 278 HB3 LYS 32 HB3 LYS 32 8.059 -17.681 -3.119 279 HG2 LYS 32 HG2 LYS 32 10.017 -15.565 -2.240 280 HG3 LYS 32 HG3 LYS 32 9.930 -15.871 -3.938 281 HD2 LYS 32 HD2 LYS 32 7.393 -15.355 -2.348 282 HD3 LYS 32 HD3 LYS 32 8.420 -14.003 -2.857 283 HE2 LYS 32 HE2 LYS 32 7.550 -16.174 -4.778 284 HE3 LYS 32 HE3 LYS 32 6.524 -14.752 -4.488 285 HZ1 LYS 32 HZ1 LYS 32 8.209 -13.322 -5.336 286 HZ2 LYS 32 HZ2 LYS 32 8.155 -14.597 -6.401 287 HZ3 LYS 32 HZ3 LYS 32 9.355 -14.460 -5.286 288 H TYR 33 H TYR 33 11.494 -18.907 -1.907 289 HA TYR 33 HA TYR 33 13.076 -17.570 0.170 290 HB2 TYR 33 HB2 TYR 33 13.983 -19.417 -2.059 291 HB3 TYR 33 HB3 TYR 33 14.933 -18.882 -0.680 292 HD1 TYR 33 HD1 TYR 33 12.776 -19.239 1.536 293 HD2 TYR 33 HD2 TYR 33 14.070 -21.773 -1.730 294 HE1 TYR 33 HE1 TYR 33 11.960 -21.207 2.739 295 HE2 TYR 33 HE2 TYR 33 13.284 -23.746 -0.508 296 HH TYR 33 HH TYR 33 12.546 -24.530 1.632 297 H GLY 34 H GLY 34 13.661 -17.842 -3.381 298 HA2 GLY 34 HA2 GLY 34 13.705 -15.964 -4.883 299 HA3 GLY 34 HA3 GLY 34 14.172 -14.901 -3.531 300 H SER 35 H SER 35 16.289 -14.334 -3.913 301 HA SER 35 HA SER 35 18.356 -16.356 -3.837 302 HB2 SER 35 HB2 SER 35 17.814 -14.895 -6.435 303 HB3 SER 35 HB3 SER 35 19.424 -15.536 -6.040 304 HG SER 35 HG SER 35 17.213 -17.218 -5.736 305 H GLY 36 H GLY 36 17.456 -12.891 -4.114 306 HA2 GLY 36 HA2 GLY 36 18.452 -11.048 -3.217 307 HA3 GLY 36 HA3 GLY 36 19.454 -12.120 -2.240 308 H SER 37 H SER 37 20.813 -10.045 -2.789 309 HA SER 37 HA SER 37 22.749 -10.723 -4.910 310 HB2 SER 37 HB2 SER 37 22.863 -8.298 -5.513 311 HB3 SER 37 HB3 SER 37 21.358 -9.100 -5.954 312 HG SER 37 HG SER 37 20.648 -8.156 -3.744 313 H GLY 38 H GLY 38 24.684 -8.941 -4.534 314 HA2 GLY 38 HA2 GLY 38 25.387 -8.861 -1.665 315 HA3 GLY 38 HA3 GLY 38 26.472 -9.613 -2.855 316 H SER 39 H SER 39 28.008 -7.793 -2.098 317 HA SER 39 HA SER 39 27.663 -5.450 -3.829 318 HB2 SER 39 HB2 SER 39 28.223 -3.942 -1.912 319 HB3 SER 39 HB3 SER 39 26.653 -4.729 -1.728 320 HG SER 39 HG SER 39 27.304 -5.748 -0.066 321 H GLY 40 H GLY 40 29.723 -3.990 -3.534 322 HA2 GLY 40 HA2 GLY 40 32.208 -5.496 -3.094 323 HA3 GLY 40 HA3 GLY 40 31.887 -4.845 -4.718 324 H SER 41 H SER 41 34.111 -3.771 -3.646 325 HA SER 41 HA SER 41 33.398 -1.012 -3.071 326 HB2 SER 41 HB2 SER 41 34.940 -1.016 -1.055 327 HB3 SER 41 HB3 SER 41 33.414 -1.885 -0.835 328 HG SER 41 HG SER 41 35.136 -3.112 -0.051 329 H GLY 42 H GLY 42 35.922 0.025 -2.604 330 HA2 GLY 42 HA2 GLY 42 37.787 -1.063 -4.582 331 HA3 GLY 42 HA3 GLY 42 37.149 0.581 -4.838 332 H SER 43 H SER 43 39.942 0.057 -4.314 333 HA SER 43 HA SER 43 40.585 0.445 -1.552 334 HB2 SER 43 HB2 SER 43 42.870 0.936 -2.747 335 HB3 SER 43 HB3 SER 43 42.186 -0.697 -2.803 336 HG SER 43 HG SER 43 42.950 0.316 -4.855 337 H GLY 44 H GLY 44 40.574 2.624 -4.412 338 HA2 GLY 44 HA2 GLY 44 40.315 4.959 -4.447 339 HA3 GLY 44 HA3 GLY 44 40.170 4.953 -2.672 340 H SER 45 H SER 45 41.688 6.896 -2.862 341 HA SER 45 HA SER 45 44.437 6.064 -2.488 342 HB2 SER 45 HB2 SER 45 45.228 7.801 -4.189 343 HB3 SER 45 HB3 SER 45 44.554 6.315 -4.873 344 HG SER 45 HG SER 45 42.968 8.629 -4.468 345 H GLY 46 H GLY 46 45.652 7.821 -1.440 346 HA2 GLY 46 HA2 GLY 46 45.899 9.854 -0.327 347 HA3 GLY 46 HA3 GLY 46 44.269 10.343 -0.840 348 H SER 47 H SER 47 43.725 10.994 1.373 349 HA SER 47 HA SER 47 42.707 8.867 3.003 350 HB2 SER 47 HB2 SER 47 45.135 9.038 3.715 351 HB3 SER 47 HB3 SER 47 44.830 10.730 4.170 352 HG SER 47 HG SER 47 44.634 9.058 5.859 353 H GLY 48 H GLY 48 41.364 9.927 4.779 354 HA2 GLY 48 HA2 GLY 48 40.832 12.530 5.264 355 HA3 GLY 48 HA3 GLY 48 39.973 12.242 3.730 356 H SER 49 H SER 49 38.139 12.768 5.402 357 HA SER 49 HA SER 49 37.394 10.544 7.181 358 HB2 SER 49 HB2 SER 49 35.959 13.112 6.355 359 HB3 SER 49 HB3 SER 49 35.389 11.972 7.590 360 HG SER 49 HG SER 49 37.958 13.170 7.699 361 H GLY 50 H GLY 50 35.696 9.057 6.732 362 HA2 GLY 50 HA2 GLY 50 34.220 9.251 4.185 363 HA3 GLY 50 HA3 GLY 50 35.249 7.832 4.488 364 H SER 51 H SER 51 32.096 9.082 4.953 365 HA SER 51 HA SER 51 31.262 6.862 6.511 366 HB2 SER 51 HB2 SER 51 30.394 8.248 8.458 367 HB3 SER 51 HB3 SER 51 32.136 8.007 8.430 368 HG SER 51 HG SER 51 32.386 10.062 7.631 369 H GLY 52 H GLY 52 28.806 7.387 7.141 370 HA2 GLY 52 HA2 GLY 52 27.333 9.312 5.647 371 HA3 GLY 52 HA3 GLY 52 27.309 7.737 4.824 372 H SER 53 H SER 53 24.937 8.866 5.929 373 HA SER 53 HA SER 53 23.950 6.758 7.570 374 HB2 SER 53 HB2 SER 53 25.249 8.211 9.251 375 HB3 SER 53 HB3 SER 53 24.178 9.546 8.800 376 HG SER 53 HG SER 53 23.189 8.783 10.463 377 H GLY 54 H GLY 54 21.529 7.082 7.709 378 HA2 GLY 54 HA2 GLY 54 20.334 9.411 6.350 379 HA3 GLY 54 HA3 GLY 54 20.155 7.830 5.575 380 H SER 55 H SER 55 17.979 9.477 6.720 381 HA SER 55 HA SER 55 16.667 7.441 8.263 382 HB2 SER 55 HB2 SER 55 16.307 8.866 10.286 383 HB3 SER 55 HB3 SER 55 17.985 8.396 10.067 384 HG SER 55 HG SER 55 18.310 10.502 9.054 385 H GLY 56 H GLY 56 14.425 8.574 9.132 386 HA2 GLY 56 HA2 GLY 56 13.009 10.563 8.492 387 HA3 GLY 56 HA3 GLY 56 13.342 10.121 6.822 388 H SER 57 H SER 57 10.766 10.326 7.910 389 HA SER 57 HA SER 57 9.582 7.811 7.183 390 HB2 SER 57 HB2 SER 57 8.815 8.986 9.887 391 HB3 SER 57 HB3 SER 57 8.300 7.453 9.185 392 HG SER 57 HG SER 57 10.415 6.699 9.419 393 H GLY 58 H GLY 58 7.388 8.336 6.423 394 HA2 GLY 58 HA2 GLY 58 6.218 10.954 7.023 395 HA3 GLY 58 HA3 GLY 58 6.833 10.754 5.370 396 H TYR 59 H TYR 59 4.697 10.855 4.505 397 HA TYR 59 HA TYR 59 2.644 8.902 5.290 398 HB2 TYR 59 HB2 TYR 59 2.768 11.008 3.105 399 HB3 TYR 59 HB3 TYR 59 1.406 9.936 3.346 400 HD1 TYR 59 HD1 TYR 59 -0.258 10.274 5.019 401 HD2 TYR 59 HD2 TYR 59 3.223 12.818 4.824 402 HE1 TYR 59 HE1 TYR 59 -1.376 11.930 6.481 403 HE2 TYR 59 HE2 TYR 59 2.110 14.461 6.277 404 HH TYR 59 HH TYR 59 0.101 15.082 7.225 405 H GLN3288 H GLN3288 2.199 8.809 2.103 406 HA GLN3288 HA GLN3288 3.377 6.206 1.773 407 HB2 GLN3288 HB2 GLN3288 2.530 6.342 -0.489 408 HB3 GLN3288 HB3 GLN3288 1.296 6.931 0.644 409 HG2 GLN3288 HG2 GLN3288 2.162 9.320 0.065 410 HG3 GLN3288 HG3 GLN3288 3.030 8.560 -1.270 411 HE21 GLN3288 HE21 GLN3288 1.724 7.451 -2.944 412 HE22 GLN3288 HE22 GLN3288 0.017 7.900 -3.144 413 H ILE3289 H ILE3289 4.945 5.623 0.064 414 HA ILE3289 HA ILE3289 7.076 7.649 -0.153 415 HB ILE3289 HB ILE3289 7.346 4.708 -0.749 416 HG12 ILE3289 HG12 ILE3289 7.970 6.215 1.833 417 HG13 ILE3289 HG13 ILE3289 6.716 4.989 1.607 418 HG21 ILE3289 HG21 ILE3289 9.783 5.279 -0.547 419 HG22 ILE3289 HG22 ILE3289 9.011 6.263 -1.787 420 HG23 ILE3289 HG23 ILE3289 9.357 6.961 -0.196 421 HD11 ILE3289 HD11 ILE3289 9.705 4.486 1.546 422 HD12 ILE3289 HD12 ILE3289 8.539 3.983 2.775 423 HD13 ILE3289 HD13 ILE3289 8.452 3.280 1.151 424 H GLU3290 H GLU3290 6.583 8.890 -1.866 425 HA GLU3290 HA GLU3290 5.176 7.845 -4.192 426 HB2 GLU3290 HB2 GLU3290 4.818 10.104 -3.161 427 HB3 GLU3290 HB3 GLU3290 6.378 10.612 -3.835 428 HG2 GLU3290 HG2 GLU3290 5.557 10.249 -6.107 429 HG3 GLU3290 HG3 GLU3290 4.160 9.363 -5.515 430 H THR3291 H THR3291 8.387 7.751 -3.268 431 HA THR3291 HA THR3291 9.316 7.374 -6.089 432 HB THR3291 HB THR3291 10.177 9.427 -5.362 433 HG1 THR3291 HG1 THR3291 12.307 9.083 -5.587 434 HG21 THR3291 HG21 THR3291 9.998 9.405 -2.968 435 HG22 THR3291 HG22 THR3291 11.681 9.696 -3.396 436 HG23 THR3291 HG23 THR3291 11.179 8.085 -2.834 437 H PHE3292 H PHE3292 8.210 5.228 -5.200 438 HA PHE3292 HA PHE3292 10.390 3.412 -4.846 439 HB2 PHE3292 HB2 PHE3292 10.197 4.186 -2.487 440 HB3 PHE3292 HB3 PHE3292 8.514 3.671 -2.471 441 HD1 PHE3292 HD1 PHE3292 11.556 1.859 -3.866 442 HD2 PHE3292 HD2 PHE3292 8.555 2.030 -0.771 443 HE1 PHE3292 HE1 PHE3292 12.270 -0.339 -3.051 444 HE2 PHE3292 HE2 PHE3292 9.301 -0.192 0.058 445 HZ PHE3292 HZ PHE3292 11.144 -1.389 -1.093 446 H PHE3293 H PHE3293 6.833 3.853 -4.431 447 HA PHE3293 HA PHE3293 6.432 1.533 -6.237 448 HB2 PHE3293 HB2 PHE3293 4.546 0.865 -4.601 449 HB3 PHE3293 HB3 PHE3293 6.171 0.352 -4.300 450 HD1 PHE3293 HD1 PHE3293 6.536 0.211 -1.966 451 HD2 PHE3293 HD2 PHE3293 4.326 3.570 -3.534 452 HE1 PHE3293 HE1 PHE3293 6.418 1.201 0.293 453 HE2 PHE3293 HE2 PHE3293 4.267 4.566 -1.327 454 HZ PHE3293 HZ PHE3293 5.296 3.397 0.642 455 H ALA3294 H ALA3294 5.939 4.698 -6.110 456 HA ALA3294 HA ALA3294 3.212 5.211 -6.148 457 HB1 ALA3294 HB1 ALA3294 3.793 7.128 -7.633 458 HB2 ALA3294 HB2 ALA3294 4.833 6.972 -6.217 459 HB3 ALA3294 HB3 ALA3294 5.429 6.459 -7.813 460 H GLN3295 H GLN3295 5.080 3.604 -8.676 461 HA GLN3295 HA GLN3295 2.928 3.951 -10.685 462 HB2 GLN3295 HB2 GLN3295 5.255 2.049 -10.796 463 HB3 GLN3295 HB3 GLN3295 4.251 2.612 -12.133 464 HG2 GLN3295 HG2 GLN3295 6.137 4.389 -10.518 465 HG3 GLN3295 HG3 GLN3295 6.494 3.692 -12.091 466 HE21 GLN3295 HE21 GLN3295 4.410 6.080 -10.414 467 HE22 GLN3295 HE22 GLN3295 3.910 6.901 -11.875 468 H ASP3296 H ASP3296 3.896 1.557 -8.307 469 HA ASP3296 HA ASP3296 2.099 -0.535 -9.390 470 HB2 ASP3296 HB2 ASP3296 3.750 -0.300 -6.831 471 HB3 ASP3296 HB3 ASP3296 2.604 -1.609 -7.098 472 H ILE3297 H ILE3297 2.021 2.106 -7.163 473 HA ILE3297 HA ILE3297 -0.156 1.476 -5.507 474 HB ILE3297 HB ILE3297 1.553 3.729 -6.078 475 HG12 ILE3297 HG12 ILE3297 1.161 4.346 -3.783 476 HG13 ILE3297 HG13 ILE3297 -0.255 3.293 -3.684 477 HG21 ILE3297 HG21 ILE3297 -1.304 4.606 -5.636 478 HG22 ILE3297 HG22 ILE3297 0.141 5.627 -5.477 479 HG23 ILE3297 HG23 ILE3297 -0.273 4.952 -7.048 480 HD11 ILE3297 HD11 ILE3297 1.943 2.481 -2.635 481 HD12 ILE3297 HD12 ILE3297 1.092 1.325 -3.687 482 HD13 ILE3297 HD13 ILE3297 2.514 2.206 -4.276 483 H GLU3298 H GLU3298 -0.104 3.133 -8.669 484 HA GLU3298 HA GLU3298 -2.885 3.672 -8.720 485 HB2 GLU3298 HB2 GLU3298 -2.601 4.007 -11.143 486 HB3 GLU3298 HB3 GLU3298 -1.454 4.907 -10.140 487 HG2 GLU3298 HG2 GLU3298 0.367 3.802 -10.902 488 HG3 GLU3298 HG3 GLU3298 -0.484 2.268 -11.078 489 H SER3299 H SER3299 -1.077 0.800 -9.442 490 HA SER3299 HA SER3299 -3.200 -0.590 -10.840 491 HB2 SER3299 HB2 SER3299 -0.516 -0.896 -10.774 492 HB3 SER3299 HB3 SER3299 -0.954 -2.144 -9.602 493 HG SER3299 HG SER3299 -2.272 -3.101 -11.168 494 H VAL3300 H VAL3300 -1.733 -0.846 -7.558 495 HA VAL3300 HA VAL3300 -3.588 -2.891 -6.744 496 HB VAL3300 HB VAL3300 -1.319 -2.396 -5.725 497 HG11 VAL3300 HG11 VAL3300 -1.622 -0.002 -5.233 498 HG12 VAL3300 HG12 VAL3300 -2.874 -0.368 -4.036 499 HG13 VAL3300 HG13 VAL3300 -1.212 -0.914 -3.777 500 HG21 VAL3300 HG21 VAL3300 -2.731 -4.085 -4.814 501 HG22 VAL3300 HG22 VAL3300 -2.058 -3.174 -3.456 502 HG23 VAL3300 HG23 VAL3300 -3.741 -2.911 -3.984 503 H GLN3301 H GLN3301 -3.656 0.667 -6.488 504 HA GLN3301 HA GLN3301 -6.047 0.665 -4.881 505 HB2 GLN3301 HB2 GLN3301 -6.094 2.987 -5.112 506 HB3 GLN3301 HB3 GLN3301 -4.420 2.496 -5.021 507 HG2 GLN3301 HG2 GLN3301 -4.134 3.869 -6.755 508 HG3 GLN3301 HG3 GLN3301 -4.775 2.546 -7.717 509 HE21 GLN3301 HE21 GLN3301 -7.632 2.762 -7.277 510 HE22 GLN3301 HE22 GLN3301 -8.087 4.324 -7.896 511 H LYS3302 H LYS3302 -5.465 0.416 -8.387 512 HA LYS3302 HA LYS3302 -8.058 1.079 -9.329 513 HB2 LYS3302 HB2 LYS3302 -5.720 -0.436 -10.383 514 HB3 LYS3302 HB3 LYS3302 -7.287 -0.838 -11.091 515 HG2 LYS3302 HG2 LYS3302 -7.655 1.401 -11.828 516 HG3 LYS3302 HG3 LYS3302 -6.322 2.020 -10.838 517 HD2 LYS3302 HD2 LYS3302 -5.637 1.961 -13.151 518 HD3 LYS3302 HD3 LYS3302 -4.697 0.779 -12.225 519 HE2 LYS3302 HE2 LYS3302 -6.316 -1.012 -13.040 520 HE3 LYS3302 HE3 LYS3302 -7.052 0.224 -14.077 521 HZ1 LYS3302 HZ1 LYS3302 -5.414 -1.040 -15.277 522 HZ2 LYS3302 HZ2 LYS3302 -4.231 -0.679 -14.190 523 HZ3 LYS3302 HZ3 LYS3302 -4.831 0.515 -15.084 524 H GLU3303 H GLU3303 -6.877 -1.779 -7.609 525 HA GLU3303 HA GLU3303 -9.112 -3.432 -8.446 526 HB2 GLU3303 HB2 GLU3303 -8.226 -5.119 -7.286 527 HB3 GLU3303 HB3 GLU3303 -6.820 -4.152 -7.742 528 HG2 GLU3303 HG2 GLU3303 -7.386 -3.106 -5.302 529 HG3 GLU3303 HG3 GLU3303 -8.087 -4.672 -5.083 530 H LEU3304 H LEU3304 -8.469 -1.321 -5.644 531 HA LEU3304 HA LEU3304 -10.954 -2.017 -4.332 532 HB2 LEU3304 HB2 LEU3304 -8.886 0.218 -3.913 533 HB3 LEU3304 HB3 LEU3304 -10.206 -0.136 -2.822 534 HG LEU3304 HG LEU3304 -7.727 -1.785 -3.410 535 HD11 LEU3304 HD11 LEU3304 -7.437 -1.599 -1.019 536 HD12 LEU3304 HD12 LEU3304 -9.104 -0.967 -0.853 537 HD13 LEU3304 HD13 LEU3304 -7.852 0.009 -1.638 538 HD21 LEU3304 HD21 LEU3304 -8.819 -3.509 -1.791 539 HD22 LEU3304 HD22 LEU3304 -9.343 -3.511 -3.489 540 HD23 LEU3304 HD23 LEU3304 -10.340 -2.754 -2.252 541 H GLU3305 H GLU3305 -10.056 0.736 -6.412 542 HA GLU3305 HA GLU3305 -12.203 2.395 -5.472 543 HB2 GLU3305 HB2 GLU3305 -11.927 3.644 -7.619 544 HB3 GLU3305 HB3 GLU3305 -10.454 3.436 -6.665 545 HG2 GLU3305 HG2 GLU3305 -9.743 1.586 -8.088 546 HG3 GLU3305 HG3 GLU3305 -11.210 1.686 -9.040 547 H ASN3306 H ASN3306 -12.321 -0.374 -7.533 548 HA ASN3306 HA ASN3306 -15.050 0.336 -8.431 549 HB2 ASN3306 HB2 ASN3306 -14.886 -1.278 -10.085 550 HB3 ASN3306 HB3 ASN3306 -13.317 -0.477 -10.068 551 HD21 ASN3306 HD21 ASN3306 -11.436 -1.561 -9.201 552 HD22 ASN3306 HD22 ASN3306 -11.541 -3.228 -8.728 553 H LEU3307 H LEU3307 -13.743 -1.021 -5.689 554 HA LEU3307 HA LEU3307 -15.707 -3.190 -5.375 555 HB2 LEU3307 HB2 LEU3307 -13.180 -2.407 -4.115 556 HB3 LEU3307 HB3 LEU3307 -14.421 -2.710 -2.948 557 HG LEU3307 HG LEU3307 -13.708 -4.796 -2.994 558 HD11 LEU3307 HD11 LEU3307 -15.839 -5.113 -4.348 559 HD12 LEU3307 HD12 LEU3307 -14.615 -6.367 -4.560 560 HD13 LEU3307 HD13 LEU3307 -14.807 -5.118 -5.800 561 HD21 LEU3307 HD21 LEU3307 -12.535 -4.529 -5.745 562 HD22 LEU3307 HD22 LEU3307 -12.314 -5.843 -4.570 563 HD23 LEU3307 HD23 LEU3307 -11.685 -4.225 -4.197 564 H SER3308 H SER3308 -17.072 -3.302 -3.475 565 HA SER3308 HA SER3308 -18.677 -0.909 -3.119 566 HB2 SER3308 HB2 SER3308 -18.947 -3.786 -2.142 567 HB3 SER3308 HB3 SER3308 -20.235 -2.570 -2.187 568 HG SER3308 HG SER3308 -20.398 -2.770 -4.284 569 H GLU3309 H GLU3309 -19.558 -0.485 -0.714 570 HA GLU3309 HA GLU3309 -17.295 -0.001 0.955 571 HB2 GLU3309 HB2 GLU3309 -20.317 0.152 1.378 572 HB3 GLU3309 HB3 GLU3309 -19.272 0.012 2.787 573 HG2 GLU3309 HG2 GLU3309 -17.982 1.983 1.501 574 HG3 GLU3309 HG3 GLU3309 -19.642 2.312 0.994 575 H GLU3310 H GLU3310 -19.882 -2.475 1.241 576 HA GLU3310 HA GLU3310 -18.904 -3.766 3.438 577 HB2 GLU3310 HB2 GLU3310 -20.103 -5.234 1.096 578 HB3 GLU3310 HB3 GLU3310 -20.245 -5.633 2.811 579 HG2 GLU3310 HG2 GLU3310 -21.457 -3.196 1.395 580 HG3 GLU3310 HG3 GLU3310 -22.303 -4.633 1.788 581 H GLU3311 H GLU3311 -17.300 -3.709 0.364 582 HA GLU3311 HA GLU3311 -15.733 -6.181 0.849 583 HB2 GLU3311 HB2 GLU3311 -15.644 -4.002 -1.238 584 HB3 GLU3311 HB3 GLU3311 -14.639 -5.417 -1.279 585 HG2 GLU3311 HG2 GLU3311 -17.595 -5.928 -1.105 586 HG3 GLU3311 HG3 GLU3311 -17.034 -5.162 -2.556 587 H LEU3312 H LEU3312 -15.306 -2.661 0.544 588 HA LEU3312 HA LEU3312 -12.555 -2.632 1.404 589 HB2 LEU3312 HB2 LEU3312 -14.342 -0.204 1.234 590 HB3 LEU3312 HB3 LEU3312 -12.631 -0.252 1.036 591 HG LEU3312 HG LEU3312 -14.341 -1.762 -0.967 592 HD11 LEU3312 HD11 LEU3312 -13.920 1.216 -0.944 593 HD12 LEU3312 HD12 LEU3312 -15.446 0.275 -0.872 594 HD13 LEU3312 HD13 LEU3312 -14.464 0.246 -2.337 595 HD21 LEU3312 HD21 LEU3312 -12.488 -1.222 -2.435 596 HD22 LEU3312 HD22 LEU3312 -12.057 -2.228 -1.034 597 HD23 LEU3312 HD23 LEU3312 -11.627 -0.508 -1.059 598 H LEU3313 H LEU3313 -15.531 -1.248 2.756 599 HA LEU3313 HA LEU3313 -14.618 -0.103 5.109 600 HB2 LEU3313 HB2 LEU3313 -16.833 0.290 4.072 601 HB3 LEU3313 HB3 LEU3313 -17.275 -1.378 4.410 602 HG LEU3313 HG LEU3313 -18.276 0.286 5.913 603 HD11 LEU3313 HD11 LEU3313 -18.435 -1.166 7.756 604 HD12 LEU3313 HD12 LEU3313 -16.927 -1.993 7.369 605 HD13 LEU3313 HD13 LEU3313 -18.340 -2.156 6.300 606 HD21 LEU3313 HD21 LEU3313 -15.650 0.160 7.418 607 HD22 LEU3313 HD22 LEU3313 -17.145 0.941 7.945 608 HD23 LEU3313 HD23 LEU3313 -16.268 1.588 6.560 609 H ALA3314 H ALA3314 -15.634 -3.470 4.308 610 HA ALA3314 HA ALA3314 -15.474 -4.395 6.994 611 HB1 ALA3314 HB1 ALA3314 -15.350 -6.666 5.893 612 HB2 ALA3314 HB2 ALA3314 -16.678 -5.638 5.332 613 HB3 ALA3314 HB3 ALA3314 -15.218 -5.818 4.325 614 H MET3315 H MET3315 -12.929 -3.846 4.633 615 HA MET3315 HA MET3315 -10.939 -5.546 5.903 616 HB2 MET3315 HB2 MET3315 -10.456 -3.196 4.050 617 HB3 MET3315 HB3 MET3315 -9.351 -4.509 4.396 618 HG2 MET3315 HG2 MET3315 -11.961 -5.425 3.414 619 HG3 MET3315 HG3 MET3315 -11.217 -4.317 2.317 620 HE1 MET3315 HE1 MET3315 -9.636 -8.520 3.503 621 HE2 MET3315 HE2 MET3315 -9.755 -7.231 4.720 622 HE3 MET3315 HE3 MET3315 -11.222 -7.837 3.910 623 H LEU3316 H LEU3316 -11.437 -2.027 5.693 624 HA LEU3316 HA LEU3316 -9.345 -1.340 7.543 625 HB2 LEU3316 HB2 LEU3316 -10.390 0.915 7.517 626 HB3 LEU3316 HB3 LEU3316 -9.961 0.262 5.953 627 HG LEU3316 HG LEU3316 -12.547 -0.525 6.010 628 HD11 LEU3316 HD11 LEU3316 -13.892 1.479 6.930 629 HD12 LEU3316 HD12 LEU3316 -12.431 2.008 7.769 630 HD13 LEU3316 HD13 LEU3316 -13.200 0.480 8.192 631 HD21 LEU3316 HD21 LEU3316 -12.922 1.059 4.421 632 HD22 LEU3316 HD22 LEU3316 -11.192 1.244 4.511 633 HD23 LEU3316 HD23 LEU3316 -12.242 2.381 5.386 634 H ASN3317 H ASN3317 -12.876 -1.888 7.951 635 HA ASN3317 HA ASN3317 -12.762 -1.149 10.743 636 HB2 ASN3317 HB2 ASN3317 -14.794 -1.154 9.027 637 HB3 ASN3317 HB3 ASN3317 -15.009 -2.804 9.585 638 HD21 ASN3317 HD21 ASN3317 -14.607 0.625 10.677 639 HD22 ASN3317 HD22 ASN3317 -15.641 0.426 12.069 640 H GLY3318 H GLY3318 -12.175 -4.005 8.908 641 HA2 GLY3318 HA2 GLY3318 -11.393 -6.097 9.543 642 HA3 GLY3318 HA3 GLY3318 -11.207 -5.466 11.188 643 H ASP3319 H ASP3319 -14.306 -5.375 9.489 644 HA ASP3319 HA ASP3319 -15.463 -7.467 11.281 645 HB2 ASP3319 HB2 ASP3319 -16.196 -4.618 10.753 646 HB3 ASP3319 HB3 ASP3319 -17.514 -5.776 10.730 647 H GLN3320 H GLN3320 -16.664 -8.965 10.411 648 HA GLN3320 HA GLN3320 -16.797 -9.065 7.491 649 HB2 GLN3320 HB2 GLN3320 -16.096 -11.013 8.931 650 HB3 GLN3320 HB3 GLN3320 -17.747 -11.089 9.549 651 HG2 GLN3320 HG2 GLN3320 -18.362 -11.145 6.949 652 HG3 GLN3320 HG3 GLN3320 -16.693 -11.681 6.766 653 HE21 GLN3320 HE21 GLN3320 -18.911 -13.226 5.993 654 HE22 GLN3320 HE22 GLN3320 -19.176 -14.549 7.111 655 H GLN3321 H GLN3321 -18.353 -7.743 6.745 656 HA GLN3321 HA GLN3321 -21.160 -8.429 7.250 657 HB2 GLN3321 HB2 GLN3321 -20.137 -5.579 7.485 658 HB3 GLN3321 HB3 GLN3321 -21.814 -5.976 7.153 659 HG2 GLN3321 HG2 GLN3321 -20.344 -6.852 9.673 660 HG3 GLN3321 HG3 GLN3321 -21.372 -5.438 9.536 661 HE21 GLN3321 HE21 GLN3321 -21.444 -8.999 9.248 662 HE22 GLN3321 HE22 GLN3321 -23.141 -9.212 9.629 Start of MODEL 2 1 H1 MET 1 H MET 1 -27.708 6.734 -4.876 2 HA MET 1 HA MET 1 -27.886 9.044 -6.699 3 HB2 MET 1 HB2 MET 1 -28.926 8.712 -3.853 4 HB3 MET 1 HB3 MET 1 -28.858 10.245 -4.710 5 HG2 MET 1 HG2 MET 1 -30.312 9.442 -6.431 6 HG3 MET 1 HG3 MET 1 -30.340 7.812 -5.735 7 HE1 MET 1 HE1 MET 1 -32.536 8.158 -2.552 8 HE2 MET 1 HE2 MET 1 -31.669 7.063 -3.648 9 HE3 MET 1 HE3 MET 1 -30.764 8.186 -2.604 10 H ASN 2 H ASN 2 -26.885 8.484 -3.249 11 HA ASN 2 HA ASN 2 -25.148 10.692 -3.331 12 HB2 ASN 2 HB2 ASN 2 -24.624 8.265 -1.582 13 HB3 ASN 2 HB3 ASN 2 -24.165 9.922 -1.261 14 HD21 ASN 2 HD21 ASN 2 -26.260 11.536 -1.028 15 HD22 ASN 2 HD22 ASN 2 -27.524 10.791 -0.084 16 H ILE 3 H ILE 3 -22.884 10.766 -3.561 17 HA ILE 3 HA ILE 3 -21.843 9.159 -5.661 18 HB ILE 3 HB ILE 3 -21.302 11.568 -5.004 19 HG12 ILE 3 HG12 ILE 3 -18.854 11.393 -5.667 20 HG13 ILE 3 HG13 ILE 3 -19.102 9.646 -5.788 21 HG21 ILE 3 HG21 ILE 3 -20.811 11.202 -2.622 22 HG22 ILE 3 HG22 ILE 3 -19.349 10.298 -3.047 23 HG23 ILE 3 HG23 ILE 3 -19.488 12.020 -3.458 24 HD11 ILE 3 HD11 ILE 3 -19.382 10.707 -7.978 25 HD12 ILE 3 HD12 ILE 3 -20.978 10.155 -7.441 26 HD13 ILE 3 HD13 ILE 3 -20.544 11.870 -7.311 27 H ASN 4 H ASN 4 -20.310 7.553 -5.693 28 HA ASN 4 HA ASN 4 -19.644 6.129 -3.148 29 HB2 ASN 4 HB2 ASN 4 -19.689 4.029 -4.438 30 HB3 ASN 4 HB3 ASN 4 -21.252 4.738 -4.138 31 HD21 ASN 4 HD21 ASN 4 -18.843 3.957 -6.662 32 HD22 ASN 4 HD22 ASN 4 -19.792 4.587 -7.979 33 H GLU 5 H GLU 5 -18.697 6.957 -6.499 34 HA GLU 5 HA GLU 5 -16.148 5.769 -6.584 35 HB2 GLU 5 HB2 GLU 5 -17.278 8.345 -7.740 36 HB3 GLU 5 HB3 GLU 5 -15.675 7.728 -8.182 37 HG2 GLU 5 HG2 GLU 5 -16.574 5.705 -9.083 38 HG3 GLU 5 HG3 GLU 5 -18.162 5.988 -8.410 39 H GLN 6 H GLN 6 -17.261 8.742 -5.263 40 HA GLN 6 HA GLN 6 -14.614 9.650 -4.304 41 HB2 GLN 6 HB2 GLN 6 -17.392 10.756 -4.110 42 HB3 GLN 6 HB3 GLN 6 -16.151 11.360 -3.019 43 HG2 GLN 6 HG2 GLN 6 -16.400 12.665 -5.161 44 HG3 GLN 6 HG3 GLN 6 -14.781 12.131 -4.732 45 HE21 GLN 6 HE21 GLN 6 -17.466 11.602 -7.071 46 HE22 GLN 6 HE22 GLN 6 -16.438 10.732 -8.214 47 H THR 7 H THR 7 -17.272 7.756 -2.947 48 HA THR 7 HA THR 7 -16.407 8.037 -0.204 49 HB THR 7 HB THR 7 -17.910 5.763 -1.517 50 HG1 THR 7 HG1 THR 7 -19.677 6.930 -1.169 51 HG21 THR 7 HG21 THR 7 -17.453 6.544 1.376 52 HG22 THR 7 HG22 THR 7 -17.025 5.037 0.551 53 HG23 THR 7 HG23 THR 7 -18.734 5.400 0.851 54 H LEU 8 H LEU 8 -15.575 5.758 -2.911 55 HA LEU 8 HA LEU 8 -14.155 3.837 -1.574 56 HB2 LEU 8 HB2 LEU 8 -13.015 5.154 -4.069 57 HB3 LEU 8 HB3 LEU 8 -12.914 3.491 -3.555 58 HG LEU 8 HG LEU 8 -15.272 4.911 -4.787 59 HD11 LEU 8 HD11 LEU 8 -13.349 4.267 -6.232 60 HD12 LEU 8 HD12 LEU 8 -14.870 3.525 -6.697 61 HD13 LEU 8 HD13 LEU 8 -13.652 2.570 -5.821 62 HD21 LEU 8 HD21 LEU 8 -15.217 2.011 -3.941 63 HD22 LEU 8 HD22 LEU 8 -16.513 2.824 -4.841 64 HD23 LEU 8 HD23 LEU 8 -16.183 3.313 -3.195 65 H ASP 9 H ASP 9 -13.281 7.191 -2.188 66 HA ASP 9 HA ASP 9 -10.519 7.239 -1.881 67 HB2 ASP 9 HB2 ASP 9 -12.099 9.143 -2.442 68 HB3 ASP 9 HB3 ASP 9 -12.411 9.303 -0.710 69 H LYS 10 H LYS 10 -13.060 7.355 0.712 70 HA LYS 10 HA LYS 10 -11.119 7.497 2.840 71 HB2 LYS 10 HB2 LYS 10 -12.827 7.368 4.380 72 HB3 LYS 10 HB3 LYS 10 -13.607 8.146 2.997 73 HG2 LYS 10 HG2 LYS 10 -14.672 6.074 2.385 74 HG3 LYS 10 HG3 LYS 10 -13.855 5.164 3.663 75 HD2 LYS 10 HD2 LYS 10 -15.797 7.413 4.095 76 HD3 LYS 10 HD3 LYS 10 -16.218 5.698 4.012 77 HE2 LYS 10 HE2 LYS 10 -14.609 5.284 5.923 78 HE3 LYS 10 HE3 LYS 10 -14.414 7.037 6.080 79 HZ1 LYS 10 HZ1 LYS 10 -16.093 6.157 7.580 80 HZ2 LYS 10 HZ2 LYS 10 -16.968 5.550 6.333 81 HZ3 LYS 10 HZ3 LYS 10 -16.797 7.181 6.508 82 H LEU 11 H LEU 11 -12.395 4.852 0.968 83 HA LEU 11 HA LEU 11 -11.755 2.753 2.915 84 HB2 LEU 11 HB2 LEU 11 -12.645 2.732 0.020 85 HB3 LEU 11 HB3 LEU 11 -12.178 1.287 0.915 86 HG LEU 11 HG LEU 11 -14.443 1.245 0.831 87 HD11 LEU 11 HD11 LEU 11 -13.834 0.613 2.983 88 HD12 LEU 11 HD12 LEU 11 -15.307 1.547 3.133 89 HD13 LEU 11 HD13 LEU 11 -13.769 2.299 3.592 90 HD21 LEU 11 HD21 LEU 11 -15.154 3.352 0.123 91 HD22 LEU 11 HD22 LEU 11 -14.534 4.150 1.569 92 HD23 LEU 11 HD23 LEU 11 -15.959 3.100 1.650 93 H ARG 12 H ARG 12 -10.433 3.837 -0.273 94 HA ARG 12 HA ARG 12 -8.214 2.050 -0.153 95 HB2 ARG 12 HB2 ARG 12 -7.115 3.674 -1.804 96 HB3 ARG 12 HB3 ARG 12 -8.527 2.755 -2.236 97 HG2 ARG 12 HG2 ARG 12 -9.575 4.562 -2.903 98 HG3 ARG 12 HG3 ARG 12 -9.528 5.225 -1.275 99 HD2 ARG 12 HD2 ARG 12 -7.042 5.529 -2.832 100 HD3 ARG 12 HD3 ARG 12 -8.502 6.388 -3.382 101 HE ARG 12 HE ARG 12 -8.667 7.065 -0.843 102 HH11 ARG 12 HH11 ARG 12 -5.740 7.184 -2.813 103 HH12 ARG 12 HH12 ARG 12 -5.271 8.767 -2.213 104 HH21 ARG 12 HH21 ARG 12 -8.180 9.272 -0.342 105 HH22 ARG 12 HH22 ARG 12 -6.576 9.834 -0.734 106 H GLN 13 H GLN 13 -8.417 5.428 0.978 107 HA GLN 13 HA GLN 13 -5.732 5.521 1.803 108 HB2 GLN 13 HB2 GLN 13 -6.275 7.480 2.998 109 HB3 GLN 13 HB3 GLN 13 -7.220 7.441 1.519 110 HG2 GLN 13 HG2 GLN 13 -8.865 8.082 2.982 111 HG3 GLN 13 HG3 GLN 13 -9.051 6.358 2.985 112 HE21 GLN 13 HE21 GLN 13 -9.787 5.909 4.993 113 HE22 GLN 13 HE22 GLN 13 -8.848 6.120 6.461 114 H ALA 14 H ALA 14 -8.540 3.967 3.386 115 HA ALA 14 HA ALA 14 -7.255 3.604 5.939 116 HB1 ALA 14 HB1 ALA 14 -9.099 1.933 6.262 117 HB2 ALA 14 HB2 ALA 14 -9.700 3.502 5.694 118 HB3 ALA 14 HB3 ALA 14 -9.569 2.143 4.567 119 H VAL 15 H VAL 15 -7.666 1.654 2.969 120 HA VAL 15 HA VAL 15 -6.293 -0.672 3.915 121 HB VAL 15 HB VAL 15 -6.882 0.303 1.088 122 HG11 VAL 15 HG11 VAL 15 -5.919 -2.415 2.069 123 HG12 VAL 15 HG12 VAL 15 -6.697 -2.150 0.489 124 HG13 VAL 15 HG13 VAL 15 -5.191 -1.340 0.840 125 HG21 VAL 15 HG21 VAL 15 -8.388 -1.403 3.076 126 HG22 VAL 15 HG22 VAL 15 -8.956 -0.022 2.122 127 HG23 VAL 15 HG23 VAL 15 -8.632 -1.519 1.322 128 H LEU 16 H LEU 16 -5.195 2.258 2.186 129 HA LEU 16 HA LEU 16 -2.545 1.260 1.774 130 HB2 LEU 16 HB2 LEU 16 -1.913 3.206 0.826 131 HB3 LEU 16 HB3 LEU 16 -3.632 3.129 0.521 132 HG LEU 16 HG LEU 16 -3.867 4.739 2.511 133 HD11 LEU 16 HD11 LEU 16 -1.008 5.366 1.713 134 HD12 LEU 16 HD12 LEU 16 -1.515 4.735 3.288 135 HD13 LEU 16 HD13 LEU 16 -2.041 6.340 2.771 136 HD21 LEU 16 HD21 LEU 16 -2.690 5.755 -0.119 137 HD22 LEU 16 HD22 LEU 16 -3.796 6.604 0.950 138 HD23 LEU 16 HD23 LEU 16 -4.365 5.199 0.060 139 H GLN 17 H GLN 17 -3.988 3.180 4.468 140 HA GLN 17 HA GLN 17 -1.619 3.579 5.890 141 HB2 GLN 17 HB2 GLN 17 -4.506 3.272 6.755 142 HB3 GLN 17 HB3 GLN 17 -3.218 3.376 7.960 143 HG2 GLN 17 HG2 GLN 17 -2.382 5.452 6.808 144 HG3 GLN 17 HG3 GLN 17 -3.794 5.376 5.756 145 HE21 GLN 17 HE21 GLN 17 -4.842 7.294 6.494 146 HE22 GLN 17 HE22 GLN 17 -5.115 7.653 8.202 147 H LYS 18 H LYS 18 -3.775 0.482 6.236 148 HA LYS 18 HA LYS 18 -1.840 -0.566 8.043 149 HB2 LYS 18 HB2 LYS 18 -3.012 -2.650 7.622 150 HB3 LYS 18 HB3 LYS 18 -4.047 -1.295 8.054 151 HG2 LYS 18 HG2 LYS 18 -4.442 -0.940 5.533 152 HG3 LYS 18 HG3 LYS 18 -3.773 -2.556 5.278 153 HD2 LYS 18 HD2 LYS 18 -5.974 -1.884 7.240 154 HD3 LYS 18 HD3 LYS 18 -6.323 -2.049 5.532 155 HE2 LYS 18 HE2 LYS 18 -6.750 -4.204 6.687 156 HE3 LYS 18 HE3 LYS 18 -5.583 -4.243 5.355 157 HZ1 LYS 18 HZ1 LYS 18 -4.865 -4.445 8.212 158 HZ2 LYS 18 HZ2 LYS 18 -3.797 -4.465 6.895 159 HZ3 LYS 18 HZ3 LYS 18 -4.867 -5.632 7.116 160 H LYS 19 H LYS 19 -2.145 -0.714 4.474 161 HA LYS 19 HA LYS 19 -0.248 -2.716 4.026 162 HB2 LYS 19 HB2 LYS 19 -1.418 -0.531 2.418 163 HB3 LYS 19 HB3 LYS 19 0.148 -1.087 1.848 164 HG2 LYS 19 HG2 LYS 19 -0.552 -3.273 1.477 165 HG3 LYS 19 HG3 LYS 19 -1.898 -3.160 2.628 166 HD2 LYS 19 HD2 LYS 19 -3.196 -1.822 1.160 167 HD3 LYS 19 HD3 LYS 19 -1.893 -1.615 0.009 168 HE2 LYS 19 HE2 LYS 19 -3.540 -3.293 -0.765 169 HE3 LYS 19 HE3 LYS 19 -1.904 -3.926 -0.600 170 HZ1 LYS 19 HZ1 LYS 19 -3.673 -5.388 0.234 171 HZ2 LYS 19 HZ2 LYS 19 -3.912 -4.385 1.536 172 HZ3 LYS 19 HZ3 LYS 19 -2.476 -5.109 1.291 173 H ILE 20 H ILE 20 0.394 0.668 4.985 174 HA ILE 20 HA ILE 20 3.099 0.713 4.295 175 HB ILE 20 HB ILE 20 1.866 1.998 6.778 176 HG12 ILE 20 HG12 ILE 20 0.418 2.885 5.227 177 HG13 ILE 20 HG13 ILE 20 1.676 4.082 5.263 178 HG21 ILE 20 HG21 ILE 20 4.278 2.772 5.101 179 HG22 ILE 20 HG22 ILE 20 3.607 3.736 6.436 180 HG23 ILE 20 HG23 ILE 20 4.291 2.142 6.753 181 HD11 ILE 20 HD11 ILE 20 2.646 2.864 3.202 182 HD12 ILE 20 HD12 ILE 20 1.114 2.040 3.077 183 HD13 ILE 20 HD13 ILE 20 1.153 3.810 2.983 184 H LYS 21 H LYS 21 1.425 -0.440 7.180 185 HA LYS 21 HA LYS 21 3.675 -1.272 8.783 186 HB2 LYS 21 HB2 LYS 21 0.942 -2.571 8.900 187 HB3 LYS 21 HB3 LYS 21 2.065 -2.224 10.197 188 HG2 LYS 21 HG2 LYS 21 1.529 0.222 9.982 189 HG3 LYS 21 HG3 LYS 21 0.390 -0.149 8.682 190 HD2 LYS 21 HD2 LYS 21 -0.812 -1.691 10.299 191 HD3 LYS 21 HD3 LYS 21 0.232 -1.009 11.563 192 HE2 LYS 21 HE2 LYS 21 -0.614 1.310 10.665 193 HE3 LYS 21 HE3 LYS 21 -1.856 0.373 9.815 194 HZ1 LYS 21 HZ1 LYS 21 -1.436 0.308 12.750 195 HZ2 LYS 21 HZ2 LYS 21 -2.655 -0.416 11.927 196 HZ3 LYS 21 HZ3 LYS 21 -2.595 1.214 11.977 197 H GLU 22 H GLU 22 1.701 -2.755 6.205 198 HA GLU 22 HA GLU 22 2.472 -5.472 6.895 199 HB2 GLU 22 HB2 GLU 22 1.084 -4.365 4.429 200 HB3 GLU 22 HB3 GLU 22 1.382 -6.075 4.760 201 HG2 GLU 22 HG2 GLU 22 0.120 -5.891 6.899 202 HG3 GLU 22 HG3 GLU 22 -0.204 -4.203 6.580 203 H ARG 23 H ARG 23 3.356 -3.176 4.264 204 HA ARG 23 HA ARG 23 5.355 -4.918 3.204 205 HB2 ARG 23 HB2 ARG 23 6.205 -3.016 1.938 206 HB3 ARG 23 HB3 ARG 23 4.465 -3.177 1.856 207 HG2 ARG 23 HG2 ARG 23 4.633 -0.914 2.079 208 HG3 ARG 23 HG3 ARG 23 4.445 -1.365 3.767 209 HD2 ARG 23 HD2 ARG 23 6.119 0.335 3.447 210 HD3 ARG 23 HD3 ARG 23 6.876 -1.121 4.082 211 HE ARG 23 HE ARG 23 6.943 -0.232 1.205 212 HH11 ARG 23 HH11 ARG 23 8.489 -2.457 3.629 213 HH12 ARG 23 HH12 ARG 23 9.870 -2.602 2.614 214 HH21 ARG 23 HH21 ARG 23 8.613 -1.085 -0.176 215 HH22 ARG 23 HH22 ARG 23 9.975 -1.820 0.582 216 H ILE 24 H ILE 24 5.574 -2.717 5.968 217 HA ILE 24 HA ILE 24 8.513 -2.893 5.992 218 HB ILE 24 HB ILE 24 7.442 -0.869 6.801 219 HG12 ILE 24 HG12 ILE 24 8.930 -2.481 8.925 220 HG13 ILE 24 HG13 ILE 24 9.587 -1.339 7.747 221 HG21 ILE 24 HG21 ILE 24 5.391 -2.059 7.704 222 HG22 ILE 24 HG22 ILE 24 6.297 -2.375 9.182 223 HG23 ILE 24 HG23 ILE 24 5.973 -0.707 8.637 224 HD11 ILE 24 HD11 ILE 24 7.749 -0.720 10.104 225 HD12 ILE 24 HD12 ILE 24 9.483 -0.330 9.951 226 HD13 ILE 24 HD13 ILE 24 8.299 0.479 8.894 227 H GLN 25 H GLN 25 5.753 -4.342 7.866 228 HA GLN 25 HA GLN 25 7.503 -5.799 9.596 229 HB2 GLN 25 HB2 GLN 25 5.119 -5.136 10.042 230 HB3 GLN 25 HB3 GLN 25 4.598 -6.311 8.822 231 HG2 GLN 25 HG2 GLN 25 5.919 -8.037 10.324 232 HG3 GLN 25 HG3 GLN 25 5.829 -6.754 11.533 233 HE21 GLN 25 HE21 GLN 25 3.657 -6.110 12.241 234 HE22 GLN 25 HE22 GLN 25 2.281 -7.204 12.021 235 H ASN 26 H ASN 26 5.597 -6.824 6.710 236 HA ASN 26 HA ASN 26 6.617 -9.539 6.905 237 HB2 ASN 26 HB2 ASN 26 5.157 -8.118 4.657 238 HB3 ASN 26 HB3 ASN 26 5.534 -9.836 4.684 239 HD21 ASN 26 HD21 ASN 26 3.566 -7.268 6.196 240 HD22 ASN 26 HD22 ASN 26 2.386 -8.412 6.842 241 H SER 27 H SER 27 7.134 -6.779 4.653 242 HA SER 27 HA SER 27 8.775 -6.189 3.250 243 HB2 SER 27 HB2 SER 27 9.908 -6.094 5.528 244 HB3 SER 27 HB3 SER 27 10.689 -7.629 5.096 245 HG SER 27 HG SER 27 11.878 -6.666 3.683 246 H LEU 28 H LEU 28 7.492 -8.879 2.964 247 HA LEU 28 HA LEU 28 9.285 -9.928 0.867 248 HB2 LEU 28 HB2 LEU 28 8.710 -12.233 1.548 249 HB3 LEU 28 HB3 LEU 28 9.628 -11.343 2.747 250 HG LEU 28 HG LEU 28 7.450 -10.911 3.993 251 HD11 LEU 28 HD11 LEU 28 6.373 -12.774 1.881 252 HD12 LEU 28 HD12 LEU 28 5.720 -11.240 2.489 253 HD13 LEU 28 HD13 LEU 28 5.654 -12.661 3.512 254 HD21 LEU 28 HD21 LEU 28 9.107 -12.550 4.700 255 HD22 LEU 28 HD22 LEU 28 8.370 -13.770 3.684 256 HD23 LEU 28 HD23 LEU 28 7.451 -13.110 5.045 257 H SER 29 H SER 29 7.959 -11.587 -0.425 258 HA SER 29 HA SER 29 5.289 -10.396 -1.097 259 HB2 SER 29 HB2 SER 29 7.431 -11.743 -2.760 260 HB3 SER 29 HB3 SER 29 5.816 -11.297 -3.314 261 HG SER 29 HG SER 29 7.285 -9.218 -2.174 262 H THR 30 H THR 30 7.089 -13.579 -1.176 263 HA THR 30 HA THR 30 4.522 -14.949 -0.662 264 HB THR 30 HB THR 30 4.809 -14.767 -3.119 265 HG1 THR 30 HG1 THR 30 4.946 -17.329 -1.945 266 HG21 THR 30 HG21 THR 30 6.429 -16.154 -4.307 267 HG22 THR 30 HG22 THR 30 7.222 -16.589 -2.779 268 HG23 THR 30 HG23 THR 30 7.222 -14.909 -3.344 269 H GLU 31 H GLU 31 6.827 -14.368 1.005 270 HA GLU 31 HA GLU 31 8.206 -15.377 2.494 271 HB2 GLU 31 HB2 GLU 31 6.744 -17.978 2.069 272 HB3 GLU 31 HB3 GLU 31 7.548 -17.344 3.523 273 HG2 GLU 31 HG2 GLU 31 5.888 -15.334 3.283 274 HG3 GLU 31 HG3 GLU 31 4.977 -16.415 2.210 275 H LYS 32 H LYS 32 9.139 -14.979 -0.008 276 HA LYS 32 HA LYS 32 10.672 -17.221 -1.000 277 HB2 LYS 32 HB2 LYS 32 10.385 -14.295 -1.601 278 HB3 LYS 32 HB3 LYS 32 11.931 -15.020 -2.057 279 HG2 LYS 32 HG2 LYS 32 10.852 -16.697 -3.410 280 HG3 LYS 32 HG3 LYS 32 9.274 -16.207 -2.836 281 HD2 LYS 32 HD2 LYS 32 11.118 -14.673 -4.690 282 HD3 LYS 32 HD3 LYS 32 9.540 -15.395 -5.044 283 HE2 LYS 32 HE2 LYS 32 8.662 -13.699 -3.232 284 HE3 LYS 32 HE3 LYS 32 10.163 -12.847 -3.545 285 HZ1 LYS 32 HZ1 LYS 32 8.088 -12.281 -4.958 286 HZ2 LYS 32 HZ2 LYS 32 8.404 -13.627 -5.794 287 HZ3 LYS 32 HZ3 LYS 32 9.540 -12.432 -5.711 288 H TYR 33 H TYR 33 13.123 -17.109 -0.922 289 HA TYR 33 HA TYR 33 14.267 -15.652 1.429 290 HB2 TYR 33 HB2 TYR 33 14.032 -17.878 2.197 291 HB3 TYR 33 HB3 TYR 33 14.587 -18.570 0.693 292 HD1 TYR 33 HD1 TYR 33 16.916 -18.973 0.280 293 HD2 TYR 33 HD2 TYR 33 15.709 -16.664 3.715 294 HE1 TYR 33 HE1 TYR 33 19.226 -19.066 1.131 295 HE2 TYR 33 HE2 TYR 33 18.023 -16.787 4.606 296 HH TYR 33 HH TYR 33 20.618 -18.633 2.963 297 H GLY 34 H GLY 34 15.396 -17.730 -1.302 298 HA2 GLY 34 HA2 GLY 34 16.416 -16.920 -3.273 299 HA3 GLY 34 HA3 GLY 34 16.757 -15.372 -2.497 300 H SER 35 H SER 35 18.864 -15.087 -1.857 301 HA SER 35 HA SER 35 20.437 -17.275 -0.768 302 HB2 SER 35 HB2 SER 35 20.738 -17.746 -3.142 303 HB3 SER 35 HB3 SER 35 21.186 -16.065 -3.463 304 HG SER 35 HG SER 35 22.596 -17.920 -1.810 305 H GLY 36 H GLY 36 22.112 -14.600 -2.341 306 HA2 GLY 36 HA2 GLY 36 22.851 -12.590 -1.611 307 HA3 GLY 36 HA3 GLY 36 21.861 -12.701 -0.154 308 H SER 37 H SER 37 24.829 -13.815 -1.711 309 HA SER 37 HA SER 37 26.129 -14.209 0.932 310 HB2 SER 37 HB2 SER 37 26.475 -16.140 -1.386 311 HB3 SER 37 HB3 SER 37 27.079 -16.300 0.269 312 HG SER 37 HG SER 37 24.602 -16.156 0.719 313 H GLY 38 H GLY 38 26.151 -12.139 -1.390 314 HA2 GLY 38 HA2 GLY 38 29.022 -12.306 -2.193 315 HA3 GLY 38 HA3 GLY 38 27.759 -11.359 -2.990 316 H SER 39 H SER 39 27.227 -9.333 -2.185 317 HA SER 39 HA SER 39 27.506 -7.352 -1.259 318 HB2 SER 39 HB2 SER 39 26.395 -8.631 0.578 319 HB3 SER 39 HB3 SER 39 27.988 -8.847 1.335 320 HG SER 39 HG SER 39 28.172 -6.526 1.204 321 H GLY 40 H GLY 40 30.302 -9.165 -1.554 322 HA2 GLY 40 HA2 GLY 40 32.085 -7.121 -0.338 323 HA3 GLY 40 HA3 GLY 40 32.527 -8.744 -0.880 324 H SER 41 H SER 41 30.684 -6.143 -2.635 325 HA SER 41 HA SER 41 32.873 -5.575 -4.431 326 HB2 SER 41 HB2 SER 41 30.455 -7.197 -5.366 327 HB3 SER 41 HB3 SER 41 31.532 -6.320 -6.467 328 HG SER 41 HG SER 41 32.825 -7.949 -4.639 329 H GLY 42 H GLY 42 31.917 -4.061 -6.245 330 HA2 GLY 42 HA2 GLY 42 30.544 -1.910 -4.906 331 HA3 GLY 42 HA3 GLY 42 30.987 -1.995 -6.628 332 H SER 43 H SER 43 28.362 -1.533 -4.847 333 HA SER 43 HA SER 43 26.504 -3.515 -5.644 334 HB2 SER 43 HB2 SER 43 24.808 -1.628 -5.168 335 HB3 SER 43 HB3 SER 43 25.820 -2.222 -3.852 336 HG SER 43 HG SER 43 27.166 -0.436 -4.081 337 H GLY 44 H GLY 44 24.878 -3.481 -7.300 338 HA2 GLY 44 HA2 GLY 44 25.153 -1.608 -9.576 339 HA3 GLY 44 HA3 GLY 44 25.506 -3.319 -9.867 340 H SER 45 H SER 45 23.127 -1.976 -7.599 341 HA SER 45 HA SER 45 21.011 -3.714 -8.394 342 HB2 SER 45 HB2 SER 45 20.892 -1.156 -6.748 343 HB3 SER 45 HB3 SER 45 19.826 -2.568 -6.629 344 HG SER 45 HG SER 45 21.430 -2.449 -5.002 345 H GLY 46 H GLY 46 18.719 -2.630 -8.775 346 HA2 GLY 46 HA2 GLY 46 18.716 -0.255 -10.464 347 HA3 GLY 46 HA3 GLY 46 18.305 -1.785 -11.273 348 H SER 47 H SER 47 16.560 0.551 -10.641 349 HA SER 47 HA SER 47 14.720 -0.353 -8.554 350 HB2 SER 47 HB2 SER 47 14.655 2.022 -10.455 351 HB3 SER 47 HB3 SER 47 13.660 1.811 -9.006 352 HG SER 47 HG SER 47 15.817 3.057 -9.033 353 H GLY 48 H GLY 48 12.328 0.337 -9.377 354 HA2 GLY 48 HA2 GLY 48 11.561 -1.296 -11.735 355 HA3 GLY 48 HA3 GLY 48 10.689 -1.357 -10.177 356 H SER 49 H SER 49 8.843 -0.468 -11.734 357 HA SER 49 HA SER 49 8.656 2.335 -11.201 358 HB2 SER 49 HB2 SER 49 10.158 2.284 -13.269 359 HB3 SER 49 HB3 SER 49 8.803 1.596 -14.157 360 HG SER 49 HG SER 49 8.838 4.073 -12.737 361 H GLY 50 H GLY 50 6.617 2.935 -11.049 362 HA2 GLY 50 HA2 GLY 50 4.466 1.240 -12.218 363 HA3 GLY 50 HA3 GLY 50 4.357 2.200 -10.736 364 H SER 51 H SER 51 6.099 3.628 -13.328 365 HA SER 51 HA SER 51 5.924 5.500 -14.452 366 HB2 SER 51 HB2 SER 51 4.349 5.507 -16.227 367 HB3 SER 51 HB3 SER 51 4.957 3.876 -15.959 368 HG SER 51 HG SER 51 2.509 4.774 -16.083 369 H GLY 52 H GLY 52 4.872 5.771 -11.707 370 HA2 GLY 52 HA2 GLY 52 3.196 8.225 -12.048 371 HA3 GLY 52 HA3 GLY 52 3.041 7.096 -10.697 372 H SER 53 H SER 53 3.455 9.643 -10.005 373 HA SER 53 HA SER 53 6.063 9.544 -8.730 374 HB2 SER 53 HB2 SER 53 6.586 10.593 -10.913 375 HB3 SER 53 HB3 SER 53 5.410 11.873 -10.570 376 HG SER 53 HG SER 53 7.931 11.629 -9.802 377 H GLY 54 H GLY 54 5.111 9.593 -6.709 378 HA2 GLY 54 HA2 GLY 54 3.727 12.067 -5.930 379 HA3 GLY 54 HA3 GLY 54 2.750 10.589 -5.837 380 H SER 55 H SER 55 2.969 11.777 -3.544 381 HA SER 55 HA SER 55 4.738 10.101 -1.903 382 HB2 SER 55 HB2 SER 55 4.629 13.159 -1.856 383 HB3 SER 55 HB3 SER 55 5.255 12.182 -0.532 384 HG SER 55 HG SER 55 7.023 12.079 -1.481 385 H GLY 56 H GLY 56 4.056 10.612 0.514 386 HA2 GLY 56 HA2 GLY 56 1.228 11.300 0.872 387 HA3 GLY 56 HA3 GLY 56 1.762 9.657 1.312 388 H SER 57 H SER 57 0.835 11.617 3.231 389 HA SER 57 HA SER 57 3.261 11.898 4.918 390 HB2 SER 57 HB2 SER 57 1.216 14.085 4.330 391 HB3 SER 57 HB3 SER 57 2.515 14.186 5.534 392 HG SER 57 HG SER 57 4.025 14.171 3.995 393 H GLY 58 H GLY 58 2.378 12.670 7.226 394 HA2 GLY 58 HA2 GLY 58 0.381 12.534 8.708 395 HA3 GLY 58 HA3 GLY 58 -0.009 10.990 7.935 396 H TYR 59 H TYR 59 0.416 9.467 9.571 397 HA TYR 59 HA TYR 59 2.804 9.782 11.237 398 HB2 TYR 59 HB2 TYR 59 0.454 8.988 11.913 399 HB3 TYR 59 HB3 TYR 59 0.887 7.438 11.203 400 HD1 TYR 59 HD1 TYR 59 2.005 5.865 12.591 401 HD2 TYR 59 HD2 TYR 59 2.061 10.031 13.667 402 HE1 TYR 59 HE1 TYR 59 3.134 5.294 14.733 403 HE2 TYR 59 HE2 TYR 59 3.163 9.475 15.803 404 HH TYR 59 HH TYR 59 4.194 6.119 16.585 405 H GLN3288 H GLN3288 2.631 8.915 8.153 406 HA GLN3288 HA GLN3288 4.114 6.373 8.193 407 HB2 GLN3288 HB2 GLN3288 4.023 6.536 5.756 408 HB3 GLN3288 HB3 GLN3288 2.421 6.688 6.466 409 HG2 GLN3288 HG2 GLN3288 2.575 9.189 6.168 410 HG3 GLN3288 HG3 GLN3288 4.131 8.954 5.359 411 HE21 GLN3288 HE21 GLN3288 4.163 7.893 3.290 412 HE22 GLN3288 HE22 GLN3288 2.703 7.709 2.324 413 H ILE3289 H ILE3289 6.278 6.221 7.438 414 HA ILE3289 HA ILE3289 7.941 8.439 8.248 415 HB ILE3289 HB ILE3289 8.787 5.841 6.926 416 HG12 ILE3289 HG12 ILE3289 8.679 6.418 9.922 417 HG13 ILE3289 HG13 ILE3289 7.456 5.473 9.083 418 HG21 ILE3289 HG21 ILE3289 10.476 7.636 6.890 419 HG22 ILE3289 HG22 ILE3289 10.239 7.937 8.619 420 HG23 ILE3289 HG23 ILE3289 10.974 6.425 8.069 421 HD11 ILE3289 HD11 ILE3289 10.384 4.700 9.288 422 HD12 ILE3289 HD12 ILE3289 9.020 3.966 10.129 423 HD13 ILE3289 HD13 ILE3289 9.148 3.823 8.364 424 H GLU3290 H GLU3290 7.784 10.139 6.922 425 HA GLU3290 HA GLU3290 7.272 10.024 4.172 426 HB2 GLU3290 HB2 GLU3290 7.066 11.920 6.071 427 HB3 GLU3290 HB3 GLU3290 8.589 12.459 5.329 428 HG2 GLU3290 HG2 GLU3290 7.470 12.263 3.101 429 HG3 GLU3290 HG3 GLU3290 5.976 11.812 3.924 430 H THR3291 H THR3291 10.163 9.268 5.527 431 HA THR3291 HA THR3291 11.586 9.606 2.938 432 HB THR3291 HB THR3291 12.094 11.563 4.156 433 HG1 THR3291 HG1 THR3291 14.343 11.433 4.144 434 HG21 THR3291 HG21 THR3291 13.221 9.886 6.416 435 HG22 THR3291 HG22 THR3291 11.777 10.907 6.489 436 HG23 THR3291 HG23 THR3291 13.367 11.641 6.252 437 H PHE3292 H PHE3292 10.661 7.295 3.223 438 HA PHE3292 HA PHE3292 13.003 5.628 3.832 439 HB2 PHE3292 HB2 PHE3292 11.847 5.927 6.025 440 HB3 PHE3292 HB3 PHE3292 10.418 5.134 5.379 441 HD1 PHE3292 HD1 PHE3292 13.582 4.704 7.038 442 HD2 PHE3292 HD2 PHE3292 10.736 2.653 4.518 443 HE1 PHE3292 HE1 PHE3292 14.651 2.550 7.575 444 HE2 PHE3292 HE2 PHE3292 11.765 0.486 5.126 445 HZ PHE3292 HZ PHE3292 13.782 0.432 6.573 446 H PHE3293 H PHE3293 9.485 5.376 3.306 447 HA PHE3293 HA PHE3293 9.966 3.550 0.998 448 HB2 PHE3293 HB2 PHE3293 7.689 2.516 1.760 449 HB3 PHE3293 HB3 PHE3293 9.154 2.018 2.506 450 HD1 PHE3293 HD1 PHE3293 8.530 1.363 4.696 451 HD2 PHE3293 HD2 PHE3293 7.097 5.153 3.182 452 HE1 PHE3293 HE1 PHE3293 7.624 1.942 6.929 453 HE2 PHE3293 HE2 PHE3293 6.233 5.717 5.352 454 HZ PHE3293 HZ PHE3293 6.472 4.108 7.292 455 H ALA3294 H ALA3294 9.402 6.598 1.342 456 HA ALA3294 HA ALA3294 6.803 7.232 0.530 457 HB1 ALA3294 HB1 ALA3294 9.364 8.577 -0.390 458 HB2 ALA3294 HB2 ALA3294 7.741 9.286 -0.362 459 HB3 ALA3294 HB3 ALA3294 8.549 8.868 1.166 460 H GLN3295 H GLN3295 9.449 5.977 -1.381 461 HA GLN3295 HA GLN3295 8.327 6.364 -4.033 462 HB2 GLN3295 HB2 GLN3295 10.333 4.301 -3.029 463 HB3 GLN3295 HB3 GLN3295 10.121 4.811 -4.704 464 HG2 GLN3295 HG2 GLN3295 11.022 6.732 -2.484 465 HG3 GLN3295 HG3 GLN3295 12.099 5.710 -3.405 466 HE21 GLN3295 HE21 GLN3295 9.489 8.283 -3.997 467 HE22 GLN3295 HE22 GLN3295 10.307 8.861 -5.406 468 H ASP3296 H ASP3296 8.197 3.781 -1.627 469 HA ASP3296 HA ASP3296 6.835 1.874 -3.354 470 HB2 ASP3296 HB2 ASP3296 8.161 1.978 -0.690 471 HB3 ASP3296 HB3 ASP3296 6.653 1.096 -0.626 472 H ILE3297 H ILE3297 6.044 4.288 -1.027 473 HA ILE3297 HA ILE3297 3.402 3.512 -0.345 474 HB ILE3297 HB ILE3297 5.271 5.745 0.049 475 HG12 ILE3297 HG12 ILE3297 4.383 5.868 2.233 476 HG13 ILE3297 HG13 ILE3297 2.921 4.983 1.787 477 HG21 ILE3297 HG21 ILE3297 2.390 6.623 -0.157 478 HG22 ILE3297 HG22 ILE3297 3.755 7.566 0.519 479 HG23 ILE3297 HG23 ILE3297 3.749 7.130 -1.185 480 HD11 ILE3297 HD11 ILE3297 5.731 3.811 1.727 481 HD12 ILE3297 HD12 ILE3297 4.658 3.699 3.099 482 HD13 ILE3297 HD13 ILE3297 4.223 2.912 1.565 483 H GLU3298 H GLU3298 4.674 5.639 -2.943 484 HA GLU3298 HA GLU3298 2.038 6.339 -3.866 485 HB2 GLU3298 HB2 GLU3298 3.147 7.072 -5.938 486 HB3 GLU3298 HB3 GLU3298 3.838 7.774 -4.479 487 HG2 GLU3298 HG2 GLU3298 5.868 6.732 -4.743 488 HG3 GLU3298 HG3 GLU3298 5.169 5.295 -5.467 489 H SER3299 H SER3299 4.267 3.762 -4.574 490 HA SER3299 HA SER3299 2.873 2.803 -6.874 491 HB2 SER3299 HB2 SER3299 5.222 2.194 -6.434 492 HB3 SER3299 HB3 SER3299 4.755 1.307 -4.974 493 HG SER3299 HG SER3299 3.591 -0.143 -6.301 494 H VAL3300 H VAL3300 2.607 1.791 -3.453 495 HA VAL3300 HA VAL3300 0.644 -0.231 -4.169 496 HB VAL3300 HB VAL3300 2.146 -0.404 -2.213 497 HG11 VAL3300 HG11 VAL3300 0.332 1.625 -0.862 498 HG12 VAL3300 HG12 VAL3300 1.667 0.733 -0.125 499 HG13 VAL3300 HG13 VAL3300 2.019 1.920 -1.388 500 HG21 VAL3300 HG21 VAL3300 0.151 -1.787 -2.436 501 HG22 VAL3300 HG22 VAL3300 0.431 -1.399 -0.736 502 HG23 VAL3300 HG23 VAL3300 -0.839 -0.544 -1.652 503 H GLN3301 H GLN3301 0.466 3.167 -2.887 504 HA GLN3301 HA GLN3301 -2.386 2.999 -2.652 505 HB2 GLN3301 HB2 GLN3301 -2.460 5.237 -2.194 506 HB3 GLN3301 HB3 GLN3301 -1.052 4.575 -1.401 507 HG2 GLN3301 HG2 GLN3301 0.185 6.212 -2.291 508 HG3 GLN3301 HG3 GLN3301 -0.131 5.546 -3.903 509 HE21 GLN3301 HE21 GLN3301 -2.351 6.219 -4.822 510 HE22 GLN3301 HE22 GLN3301 -2.694 7.913 -4.676 511 H LYS3302 H LYS3302 -0.316 3.665 -5.424 512 HA LYS3302 HA LYS3302 -2.274 4.749 -7.155 513 HB2 LYS3302 HB2 LYS3302 0.375 3.368 -7.457 514 HB3 LYS3302 HB3 LYS3302 -0.649 3.550 -8.874 515 HG2 LYS3302 HG2 LYS3302 -0.831 5.929 -8.535 516 HG3 LYS3302 HG3 LYS3302 0.104 5.890 -7.077 517 HD2 LYS3302 HD2 LYS3302 1.483 6.658 -8.910 518 HD3 LYS3302 HD3 LYS3302 2.048 5.082 -8.351 519 HE2 LYS3302 HE2 LYS3302 2.058 5.294 -10.848 520 HE3 LYS3302 HE3 LYS3302 1.073 3.958 -10.283 521 HZ1 LYS3302 HZ1 LYS3302 -0.112 6.588 -10.964 522 HZ2 LYS3302 HZ2 LYS3302 -0.890 5.164 -10.751 523 HZ3 LYS3302 HZ3 LYS3302 0.097 5.353 -12.044 524 H GLU3303 H GLU3303 -1.797 1.523 -5.974 525 HA GLU3303 HA GLU3303 -3.398 0.280 -8.126 526 HB2 GLU3303 HB2 GLU3303 -2.570 -1.648 -7.428 527 HB3 GLU3303 HB3 GLU3303 -1.481 -0.717 -6.408 528 HG2 GLU3303 HG2 GLU3303 -3.131 -0.947 -4.529 529 HG3 GLU3303 HG3 GLU3303 -4.150 -1.933 -5.575 530 H LEU3304 H LEU3304 -3.846 1.195 -4.641 531 HA LEU3304 HA LEU3304 -6.439 0.293 -4.445 532 HB2 LEU3304 HB2 LEU3304 -4.895 2.505 -3.015 533 HB3 LEU3304 HB3 LEU3304 -6.353 1.757 -2.451 534 HG LEU3304 HG LEU3304 -3.670 0.395 -2.887 535 HD11 LEU3304 HD11 LEU3304 -5.050 1.199 -0.354 536 HD12 LEU3304 HD12 LEU3304 -3.525 1.793 -1.075 537 HD13 LEU3304 HD13 LEU3304 -3.605 0.149 -0.443 538 HD21 LEU3304 HD21 LEU3304 -4.442 -1.626 -1.901 539 HD22 LEU3304 HD22 LEU3304 -5.463 -1.252 -3.269 540 HD23 LEU3304 HD23 LEU3304 -6.054 -0.940 -1.615 541 H GLU3305 H GLU3305 -5.307 3.440 -5.593 542 HA GLU3305 HA GLU3305 -7.782 4.833 -5.305 543 HB2 GLU3305 HB2 GLU3305 -6.868 6.333 -7.125 544 HB3 GLU3305 HB3 GLU3305 -5.770 6.093 -5.763 545 HG2 GLU3305 HG2 GLU3305 -4.471 4.546 -6.906 546 HG3 GLU3305 HG3 GLU3305 -5.607 4.356 -8.247 547 H ASN3306 H ASN3306 -7.056 2.216 -7.416 548 HA ASN3306 HA ASN3306 -9.350 2.960 -9.153 549 HB2 ASN3306 HB2 ASN3306 -8.459 1.895 -10.982 550 HB3 ASN3306 HB3 ASN3306 -7.164 2.862 -10.299 551 HD21 ASN3306 HD21 ASN3306 -5.267 1.841 -9.519 552 HD22 ASN3306 HD22 ASN3306 -4.950 0.166 -9.916 553 H LEU3307 H LEU3307 -8.807 1.141 -6.453 554 HA LEU3307 HA LEU3307 -10.335 -1.181 -7.488 555 HB2 LEU3307 HB2 LEU3307 -8.655 -0.533 -5.095 556 HB3 LEU3307 HB3 LEU3307 -10.063 -1.503 -4.797 557 HG LEU3307 HG LEU3307 -8.710 -3.220 -5.128 558 HD11 LEU3307 HD11 LEU3307 -8.481 -4.166 -7.316 559 HD12 LEU3307 HD12 LEU3307 -8.626 -2.570 -8.078 560 HD13 LEU3307 HD13 LEU3307 -10.028 -3.317 -7.284 561 HD21 LEU3307 HD21 LEU3307 -6.797 -1.697 -6.829 562 HD22 LEU3307 HD22 LEU3307 -6.578 -3.303 -6.107 563 HD23 LEU3307 HD23 LEU3307 -6.712 -1.891 -5.051 564 H SER3308 H SER3308 -12.241 -1.833 -6.460 565 HA SER3308 HA SER3308 -14.129 0.329 -5.924 566 HB2 SER3308 HB2 SER3308 -14.548 -2.687 -6.096 567 HB3 SER3308 HB3 SER3308 -15.760 -1.419 -6.334 568 HG SER3308 HG SER3308 -14.624 -0.749 -8.191 569 H GLU3309 H GLU3309 -15.874 -0.245 -4.070 570 HA GLU3309 HA GLU3309 -14.459 -0.390 -1.562 571 HB2 GLU3309 HB2 GLU3309 -17.384 -0.493 -2.449 572 HB3 GLU3309 HB3 GLU3309 -16.993 -0.988 -0.810 573 HG2 GLU3309 HG2 GLU3309 -16.339 1.093 -0.131 574 HG3 GLU3309 HG3 GLU3309 -16.027 1.683 -1.752 575 H GLU3310 H GLU3310 -16.377 -2.837 -3.239 576 HA GLU3310 HA GLU3310 -16.113 -4.916 -1.575 577 HB2 GLU3310 HB2 GLU3310 -15.591 -5.158 -4.555 578 HB3 GLU3310 HB3 GLU3310 -16.173 -6.450 -3.507 579 HG2 GLU3310 HG2 GLU3310 -17.747 -3.893 -3.954 580 HG3 GLU3310 HG3 GLU3310 -17.829 -5.270 -5.049 581 H GLU3311 H GLU3311 -13.439 -3.518 -3.417 582 HA GLU3311 HA GLU3311 -11.674 -5.838 -2.996 583 HB2 GLU3311 HB2 GLU3311 -11.253 -3.108 -4.201 584 HB3 GLU3311 HB3 GLU3311 -10.089 -4.411 -4.210 585 HG2 GLU3311 HG2 GLU3311 -12.771 -4.975 -5.418 586 HG3 GLU3311 HG3 GLU3311 -11.853 -3.768 -6.229 587 H LEU3312 H LEU3312 -11.857 -2.401 -2.162 588 HA LEU3312 HA LEU3312 -9.627 -2.471 -0.301 589 HB2 LEU3312 HB2 LEU3312 -11.578 -0.182 -0.515 590 HB3 LEU3312 HB3 LEU3312 -9.949 -0.111 0.019 591 HG LEU3312 HG LEU3312 -10.447 -1.072 -2.781 592 HD11 LEU3312 HD11 LEU3312 -10.840 1.736 -1.951 593 HD12 LEU3312 HD12 LEU3312 -11.663 0.629 -3.138 594 HD13 LEU3312 HD13 LEU3312 -10.125 1.338 -3.536 595 HD21 LEU3312 HD21 LEU3312 -8.156 0.321 -1.386 596 HD22 LEU3312 HD22 LEU3312 -8.259 0.140 -3.144 597 HD23 LEU3312 HD23 LEU3312 -8.217 -1.301 -2.116 598 H LEU3313 H LEU3313 -13.075 -1.832 0.080 599 HA LEU3313 HA LEU3313 -13.186 -1.533 2.915 600 HB2 LEU3313 HB2 LEU3313 -15.008 -0.820 1.389 601 HB3 LEU3313 HB3 LEU3313 -15.316 -2.477 0.897 602 HG LEU3313 HG LEU3313 -16.945 -1.532 2.429 603 HD11 LEU3313 HD11 LEU3313 -17.379 -3.556 3.722 604 HD12 LEU3313 HD12 LEU3313 -15.802 -4.204 3.224 605 HD13 LEU3313 HD13 LEU3313 -17.046 -3.809 2.027 606 HD21 LEU3313 HD21 LEU3313 -16.732 -1.544 4.761 607 HD22 LEU3313 HD22 LEU3313 -15.479 -0.481 4.133 608 HD23 LEU3313 HD23 LEU3313 -15.044 -2.121 4.694 609 H ALA3314 H ALA3314 -13.191 -4.457 0.765 610 HA ALA3314 HA ALA3314 -13.817 -6.117 2.947 611 HB1 ALA3314 HB1 ALA3314 -13.150 -7.933 1.457 612 HB2 ALA3314 HB2 ALA3314 -14.046 -6.727 0.544 613 HB3 ALA3314 HB3 ALA3314 -12.296 -6.783 0.375 614 H MET3315 H MET3315 -10.744 -4.703 1.905 615 HA MET3315 HA MET3315 -8.938 -6.485 3.260 616 HB2 MET3315 HB2 MET3315 -8.508 -3.546 2.555 617 HB3 MET3315 HB3 MET3315 -7.262 -4.704 2.921 618 HG2 MET3315 HG2 MET3315 -9.048 -5.567 0.780 619 HG3 MET3315 HG3 MET3315 -8.321 -4.020 0.430 620 HE1 MET3315 HE1 MET3315 -7.655 -6.397 -1.432 621 HE2 MET3315 HE2 MET3315 -6.182 -7.325 -1.103 622 HE3 MET3315 HE3 MET3315 -7.637 -7.656 -0.170 623 H LEU3316 H LEU3316 -10.052 -3.214 4.008 624 HA LEU3316 HA LEU3316 -8.769 -3.033 6.591 625 HB2 LEU3316 HB2 LEU3316 -10.222 -1.029 6.883 626 HB3 LEU3316 HB3 LEU3316 -9.242 -1.033 5.424 627 HG LEU3316 HG LEU3316 -11.506 -2.087 4.378 628 HD11 LEU3316 HD11 LEU3316 -12.424 -0.495 6.843 629 HD12 LEU3316 HD12 LEU3316 -13.019 -2.060 6.293 630 HD13 LEU3316 HD13 LEU3316 -13.429 -0.614 5.391 631 HD21 LEU3316 HD21 LEU3316 -10.245 0.106 3.880 632 HD22 LEU3316 HD22 LEU3316 -11.434 0.883 4.968 633 HD23 LEU3316 HD23 LEU3316 -11.930 0.031 3.494 634 H ASN3317 H ASN3317 -11.931 -4.232 5.436 635 HA ASN3317 HA ASN3317 -13.043 -4.323 8.127 636 HB2 ASN3317 HB2 ASN3317 -14.334 -4.084 5.852 637 HB3 ASN3317 HB3 ASN3317 -14.119 -5.838 5.714 638 HD21 ASN3317 HD21 ASN3317 -15.305 -3.175 7.693 639 HD22 ASN3317 HD22 ASN3317 -16.608 -4.080 8.481 640 H GLY3318 H GLY3318 -11.230 -6.349 5.976 641 HA2 GLY3318 HA2 GLY3318 -10.133 -8.337 6.239 642 HA3 GLY3318 HA3 GLY3318 -10.424 -8.238 7.987 643 H ASP3319 H ASP3319 -12.824 -8.296 5.330 644 HA ASP3319 HA ASP3319 -13.884 -10.919 6.305 645 HB2 ASP3319 HB2 ASP3319 -15.143 -8.245 6.169 646 HB3 ASP3319 HB3 ASP3319 -16.052 -9.478 5.350 647 H GLN3320 H GLN3320 -15.629 -11.672 4.637 648 HA GLN3320 HA GLN3320 -14.307 -11.871 2.025 649 HB2 GLN3320 HB2 GLN3320 -15.633 -13.919 1.793 650 HB3 GLN3320 HB3 GLN3320 -15.012 -13.904 3.448 651 HG2 GLN3320 HG2 GLN3320 -17.264 -12.742 4.062 652 HG3 GLN3320 HG3 GLN3320 -17.818 -13.256 2.480 653 HE21 GLN3320 HE21 GLN3320 -17.980 -14.016 5.608 654 HE22 GLN3320 HE22 GLN3320 -18.289 -15.745 5.499 655 H GLN3321 H GLN3321 -15.917 -9.623 2.944 656 HA GLN3321 HA GLN3321 -18.255 -9.616 1.204 657 HB2 GLN3321 HB2 GLN3321 -17.017 -7.591 3.118 658 HB3 GLN3321 HB3 GLN3321 -18.157 -7.025 1.918 659 HG2 GLN3321 HG2 GLN3321 -19.534 -7.404 3.704 660 HG3 GLN3321 HG3 GLN3321 -19.771 -8.844 2.712 661 HE21 GLN3321 HE21 GLN3321 -18.623 -7.600 5.771 662 HE22 GLN3321 HE22 GLN3321 -18.127 -9.155 6.441 Start of MODEL 3 1 H1 MET 1 H MET 1 -28.392 10.449 -2.709 2 HA MET 1 HA MET 1 -28.112 12.801 -4.467 3 HB2 MET 1 HB2 MET 1 -28.288 12.835 -1.413 4 HB3 MET 1 HB3 MET 1 -28.308 14.195 -2.497 5 HG2 MET 1 HG2 MET 1 -30.441 12.082 -2.138 6 HG3 MET 1 HG3 MET 1 -30.535 13.798 -1.745 7 HE1 MET 1 HE1 MET 1 -33.218 13.419 -4.573 8 HE2 MET 1 HE2 MET 1 -32.817 12.240 -3.306 9 HE3 MET 1 HE3 MET 1 -32.886 13.975 -2.919 10 H ASN 2 H ASN 2 -26.688 11.488 -1.455 11 HA ASN 2 HA ASN 2 -24.302 12.896 -1.661 12 HB2 ASN 2 HB2 ASN 2 -25.256 10.502 -0.060 13 HB3 ASN 2 HB3 ASN 2 -23.595 11.076 0.083 14 HD21 ASN 2 HD21 ASN 2 -23.173 12.981 1.271 15 HD22 ASN 2 HD22 ASN 2 -24.478 14.059 1.796 16 H ILE 3 H ILE 3 -22.428 12.598 -2.592 17 HA ILE 3 HA ILE 3 -22.061 10.555 -4.615 18 HB ILE 3 HB ILE 3 -21.097 12.999 -4.413 19 HG12 ILE 3 HG12 ILE 3 -19.184 10.811 -5.299 20 HG13 ILE 3 HG13 ILE 3 -20.644 11.279 -6.182 21 HG21 ILE 3 HG21 ILE 3 -19.965 12.632 -2.166 22 HG22 ILE 3 HG22 ILE 3 -18.793 11.586 -2.990 23 HG23 ILE 3 HG23 ILE 3 -18.922 13.304 -3.407 24 HD11 ILE 3 HD11 ILE 3 -18.339 13.169 -5.544 25 HD12 ILE 3 HD12 ILE 3 -18.702 12.445 -7.117 26 HD13 ILE 3 HD13 ILE 3 -19.834 13.594 -6.362 27 H ASN 4 H ASN 4 -20.997 8.825 -4.595 28 HA ASN 4 HA ASN 4 -20.008 7.674 -2.044 29 HB2 ASN 4 HB2 ASN 4 -20.846 5.518 -2.852 30 HB3 ASN 4 HB3 ASN 4 -22.154 6.684 -2.703 31 HD21 ASN 4 HD21 ASN 4 -20.297 4.691 -4.996 32 HD22 ASN 4 HD22 ASN 4 -21.100 5.357 -6.406 33 H GLU 5 H GLU 5 -19.656 7.673 -5.628 34 HA GLU 5 HA GLU 5 -17.428 6.050 -5.867 35 HB2 GLU 5 HB2 GLU 5 -17.994 8.548 -7.481 36 HB3 GLU 5 HB3 GLU 5 -17.034 7.151 -7.972 37 HG2 GLU 5 HG2 GLU 5 -19.077 5.726 -7.853 38 HG3 GLU 5 HG3 GLU 5 -20.030 7.164 -7.459 39 H GLN 6 H GLN 6 -17.588 9.473 -5.128 40 HA GLN 6 HA GLN 6 -14.711 9.884 -5.037 41 HB2 GLN 6 HB2 GLN 6 -16.884 11.502 -5.344 42 HB3 GLN 6 HB3 GLN 6 -16.516 11.809 -3.647 43 HG2 GLN 6 HG2 GLN 6 -14.157 12.400 -4.381 44 HG3 GLN 6 HG3 GLN 6 -14.650 12.114 -6.050 45 HE21 GLN 6 HE21 GLN 6 -15.600 13.994 -3.135 46 HE22 GLN 6 HE22 GLN 6 -16.235 15.384 -4.014 47 H THR 7 H THR 7 -17.156 8.805 -2.754 48 HA THR 7 HA THR 7 -15.633 9.418 -0.360 49 HB THR 7 HB THR 7 -18.073 7.709 -0.816 50 HG1 THR 7 HG1 THR 7 -19.189 9.517 -0.540 51 HG21 THR 7 HG21 THR 7 -16.715 8.746 1.688 52 HG22 THR 7 HG22 THR 7 -17.031 7.061 1.216 53 HG23 THR 7 HG23 THR 7 -18.389 8.106 1.661 54 H LEU 8 H LEU 8 -16.122 6.561 -2.533 55 HA LEU 8 HA LEU 8 -15.140 4.487 -0.977 56 HB2 LEU 8 HB2 LEU 8 -14.057 4.723 -3.769 57 HB3 LEU 8 HB3 LEU 8 -14.617 3.332 -2.838 58 HG LEU 8 HG LEU 8 -16.357 5.442 -4.121 59 HD11 LEU 8 HD11 LEU 8 -16.934 3.800 -5.826 60 HD12 LEU 8 HD12 LEU 8 -15.918 2.588 -5.046 61 HD13 LEU 8 HD13 LEU 8 -15.181 4.024 -5.793 62 HD21 LEU 8 HD21 LEU 8 -17.563 4.500 -2.275 63 HD22 LEU 8 HD22 LEU 8 -17.139 2.849 -2.804 64 HD23 LEU 8 HD23 LEU 8 -18.235 3.859 -3.764 65 H ASP 9 H ASP 9 -13.432 7.216 -2.431 66 HA ASP 9 HA ASP 9 -10.763 6.498 -2.422 67 HB2 ASP 9 HB2 ASP 9 -11.706 8.618 -3.229 68 HB3 ASP 9 HB3 ASP 9 -11.989 9.129 -1.564 69 H LYS 10 H LYS 10 -12.649 7.846 0.409 70 HA LYS 10 HA LYS 10 -10.386 7.683 2.159 71 HB2 LYS 10 HB2 LYS 10 -11.735 8.319 3.954 72 HB3 LYS 10 HB3 LYS 10 -12.371 9.175 2.546 73 HG2 LYS 10 HG2 LYS 10 -14.125 7.446 2.370 74 HG3 LYS 10 HG3 LYS 10 -13.582 6.687 3.857 75 HD2 LYS 10 HD2 LYS 10 -14.369 9.596 3.703 76 HD3 LYS 10 HD3 LYS 10 -15.613 8.348 3.740 77 HE2 LYS 10 HE2 LYS 10 -15.042 7.629 5.916 78 HE3 LYS 10 HE3 LYS 10 -13.491 8.508 5.891 79 HZ1 LYS 10 HZ1 LYS 10 -15.436 9.629 7.119 80 HZ2 LYS 10 HZ2 LYS 10 -16.018 9.975 5.617 81 HZ3 LYS 10 HZ3 LYS 10 -14.551 10.524 6.069 82 H LEU 11 H LEU 11 -12.728 5.346 1.087 83 HA LEU 11 HA LEU 11 -12.324 3.459 3.280 84 HB2 LEU 11 HB2 LEU 11 -13.798 3.209 0.587 85 HB3 LEU 11 HB3 LEU 11 -13.554 1.915 1.765 86 HG LEU 11 HG LEU 11 -15.712 2.595 1.986 87 HD11 LEU 11 HD11 LEU 11 -14.693 2.146 4.123 88 HD12 LEU 11 HD12 LEU 11 -15.938 3.379 4.277 89 HD13 LEU 11 HD13 LEU 11 -14.237 3.867 4.314 90 HD21 LEU 11 HD21 LEU 11 -16.499 4.871 2.523 91 HD22 LEU 11 HD22 LEU 11 -15.715 4.805 0.956 92 HD23 LEU 11 HD23 LEU 11 -14.837 5.460 2.325 93 H ARG 12 H ARG 12 -11.420 3.580 -0.225 94 HA ARG 12 HA ARG 12 -9.807 1.251 -0.064 95 HB2 ARG 12 HB2 ARG 12 -8.621 2.210 -2.139 96 HB3 ARG 12 HB3 ARG 12 -10.311 1.753 -2.218 97 HG2 ARG 12 HG2 ARG 12 -10.836 3.680 -3.076 98 HG3 ARG 12 HG3 ARG 12 -10.366 4.483 -1.594 99 HD2 ARG 12 HD2 ARG 12 -8.185 3.861 -3.512 100 HD3 ARG 12 HD3 ARG 12 -9.387 5.114 -3.915 101 HE ARG 12 HE ARG 12 -8.776 5.898 -1.473 102 HH11 ARG 12 HH11 ARG 12 -6.665 5.178 -4.259 103 HH12 ARG 12 HH12 ARG 12 -6.049 6.760 -4.325 104 HH21 ARG 12 HH21 ARG 12 -7.847 7.966 -1.548 105 HH22 ARG 12 HH22 ARG 12 -6.448 8.264 -2.489 106 H GLN 13 H GLN 13 -8.905 4.622 0.474 107 HA GLN 13 HA GLN 13 -6.155 3.985 0.828 108 HB2 GLN 13 HB2 GLN 13 -5.840 6.182 1.589 109 HB3 GLN 13 HB3 GLN 13 -7.018 6.202 0.287 110 HG2 GLN 13 HG2 GLN 13 -8.104 7.601 1.741 111 HG3 GLN 13 HG3 GLN 13 -8.788 6.062 2.178 112 HE21 GLN 13 HE21 GLN 13 -9.207 6.224 4.387 113 HE22 GLN 13 HE22 GLN 13 -7.930 6.598 5.555 114 H ALA 14 H ALA 14 -8.937 3.736 3.061 115 HA ALA 14 HA ALA 14 -7.340 3.399 5.431 116 HB1 ALA 14 HB1 ALA 14 -9.625 4.056 5.674 117 HB2 ALA 14 HB2 ALA 14 -10.211 2.764 4.625 118 HB3 ALA 14 HB3 ALA 14 -9.567 2.357 6.214 119 H VAL 15 H VAL 15 -8.627 1.242 2.881 120 HA VAL 15 HA VAL 15 -7.865 -1.199 4.208 121 HB VAL 15 HB VAL 15 -8.517 -0.600 1.308 122 HG11 VAL 15 HG11 VAL 15 -7.274 -2.769 1.535 123 HG12 VAL 15 HG12 VAL 15 -8.459 -3.297 2.737 124 HG13 VAL 15 HG13 VAL 15 -8.951 -3.016 1.057 125 HG21 VAL 15 HG21 VAL 15 -10.241 -1.450 3.648 126 HG22 VAL 15 HG22 VAL 15 -10.503 -0.132 2.486 127 HG23 VAL 15 HG23 VAL 15 -10.676 -1.769 1.964 128 H LEU 16 H LEU 16 -6.373 0.640 1.404 129 HA LEU 16 HA LEU 16 -4.176 -1.058 1.157 130 HB2 LEU 16 HB2 LEU 16 -3.063 0.515 -0.144 131 HB3 LEU 16 HB3 LEU 16 -4.771 0.693 -0.457 132 HG LEU 16 HG LEU 16 -4.550 2.595 1.413 133 HD11 LEU 16 HD11 LEU 16 -1.785 2.617 0.139 134 HD12 LEU 16 HD12 LEU 16 -2.117 2.289 1.843 135 HD13 LEU 16 HD13 LEU 16 -2.467 3.878 1.183 136 HD21 LEU 16 HD21 LEU 16 -3.656 3.008 -1.468 137 HD22 LEU 16 HD22 LEU 16 -4.332 4.230 -0.395 138 HD23 LEU 16 HD23 LEU 16 -5.355 2.892 -0.952 139 H GLN 17 H GLN 17 -4.618 1.458 3.639 140 HA GLN 17 HA GLN 17 -1.957 1.627 4.507 141 HB2 GLN 17 HB2 GLN 17 -4.613 1.827 5.929 142 HB3 GLN 17 HB3 GLN 17 -3.088 1.968 6.815 143 HG2 GLN 17 HG2 GLN 17 -2.408 3.894 5.536 144 HG3 GLN 17 HG3 GLN 17 -3.739 3.700 4.420 145 HE21 GLN 17 HE21 GLN 17 -5.132 5.536 4.869 146 HE22 GLN 17 HE22 GLN 17 -5.671 5.915 6.471 147 H LYS 18 H LYS 18 -4.378 -1.098 5.235 148 HA LYS 18 HA LYS 18 -2.436 -2.254 7.062 149 HB2 LYS 18 HB2 LYS 18 -3.886 -4.073 7.279 150 HB3 LYS 18 HB3 LYS 18 -4.858 -2.614 7.296 151 HG2 LYS 18 HG2 LYS 18 -4.814 -3.520 4.573 152 HG3 LYS 18 HG3 LYS 18 -4.969 -4.953 5.540 153 HD2 LYS 18 HD2 LYS 18 -6.785 -2.562 6.092 154 HD3 LYS 18 HD3 LYS 18 -7.101 -3.593 4.719 155 HE2 LYS 18 HE2 LYS 18 -8.373 -4.553 6.362 156 HE3 LYS 18 HE3 LYS 18 -6.933 -5.592 6.170 157 HZ1 LYS 18 HZ1 LYS 18 -6.142 -4.967 8.195 158 HZ2 LYS 18 HZ2 LYS 18 -7.749 -5.039 8.491 159 HZ3 LYS 18 HZ3 LYS 18 -7.066 -3.568 8.282 160 H LYS 19 H LYS 19 -3.227 -2.607 3.578 161 HA LYS 19 HA LYS 19 -1.750 -4.891 2.996 162 HB2 LYS 19 HB2 LYS 19 -2.146 -2.439 1.234 163 HB3 LYS 19 HB3 LYS 19 -1.422 -3.940 0.718 164 HG2 LYS 19 HG2 LYS 19 -3.524 -5.168 1.360 165 HG3 LYS 19 HG3 LYS 19 -4.266 -3.607 1.770 166 HD2 LYS 19 HD2 LYS 19 -3.929 -2.848 -0.586 167 HD3 LYS 19 HD3 LYS 19 -3.231 -4.436 -0.978 168 HE2 LYS 19 HE2 LYS 19 -5.913 -4.369 0.297 169 HE3 LYS 19 HE3 LYS 19 -5.804 -3.790 -1.377 170 HZ1 LYS 19 HZ1 LYS 19 -4.789 -6.452 -0.623 171 HZ2 LYS 19 HZ2 LYS 19 -5.096 -5.835 -2.131 172 HZ3 LYS 19 HZ3 LYS 19 -6.308 -6.212 -1.086 173 H ILE 20 H ILE 20 -0.544 -1.525 3.439 174 HA ILE 20 HA ILE 20 2.071 -1.983 2.576 175 HB ILE 20 HB ILE 20 1.430 -0.150 4.898 176 HG12 ILE 20 HG12 ILE 20 -0.259 0.454 3.388 177 HG13 ILE 20 HG13 ILE 20 1.002 1.645 3.209 178 HG21 ILE 20 HG21 ILE 20 3.797 -0.303 4.394 179 HG22 ILE 20 HG22 ILE 20 3.505 -0.053 2.667 180 HG23 ILE 20 HG23 ILE 20 3.209 1.260 3.825 181 HD11 ILE 20 HD11 ILE 20 1.776 0.371 1.141 182 HD12 ILE 20 HD12 ILE 20 0.318 -0.613 1.269 183 HD13 ILE 20 HD13 ILE 20 0.175 1.128 1.008 184 H LYS 21 H LYS 21 0.597 -2.743 5.742 185 HA LYS 21 HA LYS 21 3.062 -3.520 7.075 186 HB2 LYS 21 HB2 LYS 21 0.252 -4.442 7.707 187 HB3 LYS 21 HB3 LYS 21 1.646 -4.410 8.782 188 HG2 LYS 21 HG2 LYS 21 1.612 -1.896 8.686 189 HG3 LYS 21 HG3 LYS 21 0.185 -1.984 7.636 190 HD2 LYS 21 HD2 LYS 21 -0.864 -3.461 9.488 191 HD3 LYS 21 HD3 LYS 21 0.406 -2.831 10.545 192 HE2 LYS 21 HE2 LYS 21 -1.536 -1.179 8.873 193 HE3 LYS 21 HE3 LYS 21 -1.777 -1.567 10.583 194 HZ1 LYS 21 HZ1 LYS 21 0.318 0.158 9.435 195 HZ2 LYS 21 HZ2 LYS 21 0.413 -0.424 10.985 196 HZ3 LYS 21 HZ3 LYS 21 -0.823 0.543 10.542 197 H GLU 22 H GLU 22 0.680 -4.991 5.001 198 HA GLU 22 HA GLU 22 1.386 -7.747 5.712 199 HB2 GLU 22 HB2 GLU 22 -0.366 -6.707 3.429 200 HB3 GLU 22 HB3 GLU 22 -0.135 -8.408 3.874 201 HG2 GLU 22 HG2 GLU 22 -1.006 -7.971 6.135 202 HG3 GLU 22 HG3 GLU 22 -1.223 -6.275 5.752 203 H ARG 23 H ARG 23 1.986 -5.613 2.854 204 HA ARG 23 HA ARG 23 3.687 -7.490 1.554 205 HB2 ARG 23 HB2 ARG 23 4.628 -5.614 0.236 206 HB3 ARG 23 HB3 ARG 23 2.872 -5.609 0.316 207 HG2 ARG 23 HG2 ARG 23 3.237 -3.404 0.613 208 HG3 ARG 23 HG3 ARG 23 3.260 -3.910 2.274 209 HD2 ARG 23 HD2 ARG 23 5.054 -2.385 1.911 210 HD3 ARG 23 HD3 ARG 23 5.792 -3.955 2.148 211 HE ARG 23 HE ARG 23 5.172 -3.161 -0.621 212 HH11 ARG 23 HH11 ARG 23 7.944 -3.524 1.734 213 HH12 ARG 23 HH12 ARG 23 9.033 -3.794 0.425 214 HH21 ARG 23 HH21 ARG 23 6.915 -3.272 -2.243 215 HH22 ARG 23 HH22 ARG 23 8.496 -3.639 -1.681 216 H ILE 24 H ILE 24 4.569 -5.000 4.017 217 HA ILE 24 HA ILE 24 7.366 -5.563 3.809 218 HB ILE 24 HB ILE 24 6.558 -3.476 4.734 219 HG12 ILE 24 HG12 ILE 24 8.019 -5.115 6.860 220 HG13 ILE 24 HG13 ILE 24 8.764 -4.224 5.541 221 HG21 ILE 24 HG21 ILE 24 5.304 -3.203 6.705 222 HG22 ILE 24 HG22 ILE 24 4.553 -4.562 5.899 223 HG23 ILE 24 HG23 ILE 24 5.612 -4.864 7.270 224 HD11 ILE 24 HD11 ILE 24 7.246 -3.100 7.892 225 HD12 ILE 24 HD12 ILE 24 8.975 -2.959 7.526 226 HD13 ILE 24 HD13 ILE 24 7.777 -2.115 6.501 227 H GLN 25 H GLN 25 4.812 -6.869 6.052 228 HA GLN 25 HA GLN 25 6.811 -8.326 7.475 229 HB2 GLN 25 HB2 GLN 25 4.536 -7.553 8.330 230 HB3 GLN 25 HB3 GLN 25 3.803 -8.882 7.422 231 HG2 GLN 25 HG2 GLN 25 5.772 -10.247 8.745 232 HG3 GLN 25 HG3 GLN 25 5.638 -8.903 9.845 233 HE21 GLN 25 HE21 GLN 25 2.664 -8.549 9.919 234 HE22 GLN 25 HE22 GLN 25 2.064 -10.107 10.467 235 H ASN 26 H ASN 26 4.270 -9.337 5.098 236 HA ASN 26 HA ASN 26 5.112 -12.099 5.063 237 HB2 ASN 26 HB2 ASN 26 3.296 -10.603 3.115 238 HB3 ASN 26 HB3 ASN 26 3.508 -12.333 3.166 239 HD21 ASN 26 HD21 ASN 26 2.285 -9.580 5.059 240 HD22 ASN 26 HD22 ASN 26 1.239 -10.565 6.079 241 H SER 27 H SER 27 5.470 -9.408 2.750 242 HA SER 27 HA SER 27 6.788 -9.120 0.920 243 HB2 SER 27 HB2 SER 27 8.329 -9.105 2.965 244 HB3 SER 27 HB3 SER 27 8.862 -10.713 2.460 245 HG SER 27 HG SER 27 8.993 -8.256 0.991 246 H LEU 28 H LEU 28 5.224 -11.705 1.070 247 HA LEU 28 HA LEU 28 6.586 -13.161 -1.119 248 HB2 LEU 28 HB2 LEU 28 5.621 -15.251 -0.192 249 HB3 LEU 28 HB3 LEU 28 6.738 -14.459 0.897 250 HG LEU 28 HG LEU 28 4.821 -13.571 2.171 251 HD11 LEU 28 HD11 LEU 28 3.205 -15.283 0.258 252 HD12 LEU 28 HD12 LEU 28 2.917 -13.599 0.740 253 HD13 LEU 28 HD13 LEU 28 2.615 -14.878 1.885 254 HD21 LEU 28 HD21 LEU 28 4.778 -16.579 2.000 255 HD22 LEU 28 HD22 LEU 28 4.383 -15.571 3.397 256 HD23 LEU 28 HD23 LEU 28 6.052 -15.639 2.800 257 H SER 29 H SER 29 5.023 -14.591 -2.113 258 HA SER 29 HA SER 29 2.566 -13.095 -2.966 259 HB2 SER 29 HB2 SER 29 4.321 -15.074 -4.482 260 HB3 SER 29 HB3 SER 29 2.772 -14.454 -5.042 261 HG SER 29 HG SER 29 5.268 -13.149 -4.684 262 H THR 30 H THR 30 3.874 -16.410 -2.392 263 HA THR 30 HA THR 30 1.364 -17.319 -1.359 264 HB THR 30 HB THR 30 0.807 -17.368 -3.725 265 HG1 THR 30 HG1 THR 30 0.472 -19.304 -2.194 266 HG21 THR 30 HG21 THR 30 2.974 -17.427 -4.770 267 HG22 THR 30 HG22 THR 30 2.070 -18.855 -5.298 268 HG23 THR 30 HG23 THR 30 3.358 -19.001 -4.076 269 H GLU 31 H GLU 31 3.821 -17.084 -0.248 270 HA GLU 31 HA GLU 31 5.568 -18.163 0.850 271 HB2 GLU 31 HB2 GLU 31 4.115 -20.801 0.484 272 HB3 GLU 31 HB3 GLU 31 5.236 -20.287 1.740 273 HG2 GLU 31 HG2 GLU 31 3.358 -18.428 2.194 274 HG3 GLU 31 HG3 GLU 31 2.331 -19.643 1.410 275 H LYS 32 H LYS 32 5.713 -17.712 -1.970 276 HA LYS 32 HA LYS 32 6.994 -19.992 -3.222 277 HB2 LYS 32 HB2 LYS 32 5.718 -17.843 -4.294 278 HB3 LYS 32 HB3 LYS 32 7.343 -17.176 -4.262 279 HG2 LYS 32 HG2 LYS 32 7.457 -18.100 -6.297 280 HG3 LYS 32 HG3 LYS 32 7.984 -19.512 -5.378 281 HD2 LYS 32 HD2 LYS 32 5.129 -18.951 -6.312 282 HD3 LYS 32 HD3 LYS 32 6.282 -19.967 -7.162 283 HE2 LYS 32 HE2 LYS 32 6.392 -21.395 -5.014 284 HE3 LYS 32 HE3 LYS 32 4.969 -20.480 -4.461 285 HZ1 LYS 32 HZ1 LYS 32 5.223 -22.193 -6.850 286 HZ2 LYS 32 HZ2 LYS 32 3.919 -21.212 -6.602 287 HZ3 LYS 32 HZ3 LYS 32 4.251 -22.460 -5.566 288 H TYR 33 H TYR 33 8.954 -20.583 -2.263 289 HA TYR 33 HA TYR 33 10.481 -18.769 -0.670 290 HB2 TYR 33 HB2 TYR 33 11.305 -21.476 -1.767 291 HB3 TYR 33 HB3 TYR 33 11.954 -20.675 -0.345 292 HD1 TYR 33 HD1 TYR 33 9.761 -19.833 1.304 293 HD2 TYR 33 HD2 TYR 33 10.058 -23.346 -1.178 294 HE1 TYR 33 HE1 TYR 33 7.967 -20.890 2.606 295 HE2 TYR 33 HE2 TYR 33 8.301 -24.452 0.185 296 HH TYR 33 HH TYR 33 6.612 -22.750 2.870 297 H GLY 34 H GLY 34 12.982 -18.633 -1.046 298 HA2 GLY 34 HA2 GLY 34 14.335 -18.801 -3.398 299 HA3 GLY 34 HA3 GLY 34 13.448 -17.266 -3.549 300 H SER 35 H SER 35 16.350 -17.623 -3.331 301 HA SER 35 HA SER 35 16.865 -15.840 -1.065 302 HB2 SER 35 HB2 SER 35 18.391 -18.409 -1.607 303 HB3 SER 35 HB3 SER 35 18.856 -17.160 -0.432 304 HG SER 35 HG SER 35 17.634 -18.980 0.428 305 H GLY 36 H GLY 36 19.287 -15.039 -1.334 306 HA2 GLY 36 HA2 GLY 36 20.539 -15.103 -3.863 307 HA3 GLY 36 HA3 GLY 36 19.490 -13.682 -3.784 308 H SER 37 H SER 37 22.000 -12.994 -4.044 309 HA SER 37 HA SER 37 22.852 -12.021 -1.387 310 HB2 SER 37 HB2 SER 37 25.217 -12.594 -2.025 311 HB3 SER 37 HB3 SER 37 24.187 -14.015 -1.803 312 HG SER 37 HG SER 37 23.856 -13.926 -4.166 313 H GLY 38 H GLY 38 24.585 -10.254 -1.661 314 HA2 GLY 38 HA2 GLY 38 24.438 -8.761 -4.202 315 HA3 GLY 38 HA3 GLY 38 23.791 -7.984 -2.740 316 H SER 39 H SER 39 26.204 -7.387 -4.433 317 HA SER 39 HA SER 39 28.262 -7.346 -2.291 318 HB2 SER 39 HB2 SER 39 28.659 -7.828 -5.271 319 HB3 SER 39 HB3 SER 39 29.950 -7.666 -4.068 320 HG SER 39 HG SER 39 29.239 -9.860 -4.664 321 H GLY 40 H GLY 40 30.000 -5.568 -3.022 322 HA2 GLY 40 HA2 GLY 40 28.934 -3.302 -4.474 323 HA3 GLY 40 HA3 GLY 40 29.061 -3.077 -2.716 324 H SER 41 H SER 41 30.672 -1.371 -3.933 325 HA SER 41 HA SER 41 33.349 -2.339 -3.351 326 HB2 SER 41 HB2 SER 41 32.513 -1.514 -6.167 327 HB3 SER 41 HB3 SER 41 34.197 -1.541 -5.616 328 HG SER 41 HG SER 41 32.746 -3.853 -5.093 329 H GLY 42 H GLY 42 34.845 -0.566 -3.179 330 HA2 GLY 42 HA2 GLY 42 33.624 1.863 -2.188 331 HA3 GLY 42 HA3 GLY 42 35.360 1.503 -2.304 332 H SER 43 H SER 43 34.609 4.083 -2.945 333 HA SER 43 HA SER 43 35.355 4.305 -5.724 334 HB2 SER 43 HB2 SER 43 32.690 5.464 -4.762 335 HB3 SER 43 HB3 SER 43 33.408 5.649 -6.373 336 HG SER 43 HG SER 43 33.346 3.078 -5.963 337 H GLY 44 H GLY 44 35.897 6.679 -6.146 338 HA2 GLY 44 HA2 GLY 44 35.849 8.581 -3.992 339 HA3 GLY 44 HA3 GLY 44 37.442 7.818 -4.185 340 H SER 45 H SER 45 35.219 10.167 -5.487 341 HA SER 45 HA SER 45 37.077 11.273 -7.271 342 HB2 SER 45 HB2 SER 45 36.276 9.274 -8.652 343 HB3 SER 45 HB3 SER 45 34.652 9.984 -8.614 344 HG SER 45 HG SER 45 36.159 10.460 -10.452 345 H GLY 46 H GLY 46 35.550 12.968 -8.627 346 HA2 GLY 46 HA2 GLY 46 33.928 14.656 -8.567 347 HA3 GLY 46 HA3 GLY 46 33.170 13.864 -7.168 348 H SER 47 H SER 47 33.066 16.238 -6.535 349 HA SER 47 HA SER 47 35.301 16.800 -4.700 350 HB2 SER 47 HB2 SER 47 34.489 18.931 -6.713 351 HB3 SER 47 HB3 SER 47 35.762 19.025 -5.486 352 HG SER 47 HG SER 47 36.420 16.932 -6.790 353 H GLY 48 H GLY 48 31.919 17.052 -5.490 354 HA2 GLY 48 HA2 GLY 48 31.368 18.032 -2.813 355 HA3 GLY 48 HA3 GLY 48 31.015 19.223 -4.071 356 H SER 49 H SER 49 30.692 15.659 -4.344 357 HA SER 49 HA SER 49 28.239 15.658 -5.625 358 HB2 SER 49 HB2 SER 49 29.390 13.432 -3.919 359 HB3 SER 49 HB3 SER 49 28.335 13.278 -5.329 360 HG SER 49 HG SER 49 30.452 12.853 -5.859 361 H GLY 50 H GLY 50 28.742 15.960 -2.121 362 HA2 GLY 50 HA2 GLY 50 27.149 16.394 -0.528 363 HA3 GLY 50 HA3 GLY 50 25.858 16.148 -1.719 364 H SER 51 H SER 51 25.205 15.074 0.551 365 HA SER 51 HA SER 51 25.478 12.159 0.257 366 HB2 SER 51 HB2 SER 51 25.757 12.157 2.834 367 HB3 SER 51 HB3 SER 51 27.161 12.536 1.839 368 HG SER 51 HG SER 51 25.474 14.438 3.130 369 H GLY 52 H GLY 52 23.779 11.170 1.983 370 HA2 GLY 52 HA2 GLY 52 21.396 12.877 2.298 371 HA3 GLY 52 HA3 GLY 52 21.251 11.457 1.250 372 H SER 53 H SER 53 19.720 11.684 3.554 373 HA SER 53 HA SER 53 20.960 9.694 5.438 374 HB2 SER 53 HB2 SER 53 18.853 11.787 6.029 375 HB3 SER 53 HB3 SER 53 19.686 10.737 7.188 376 HG SER 53 HG SER 53 20.742 12.863 5.610 377 H GLY 54 H GLY 54 18.222 10.098 3.238 378 HA2 GLY 54 HA2 GLY 54 16.666 8.486 2.712 379 HA3 GLY 54 HA3 GLY 54 17.240 7.462 4.046 380 H SER 55 H SER 55 14.685 7.349 4.167 381 HA SER 55 HA SER 55 13.776 9.302 6.199 382 HB2 SER 55 HB2 SER 55 12.133 8.305 3.846 383 HB3 SER 55 HB3 SER 55 11.651 9.481 5.080 384 HG SER 55 HG SER 55 12.777 10.999 4.120 385 H GLY 56 H GLY 56 11.187 8.095 6.446 386 HA2 GLY 56 HA2 GLY 56 10.102 6.099 7.061 387 HA3 GLY 56 HA3 GLY 56 11.665 5.274 7.252 388 H SER 57 H SER 57 9.356 7.523 8.668 389 HA SER 57 HA SER 57 10.759 7.308 11.288 390 HB2 SER 57 HB2 SER 57 11.157 9.461 10.002 391 HB3 SER 57 HB3 SER 57 9.447 9.824 10.189 392 HG SER 57 HG SER 57 11.004 9.213 12.461 393 H GLY 58 H GLY 58 7.654 7.493 9.543 394 HA2 GLY 58 HA2 GLY 58 6.293 6.291 11.779 395 HA3 GLY 58 HA3 GLY 58 5.878 8.003 11.617 396 H TYR 59 H TYR 59 5.263 8.687 9.275 397 HA TYR 59 HA TYR 59 3.107 7.025 8.341 398 HB2 TYR 59 HB2 TYR 59 4.436 9.522 7.232 399 HB3 TYR 59 HB3 TYR 59 3.031 8.792 6.489 400 HD1 TYR 59 HD1 TYR 59 1.092 8.179 8.466 401 HD2 TYR 59 HD2 TYR 59 3.852 11.507 8.328 402 HE1 TYR 59 HE1 TYR 59 -0.471 9.538 9.816 403 HE2 TYR 59 HE2 TYR 59 2.303 12.844 9.698 404 HH TYR 59 HH TYR 59 0.435 12.776 11.046 405 H GLN3288 H GLN3288 3.031 6.869 5.701 406 HA GLN3288 HA GLN3288 4.636 4.670 5.059 407 HB2 GLN3288 HB2 GLN3288 3.720 4.788 2.857 408 HB3 GLN3288 HB3 GLN3288 2.468 5.232 4.014 409 HG2 GLN3288 HG2 GLN3288 3.115 7.709 3.460 410 HG3 GLN3288 HG3 GLN3288 3.992 7.036 2.082 411 HE21 GLN3288 HE21 GLN3288 2.778 6.216 0.302 412 HE22 GLN3288 HE22 GLN3288 1.054 6.436 0.173 413 H ILE3289 H ILE3289 6.158 4.404 3.269 414 HA ILE3289 HA ILE3289 8.149 6.593 3.254 415 HB ILE3289 HB ILE3289 8.675 3.652 2.835 416 HG12 ILE3289 HG12 ILE3289 8.999 5.318 5.364 417 HG13 ILE3289 HG13 ILE3289 7.828 4.022 5.146 418 HG21 ILE3289 HG21 ILE3289 10.504 6.036 3.452 419 HG22 ILE3289 HG22 ILE3289 11.029 4.367 3.151 420 HG23 ILE3289 HG23 ILE3289 10.308 5.276 1.850 421 HD11 ILE3289 HD11 ILE3289 10.839 3.676 5.255 422 HD12 ILE3289 HD12 ILE3289 9.637 3.146 6.419 423 HD13 ILE3289 HD13 ILE3289 9.678 2.392 4.815 424 H GLU3290 H GLU3290 7.330 7.738 1.628 425 HA GLU3290 HA GLU3290 6.492 6.826 -0.910 426 HB2 GLU3290 HB2 GLU3290 5.997 8.969 0.310 427 HB3 GLU3290 HB3 GLU3290 7.626 9.523 -0.096 428 HG2 GLU3290 HG2 GLU3290 7.106 9.588 -2.436 429 HG3 GLU3290 HG3 GLU3290 5.558 8.753 -2.175 430 H THR3291 H THR3291 9.515 6.826 0.452 431 HA THR3291 HA THR3291 10.999 6.838 -2.122 432 HB THR3291 HB THR3291 11.386 8.806 -0.758 433 HG1 THR3291 HG1 THR3291 13.690 7.279 -0.451 434 HG21 THR3291 HG21 THR3291 10.970 8.042 1.505 435 HG22 THR3291 HG22 THR3291 12.590 8.715 1.388 436 HG23 THR3291 HG23 THR3291 12.364 6.949 1.441 437 H PHE3292 H PHE3292 9.660 4.475 -1.196 438 HA PHE3292 HA PHE3292 11.998 2.763 -1.131 439 HB2 PHE3292 HB2 PHE3292 11.724 3.202 1.242 440 HB3 PHE3292 HB3 PHE3292 10.022 2.723 1.167 441 HD1 PHE3292 HD1 PHE3292 12.785 0.820 -0.572 442 HD2 PHE3292 HD2 PHE3292 10.134 1.027 2.829 443 HE1 PHE3292 HE1 PHE3292 13.293 -1.527 -0.034 444 HE2 PHE3292 HE2 PHE3292 10.645 -1.333 3.358 445 HZ PHE3292 HZ PHE3292 12.238 -2.624 1.924 446 H PHE3293 H PHE3293 8.468 2.574 -0.486 447 HA PHE3293 HA PHE3293 8.263 0.458 -2.598 448 HB2 PHE3293 HB2 PHE3293 6.186 -0.226 -1.206 449 HB3 PHE3293 HB3 PHE3293 7.760 -0.731 -0.725 450 HD1 PHE3293 HD1 PHE3293 8.139 -0.703 1.580 451 HD2 PHE3293 HD2 PHE3293 5.723 2.435 -0.153 452 HE1 PHE3293 HE1 PHE3293 7.862 0.345 3.801 453 HE2 PHE3293 HE2 PHE3293 5.392 3.403 2.039 454 HZ PHE3293 HZ PHE3293 6.429 2.331 4.086 455 H ALA3294 H ALA3294 7.802 3.628 -2.515 456 HA ALA3294 HA ALA3294 5.126 4.153 -3.029 457 HB1 ALA3294 HB1 ALA3294 7.526 5.398 -4.376 458 HB2 ALA3294 HB2 ALA3294 5.883 6.055 -4.388 459 HB3 ALA3294 HB3 ALA3294 6.738 5.900 -2.857 460 H GLN3295 H GLN3295 7.476 2.615 -5.144 461 HA GLN3295 HA GLN3295 6.085 2.842 -7.631 462 HB2 GLN3295 HB2 GLN3295 8.060 0.711 -6.725 463 HB3 GLN3295 HB3 GLN3295 7.680 1.165 -8.388 464 HG2 GLN3295 HG2 GLN3295 9.082 2.916 -6.304 465 HG3 GLN3295 HG3 GLN3295 9.839 2.125 -7.673 466 HE21 GLN3295 HE21 GLN3295 8.486 5.133 -6.677 467 HE22 GLN3295 HE22 GLN3295 8.138 5.755 -8.259 468 H ASP3296 H ASP3296 5.907 0.504 -4.946 469 HA ASP3296 HA ASP3296 4.097 -1.299 -6.413 470 HB2 ASP3296 HB2 ASP3296 5.019 -1.239 -3.506 471 HB3 ASP3296 HB3 ASP3296 3.894 -2.419 -4.183 472 H ILE3297 H ILE3297 3.955 1.362 -4.201 473 HA ILE3297 HA ILE3297 1.454 1.056 -2.976 474 HB ILE3297 HB ILE3297 3.460 3.065 -3.240 475 HG12 ILE3297 HG12 ILE3297 2.700 3.868 -1.062 476 HG13 ILE3297 HG13 ILE3297 1.207 2.915 -1.232 477 HG21 ILE3297 HG21 ILE3297 2.212 5.168 -3.023 478 HG22 ILE3297 HG22 ILE3297 2.068 4.434 -4.616 479 HG23 ILE3297 HG23 ILE3297 0.718 4.303 -3.480 480 HD11 ILE3297 HD11 ILE3297 2.442 0.868 -1.061 481 HD12 ILE3297 HD12 ILE3297 3.992 1.692 -1.312 482 HD13 ILE3297 HD13 ILE3297 3.097 1.947 0.194 483 H GLU3298 H GLU3298 2.251 2.619 -6.036 484 HA GLU3298 HA GLU3298 -0.419 3.404 -6.661 485 HB2 GLU3298 HB2 GLU3298 0.507 3.592 -8.996 486 HB3 GLU3298 HB3 GLU3298 1.289 4.545 -7.720 487 HG2 GLU3298 HG2 GLU3298 3.192 3.164 -7.630 488 HG3 GLU3298 HG3 GLU3298 2.469 1.892 -8.587 489 H SER3299 H SER3299 1.494 0.581 -7.464 490 HA SER3299 HA SER3299 -0.413 -0.688 -9.171 491 HB2 SER3299 HB2 SER3299 1.888 -1.376 -9.155 492 HB3 SER3299 HB3 SER3299 1.826 -1.854 -7.458 493 HG SER3299 HG SER3299 0.596 -3.615 -7.987 494 H VAL3300 H VAL3300 0.051 -0.982 -5.639 495 HA VAL3300 HA VAL3300 -2.117 -2.925 -5.441 496 HB VAL3300 HB VAL3300 -0.145 -2.934 -3.963 497 HG11 VAL3300 HG11 VAL3300 -1.370 -0.497 -2.593 498 HG12 VAL3300 HG12 VAL3300 0.012 -1.446 -2.028 499 HG13 VAL3300 HG13 VAL3300 0.136 -0.539 -3.532 500 HG21 VAL3300 HG21 VAL3300 -2.794 -2.598 -2.541 501 HG22 VAL3300 HG22 VAL3300 -2.247 -4.066 -3.371 502 HG23 VAL3300 HG23 VAL3300 -1.370 -3.486 -1.939 503 H GLN3301 H GLN3301 -1.823 0.626 -4.897 504 HA GLN3301 HA GLN3301 -4.508 0.731 -3.875 505 HB2 GLN3301 HB2 GLN3301 -4.275 2.993 -3.680 506 HB3 GLN3301 HB3 GLN3301 -2.696 2.296 -3.336 507 HG2 GLN3301 HG2 GLN3301 -1.808 3.772 -4.749 508 HG3 GLN3301 HG3 GLN3301 -2.561 2.879 -6.061 509 HE21 GLN3301 HE21 GLN3301 -5.148 3.525 -6.074 510 HE22 GLN3301 HE22 GLN3301 -5.220 5.171 -6.483 511 H LYS3302 H LYS3302 -3.183 0.853 -7.135 512 HA LYS3302 HA LYS3302 -5.351 1.950 -8.569 513 HB2 LYS3302 HB2 LYS3302 -3.103 0.080 -9.228 514 HB3 LYS3302 HB3 LYS3302 -4.408 0.271 -10.399 515 HG2 LYS3302 HG2 LYS3302 -4.025 2.591 -10.688 516 HG3 LYS3302 HG3 LYS3302 -3.025 2.713 -9.245 517 HD2 LYS3302 HD2 LYS3302 -1.484 2.759 -11.055 518 HD3 LYS3302 HD3 LYS3302 -1.359 1.155 -10.369 519 HE2 LYS3302 HE2 LYS3302 -1.371 0.733 -12.642 520 HE3 LYS3302 HE3 LYS3302 -3.033 0.380 -12.179 521 HZ1 LYS3302 HZ1 LYS3302 -2.904 1.666 -14.188 522 HZ2 LYS3302 HZ2 LYS3302 -2.049 2.865 -13.429 523 HZ3 LYS3302 HZ3 LYS3302 -3.611 2.625 -13.039 524 H GLU3303 H GLU3303 -4.987 -1.167 -7.038 525 HA GLU3303 HA GLU3303 -7.162 -2.408 -8.575 526 HB2 GLU3303 HB2 GLU3303 -6.549 -4.376 -7.643 527 HB3 GLU3303 HB3 GLU3303 -5.044 -3.496 -7.478 528 HG2 GLU3303 HG2 GLU3303 -6.043 -2.866 -5.097 529 HG3 GLU3303 HG3 GLU3303 -7.096 -4.203 -5.423 530 H LEU3304 H LEU3304 -6.738 -1.042 -5.317 531 HA LEU3304 HA LEU3304 -9.448 -1.430 -4.533 532 HB2 LEU3304 HB2 LEU3304 -7.220 0.401 -3.523 533 HB3 LEU3304 HB3 LEU3304 -8.737 0.097 -2.722 534 HG LEU3304 HG LEU3304 -6.384 -1.773 -3.101 535 HD11 LEU3304 HD11 LEU3304 -8.056 -1.019 -0.700 536 HD12 LEU3304 HD12 LEU3304 -6.588 -0.164 -1.191 537 HD13 LEU3304 HD13 LEU3304 -6.489 -1.863 -0.675 538 HD21 LEU3304 HD21 LEU3304 -9.202 -2.617 -2.278 539 HD22 LEU3304 HD22 LEU3304 -7.746 -3.600 -2.024 540 HD23 LEU3304 HD23 LEU3304 -8.267 -3.214 -3.652 541 H GLU3305 H GLU3305 -7.861 1.391 -6.004 542 HA GLU3305 HA GLU3305 -9.810 3.344 -5.259 543 HB2 GLU3305 HB2 GLU3305 -8.884 4.679 -7.125 544 HB3 GLU3305 HB3 GLU3305 -7.609 3.952 -6.141 545 HG2 GLU3305 HG2 GLU3305 -7.366 2.138 -7.728 546 HG3 GLU3305 HG3 GLU3305 -8.694 2.726 -8.726 547 H ASN3306 H ASN3306 -10.251 0.684 -7.310 548 HA ASN3306 HA ASN3306 -12.600 2.016 -8.527 549 HB2 ASN3306 HB2 ASN3306 -12.359 0.955 -10.512 550 HB3 ASN3306 HB3 ASN3306 -10.706 1.376 -10.119 551 HD21 ASN3306 HD21 ASN3306 -9.180 -0.362 -9.520 552 HD22 ASN3306 HD22 ASN3306 -9.649 -1.993 -9.941 553 H LEU3307 H LEU3307 -11.870 0.006 -6.023 554 HA LEU3307 HA LEU3307 -14.042 -1.932 -6.506 555 HB2 LEU3307 HB2 LEU3307 -11.767 -1.625 -4.630 556 HB3 LEU3307 HB3 LEU3307 -13.251 -1.975 -3.800 557 HG LEU3307 HG LEU3307 -12.780 -4.089 -4.032 558 HD11 LEU3307 HD11 LEU3307 -14.494 -4.004 -5.795 559 HD12 LEU3307 HD12 LEU3307 -13.342 -5.316 -6.015 560 HD13 LEU3307 HD13 LEU3307 -13.208 -3.851 -7.022 561 HD21 LEU3307 HD21 LEU3307 -10.479 -3.599 -4.486 562 HD22 LEU3307 HD22 LEU3307 -10.826 -3.560 -6.247 563 HD23 LEU3307 HD23 LEU3307 -11.038 -5.054 -5.293 564 H SER3308 H SER3308 -15.876 -2.069 -5.118 565 HA SER3308 HA SER3308 -17.105 0.496 -4.613 566 HB2 SER3308 HB2 SER3308 -17.952 -2.369 -3.999 567 HB3 SER3308 HB3 SER3308 -18.996 -0.952 -3.836 568 HG SER3308 HG SER3308 -19.359 -0.988 -5.847 569 H GLU3309 H GLU3309 -18.212 1.005 -2.410 570 HA GLU3309 HA GLU3309 -16.343 0.957 -0.248 571 HB2 GLU3309 HB2 GLU3309 -19.343 1.410 -0.638 572 HB3 GLU3309 HB3 GLU3309 -18.790 1.110 1.002 573 HG2 GLU3309 HG2 GLU3309 -17.667 3.042 1.227 574 HG3 GLU3309 HG3 GLU3309 -17.350 3.248 -0.482 575 H GLU3310 H GLU3310 -19.133 -1.107 -1.039 576 HA GLU3310 HA GLU3310 -19.238 -2.767 1.096 577 HB2 GLU3310 HB2 GLU3310 -19.516 -3.389 -1.877 578 HB3 GLU3310 HB3 GLU3310 -20.223 -4.372 -0.592 579 HG2 GLU3310 HG2 GLU3310 -21.542 -2.310 0.143 580 HG3 GLU3310 HG3 GLU3310 -20.902 -1.466 -1.261 581 H GLU3311 H GLU3311 -16.741 -2.683 -1.325 582 HA GLU3311 HA GLU3311 -15.656 -5.341 -0.707 583 HB2 GLU3311 HB2 GLU3311 -14.985 -3.109 -2.674 584 HB3 GLU3311 HB3 GLU3311 -14.025 -4.540 -2.503 585 HG2 GLU3311 HG2 GLU3311 -16.992 -4.823 -2.969 586 HG3 GLU3311 HG3 GLU3311 -16.013 -4.345 -4.261 587 H LEU3312 H LEU3312 -14.678 -1.928 -0.709 588 HA LEU3312 HA LEU3312 -12.286 -2.376 0.777 589 HB2 LEU3312 HB2 LEU3312 -13.686 0.273 0.498 590 HB3 LEU3312 HB3 LEU3312 -11.983 0.018 0.721 591 HG LEU3312 HG LEU3312 -13.351 -1.088 -1.762 592 HD11 LEU3312 HD11 LEU3312 -12.586 1.771 -1.304 593 HD12 LEU3312 HD12 LEU3312 -14.146 1.028 -1.794 594 HD13 LEU3312 HD13 LEU3312 -12.772 1.014 -2.901 595 HD21 LEU3312 HD21 LEU3312 -11.105 -0.750 -2.712 596 HD22 LEU3312 HD22 LEU3312 -11.219 -1.970 -1.430 597 HD23 LEU3312 HD23 LEU3312 -10.506 -0.386 -1.088 598 H LEU3313 H LEU3313 -15.271 -0.797 1.673 599 HA LEU3313 HA LEU3313 -14.804 -0.097 4.380 600 HB2 LEU3313 HB2 LEU3313 -16.675 0.815 2.940 601 HB3 LEU3313 HB3 LEU3313 -17.428 -0.760 2.884 602 HG LEU3313 HG LEU3313 -18.492 0.794 4.421 603 HD11 LEU3313 HD11 LEU3313 -19.244 -0.870 5.937 604 HD12 LEU3313 HD12 LEU3313 -17.804 -1.851 5.715 605 HD13 LEU3313 HD13 LEU3313 -18.945 -1.638 4.372 606 HD21 LEU3313 HD21 LEU3313 -16.314 0.097 6.397 607 HD22 LEU3313 HD22 LEU3313 -17.793 1.019 6.710 608 HD23 LEU3313 HD23 LEU3313 -16.554 1.698 5.655 609 H ALA3314 H ALA3314 -16.008 -3.146 2.785 610 HA ALA3314 HA ALA3314 -16.518 -4.336 5.310 611 HB1 ALA3314 HB1 ALA3314 -17.467 -5.170 3.208 612 HB2 ALA3314 HB2 ALA3314 -15.882 -5.699 2.655 613 HB3 ALA3314 HB3 ALA3314 -16.639 -6.451 4.121 614 H MET3315 H MET3315 -13.452 -3.906 3.543 615 HA MET3315 HA MET3315 -12.072 -6.083 4.908 616 HB2 MET3315 HB2 MET3315 -10.732 -3.638 3.759 617 HB3 MET3315 HB3 MET3315 -10.075 -5.248 3.918 618 HG2 MET3315 HG2 MET3315 -12.417 -5.436 2.310 619 HG3 MET3315 HG3 MET3315 -11.554 -4.012 1.775 620 HE1 MET3315 HE1 MET3315 -12.235 -6.291 -0.212 621 HE2 MET3315 HE2 MET3315 -11.348 -4.813 -0.639 622 HE3 MET3315 HE3 MET3315 -10.707 -6.400 -1.114 623 H LEU3316 H LEU3316 -11.977 -2.540 5.166 624 HA LEU3316 HA LEU3316 -10.304 -2.456 7.479 625 HB2 LEU3316 HB2 LEU3316 -11.051 -0.065 7.644 626 HB3 LEU3316 HB3 LEU3316 -10.375 -0.550 6.097 627 HG LEU3316 HG LEU3316 -13.010 -0.945 5.554 628 HD11 LEU3316 HD11 LEU3316 -12.948 1.311 7.635 629 HD12 LEU3316 HD12 LEU3316 -13.938 -0.153 7.704 630 HD13 LEU3316 HD13 LEU3316 -14.266 1.067 6.482 631 HD21 LEU3316 HD21 LEU3316 -12.913 0.940 4.234 632 HD22 LEU3316 HD22 LEU3316 -11.215 0.661 4.502 633 HD23 LEU3316 HD23 LEU3316 -12.066 1.909 5.453 634 H ASN3317 H ASN3317 -13.853 -2.637 7.066 635 HA ASN3317 HA ASN3317 -14.343 -2.152 9.920 636 HB2 ASN3317 HB2 ASN3317 -15.936 -1.707 7.840 637 HB3 ASN3317 HB3 ASN3317 -16.420 -3.387 8.095 638 HD21 ASN3317 HD21 ASN3317 -16.776 -0.211 8.935 639 HD22 ASN3317 HD22 ASN3317 -17.803 -0.378 10.355 640 H GLY3318 H GLY3318 -13.886 -4.823 7.771 641 HA2 GLY3318 HA2 GLY3318 -13.011 -6.925 8.756 642 HA3 GLY3318 HA3 GLY3318 -14.238 -6.805 10.019 643 H ASP3319 H ASP3319 -16.602 -6.147 8.439 644 HA ASP3319 HA ASP3319 -16.813 -7.971 6.227 645 HB2 ASP3319 HB2 ASP3319 -18.452 -9.371 7.226 646 HB3 ASP3319 HB3 ASP3319 -17.010 -9.289 8.234 647 H GLN3320 H GLN3320 -19.004 -8.030 5.437 648 HA GLN3320 HA GLN3320 -20.956 -6.098 6.095 649 HB2 GLN3320 HB2 GLN3320 -19.307 -4.594 4.834 650 HB3 GLN3320 HB3 GLN3320 -19.653 -5.588 3.405 651 HG2 GLN3320 HG2 GLN3320 -22.203 -5.138 4.178 652 HG3 GLN3320 HG3 GLN3320 -21.468 -3.770 5.008 653 HE21 GLN3320 HE21 GLN3320 -22.313 -2.108 3.668 654 HE22 GLN3320 HE22 GLN3320 -21.955 -2.017 1.941 655 H GLN3321 H GLN3321 -22.143 -7.882 6.195 656 HA GLN3321 HA GLN3321 -22.417 -9.815 3.986 657 HB2 GLN3321 HB2 GLN3321 -24.212 -9.466 6.452 658 HB3 GLN3321 HB3 GLN3321 -24.234 -10.755 5.273 659 HG2 GLN3321 HG2 GLN3321 -23.071 -11.799 6.938 660 HG3 GLN3321 HG3 GLN3321 -21.750 -11.174 5.966 661 HE21 GLN3321 HE21 GLN3321 -22.911 -8.397 7.550 662 HE22 GLN3321 HE22 GLN3321 -21.537 -8.463 8.660 Start of MODEL 4 1 H1 MET 1 H MET 1 -27.715 14.426 -0.505 2 HA MET 1 HA MET 1 -24.939 13.895 0.370 3 HB2 MET 1 HB2 MET 1 -27.511 13.833 2.021 4 HB3 MET 1 HB3 MET 1 -25.948 13.201 2.546 5 HG2 MET 1 HG2 MET 1 -25.111 15.604 1.801 6 HG3 MET 1 HG3 MET 1 -26.817 16.000 2.091 7 HE1 MET 1 HE1 MET 1 -23.777 14.375 5.143 8 HE2 MET 1 HE2 MET 1 -24.020 13.784 3.504 9 HE3 MET 1 HE3 MET 1 -23.263 15.370 3.759 10 H ASN 2 H ASN 2 -28.192 12.374 -0.165 11 HA ASN 2 HA ASN 2 -27.378 9.884 0.701 12 HB2 ASN 2 HB2 ASN 2 -29.613 10.734 -1.176 13 HB3 ASN 2 HB3 ASN 2 -29.315 9.041 -0.811 14 HD21 ASN 2 HD21 ASN 2 -30.026 12.192 0.865 15 HD22 ASN 2 HD22 ASN 2 -30.764 11.357 2.230 16 H ILE 3 H ILE 3 -25.558 8.863 -0.109 17 HA ILE 3 HA ILE 3 -25.558 7.729 -2.726 18 HB ILE 3 HB ILE 3 -24.842 10.085 -3.259 19 HG12 ILE 3 HG12 ILE 3 -22.660 8.094 -3.897 20 HG13 ILE 3 HG13 ILE 3 -24.296 7.911 -4.531 21 HG21 ILE 3 HG21 ILE 3 -22.593 10.856 -2.750 22 HG22 ILE 3 HG22 ILE 3 -23.468 10.556 -1.250 23 HG23 ILE 3 HG23 ILE 3 -22.259 9.386 -1.804 24 HD11 ILE 3 HD11 ILE 3 -22.563 10.369 -4.992 25 HD12 ILE 3 HD12 ILE 3 -22.909 9.065 -6.147 26 HD13 ILE 3 HD13 ILE 3 -24.217 10.120 -5.570 27 H ASN 4 H ASN 4 -24.415 5.956 -2.777 28 HA ASN 4 HA ASN 4 -22.792 5.176 -0.423 29 HB2 ASN 4 HB2 ASN 4 -23.270 2.859 -1.165 30 HB3 ASN 4 HB3 ASN 4 -24.689 3.754 -0.652 31 HD21 ASN 4 HD21 ASN 4 -23.147 2.158 -3.352 32 HD22 ASN 4 HD22 ASN 4 -24.260 2.669 -4.613 33 H GLU 5 H GLU 5 -22.806 4.950 -4.010 34 HA GLU 5 HA GLU 5 -20.350 3.769 -4.463 35 HB2 GLU 5 HB2 GLU 5 -21.801 5.958 -5.966 36 HB3 GLU 5 HB3 GLU 5 -20.308 5.241 -6.581 37 HG2 GLU 5 HG2 GLU 5 -21.272 3.115 -6.899 38 HG3 GLU 5 HG3 GLU 5 -22.630 3.478 -5.831 39 H GLN 6 H GLN 6 -21.034 7.167 -4.009 40 HA GLN 6 HA GLN 6 -18.273 7.989 -4.317 41 HB2 GLN 6 HB2 GLN 6 -20.687 9.289 -4.391 42 HB3 GLN 6 HB3 GLN 6 -20.032 9.906 -2.872 43 HG2 GLN 6 HG2 GLN 6 -18.125 10.839 -4.003 44 HG3 GLN 6 HG3 GLN 6 -18.387 9.823 -5.432 45 HE21 GLN 6 HE21 GLN 6 -20.035 12.448 -3.597 46 HE22 GLN 6 HE22 GLN 6 -20.772 13.132 -5.048 47 H THR 7 H THR 7 -20.173 6.826 -1.600 48 HA THR 7 HA THR 7 -18.360 7.854 0.428 49 HB THR 7 HB THR 7 -20.263 5.491 0.573 50 HG1 THR 7 HG1 THR 7 -21.779 6.920 0.836 51 HG21 THR 7 HG21 THR 7 -18.727 7.188 2.603 52 HG22 THR 7 HG22 THR 7 -18.693 5.435 2.383 53 HG23 THR 7 HG23 THR 7 -20.138 6.187 3.063 54 H LEU 8 H LEU 8 -18.643 4.780 -1.423 55 HA LEU 8 HA LEU 8 -16.890 3.106 -0.092 56 HB2 LEU 8 HB2 LEU 8 -16.684 3.379 -3.088 57 HB3 LEU 8 HB3 LEU 8 -16.559 1.962 -2.041 58 HG LEU 8 HG LEU 8 -19.066 3.479 -2.830 59 HD11 LEU 8 HD11 LEU 8 -19.702 1.509 -4.097 60 HD12 LEU 8 HD12 LEU 8 -18.254 0.666 -3.530 61 HD13 LEU 8 HD13 LEU 8 -18.097 2.060 -4.625 62 HD21 LEU 8 HD21 LEU 8 -20.332 1.633 -1.748 63 HD22 LEU 8 HD22 LEU 8 -19.449 2.676 -0.641 64 HD23 LEU 8 HD23 LEU 8 -18.794 1.066 -1.051 65 H ASP 9 H ASP 9 -16.170 5.955 -2.071 66 HA ASP 9 HA ASP 9 -13.481 5.642 -2.711 67 HB2 ASP 9 HB2 ASP 9 -14.820 7.536 -3.451 68 HB3 ASP 9 HB3 ASP 9 -14.863 8.165 -1.793 69 H LYS 10 H LYS 10 -14.876 6.883 0.391 70 HA LYS 10 HA LYS 10 -12.253 7.360 1.539 71 HB2 LYS 10 HB2 LYS 10 -13.272 8.074 3.474 72 HB3 LYS 10 HB3 LYS 10 -14.459 8.497 2.232 73 HG2 LYS 10 HG2 LYS 10 -15.756 6.517 2.772 74 HG3 LYS 10 HG3 LYS 10 -14.600 6.014 4.011 75 HD2 LYS 10 HD2 LYS 10 -16.086 8.632 4.076 76 HD3 LYS 10 HD3 LYS 10 -16.730 7.106 4.729 77 HE2 LYS 10 HE2 LYS 10 -14.796 6.867 6.214 78 HE3 LYS 10 HE3 LYS 10 -14.053 8.329 5.553 79 HZ1 LYS 10 HZ1 LYS 10 -16.694 8.383 6.861 80 HZ2 LYS 10 HZ2 LYS 10 -15.706 9.647 6.538 81 HZ3 LYS 10 HZ3 LYS 10 -15.306 8.531 7.707 82 H LEU 11 H LEU 11 -14.277 4.569 1.217 83 HA LEU 11 HA LEU 11 -13.041 3.020 3.384 84 HB2 LEU 11 HB2 LEU 11 -15.005 2.257 1.167 85 HB3 LEU 11 HB3 LEU 11 -14.260 1.125 2.285 86 HG LEU 11 HG LEU 11 -16.409 1.465 3.027 87 HD11 LEU 11 HD11 LEU 11 -16.220 2.478 5.268 88 HD12 LEU 11 HD12 LEU 11 -14.593 3.041 4.877 89 HD13 LEU 11 HD13 LEU 11 -14.990 1.291 4.882 90 HD21 LEU 11 HD21 LEU 11 -17.473 3.561 3.574 91 HD22 LEU 11 HD22 LEU 11 -16.917 3.619 1.902 92 HD23 LEU 11 HD23 LEU 11 -15.999 4.444 3.166 93 H ARG 12 H ARG 12 -12.979 2.989 -0.235 94 HA ARG 12 HA ARG 12 -10.973 0.957 -0.367 95 HB2 ARG 12 HB2 ARG 12 -10.467 1.885 -2.701 96 HB3 ARG 12 HB3 ARG 12 -11.973 1.142 -2.314 97 HG2 ARG 12 HG2 ARG 12 -13.076 2.847 -3.157 98 HG3 ARG 12 HG3 ARG 12 -12.468 3.879 -1.879 99 HD2 ARG 12 HD2 ARG 12 -10.659 3.466 -4.190 100 HD3 ARG 12 HD3 ARG 12 -12.155 4.400 -4.432 101 HE ARG 12 HE ARG 12 -11.346 5.688 -2.321 102 HH11 ARG 12 HH11 ARG 12 -9.476 4.885 -5.230 103 HH12 ARG 12 HH12 ARG 12 -8.227 5.989 -4.930 104 HH21 ARG 12 HH21 ARG 12 -10.201 7.692 -2.474 105 HH22 ARG 12 HH22 ARG 12 -8.781 7.775 -3.454 106 H GLN 13 H GLN 13 -10.553 4.471 -0.222 107 HA GLN 13 HA GLN 13 -7.756 4.291 -0.437 108 HB2 GLN 13 HB2 GLN 13 -7.638 6.561 0.199 109 HB3 GLN 13 HB3 GLN 13 -9.084 6.306 -0.751 110 HG2 GLN 13 HG2 GLN 13 -10.012 7.569 0.907 111 HG3 GLN 13 HG3 GLN 13 -10.280 5.964 1.493 112 HE21 GLN 13 HE21 GLN 13 -10.354 6.431 3.665 113 HE22 GLN 13 HE22 GLN 13 -8.877 6.674 4.573 114 H ALA 14 H ALA 14 -9.835 3.678 2.398 115 HA ALA 14 HA ALA 14 -7.675 3.707 4.307 116 HB1 ALA 14 HB1 ALA 14 -9.356 2.428 5.701 117 HB2 ALA 14 HB2 ALA 14 -9.976 3.962 5.051 118 HB3 ALA 14 HB3 ALA 14 -10.434 2.430 4.298 119 H VAL 15 H VAL 15 -9.225 1.237 2.220 120 HA VAL 15 HA VAL 15 -7.671 -0.967 3.236 121 HB VAL 15 HB VAL 15 -9.204 -0.758 0.615 122 HG11 VAL 15 HG11 VAL 15 -9.359 -3.214 0.767 123 HG12 VAL 15 HG12 VAL 15 -7.663 -2.722 0.697 124 HG13 VAL 15 HG13 VAL 15 -8.382 -3.205 2.246 125 HG21 VAL 15 HG21 VAL 15 -10.923 -2.042 1.965 126 HG22 VAL 15 HG22 VAL 15 -10.111 -1.494 3.428 127 HG23 VAL 15 HG23 VAL 15 -10.837 -0.341 2.277 128 H LEU 16 H LEU 16 -7.227 1.372 0.597 129 HA LEU 16 HA LEU 16 -4.912 -0.031 -0.445 130 HB2 LEU 16 HB2 LEU 16 -4.500 1.597 -1.979 131 HB3 LEU 16 HB3 LEU 16 -6.234 1.603 -1.789 132 HG LEU 16 HG LEU 16 -5.777 3.614 -0.193 133 HD11 LEU 16 HD11 LEU 16 -3.976 5.085 -0.881 134 HD12 LEU 16 HD12 LEU 16 -3.349 3.834 -1.983 135 HD13 LEU 16 HD13 LEU 16 -3.328 3.591 -0.222 136 HD21 LEU 16 HD21 LEU 16 -5.535 4.102 -3.186 137 HD22 LEU 16 HD22 LEU 16 -6.300 5.116 -1.971 138 HD23 LEU 16 HD23 LEU 16 -7.057 3.599 -2.419 139 H GLN 17 H GLN 17 -5.336 2.536 2.068 140 HA GLN 17 HA GLN 17 -2.633 3.075 2.483 141 HB2 GLN 17 HB2 GLN 17 -5.048 3.188 4.280 142 HB3 GLN 17 HB3 GLN 17 -3.430 3.427 4.953 143 HG2 GLN 17 HG2 GLN 17 -2.983 5.166 3.241 144 HG3 GLN 17 HG3 GLN 17 -4.646 5.018 2.666 145 HE21 GLN 17 HE21 GLN 17 -5.932 6.759 3.543 146 HE22 GLN 17 HE22 GLN 17 -5.594 7.434 5.129 147 H LYS 18 H LYS 18 -4.504 0.363 4.223 148 HA LYS 18 HA LYS 18 -2.146 -0.436 5.601 149 HB2 LYS 18 HB2 LYS 18 -3.347 -2.580 5.973 150 HB3 LYS 18 HB3 LYS 18 -4.383 -1.176 6.286 151 HG2 LYS 18 HG2 LYS 18 -5.156 -1.416 3.868 152 HG3 LYS 18 HG3 LYS 18 -4.424 -3.019 3.836 153 HD2 LYS 18 HD2 LYS 18 -6.550 -1.922 5.645 154 HD3 LYS 18 HD3 LYS 18 -6.874 -2.875 4.189 155 HE2 LYS 18 HE2 LYS 18 -5.451 -3.862 6.724 156 HE3 LYS 18 HE3 LYS 18 -7.050 -4.370 6.159 157 HZ1 LYS 18 HZ1 LYS 18 -5.317 -5.968 5.683 158 HZ2 LYS 18 HZ2 LYS 18 -4.475 -4.963 4.747 159 HZ3 LYS 18 HZ3 LYS 18 -5.973 -5.443 4.262 160 H LYS 19 H LYS 19 -3.453 -1.384 2.384 161 HA LYS 19 HA LYS 19 -1.650 -3.439 1.812 162 HB2 LYS 19 HB2 LYS 19 -3.248 -1.520 0.104 163 HB3 LYS 19 HB3 LYS 19 -2.041 -2.546 -0.642 164 HG2 LYS 19 HG2 LYS 19 -3.091 -4.555 0.233 165 HG3 LYS 19 HG3 LYS 19 -4.322 -3.595 1.065 166 HD2 LYS 19 HD2 LYS 19 -5.309 -2.875 -1.027 167 HD3 LYS 19 HD3 LYS 19 -3.949 -3.451 -1.968 168 HE2 LYS 19 HE2 LYS 19 -5.214 -5.531 -0.252 169 HE3 LYS 19 HE3 LYS 19 -6.295 -4.861 -1.476 170 HZ1 LYS 19 HZ1 LYS 19 -5.005 -6.822 -2.223 171 HZ2 LYS 19 HZ2 LYS 19 -3.622 -5.941 -2.217 172 HZ3 LYS 19 HZ3 LYS 19 -4.913 -5.563 -3.191 173 H ILE 20 H ILE 20 -1.081 0.124 1.651 174 HA ILE 20 HA ILE 20 1.339 -0.067 0.229 175 HB ILE 20 HB ILE 20 0.926 1.981 2.430 176 HG12 ILE 20 HG12 ILE 20 -1.094 2.248 1.306 177 HG13 ILE 20 HG13 ILE 20 -0.057 3.480 0.647 178 HG21 ILE 20 HG21 ILE 20 2.255 3.414 0.890 179 HG22 ILE 20 HG22 ILE 20 3.136 1.974 1.390 180 HG23 ILE 20 HG23 ILE 20 2.430 2.047 -0.228 181 HD11 ILE 20 HD11 ILE 20 0.375 1.873 -1.289 182 HD12 ILE 20 HD12 ILE 20 -0.954 0.893 -0.702 183 HD13 ILE 20 HD13 ILE 20 -1.260 2.562 -1.195 184 H LYS 21 H LYS 21 0.685 -0.300 3.744 185 HA LYS 21 HA LYS 21 3.434 -0.596 4.573 186 HB2 LYS 21 HB2 LYS 21 1.001 -1.778 5.977 187 HB3 LYS 21 HB3 LYS 21 2.558 -1.316 6.657 188 HG2 LYS 21 HG2 LYS 21 1.964 1.096 5.938 189 HG3 LYS 21 HG3 LYS 21 0.329 0.482 5.658 190 HD2 LYS 21 HD2 LYS 21 1.858 0.195 8.289 191 HD3 LYS 21 HD3 LYS 21 0.757 1.529 7.931 192 HE2 LYS 21 HE2 LYS 21 -1.150 0.112 7.828 193 HE3 LYS 21 HE3 LYS 21 -0.174 -1.360 7.742 194 HZ1 LYS 21 HZ1 LYS 21 0.389 -1.201 9.969 195 HZ2 LYS 21 HZ2 LYS 21 -1.203 -0.763 9.975 196 HZ3 LYS 21 HZ3 LYS 21 -0.070 0.388 10.112 197 H GLU 22 H GLU 22 0.954 -2.826 3.299 198 HA GLU 22 HA GLU 22 2.285 -5.224 4.231 199 HB2 GLU 22 HB2 GLU 22 0.142 -4.819 2.093 200 HB3 GLU 22 HB3 GLU 22 0.761 -6.383 2.640 201 HG2 GLU 22 HG2 GLU 22 0.085 -5.944 4.899 202 HG3 GLU 22 HG3 GLU 22 -0.479 -4.328 4.503 203 H ARG 23 H ARG 23 2.066 -3.607 1.027 204 HA ARG 23 HA ARG 23 3.910 -5.369 -0.202 205 HB2 ARG 23 HB2 ARG 23 4.093 -3.747 -2.021 206 HB3 ARG 23 HB3 ARG 23 2.453 -4.098 -1.544 207 HG2 ARG 23 HG2 ARG 23 2.317 -1.865 -1.883 208 HG3 ARG 23 HG3 ARG 23 2.581 -1.910 -0.164 209 HD2 ARG 23 HD2 ARG 23 3.803 -0.109 -1.434 210 HD3 ARG 23 HD3 ARG 23 4.871 -1.128 -0.490 211 HE ARG 23 HE ARG 23 6.006 -1.619 -2.384 212 HH11 ARG 23 HH11 ARG 23 2.646 -1.331 -3.538 213 HH12 ARG 23 HH12 ARG 23 3.115 -1.303 -5.179 214 HH21 ARG 23 HH21 ARG 23 6.585 -1.433 -4.584 215 HH22 ARG 23 HH22 ARG 23 5.367 -1.395 -5.806 216 H ILE 24 H ILE 24 4.600 -2.416 1.679 217 HA ILE 24 HA ILE 24 7.401 -2.442 0.860 218 HB ILE 24 HB ILE 24 6.230 -0.366 1.452 219 HG12 ILE 24 HG12 ILE 24 8.594 -1.085 3.224 220 HG13 ILE 24 HG13 ILE 24 8.623 -0.283 1.645 221 HG21 ILE 24 HG21 ILE 24 6.276 -1.162 4.382 222 HG22 ILE 24 HG22 ILE 24 5.410 0.177 3.588 223 HG23 ILE 24 HG23 ILE 24 4.901 -1.478 3.340 224 HD11 ILE 24 HD11 ILE 24 7.346 1.640 2.721 225 HD12 ILE 24 HD12 ILE 24 7.536 0.814 4.278 226 HD13 ILE 24 HD13 ILE 24 8.976 1.370 3.399 227 H GLN 25 H GLN 25 5.552 -3.478 3.827 228 HA GLN 25 HA GLN 25 7.928 -4.227 5.207 229 HB2 GLN 25 HB2 GLN 25 5.687 -3.635 6.195 230 HB3 GLN 25 HB3 GLN 25 5.072 -5.204 5.640 231 HG2 GLN 25 HG2 GLN 25 7.060 -6.187 7.059 232 HG3 GLN 25 HG3 GLN 25 7.122 -4.574 7.757 233 HE21 GLN 25 HE21 GLN 25 5.518 -7.605 7.815 234 HE22 GLN 25 HE22 GLN 25 4.363 -7.176 9.071 235 H ASN 26 H ASN 26 5.458 -6.207 3.463 236 HA ASN 26 HA ASN 26 6.873 -8.706 4.017 237 HB2 ASN 26 HB2 ASN 26 4.666 -8.048 1.982 238 HB3 ASN 26 HB3 ASN 26 5.269 -9.650 2.332 239 HD21 ASN 26 HD21 ASN 26 3.678 -6.884 3.894 240 HD22 ASN 26 HD22 ASN 26 2.800 -7.822 5.104 241 H SER 27 H SER 27 6.260 -6.766 1.124 242 HA SER 27 HA SER 27 7.183 -6.442 -0.780 243 HB2 SER 27 HB2 SER 27 9.175 -5.971 0.752 244 HB3 SER 27 HB3 SER 27 9.851 -7.495 0.143 245 HG SER 27 HG SER 27 9.850 -6.628 -1.926 246 H LEU 28 H LEU 28 7.646 -9.372 0.382 247 HA LEU 28 HA LEU 28 7.920 -10.892 -2.035 248 HB2 LEU 28 HB2 LEU 28 7.690 -12.875 -0.591 249 HB3 LEU 28 HB3 LEU 28 8.754 -11.636 0.088 250 HG LEU 28 HG LEU 28 6.893 -10.874 1.577 251 HD11 LEU 28 HD11 LEU 28 4.904 -11.747 0.632 252 HD12 LEU 28 HD12 LEU 28 5.158 -12.599 2.139 253 HD13 LEU 28 HD13 LEU 28 5.546 -13.404 0.605 254 HD21 LEU 28 HD21 LEU 28 8.004 -13.672 1.928 255 HD22 LEU 28 HD22 LEU 28 7.268 -12.679 3.198 256 HD23 LEU 28 HD23 LEU 28 8.752 -12.144 2.418 257 H SER 29 H SER 29 6.374 -12.832 -2.278 258 HA SER 29 HA SER 29 3.518 -11.899 -2.449 259 HB2 SER 29 HB2 SER 29 5.352 -13.241 -4.453 260 HB3 SER 29 HB3 SER 29 3.575 -13.242 -4.594 261 HG SER 29 HG SER 29 3.543 -11.048 -4.645 262 H THR 30 H THR 30 5.718 -14.619 -1.906 263 HA THR 30 HA THR 30 3.715 -16.100 -0.643 264 HB THR 30 HB THR 30 2.903 -16.603 -2.883 265 HG1 THR 30 HG1 THR 30 2.966 -18.229 -1.196 266 HG21 THR 30 HG21 THR 30 5.651 -17.771 -3.445 267 HG22 THR 30 HG22 THR 30 4.903 -16.352 -4.227 268 HG23 THR 30 HG23 THR 30 4.203 -17.960 -4.454 269 H GLU 31 H GLU 31 6.295 -14.994 -0.157 270 HA GLU 31 HA GLU 31 8.371 -15.414 0.688 271 HB2 GLU 31 HB2 GLU 31 7.286 -18.091 1.578 272 HB3 GLU 31 HB3 GLU 31 8.463 -17.039 2.369 273 HG2 GLU 31 HG2 GLU 31 6.520 -15.305 2.515 274 HG3 GLU 31 HG3 GLU 31 5.450 -16.639 2.104 275 H LYS 32 H LYS 32 7.964 -16.180 -2.092 276 HA LYS 32 HA LYS 32 9.367 -18.499 -2.837 277 HB2 LYS 32 HB2 LYS 32 9.168 -17.677 -5.079 278 HB3 LYS 32 HB3 LYS 32 7.693 -17.381 -4.190 279 HG2 LYS 32 HG2 LYS 32 9.223 -15.030 -3.828 280 HG3 LYS 32 HG3 LYS 32 9.519 -15.463 -5.495 281 HD2 LYS 32 HD2 LYS 32 6.821 -15.080 -4.180 282 HD3 LYS 32 HD3 LYS 32 7.624 -13.886 -5.206 283 HE2 LYS 32 HE2 LYS 32 6.770 -16.658 -6.136 284 HE3 LYS 32 HE3 LYS 32 5.771 -15.220 -6.339 285 HZ1 LYS 32 HZ1 LYS 32 7.459 -14.297 -7.785 286 HZ2 LYS 32 HZ2 LYS 32 7.058 -15.796 -8.312 287 HZ3 LYS 32 HZ3 LYS 32 8.448 -15.603 -7.515 288 H TYR 33 H TYR 33 11.205 -17.226 -0.997 289 HA TYR 33 HA TYR 33 13.224 -15.697 -2.400 290 HB2 TYR 33 HB2 TYR 33 13.381 -17.307 0.161 291 HB3 TYR 33 HB3 TYR 33 14.679 -16.315 -0.460 292 HD1 TYR 33 HD1 TYR 33 11.504 -14.571 -0.978 293 HD2 TYR 33 HD2 TYR 33 14.533 -15.539 1.953 294 HE1 TYR 33 HE1 TYR 33 10.776 -12.687 0.393 295 HE2 TYR 33 HE2 TYR 33 13.818 -13.625 3.317 296 HH TYR 33 HH TYR 33 11.409 -11.239 2.220 297 H GLY 34 H GLY 34 13.731 -18.991 -1.009 298 HA2 GLY 34 HA2 GLY 34 14.595 -20.880 -1.922 299 HA3 GLY 34 HA3 GLY 34 14.621 -20.132 -3.518 300 H SER 35 H SER 35 16.374 -17.905 -3.019 301 HA SER 35 HA SER 35 18.850 -19.057 -1.903 302 HB2 SER 35 HB2 SER 35 20.045 -18.614 -4.037 303 HB3 SER 35 HB3 SER 35 18.764 -19.821 -4.225 304 HG SER 35 HG SER 35 18.899 -17.187 -5.168 305 H GLY 36 H GLY 36 20.688 -17.205 -2.475 306 HA2 GLY 36 HA2 GLY 36 19.898 -14.500 -2.499 307 HA3 GLY 36 HA3 GLY 36 20.230 -15.017 -0.837 308 H SER 37 H SER 37 21.960 -13.138 -1.804 309 HA SER 37 HA SER 37 24.527 -14.494 -1.983 310 HB2 SER 37 HB2 SER 37 25.132 -13.271 -4.078 311 HB3 SER 37 HB3 SER 37 23.832 -14.440 -4.343 312 HG SER 37 HG SER 37 22.335 -12.609 -4.066 313 H GLY 38 H GLY 38 26.291 -12.567 -2.173 314 HA2 GLY 38 HA2 GLY 38 25.443 -10.407 -0.318 315 HA3 GLY 38 HA3 GLY 38 27.045 -11.125 -0.470 316 H SER 39 H SER 39 27.351 -8.724 -0.461 317 HA SER 39 HA SER 39 27.051 -7.212 -2.938 318 HB2 SER 39 HB2 SER 39 26.732 -6.219 -0.713 319 HB3 SER 39 HB3 SER 39 28.358 -6.709 -0.227 320 HG SER 39 HG SER 39 28.524 -4.642 -0.737 321 H GLY 40 H GLY 40 30.080 -6.500 -1.569 322 HA2 GLY 40 HA2 GLY 40 31.803 -8.430 -2.788 323 HA3 GLY 40 HA3 GLY 40 31.685 -6.920 -3.731 324 H SER 41 H SER 41 34.133 -7.598 -2.475 325 HA SER 41 HA SER 41 34.351 -6.436 0.134 326 HB2 SER 41 HB2 SER 41 35.870 -8.175 -1.002 327 HB3 SER 41 HB3 SER 41 36.631 -6.807 -1.840 328 HG SER 41 HG SER 41 37.013 -5.923 0.289 329 H GLY 42 H GLY 42 34.679 -5.014 -3.133 330 HA2 GLY 42 HA2 GLY 42 34.878 -2.798 -3.759 331 HA3 GLY 42 HA3 GLY 42 34.522 -2.345 -2.077 332 H SER 43 H SER 43 36.226 -0.623 -2.729 333 HA SER 43 HA SER 43 38.679 -1.116 -1.472 334 HB2 SER 43 HB2 SER 43 39.134 -2.239 -3.723 335 HB3 SER 43 HB3 SER 43 38.875 -0.662 -4.491 336 HG SER 43 HG SER 43 41.104 -1.326 -3.890 337 H GLY 44 H GLY 44 40.006 1.062 -1.773 338 HA2 GLY 44 HA2 GLY 44 39.150 3.401 -2.879 339 HA3 GLY 44 HA3 GLY 44 38.203 3.286 -1.379 340 H SER 45 H SER 45 39.954 5.411 -1.517 341 HA SER 45 HA SER 45 41.719 4.928 0.677 342 HB2 SER 45 HB2 SER 45 43.775 5.686 -0.607 343 HB3 SER 45 HB3 SER 45 43.213 4.057 -0.992 344 HG SER 45 HG SER 45 43.615 5.066 -2.909 345 H GLY 46 H GLY 46 42.979 7.141 1.023 346 HA2 GLY 46 HA2 GLY 46 42.693 9.567 0.138 347 HA3 GLY 46 HA3 GLY 46 41.030 9.333 0.720 348 H SER 47 H SER 47 42.632 11.312 1.894 349 HA SER 47 HA SER 47 43.909 10.293 4.282 350 HB2 SER 47 HB2 SER 47 44.504 12.408 2.971 351 HB3 SER 47 HB3 SER 47 43.074 13.160 3.715 352 HG SER 47 HG SER 47 44.042 12.493 5.762 353 H GLY 48 H GLY 48 40.671 10.401 3.587 354 HA2 GLY 48 HA2 GLY 48 39.321 9.634 5.619 355 HA3 GLY 48 HA3 GLY 48 39.809 11.179 6.339 356 H SER 49 H SER 49 37.992 9.723 3.616 357 HA SER 49 HA SER 49 37.027 12.210 2.582 358 HB2 SER 49 HB2 SER 49 37.232 9.902 1.440 359 HB3 SER 49 HB3 SER 49 35.692 9.505 2.235 360 HG SER 49 HG SER 49 34.868 11.442 1.215 361 H GLY 50 H GLY 50 36.274 10.853 5.536 362 HA2 GLY 50 HA2 GLY 50 34.664 11.262 7.097 363 HA3 GLY 50 HA3 GLY 50 34.071 12.567 6.054 364 H SER 51 H SER 51 32.036 11.479 7.265 365 HA SER 51 HA SER 51 30.628 9.986 5.223 366 HB2 SER 51 HB2 SER 51 29.874 8.291 6.975 367 HB3 SER 51 HB3 SER 51 31.516 8.096 6.358 368 HG SER 51 HG SER 51 31.282 7.924 8.661 369 H GLY 52 H GLY 52 28.282 9.677 6.122 370 HA2 GLY 52 HA2 GLY 52 27.192 11.293 8.117 371 HA3 GLY 52 HA3 GLY 52 27.135 12.182 6.577 372 H SER 53 H SER 53 24.786 11.064 7.974 373 HA SER 53 HA SER 53 23.556 9.742 5.783 374 HB2 SER 53 HB2 SER 53 24.459 8.093 8.169 375 HB3 SER 53 HB3 SER 53 22.887 7.748 7.445 376 HG SER 53 HG SER 53 25.405 7.703 6.136 377 H GLY 54 H GLY 54 21.260 9.147 6.423 378 HA2 GLY 54 HA2 GLY 54 19.686 9.642 8.477 379 HA3 GLY 54 HA3 GLY 54 20.129 11.316 8.084 380 H SER 55 H SER 55 17.609 9.481 7.676 381 HA SER 55 HA SER 55 16.619 10.719 5.295 382 HB2 SER 55 HB2 SER 55 17.135 7.706 5.209 383 HB3 SER 55 HB3 SER 55 16.132 8.588 4.046 384 HG SER 55 HG SER 55 18.691 9.583 4.477 385 H GLY 56 H GLY 56 14.264 10.460 5.226 386 HA2 GLY 56 HA2 GLY 56 12.676 8.628 6.430 387 HA3 GLY 56 HA3 GLY 56 13.083 9.716 7.755 388 H SER 57 H SER 57 10.413 9.517 6.934 389 HA SER 57 HA SER 57 9.916 12.253 6.099 390 HB2 SER 57 HB2 SER 57 10.008 11.038 3.921 391 HB3 SER 57 HB3 SER 57 8.700 9.974 4.474 392 HG SER 57 HG SER 57 7.606 11.604 3.503 393 H GLY 58 H GLY 58 7.421 9.764 5.891 394 HA2 GLY 58 HA2 GLY 58 6.561 9.275 8.428 395 HA3 GLY 58 HA3 GLY 58 5.934 10.902 8.106 396 H TYR 59 H TYR 59 4.982 11.116 5.749 397 HA TYR 59 HA TYR 59 2.837 9.180 5.541 398 HB2 TYR 59 HB2 TYR 59 3.648 11.635 3.957 399 HB3 TYR 59 HB3 TYR 59 2.348 10.604 3.382 400 HD1 TYR 59 HD1 TYR 59 0.585 9.844 5.253 401 HD2 TYR 59 HD2 TYR 59 2.961 13.456 5.340 402 HE1 TYR 59 HE1 TYR 59 -0.886 10.770 7.007 403 HE2 TYR 59 HE2 TYR 59 1.427 14.421 7.019 404 HH TYR 59 HH TYR 59 -0.687 14.034 8.225 405 H GLN3288 H GLN3288 2.327 8.590 3.016 406 HA GLN3288 HA GLN3288 4.012 6.382 2.498 407 HB2 GLN3288 HB2 GLN3288 2.648 5.992 0.572 408 HB3 GLN3288 HB3 GLN3288 1.598 6.622 1.833 409 HG2 GLN3288 HG2 GLN3288 1.919 8.940 0.713 410 HG3 GLN3288 HG3 GLN3288 2.638 8.066 -0.642 411 HE21 GLN3288 HE21 GLN3288 1.211 6.602 -1.942 412 HE22 GLN3288 HE22 GLN3288 -0.512 6.868 -1.822 413 H ILE3289 H ILE3289 5.215 5.976 0.449 414 HA ILE3289 HA ILE3289 6.999 8.239 -0.069 415 HB ILE3289 HB ILE3289 7.303 5.344 -0.930 416 HG12 ILE3289 HG12 ILE3289 8.755 6.602 1.424 417 HG13 ILE3289 HG13 ILE3289 7.241 5.745 1.675 418 HG21 ILE3289 HG21 ILE3289 9.709 6.117 -1.130 419 HG22 ILE3289 HG22 ILE3289 8.613 6.962 -2.219 420 HG23 ILE3289 HG23 ILE3289 9.164 7.756 -0.731 421 HD11 ILE3289 HD11 ILE3289 8.115 3.687 0.785 422 HD12 ILE3289 HD12 ILE3289 9.665 4.452 0.376 423 HD13 ILE3289 HD13 ILE3289 9.172 4.273 2.064 424 H GLU3290 H GLU3290 6.007 9.577 -1.538 425 HA GLU3290 HA GLU3290 4.389 8.545 -3.698 426 HB2 GLU3290 HB2 GLU3290 4.190 10.754 -2.449 427 HB3 GLU3290 HB3 GLU3290 5.557 11.346 -3.405 428 HG2 GLU3290 HG2 GLU3290 4.306 11.053 -5.463 429 HG3 GLU3290 HG3 GLU3290 3.017 10.176 -4.628 430 H THR3291 H THR3291 7.711 8.723 -3.235 431 HA THR3291 HA THR3291 8.311 8.488 -6.138 432 HB THR3291 HB THR3291 8.986 10.553 -5.105 433 HG1 THR3291 HG1 THR3291 10.244 10.043 -6.748 434 HG21 THR3291 HG21 THR3291 10.917 9.037 -3.335 435 HG22 THR3291 HG22 THR3291 9.402 9.801 -2.792 436 HG23 THR3291 HG23 THR3291 10.688 10.784 -3.476 437 H PHE3292 H PHE3292 7.547 6.185 -5.301 438 HA PHE3292 HA PHE3292 9.902 4.546 -5.408 439 HB2 PHE3292 HB2 PHE3292 9.963 4.962 -2.999 440 HB3 PHE3292 HB3 PHE3292 8.265 4.481 -2.844 441 HD1 PHE3292 HD1 PHE3292 10.825 2.613 -4.908 442 HD2 PHE3292 HD2 PHE3292 8.621 2.774 -1.213 443 HE1 PHE3292 HE1 PHE3292 11.528 0.331 -4.396 444 HE2 PHE3292 HE2 PHE3292 9.292 0.428 -0.719 445 HZ PHE3292 HZ PHE3292 10.736 -0.808 -2.331 446 H PHE3293 H PHE3293 6.443 4.572 -4.453 447 HA PHE3293 HA PHE3293 5.972 2.363 -6.388 448 HB2 PHE3293 HB2 PHE3293 4.411 1.393 -4.583 449 HB3 PHE3293 HB3 PHE3293 6.126 1.165 -4.436 450 HD1 PHE3293 HD1 PHE3293 6.613 0.944 -2.184 451 HD2 PHE3293 HD2 PHE3293 4.012 4.161 -3.416 452 HE1 PHE3293 HE1 PHE3293 6.639 1.862 0.107 453 HE2 PHE3293 HE2 PHE3293 4.073 5.077 -1.169 454 HZ PHE3293 HZ PHE3293 5.358 3.923 0.650 455 H ALA3294 H ALA3294 5.297 5.483 -6.132 456 HA ALA3294 HA ALA3294 2.519 5.684 -5.886 457 HB1 ALA3294 HB1 ALA3294 4.410 7.265 -7.664 458 HB2 ALA3294 HB2 ALA3294 2.741 7.736 -7.302 459 HB3 ALA3294 HB3 ALA3294 3.930 7.630 -5.992 460 H GLN3295 H GLN3295 4.343 4.435 -8.552 461 HA GLN3295 HA GLN3295 2.221 4.453 -10.517 462 HB2 GLN3295 HB2 GLN3295 4.754 2.733 -10.334 463 HB3 GLN3295 HB3 GLN3295 3.759 2.995 -11.766 464 HG2 GLN3295 HG2 GLN3295 5.496 5.024 -10.353 465 HG3 GLN3295 HG3 GLN3295 5.708 4.363 -11.977 466 HE21 GLN3295 HE21 GLN3295 4.771 7.179 -10.482 467 HE22 GLN3295 HE22 GLN3295 3.412 7.653 -11.462 468 H ASP3296 H ASP3296 3.411 2.093 -8.119 469 HA ASP3296 HA ASP3296 1.578 0.011 -9.043 470 HB2 ASP3296 HB2 ASP3296 3.299 0.234 -6.543 471 HB3 ASP3296 HB3 ASP3296 2.326 -1.183 -6.949 472 H ILE3297 H ILE3297 1.550 2.582 -6.750 473 HA ILE3297 HA ILE3297 -0.492 1.656 -4.959 474 HB ILE3297 HB ILE3297 0.945 4.192 -5.617 475 HG12 ILE3297 HG12 ILE3297 1.608 4.246 -3.410 476 HG13 ILE3297 HG13 ILE3297 0.137 3.471 -2.852 477 HG21 ILE3297 HG21 ILE3297 -1.740 4.310 -4.223 478 HG22 ILE3297 HG22 ILE3297 -0.514 5.614 -4.206 479 HG23 ILE3297 HG23 ILE3297 -1.252 5.108 -5.736 480 HD11 ILE3297 HD11 ILE3297 2.260 2.110 -2.588 481 HD12 ILE3297 HD12 ILE3297 0.943 1.267 -3.415 482 HD13 ILE3297 HD13 ILE3297 2.287 1.918 -4.338 483 H GLU3298 H GLU3298 -0.561 3.636 -7.910 484 HA GLU3298 HA GLU3298 -3.421 3.973 -7.815 485 HB2 GLU3298 HB2 GLU3298 -3.243 4.843 -10.031 486 HB3 GLU3298 HB3 GLU3298 -2.090 5.586 -8.934 487 HG2 GLU3298 HG2 GLU3298 -0.242 4.739 -9.996 488 HG3 GLU3298 HG3 GLU3298 -1.063 3.286 -10.550 489 H SER3299 H SER3299 -1.313 1.588 -9.033 490 HA SER3299 HA SER3299 -3.113 0.130 -10.756 491 HB2 SER3299 HB2 SER3299 -0.598 0.151 -10.848 492 HB3 SER3299 HB3 SER3299 -0.572 -0.822 -9.379 493 HG SER3299 HG SER3299 -0.331 -2.022 -11.213 494 H VAL3300 H VAL3300 -2.006 -0.393 -7.353 495 HA VAL3300 HA VAL3300 -3.709 -2.723 -7.064 496 HB VAL3300 HB VAL3300 -1.509 -2.359 -5.902 497 HG11 VAL3300 HG11 VAL3300 -1.888 -0.021 -5.142 498 HG12 VAL3300 HG12 VAL3300 -3.077 -0.611 -3.957 499 HG13 VAL3300 HG13 VAL3300 -1.379 -1.100 -3.862 500 HG21 VAL3300 HG21 VAL3300 -3.935 -3.070 -4.226 501 HG22 VAL3300 HG22 VAL3300 -2.979 -4.152 -5.250 502 HG23 VAL3300 HG23 VAL3300 -2.238 -3.450 -3.801 503 H GLN3301 H GLN3301 -3.942 0.785 -6.118 504 HA GLN3301 HA GLN3301 -6.403 0.376 -4.754 505 HB2 GLN3301 HB2 GLN3301 -6.700 2.631 -4.623 506 HB3 GLN3301 HB3 GLN3301 -4.961 2.342 -4.465 507 HG2 GLN3301 HG2 GLN3301 -4.639 3.920 -6.010 508 HG3 GLN3301 HG3 GLN3301 -5.380 2.827 -7.208 509 HE21 GLN3301 HE21 GLN3301 -7.841 2.976 -7.368 510 HE22 GLN3301 HE22 GLN3301 -8.532 4.544 -7.272 511 H LYS3302 H LYS3302 -5.682 0.604 -8.168 512 HA LYS3302 HA LYS3302 -8.244 1.213 -9.183 513 HB2 LYS3302 HB2 LYS3302 -5.781 -0.023 -10.218 514 HB3 LYS3302 HB3 LYS3302 -7.260 -0.536 -11.023 515 HG2 LYS3302 HG2 LYS3302 -7.799 1.695 -11.687 516 HG3 LYS3302 HG3 LYS3302 -6.588 2.373 -10.588 517 HD2 LYS3302 HD2 LYS3302 -5.801 2.406 -12.944 518 HD3 LYS3302 HD3 LYS3302 -4.765 1.434 -11.883 519 HE2 LYS3302 HE2 LYS3302 -6.075 -0.621 -12.638 520 HE3 LYS3302 HE3 LYS3302 -6.865 0.416 -13.843 521 HZ1 LYS3302 HZ1 LYS3302 -4.861 0.674 -14.948 522 HZ2 LYS3302 HZ2 LYS3302 -4.861 -0.921 -14.523 523 HZ3 LYS3302 HZ3 LYS3302 -3.935 0.164 -13.700 524 H GLU3303 H GLU3303 -7.043 -1.686 -7.650 525 HA GLU3303 HA GLU3303 -9.259 -3.346 -8.695 526 HB2 GLU3303 HB2 GLU3303 -8.244 -5.145 -7.793 527 HB3 GLU3303 HB3 GLU3303 -6.853 -4.087 -8.009 528 HG2 GLU3303 HG2 GLU3303 -7.471 -3.358 -5.514 529 HG3 GLU3303 HG3 GLU3303 -8.348 -4.861 -5.501 530 H LEU3304 H LEU3304 -8.558 -1.489 -5.788 531 HA LEU3304 HA LEU3304 -10.921 -2.235 -4.348 532 HB2 LEU3304 HB2 LEU3304 -9.004 0.134 -4.076 533 HB3 LEU3304 HB3 LEU3304 -10.175 -0.380 -2.885 534 HG LEU3304 HG LEU3304 -7.752 -1.973 -3.828 535 HD11 LEU3304 HD11 LEU3304 -7.029 -1.573 -1.437 536 HD12 LEU3304 HD12 LEU3304 -8.307 -0.340 -1.370 537 HD13 LEU3304 HD13 LEU3304 -6.998 -0.214 -2.562 538 HD21 LEU3304 HD21 LEU3304 -8.293 -3.533 -1.972 539 HD22 LEU3304 HD22 LEU3304 -9.509 -3.529 -3.245 540 HD23 LEU3304 HD23 LEU3304 -9.822 -2.653 -1.723 541 H GLU3305 H GLU3305 -10.234 0.580 -6.459 542 HA GLU3305 HA GLU3305 -12.285 2.266 -5.544 543 HB2 GLU3305 HB2 GLU3305 -12.019 3.431 -7.725 544 HB3 GLU3305 HB3 GLU3305 -10.471 3.066 -6.924 545 HG2 GLU3305 HG2 GLU3305 -10.186 1.076 -8.266 546 HG3 GLU3305 HG3 GLU3305 -11.752 1.324 -9.061 547 H ASN3306 H ASN3306 -12.670 -0.687 -7.280 548 HA ASN3306 HA ASN3306 -15.423 0.173 -8.007 549 HB2 ASN3306 HB2 ASN3306 -15.531 -1.480 -9.661 550 HB3 ASN3306 HB3 ASN3306 -14.049 -0.556 -9.919 551 HD21 ASN3306 HD21 ASN3306 -12.027 -1.567 -9.648 552 HD22 ASN3306 HD22 ASN3306 -11.877 -3.277 -9.325 553 H LEU3307 H LEU3307 -13.833 -1.515 -5.531 554 HA LEU3307 HA LEU3307 -15.813 -3.658 -5.270 555 HB2 LEU3307 HB2 LEU3307 -13.392 -2.677 -3.815 556 HB3 LEU3307 HB3 LEU3307 -14.639 -3.290 -2.798 557 HG LEU3307 HG LEU3307 -13.624 -5.233 -2.978 558 HD11 LEU3307 HD11 LEU3307 -14.598 -5.404 -5.850 559 HD12 LEU3307 HD12 LEU3307 -15.630 -5.698 -4.425 560 HD13 LEU3307 HD13 LEU3307 -14.253 -6.749 -4.729 561 HD21 LEU3307 HD21 LEU3307 -11.654 -4.282 -3.913 562 HD22 LEU3307 HD22 LEU3307 -12.376 -4.403 -5.542 563 HD23 LEU3307 HD23 LEU3307 -11.991 -5.870 -4.607 564 H SER3308 H SER3308 -17.230 -3.873 -3.391 565 HA SER3308 HA SER3308 -18.802 -1.429 -2.927 566 HB2 SER3308 HB2 SER3308 -19.239 -4.293 -2.010 567 HB3 SER3308 HB3 SER3308 -20.430 -2.986 -2.014 568 HG SER3308 HG SER3308 -19.399 -4.571 -4.065 569 H GLU3309 H GLU3309 -19.622 -1.128 -0.517 570 HA GLU3309 HA GLU3309 -17.349 -0.640 1.162 571 HB2 GLU3309 HB2 GLU3309 -20.372 -0.726 1.661 572 HB3 GLU3309 HB3 GLU3309 -19.248 -0.746 3.015 573 HG2 GLU3309 HG2 GLU3309 -18.191 1.352 1.918 574 HG3 GLU3309 HG3 GLU3309 -19.731 1.439 1.047 575 H GLU3310 H GLU3310 -19.846 -3.298 1.324 576 HA GLU3310 HA GLU3310 -18.819 -4.643 3.474 577 HB2 GLU3310 HB2 GLU3310 -19.886 -6.638 2.479 578 HB3 GLU3310 HB3 GLU3310 -20.873 -5.197 2.206 579 HG2 GLU3310 HG2 GLU3310 -19.664 -5.004 -0.062 580 HG3 GLU3310 HG3 GLU3310 -19.027 -6.607 0.239 581 H GLU3311 H GLU3311 -17.202 -4.353 0.363 582 HA GLU3311 HA GLU3311 -15.538 -6.737 0.778 583 HB2 GLU3311 HB2 GLU3311 -15.320 -4.543 -1.251 584 HB3 GLU3311 HB3 GLU3311 -14.611 -6.141 -1.374 585 HG2 GLU3311 HG2 GLU3311 -17.637 -5.718 -1.295 586 HG3 GLU3311 HG3 GLU3311 -16.750 -5.445 -2.702 587 H LEU3312 H LEU3312 -15.268 -3.226 0.504 588 HA LEU3312 HA LEU3312 -12.513 -3.117 1.335 589 HB2 LEU3312 HB2 LEU3312 -14.429 -0.768 1.284 590 HB3 LEU3312 HB3 LEU3312 -12.721 -0.693 1.121 591 HG LEU3312 HG LEU3312 -14.309 -2.234 -0.951 592 HD11 LEU3312 HD11 LEU3312 -14.053 0.754 -0.833 593 HD12 LEU3312 HD12 LEU3312 -15.512 -0.294 -0.840 594 HD13 LEU3312 HD13 LEU3312 -14.489 -0.199 -2.275 595 HD21 LEU3312 HD21 LEU3312 -11.590 -0.950 -0.860 596 HD22 LEU3312 HD22 LEU3312 -12.388 -1.443 -2.362 597 HD23 LEU3312 HD23 LEU3312 -12.037 -2.643 -1.111 598 H LEU3313 H LEU3313 -15.487 -1.931 2.805 599 HA LEU3313 HA LEU3313 -14.614 -0.858 5.208 600 HB2 LEU3313 HB2 LEU3313 -16.811 -0.446 4.219 601 HB3 LEU3313 HB3 LEU3313 -17.248 -2.146 4.449 602 HG LEU3313 HG LEU3313 -18.255 -0.548 6.021 603 HD11 LEU3313 HD11 LEU3313 -18.396 -2.118 7.811 604 HD12 LEU3313 HD12 LEU3313 -16.906 -2.930 7.290 605 HD13 LEU3313 HD13 LEU3313 -18.362 -2.986 6.275 606 HD21 LEU3313 HD21 LEU3313 -17.168 -0.023 8.108 607 HD22 LEU3313 HD22 LEU3313 -16.333 0.757 6.766 608 HD23 LEU3313 HD23 LEU3313 -15.642 -0.698 7.525 609 H ALA3314 H ALA3314 -15.529 -4.240 4.289 610 HA ALA3314 HA ALA3314 -15.286 -5.163 6.949 611 HB1 ALA3314 HB1 ALA3314 -15.322 -7.388 5.930 612 HB2 ALA3314 HB2 ALA3314 -16.545 -6.319 5.216 613 HB3 ALA3314 HB3 ALA3314 -15.073 -6.648 4.296 614 H MET3315 H MET3315 -12.819 -4.521 4.484 615 HA MET3315 HA MET3315 -10.795 -6.238 5.738 616 HB2 MET3315 HB2 MET3315 -10.155 -3.886 3.910 617 HB3 MET3315 HB3 MET3315 -9.221 -5.340 4.208 618 HG2 MET3315 HG2 MET3315 -11.812 -6.047 3.164 619 HG3 MET3315 HG3 MET3315 -11.147 -4.749 2.194 620 HE1 MET3315 HE1 MET3315 -10.864 -5.875 -0.067 621 HE2 MET3315 HE2 MET3315 -10.360 -7.572 -0.242 622 HE3 MET3315 HE3 MET3315 -11.823 -7.164 0.684 623 H LEU3316 H LEU3316 -11.234 -2.724 5.388 624 HA LEU3316 HA LEU3316 -9.161 -1.950 7.177 625 HB2 LEU3316 HB2 LEU3316 -10.279 0.251 7.234 626 HB3 LEU3316 HB3 LEU3316 -9.969 -0.382 5.634 627 HG LEU3316 HG LEU3316 -12.511 -1.252 5.911 628 HD11 LEU3316 HD11 LEU3316 -12.405 1.294 7.609 629 HD12 LEU3316 HD12 LEU3316 -12.993 -0.294 8.141 630 HD13 LEU3316 HD13 LEU3316 -13.882 0.614 6.931 631 HD21 LEU3316 HD21 LEU3316 -11.406 0.450 4.258 632 HD22 LEU3316 HD22 LEU3316 -12.238 1.665 5.273 633 HD23 LEU3316 HD23 LEU3316 -13.129 0.387 4.427 634 H ASN3317 H ASN3317 -12.580 -2.736 7.761 635 HA ASN3317 HA ASN3317 -12.360 -1.946 10.583 636 HB2 ASN3317 HB2 ASN3317 -14.514 -1.980 9.042 637 HB3 ASN3317 HB3 ASN3317 -14.602 -3.678 9.512 638 HD21 ASN3317 HD21 ASN3317 -14.609 -0.332 10.576 639 HD22 ASN3317 HD22 ASN3317 -15.508 -0.633 12.078 640 H GLY3318 H GLY3318 -12.018 -4.829 8.669 641 HA2 GLY3318 HA2 GLY3318 -11.074 -6.867 9.115 642 HA3 GLY3318 HA3 GLY3318 -10.763 -6.357 10.791 643 H ASP3319 H ASP3319 -13.745 -6.769 8.770 644 HA ASP3319 HA ASP3319 -14.783 -8.727 10.726 645 HB2 ASP3319 HB2 ASP3319 -15.523 -6.108 10.961 646 HB3 ASP3319 HB3 ASP3319 -16.751 -6.651 9.865 647 H GLN3320 H GLN3320 -17.515 -8.475 9.354 648 HA GLN3320 HA GLN3320 -17.021 -9.470 6.668 649 HB2 GLN3320 HB2 GLN3320 -18.280 -11.531 7.112 650 HB3 GLN3320 HB3 GLN3320 -16.835 -11.440 8.117 651 HG2 GLN3320 HG2 GLN3320 -18.110 -10.822 10.078 652 HG3 GLN3320 HG3 GLN3320 -19.596 -10.701 9.135 653 HE21 GLN3320 HE21 GLN3320 -20.640 -12.674 8.375 654 HE22 GLN3320 HE22 GLN3320 -20.263 -14.191 9.200 655 H GLN3321 H GLN3321 -18.160 -7.034 7.745 656 HA GLN3321 HA GLN3321 -21.048 -7.350 7.462 657 HB2 GLN3321 HB2 GLN3321 -19.238 -4.944 7.843 658 HB3 GLN3321 HB3 GLN3321 -20.901 -4.726 7.312 659 HG2 GLN3321 HG2 GLN3321 -20.065 -6.139 9.868 660 HG3 GLN3321 HG3 GLN3321 -20.729 -4.503 9.753 661 HE21 GLN3321 HE21 GLN3321 -21.591 -7.666 10.420 662 HE22 GLN3321 HE22 GLN3321 -23.293 -7.607 9.999 Start of MODEL 5 1 H1 MET 1 H MET 1 -30.258 8.468 -0.022 2 HA MET 1 HA MET 1 -30.604 10.367 -2.250 3 HB2 MET 1 HB2 MET 1 -30.726 11.396 0.574 4 HB3 MET 1 HB3 MET 1 -31.327 12.088 -0.923 5 HG2 MET 1 HG2 MET 1 -33.073 10.306 -0.992 6 HG3 MET 1 HG3 MET 1 -32.474 9.735 0.583 7 HE1 MET 1 HE1 MET 1 -34.948 9.897 1.579 8 HE2 MET 1 HE2 MET 1 -35.939 11.372 1.495 9 HE3 MET 1 HE3 MET 1 -35.545 10.486 0.006 10 H ASN 2 H ASN 2 -28.712 9.604 0.786 11 HA ASN 2 HA ASN 2 -26.725 11.554 -0.004 12 HB2 ASN 2 HB2 ASN 2 -26.843 9.474 2.228 13 HB3 ASN 2 HB3 ASN 2 -25.391 10.397 1.878 14 HD21 ASN 2 HD21 ASN 2 -28.814 10.771 2.890 15 HD22 ASN 2 HD22 ASN 2 -28.554 12.350 3.636 16 H ILE 3 H ILE 3 -25.202 11.127 -1.521 17 HA ILE 3 HA ILE 3 -25.005 8.726 -2.987 18 HB ILE 3 HB ILE 3 -24.302 11.068 -3.633 19 HG12 ILE 3 HG12 ILE 3 -22.311 8.895 -4.292 20 HG13 ILE 3 HG13 ILE 3 -23.952 9.050 -4.953 21 HG21 ILE 3 HG21 ILE 3 -22.891 11.660 -1.732 22 HG22 ILE 3 HG22 ILE 3 -21.761 10.379 -2.083 23 HG23 ILE 3 HG23 ILE 3 -21.954 11.756 -3.196 24 HD11 ILE 3 HD11 ILE 3 -21.793 11.116 -5.350 25 HD12 ILE 3 HD12 ILE 3 -22.351 9.927 -6.531 26 HD13 ILE 3 HD13 ILE 3 -23.459 11.191 -5.954 27 H ASN 4 H ASN 4 -23.998 6.908 -2.861 28 HA ASN 4 HA ASN 4 -22.359 6.355 -0.430 29 HB2 ASN 4 HB2 ASN 4 -22.849 4.006 -0.854 30 HB3 ASN 4 HB3 ASN 4 -24.306 4.950 -0.571 31 HD21 ASN 4 HD21 ASN 4 -22.408 3.251 -3.121 32 HD22 ASN 4 HD22 ASN 4 -23.622 3.512 -4.366 33 H GLU 5 H GLU 5 -22.428 6.129 -3.964 34 HA GLU 5 HA GLU 5 -20.020 4.730 -4.419 35 HB2 GLU 5 HB2 GLU 5 -21.417 6.866 -6.045 36 HB3 GLU 5 HB3 GLU 5 -19.896 6.123 -6.571 37 HG2 GLU 5 HG2 GLU 5 -20.926 3.862 -6.362 38 HG3 GLU 5 HG3 GLU 5 -22.467 4.612 -5.929 39 H GLN 6 H GLN 6 -20.538 8.119 -3.841 40 HA GLN 6 HA GLN 6 -17.794 8.967 -4.055 41 HB2 GLN 6 HB2 GLN 6 -20.332 10.183 -3.693 42 HB3 GLN 6 HB3 GLN 6 -19.404 10.633 -2.259 43 HG2 GLN 6 HG2 GLN 6 -18.910 12.343 -3.661 44 HG3 GLN 6 HG3 GLN 6 -17.574 11.261 -4.068 45 HE21 GLN 6 HE21 GLN 6 -19.014 13.377 -5.653 46 HE22 GLN 6 HE22 GLN 6 -19.428 12.526 -7.115 47 H THR 7 H THR 7 -19.781 7.621 -1.400 48 HA THR 7 HA THR 7 -17.900 8.401 0.628 49 HB THR 7 HB THR 7 -19.986 6.213 0.679 50 HG1 THR 7 HG1 THR 7 -21.279 7.784 1.623 51 HG21 THR 7 HG21 THR 7 -18.310 7.569 2.816 52 HG22 THR 7 HG22 THR 7 -18.453 5.847 2.427 53 HG23 THR 7 HG23 THR 7 -19.819 6.673 3.196 54 H LEU 8 H LEU 8 -18.305 5.453 -1.409 55 HA LEU 8 HA LEU 8 -16.659 3.607 -0.097 56 HB2 LEU 8 HB2 LEU 8 -16.287 4.105 -3.060 57 HB3 LEU 8 HB3 LEU 8 -16.254 2.612 -2.144 58 HG LEU 8 HG LEU 8 -18.682 4.282 -2.932 59 HD11 LEU 8 HD11 LEU 8 -17.521 2.949 -4.758 60 HD12 LEU 8 HD12 LEU 8 -19.211 2.511 -4.480 61 HD13 LEU 8 HD13 LEU 8 -17.927 1.480 -3.835 62 HD21 LEU 8 HD21 LEU 8 -19.265 3.233 -0.865 63 HD22 LEU 8 HD22 LEU 8 -18.584 1.679 -1.405 64 HD23 LEU 8 HD23 LEU 8 -20.044 2.347 -2.169 65 H ASP 9 H ASP 9 -15.802 6.498 -1.931 66 HA ASP 9 HA ASP 9 -13.079 6.150 -2.462 67 HB2 ASP 9 HB2 ASP 9 -14.333 8.070 -3.237 68 HB3 ASP 9 HB3 ASP 9 -14.512 8.635 -1.578 69 H LYS 10 H LYS 10 -14.552 7.446 0.597 70 HA LYS 10 HA LYS 10 -11.954 7.761 1.790 71 HB2 LYS 10 HB2 LYS 10 -12.965 8.346 3.800 72 HB3 LYS 10 HB3 LYS 10 -14.074 8.921 2.557 73 HG2 LYS 10 HG2 LYS 10 -15.520 7.027 2.908 74 HG3 LYS 10 HG3 LYS 10 -14.421 6.317 4.096 75 HD2 LYS 10 HD2 LYS 10 -15.218 9.065 4.707 76 HD3 LYS 10 HD3 LYS 10 -16.593 7.958 4.521 77 HE2 LYS 10 HE2 LYS 10 -14.170 7.134 6.134 78 HE3 LYS 10 HE3 LYS 10 -15.368 8.199 6.880 79 HZ1 LYS 10 HZ1 LYS 10 -16.174 5.655 5.617 80 HZ2 LYS 10 HZ2 LYS 10 -17.011 6.591 6.691 81 HZ3 LYS 10 HZ3 LYS 10 -15.696 5.733 7.179 82 H LEU 11 H LEU 11 -14.068 5.035 1.411 83 HA LEU 11 HA LEU 11 -12.888 3.378 3.519 84 HB2 LEU 11 HB2 LEU 11 -14.855 2.737 1.256 85 HB3 LEU 11 HB3 LEU 11 -14.144 1.565 2.358 86 HG LEU 11 HG LEU 11 -16.262 1.912 3.066 87 HD11 LEU 11 HD11 LEU 11 -14.503 3.454 4.994 88 HD12 LEU 11 HD12 LEU 11 -14.907 1.705 4.950 89 HD13 LEU 11 HD13 LEU 11 -16.148 2.879 5.329 90 HD21 LEU 11 HD21 LEU 11 -17.314 4.048 3.647 91 HD22 LEU 11 HD22 LEU 11 -16.813 4.011 1.964 92 HD23 LEU 11 HD23 LEU 11 -15.841 4.900 3.126 93 H ARG 12 H ARG 12 -12.799 3.390 -0.101 94 HA ARG 12 HA ARG 12 -10.906 1.284 -0.245 95 HB2 ARG 12 HB2 ARG 12 -10.414 2.154 -2.562 96 HB3 ARG 12 HB3 ARG 12 -12.084 1.764 -2.231 97 HG2 ARG 12 HG2 ARG 12 -12.718 4.027 -2.142 98 HG3 ARG 12 HG3 ARG 12 -11.035 4.612 -1.990 99 HD2 ARG 12 HD2 ARG 12 -10.900 3.334 -4.321 100 HD3 ARG 12 HD3 ARG 12 -12.662 3.759 -4.241 101 HE ARG 12 HE ARG 12 -12.163 5.914 -4.713 102 HH11 ARG 12 HH11 ARG 12 -9.116 4.176 -4.301 103 HH12 ARG 12 HH12 ARG 12 -8.132 5.623 -4.354 104 HH21 ARG 12 HH21 ARG 12 -10.826 7.817 -4.823 105 HH22 ARG 12 HH22 ARG 12 -9.142 7.593 -5.174 106 H GLN 13 H GLN 13 -10.344 4.823 -0.118 107 HA GLN 13 HA GLN 13 -7.573 4.533 -0.436 108 HB2 GLN 13 HB2 GLN 13 -7.392 6.808 0.141 109 HB3 GLN 13 HB3 GLN 13 -8.847 6.576 -0.799 110 HG2 GLN 13 HG2 GLN 13 -9.702 7.921 0.858 111 HG3 GLN 13 HG3 GLN 13 -10.034 6.345 1.512 112 HE21 GLN 13 HE21 GLN 13 -9.928 6.649 3.692 113 HE22 GLN 13 HE22 GLN 13 -8.501 7.233 4.545 114 H ALA 14 H ALA 14 -9.667 4.105 2.419 115 HA ALA 14 HA ALA 14 -7.550 4.093 4.373 116 HB1 ALA 14 HB1 ALA 14 -10.424 3.048 4.371 117 HB2 ALA 14 HB2 ALA 14 -9.363 3.016 5.774 118 HB3 ALA 14 HB3 ALA 14 -9.834 4.567 5.061 119 H VAL 15 H VAL 15 -9.181 1.588 2.337 120 HA VAL 15 HA VAL 15 -7.895 -0.614 3.668 121 HB VAL 15 HB VAL 15 -9.199 -0.384 0.950 122 HG11 VAL 15 HG11 VAL 15 -8.435 -2.921 2.475 123 HG12 VAL 15 HG12 VAL 15 -9.360 -2.859 0.965 124 HG13 VAL 15 HG13 VAL 15 -7.669 -2.363 0.978 125 HG21 VAL 15 HG21 VAL 15 -10.971 -1.730 2.143 126 HG22 VAL 15 HG22 VAL 15 -10.227 -1.209 3.663 127 HG23 VAL 15 HG23 VAL 15 -10.899 -0.033 2.515 128 H LEU 16 H LEU 16 -7.282 1.061 0.493 129 HA LEU 16 HA LEU 16 -4.956 -0.427 -0.062 130 HB2 LEU 16 HB2 LEU 16 -4.327 1.132 -1.688 131 HB3 LEU 16 HB3 LEU 16 -6.055 0.897 -1.721 132 HG LEU 16 HG LEU 16 -5.977 3.107 -0.186 133 HD11 LEU 16 HD11 LEU 16 -3.559 3.386 -2.018 134 HD12 LEU 16 HD12 LEU 16 -3.501 3.292 -0.247 135 HD13 LEU 16 HD13 LEU 16 -4.277 4.672 -1.028 136 HD21 LEU 16 HD21 LEU 16 -5.813 2.953 -3.213 137 HD22 LEU 16 HD22 LEU 16 -6.358 4.395 -2.351 138 HD23 LEU 16 HD23 LEU 16 -7.305 2.898 -2.258 139 H GLN 17 H GLN 17 -5.307 2.356 2.162 140 HA GLN 17 HA GLN 17 -2.561 2.860 2.455 141 HB2 GLN 17 HB2 GLN 17 -4.958 3.237 4.238 142 HB3 GLN 17 HB3 GLN 17 -3.339 3.364 4.951 143 HG2 GLN 17 HG2 GLN 17 -2.696 4.989 3.211 144 HG3 GLN 17 HG3 GLN 17 -4.312 4.900 2.527 145 HE21 GLN 17 HE21 GLN 17 -5.568 6.736 3.182 146 HE22 GLN 17 HE22 GLN 17 -5.274 7.598 4.652 147 H LYS 18 H LYS 18 -4.549 0.303 4.253 148 HA LYS 18 HA LYS 18 -2.182 -0.535 5.639 149 HB2 LYS 18 HB2 LYS 18 -3.264 -2.428 6.392 150 HB3 LYS 18 HB3 LYS 18 -4.420 -1.113 6.430 151 HG2 LYS 18 HG2 LYS 18 -4.691 -2.526 3.896 152 HG3 LYS 18 HG3 LYS 18 -4.598 -3.717 5.158 153 HD2 LYS 18 HD2 LYS 18 -6.462 -1.337 5.524 154 HD3 LYS 18 HD3 LYS 18 -6.866 -2.602 4.363 155 HE2 LYS 18 HE2 LYS 18 -7.884 -3.139 6.453 156 HE3 LYS 18 HE3 LYS 18 -6.648 -4.323 5.979 157 HZ1 LYS 18 HZ1 LYS 18 -5.223 -3.573 7.659 158 HZ2 LYS 18 HZ2 LYS 18 -6.666 -3.790 8.329 159 HZ3 LYS 18 HZ3 LYS 18 -6.146 -2.258 8.054 160 H LYS 19 H LYS 19 -3.528 -1.557 2.476 161 HA LYS 19 HA LYS 19 -1.860 -3.731 1.971 162 HB2 LYS 19 HB2 LYS 19 -2.974 -1.667 0.026 163 HB3 LYS 19 HB3 LYS 19 -2.076 -3.084 -0.470 164 HG2 LYS 19 HG2 LYS 19 -3.702 -4.540 0.695 165 HG3 LYS 19 HG3 LYS 19 -4.645 -3.129 1.187 166 HD2 LYS 19 HD2 LYS 19 -5.283 -2.636 -1.102 167 HD3 LYS 19 HD3 LYS 19 -4.132 -3.811 -1.746 168 HE2 LYS 19 HE2 LYS 19 -6.413 -4.605 0.102 169 HE3 LYS 19 HE3 LYS 19 -6.586 -4.506 -1.667 170 HZ1 LYS 19 HZ1 LYS 19 -4.822 -6.342 -0.188 171 HZ2 LYS 19 HZ2 LYS 19 -4.729 -6.122 -1.817 172 HZ3 LYS 19 HZ3 LYS 19 -6.107 -6.695 -1.173 173 H ILE 20 H ILE 20 -1.077 -0.231 1.620 174 HA ILE 20 HA ILE 20 1.406 -0.675 0.384 175 HB ILE 20 HB ILE 20 0.876 1.649 2.252 176 HG12 ILE 20 HG12 ILE 20 -1.013 1.876 0.970 177 HG13 ILE 20 HG13 ILE 20 0.123 2.862 0.099 178 HG21 ILE 20 HG21 ILE 20 2.353 2.862 0.621 179 HG22 ILE 20 HG22 ILE 20 3.164 1.530 1.446 180 HG23 ILE 20 HG23 ILE 20 2.622 1.325 -0.224 181 HD11 ILE 20 HD11 ILE 20 0.468 0.740 -1.404 182 HD12 ILE 20 HD12 ILE 20 -1.049 0.184 -0.716 183 HD13 ILE 20 HD13 ILE 20 -1.022 1.707 -1.591 184 H LYS 21 H LYS 21 0.531 -0.718 3.826 185 HA LYS 21 HA LYS 21 3.251 -0.931 4.859 186 HB2 LYS 21 HB2 LYS 21 0.736 -1.877 6.269 187 HB3 LYS 21 HB3 LYS 21 2.234 -1.276 6.963 188 HG2 LYS 21 HG2 LYS 21 1.668 1.027 6.036 189 HG3 LYS 21 HG3 LYS 21 0.122 0.351 5.495 190 HD2 LYS 21 HD2 LYS 21 -0.068 -0.447 8.011 191 HD3 LYS 21 HD3 LYS 21 1.067 0.878 8.298 192 HE2 LYS 21 HE2 LYS 21 -1.573 1.152 6.800 193 HE3 LYS 21 HE3 LYS 21 -1.430 1.347 8.555 194 HZ1 LYS 21 HZ1 LYS 21 0.151 3.173 8.114 195 HZ2 LYS 21 HZ2 LYS 21 -1.355 3.469 7.508 196 HZ3 LYS 21 HZ3 LYS 21 -0.149 3.043 6.503 197 H GLU 22 H GLU 22 0.767 -3.142 3.628 198 HA GLU 22 HA GLU 22 1.918 -5.510 4.839 199 HB2 GLU 22 HB2 GLU 22 -0.116 -5.253 2.591 200 HB3 GLU 22 HB3 GLU 22 0.427 -6.766 3.333 201 HG2 GLU 22 HG2 GLU 22 -0.330 -5.906 5.565 202 HG3 GLU 22 HG3 GLU 22 -0.991 -4.496 4.754 203 H ARG 23 H ARG 23 1.909 -4.168 1.494 204 HA ARG 23 HA ARG 23 3.575 -6.166 0.366 205 HB2 ARG 23 HB2 ARG 23 4.248 -4.528 -1.419 206 HB3 ARG 23 HB3 ARG 23 2.534 -4.754 -1.174 207 HG2 ARG 23 HG2 ARG 23 2.467 -2.544 -1.372 208 HG3 ARG 23 HG3 ARG 23 2.784 -2.577 0.331 209 HD2 ARG 23 HD2 ARG 23 4.206 -0.913 -0.795 210 HD3 ARG 23 HD3 ARG 23 5.185 -2.164 -0.049 211 HE ARG 23 HE ARG 23 6.114 -2.558 -2.071 212 HH11 ARG 23 HH11 ARG 23 2.972 -1.119 -2.701 213 HH12 ARG 23 HH12 ARG 23 2.936 -1.396 -4.376 214 HH21 ARG 23 HH21 ARG 23 6.066 -3.153 -4.388 215 HH22 ARG 23 HH22 ARG 23 4.982 -2.359 -5.424 216 H ILE 24 H ILE 24 4.580 -3.305 2.194 217 HA ILE 24 HA ILE 24 7.396 -3.780 1.707 218 HB ILE 24 HB ILE 24 6.581 -1.560 2.161 219 HG12 ILE 24 HG12 ILE 24 8.343 -2.606 4.430 220 HG13 ILE 24 HG13 ILE 24 8.888 -2.001 2.866 221 HG21 ILE 24 HG21 ILE 24 4.690 -2.189 3.635 222 HG22 ILE 24 HG22 ILE 24 5.821 -2.279 5.002 223 HG23 ILE 24 HG23 ILE 24 5.547 -0.759 4.116 224 HD11 ILE 24 HD11 ILE 24 7.864 0.232 3.494 225 HD12 ILE 24 HD12 ILE 24 7.533 -0.459 5.109 226 HD13 ILE 24 HD13 ILE 24 9.215 -0.291 4.537 227 H GLN 25 H GLN 25 5.196 -4.367 4.532 228 HA GLN 25 HA GLN 25 7.257 -5.484 6.144 229 HB2 GLN 25 HB2 GLN 25 5.131 -4.467 6.917 230 HB3 GLN 25 HB3 GLN 25 4.228 -5.835 6.246 231 HG2 GLN 25 HG2 GLN 25 5.481 -7.339 7.819 232 HG3 GLN 25 HG3 GLN 25 6.308 -5.891 8.434 233 HE21 GLN 25 HE21 GLN 25 5.355 -5.154 10.309 234 HE22 GLN 25 HE22 GLN 25 3.640 -5.247 10.695 235 H ASN 26 H ASN 26 4.790 -7.052 4.138 236 HA ASN 26 HA ASN 26 5.572 -9.762 4.944 237 HB2 ASN 26 HB2 ASN 26 3.690 -8.760 2.732 238 HB3 ASN 26 HB3 ASN 26 3.940 -10.433 3.168 239 HD21 ASN 26 HD21 ASN 26 3.015 -7.350 4.899 240 HD22 ASN 26 HD22 ASN 26 1.830 -8.170 5.899 241 H SER 27 H SER 27 5.670 -7.794 1.985 242 HA SER 27 HA SER 27 6.742 -7.853 0.078 243 HB2 SER 27 HB2 SER 27 8.576 -7.585 2.091 244 HB3 SER 27 HB3 SER 27 9.276 -8.931 1.175 245 HG SER 27 HG SER 27 8.329 -6.487 0.061 246 H LEU 28 H LEU 28 5.911 -10.660 1.254 247 HA LEU 28 HA LEU 28 7.034 -12.382 -0.846 248 HB2 LEU 28 HB2 LEU 28 6.100 -14.194 0.581 249 HB3 LEU 28 HB3 LEU 28 7.185 -13.113 1.424 250 HG LEU 28 HG LEU 28 5.442 -12.015 2.602 251 HD11 LEU 28 HD11 LEU 28 3.093 -12.902 2.569 252 HD12 LEU 28 HD12 LEU 28 3.492 -13.743 1.059 253 HD13 LEU 28 HD13 LEU 28 3.550 -11.955 1.156 254 HD21 LEU 28 HD21 LEU 28 6.387 -14.241 3.391 255 HD22 LEU 28 HD22 LEU 28 4.890 -14.985 2.783 256 HD23 LEU 28 HD23 LEU 28 4.828 -13.780 4.076 257 H SER 29 H SER 29 5.228 -14.184 -1.136 258 HA SER 29 HA SER 29 2.702 -13.077 -2.244 259 HB2 SER 29 HB2 SER 29 4.677 -14.998 -3.569 260 HB3 SER 29 HB3 SER 29 3.020 -14.766 -4.098 261 HG SER 29 HG SER 29 5.256 -13.056 -4.152 262 H THR 30 H THR 30 4.614 -16.021 -1.472 263 HA THR 30 HA THR 30 2.463 -17.061 0.172 264 HB THR 30 HB THR 30 1.850 -17.778 -2.055 265 HG1 THR 30 HG1 THR 30 1.871 -19.302 -0.139 266 HG21 THR 30 HG21 THR 30 3.272 -19.292 -3.392 267 HG22 THR 30 HG22 THR 30 4.594 -19.074 -2.231 268 HG23 THR 30 HG23 THR 30 4.025 -17.696 -3.177 269 H GLU 31 H GLU 31 4.873 -15.994 0.881 270 HA GLU 31 HA GLU 31 6.800 -16.274 2.114 271 HB2 GLU 31 HB2 GLU 31 6.031 -19.157 2.498 272 HB3 GLU 31 HB3 GLU 31 6.933 -18.117 3.595 273 HG2 GLU 31 HG2 GLU 31 4.889 -16.811 4.048 274 HG3 GLU 31 HG3 GLU 31 3.961 -17.849 2.949 275 H LYS 32 H LYS 32 6.680 -17.399 -0.787 276 HA LYS 32 HA LYS 32 8.325 -19.389 -1.391 277 HB2 LYS 32 HB2 LYS 32 7.151 -17.668 -2.917 278 HB3 LYS 32 HB3 LYS 32 8.686 -16.822 -2.951 279 HG2 LYS 32 HG2 LYS 32 9.546 -18.301 -4.429 280 HG3 LYS 32 HG3 LYS 32 9.174 -19.669 -3.412 281 HD2 LYS 32 HD2 LYS 32 7.145 -18.319 -5.248 282 HD3 LYS 32 HD3 LYS 32 8.068 -19.763 -5.684 283 HE2 LYS 32 HE2 LYS 32 6.316 -19.632 -3.196 284 HE3 LYS 32 HE3 LYS 32 5.668 -20.096 -4.773 285 HZ1 LYS 32 HZ1 LYS 32 6.326 -21.960 -3.357 286 HZ2 LYS 32 HZ2 LYS 32 7.909 -21.531 -3.470 287 HZ3 LYS 32 HZ3 LYS 32 7.077 -21.991 -4.800 288 H TYR 33 H TYR 33 10.059 -16.173 -1.312 289 HA TYR 33 HA TYR 33 12.146 -17.266 0.295 290 HB2 TYR 33 HB2 TYR 33 12.434 -18.216 -2.211 291 HB3 TYR 33 HB3 TYR 33 13.063 -16.614 -2.517 292 HD1 TYR 33 HD1 TYR 33 15.414 -16.390 -2.310 293 HD2 TYR 33 HD2 TYR 33 13.391 -19.415 -0.000 294 HE1 TYR 33 HE1 TYR 33 17.589 -17.145 -1.436 295 HE2 TYR 33 HE2 TYR 33 15.599 -20.218 0.853 296 HH TYR 33 HH TYR 33 18.697 -18.701 -0.141 297 H GLY 34 H GLY 34 14.079 -15.623 0.193 298 HA2 GLY 34 HA2 GLY 34 13.122 -12.815 -0.034 299 HA3 GLY 34 HA3 GLY 34 14.136 -13.442 1.285 300 H SER 35 H SER 35 15.461 -11.456 0.145 301 HA SER 35 HA SER 35 17.667 -12.699 -1.228 302 HB2 SER 35 HB2 SER 35 16.085 -12.490 -3.153 303 HB3 SER 35 HB3 SER 35 15.894 -10.775 -2.804 304 HG SER 35 HG SER 35 17.321 -11.126 -4.500 305 H GLY 36 H GLY 36 19.410 -11.096 -1.562 306 HA2 GLY 36 HA2 GLY 36 19.179 -8.390 -0.519 307 HA3 GLY 36 HA3 GLY 36 20.145 -9.509 0.470 308 H SER 37 H SER 37 21.702 -7.581 -0.391 309 HA SER 37 HA SER 37 23.508 -8.772 -2.204 310 HB2 SER 37 HB2 SER 37 21.494 -7.263 -3.477 311 HB3 SER 37 HB3 SER 37 22.853 -6.147 -3.376 312 HG SER 37 HG SER 37 23.004 -8.833 -4.357 313 H GLY 38 H GLY 38 25.422 -7.119 -2.507 314 HA2 GLY 38 HA2 GLY 38 25.622 -5.167 -0.255 315 HA3 GLY 38 HA3 GLY 38 26.867 -6.413 -0.497 316 H SER 39 H SER 39 27.519 -3.629 -0.667 317 HA SER 39 HA SER 39 27.805 -3.162 -3.593 318 HB2 SER 39 HB2 SER 39 28.117 -0.827 -2.938 319 HB3 SER 39 HB3 SER 39 26.567 -1.496 -2.462 320 HG SER 39 HG SER 39 27.193 -0.491 -0.680 321 H GLY 40 H GLY 40 29.979 -1.185 -2.272 322 HA2 GLY 40 HA2 GLY 40 32.228 -2.391 -1.424 323 HA3 GLY 40 HA3 GLY 40 32.266 -2.741 -3.171 324 H SER 41 H SER 41 33.011 -1.117 -4.502 325 HA SER 41 HA SER 41 33.932 0.772 -5.217 326 HB2 SER 41 HB2 SER 41 32.640 2.926 -4.770 327 HB3 SER 41 HB3 SER 41 31.846 1.605 -5.619 328 HG SER 41 HG SER 41 31.538 1.639 -2.857 329 H GLY 42 H GLY 42 34.664 -0.049 -2.199 330 HA2 GLY 42 HA2 GLY 42 35.635 2.344 -1.015 331 HA3 GLY 42 HA3 GLY 42 36.227 0.700 -0.691 332 H SER 43 H SER 43 37.620 3.435 -1.233 333 HA SER 43 HA SER 43 39.794 2.365 -2.785 334 HB2 SER 43 HB2 SER 43 37.995 3.363 -4.434 335 HB3 SER 43 HB3 SER 43 38.500 4.933 -3.785 336 HG SER 43 HG SER 43 39.885 3.078 -5.361 337 H GLY 44 H GLY 44 41.405 4.446 -3.023 338 HA2 GLY 44 HA2 GLY 44 41.302 6.494 -1.064 339 HA3 GLY 44 HA3 GLY 44 42.286 5.137 -0.469 340 H SER 45 H SER 45 43.463 7.658 -1.053 341 HA SER 45 HA SER 45 45.491 6.886 -3.000 342 HB2 SER 45 HB2 SER 45 43.671 9.277 -3.533 343 HB3 SER 45 HB3 SER 45 45.211 8.977 -4.355 344 HG SER 45 HG SER 45 43.545 6.793 -4.393 345 H GLY 46 H GLY 46 46.603 6.948 -0.916 346 HA2 GLY 46 HA2 GLY 46 48.116 7.916 0.486 347 HA3 GLY 46 HA3 GLY 46 47.880 9.454 -0.350 348 H SER 47 H SER 47 45.056 9.675 0.175 349 HA SER 47 HA SER 47 45.101 10.873 2.791 350 HB2 SER 47 HB2 SER 47 43.873 11.639 0.652 351 HB3 SER 47 HB3 SER 47 42.690 10.364 0.996 352 HG SER 47 HG SER 47 42.124 12.436 1.845 353 H GLY 48 H GLY 48 42.966 10.467 4.073 354 HA2 GLY 48 HA2 GLY 48 43.097 7.762 5.182 355 HA3 GLY 48 HA3 GLY 48 42.160 9.137 5.805 356 H SER 49 H SER 49 40.192 7.951 6.044 357 HA SER 49 HA SER 49 38.791 7.362 3.529 358 HB2 SER 49 HB2 SER 49 39.914 5.275 4.684 359 HB3 SER 49 HB3 SER 49 38.615 5.456 5.875 360 HG SER 49 HG SER 49 38.480 4.897 3.107 361 H GLY 50 H GLY 50 36.363 6.797 4.247 362 HA2 GLY 50 HA2 GLY 50 35.318 8.073 6.576 363 HA3 GLY 50 HA3 GLY 50 35.134 9.096 5.132 364 H SER 51 H SER 51 32.792 8.238 6.235 365 HA SER 51 HA SER 51 31.579 6.608 4.218 366 HB2 SER 51 HB2 SER 51 32.570 4.894 5.791 367 HB3 SER 51 HB3 SER 51 31.684 5.647 7.121 368 HG SER 51 HG SER 51 30.664 4.197 4.884 369 H GLY 52 H GLY 52 29.107 6.395 5.206 370 HA2 GLY 52 HA2 GLY 52 28.137 8.284 7.042 371 HA3 GLY 52 HA3 GLY 52 28.099 9.037 5.433 372 H SER 53 H SER 53 25.795 8.167 7.142 373 HA SER 53 HA SER 53 24.359 6.621 5.121 374 HB2 SER 53 HB2 SER 53 25.521 5.087 6.871 375 HB3 SER 53 HB3 SER 53 24.363 5.746 8.039 376 HG SER 53 HG SER 53 23.920 3.726 6.750 377 H GLY 54 H GLY 54 21.991 6.339 6.388 378 HA2 GLY 54 HA2 GLY 54 20.885 8.098 8.128 379 HA3 GLY 54 HA3 GLY 54 20.993 9.065 6.640 380 H SER 55 H SER 55 18.481 8.732 7.345 381 HA SER 55 HA SER 55 17.298 7.095 5.312 382 HB2 SER 55 HB2 SER 55 17.746 5.412 7.170 383 HB3 SER 55 HB3 SER 55 16.708 6.382 8.226 384 HG SER 55 HG SER 55 15.539 4.704 7.358 385 H GLY 56 H GLY 56 14.738 7.198 6.038 386 HA2 GLY 56 HA2 GLY 56 13.895 9.683 7.290 387 HA3 GLY 56 HA3 GLY 56 13.678 9.620 5.524 388 H SER 57 H SER 57 11.341 9.798 6.874 389 HA SER 57 HA SER 57 9.937 7.397 6.260 390 HB2 SER 57 HB2 SER 57 9.044 7.111 8.634 391 HB3 SER 57 HB3 SER 57 10.703 6.567 8.384 392 HG SER 57 HG SER 57 11.440 8.535 9.267 393 H GLY 58 H GLY 58 7.523 7.788 7.007 394 HA2 GLY 58 HA2 GLY 58 6.173 9.794 7.880 395 HA3 GLY 58 HA3 GLY 58 6.831 10.596 6.438 396 H TYR 59 H TYR 59 5.133 10.695 5.100 397 HA TYR 59 HA TYR 59 3.013 8.811 4.816 398 HB2 TYR 59 HB2 TYR 59 3.991 11.146 3.147 399 HB3 TYR 59 HB3 TYR 59 2.577 10.215 2.714 400 HD1 TYR 59 HD1 TYR 59 0.606 10.017 4.375 401 HD2 TYR 59 HD2 TYR 59 3.788 12.897 4.803 402 HE1 TYR 59 HE1 TYR 59 -0.848 11.372 5.790 403 HE2 TYR 59 HE2 TYR 59 2.322 14.269 6.259 404 HH TYR 59 HH TYR 59 -0.015 14.601 6.849 405 H GLN3288 H GLN3288 2.563 8.186 2.305 406 HA GLN3288 HA GLN3288 4.156 5.922 1.794 407 HB2 GLN3288 HB2 GLN3288 2.858 5.687 -0.233 408 HB3 GLN3288 HB3 GLN3288 1.804 6.243 1.064 409 HG2 GLN3288 HG2 GLN3288 2.154 8.625 0.152 410 HG3 GLN3288 HG3 GLN3288 2.889 7.869 -1.266 411 HE21 GLN3288 HE21 GLN3288 1.460 6.185 -2.429 412 HE22 GLN3288 HE22 GLN3288 -0.231 6.585 -2.491 413 H ILE3289 H ILE3289 5.579 5.425 0.022 414 HA ILE3289 HA ILE3289 7.340 7.666 -0.643 415 HB ILE3289 HB ILE3289 7.782 4.699 -1.028 416 HG12 ILE3289 HG12 ILE3289 8.688 6.470 1.298 417 HG13 ILE3289 HG13 ILE3289 7.439 5.232 1.398 418 HG21 ILE3289 HG21 ILE3289 10.167 5.407 -1.211 419 HG22 ILE3289 HG22 ILE3289 9.184 6.235 -2.415 420 HG23 ILE3289 HG23 ILE3289 9.692 7.097 -0.950 421 HD11 ILE3289 HD11 ILE3289 9.117 3.495 0.760 422 HD12 ILE3289 HD12 ILE3289 10.388 4.737 0.918 423 HD13 ILE3289 HD13 ILE3289 9.408 4.294 2.319 424 H GLU3290 H GLU3290 6.226 8.727 -2.211 425 HA GLU3290 HA GLU3290 4.846 7.509 -4.404 426 HB2 GLU3290 HB2 GLU3290 4.476 9.761 -3.340 427 HB3 GLU3290 HB3 GLU3290 5.929 10.349 -4.146 428 HG2 GLU3290 HG2 GLU3290 4.928 10.106 -6.319 429 HG3 GLU3290 HG3 GLU3290 3.611 9.113 -5.681 430 H THR3291 H THR3291 8.133 7.775 -3.797 431 HA THR3291 HA THR3291 8.870 7.450 -6.662 432 HB THR3291 HB THR3291 9.438 9.574 -5.838 433 HG1 THR3291 HG1 THR3291 11.184 7.890 -6.827 434 HG21 THR3291 HG21 THR3291 11.073 10.001 -4.053 435 HG22 THR3291 HG22 THR3291 11.019 8.279 -3.601 436 HG23 THR3291 HG23 THR3291 9.583 9.311 -3.439 437 H PHE3292 H PHE3292 8.036 5.244 -5.621 438 HA PHE3292 HA PHE3292 10.333 3.581 -5.569 439 HB2 PHE3292 HB2 PHE3292 10.370 4.255 -3.190 440 HB3 PHE3292 HB3 PHE3292 8.717 3.659 -3.000 441 HD1 PHE3292 HD1 PHE3292 11.427 1.918 -5.006 442 HD2 PHE3292 HD2 PHE3292 9.233 2.006 -1.281 443 HE1 PHE3292 HE1 PHE3292 12.255 -0.298 -4.481 444 HE2 PHE3292 HE2 PHE3292 10.147 -0.257 -0.750 445 HZ PHE3292 HZ PHE3292 11.570 -1.447 -2.387 446 H PHE3293 H PHE3293 6.891 3.605 -4.486 447 HA PHE3293 HA PHE3293 6.447 1.236 -6.248 448 HB2 PHE3293 HB2 PHE3293 4.720 0.595 -4.444 449 HB3 PHE3293 HB3 PHE3293 6.374 0.214 -4.186 450 HD1 PHE3293 HD1 PHE3293 7.044 0.470 -1.962 451 HD2 PHE3293 HD2 PHE3293 4.265 3.334 -3.607 452 HE1 PHE3293 HE1 PHE3293 6.993 1.696 0.196 453 HE2 PHE3293 HE2 PHE3293 4.217 4.517 -1.490 454 HZ PHE3293 HZ PHE3293 5.512 3.638 0.499 455 H ALA3294 H ALA3294 5.785 4.335 -6.434 456 HA ALA3294 HA ALA3294 2.986 4.618 -6.387 457 HB1 ALA3294 HB1 ALA3294 4.855 5.940 -8.351 458 HB2 ALA3294 HB2 ALA3294 3.261 6.502 -7.828 459 HB3 ALA3294 HB3 ALA3294 4.592 6.437 -6.655 460 H GLN3295 H GLN3295 5.003 3.033 -8.778 461 HA GLN3295 HA GLN3295 3.058 2.888 -10.878 462 HB2 GLN3295 HB2 GLN3295 5.309 0.919 -10.336 463 HB3 GLN3295 HB3 GLN3295 4.502 1.217 -11.865 464 HG2 GLN3295 HG2 GLN3295 6.382 3.107 -10.371 465 HG3 GLN3295 HG3 GLN3295 6.695 2.267 -11.887 466 HE21 GLN3295 HE21 GLN3295 6.218 5.367 -10.912 467 HE22 GLN3295 HE22 GLN3295 5.126 5.892 -12.184 468 H ASP3296 H ASP3296 3.759 0.764 -8.062 469 HA ASP3296 HA ASP3296 1.748 -1.201 -8.938 470 HB2 ASP3296 HB2 ASP3296 3.411 -0.941 -6.390 471 HB3 ASP3296 HB3 ASP3296 2.195 -2.199 -6.640 472 H ILE3297 H ILE3297 1.976 1.496 -6.708 473 HA ILE3297 HA ILE3297 -0.279 1.030 -5.068 474 HB ILE3297 HB ILE3297 1.514 3.270 -5.801 475 HG12 ILE3297 HG12 ILE3297 1.566 3.823 -3.484 476 HG13 ILE3297 HG13 ILE3297 0.088 2.906 -3.166 477 HG21 ILE3297 HG21 ILE3297 0.097 5.121 -4.926 478 HG22 ILE3297 HG22 ILE3297 -0.427 4.476 -6.485 479 HG23 ILE3297 HG23 ILE3297 -1.309 4.031 -5.017 480 HD11 ILE3297 HD11 ILE3297 2.231 1.817 -2.411 481 HD12 ILE3297 HD12 ILE3297 1.259 0.805 -3.492 482 HD13 ILE3297 HD13 ILE3297 2.687 1.637 -4.104 483 H GLU3298 H GLU3298 -0.055 2.687 -8.248 484 HA GLU3298 HA GLU3298 -2.770 3.457 -8.326 485 HB2 GLU3298 HB2 GLU3298 -2.424 3.929 -10.614 486 HB3 GLU3298 HB3 GLU3298 -0.923 4.300 -9.776 487 HG2 GLU3298 HG2 GLU3298 0.067 3.103 -11.425 488 HG3 GLU3298 HG3 GLU3298 -0.439 1.705 -10.506 489 H SER3299 H SER3299 -1.198 0.407 -9.048 490 HA SER3299 HA SER3299 -3.526 -0.684 -10.383 491 HB2 SER3299 HB2 SER3299 -1.104 -1.524 -10.621 492 HB3 SER3299 HB3 SER3299 -1.407 -2.430 -9.117 493 HG SER3299 HG SER3299 -3.411 -3.123 -10.272 494 H VAL3300 H VAL3300 -2.452 -0.536 -7.053 495 HA VAL3300 HA VAL3300 -4.401 -2.480 -6.055 496 HB VAL3300 HB VAL3300 -2.543 -0.415 -4.779 497 HG11 VAL3300 HG11 VAL3300 -4.508 -2.255 -3.404 498 HG12 VAL3300 HG12 VAL3300 -3.139 -1.436 -2.586 499 HG13 VAL3300 HG13 VAL3300 -4.438 -0.479 -3.316 500 HG21 VAL3300 HG21 VAL3300 -1.437 -2.477 -3.934 501 HG22 VAL3300 HG22 VAL3300 -2.593 -3.459 -4.851 502 HG23 VAL3300 HG23 VAL3300 -1.466 -2.385 -5.712 503 H GLN3301 H GLN3301 -4.094 1.103 -6.262 504 HA GLN3301 HA GLN3301 -6.614 1.526 -4.992 505 HB2 GLN3301 HB2 GLN3301 -6.309 3.745 -5.268 506 HB3 GLN3301 HB3 GLN3301 -4.668 3.097 -5.263 507 HG2 GLN3301 HG2 GLN3301 -4.396 4.461 -7.033 508 HG3 GLN3301 HG3 GLN3301 -5.180 3.153 -7.922 509 HE21 GLN3301 HE21 GLN3301 -7.896 3.411 -7.547 510 HE22 GLN3301 HE22 GLN3301 -8.391 4.964 -8.102 511 H LYS3302 H LYS3302 -5.702 0.951 -8.359 512 HA LYS3302 HA LYS3302 -8.237 1.511 -9.550 513 HB2 LYS3302 HB2 LYS3302 -5.820 -0.099 -10.346 514 HB3 LYS3302 HB3 LYS3302 -7.299 -0.167 -11.307 515 HG2 LYS3302 HG2 LYS3302 -7.271 2.180 -11.786 516 HG3 LYS3302 HG3 LYS3302 -6.016 2.500 -10.598 517 HD2 LYS3302 HD2 LYS3302 -4.964 2.551 -12.748 518 HD3 LYS3302 HD3 LYS3302 -4.447 1.052 -11.958 519 HE2 LYS3302 HE2 LYS3302 -6.299 -0.153 -13.199 520 HE3 LYS3302 HE3 LYS3302 -6.652 1.363 -14.032 521 HZ1 LYS3302 HZ1 LYS3302 -5.278 0.029 -15.416 522 HZ2 LYS3302 HZ2 LYS3302 -4.139 -0.193 -14.234 523 HZ3 LYS3302 HZ3 LYS3302 -4.364 1.273 -14.917 524 H GLU3303 H GLU3303 -7.007 -1.298 -7.745 525 HA GLU3303 HA GLU3303 -9.131 -3.022 -8.746 526 HB2 GLU3303 HB2 GLU3303 -8.066 -4.699 -7.764 527 HB3 GLU3303 HB3 GLU3303 -6.738 -3.576 -7.523 528 HG2 GLU3303 HG2 GLU3303 -7.609 -3.121 -5.213 529 HG3 GLU3303 HG3 GLU3303 -8.931 -4.258 -5.519 530 H LEU3304 H LEU3304 -8.513 -1.212 -5.735 531 HA LEU3304 HA LEU3304 -10.990 -1.785 -4.502 532 HB2 LEU3304 HB2 LEU3304 -9.022 0.512 -4.189 533 HB3 LEU3304 HB3 LEU3304 -10.345 0.141 -3.114 534 HG LEU3304 HG LEU3304 -7.761 -1.379 -3.548 535 HD11 LEU3304 HD11 LEU3304 -7.599 -1.072 -1.163 536 HD12 LEU3304 HD12 LEU3304 -9.301 -0.520 -1.109 537 HD13 LEU3304 HD13 LEU3304 -8.096 0.475 -1.915 538 HD21 LEU3304 HD21 LEU3304 -8.528 -3.223 -2.122 539 HD22 LEU3304 HD22 LEU3304 -9.458 -3.168 -3.615 540 HD23 LEU3304 HD23 LEU3304 -10.179 -2.564 -2.121 541 H GLU3305 H GLU3305 -10.245 0.847 -6.731 542 HA GLU3305 HA GLU3305 -12.413 2.523 -5.848 543 HB2 GLU3305 HB2 GLU3305 -12.109 3.808 -7.895 544 HB3 GLU3305 HB3 GLU3305 -10.588 3.502 -7.036 545 HG2 GLU3305 HG2 GLU3305 -10.119 1.616 -8.489 546 HG3 GLU3305 HG3 GLU3305 -11.626 1.850 -9.374 547 H ASN3306 H ASN3306 -12.571 -0.390 -7.610 548 HA ASN3306 HA ASN3306 -15.320 0.321 -8.523 549 HB2 ASN3306 HB2 ASN3306 -15.296 -1.557 -9.955 550 HB3 ASN3306 HB3 ASN3306 -13.876 -0.571 -10.293 551 HD21 ASN3306 HD21 ASN3306 -11.840 -1.478 -10.005 552 HD22 ASN3306 HD22 ASN3306 -11.589 -3.053 -9.290 553 H LEU3307 H LEU3307 -13.790 -0.883 -5.788 554 HA LEU3307 HA LEU3307 -15.809 -3.017 -5.380 555 HB2 LEU3307 HB2 LEU3307 -13.276 -2.171 -4.042 556 HB3 LEU3307 HB3 LEU3307 -14.537 -2.678 -2.956 557 HG LEU3307 HG LEU3307 -13.706 -4.701 -3.163 558 HD11 LEU3307 HD11 LEU3307 -14.430 -6.143 -4.908 559 HD12 LEU3307 HD12 LEU3307 -14.725 -4.807 -6.024 560 HD13 LEU3307 HD13 LEU3307 -15.731 -5.018 -4.565 561 HD21 LEU3307 HD21 LEU3307 -12.363 -3.973 -5.740 562 HD22 LEU3307 HD22 LEU3307 -12.155 -5.484 -4.849 563 HD23 LEU3307 HD23 LEU3307 -11.645 -3.952 -4.104 564 H SER3308 H SER3308 -17.173 -3.118 -3.603 565 HA SER3308 HA SER3308 -18.638 -0.664 -3.091 566 HB2 SER3308 HB2 SER3308 -19.123 -3.586 -2.433 567 HB3 SER3308 HB3 SER3308 -20.313 -2.282 -2.271 568 HG SER3308 HG SER3308 -19.921 -1.914 -4.598 569 H GLU3309 H GLU3309 -19.490 -0.280 -0.705 570 HA GLU3309 HA GLU3309 -17.282 0.021 1.050 571 HB2 GLU3309 HB2 GLU3309 -20.295 0.336 1.173 572 HB3 GLU3309 HB3 GLU3309 -19.484 0.029 2.714 573 HG2 GLU3309 HG2 GLU3309 -18.297 1.962 2.688 574 HG3 GLU3309 HG3 GLU3309 -18.381 2.193 0.947 575 H GLU3310 H GLU3310 -19.898 -2.439 1.029 576 HA GLU3310 HA GLU3310 -19.154 -3.942 3.180 577 HB2 GLU3310 HB2 GLU3310 -20.308 -5.793 1.969 578 HB3 GLU3310 HB3 GLU3310 -21.161 -4.246 1.845 579 HG2 GLU3310 HG2 GLU3310 -19.694 -4.045 -0.397 580 HG3 GLU3310 HG3 GLU3310 -19.624 -5.782 -0.244 581 H GLU3311 H GLU3311 -17.359 -3.715 0.186 582 HA GLU3311 HA GLU3311 -15.801 -6.190 0.614 583 HB2 GLU3311 HB2 GLU3311 -15.657 -3.928 -1.406 584 HB3 GLU3311 HB3 GLU3311 -14.600 -5.313 -1.399 585 HG2 GLU3311 HG2 GLU3311 -17.557 -5.863 -1.402 586 HG3 GLU3311 HG3 GLU3311 -16.941 -5.126 -2.791 587 H LEU3312 H LEU3312 -15.308 -2.702 0.408 588 HA LEU3312 HA LEU3312 -12.587 -2.738 1.327 589 HB2 LEU3312 HB2 LEU3312 -14.304 -0.254 1.329 590 HB3 LEU3312 HB3 LEU3312 -12.607 -0.349 1.074 591 HG LEU3312 HG LEU3312 -14.409 -1.668 -0.968 592 HD11 LEU3312 HD11 LEU3312 -14.663 0.412 -2.135 593 HD12 LEU3312 HD12 LEU3312 -13.955 1.308 -0.764 594 HD13 LEU3312 HD13 LEU3312 -15.486 0.399 -0.592 595 HD21 LEU3312 HD21 LEU3312 -12.189 -2.126 -1.335 596 HD22 LEU3312 HD22 LEU3312 -11.671 -0.453 -1.047 597 HD23 LEU3312 HD23 LEU3312 -12.625 -0.851 -2.485 598 H LEU3313 H LEU3313 -15.562 -1.430 2.765 599 HA LEU3313 HA LEU3313 -14.645 -0.493 5.225 600 HB2 LEU3313 HB2 LEU3313 -16.853 0.026 4.183 601 HB3 LEU3313 HB3 LEU3313 -17.341 -1.664 4.336 602 HG LEU3313 HG LEU3313 -18.327 -0.099 5.987 603 HD11 LEU3313 HD11 LEU3313 -18.582 -1.788 7.627 604 HD12 LEU3313 HD12 LEU3313 -17.051 -2.561 7.200 605 HD13 LEU3313 HD13 LEU3313 -18.429 -2.577 6.061 606 HD21 LEU3313 HD21 LEU3313 -15.662 -0.399 7.403 607 HD22 LEU3313 HD22 LEU3313 -17.147 0.195 8.123 608 HD23 LEU3313 HD23 LEU3313 -16.403 1.113 6.815 609 H ALA3314 H ALA3314 -15.723 -3.747 4.142 610 HA ALA3314 HA ALA3314 -15.569 -4.866 6.754 611 HB1 ALA3314 HB1 ALA3314 -15.309 -6.125 3.999 612 HB2 ALA3314 HB2 ALA3314 -15.440 -7.057 5.523 613 HB3 ALA3314 HB3 ALA3314 -16.753 -5.977 5.014 614 H MET3315 H MET3315 -12.978 -4.191 4.425 615 HA MET3315 HA MET3315 -11.021 -5.920 5.723 616 HB2 MET3315 HB2 MET3315 -10.364 -3.508 3.998 617 HB3 MET3315 HB3 MET3315 -9.401 -4.950 4.260 618 HG2 MET3315 HG2 MET3315 -11.998 -5.600 3.128 619 HG3 MET3315 HG3 MET3315 -11.254 -4.342 2.194 620 HE1 MET3315 HE1 MET3315 -11.952 -7.021 0.808 621 HE2 MET3315 HE2 MET3315 -11.074 -5.716 -0.008 622 HE3 MET3315 HE3 MET3315 -10.466 -7.388 -0.086 623 H LEU3316 H LEU3316 -11.424 -2.378 5.515 624 HA LEU3316 HA LEU3316 -9.343 -1.745 7.380 625 HB2 LEU3316 HB2 LEU3316 -10.350 0.518 7.467 626 HB3 LEU3316 HB3 LEU3316 -9.990 -0.089 5.864 627 HG LEU3316 HG LEU3316 -12.579 -0.856 5.987 628 HD11 LEU3316 HD11 LEU3316 -13.955 0.949 7.011 629 HD12 LEU3316 HD12 LEU3316 -12.522 1.691 7.686 630 HD13 LEU3316 HD13 LEU3316 -13.057 0.106 8.267 631 HD21 LEU3316 HD21 LEU3316 -12.194 2.065 5.430 632 HD22 LEU3316 HD22 LEU3316 -13.022 0.803 4.493 633 HD23 LEU3316 HD23 LEU3316 -11.279 0.890 4.469 634 H ASN3317 H ASN3317 -12.814 -2.437 7.883 635 HA ASN3317 HA ASN3317 -12.558 -1.687 10.716 636 HB2 ASN3317 HB2 ASN3317 -14.702 -1.745 8.998 637 HB3 ASN3317 HB3 ASN3317 -14.922 -3.285 9.828 638 HD21 ASN3317 HD21 ASN3317 -15.956 -0.354 9.816 639 HD22 ASN3317 HD22 ASN3317 -16.237 0.012 11.531 640 H GLY3318 H GLY3318 -12.396 -4.492 8.711 641 HA2 GLY3318 HA2 GLY3318 -11.603 -6.648 9.102 642 HA3 GLY3318 HA3 GLY3318 -11.252 -6.199 10.788 643 H ASP3319 H ASP3319 -14.084 -6.634 8.590 644 HA ASP3319 HA ASP3319 -15.435 -8.208 10.685 645 HB2 ASP3319 HB2 ASP3319 -16.073 -5.600 10.561 646 HB3 ASP3319 HB3 ASP3319 -17.151 -6.186 9.311 647 H GLN3320 H GLN3320 -17.920 -8.316 9.172 648 HA GLN3320 HA GLN3320 -17.239 -9.621 6.629 649 HB2 GLN3320 HB2 GLN3320 -18.317 -11.719 7.364 650 HB3 GLN3320 HB3 GLN3320 -16.968 -11.321 8.394 651 HG2 GLN3320 HG2 GLN3320 -18.359 -11.812 10.080 652 HG3 GLN3320 HG3 GLN3320 -19.003 -10.195 9.864 653 HE21 GLN3320 HE21 GLN3320 -21.287 -10.306 10.096 654 HE22 GLN3320 HE22 GLN3320 -22.217 -11.643 9.455 655 H GLN3321 H GLN3321 -18.654 -7.135 7.121 656 HA GLN3321 HA GLN3321 -21.357 -7.929 6.132 657 HB2 GLN3321 HB2 GLN3321 -20.697 -5.809 8.222 658 HB3 GLN3321 HB3 GLN3321 -22.221 -5.856 7.329 659 HG2 GLN3321 HG2 GLN3321 -21.221 -8.124 9.080 660 HG3 GLN3321 HG3 GLN3321 -22.378 -6.876 9.564 661 HE21 GLN3321 HE21 GLN3321 -21.894 -9.659 7.454 662 HE22 GLN3321 HE22 GLN3321 -23.511 -9.697 6.808 Start of MODEL 6 1 H1 MET 1 H MET 1 -24.215 15.529 -1.355 2 HA MET 1 HA MET 1 -22.678 14.332 0.858 3 HB2 MET 1 HB2 MET 1 -25.327 15.736 0.798 4 HB3 MET 1 HB3 MET 1 -25.106 14.406 1.941 5 HG2 MET 1 HG2 MET 1 -23.222 15.447 2.939 6 HG3 MET 1 HG3 MET 1 -23.145 16.703 1.698 7 HE1 MET 1 HE1 MET 1 -23.357 16.749 5.106 8 HE2 MET 1 HE2 MET 1 -22.812 18.096 4.082 9 HE3 MET 1 HE3 MET 1 -24.146 18.332 5.239 10 H ASN 2 H ASN 2 -25.939 13.663 -0.664 11 HA ASN 2 HA ASN 2 -25.686 10.884 -0.069 12 HB2 ASN 2 HB2 ASN 2 -27.532 12.423 -1.938 13 HB3 ASN 2 HB3 ASN 2 -27.560 10.670 -1.802 14 HD21 ASN 2 HD21 ASN 2 -27.975 13.653 0.163 15 HD22 ASN 2 HD22 ASN 2 -28.944 12.849 1.393 16 H ILE 3 H ILE 3 -23.757 10.004 -0.836 17 HA ILE 3 HA ILE 3 -23.720 9.274 -3.640 18 HB ILE 3 HB ILE 3 -22.568 11.576 -3.414 19 HG12 ILE 3 HG12 ILE 3 -20.744 9.468 -4.586 20 HG13 ILE 3 HG13 ILE 3 -22.334 9.821 -5.271 21 HG21 ILE 3 HG21 ILE 3 -20.290 9.946 -2.204 22 HG22 ILE 3 HG22 ILE 3 -20.278 11.665 -2.623 23 HG23 ILE 3 HG23 ILE 3 -21.309 11.099 -1.315 24 HD11 ILE 3 HD11 ILE 3 -20.554 11.112 -6.407 25 HD12 ILE 3 HD12 ILE 3 -21.763 12.156 -5.641 26 HD13 ILE 3 HD13 ILE 3 -20.185 11.925 -4.879 27 H ASN 4 H ASN 4 -22.476 7.454 -3.989 28 HA ASN 4 HA ASN 4 -21.470 6.104 -1.525 29 HB2 ASN 4 HB2 ASN 4 -22.153 3.968 -2.603 30 HB3 ASN 4 HB3 ASN 4 -23.461 5.012 -2.076 31 HD21 ASN 4 HD21 ASN 4 -21.727 3.811 -5.002 32 HD22 ASN 4 HD22 ASN 4 -22.957 4.358 -6.120 33 H GLU 5 H GLU 5 -21.056 6.033 -5.098 34 HA GLU 5 HA GLU 5 -18.635 4.651 -5.158 35 HB2 GLU 5 HB2 GLU 5 -19.813 6.785 -6.936 36 HB3 GLU 5 HB3 GLU 5 -18.286 5.996 -7.345 37 HG2 GLU 5 HG2 GLU 5 -19.216 4.002 -7.823 38 HG3 GLU 5 HG3 GLU 5 -20.468 4.103 -6.597 39 H GLN 6 H GLN 6 -19.108 8.110 -4.737 40 HA GLN 6 HA GLN 6 -16.280 8.707 -4.832 41 HB2 GLN 6 HB2 GLN 6 -18.474 10.170 -5.208 42 HB3 GLN 6 HB3 GLN 6 -18.248 10.565 -3.515 43 HG2 GLN 6 HG2 GLN 6 -16.038 11.481 -3.977 44 HG3 GLN 6 HG3 GLN 6 -16.057 10.843 -5.632 45 HE21 GLN 6 HE21 GLN 6 -18.085 12.937 -3.512 46 HE22 GLN 6 HE22 GLN 6 -18.606 13.994 -4.833 47 H THR 7 H THR 7 -18.539 7.782 -2.293 48 HA THR 7 HA THR 7 -16.911 8.639 -0.093 49 HB THR 7 HB THR 7 -19.112 6.549 -0.239 50 HG1 THR 7 HG1 THR 7 -20.476 8.192 -0.040 51 HG21 THR 7 HG21 THR 7 -17.797 7.972 2.115 52 HG22 THR 7 HG22 THR 7 -17.802 6.236 1.757 53 HG23 THR 7 HG23 THR 7 -19.315 7.025 2.227 54 H LEU 8 H LEU 8 -17.196 5.585 -1.979 55 HA LEU 8 HA LEU 8 -15.850 3.741 -0.391 56 HB2 LEU 8 HB2 LEU 8 -15.193 3.977 -3.341 57 HB3 LEU 8 HB3 LEU 8 -15.350 2.554 -2.311 58 HG LEU 8 HG LEU 8 -17.591 4.298 -3.324 59 HD11 LEU 8 HD11 LEU 8 -18.248 2.436 -4.732 60 HD12 LEU 8 HD12 LEU 8 -16.934 1.464 -4.076 61 HD13 LEU 8 HD13 LEU 8 -16.560 2.882 -5.061 62 HD21 LEU 8 HD21 LEU 8 -18.252 3.431 -1.188 63 HD22 LEU 8 HD22 LEU 8 -17.713 1.793 -1.643 64 HD23 LEU 8 HD23 LEU 8 -19.101 2.557 -2.459 65 H ASP 9 H ASP 9 -14.571 6.546 -2.149 66 HA ASP 9 HA ASP 9 -11.831 6.005 -2.365 67 HB2 ASP 9 HB2 ASP 9 -12.953 8.009 -3.217 68 HB3 ASP 9 HB3 ASP 9 -13.183 8.591 -1.565 69 H LYS 10 H LYS 10 -13.646 7.289 0.524 70 HA LYS 10 HA LYS 10 -11.222 7.428 2.077 71 HB2 LYS 10 HB2 LYS 10 -12.449 8.065 3.928 72 HB3 LYS 10 HB3 LYS 10 -13.383 8.711 2.576 73 HG2 LYS 10 HG2 LYS 10 -14.943 6.865 2.731 74 HG3 LYS 10 HG3 LYS 10 -14.051 6.146 4.080 75 HD2 LYS 10 HD2 LYS 10 -15.473 8.825 4.083 76 HD3 LYS 10 HD3 LYS 10 -16.087 7.280 4.686 77 HE2 LYS 10 HE2 LYS 10 -15.257 7.913 6.685 78 HE3 LYS 10 HE3 LYS 10 -13.745 7.298 6.019 79 HZ1 LYS 10 HZ1 LYS 10 -14.621 10.067 6.440 80 HZ2 LYS 10 HZ2 LYS 10 -13.605 9.828 5.196 81 HZ3 LYS 10 HZ3 LYS 10 -13.141 9.426 6.716 82 H LEU 11 H LEU 11 -13.398 4.809 1.314 83 HA LEU 11 HA LEU 11 -12.591 3.081 3.525 84 HB2 LEU 11 HB2 LEU 11 -14.295 2.595 1.017 85 HB3 LEU 11 HB3 LEU 11 -13.839 1.379 2.208 86 HG LEU 11 HG LEU 11 -15.983 1.901 2.681 87 HD11 LEU 11 HD11 LEU 11 -14.764 1.644 4.641 88 HD12 LEU 11 HD12 LEU 11 -16.027 2.832 4.902 89 HD13 LEU 11 HD13 LEU 11 -14.357 3.402 4.730 90 HD21 LEU 11 HD21 LEU 11 -15.347 4.830 2.461 91 HD22 LEU 11 HD22 LEU 11 -16.827 4.232 3.239 92 HD23 LEU 11 HD23 LEU 11 -16.519 3.899 1.547 93 H ARG 12 H ARG 12 -12.101 3.065 -0.048 94 HA ARG 12 HA ARG 12 -10.331 0.867 -0.001 95 HB2 ARG 12 HB2 ARG 12 -9.647 1.716 -2.338 96 HB3 ARG 12 HB3 ARG 12 -11.269 1.228 -2.024 97 HG2 ARG 12 HG2 ARG 12 -12.156 3.113 -2.628 98 HG3 ARG 12 HG3 ARG 12 -11.048 4.079 -1.619 99 HD2 ARG 12 HD2 ARG 12 -9.535 4.374 -3.217 100 HD3 ARG 12 HD3 ARG 12 -9.971 2.916 -4.142 101 HE ARG 12 HE ARG 12 -12.178 4.225 -4.629 102 HH11 ARG 12 HH11 ARG 12 -8.964 5.789 -4.376 103 HH12 ARG 12 HH12 ARG 12 -9.469 7.089 -5.398 104 HH21 ARG 12 HH21 ARG 12 -12.707 5.862 -6.013 105 HH22 ARG 12 HH22 ARG 12 -11.576 7.203 -6.250 106 H GLN 13 H GLN 13 -9.549 4.335 0.183 107 HA GLN 13 HA GLN 13 -6.771 3.965 0.214 108 HB2 GLN 13 HB2 GLN 13 -6.581 6.212 0.954 109 HB3 GLN 13 HB3 GLN 13 -7.927 6.078 -0.176 110 HG2 GLN 13 HG2 GLN 13 -8.895 7.358 1.459 111 HG3 GLN 13 HG3 GLN 13 -9.393 5.758 1.927 112 HE21 GLN 13 HE21 GLN 13 -9.697 6.064 4.021 113 HE22 GLN 13 HE22 GLN 13 -8.499 6.532 5.193 114 H ALA 14 H ALA 14 -9.144 3.431 2.784 115 HA ALA 14 HA ALA 14 -7.233 3.361 4.972 116 HB1 ALA 14 HB1 ALA 14 -10.105 2.382 4.665 117 HB2 ALA 14 HB2 ALA 14 -9.184 2.307 6.168 118 HB3 ALA 14 HB3 ALA 14 -9.564 3.880 5.437 119 H VAL 15 H VAL 15 -8.830 0.962 2.787 120 HA VAL 15 HA VAL 15 -7.741 -1.360 4.091 121 HB VAL 15 HB VAL 15 -8.517 -1.044 1.193 122 HG11 VAL 15 HG11 VAL 15 -7.200 -3.099 1.645 123 HG12 VAL 15 HG12 VAL 15 -8.322 -3.518 2.961 124 HG13 VAL 15 HG13 VAL 15 -8.880 -3.475 1.280 125 HG21 VAL 15 HG21 VAL 15 -10.239 -1.774 3.555 126 HG22 VAL 15 HG22 VAL 15 -10.477 -0.430 2.401 127 HG23 VAL 15 HG23 VAL 15 -10.619 -2.084 1.847 128 H LEU 16 H LEU 16 -6.729 0.424 1.075 129 HA LEU 16 HA LEU 16 -4.398 -1.013 0.713 130 HB2 LEU 16 HB2 LEU 16 -3.610 0.521 -0.830 131 HB3 LEU 16 HB3 LEU 16 -5.343 0.480 -0.953 132 HG LEU 16 HG LEU 16 -5.221 2.563 0.666 133 HD11 LEU 16 HD11 LEU 16 -3.219 4.015 -0.113 134 HD12 LEU 16 HD12 LEU 16 -2.452 2.488 -0.526 135 HD13 LEU 16 HD13 LEU 16 -2.915 2.837 1.155 136 HD21 LEU 16 HD21 LEU 16 -5.184 4.031 -1.371 137 HD22 LEU 16 HD22 LEU 16 -6.177 2.589 -1.607 138 HD23 LEU 16 HD23 LEU 16 -4.536 2.672 -2.295 139 H GLN 17 H GLN 17 -4.866 1.621 3.062 140 HA GLN 17 HA GLN 17 -2.154 2.232 3.548 141 HB2 GLN 17 HB2 GLN 17 -4.662 2.294 5.181 142 HB3 GLN 17 HB3 GLN 17 -3.120 2.366 6.054 143 HG2 GLN 17 HG2 GLN 17 -2.455 4.319 4.705 144 HG3 GLN 17 HG3 GLN 17 -3.970 4.219 3.824 145 HE21 GLN 17 HE21 GLN 17 -5.313 5.963 4.534 146 HE22 GLN 17 HE22 GLN 17 -5.434 6.387 6.225 147 H LYS 18 H LYS 18 -4.128 -0.564 4.863 148 HA LYS 18 HA LYS 18 -1.804 -1.494 6.340 149 HB2 LYS 18 HB2 LYS 18 -3.008 -3.344 6.996 150 HB3 LYS 18 HB3 LYS 18 -4.108 -1.981 7.047 151 HG2 LYS 18 HG2 LYS 18 -4.401 -3.278 4.481 152 HG3 LYS 18 HG3 LYS 18 -4.385 -4.516 5.700 153 HD2 LYS 18 HD2 LYS 18 -6.217 -2.085 5.924 154 HD3 LYS 18 HD3 LYS 18 -6.627 -3.519 4.981 155 HE2 LYS 18 HE2 LYS 18 -7.612 -4.008 7.030 156 HE3 LYS 18 HE3 LYS 18 -6.090 -4.905 7.069 157 HZ1 LYS 18 HZ1 LYS 18 -6.542 -2.281 8.418 158 HZ2 LYS 18 HZ2 LYS 18 -5.181 -3.218 8.508 159 HZ3 LYS 18 HZ3 LYS 18 -6.566 -3.738 9.137 160 H LYS 19 H LYS 19 -3.164 -2.133 3.088 161 HA LYS 19 HA LYS 19 -1.539 -4.292 2.379 162 HB2 LYS 19 HB2 LYS 19 -2.618 -2.070 0.617 163 HB3 LYS 19 HB3 LYS 19 -1.742 -3.450 0.025 164 HG2 LYS 19 HG2 LYS 19 -3.324 -4.994 1.060 165 HG3 LYS 19 HG3 LYS 19 -4.254 -3.643 1.751 166 HD2 LYS 19 HD2 LYS 19 -5.190 -3.044 -0.302 167 HD3 LYS 19 HD3 LYS 19 -3.846 -3.739 -1.202 168 HE2 LYS 19 HE2 LYS 19 -6.186 -4.892 -1.255 169 HE3 LYS 19 HE3 LYS 19 -4.669 -5.826 -1.243 170 HZ1 LYS 19 HZ1 LYS 19 -6.757 -5.737 0.699 171 HZ2 LYS 19 HZ2 LYS 19 -5.243 -5.710 1.365 172 HZ3 LYS 19 HZ3 LYS 19 -5.682 -6.920 0.353 173 H ILE 20 H ILE 20 -0.654 -0.781 2.416 174 HA ILE 20 HA ILE 20 1.770 -1.141 1.045 175 HB ILE 20 HB ILE 20 1.425 0.864 3.297 176 HG12 ILE 20 HG12 ILE 20 -0.498 1.278 2.003 177 HG13 ILE 20 HG13 ILE 20 0.668 2.481 1.520 178 HG21 ILE 20 HG21 ILE 20 3.092 0.932 0.738 179 HG22 ILE 20 HG22 ILE 20 2.955 2.247 1.925 180 HG23 ILE 20 HG23 ILE 20 3.700 0.714 2.374 181 HD11 ILE 20 HD11 ILE 20 1.205 0.958 -0.481 182 HD12 ILE 20 HD12 ILE 20 -0.254 0.048 -0.060 183 HD13 ILE 20 HD13 ILE 20 -0.363 1.764 -0.490 184 H LYS 21 H LYS 21 0.936 -1.732 4.417 185 HA LYS 21 HA LYS 21 3.591 -2.263 5.459 186 HB2 LYS 21 HB2 LYS 21 1.037 -3.383 6.620 187 HB3 LYS 21 HB3 LYS 21 2.514 -2.895 7.432 188 HG2 LYS 21 HG2 LYS 21 1.995 -0.484 6.827 189 HG3 LYS 21 HG3 LYS 21 0.491 -1.041 6.099 190 HD2 LYS 21 HD2 LYS 21 -0.171 -1.983 8.351 191 HD3 LYS 21 HD3 LYS 21 1.236 -1.099 9.016 192 HE2 LYS 21 HE2 LYS 21 0.322 0.974 7.819 193 HE3 LYS 21 HE3 LYS 21 -1.125 0.041 7.426 194 HZ1 LYS 21 HZ1 LYS 21 -0.590 1.432 9.774 195 HZ2 LYS 21 HZ2 LYS 21 -0.695 -0.159 10.169 196 HZ3 LYS 21 HZ3 LYS 21 -1.933 0.525 9.396 197 H GLU 22 H GLU 22 0.942 -4.126 3.905 198 HA GLU 22 HA GLU 22 1.937 -6.712 4.673 199 HB2 GLU 22 HB2 GLU 22 0.016 -5.846 2.484 200 HB3 GLU 22 HB3 GLU 22 0.391 -7.528 2.879 201 HG2 GLU 22 HG2 GLU 22 -0.429 -7.219 5.145 202 HG3 GLU 22 HG3 GLU 22 -0.801 -5.526 4.843 203 H ARG 23 H ARG 23 2.055 -4.795 1.623 204 HA ARG 23 HA ARG 23 3.717 -6.668 0.283 205 HB2 ARG 23 HB2 ARG 23 4.046 -4.993 -1.422 206 HB3 ARG 23 HB3 ARG 23 2.385 -5.131 -0.911 207 HG2 ARG 23 HG2 ARG 23 2.537 -2.871 -1.106 208 HG3 ARG 23 HG3 ARG 23 2.834 -3.096 0.620 209 HD2 ARG 23 HD2 ARG 23 4.316 -1.411 -0.401 210 HD3 ARG 23 HD3 ARG 23 5.214 -2.744 0.310 211 HE ARG 23 HE ARG 23 4.594 -2.563 -2.638 212 HH11 ARG 23 HH11 ARG 23 7.105 -3.189 -0.095 213 HH12 ARG 23 HH12 ARG 23 8.324 -3.258 -1.328 214 HH21 ARG 23 HH21 ARG 23 6.243 -2.826 -4.058 215 HH22 ARG 23 HH22 ARG 23 7.842 -3.252 -3.523 216 H ILE 24 H ILE 24 4.687 -4.053 2.500 217 HA ILE 24 HA ILE 24 7.510 -4.386 1.803 218 HB ILE 24 HB ILE 24 6.707 -2.230 2.580 219 HG12 ILE 24 HG12 ILE 24 8.710 -3.550 4.468 220 HG13 ILE 24 HG13 ILE 24 9.043 -2.580 3.034 221 HG21 ILE 24 HG21 ILE 24 5.794 -1.760 4.710 222 HG22 ILE 24 HG22 ILE 24 4.979 -3.190 4.143 223 HG23 ILE 24 HG23 ILE 24 6.236 -3.362 5.363 224 HD11 ILE 24 HD11 ILE 24 7.884 -1.640 5.666 225 HD12 ILE 24 HD12 ILE 24 9.479 -1.246 4.997 226 HD13 ILE 24 HD13 ILE 24 7.996 -0.609 4.225 227 H GLN 25 H GLN 25 5.363 -5.470 4.549 228 HA GLN 25 HA GLN 25 7.514 -6.730 5.951 229 HB2 GLN 25 HB2 GLN 25 5.307 -5.949 6.878 230 HB3 GLN 25 HB3 GLN 25 4.531 -7.334 6.094 231 HG2 GLN 25 HG2 GLN 25 6.113 -8.808 7.429 232 HG3 GLN 25 HG3 GLN 25 6.571 -7.350 8.323 233 HE21 GLN 25 HE21 GLN 25 4.896 -9.895 8.992 234 HE22 GLN 25 HE22 GLN 25 3.264 -9.363 9.388 235 H ASN 26 H ASN 26 4.913 -8.055 3.818 236 HA ASN 26 HA ASN 26 6.043 -10.730 3.998 237 HB2 ASN 26 HB2 ASN 26 3.842 -9.638 2.204 238 HB3 ASN 26 HB3 ASN 26 4.234 -11.336 2.451 239 HD21 ASN 26 HD21 ASN 26 2.880 -8.482 3.970 240 HD22 ASN 26 HD22 ASN 26 2.355 -9.178 5.476 241 H SER 27 H SER 27 5.722 -8.338 1.322 242 HA SER 27 HA SER 27 6.724 -8.098 -0.643 243 HB2 SER 27 HB2 SER 27 8.487 -7.482 1.162 244 HB3 SER 27 HB3 SER 27 9.309 -8.965 0.628 245 HG SER 27 HG SER 27 8.454 -6.875 -1.108 246 H LEU 28 H LEU 28 5.592 -10.663 -0.183 247 HA LEU 28 HA LEU 28 6.875 -12.239 -2.289 248 HB2 LEU 28 HB2 LEU 28 6.484 -14.312 -0.979 249 HB3 LEU 28 HB3 LEU 28 7.662 -13.233 -0.256 250 HG LEU 28 HG LEU 28 5.754 -12.354 1.243 251 HD11 LEU 28 HD11 LEU 28 3.776 -13.181 0.305 252 HD12 LEU 28 HD12 LEU 28 4.029 -14.097 1.773 253 HD13 LEU 28 HD13 LEU 28 4.403 -14.841 0.207 254 HD21 LEU 28 HD21 LEU 28 6.657 -15.195 1.734 255 HD22 LEU 28 HD22 LEU 28 6.134 -13.993 2.915 256 HD23 LEU 28 HD23 LEU 28 7.630 -13.736 2.025 257 H SER 29 H SER 29 5.178 -14.134 -2.650 258 HA SER 29 HA SER 29 2.393 -13.017 -2.739 259 HB2 SER 29 HB2 SER 29 4.041 -14.540 -4.787 260 HB3 SER 29 HB3 SER 29 2.273 -14.275 -4.930 261 HG SER 29 HG SER 29 3.335 -12.616 -6.036 262 H THR 30 H THR 30 4.282 -16.081 -3.080 263 HA THR 30 HA THR 30 2.310 -17.442 -1.344 264 HB THR 30 HB THR 30 1.757 -17.529 -3.739 265 HG1 THR 30 HG1 THR 30 1.136 -19.180 -2.186 266 HG21 THR 30 HG21 THR 30 2.859 -18.980 -5.286 267 HG22 THR 30 HG22 THR 30 4.052 -19.456 -4.071 268 HG23 THR 30 HG23 THR 30 4.030 -17.785 -4.694 269 H GLU 31 H GLU 31 4.758 -16.271 -0.793 270 HA GLU 31 HA GLU 31 6.723 -16.502 0.219 271 HB2 GLU 31 HB2 GLU 31 6.032 -19.400 0.733 272 HB3 GLU 31 HB3 GLU 31 7.073 -18.346 1.684 273 HG2 GLU 31 HG2 GLU 31 5.045 -16.969 2.281 274 HG3 GLU 31 HG3 GLU 31 4.050 -18.205 1.484 275 H LYS 32 H LYS 32 6.356 -17.836 -2.580 276 HA LYS 32 HA LYS 32 7.979 -19.638 -3.459 277 HB2 LYS 32 HB2 LYS 32 7.465 -16.917 -4.535 278 HB3 LYS 32 HB3 LYS 32 8.810 -17.802 -5.301 279 HG2 LYS 32 HG2 LYS 32 7.391 -19.703 -5.756 280 HG3 LYS 32 HG3 LYS 32 6.092 -19.028 -4.772 281 HD2 LYS 32 HD2 LYS 32 5.909 -17.109 -6.414 282 HD3 LYS 32 HD3 LYS 32 7.108 -17.949 -7.421 283 HE2 LYS 32 HE2 LYS 32 5.366 -20.001 -6.870 284 HE3 LYS 32 HE3 LYS 32 4.244 -18.635 -6.805 285 HZ1 LYS 32 HZ1 LYS 32 4.936 -18.062 -9.045 286 HZ2 LYS 32 HZ2 LYS 32 4.446 -19.666 -8.992 287 HZ3 LYS 32 HZ3 LYS 32 6.026 -19.301 -9.061 288 H TYR 33 H TYR 33 9.765 -16.526 -3.110 289 HA TYR 33 HA TYR 33 11.899 -17.930 -1.708 290 HB2 TYR 33 HB2 TYR 33 12.238 -18.125 -4.335 291 HB3 TYR 33 HB3 TYR 33 12.841 -16.489 -4.186 292 HD1 TYR 33 HD1 TYR 33 14.429 -16.544 -1.611 293 HD2 TYR 33 HD2 TYR 33 14.014 -19.566 -4.675 294 HE1 TYR 33 HE1 TYR 33 16.576 -17.446 -0.972 295 HE2 TYR 33 HE2 TYR 33 16.233 -20.473 -4.037 296 HH TYR 33 HH TYR 33 18.205 -19.004 -1.432 297 H GLY 34 H GLY 34 10.076 -16.190 -0.802 298 HA2 GLY 34 HA2 GLY 34 9.775 -14.199 0.290 299 HA3 GLY 34 HA3 GLY 34 11.540 -14.123 0.412 300 H SER 35 H SER 35 12.402 -12.308 -0.507 301 HA SER 35 HA SER 35 11.075 -11.062 -2.857 302 HB2 SER 35 HB2 SER 35 10.781 -10.011 -0.567 303 HB3 SER 35 HB3 SER 35 12.512 -9.708 -0.550 304 HG SER 35 HG SER 35 10.476 -8.457 -1.869 305 H GLY 36 H GLY 36 14.302 -10.954 -1.082 306 HA2 GLY 36 HA2 GLY 36 15.838 -11.985 -3.203 307 HA3 GLY 36 HA3 GLY 36 15.771 -10.227 -3.401 308 H SER 37 H SER 37 18.207 -11.073 -3.021 309 HA SER 37 HA SER 37 18.958 -11.399 -0.290 310 HB2 SER 37 HB2 SER 37 20.134 -12.390 -2.249 311 HB3 SER 37 HB3 SER 37 20.791 -10.793 -2.618 312 HG SER 37 HG SER 37 21.297 -12.561 -0.519 313 H GLY 38 H GLY 38 20.235 -8.708 -2.438 314 HA2 GLY 38 HA2 GLY 38 19.340 -6.526 -1.053 315 HA3 GLY 38 HA3 GLY 38 20.694 -7.093 -0.073 316 H SER 39 H SER 39 22.551 -6.009 -0.517 317 HA SER 39 HA SER 39 23.538 -5.788 -3.223 318 HB2 SER 39 HB2 SER 39 23.754 -3.296 -3.157 319 HB3 SER 39 HB3 SER 39 22.096 -3.857 -3.263 320 HG SER 39 HG SER 39 23.307 -3.110 -0.809 321 H GLY 40 H GLY 40 25.513 -3.937 -2.804 322 HA2 GLY 40 HA2 GLY 40 27.125 -4.884 -0.496 323 HA3 GLY 40 HA3 GLY 40 27.770 -4.722 -2.148 324 H SER 41 H SER 41 29.094 -3.292 -0.455 325 HA SER 41 HA SER 41 28.026 -0.508 -0.382 326 HB2 SER 41 HB2 SER 41 30.321 -1.859 1.099 327 HB3 SER 41 HB3 SER 41 29.782 -0.179 1.328 328 HG SER 41 HG SER 41 28.838 -2.339 2.502 329 H GLY 42 H GLY 42 30.504 0.865 -0.279 330 HA2 GLY 42 HA2 GLY 42 32.098 0.193 -2.608 331 HA3 GLY 42 HA3 GLY 42 31.118 1.681 -2.727 332 H SER 43 H SER 43 34.086 1.545 -2.544 333 HA SER 43 HA SER 43 34.867 2.238 0.146 334 HB2 SER 43 HB2 SER 43 37.013 2.838 -1.227 335 HB3 SER 43 HB3 SER 43 36.514 1.142 -1.103 336 HG SER 43 HG SER 43 37.050 1.905 -3.276 337 H GLY 44 H GLY 44 35.147 4.102 -2.919 338 HA2 GLY 44 HA2 GLY 44 33.651 6.312 -2.528 339 HA3 GLY 44 HA3 GLY 44 35.069 6.636 -1.500 340 H SER 45 H SER 45 34.849 8.384 -3.469 341 HA SER 45 HA SER 45 36.762 7.568 -5.591 342 HB2 SER 45 HB2 SER 45 35.518 9.418 -6.879 343 HB3 SER 45 HB3 SER 45 34.689 7.872 -6.634 344 HG SER 45 HG SER 45 33.329 9.640 -6.148 345 H GLY 46 H GLY 46 36.775 9.185 -2.709 346 HA2 GLY 46 HA2 GLY 46 39.062 10.750 -3.378 347 HA3 GLY 46 HA3 GLY 46 37.626 11.762 -3.104 348 H SER 47 H SER 47 39.371 12.314 -1.304 349 HA SER 47 HA SER 47 38.581 10.936 1.185 350 HB2 SER 47 HB2 SER 47 41.027 11.173 1.885 351 HB3 SER 47 HB3 SER 47 40.680 9.956 0.656 352 HG SER 47 HG SER 47 41.859 12.509 0.252 353 H GLY 48 H GLY 48 39.790 12.520 3.023 354 HA2 GLY 48 HA2 GLY 48 39.537 14.498 4.148 355 HA3 GLY 48 HA3 GLY 48 40.012 15.257 2.626 356 H SER 49 H SER 49 37.013 13.390 2.948 357 HA SER 49 HA SER 49 35.365 15.836 3.096 358 HB2 SER 49 HB2 SER 49 34.015 14.694 1.159 359 HB3 SER 49 HB3 SER 49 35.442 15.670 0.779 360 HG SER 49 HG SER 49 36.622 13.902 0.388 361 H GLY 50 H GLY 50 34.605 12.440 2.288 362 HA2 GLY 50 HA2 GLY 50 33.985 10.764 3.932 363 HA3 GLY 50 HA3 GLY 50 33.463 12.045 5.032 364 H SER 51 H SER 51 31.538 10.431 4.983 365 HA SER 51 HA SER 51 29.424 11.512 3.316 366 HB2 SER 51 HB2 SER 51 30.416 9.732 1.888 367 HB3 SER 51 HB3 SER 51 30.311 8.581 3.233 368 HG SER 51 HG SER 51 28.398 8.169 2.631 369 H GLY 52 H GLY 52 27.348 10.835 4.245 370 HA2 GLY 52 HA2 GLY 52 26.705 9.088 6.234 371 HA3 GLY 52 HA3 GLY 52 27.423 10.438 7.132 372 H SER 53 H SER 53 24.689 9.357 5.262 373 HA SER 53 HA SER 53 23.137 11.794 5.918 374 HB2 SER 53 HB2 SER 53 23.419 10.474 3.182 375 HB3 SER 53 HB3 SER 53 22.079 11.543 3.623 376 HG SER 53 HG SER 53 24.842 12.228 3.577 377 H GLY 54 H GLY 54 20.715 11.259 5.889 378 HA2 GLY 54 HA2 GLY 54 19.445 8.881 5.411 379 HA3 GLY 54 HA3 GLY 54 20.215 8.632 6.991 380 H SER 55 H SER 55 17.874 8.516 7.676 381 HA SER 55 HA SER 55 16.299 9.306 9.037 382 HB2 SER 55 HB2 SER 55 18.084 11.085 9.691 383 HB3 SER 55 HB3 SER 55 17.160 12.188 8.657 384 HG SER 55 HG SER 55 16.430 12.419 10.660 385 H GLY 56 H GLY 56 14.280 10.785 8.971 386 HA2 GLY 56 HA2 GLY 56 12.829 12.174 7.601 387 HA3 GLY 56 HA3 GLY 56 13.347 11.249 6.173 388 H SER 57 H SER 57 10.789 11.502 8.302 389 HA SER 57 HA SER 57 9.838 8.850 7.644 390 HB2 SER 57 HB2 SER 57 9.324 8.281 10.002 391 HB3 SER 57 HB3 SER 57 11.064 8.364 9.709 392 HG SER 57 HG SER 57 10.432 9.370 11.629 393 H GLY 58 H GLY 58 7.587 8.649 8.077 394 HA2 GLY 58 HA2 GLY 58 5.702 10.112 9.266 395 HA3 GLY 58 HA3 GLY 58 6.066 11.137 7.857 396 H TYR 59 H TYR 59 5.013 10.661 6.039 397 HA TYR 59 HA TYR 59 3.133 8.524 5.867 398 HB2 TYR 59 HB2 TYR 59 2.590 9.499 3.688 399 HB3 TYR 59 HB3 TYR 59 2.622 10.629 5.011 400 HD1 TYR 59 HD1 TYR 59 4.154 12.488 5.110 401 HD2 TYR 59 HD2 TYR 59 4.298 9.681 1.836 402 HE1 TYR 59 HE1 TYR 59 5.536 14.057 3.800 403 HE2 TYR 59 HE2 TYR 59 5.658 11.250 0.532 404 HH TYR 59 HH TYR 59 6.101 14.539 1.524 405 H GLN3288 H GLN3288 3.157 7.732 3.278 406 HA GLN3288 HA GLN3288 4.770 5.374 3.340 407 HB2 GLN3288 HB2 GLN3288 3.680 4.902 1.257 408 HB3 GLN3288 HB3 GLN3288 2.497 5.727 2.256 409 HG2 GLN3288 HG2 GLN3288 3.530 7.904 1.008 410 HG3 GLN3288 HG3 GLN3288 3.984 6.706 -0.190 411 HE21 GLN3288 HE21 GLN3288 2.523 6.758 -1.832 412 HE22 GLN3288 HE22 GLN3288 0.818 7.156 -1.660 413 H ILE3289 H ILE3289 6.020 4.848 1.106 414 HA ILE3289 HA ILE3289 8.013 7.006 0.753 415 HB ILE3289 HB ILE3289 8.450 4.075 0.163 416 HG12 ILE3289 HG12 ILE3289 9.297 5.679 2.623 417 HG13 ILE3289 HG13 ILE3289 8.050 4.434 2.615 418 HG21 ILE3289 HG21 ILE3289 10.294 6.504 0.455 419 HG22 ILE3289 HG22 ILE3289 10.833 4.857 0.090 420 HG23 ILE3289 HG23 ILE3289 9.850 5.735 -1.078 421 HD11 ILE3289 HD11 ILE3289 11.010 3.998 2.130 422 HD12 ILE3289 HD12 ILE3289 10.033 3.458 3.493 423 HD13 ILE3289 HD13 ILE3289 9.748 2.756 1.898 424 H GLU3290 H GLU3290 7.139 8.195 -0.767 425 HA GLU3290 HA GLU3290 5.588 7.225 -3.000 426 HB2 GLU3290 HB2 GLU3290 5.290 9.338 -1.753 427 HB3 GLU3290 HB3 GLU3290 6.776 9.976 -2.470 428 HG2 GLU3290 HG2 GLU3290 5.819 10.130 -4.612 429 HG3 GLU3290 HG3 GLU3290 4.641 8.862 -4.293 430 H THR3291 H THR3291 8.860 7.165 -2.410 431 HA THR3291 HA THR3291 9.530 7.008 -5.299 432 HB THR3291 HB THR3291 10.175 9.129 -4.257 433 HG1 THR3291 HG1 THR3291 11.482 8.096 -5.924 434 HG21 THR3291 HG21 THR3291 11.961 9.304 -2.606 435 HG22 THR3291 HG22 THR3291 12.055 7.540 -2.471 436 HG23 THR3291 HG23 THR3291 10.600 8.411 -1.937 437 H PHE3292 H PHE3292 8.688 4.708 -3.874 438 HA PHE3292 HA PHE3292 11.136 3.127 -4.214 439 HB2 PHE3292 HB2 PHE3292 11.181 3.705 -1.867 440 HB3 PHE3292 HB3 PHE3292 9.520 3.151 -1.637 441 HD1 PHE3292 HD1 PHE3292 12.216 1.290 -3.574 442 HD2 PHE3292 HD2 PHE3292 9.850 1.523 0.028 443 HE1 PHE3292 HE1 PHE3292 12.925 -0.978 -2.961 444 HE2 PHE3292 HE2 PHE3292 10.594 -0.757 0.656 445 HZ PHE3292 HZ PHE3292 12.098 -2.037 -0.857 446 H PHE3293 H PHE3293 8.108 2.164 -2.634 447 HA PHE3293 HA PHE3293 7.575 0.212 -4.736 448 HB2 PHE3293 HB2 PHE3293 5.696 -0.331 -3.063 449 HB3 PHE3293 HB3 PHE3293 7.394 -0.564 -2.650 450 HD1 PHE3293 HD1 PHE3293 7.912 -0.244 -0.471 451 HD2 PHE3293 HD2 PHE3293 5.068 2.411 -2.334 452 HE1 PHE3293 HE1 PHE3293 7.830 1.117 1.579 453 HE2 PHE3293 HE2 PHE3293 4.962 3.739 -0.272 454 HZ PHE3293 HZ PHE3293 6.255 3.026 1.764 455 H ALA3294 H ALA3294 7.023 3.382 -4.843 456 HA ALA3294 HA ALA3294 4.317 3.832 -5.233 457 HB1 ALA3294 HB1 ALA3294 5.004 5.736 -6.574 458 HB2 ALA3294 HB2 ALA3294 5.989 5.560 -5.115 459 HB3 ALA3294 HB3 ALA3294 6.655 5.075 -6.695 460 H GLN3295 H GLN3295 6.427 2.027 -7.350 461 HA GLN3295 HA GLN3295 4.846 2.244 -9.768 462 HB2 GLN3295 HB2 GLN3295 6.947 0.235 -8.808 463 HB3 GLN3295 HB3 GLN3295 6.255 0.226 -10.433 464 HG2 GLN3295 HG2 GLN3295 7.684 2.608 -9.211 465 HG3 GLN3295 HG3 GLN3295 8.468 1.392 -10.220 466 HE21 GLN3295 HE21 GLN3295 6.179 4.191 -10.305 467 HE22 GLN3295 HE22 GLN3295 6.018 4.193 -12.030 468 H ASP3296 H ASP3296 5.066 -0.175 -7.157 469 HA ASP3296 HA ASP3296 2.941 -1.791 -8.429 470 HB2 ASP3296 HB2 ASP3296 3.130 -3.288 -6.490 471 HB3 ASP3296 HB3 ASP3296 4.617 -3.086 -7.409 472 H ILE3297 H ILE3297 3.229 0.639 -5.969 473 HA ILE3297 HA ILE3297 0.851 0.276 -4.547 474 HB ILE3297 HB ILE3297 2.846 2.355 -5.000 475 HG12 ILE3297 HG12 ILE3297 2.719 2.748 -2.714 476 HG13 ILE3297 HG13 ILE3297 1.098 2.051 -2.565 477 HG21 ILE3297 HG21 ILE3297 1.563 4.327 -4.202 478 HG22 ILE3297 HG22 ILE3297 1.210 3.803 -5.857 479 HG23 ILE3297 HG23 ILE3297 0.061 3.433 -4.572 480 HD11 ILE3297 HD11 ILE3297 1.968 -0.182 -2.714 481 HD12 ILE3297 HD12 ILE3297 3.521 0.382 -3.347 482 HD13 ILE3297 HD13 ILE3297 3.100 0.691 -1.665 483 H GLU3298 H GLU3298 1.284 2.048 -7.613 484 HA GLU3298 HA GLU3298 -1.384 3.072 -7.736 485 HB2 GLU3298 HB2 GLU3298 -0.836 3.192 -10.239 486 HB3 GLU3298 HB3 GLU3298 0.209 4.099 -9.130 487 HG2 GLU3298 HG2 GLU3298 1.988 2.591 -9.316 488 HG3 GLU3298 HG3 GLU3298 1.000 1.315 -9.996 489 H SER3299 H SER3299 0.125 0.036 -8.770 490 HA SER3299 HA SER3299 -2.077 -1.012 -10.202 491 HB2 SER3299 HB2 SER3299 0.087 -2.606 -8.774 492 HB3 SER3299 HB3 SER3299 -0.770 -2.948 -10.267 493 HG SER3299 HG SER3299 0.235 -0.962 -11.099 494 H VAL3300 H VAL3300 -1.022 -1.228 -6.858 495 HA VAL3300 HA VAL3300 -2.926 -3.160 -5.913 496 HB VAL3300 HB VAL3300 -1.015 -1.122 -4.703 497 HG11 VAL3300 HG11 VAL3300 -2.797 -1.340 -3.013 498 HG12 VAL3300 HG12 VAL3300 -2.594 -3.112 -3.058 499 HG13 VAL3300 HG13 VAL3300 -1.279 -2.078 -2.488 500 HG21 VAL3300 HG21 VAL3300 -0.130 -3.187 -5.820 501 HG22 VAL3300 HG22 VAL3300 0.282 -3.082 -4.105 502 HG23 VAL3300 HG23 VAL3300 -1.031 -4.158 -4.648 503 H GLN3301 H GLN3301 -2.752 0.449 -5.733 504 HA GLN3301 HA GLN3301 -5.323 0.611 -4.468 505 HB2 GLN3301 HB2 GLN3301 -5.234 2.913 -4.552 506 HB3 GLN3301 HB3 GLN3301 -3.564 2.366 -4.416 507 HG2 GLN3301 HG2 GLN3301 -3.183 3.887 -6.024 508 HG3 GLN3301 HG3 GLN3301 -3.709 2.579 -7.072 509 HE21 GLN3301 HE21 GLN3301 -6.684 2.815 -6.607 510 HE22 GLN3301 HE22 GLN3301 -7.086 4.245 -7.497 511 H LYS3302 H LYS3302 -4.386 0.510 -7.877 512 HA LYS3302 HA LYS3302 -6.847 1.270 -9.035 513 HB2 LYS3302 HB2 LYS3302 -4.456 -0.299 -9.934 514 HB3 LYS3302 HB3 LYS3302 -5.915 -0.313 -10.936 515 HG2 LYS3302 HG2 LYS3302 -5.921 2.036 -11.247 516 HG3 LYS3302 HG3 LYS3302 -4.810 2.317 -9.910 517 HD2 LYS3302 HD2 LYS3302 -3.718 2.720 -12.024 518 HD3 LYS3302 HD3 LYS3302 -2.942 1.401 -11.160 519 HE2 LYS3302 HE2 LYS3302 -4.196 -0.236 -12.605 520 HE3 LYS3302 HE3 LYS3302 -4.791 1.149 -13.546 521 HZ1 LYS3302 HZ1 LYS3302 -1.968 0.320 -13.188 522 HZ2 LYS3302 HZ2 LYS3302 -2.383 1.760 -13.791 523 HZ3 LYS3302 HZ3 LYS3302 -2.808 0.429 -14.616 524 H GLU3303 H GLU3303 -5.919 -1.696 -7.392 525 HA GLU3303 HA GLU3303 -8.085 -3.263 -8.553 526 HB2 GLU3303 HB2 GLU3303 -7.152 -5.018 -7.514 527 HB3 GLU3303 HB3 GLU3303 -5.788 -3.949 -7.225 528 HG2 GLU3303 HG2 GLU3303 -6.868 -3.380 -4.986 529 HG3 GLU3303 HG3 GLU3303 -8.058 -4.643 -5.321 530 H LEU3304 H LEU3304 -7.680 -1.427 -5.498 531 HA LEU3304 HA LEU3304 -10.270 -2.073 -4.476 532 HB2 LEU3304 HB2 LEU3304 -8.456 0.276 -3.851 533 HB3 LEU3304 HB3 LEU3304 -9.777 -0.318 -2.864 534 HG LEU3304 HG LEU3304 -7.175 -1.632 -3.464 535 HD11 LEU3304 HD11 LEU3304 -8.519 -0.747 -0.899 536 HD12 LEU3304 HD12 LEU3304 -7.284 0.163 -1.781 537 HD13 LEU3304 HD13 LEU3304 -6.860 -1.399 -1.029 538 HD21 LEU3304 HD21 LEU3304 -7.836 -3.509 -1.947 539 HD22 LEU3304 HD22 LEU3304 -8.816 -3.472 -3.406 540 HD23 LEU3304 HD23 LEU3304 -9.488 -2.854 -1.889 541 H GLU3305 H GLU3305 -9.274 0.649 -6.512 542 HA GLU3305 HA GLU3305 -11.425 2.357 -5.722 543 HB2 GLU3305 HB2 GLU3305 -10.968 3.538 -7.901 544 HB3 GLU3305 HB3 GLU3305 -9.594 3.367 -6.793 545 HG2 GLU3305 HG2 GLU3305 -8.724 1.498 -8.019 546 HG3 GLU3305 HG3 GLU3305 -10.136 1.426 -9.053 547 H ASN3306 H ASN3306 -11.582 -0.530 -7.556 548 HA ASN3306 HA ASN3306 -14.229 0.283 -8.652 549 HB2 ASN3306 HB2 ASN3306 -14.124 -1.559 -10.142 550 HB3 ASN3306 HB3 ASN3306 -12.624 -0.671 -10.279 551 HD21 ASN3306 HD21 ASN3306 -10.785 -1.894 -10.221 552 HD22 ASN3306 HD22 ASN3306 -10.671 -3.486 -9.486 553 H LEU3307 H LEU3307 -12.943 -1.141 -5.815 554 HA LEU3307 HA LEU3307 -15.079 -3.172 -5.629 555 HB2 LEU3307 HB2 LEU3307 -12.643 -2.372 -4.067 556 HB3 LEU3307 HB3 LEU3307 -13.974 -2.909 -3.129 557 HG LEU3307 HG LEU3307 -13.067 -4.937 -3.320 558 HD11 LEU3307 HD11 LEU3307 -13.677 -6.382 -5.106 559 HD12 LEU3307 HD12 LEU3307 -13.860 -5.020 -6.242 560 HD13 LEU3307 HD13 LEU3307 -15.004 -5.246 -4.909 561 HD21 LEU3307 HD21 LEU3307 -11.000 -4.146 -4.011 562 HD22 LEU3307 HD22 LEU3307 -11.571 -3.984 -5.694 563 HD23 LEU3307 HD23 LEU3307 -11.381 -5.597 -4.946 564 H SER3308 H SER3308 -16.664 -3.162 -3.945 565 HA SER3308 HA SER3308 -17.875 -0.513 -3.533 566 HB2 SER3308 HB2 SER3308 -19.034 -3.065 -2.456 567 HB3 SER3308 HB3 SER3308 -19.841 -1.674 -3.191 568 HG SER3308 HG SER3308 -18.645 -2.530 -5.209 569 H GLU3309 H GLU3309 -19.009 -0.248 -1.148 570 HA GLU3309 HA GLU3309 -16.876 -0.168 0.741 571 HB2 GLU3309 HB2 GLU3309 -19.920 0.001 0.925 572 HB3 GLU3309 HB3 GLU3309 -18.959 -0.156 2.403 573 HG2 GLU3309 HG2 GLU3309 -17.694 1.902 1.567 574 HG3 GLU3309 HG3 GLU3309 -18.993 2.090 0.408 575 H GLU3310 H GLU3310 -19.530 -2.492 0.313 576 HA GLU3310 HA GLU3310 -19.139 -4.208 2.382 577 HB2 GLU3310 HB2 GLU3310 -19.624 -5.058 -0.495 578 HB3 GLU3310 HB3 GLU3310 -19.952 -6.073 0.897 579 HG2 GLU3310 HG2 GLU3310 -21.314 -3.413 0.434 580 HG3 GLU3310 HG3 GLU3310 -21.918 -4.898 -0.237 581 H GLU3311 H GLU3311 -16.995 -3.790 -0.354 582 HA GLU3311 HA GLU3311 -15.533 -6.316 0.174 583 HB2 GLU3311 HB2 GLU3311 -15.205 -4.011 -1.736 584 HB3 GLU3311 HB3 GLU3311 -14.192 -5.448 -1.714 585 HG2 GLU3311 HG2 GLU3311 -17.186 -5.794 -1.993 586 HG3 GLU3311 HG3 GLU3311 -16.357 -5.156 -3.333 587 H LEU3312 H LEU3312 -14.952 -2.820 0.054 588 HA LEU3312 HA LEU3312 -12.358 -2.988 1.266 589 HB2 LEU3312 HB2 LEU3312 -13.956 -0.434 1.134 590 HB3 LEU3312 HB3 LEU3312 -12.256 -0.601 1.039 591 HG LEU3312 HG LEU3312 -13.925 -1.814 -1.185 592 HD11 LEU3312 HD11 LEU3312 -14.934 0.243 -0.967 593 HD12 LEU3312 HD12 LEU3312 -13.860 0.321 -2.358 594 HD13 LEU3312 HD13 LEU3312 -13.375 1.123 -0.838 595 HD21 LEU3312 HD21 LEU3312 -11.913 -1.053 -2.479 596 HD22 LEU3312 HD22 LEU3312 -11.746 -2.428 -1.400 597 HD23 LEU3312 HD23 LEU3312 -11.093 -0.866 -0.908 598 H LEU3313 H LEU3313 -15.368 -1.518 2.464 599 HA LEU3313 HA LEU3313 -14.534 -0.659 5.003 600 HB2 LEU3313 HB2 LEU3313 -16.567 0.163 3.838 601 HB3 LEU3313 HB3 LEU3313 -17.310 -1.419 3.829 602 HG LEU3313 HG LEU3313 -18.251 0.094 5.483 603 HD11 LEU3313 HD11 LEU3313 -18.283 -2.473 5.610 604 HD12 LEU3313 HD12 LEU3313 -18.847 -1.527 6.969 605 HD13 LEU3313 HD13 LEU3313 -17.232 -2.288 7.015 606 HD21 LEU3313 HD21 LEU3313 -16.279 1.203 6.438 607 HD22 LEU3313 HD22 LEU3313 -15.741 -0.346 7.128 608 HD23 LEU3313 HD23 LEU3313 -17.237 0.398 7.684 609 H ALA3314 H ALA3314 -15.802 -3.813 3.796 610 HA ALA3314 HA ALA3314 -15.969 -4.891 6.418 611 HB1 ALA3314 HB1 ALA3314 -15.528 -6.206 3.717 612 HB2 ALA3314 HB2 ALA3314 -15.987 -7.076 5.212 613 HB3 ALA3314 HB3 ALA3314 -17.082 -5.883 4.500 614 H MET3315 H MET3315 -13.154 -4.484 4.271 615 HA MET3315 HA MET3315 -11.529 -6.496 5.629 616 HB2 MET3315 HB2 MET3315 -10.506 -4.193 3.926 617 HB3 MET3315 HB3 MET3315 -9.689 -5.715 4.284 618 HG2 MET3315 HG2 MET3315 -12.329 -6.096 3.121 619 HG3 MET3315 HG3 MET3315 -11.344 -5.059 2.128 620 HE1 MET3315 HE1 MET3315 -12.817 -7.792 1.348 621 HE2 MET3315 HE2 MET3315 -11.824 -6.957 0.140 622 HE3 MET3315 HE3 MET3315 -11.594 -8.689 0.435 623 H LEU3316 H LEU3316 -11.477 -2.942 5.503 624 HA LEU3316 HA LEU3316 -9.491 -2.610 7.547 625 HB2 LEU3316 HB2 LEU3316 -10.346 -0.273 7.678 626 HB3 LEU3316 HB3 LEU3316 -9.973 -0.820 6.053 627 HG LEU3316 HG LEU3316 -12.608 -1.362 6.048 628 HD11 LEU3316 HD11 LEU3316 -13.761 0.664 7.193 629 HD12 LEU3316 HD12 LEU3316 -12.274 0.919 8.103 630 HD13 LEU3316 HD13 LEU3316 -13.219 -0.550 8.330 631 HD21 LEU3316 HD21 LEU3316 -11.257 0.259 4.606 632 HD22 LEU3316 HD22 LEU3316 -11.693 1.511 5.824 633 HD23 LEU3316 HD23 LEU3316 -12.930 0.677 4.893 634 H ASN3317 H ASN3317 -13.058 -2.873 7.634 635 HA ASN3317 HA ASN3317 -13.160 -2.400 10.475 636 HB2 ASN3317 HB2 ASN3317 -15.062 -2.062 8.721 637 HB3 ASN3317 HB3 ASN3317 -15.342 -3.804 8.903 638 HD21 ASN3317 HD21 ASN3317 -15.155 -0.652 10.558 639 HD22 ASN3317 HD22 ASN3317 -16.076 -1.204 11.975 640 H GLY3318 H GLY3318 -12.817 -5.201 8.487 641 HA2 GLY3318 HA2 GLY3318 -12.035 -7.318 9.008 642 HA3 GLY3318 HA3 GLY3318 -12.102 -6.954 10.739 643 H ASP3319 H ASP3319 -14.934 -6.113 9.215 644 HA ASP3319 HA ASP3319 -16.498 -8.368 10.336 645 HB2 ASP3319 HB2 ASP3319 -17.016 -5.505 9.584 646 HB3 ASP3319 HB3 ASP3319 -18.352 -6.600 9.340 647 H GLN3320 H GLN3320 -18.649 -8.354 8.564 648 HA GLN3320 HA GLN3320 -17.541 -9.192 5.948 649 HB2 GLN3320 HB2 GLN3320 -18.981 -11.144 5.938 650 HB3 GLN3320 HB3 GLN3320 -17.995 -11.182 7.398 651 HG2 GLN3320 HG2 GLN3320 -19.965 -10.174 8.661 652 HG3 GLN3320 HG3 GLN3320 -20.930 -10.346 7.194 653 HE21 GLN3320 HE21 GLN3320 -21.536 -12.511 6.457 654 HE22 GLN3320 HE22 GLN3320 -21.221 -13.907 7.470 655 H GLN3321 H GLN3321 -18.783 -6.743 6.900 656 HA GLN3321 HA GLN3321 -21.354 -6.657 5.402 657 HB2 GLN3321 HB2 GLN3321 -19.944 -4.761 7.331 658 HB3 GLN3321 HB3 GLN3321 -21.191 -4.163 6.240 659 HG2 GLN3321 HG2 GLN3321 -21.651 -6.466 8.173 660 HG3 GLN3321 HG3 GLN3321 -21.983 -4.770 8.525 661 HE21 GLN3321 HE21 GLN3321 -23.710 -7.360 7.946 662 HE22 GLN3321 HE22 GLN3321 -25.004 -6.668 6.966 Start of MODEL 7 1 H1 MET 1 H MET 1 -24.223 13.480 4.046 2 HA MET 1 HA MET 1 -23.752 11.698 2.465 3 HB2 MET 1 HB2 MET 1 -24.569 11.149 4.761 4 HB3 MET 1 HB3 MET 1 -26.211 11.059 4.110 5 HG2 MET 1 HG2 MET 1 -25.472 9.249 2.565 6 HG3 MET 1 HG3 MET 1 -23.852 9.323 3.261 7 HE1 MET 1 HE1 MET 1 -23.148 8.361 5.536 8 HE2 MET 1 HE2 MET 1 -24.179 9.552 6.367 9 HE3 MET 1 HE3 MET 1 -24.273 7.841 6.811 10 H ASN 2 H ASN 2 -24.192 12.371 0.248 11 HA ASN 2 HA ASN 2 -26.861 11.483 -0.719 12 HB2 ASN 2 HB2 ASN 2 -25.533 14.144 -1.351 13 HB3 ASN 2 HB3 ASN 2 -26.860 13.458 -2.276 14 HD21 ASN 2 HD21 ASN 2 -26.044 15.061 0.777 15 HD22 ASN 2 HD22 ASN 2 -27.675 15.037 1.411 16 H ILE 3 H ILE 3 -24.172 10.170 -0.702 17 HA ILE 3 HA ILE 3 -24.087 9.457 -3.481 18 HB ILE 3 HB ILE 3 -22.705 11.641 -3.172 19 HG12 ILE 3 HG12 ILE 3 -21.093 9.402 -4.381 20 HG13 ILE 3 HG13 ILE 3 -22.623 9.941 -5.086 21 HG21 ILE 3 HG21 ILE 3 -21.585 10.947 -1.046 22 HG22 ILE 3 HG22 ILE 3 -20.626 9.780 -1.973 23 HG23 ILE 3 HG23 ILE 3 -20.474 11.510 -2.306 24 HD11 ILE 3 HD11 ILE 3 -20.399 11.912 -4.536 25 HD12 ILE 3 HD12 ILE 3 -20.593 11.019 -6.068 26 HD13 ILE 3 HD13 ILE 3 -21.842 12.131 -5.502 27 H ASN 4 H ASN 4 -22.407 7.726 -3.738 28 HA ASN 4 HA ASN 4 -21.705 6.218 -1.309 29 HB2 ASN 4 HB2 ASN 4 -22.567 4.119 -2.314 30 HB3 ASN 4 HB3 ASN 4 -23.811 5.222 -1.752 31 HD21 ASN 4 HD21 ASN 4 -22.387 3.660 -4.583 32 HD22 ASN 4 HD22 ASN 4 -23.400 4.443 -5.774 33 H GLU 5 H GLU 5 -21.552 6.339 -4.917 34 HA GLU 5 HA GLU 5 -19.207 4.874 -5.245 35 HB2 GLU 5 HB2 GLU 5 -20.315 7.227 -6.825 36 HB3 GLU 5 HB3 GLU 5 -18.923 6.269 -7.357 37 HG2 GLU 5 HG2 GLU 5 -20.261 4.218 -7.355 38 HG3 GLU 5 HG3 GLU 5 -21.676 5.126 -6.816 39 H GLN 6 H GLN 6 -19.565 8.279 -4.508 40 HA GLN 6 HA GLN 6 -16.626 8.722 -4.554 41 HB2 GLN 6 HB2 GLN 6 -18.867 10.575 -3.774 42 HB3 GLN 6 HB3 GLN 6 -17.171 10.966 -3.493 43 HG2 GLN 6 HG2 GLN 6 -16.635 10.716 -5.878 44 HG3 GLN 6 HG3 GLN 6 -18.317 10.297 -6.229 45 HE21 GLN 6 HE21 GLN 6 -18.613 12.191 -7.658 46 HE22 GLN 6 HE22 GLN 6 -18.926 13.721 -6.872 47 H THR 7 H THR 7 -18.996 7.696 -2.125 48 HA THR 7 HA THR 7 -17.360 8.470 0.141 49 HB THR 7 HB THR 7 -19.527 6.365 -0.101 50 HG1 THR 7 HG1 THR 7 -19.535 9.034 0.877 51 HG21 THR 7 HG21 THR 7 -18.168 5.887 1.813 52 HG22 THR 7 HG22 THR 7 -19.662 6.628 2.407 53 HG23 THR 7 HG23 THR 7 -18.140 7.575 2.314 54 H LEU 8 H LEU 8 -17.519 5.547 -2.016 55 HA LEU 8 HA LEU 8 -16.047 3.712 -0.514 56 HB2 LEU 8 HB2 LEU 8 -15.315 4.197 -3.400 57 HB3 LEU 8 HB3 LEU 8 -15.490 2.692 -2.494 58 HG LEU 8 HG LEU 8 -17.711 4.467 -3.560 59 HD11 LEU 8 HD11 LEU 8 -18.132 2.737 -5.185 60 HD12 LEU 8 HD12 LEU 8 -16.902 1.688 -4.468 61 HD13 LEU 8 HD13 LEU 8 -16.414 3.174 -5.289 62 HD21 LEU 8 HD21 LEU 8 -17.974 1.848 -2.138 63 HD22 LEU 8 HD22 LEU 8 -19.267 2.717 -3.018 64 HD23 LEU 8 HD23 LEU 8 -18.542 3.467 -1.615 65 H ASP 9 H ASP 9 -14.983 6.717 -2.113 66 HA ASP 9 HA ASP 9 -12.223 6.334 -2.278 67 HB2 ASP 9 HB2 ASP 9 -13.370 8.365 -3.109 68 HB3 ASP 9 HB3 ASP 9 -13.577 8.917 -1.435 69 H LYS 10 H LYS 10 -14.114 7.462 0.596 70 HA LYS 10 HA LYS 10 -11.719 7.734 2.188 71 HB2 LYS 10 HB2 LYS 10 -13.014 8.170 4.081 72 HB3 LYS 10 HB3 LYS 10 -13.904 8.897 2.729 73 HG2 LYS 10 HG2 LYS 10 -15.335 6.921 2.664 74 HG3 LYS 10 HG3 LYS 10 -14.511 6.210 4.051 75 HD2 LYS 10 HD2 LYS 10 -16.159 8.763 3.974 76 HD3 LYS 10 HD3 LYS 10 -16.708 7.150 4.483 77 HE2 LYS 10 HE2 LYS 10 -14.776 7.182 6.170 78 HE3 LYS 10 HE3 LYS 10 -14.609 8.897 5.807 79 HZ1 LYS 10 HZ1 LYS 10 -16.958 9.139 6.481 80 HZ2 LYS 10 HZ2 LYS 10 -16.049 8.509 7.730 81 HZ3 LYS 10 HZ3 LYS 10 -17.045 7.564 6.825 82 H LEU 11 H LEU 11 -13.615 5.010 1.235 83 HA LEU 11 HA LEU 11 -12.736 3.274 3.435 84 HB2 LEU 11 HB2 LEU 11 -14.419 2.719 0.939 85 HB3 LEU 11 HB3 LEU 11 -13.848 1.516 2.096 86 HG LEU 11 HG LEU 11 -16.046 1.889 2.632 87 HD11 LEU 11 HD11 LEU 11 -14.830 1.693 4.611 88 HD12 LEU 11 HD12 LEU 11 -16.130 2.844 4.859 89 HD13 LEU 11 HD13 LEU 11 -14.471 3.446 4.685 90 HD21 LEU 11 HD21 LEU 11 -16.541 3.978 1.495 91 HD22 LEU 11 HD22 LEU 11 -15.529 4.855 2.612 92 HD23 LEU 11 HD23 LEU 11 -17.028 4.130 3.181 93 H ARG 12 H ARG 12 -12.175 3.448 -0.140 94 HA ARG 12 HA ARG 12 -10.214 1.401 -0.103 95 HB2 ARG 12 HB2 ARG 12 -9.423 2.418 -2.298 96 HB3 ARG 12 HB3 ARG 12 -11.096 1.916 -2.195 97 HG2 ARG 12 HG2 ARG 12 -11.930 4.006 -2.387 98 HG3 ARG 12 HG3 ARG 12 -10.643 4.739 -1.422 99 HD2 ARG 12 HD2 ARG 12 -9.445 3.926 -3.840 100 HD3 ARG 12 HD3 ARG 12 -11.038 4.683 -4.201 101 HE ARG 12 HE ARG 12 -10.357 6.701 -3.224 102 HH11 ARG 12 HH11 ARG 12 -7.568 4.611 -3.927 103 HH12 ARG 12 HH12 ARG 12 -6.430 5.889 -3.610 104 HH21 ARG 12 HH21 ARG 12 -8.946 8.274 -2.951 105 HH22 ARG 12 HH22 ARG 12 -7.211 8.044 -3.059 106 H GLN 13 H GLN 13 -9.788 4.922 0.386 107 HA GLN 13 HA GLN 13 -6.960 4.801 0.461 108 HB2 GLN 13 HB2 GLN 13 -7.039 7.019 1.288 109 HB3 GLN 13 HB3 GLN 13 -8.301 6.821 0.081 110 HG2 GLN 13 HG2 GLN 13 -9.470 7.949 1.715 111 HG3 GLN 13 HG3 GLN 13 -9.832 6.285 2.087 112 HE21 GLN 13 HE21 GLN 13 -10.352 6.721 4.278 113 HE22 GLN 13 HE22 GLN 13 -9.114 7.192 5.425 114 H ALA 14 H ALA 14 -9.425 4.015 2.855 115 HA ALA 14 HA ALA 14 -7.643 3.970 5.131 116 HB1 ALA 14 HB1 ALA 14 -9.945 4.348 5.600 117 HB2 ALA 14 HB2 ALA 14 -10.484 3.036 4.562 118 HB3 ALA 14 HB3 ALA 14 -9.685 2.661 6.087 119 H VAL 15 H VAL 15 -8.979 1.538 2.811 120 HA VAL 15 HA VAL 15 -7.724 -0.717 4.041 121 HB VAL 15 HB VAL 15 -8.651 -0.340 1.167 122 HG11 VAL 15 HG11 VAL 15 -8.127 -2.914 2.718 123 HG12 VAL 15 HG12 VAL 15 -8.789 -2.799 1.085 124 HG13 VAL 15 HG13 VAL 15 -7.120 -2.308 1.388 125 HG21 VAL 15 HG21 VAL 15 -10.548 -0.052 2.581 126 HG22 VAL 15 HG22 VAL 15 -10.577 -1.716 2.066 127 HG23 VAL 15 HG23 VAL 15 -10.014 -1.317 3.701 128 H LEU 16 H LEU 16 -6.718 1.275 1.176 129 HA LEU 16 HA LEU 16 -4.386 -0.148 0.649 130 HB2 LEU 16 HB2 LEU 16 -3.649 1.550 -0.741 131 HB3 LEU 16 HB3 LEU 16 -5.396 1.578 -0.793 132 HG LEU 16 HG LEU 16 -5.155 3.497 0.984 133 HD11 LEU 16 HD11 LEU 16 -2.674 3.405 1.200 134 HD12 LEU 16 HD12 LEU 16 -3.199 4.937 0.519 135 HD13 LEU 16 HD13 LEU 16 -2.515 3.694 -0.540 136 HD21 LEU 16 HD21 LEU 16 -5.207 5.114 -0.916 137 HD22 LEU 16 HD22 LEU 16 -6.200 3.691 -1.297 138 HD23 LEU 16 HD23 LEU 16 -4.568 3.876 -1.987 139 H GLN 17 H GLN 17 -4.835 2.252 3.242 140 HA GLN 17 HA GLN 17 -2.108 2.606 3.874 141 HB2 GLN 17 HB2 GLN 17 -4.673 2.772 5.459 142 HB3 GLN 17 HB3 GLN 17 -3.109 2.914 6.294 143 HG2 GLN 17 HG2 GLN 17 -2.453 4.736 4.871 144 HG3 GLN 17 HG3 GLN 17 -3.889 4.545 3.867 145 HE21 GLN 17 HE21 GLN 17 -4.624 6.666 4.213 146 HE22 GLN 17 HE22 GLN 17 -5.242 7.246 5.740 147 H LYS 18 H LYS 18 -4.237 -0.265 4.767 148 HA LYS 18 HA LYS 18 -2.071 -1.220 6.488 149 HB2 LYS 18 HB2 LYS 18 -3.375 -3.067 6.940 150 HB3 LYS 18 HB3 LYS 18 -4.469 -1.694 6.910 151 HG2 LYS 18 HG2 LYS 18 -4.546 -2.790 4.276 152 HG3 LYS 18 HG3 LYS 18 -4.537 -4.166 5.342 153 HD2 LYS 18 HD2 LYS 18 -6.458 -1.815 5.761 154 HD3 LYS 18 HD3 LYS 18 -6.762 -3.098 4.598 155 HE2 LYS 18 HE2 LYS 18 -7.853 -3.966 6.382 156 HE3 LYS 18 HE3 LYS 18 -6.278 -4.749 6.517 157 HZ1 LYS 18 HZ1 LYS 18 -6.934 -2.311 8.071 158 HZ2 LYS 18 HZ2 LYS 18 -5.788 -3.466 8.403 159 HZ3 LYS 18 HZ3 LYS 18 -7.347 -3.803 8.588 160 H LYS 19 H LYS 19 -3.140 -1.692 3.129 161 HA LYS 19 HA LYS 19 -1.609 -3.923 2.482 162 HB2 LYS 19 HB2 LYS 19 -2.619 -1.627 0.805 163 HB3 LYS 19 HB3 LYS 19 -1.631 -2.904 0.127 164 HG2 LYS 19 HG2 LYS 19 -3.256 -4.598 1.191 165 HG3 LYS 19 HG3 LYS 19 -4.286 -3.225 1.642 166 HD2 LYS 19 HD2 LYS 19 -4.411 -2.620 -0.803 167 HD3 LYS 19 HD3 LYS 19 -3.527 -4.088 -1.174 168 HE2 LYS 19 HE2 LYS 19 -6.176 -4.000 0.310 169 HE3 LYS 19 HE3 LYS 19 -5.993 -4.297 -1.445 170 HZ1 LYS 19 HZ1 LYS 19 -6.250 -6.387 -0.428 171 HZ2 LYS 19 HZ2 LYS 19 -5.127 -6.084 0.739 172 HZ3 LYS 19 HZ3 LYS 19 -4.674 -6.245 -0.830 173 H ILE 20 H ILE 20 -0.538 -0.491 2.663 174 HA ILE 20 HA ILE 20 1.949 -0.850 1.460 175 HB ILE 20 HB ILE 20 1.647 0.912 3.907 176 HG12 ILE 20 HG12 ILE 20 -0.318 1.479 2.748 177 HG13 ILE 20 HG13 ILE 20 0.869 2.739 2.443 178 HG21 ILE 20 HG21 ILE 20 3.198 2.384 2.682 179 HG22 ILE 20 HG22 ILE 20 3.886 0.780 2.915 180 HG23 ILE 20 HG23 ILE 20 3.250 1.231 1.329 181 HD11 ILE 20 HD11 ILE 20 -0.365 2.304 0.413 182 HD12 ILE 20 HD12 ILE 20 1.307 1.755 0.201 183 HD13 ILE 20 HD13 ILE 20 0.003 0.576 0.492 184 H LYS 21 H LYS 21 0.996 -1.369 4.837 185 HA LYS 21 HA LYS 21 3.513 -2.130 5.932 186 HB2 LYS 21 HB2 LYS 21 0.842 -3.206 6.889 187 HB3 LYS 21 HB3 LYS 21 2.303 -2.889 7.823 188 HG2 LYS 21 HG2 LYS 21 2.003 -0.452 7.438 189 HG3 LYS 21 HG3 LYS 21 0.527 -0.774 6.509 190 HD2 LYS 21 HD2 LYS 21 -0.390 -1.987 8.535 191 HD3 LYS 21 HD3 LYS 21 0.938 -1.266 9.466 192 HE2 LYS 21 HE2 LYS 21 -1.026 0.241 7.696 193 HE3 LYS 21 HE3 LYS 21 -1.243 0.053 9.452 194 HZ1 LYS 21 HZ1 LYS 21 -0.214 2.177 9.010 195 HZ2 LYS 21 HZ2 LYS 21 0.957 1.494 8.094 196 HZ3 LYS 21 HZ3 LYS 21 0.927 1.214 9.708 197 H GLU 22 H GLU 22 1.038 -3.869 4.071 198 HA GLU 22 HA GLU 22 2.025 -6.510 4.801 199 HB2 GLU 22 HB2 GLU 22 0.213 -5.653 2.486 200 HB3 GLU 22 HB3 GLU 22 0.642 -7.310 2.909 201 HG2 GLU 22 HG2 GLU 22 -0.350 -7.029 5.127 202 HG3 GLU 22 HG3 GLU 22 -0.831 -5.373 4.740 203 H ARG 23 H ARG 23 2.265 -4.439 1.819 204 HA ARG 23 HA ARG 23 4.047 -6.277 0.555 205 HB2 ARG 23 HB2 ARG 23 4.558 -4.508 -1.052 206 HB3 ARG 23 HB3 ARG 23 2.853 -4.788 -0.786 207 HG2 ARG 23 HG2 ARG 23 2.854 -2.539 -0.882 208 HG3 ARG 23 HG3 ARG 23 2.981 -2.757 0.848 209 HD2 ARG 23 HD2 ARG 23 4.405 -0.951 0.079 210 HD3 ARG 23 HD3 ARG 23 5.430 -2.257 0.663 211 HE ARG 23 HE ARG 23 4.802 -1.674 -2.236 212 HH11 ARG 23 HH11 ARG 23 7.111 -3.028 0.152 213 HH12 ARG 23 HH12 ARG 23 8.316 -3.321 -1.030 214 HH21 ARG 23 HH21 ARG 23 6.562 -1.697 -3.668 215 HH22 ARG 23 HH22 ARG 23 8.113 -2.229 -3.106 216 H ILE 24 H ILE 24 4.809 -3.600 2.809 217 HA ILE 24 HA ILE 24 7.645 -3.835 2.275 218 HB ILE 24 HB ILE 24 6.622 -1.779 3.156 219 HG12 ILE 24 HG12 ILE 24 8.770 -3.028 4.922 220 HG13 ILE 24 HG13 ILE 24 8.971 -1.938 3.548 221 HG21 ILE 24 HG21 ILE 24 5.019 -3.049 4.702 222 HG22 ILE 24 HG22 ILE 24 6.318 -3.063 5.894 223 HG23 ILE 24 HG23 ILE 24 5.658 -1.523 5.281 224 HD11 ILE 24 HD11 ILE 24 9.310 -0.666 5.555 225 HD12 ILE 24 HD12 ILE 24 7.718 -0.180 4.913 226 HD13 ILE 24 HD13 ILE 24 7.823 -1.301 6.289 227 H GLN 25 H GLN 25 5.470 -5.183 4.833 228 HA GLN 25 HA GLN 25 7.668 -6.414 6.246 229 HB2 GLN 25 HB2 GLN 25 5.479 -5.649 7.213 230 HB3 GLN 25 HB3 GLN 25 4.673 -6.999 6.398 231 HG2 GLN 25 HG2 GLN 25 6.097 -8.586 7.703 232 HG3 GLN 25 HG3 GLN 25 6.806 -7.194 8.539 233 HE21 GLN 25 HE21 GLN 25 4.581 -9.565 9.134 234 HE22 GLN 25 HE22 GLN 25 3.402 -8.602 9.997 235 H ASN 26 H ASN 26 5.076 -7.732 4.103 236 HA ASN 26 HA ASN 26 6.134 -10.441 4.377 237 HB2 ASN 26 HB2 ASN 26 4.041 -9.345 2.445 238 HB3 ASN 26 HB3 ASN 26 4.408 -11.033 2.722 239 HD21 ASN 26 HD21 ASN 26 2.999 -8.191 4.207 240 HD22 ASN 26 HD22 ASN 26 2.109 -9.104 5.449 241 H SER 27 H SER 27 5.973 -7.979 1.738 242 HA SER 27 HA SER 27 7.058 -7.739 -0.194 243 HB2 SER 27 HB2 SER 27 8.787 -7.306 1.714 244 HB3 SER 27 HB3 SER 27 9.522 -8.834 1.190 245 HG SER 27 HG SER 27 10.438 -7.726 -0.269 246 H LEU 28 H LEU 28 5.754 -10.297 0.171 247 HA LEU 28 HA LEU 28 7.085 -11.876 -1.938 248 HB2 LEU 28 HB2 LEU 28 6.557 -13.934 -0.646 249 HB3 LEU 28 HB3 LEU 28 7.741 -12.875 0.126 250 HG LEU 28 HG LEU 28 5.802 -11.962 1.522 251 HD11 LEU 28 HD11 LEU 28 3.870 -12.788 0.462 252 HD12 LEU 28 HD12 LEU 28 3.994 -13.602 2.011 253 HD13 LEU 28 HD13 LEU 28 4.458 -14.464 0.523 254 HD21 LEU 28 HD21 LEU 28 6.734 -14.774 2.033 255 HD22 LEU 28 HD22 LEU 28 6.039 -13.665 3.225 256 HD23 LEU 28 HD23 LEU 28 7.586 -13.285 2.464 257 H SER 29 H SER 29 5.444 -13.833 -2.237 258 HA SER 29 HA SER 29 2.684 -12.771 -2.627 259 HB2 SER 29 HB2 SER 29 4.242 -14.564 -4.499 260 HB3 SER 29 HB3 SER 29 2.614 -13.886 -4.765 261 HG SER 29 HG SER 29 3.855 -11.740 -4.589 262 H THR 30 H THR 30 4.357 -15.941 -3.124 263 HA THR 30 HA THR 30 2.515 -17.187 -1.192 264 HB THR 30 HB THR 30 2.044 -17.600 -3.507 265 HG1 THR 30 HG1 THR 30 1.552 -19.616 -3.232 266 HG21 THR 30 HG21 THR 30 4.310 -17.532 -4.485 267 HG22 THR 30 HG22 THR 30 3.508 -19.059 -4.898 268 HG23 THR 30 HG23 THR 30 4.748 -19.024 -3.642 269 H GLU 31 H GLU 31 4.911 -16.021 -0.381 270 HA GLU 31 HA GLU 31 6.845 -16.404 0.800 271 HB2 GLU 31 HB2 GLU 31 5.519 -19.076 1.397 272 HB3 GLU 31 HB3 GLU 31 6.758 -18.257 2.333 273 HG2 GLU 31 HG2 GLU 31 4.944 -16.260 2.304 274 HG3 GLU 31 HG3 GLU 31 3.838 -17.607 2.044 275 H LYS 32 H LYS 32 7.154 -16.879 -1.894 276 HA LYS 32 HA LYS 32 8.449 -19.267 -2.581 277 HB2 LYS 32 HB2 LYS 32 9.394 -18.135 -4.443 278 HB3 LYS 32 HB3 LYS 32 7.726 -17.624 -4.252 279 HG2 LYS 32 HG2 LYS 32 9.933 -15.898 -3.066 280 HG3 LYS 32 HG3 LYS 32 9.736 -15.966 -4.788 281 HD2 LYS 32 HD2 LYS 32 7.368 -15.332 -3.003 282 HD3 LYS 32 HD3 LYS 32 8.511 -14.076 -3.469 283 HE2 LYS 32 HE2 LYS 32 7.212 -15.880 -5.533 284 HE3 LYS 32 HE3 LYS 32 6.380 -14.438 -4.944 285 HZ1 LYS 32 HZ1 LYS 32 8.093 -13.075 -5.762 286 HZ2 LYS 32 HZ2 LYS 32 7.713 -14.059 -6.990 287 HZ3 LYS 32 HZ3 LYS 32 9.098 -14.319 -6.106 288 H TYR 33 H TYR 33 10.621 -19.866 -2.717 289 HA TYR 33 HA TYR 33 12.301 -18.926 -0.510 290 HB2 TYR 33 HB2 TYR 33 11.970 -21.322 -1.095 291 HB3 TYR 33 HB3 TYR 33 12.678 -21.038 -2.681 292 HD1 TYR 33 HD1 TYR 33 15.037 -21.137 -2.984 293 HD2 TYR 33 HD2 TYR 33 13.421 -20.814 1.011 294 HE1 TYR 33 HE1 TYR 33 17.266 -21.568 -2.062 295 HE2 TYR 33 HE2 TYR 33 15.695 -21.185 1.932 296 HH TYR 33 HH TYR 33 18.541 -21.748 -0.160 297 H GLY 34 H GLY 34 14.743 -18.602 -1.097 298 HA2 GLY 34 HA2 GLY 34 16.417 -17.866 -2.568 299 HA3 GLY 34 HA3 GLY 34 15.212 -17.264 -3.698 300 H SER 35 H SER 35 17.330 -16.480 -1.198 301 HA SER 35 HA SER 35 16.477 -13.646 -1.197 302 HB2 SER 35 HB2 SER 35 15.589 -14.983 0.830 303 HB3 SER 35 HB3 SER 35 17.277 -15.037 1.374 304 HG SER 35 HG SER 35 17.131 -12.611 1.060 305 H GLY 36 H GLY 36 19.014 -15.970 -1.578 306 HA2 GLY 36 HA2 GLY 36 21.178 -14.451 -0.446 307 HA3 GLY 36 HA3 GLY 36 21.300 -15.771 -1.622 308 H SER 37 H SER 37 22.265 -12.730 -1.325 309 HA SER 37 HA SER 37 22.732 -12.153 -4.001 310 HB2 SER 37 HB2 SER 37 20.169 -11.586 -3.807 311 HB3 SER 37 HB3 SER 37 20.697 -10.253 -2.784 312 HG SER 37 HG SER 37 20.428 -10.194 -5.285 313 H GLY 38 H GLY 38 23.178 -9.447 -3.824 314 HA2 GLY 38 HA2 GLY 38 24.090 -7.683 -2.468 315 HA3 GLY 38 HA3 GLY 38 24.551 -8.863 -1.232 316 H SER 39 H SER 39 25.706 -7.031 -3.821 317 HA SER 39 HA SER 39 28.220 -8.591 -3.905 318 HB2 SER 39 HB2 SER 39 26.760 -7.580 -6.389 319 HB3 SER 39 HB3 SER 39 28.298 -8.468 -6.335 320 HG SER 39 HG SER 39 26.571 -9.905 -6.775 321 H GLY 40 H GLY 40 30.083 -7.183 -4.636 322 HA2 GLY 40 HA2 GLY 40 29.634 -4.355 -4.979 323 HA3 GLY 40 HA3 GLY 40 30.257 -4.786 -3.378 324 H SER 41 H SER 41 31.814 -3.240 -4.829 325 HA SER 41 HA SER 41 34.151 -4.934 -5.442 326 HB2 SER 41 HB2 SER 41 32.998 -4.661 -7.608 327 HB3 SER 41 HB3 SER 41 32.981 -2.900 -7.397 328 HG SER 41 HG SER 41 34.710 -3.686 -8.717 329 H GLY 42 H GLY 42 32.841 -1.556 -5.353 330 HA2 GLY 42 HA2 GLY 42 33.543 0.243 -4.064 331 HA3 GLY 42 HA3 GLY 42 34.805 -0.766 -3.332 332 H SER 43 H SER 43 36.403 -1.578 -5.200 333 HA SER 43 HA SER 43 38.183 -1.120 -6.439 334 HB2 SER 43 HB2 SER 43 37.744 0.316 -8.555 335 HB3 SER 43 HB3 SER 43 36.985 -1.259 -8.339 336 HG SER 43 HG SER 43 35.554 0.926 -7.396 337 H GLY 44 H GLY 44 37.203 1.368 -4.431 338 HA2 GLY 44 HA2 GLY 44 39.824 2.565 -4.526 339 HA3 GLY 44 HA3 GLY 44 38.516 3.630 -5.092 340 H SER 45 H SER 45 39.843 4.412 -2.835 341 HA SER 45 HA SER 45 37.850 4.645 -0.855 342 HB2 SER 45 HB2 SER 45 38.713 2.303 -0.350 343 HB3 SER 45 HB3 SER 45 40.313 3.010 -0.067 344 HG SER 45 HG SER 45 38.822 2.677 1.787 345 H GLY 46 H GLY 46 39.391 5.620 1.174 346 HA2 GLY 46 HA2 GLY 46 40.853 7.292 1.856 347 HA3 GLY 46 HA3 GLY 46 41.717 7.105 0.318 348 H SER 47 H SER 47 38.284 7.843 -0.023 349 HA SER 47 HA SER 47 38.703 10.704 -0.005 350 HB2 SER 47 HB2 SER 47 39.461 9.620 -2.320 351 HB3 SER 47 HB3 SER 47 37.715 9.519 -2.608 352 HG SER 47 HG SER 47 39.392 11.748 -2.229 353 H GLY 48 H GLY 48 36.589 11.753 -0.655 354 HA2 GLY 48 HA2 GLY 48 34.223 11.809 -0.752 355 HA3 GLY 48 HA3 GLY 48 34.147 10.145 -0.126 356 H SER 49 H SER 49 32.928 12.807 0.887 357 HA SER 49 HA SER 49 33.445 12.308 3.700 358 HB2 SER 49 HB2 SER 49 34.133 14.704 4.123 359 HB3 SER 49 HB3 SER 49 35.360 13.706 3.330 360 HG SER 49 HG SER 49 33.567 15.469 2.022 361 H GLY 50 H GLY 50 31.219 12.020 4.081 362 HA2 GLY 50 HA2 GLY 50 29.534 14.064 4.614 363 HA3 GLY 50 HA3 GLY 50 29.231 13.745 2.896 364 H SER 51 H SER 51 27.159 13.327 4.553 365 HA SER 51 HA SER 51 26.254 10.770 4.063 366 HB2 SER 51 HB2 SER 51 26.077 9.876 6.387 367 HB3 SER 51 HB3 SER 51 27.732 9.907 5.802 368 HG SER 51 HG SER 51 27.951 10.777 7.715 369 H GLY 52 H GLY 52 24.108 10.513 5.573 370 HA2 GLY 52 HA2 GLY 52 22.863 12.598 6.880 371 HA3 GLY 52 HA3 GLY 52 22.498 12.841 5.169 372 H SER 53 H SER 53 20.259 12.424 6.135 373 HA SER 53 HA SER 53 19.367 9.771 5.468 374 HB2 SER 53 HB2 SER 53 18.221 9.581 7.786 375 HB3 SER 53 HB3 SER 53 19.947 9.200 7.714 376 HG SER 53 HG SER 53 19.207 10.604 9.477 377 H GLY 54 H GLY 54 16.968 9.811 5.337 378 HA2 GLY 54 HA2 GLY 54 15.669 12.482 5.588 379 HA3 GLY 54 HA3 GLY 54 15.572 11.565 4.073 380 H SER 55 H SER 55 13.270 12.233 5.833 381 HA SER 55 HA SER 55 12.361 9.501 6.566 382 HB2 SER 55 HB2 SER 55 13.208 11.133 8.422 383 HB3 SER 55 HB3 SER 55 11.729 12.036 8.106 384 HG SER 55 HG SER 55 11.807 10.447 9.821 385 H GLY 56 H GLY 56 9.774 10.304 7.355 386 HA2 GLY 56 HA2 GLY 56 8.407 12.005 5.556 387 HA3 GLY 56 HA3 GLY 56 8.304 10.328 4.969 388 H SER 57 H SER 57 6.003 11.770 5.891 389 HA SER 57 HA SER 57 4.975 9.961 7.860 390 HB2 SER 57 HB2 SER 57 6.171 11.583 9.307 391 HB3 SER 57 HB3 SER 57 5.270 12.915 8.565 392 HG SER 57 HG SER 57 4.234 10.712 10.066 393 H GLY 58 H GLY 58 2.643 11.114 8.435 394 HA2 GLY 58 HA2 GLY 58 0.561 11.715 7.679 395 HA3 GLY 58 HA3 GLY 58 1.345 12.608 6.361 396 H TYR 59 H TYR 59 1.688 11.607 4.432 397 HA TYR 59 HA TYR 59 0.054 9.272 3.759 398 HB2 TYR 59 HB2 TYR 59 0.299 9.939 1.528 399 HB3 TYR 59 HB3 TYR 59 0.005 11.385 2.464 400 HD1 TYR 59 HD1 TYR 59 2.832 12.192 3.372 401 HD2 TYR 59 HD2 TYR 59 1.244 10.810 -0.406 402 HE1 TYR 59 HE1 TYR 59 4.600 13.347 2.230 403 HE2 TYR 59 HE2 TYR 59 3.101 11.956 -1.581 404 HH TYR 59 HH TYR 59 4.911 13.450 -1.310 405 H GLN3288 H GLN3288 1.236 7.824 1.903 406 HA GLN3288 HA GLN3288 3.458 6.602 3.351 407 HB2 GLN3288 HB2 GLN3288 3.283 4.767 1.929 408 HB3 GLN3288 HB3 GLN3288 1.692 5.197 2.461 409 HG2 GLN3288 HG2 GLN3288 2.793 5.952 -0.278 410 HG3 GLN3288 HG3 GLN3288 1.950 4.445 0.059 411 HE21 GLN3288 HE21 GLN3288 1.553 7.664 -0.814 412 HE22 GLN3288 HE22 GLN3288 -0.205 7.631 -0.968 413 H ILE3289 H ILE3289 5.263 5.703 1.836 414 HA ILE3289 HA ILE3289 6.822 7.979 1.079 415 HB ILE3289 HB ILE3289 7.628 5.090 0.684 416 HG12 ILE3289 HG12 ILE3289 8.145 6.709 3.209 417 HG13 ILE3289 HG13 ILE3289 6.856 5.512 3.083 418 HG21 ILE3289 HG21 ILE3289 9.916 6.083 0.968 419 HG22 ILE3289 HG22 ILE3289 9.062 6.779 -0.396 420 HG23 ILE3289 HG23 ILE3289 9.187 7.685 1.137 421 HD11 ILE3289 HD11 ILE3289 8.650 4.394 4.098 422 HD12 ILE3289 HD12 ILE3289 8.556 3.772 2.449 423 HD13 ILE3289 HD13 ILE3289 9.823 4.943 2.896 424 H GLU3290 H GLU3290 5.929 8.960 -0.716 425 HA GLU3290 HA GLU3290 5.047 7.611 -3.047 426 HB2 GLU3290 HB2 GLU3290 4.647 10.073 -2.271 427 HB3 GLU3290 HB3 GLU3290 6.200 10.434 -2.988 428 HG2 GLU3290 HG2 GLU3290 5.428 9.875 -5.195 429 HG3 GLU3290 HG3 GLU3290 4.014 9.013 -4.567 430 H THR3291 H THR3291 8.216 8.215 -1.900 431 HA THR3291 HA THR3291 9.429 7.825 -4.577 432 HB THR3291 HB THR3291 9.865 9.952 -3.761 433 HG1 THR3291 HG1 THR3291 11.580 8.586 -4.607 434 HG21 THR3291 HG21 THR3291 11.066 10.359 -1.571 435 HG22 THR3291 HG22 THR3291 10.672 8.676 -1.125 436 HG23 THR3291 HG23 THR3291 9.396 9.866 -1.419 437 H PHE3292 H PHE3292 8.436 5.531 -3.452 438 HA PHE3292 HA PHE3292 10.927 4.050 -3.230 439 HB2 PHE3292 HB2 PHE3292 10.529 4.814 -0.874 440 HB3 PHE3292 HB3 PHE3292 8.993 3.960 -0.870 441 HD1 PHE3292 HD1 PHE3292 12.411 2.886 -2.193 442 HD2 PHE3292 HD2 PHE3292 9.304 2.281 0.746 443 HE1 PHE3292 HE1 PHE3292 13.587 0.902 -1.362 444 HE2 PHE3292 HE2 PHE3292 10.514 0.296 1.594 445 HZ PHE3292 HZ PHE3292 12.653 -0.408 0.529 446 H PHE3293 H PHE3293 7.437 3.659 -2.501 447 HA PHE3293 HA PHE3293 7.382 1.366 -4.417 448 HB2 PHE3293 HB2 PHE3293 5.593 0.487 -2.794 449 HB3 PHE3293 HB3 PHE3293 7.295 0.388 -2.377 450 HD1 PHE3293 HD1 PHE3293 7.417 0.368 -0.058 451 HD2 PHE3293 HD2 PHE3293 4.911 3.303 -1.999 452 HE1 PHE3293 HE1 PHE3293 7.078 1.525 2.102 453 HE2 PHE3293 HE2 PHE3293 4.654 4.477 0.099 454 HZ PHE3293 HZ PHE3293 5.695 3.586 2.214 455 H ALA3294 H ALA3294 6.532 4.458 -4.525 456 HA ALA3294 HA ALA3294 3.778 4.595 -4.903 457 HB1 ALA3294 HB1 ALA3294 4.268 6.434 -6.530 458 HB2 ALA3294 HB2 ALA3294 5.020 6.574 -4.952 459 HB3 ALA3294 HB3 ALA3294 5.995 6.045 -6.365 460 H GLN3295 H GLN3295 6.099 3.006 -6.991 461 HA GLN3295 HA GLN3295 4.492 3.018 -9.376 462 HB2 GLN3295 HB2 GLN3295 6.652 1.009 -8.627 463 HB3 GLN3295 HB3 GLN3295 6.074 1.416 -10.240 464 HG2 GLN3295 HG2 GLN3295 7.843 3.010 -8.386 465 HG3 GLN3295 HG3 GLN3295 8.152 2.490 -10.039 466 HE21 GLN3295 HE21 GLN3295 8.182 5.254 -8.658 467 HE22 GLN3295 HE22 GLN3295 7.068 6.247 -9.573 468 H ASP3296 H ASP3296 4.910 0.577 -6.726 469 HA ASP3296 HA ASP3296 2.907 -1.159 -7.965 470 HB2 ASP3296 HB2 ASP3296 3.279 -2.639 -6.099 471 HB3 ASP3296 HB3 ASP3296 4.787 -2.202 -6.891 472 H ILE3297 H ILE3297 3.023 1.395 -5.663 473 HA ILE3297 HA ILE3297 0.676 0.746 -4.158 474 HB ILE3297 HB ILE3297 2.560 2.962 -4.328 475 HG12 ILE3297 HG12 ILE3297 2.112 3.136 -1.937 476 HG13 ILE3297 HG13 ILE3297 0.695 2.082 -2.098 477 HG21 ILE3297 HG21 ILE3297 0.767 4.314 -5.133 478 HG22 ILE3297 HG22 ILE3297 -0.315 3.753 -3.844 479 HG23 ILE3297 HG23 ILE3297 1.109 4.754 -3.446 480 HD11 ILE3297 HD11 ILE3297 2.137 0.171 -2.645 481 HD12 ILE3297 HD12 ILE3297 3.547 1.234 -2.738 482 HD13 ILE3297 HD13 ILE3297 2.782 0.939 -1.187 483 H GLU3298 H GLU3298 1.174 2.730 -7.107 484 HA GLU3298 HA GLU3298 -1.562 3.536 -7.272 485 HB2 GLU3298 HB2 GLU3298 -1.057 3.987 -9.645 486 HB3 GLU3298 HB3 GLU3298 0.078 4.738 -8.521 487 HG2 GLU3298 HG2 GLU3298 1.815 3.280 -9.064 488 HG3 GLU3298 HG3 GLU3298 0.806 2.050 -9.716 489 H SER3299 H SER3299 0.161 0.631 -8.270 490 HA SER3299 HA SER3299 -1.927 -0.411 -9.933 491 HB2 SER3299 HB2 SER3299 0.597 -1.524 -8.626 492 HB3 SER3299 HB3 SER3299 -0.454 -2.476 -9.661 493 HG SER3299 HG SER3299 -0.086 -1.191 -11.340 494 H VAL3300 H VAL3300 -0.994 -1.036 -6.505 495 HA VAL3300 HA VAL3300 -3.160 -2.952 -6.233 496 HB VAL3300 HB VAL3300 -0.976 -2.982 -4.986 497 HG11 VAL3300 HG11 VAL3300 -0.776 -1.750 -2.924 498 HG12 VAL3300 HG12 VAL3300 -0.879 -0.637 -4.287 499 HG13 VAL3300 HG13 VAL3300 -2.283 -0.869 -3.212 500 HG21 VAL3300 HG21 VAL3300 -2.855 -4.398 -4.379 501 HG22 VAL3300 HG22 VAL3300 -1.949 -3.897 -2.944 502 HG23 VAL3300 HG23 VAL3300 -3.516 -3.129 -3.339 503 H GLN3301 H GLN3301 -2.755 0.570 -5.449 504 HA GLN3301 HA GLN3301 -5.286 0.695 -4.128 505 HB2 GLN3301 HB2 GLN3301 -5.140 2.986 -4.048 506 HB3 GLN3301 HB3 GLN3301 -3.504 2.378 -3.871 507 HG2 GLN3301 HG2 GLN3301 -2.961 3.953 -5.374 508 HG3 GLN3301 HG3 GLN3301 -3.597 2.822 -6.555 509 HE21 GLN3301 HE21 GLN3301 -6.471 3.196 -6.309 510 HE22 GLN3301 HE22 GLN3301 -6.738 4.798 -6.902 511 H LYS3302 H LYS3302 -4.382 0.728 -7.519 512 HA LYS3302 HA LYS3302 -6.792 1.813 -8.611 513 HB2 LYS3302 HB2 LYS3302 -4.563 0.122 -9.631 514 HB3 LYS3302 HB3 LYS3302 -6.067 0.163 -10.560 515 HG2 LYS3302 HG2 LYS3302 -5.990 2.581 -10.742 516 HG3 LYS3302 HG3 LYS3302 -4.656 2.709 -9.644 517 HD2 LYS3302 HD2 LYS3302 -3.724 2.923 -11.831 518 HD3 LYS3302 HD3 LYS3302 -3.256 1.326 -11.255 519 HE2 LYS3302 HE2 LYS3302 -3.985 1.201 -13.588 520 HE3 LYS3302 HE3 LYS3302 -5.102 0.302 -12.550 521 HZ1 LYS3302 HZ1 LYS3302 -6.599 2.192 -12.624 522 HZ2 LYS3302 HZ2 LYS3302 -6.319 1.673 -14.117 523 HZ3 LYS3302 HZ3 LYS3302 -5.548 3.043 -13.586 524 H GLU3303 H GLU3303 -5.963 -1.319 -7.221 525 HA GLU3303 HA GLU3303 -8.250 -2.739 -8.270 526 HB2 GLU3303 HB2 GLU3303 -7.200 -4.505 -7.493 527 HB3 GLU3303 HB3 GLU3303 -5.863 -3.431 -7.132 528 HG2 GLU3303 HG2 GLU3303 -6.979 -3.213 -4.795 529 HG3 GLU3303 HG3 GLU3303 -7.926 -4.617 -5.267 530 H LEU3304 H LEU3304 -7.474 -1.143 -5.236 531 HA LEU3304 HA LEU3304 -9.972 -1.573 -3.991 532 HB2 LEU3304 HB2 LEU3304 -7.858 0.571 -3.524 533 HB3 LEU3304 HB3 LEU3304 -9.155 0.179 -2.421 534 HG LEU3304 HG LEU3304 -6.887 -1.679 -3.269 535 HD11 LEU3304 HD11 LEU3304 -5.990 -0.131 -1.879 536 HD12 LEU3304 HD12 LEU3304 -6.333 -1.484 -0.802 537 HD13 LEU3304 HD13 LEU3304 -7.413 -0.068 -0.792 538 HD21 LEU3304 HD21 LEU3304 -7.722 -3.267 -1.589 539 HD22 LEU3304 HD22 LEU3304 -8.879 -3.030 -2.853 540 HD23 LEU3304 HD23 LEU3304 -9.130 -2.221 -1.285 541 H GLU3305 H GLU3305 -8.911 1.210 -5.974 542 HA GLU3305 HA GLU3305 -11.170 2.806 -5.229 543 HB2 GLU3305 HB2 GLU3305 -10.732 4.121 -7.315 544 HB3 GLU3305 HB3 GLU3305 -9.314 3.914 -6.278 545 HG2 GLU3305 HG2 GLU3305 -8.528 2.103 -7.610 546 HG3 GLU3305 HG3 GLU3305 -9.913 2.119 -8.687 547 H ASN3306 H ASN3306 -10.961 0.091 -7.455 548 HA ASN3306 HA ASN3306 -13.629 0.802 -8.512 549 HB2 ASN3306 HB2 ASN3306 -13.324 -0.552 -10.303 550 HB3 ASN3306 HB3 ASN3306 -11.763 0.222 -10.084 551 HD21 ASN3306 HD21 ASN3306 -9.926 -1.067 -9.367 552 HD22 ASN3306 HD22 ASN3306 -9.997 -2.788 -9.573 553 H LEU3307 H LEU3307 -12.690 -0.513 -5.715 554 HA LEU3307 HA LEU3307 -14.621 -2.744 -5.837 555 HB2 LEU3307 HB2 LEU3307 -12.186 -2.054 -4.276 556 HB3 LEU3307 HB3 LEU3307 -13.519 -2.508 -3.257 557 HG LEU3307 HG LEU3307 -12.819 -4.580 -3.447 558 HD11 LEU3307 HD11 LEU3307 -13.320 -5.926 -5.400 559 HD12 LEU3307 HD12 LEU3307 -13.487 -4.457 -6.392 560 HD13 LEU3307 HD13 LEU3307 -14.640 -4.799 -5.074 561 HD21 LEU3307 HD21 LEU3307 -10.599 -3.797 -4.240 562 HD22 LEU3307 HD22 LEU3307 -11.154 -4.163 -5.893 563 HD23 LEU3307 HD23 LEU3307 -11.055 -5.448 -4.689 564 H SER3308 H SER3308 -16.265 -2.921 -4.219 565 HA SER3308 HA SER3308 -17.552 -0.334 -3.698 566 HB2 SER3308 HB2 SER3308 -18.439 -3.223 -3.569 567 HB3 SER3308 HB3 SER3308 -19.397 -1.929 -2.840 568 HG SER3308 HG SER3308 -20.159 -1.705 -4.723 569 H GLU3309 H GLU3309 -18.762 -0.099 -1.494 570 HA GLU3309 HA GLU3309 -16.752 0.051 0.485 571 HB2 GLU3309 HB2 GLU3309 -19.819 0.161 0.639 572 HB3 GLU3309 HB3 GLU3309 -18.849 0.081 2.122 573 HG2 GLU3309 HG2 GLU3309 -17.501 2.031 1.174 574 HG3 GLU3309 HG3 GLU3309 -18.807 2.213 0.035 575 H GLU3310 H GLU3310 -19.386 -2.414 0.176 576 HA GLU3310 HA GLU3310 -18.744 -3.894 2.385 577 HB2 GLU3310 HB2 GLU3310 -19.711 -5.819 1.073 578 HB3 GLU3310 HB3 GLU3310 -20.671 -4.328 1.091 579 HG2 GLU3310 HG2 GLU3310 -19.632 -3.744 -1.169 580 HG3 GLU3310 HG3 GLU3310 -18.886 -5.341 -1.145 581 H GLU3311 H GLU3311 -16.740 -3.627 -0.483 582 HA GLU3311 HA GLU3311 -15.289 -6.132 0.046 583 HB2 GLU3311 HB2 GLU3311 -14.909 -3.832 -1.885 584 HB3 GLU3311 HB3 GLU3311 -13.936 -5.268 -1.874 585 HG2 GLU3311 HG2 GLU3311 -16.892 -5.645 -2.172 586 HG3 GLU3311 HG3 GLU3311 -16.079 -4.911 -3.474 587 H LEU3312 H LEU3312 -14.766 -2.643 -0.016 588 HA LEU3312 HA LEU3312 -12.154 -2.701 1.190 589 HB2 LEU3312 HB2 LEU3312 -13.943 -0.265 1.005 590 HB3 LEU3312 HB3 LEU3312 -12.215 -0.274 1.039 591 HG LEU3312 HG LEU3312 -13.652 -1.622 -1.267 592 HD11 LEU3312 HD11 LEU3312 -13.220 1.335 -0.921 593 HD12 LEU3312 HD12 LEU3312 -14.728 0.398 -1.208 594 HD13 LEU3312 HD13 LEU3312 -13.500 0.509 -2.465 595 HD21 LEU3312 HD21 LEU3312 -11.608 -1.048 -2.437 596 HD22 LEU3312 HD22 LEU3312 -11.345 -2.124 -1.070 597 HD23 LEU3312 HD23 LEU3312 -10.918 -0.399 -0.940 598 H LEU3313 H LEU3313 -15.243 -1.419 2.331 599 HA LEU3313 HA LEU3313 -14.603 -0.486 4.884 600 HB2 LEU3313 HB2 LEU3313 -16.684 0.050 3.657 601 HB3 LEU3313 HB3 LEU3313 -17.214 -1.636 3.763 602 HG LEU3313 HG LEU3313 -18.342 -0.099 5.312 603 HD11 LEU3313 HD11 LEU3313 -17.135 -2.559 6.623 604 HD12 LEU3313 HD12 LEU3313 -18.526 -2.530 5.505 605 HD13 LEU3313 HD13 LEU3313 -18.592 -1.721 7.076 606 HD21 LEU3313 HD21 LEU3313 -16.411 1.124 6.252 607 HD22 LEU3313 HD22 LEU3313 -15.900 -0.368 7.076 608 HD23 LEU3313 HD23 LEU3313 -17.441 0.383 7.487 609 H ALA3314 H ALA3314 -15.539 -3.764 3.642 610 HA ALA3314 HA ALA3314 -15.704 -4.907 6.229 611 HB1 ALA3314 HB1 ALA3314 -15.124 -6.123 3.499 612 HB2 ALA3314 HB2 ALA3314 -15.458 -7.070 4.978 613 HB3 ALA3314 HB3 ALA3314 -16.694 -5.977 4.328 614 H MET3315 H MET3315 -12.898 -4.196 4.218 615 HA MET3315 HA MET3315 -11.077 -5.987 5.622 616 HB2 MET3315 HB2 MET3315 -10.443 -3.571 3.862 617 HB3 MET3315 HB3 MET3315 -9.344 -4.854 4.311 618 HG2 MET3315 HG2 MET3315 -11.871 -5.764 3.082 619 HG3 MET3315 HG3 MET3315 -10.974 -4.709 2.050 620 HE1 MET3315 HE1 MET3315 -8.462 -5.462 1.057 621 HE2 MET3315 HE2 MET3315 -7.906 -5.441 2.759 622 HE3 MET3315 HE3 MET3315 -7.562 -6.840 1.745 623 H LEU3316 H LEU3316 -11.421 -2.448 5.480 624 HA LEU3316 HA LEU3316 -9.473 -1.895 7.527 625 HB2 LEU3316 HB2 LEU3316 -10.554 0.360 7.629 626 HB3 LEU3316 HB3 LEU3316 -10.004 -0.165 6.042 627 HG LEU3316 HG LEU3316 -12.580 -0.971 5.835 628 HD11 LEU3316 HD11 LEU3316 -14.025 0.904 6.822 629 HD12 LEU3316 HD12 LEU3316 -12.645 1.400 7.806 630 HD13 LEU3316 HD13 LEU3316 -13.405 -0.178 8.042 631 HD21 LEU3316 HD21 LEU3316 -11.196 0.863 4.561 632 HD22 LEU3316 HD22 LEU3316 -12.201 1.974 5.547 633 HD23 LEU3316 HD23 LEU3316 -12.933 0.783 4.456 634 H ASN3317 H ASN3317 -12.951 -2.602 7.647 635 HA ASN3317 HA ASN3317 -13.157 -1.977 10.492 636 HB2 ASN3317 HB2 ASN3317 -14.944 -1.812 8.587 637 HB3 ASN3317 HB3 ASN3317 -15.131 -3.556 8.799 638 HD21 ASN3317 HD21 ASN3317 -15.328 -0.318 10.291 639 HD22 ASN3317 HD22 ASN3317 -16.636 -0.790 11.391 640 H GLY3318 H GLY3318 -12.516 -4.709 8.403 641 HA2 GLY3318 HA2 GLY3318 -11.814 -6.799 8.667 642 HA3 GLY3318 HA3 GLY3318 -11.378 -6.405 10.339 643 H ASP3319 H ASP3319 -14.398 -6.635 8.417 644 HA ASP3319 HA ASP3319 -15.681 -8.623 10.224 645 HB2 ASP3319 HB2 ASP3319 -16.285 -5.741 9.999 646 HB3 ASP3319 HB3 ASP3319 -17.643 -6.710 9.540 647 H GLN3320 H GLN3320 -17.973 -9.120 9.244 648 HA GLN3320 HA GLN3320 -17.692 -9.227 6.313 649 HB2 GLN3320 HB2 GLN3320 -17.004 -11.411 7.261 650 HB3 GLN3320 HB3 GLN3320 -18.591 -11.563 8.028 651 HG2 GLN3320 HG2 GLN3320 -18.599 -12.812 5.936 652 HG3 GLN3320 HG3 GLN3320 -19.659 -11.417 5.750 653 HE21 GLN3320 HE21 GLN3320 -16.619 -12.897 4.616 654 HE22 GLN3320 HE22 GLN3320 -16.497 -11.762 3.266 655 H GLN3321 H GLN3321 -18.961 -7.686 6.049 656 HA GLN3321 HA GLN3321 -21.509 -7.074 7.266 657 HB2 GLN3321 HB2 GLN3321 -21.911 -5.614 5.352 658 HB3 GLN3321 HB3 GLN3321 -20.262 -5.425 5.927 659 HG2 GLN3321 HG2 GLN3321 -19.884 -5.462 3.689 660 HG3 GLN3321 HG3 GLN3321 -19.689 -7.171 3.992 661 HE21 GLN3321 HE21 GLN3321 -20.887 -8.518 2.619 662 HE22 GLN3321 HE22 GLN3321 -21.922 -7.885 1.362 Start of MODEL 8 1 H1 MET 1 H MET 1 -22.215 10.540 2.437 2 HA MET 1 HA MET 1 -24.017 9.373 1.417 3 HB2 MET 1 HB2 MET 1 -25.877 10.324 2.389 4 HB3 MET 1 HB3 MET 1 -24.524 10.781 3.427 5 HG2 MET 1 HG2 MET 1 -24.561 13.049 2.309 6 HG3 MET 1 HG3 MET 1 -26.029 12.545 1.465 7 HE1 MET 1 HE1 MET 1 -27.585 10.843 3.797 8 HE2 MET 1 HE2 MET 1 -28.615 12.149 4.407 9 HE3 MET 1 HE3 MET 1 -28.348 11.979 2.660 10 H ASN 2 H ASN 2 -23.911 12.755 0.109 11 HA ASN 2 HA ASN 2 -25.738 12.239 -2.027 12 HB2 ASN 2 HB2 ASN 2 -23.686 14.466 -1.598 13 HB3 ASN 2 HB3 ASN 2 -24.902 14.455 -2.866 14 HD21 ASN 2 HD21 ASN 2 -24.361 15.087 0.523 15 HD22 ASN 2 HD22 ASN 2 -26.022 15.405 0.950 16 H ILE 3 H ILE 3 -23.126 10.577 -1.724 17 HA ILE 3 HA ILE 3 -22.629 10.081 -4.436 18 HB ILE 3 HB ILE 3 -21.283 12.218 -4.022 19 HG12 ILE 3 HG12 ILE 3 -19.222 11.576 -5.000 20 HG13 ILE 3 HG13 ILE 3 -19.517 9.862 -4.714 21 HG21 ILE 3 HG21 ILE 3 -20.696 11.595 -1.632 22 HG22 ILE 3 HG22 ILE 3 -19.473 10.514 -2.274 23 HG23 ILE 3 HG23 ILE 3 -19.393 12.267 -2.598 24 HD11 ILE 3 HD11 ILE 3 -21.389 9.941 -6.330 25 HD12 ILE 3 HD12 ILE 3 -21.133 11.702 -6.522 26 HD13 ILE 3 HD13 ILE 3 -19.883 10.561 -7.043 27 H ASN 4 H ASN 4 -20.917 8.356 -4.516 28 HA ASN 4 HA ASN 4 -20.531 6.730 -2.075 29 HB2 ASN 4 HB2 ASN 4 -21.137 4.688 -3.376 30 HB3 ASN 4 HB3 ASN 4 -22.494 5.725 -2.946 31 HD21 ASN 4 HD21 ASN 4 -20.535 4.499 -5.645 32 HD22 ASN 4 HD22 ASN 4 -21.435 5.351 -6.900 33 H GLU 5 H GLU 5 -19.776 7.173 -5.563 34 HA GLU 5 HA GLU 5 -17.362 5.798 -5.641 35 HB2 GLU 5 HB2 GLU 5 -18.094 8.314 -7.191 36 HB3 GLU 5 HB3 GLU 5 -16.802 7.164 -7.611 37 HG2 GLU 5 HG2 GLU 5 -18.543 5.346 -7.698 38 HG3 GLU 5 HG3 GLU 5 -19.767 6.602 -7.448 39 H GLN 6 H GLN 6 -17.984 9.089 -4.628 40 HA GLN 6 HA GLN 6 -15.123 9.679 -4.185 41 HB2 GLN 6 HB2 GLN 6 -17.647 11.199 -3.534 42 HB3 GLN 6 HB3 GLN 6 -16.159 11.610 -2.728 43 HG2 GLN 6 HG2 GLN 6 -16.297 13.076 -4.488 44 HG3 GLN 6 HG3 GLN 6 -15.054 11.912 -4.963 45 HE21 GLN 6 HE21 GLN 6 -17.519 13.749 -6.198 46 HE22 GLN 6 HE22 GLN 6 -18.054 12.651 -7.478 47 H THR 7 H THR 7 -17.828 8.343 -2.222 48 HA THR 7 HA THR 7 -16.655 8.762 0.285 49 HB THR 7 HB THR 7 -18.275 6.372 -0.577 50 HG1 THR 7 HG1 THR 7 -20.031 7.477 0.004 51 HG21 THR 7 HG21 THR 7 -18.912 6.385 1.911 52 HG22 THR 7 HG22 THR 7 -17.596 7.567 2.147 53 HG23 THR 7 HG23 THR 7 -17.247 5.943 1.537 54 H LEU 8 H LEU 8 -16.180 6.183 -2.139 55 HA LEU 8 HA LEU 8 -14.804 4.210 -0.842 56 HB2 LEU 8 HB2 LEU 8 -13.775 5.274 -3.491 57 HB3 LEU 8 HB3 LEU 8 -13.832 3.632 -2.857 58 HG LEU 8 HG LEU 8 -16.230 5.223 -3.802 59 HD11 LEU 8 HD11 LEU 8 -16.255 3.671 -5.717 60 HD12 LEU 8 HD12 LEU 8 -14.761 2.929 -5.123 61 HD13 LEU 8 HD13 LEU 8 -14.757 4.617 -5.665 62 HD21 LEU 8 HD21 LEU 8 -17.351 2.947 -3.737 63 HD22 LEU 8 HD22 LEU 8 -17.077 3.777 -2.206 64 HD23 LEU 8 HD23 LEU 8 -15.973 2.467 -2.705 65 H ASP 9 H ASP 9 -13.600 7.492 -1.642 66 HA ASP 9 HA ASP 9 -10.828 7.216 -1.510 67 HB2 ASP 9 HB2 ASP 9 -12.061 9.291 -2.011 68 HB3 ASP 9 HB3 ASP 9 -12.590 9.382 -0.324 69 H LYS 10 H LYS 10 -13.155 7.568 1.262 70 HA LYS 10 HA LYS 10 -11.022 7.502 3.199 71 HB2 LYS 10 HB2 LYS 10 -12.597 7.544 4.906 72 HB3 LYS 10 HB3 LYS 10 -13.362 8.441 3.594 73 HG2 LYS 10 HG2 LYS 10 -14.660 6.436 3.003 74 HG3 LYS 10 HG3 LYS 10 -13.963 5.540 4.347 75 HD2 LYS 10 HD2 LYS 10 -15.568 8.105 4.589 76 HD3 LYS 10 HD3 LYS 10 -16.263 6.473 4.647 77 HE2 LYS 10 HE2 LYS 10 -15.136 5.945 6.676 78 HE3 LYS 10 HE3 LYS 10 -14.093 7.367 6.574 79 HZ1 LYS 10 HZ1 LYS 10 -15.953 8.785 6.940 80 HZ2 LYS 10 HZ2 LYS 10 -15.974 7.651 8.129 81 HZ3 LYS 10 HZ3 LYS 10 -17.030 7.581 6.850 82 H LEU 11 H LEU 11 -12.713 5.018 1.469 83 HA LEU 11 HA LEU 11 -12.101 2.845 3.295 84 HB2 LEU 11 HB2 LEU 11 -13.277 2.856 0.467 85 HB3 LEU 11 HB3 LEU 11 -12.948 1.434 1.440 86 HG LEU 11 HG LEU 11 -15.194 1.734 1.550 87 HD11 LEU 11 HD11 LEU 11 -15.722 2.213 3.915 88 HD12 LEU 11 HD12 LEU 11 -14.082 2.780 4.176 89 HD13 LEU 11 HD13 LEU 11 -14.399 1.084 3.639 90 HD21 LEU 11 HD21 LEU 11 -15.885 3.809 0.883 91 HD22 LEU 11 HD22 LEU 11 -14.735 4.664 1.886 92 HD23 LEU 11 HD23 LEU 11 -16.203 3.951 2.593 93 H ARG 12 H ARG 12 -11.012 3.840 -0.003 94 HA ARG 12 HA ARG 12 -9.049 1.792 -0.155 95 HB2 ARG 12 HB2 ARG 12 -7.972 3.328 -1.942 96 HB3 ARG 12 HB3 ARG 12 -9.521 2.607 -2.184 97 HG2 ARG 12 HG2 ARG 12 -10.647 4.481 -2.335 98 HG3 ARG 12 HG3 ARG 12 -9.757 5.286 -1.037 99 HD2 ARG 12 HD2 ARG 12 -8.297 6.249 -2.361 100 HD3 ARG 12 HD3 ARG 12 -8.189 4.882 -3.491 101 HE ARG 12 HE ARG 12 -10.480 5.593 -4.308 102 HH11 ARG 12 HH11 ARG 12 -8.164 8.063 -3.030 103 HH12 ARG 12 HH12 ARG 12 -8.876 9.303 -3.979 104 HH21 ARG 12 HH21 ARG 12 -11.152 7.331 -5.726 105 HH22 ARG 12 HH22 ARG 12 -10.583 8.938 -5.414 106 H GLN 13 H GLN 13 -8.694 5.110 1.072 107 HA GLN 13 HA GLN 13 -5.932 4.845 1.620 108 HB2 GLN 13 HB2 GLN 13 -6.124 6.814 2.933 109 HB3 GLN 13 HB3 GLN 13 -7.225 6.940 1.560 110 HG2 GLN 13 HG2 GLN 13 -8.599 7.674 3.235 111 HG3 GLN 13 HG3 GLN 13 -9.030 6.007 3.126 112 HE21 GLN 13 HE21 GLN 13 -9.740 5.661 5.246 113 HE22 GLN 13 HE22 GLN 13 -8.601 5.687 6.609 114 H ALA 14 H ALA 14 -8.758 3.671 3.455 115 HA ALA 14 HA ALA 14 -7.312 3.026 5.861 116 HB1 ALA 14 HB1 ALA 14 -9.434 1.569 6.171 117 HB2 ALA 14 HB2 ALA 14 -9.660 3.333 6.037 118 HB3 ALA 14 HB3 ALA 14 -10.008 2.276 4.675 119 H VAL 15 H VAL 15 -8.088 1.263 2.824 120 HA VAL 15 HA VAL 15 -7.183 -1.250 3.865 121 HB VAL 15 HB VAL 15 -7.678 -0.300 1.032 122 HG11 VAL 15 HG11 VAL 15 -6.164 -2.263 1.000 123 HG12 VAL 15 HG12 VAL 15 -7.275 -3.130 2.090 124 HG13 VAL 15 HG13 VAL 15 -7.779 -2.695 0.442 125 HG21 VAL 15 HG21 VAL 15 -9.675 -1.846 1.403 126 HG22 VAL 15 HG22 VAL 15 -9.395 -1.657 3.131 127 HG23 VAL 15 HG23 VAL 15 -9.757 -0.251 2.100 128 H LEU 16 H LEU 16 -5.730 1.258 1.645 129 HA LEU 16 HA LEU 16 -3.277 -0.097 1.394 130 HB2 LEU 16 HB2 LEU 16 -2.227 1.854 0.611 131 HB3 LEU 16 HB3 LEU 16 -3.815 1.698 -0.066 132 HG LEU 16 HG LEU 16 -4.438 3.317 1.960 133 HD11 LEU 16 HD11 LEU 16 -1.612 4.146 1.295 134 HD12 LEU 16 HD12 LEU 16 -2.101 3.430 2.828 135 HD13 LEU 16 HD13 LEU 16 -2.739 5.015 2.359 136 HD21 LEU 16 HD21 LEU 16 -4.157 5.244 0.324 137 HD22 LEU 16 HD22 LEU 16 -4.952 3.824 -0.382 138 HD23 LEU 16 HD23 LEU 16 -3.241 4.140 -0.713 139 H GLN 17 H GLN 17 -4.411 1.997 4.075 140 HA GLN 17 HA GLN 17 -1.976 2.316 5.376 141 HB2 GLN 17 HB2 GLN 17 -4.825 2.100 6.322 142 HB3 GLN 17 HB3 GLN 17 -3.542 1.961 7.528 143 HG2 GLN 17 HG2 GLN 17 -2.584 4.120 6.708 144 HG3 GLN 17 HG3 GLN 17 -3.949 4.263 5.609 145 HE21 GLN 17 HE21 GLN 17 -5.598 5.615 6.490 146 HE22 GLN 17 HE22 GLN 17 -5.852 5.789 8.195 147 H LYS 18 H LYS 18 -4.182 -0.645 5.616 148 HA LYS 18 HA LYS 18 -2.216 -1.914 7.351 149 HB2 LYS 18 HB2 LYS 18 -3.390 -3.828 7.378 150 HB3 LYS 18 HB3 LYS 18 -4.554 -2.532 7.428 151 HG2 LYS 18 HG2 LYS 18 -4.173 -3.396 4.658 152 HG3 LYS 18 HG3 LYS 18 -4.317 -4.795 5.695 153 HD2 LYS 18 HD2 LYS 18 -6.403 -3.007 6.553 154 HD3 LYS 18 HD3 LYS 18 -6.297 -2.847 4.809 155 HE2 LYS 18 HE2 LYS 18 -7.660 -4.659 4.881 156 HE3 LYS 18 HE3 LYS 18 -6.036 -5.396 4.777 157 HZ1 LYS 18 HZ1 LYS 18 -6.166 -6.046 7.010 158 HZ2 LYS 18 HZ2 LYS 18 -7.578 -6.434 6.330 159 HZ3 LYS 18 HZ3 LYS 18 -7.513 -5.120 7.325 160 H LYS 19 H LYS 19 -2.764 -1.961 3.805 161 HA LYS 19 HA LYS 19 -0.959 -3.975 3.136 162 HB2 LYS 19 HB2 LYS 19 -1.668 -1.439 1.606 163 HB3 LYS 19 HB3 LYS 19 -0.616 -2.673 0.980 164 HG2 LYS 19 HG2 LYS 19 -2.431 -4.366 1.255 165 HG3 LYS 19 HG3 LYS 19 -3.530 -3.098 1.790 166 HD2 LYS 19 HD2 LYS 19 -3.529 -2.047 -0.352 167 HD3 LYS 19 HD3 LYS 19 -2.115 -2.955 -0.907 168 HE2 LYS 19 HE2 LYS 19 -4.569 -4.516 -0.111 169 HE3 LYS 19 HE3 LYS 19 -4.605 -3.614 -1.640 170 HZ1 LYS 19 HZ1 LYS 19 -2.739 -4.834 -2.433 171 HZ2 LYS 19 HZ2 LYS 19 -3.872 -5.842 -1.971 172 HZ3 LYS 19 HZ3 LYS 19 -2.575 -5.670 -1.004 173 H ILE 20 H ILE 20 -0.179 -0.508 3.863 174 HA ILE 20 HA ILE 20 2.476 -0.726 3.047 175 HB ILE 20 HB ILE 20 1.637 0.952 5.424 176 HG12 ILE 20 HG12 ILE 20 0.039 1.661 3.915 177 HG13 ILE 20 HG13 ILE 20 1.308 2.833 3.738 178 HG21 ILE 20 HG21 ILE 20 3.421 2.491 4.575 179 HG22 ILE 20 HG22 ILE 20 4.046 0.909 5.038 180 HG23 ILE 20 HG23 ILE 20 3.822 1.300 3.326 181 HD11 ILE 20 HD11 ILE 20 0.502 2.369 1.563 182 HD12 ILE 20 HD12 ILE 20 2.074 1.539 1.664 183 HD13 ILE 20 HD13 ILE 20 0.563 0.624 1.786 184 H LYS 21 H LYS 21 0.965 -1.635 6.124 185 HA LYS 21 HA LYS 21 3.349 -2.294 7.597 186 HB2 LYS 21 HB2 LYS 21 0.636 -3.579 8.019 187 HB3 LYS 21 HB3 LYS 21 1.898 -3.252 9.197 188 HG2 LYS 21 HG2 LYS 21 1.490 -0.830 9.000 189 HG3 LYS 21 HG3 LYS 21 0.260 -1.130 7.770 190 HD2 LYS 21 HD2 LYS 21 -0.921 -2.557 9.484 191 HD3 LYS 21 HD3 LYS 21 0.145 -1.836 10.698 192 HE2 LYS 21 HE2 LYS 21 -1.724 -0.402 8.757 193 HE3 LYS 21 HE3 LYS 21 -2.033 -0.635 10.489 194 HZ1 LYS 21 HZ1 LYS 21 0.120 1.041 9.307 195 HZ2 LYS 21 HZ2 LYS 21 -0.068 0.774 10.914 196 HZ3 LYS 21 HZ3 LYS 21 -1.249 1.561 10.088 197 H GLU 22 H GLU 22 1.277 -4.035 5.303 198 HA GLU 22 HA GLU 22 2.311 -6.640 6.006 199 HB2 GLU 22 HB2 GLU 22 0.964 -5.737 3.423 200 HB3 GLU 22 HB3 GLU 22 1.298 -7.409 3.913 201 HG2 GLU 22 HG2 GLU 22 -0.051 -6.930 5.996 202 HG3 GLU 22 HG3 GLU 22 -0.589 -5.440 5.224 203 H ARG 23 H ARG 23 2.903 -4.387 3.235 204 HA ARG 23 HA ARG 23 4.907 -6.030 2.078 205 HB2 ARG 23 HB2 ARG 23 5.560 -4.099 0.744 206 HB3 ARG 23 HB3 ARG 23 3.839 -4.377 0.798 207 HG2 ARG 23 HG2 ARG 23 3.892 -2.106 0.941 208 HG3 ARG 23 HG3 ARG 23 3.713 -2.571 2.605 209 HD2 ARG 23 HD2 ARG 23 5.286 -0.646 2.167 210 HD3 ARG 23 HD3 ARG 23 5.923 -1.918 3.177 211 HE ARG 23 HE ARG 23 7.608 -2.219 1.705 212 HH11 ARG 23 HH11 ARG 23 4.856 -1.174 -0.248 213 HH12 ARG 23 HH12 ARG 23 5.738 -1.086 -1.697 214 HH21 ARG 23 HH21 ARG 23 8.833 -1.947 -0.156 215 HH22 ARG 23 HH22 ARG 23 8.123 -1.388 -1.626 216 H ILE 24 H ILE 24 5.276 -3.542 4.638 217 HA ILE 24 HA ILE 24 8.145 -3.764 4.581 218 HB ILE 24 HB ILE 24 6.993 -1.763 5.349 219 HG12 ILE 24 HG12 ILE 24 8.742 -3.095 7.455 220 HG13 ILE 24 HG13 ILE 24 9.221 -1.972 6.181 221 HG21 ILE 24 HG21 ILE 24 5.104 -3.051 6.486 222 HG22 ILE 24 HG22 ILE 24 6.145 -3.169 7.902 223 HG23 ILE 24 HG23 ILE 24 5.635 -1.583 7.262 224 HD11 ILE 24 HD11 ILE 24 7.482 -1.393 8.619 225 HD12 ILE 24 HD12 ILE 24 9.121 -0.779 8.303 226 HD13 ILE 24 HD13 ILE 24 7.744 -0.227 7.306 227 H GLN 25 H GLN 25 5.583 -5.207 6.716 228 HA GLN 25 HA GLN 25 7.488 -6.522 8.399 229 HB2 GLN 25 HB2 GLN 25 5.145 -5.836 8.956 230 HB3 GLN 25 HB3 GLN 25 4.545 -7.124 7.902 231 HG2 GLN 25 HG2 GLN 25 5.734 -8.761 9.443 232 HG3 GLN 25 HG3 GLN 25 6.097 -7.374 10.493 233 HE21 GLN 25 HE21 GLN 25 4.437 -6.735 11.949 234 HE22 GLN 25 HE22 GLN 25 2.845 -7.492 11.930 235 H ASN 26 H ASN 26 5.459 -7.690 5.660 236 HA ASN 26 HA ASN 26 6.493 -10.410 5.907 237 HB2 ASN 26 HB2 ASN 26 4.775 -9.148 3.726 238 HB3 ASN 26 HB3 ASN 26 5.194 -10.839 3.840 239 HD21 ASN 26 HD21 ASN 26 3.353 -8.293 5.372 240 HD22 ASN 26 HD22 ASN 26 2.249 -9.376 6.235 241 H SER 27 H SER 27 6.686 -7.772 3.433 242 HA SER 27 HA SER 27 8.049 -7.473 1.635 243 HB2 SER 27 HB2 SER 27 9.721 -7.805 4.054 244 HB3 SER 27 HB3 SER 27 10.602 -7.844 2.502 245 HG SER 27 HG SER 27 8.694 -5.854 2.976 246 H LEU 28 H LEU 28 6.780 -9.855 1.472 247 HA LEU 28 HA LEU 28 8.534 -11.391 -0.226 248 HB2 LEU 28 HB2 LEU 28 8.097 -13.550 0.870 249 HB3 LEU 28 HB3 LEU 28 9.039 -12.470 1.875 250 HG LEU 28 HG LEU 28 6.886 -11.898 3.119 251 HD11 LEU 28 HD11 LEU 28 5.103 -12.667 1.852 252 HD12 LEU 28 HD12 LEU 28 5.234 -13.853 3.133 253 HD13 LEU 28 HD13 LEU 28 5.878 -14.225 1.520 254 HD21 LEU 28 HD21 LEU 28 7.102 -14.022 4.495 255 HD22 LEU 28 HD22 LEU 28 8.576 -13.091 4.200 256 HD23 LEU 28 HD23 LEU 28 8.294 -14.555 3.280 257 H SER 29 H SER 29 7.119 -13.280 -1.043 258 HA SER 29 HA SER 29 4.376 -12.257 -1.650 259 HB2 SER 29 HB2 SER 29 6.316 -13.940 -3.273 260 HB3 SER 29 HB3 SER 29 4.657 -13.564 -3.763 261 HG SER 29 HG SER 29 5.282 -11.297 -3.551 262 H THR 30 H THR 30 5.992 -15.433 -1.930 263 HA THR 30 HA THR 30 3.849 -16.684 -0.323 264 HB THR 30 HB THR 30 3.557 -16.966 -2.691 265 HG1 THR 30 HG1 THR 30 3.494 -19.203 -2.739 266 HG21 THR 30 HG21 THR 30 5.750 -16.562 -3.572 267 HG22 THR 30 HG22 THR 30 5.360 -18.210 -4.022 268 HG23 THR 30 HG23 THR 30 6.481 -17.882 -2.669 269 H GLU 31 H GLU 31 5.769 -15.849 1.038 270 HA GLU 31 HA GLU 31 7.529 -16.314 2.509 271 HB2 GLU 31 HB2 GLU 31 6.428 -19.121 2.170 272 HB3 GLU 31 HB3 GLU 31 7.459 -18.533 3.485 273 HG2 GLU 31 HG2 GLU 31 5.732 -16.887 4.127 274 HG3 GLU 31 HG3 GLU 31 4.681 -17.457 2.831 275 H LYS 32 H LYS 32 8.420 -15.921 -0.032 276 HA LYS 32 HA LYS 32 9.983 -18.054 -1.045 277 HB2 LYS 32 HB2 LYS 32 9.136 -15.806 -2.191 278 HB3 LYS 32 HB3 LYS 32 10.687 -15.183 -1.646 279 HG2 LYS 32 HG2 LYS 32 11.327 -15.955 -3.702 280 HG3 LYS 32 HG3 LYS 32 11.605 -17.438 -2.820 281 HD2 LYS 32 HD2 LYS 32 9.175 -16.689 -4.451 282 HD3 LYS 32 HD3 LYS 32 10.406 -17.842 -4.941 283 HE2 LYS 32 HE2 LYS 32 8.559 -18.206 -2.541 284 HE3 LYS 32 HE3 LYS 32 8.228 -18.863 -4.141 285 HZ1 LYS 32 HZ1 LYS 32 9.459 -20.244 -2.292 286 HZ2 LYS 32 HZ2 LYS 32 10.800 -19.550 -2.939 287 HZ3 LYS 32 HZ3 LYS 32 9.822 -20.450 -3.876 288 H TYR 33 H TYR 33 12.643 -17.362 -1.388 289 HA TYR 33 HA TYR 33 13.736 -16.338 1.114 290 HB2 TYR 33 HB2 TYR 33 13.273 -18.883 1.238 291 HB3 TYR 33 HB3 TYR 33 14.540 -19.067 0.043 292 HD1 TYR 33 HD1 TYR 33 16.630 -19.680 0.954 293 HD2 TYR 33 HD2 TYR 33 13.975 -17.206 3.302 294 HE1 TYR 33 HE1 TYR 33 18.203 -19.782 2.846 295 HE2 TYR 33 HE2 TYR 33 15.555 -17.296 5.183 296 HH TYR 33 HH TYR 33 17.631 -18.023 5.944 297 H GLY 34 H GLY 34 16.223 -16.387 0.881 298 HA2 GLY 34 HA2 GLY 34 17.962 -16.524 -0.999 299 HA3 GLY 34 HA3 GLY 34 16.960 -15.281 -1.778 300 H SER 35 H SER 35 19.458 -15.839 0.456 301 HA SER 35 HA SER 35 19.417 -13.051 1.464 302 HB2 SER 35 HB2 SER 35 18.615 -14.693 3.183 303 HB3 SER 35 HB3 SER 35 20.171 -15.533 3.047 304 HG SER 35 HG SER 35 19.943 -13.917 4.774 305 H GLY 36 H GLY 36 21.777 -12.777 2.540 306 HA2 GLY 36 HA2 GLY 36 24.119 -13.127 2.355 307 HA3 GLY 36 HA3 GLY 36 23.894 -13.959 0.814 308 H SER 37 H SER 37 25.453 -11.467 1.785 309 HA SER 37 HA SER 37 24.937 -9.778 -0.557 310 HB2 SER 37 HB2 SER 37 23.697 -8.882 1.509 311 HB3 SER 37 HB3 SER 37 25.280 -8.672 2.267 312 HG SER 37 HG SER 37 24.328 -7.470 -0.140 313 H GLY 38 H GLY 38 26.845 -8.015 -0.362 314 HA2 GLY 38 HA2 GLY 38 29.409 -9.334 0.369 315 HA3 GLY 38 HA3 GLY 38 29.148 -8.645 -1.252 316 H SER 39 H SER 39 31.210 -7.547 0.135 317 HA SER 39 HA SER 39 30.342 -4.828 0.636 318 HB2 SER 39 HB2 SER 39 31.804 -4.838 2.761 319 HB3 SER 39 HB3 SER 39 30.182 -5.524 2.879 320 HG SER 39 HG SER 39 30.972 -7.434 3.211 321 H GLY 40 H GLY 40 32.616 -3.531 0.987 322 HA2 GLY 40 HA2 GLY 40 35.041 -4.447 0.156 323 HA3 GLY 40 HA3 GLY 40 34.164 -4.112 -1.358 324 H SER 41 H SER 41 35.964 -2.395 -1.511 325 HA SER 41 HA SER 41 34.936 0.153 -0.568 326 HB2 SER 41 HB2 SER 41 36.524 -0.678 1.221 327 HB3 SER 41 HB3 SER 41 37.807 -0.732 -0.003 328 HG SER 41 HG SER 41 37.687 1.224 1.283 329 H GLY 42 H GLY 42 35.803 1.847 -1.950 330 HA2 GLY 42 HA2 GLY 42 37.704 1.999 -3.791 331 HA3 GLY 42 HA3 GLY 42 36.573 0.912 -4.623 332 H SER 43 H SER 43 37.134 3.413 -5.729 333 HA SER 43 HA SER 43 35.127 5.368 -4.978 334 HB2 SER 43 HB2 SER 43 36.122 6.455 -7.085 335 HB3 SER 43 HB3 SER 43 37.240 6.179 -5.739 336 HG SER 43 HG SER 43 36.885 4.428 -7.939 337 H GLY 44 H GLY 44 32.972 5.120 -5.635 338 HA2 GLY 44 HA2 GLY 44 32.007 5.105 -8.141 339 HA3 GLY 44 HA3 GLY 44 32.364 3.386 -7.930 340 H SER 45 H SER 45 31.101 2.144 -6.591 341 HA SER 45 HA SER 45 29.309 1.391 -5.564 342 HB2 SER 45 HB2 SER 45 30.076 3.731 -4.023 343 HB3 SER 45 HB3 SER 45 28.321 3.510 -3.953 344 HG SER 45 HG SER 45 28.672 1.338 -3.379 345 H GLY 46 H GLY 46 28.867 3.654 -7.921 346 HA2 GLY 46 HA2 GLY 46 26.108 4.289 -7.687 347 HA3 GLY 46 HA3 GLY 46 27.070 4.281 -9.177 348 H SER 47 H SER 47 24.292 3.359 -8.634 349 HA SER 47 HA SER 47 24.039 1.206 -10.320 350 HB2 SER 47 HB2 SER 47 23.064 -0.414 -8.511 351 HB3 SER 47 HB3 SER 47 24.797 -0.404 -8.836 352 HG SER 47 HG SER 47 25.166 0.149 -6.923 353 H GLY 48 H GLY 48 21.575 0.584 -10.339 354 HA2 GLY 48 HA2 GLY 48 19.676 1.960 -8.774 355 HA3 GLY 48 HA3 GLY 48 20.040 2.912 -10.231 356 H SER 49 H SER 49 17.619 2.333 -10.489 357 HA SER 49 HA SER 49 17.400 0.172 -12.437 358 HB2 SER 49 HB2 SER 49 15.397 -0.843 -11.323 359 HB3 SER 49 HB3 SER 49 16.929 -1.192 -10.537 360 HG SER 49 HG SER 49 14.984 -0.503 -9.260 361 H GLY 50 H GLY 50 15.340 2.328 -10.391 362 HA2 GLY 50 HA2 GLY 50 14.541 4.080 -12.482 363 HA3 GLY 50 HA3 GLY 50 13.295 2.853 -12.168 364 H SER 51 H SER 51 12.398 5.271 -11.575 365 HA SER 51 HA SER 51 12.190 5.371 -8.686 366 HB2 SER 51 HB2 SER 51 12.571 7.887 -8.751 367 HB3 SER 51 HB3 SER 51 14.017 6.887 -8.905 368 HG SER 51 HG SER 51 14.061 8.529 -10.430 369 H GLY 52 H GLY 52 10.395 7.183 -8.295 370 HA2 GLY 52 HA2 GLY 52 8.493 7.602 -10.458 371 HA3 GLY 52 HA3 GLY 52 7.971 6.405 -9.253 372 H SER 53 H SER 53 6.224 8.111 -8.738 373 HA SER 53 HA SER 53 7.140 9.842 -6.572 374 HB2 SER 53 HB2 SER 53 5.735 10.921 -9.053 375 HB3 SER 53 HB3 SER 53 5.944 11.813 -7.539 376 HG SER 53 HG SER 53 8.263 10.741 -8.631 377 H GLY 54 H GLY 54 5.548 10.033 -5.059 378 HA2 GLY 54 HA2 GLY 54 2.711 9.721 -5.613 379 HA3 GLY 54 HA3 GLY 54 3.457 8.355 -4.750 380 H SER 55 H SER 55 1.469 9.947 -3.593 381 HA SER 55 HA SER 55 2.914 11.604 -1.581 382 HB2 SER 55 HB2 SER 55 0.948 12.585 -2.841 383 HB3 SER 55 HB3 SER 55 -0.083 11.361 -2.098 384 HG SER 55 HG SER 55 0.631 12.233 -0.019 385 H GLY 56 H GLY 56 2.747 11.048 0.570 386 HA2 GLY 56 HA2 GLY 56 1.693 8.346 1.276 387 HA3 GLY 56 HA3 GLY 56 3.069 9.193 2.006 388 H SER 57 H SER 57 1.271 8.315 3.783 389 HA SER 57 HA SER 57 0.336 10.795 4.935 390 HB2 SER 57 HB2 SER 57 -2.031 9.801 5.254 391 HB3 SER 57 HB3 SER 57 -1.627 10.513 3.690 392 HG SER 57 HG SER 57 -1.029 8.295 3.061 393 H GLY 58 H GLY 58 -0.079 10.561 7.153 394 HA2 GLY 58 HA2 GLY 58 0.148 9.632 9.242 395 HA3 GLY 58 HA3 GLY 58 -0.075 8.034 8.509 396 H TYR 59 H TYR 59 1.446 7.523 10.226 397 HA TYR 59 HA TYR 59 4.165 8.343 10.263 398 HB2 TYR 59 HB2 TYR 59 2.895 5.870 11.479 399 HB3 TYR 59 HB3 TYR 59 4.344 6.699 12.034 400 HD1 TYR 59 HD1 TYR 59 3.577 9.549 12.101 401 HD2 TYR 59 HD2 TYR 59 1.328 6.040 13.254 402 HE1 TYR 59 HE1 TYR 59 2.195 10.928 13.568 403 HE2 TYR 59 HE2 TYR 59 -0.082 7.444 14.727 404 HH TYR 59 HH TYR 59 0.457 10.982 15.052 405 H GLN3288 H GLN3288 3.568 7.410 7.566 406 HA GLN3288 HA GLN3288 4.854 4.793 7.278 407 HB2 GLN3288 HB2 GLN3288 4.373 4.959 4.965 408 HB3 GLN3288 HB3 GLN3288 2.966 5.479 5.854 409 HG2 GLN3288 HG2 GLN3288 3.358 7.804 5.327 410 HG3 GLN3288 HG3 GLN3288 4.932 7.422 4.600 411 HE21 GLN3288 HE21 GLN3288 4.749 7.504 2.383 412 HE22 GLN3288 HE22 GLN3288 3.519 6.670 1.453 413 H ILE3289 H ILE3289 6.558 4.898 5.191 414 HA ILE3289 HA ILE3289 8.753 6.665 6.088 415 HB ILE3289 HB ILE3289 9.103 3.899 4.902 416 HG12 ILE3289 HG12 ILE3289 9.151 4.602 7.864 417 HG13 ILE3289 HG13 ILE3289 7.861 3.691 7.088 418 HG21 ILE3289 HG21 ILE3289 10.951 5.723 6.529 419 HG22 ILE3289 HG22 ILE3289 11.390 4.176 5.782 420 HG23 ILE3289 HG23 ILE3289 10.985 5.553 4.759 421 HD11 ILE3289 HD11 ILE3289 10.722 2.742 7.373 422 HD12 ILE3289 HD12 ILE3289 9.267 2.112 8.158 423 HD13 ILE3289 HD13 ILE3289 9.460 1.930 6.413 424 H GLU3290 H GLU3290 8.187 8.271 4.664 425 HA GLU3290 HA GLU3290 7.507 8.015 1.960 426 HB2 GLU3290 HB2 GLU3290 7.510 10.019 3.789 427 HB3 GLU3290 HB3 GLU3290 9.027 10.416 2.987 428 HG2 GLU3290 HG2 GLU3290 7.508 11.613 1.719 429 HG3 GLU3290 HG3 GLU3290 7.604 10.118 0.781 430 H THR3291 H THR3291 10.486 7.533 3.325 431 HA THR3291 HA THR3291 11.966 7.896 0.752 432 HB THR3291 HB THR3291 12.469 9.629 2.285 433 HG1 THR3291 HG1 THR3291 14.243 8.357 1.100 434 HG21 THR3291 HG21 THR3291 13.276 7.508 4.288 435 HG22 THR3291 HG22 THR3291 11.979 8.713 4.455 436 HG23 THR3291 HG23 THR3291 13.665 9.236 4.420 437 H PHE3292 H PHE3292 10.631 5.569 1.159 438 HA PHE3292 HA PHE3292 12.832 3.663 1.189 439 HB2 PHE3292 HB2 PHE3292 12.170 3.765 3.565 440 HB3 PHE3292 HB3 PHE3292 10.498 3.396 3.129 441 HD1 PHE3292 HD1 PHE3292 13.639 1.741 1.768 442 HD2 PHE3292 HD2 PHE3292 10.176 1.376 4.318 443 HE1 PHE3292 HE1 PHE3292 14.095 -0.636 2.053 444 HE2 PHE3292 HE2 PHE3292 10.634 -1.051 4.571 445 HZ PHE3292 HZ PHE3292 12.609 -2.066 3.448 446 H PHE3293 H PHE3293 9.231 3.913 1.233 447 HA PHE3293 HA PHE3293 9.216 2.276 -1.261 448 HB2 PHE3293 HB2 PHE3293 7.052 1.289 -0.239 449 HB3 PHE3293 HB3 PHE3293 8.624 0.796 0.381 450 HD1 PHE3293 HD1 PHE3293 8.418 0.228 2.617 451 HD2 PHE3293 HD2 PHE3293 6.487 3.828 1.209 452 HE1 PHE3293 HE1 PHE3293 7.777 0.811 4.926 453 HE2 PHE3293 HE2 PHE3293 5.860 4.393 3.468 454 HZ PHE3293 HZ PHE3293 6.417 2.826 5.386 455 H ALA3294 H ALA3294 8.606 5.362 -0.492 456 HA ALA3294 HA ALA3294 5.973 5.880 -1.202 457 HB1 ALA3294 HB1 ALA3294 8.353 7.567 -1.936 458 HB2 ALA3294 HB2 ALA3294 6.671 8.096 -1.739 459 HB3 ALA3294 HB3 ALA3294 7.582 7.512 -0.331 460 H GLN3295 H GLN3295 8.606 4.926 -3.304 461 HA GLN3295 HA GLN3295 7.425 5.752 -5.799 462 HB2 GLN3295 HB2 GLN3295 9.325 3.423 -5.496 463 HB3 GLN3295 HB3 GLN3295 9.133 4.491 -6.869 464 HG2 GLN3295 HG2 GLN3295 10.366 5.287 -4.180 465 HG3 GLN3295 HG3 GLN3295 11.240 4.793 -5.622 466 HE21 GLN3295 HE21 GLN3295 8.731 7.339 -4.668 467 HE22 GLN3295 HE22 GLN3295 9.433 8.508 -5.736 468 H ASP3296 H ASP3296 7.153 2.768 -3.863 469 HA ASP3296 HA ASP3296 5.569 1.362 -5.953 470 HB2 ASP3296 HB2 ASP3296 7.170 0.043 -4.720 471 HB3 ASP3296 HB3 ASP3296 6.450 0.531 -3.176 472 H ILE3297 H ILE3297 5.187 3.230 -3.030 473 HA ILE3297 HA ILE3297 2.615 2.465 -2.213 474 HB ILE3297 HB ILE3297 4.553 4.530 -1.708 475 HG12 ILE3297 HG12 ILE3297 3.647 4.580 0.512 476 HG13 ILE3297 HG13 ILE3297 2.239 3.645 0.011 477 HG21 ILE3297 HG21 ILE3297 3.110 6.121 -2.765 478 HG22 ILE3297 HG22 ILE3297 1.744 5.651 -1.746 479 HG23 ILE3297 HG23 ILE3297 3.183 6.427 -1.028 480 HD11 ILE3297 HD11 ILE3297 5.069 2.588 -0.231 481 HD12 ILE3297 HD12 ILE3297 4.068 2.350 1.193 482 HD13 ILE3297 HD13 ILE3297 3.563 1.674 -0.368 483 H GLU3298 H GLU3298 3.577 4.693 -4.791 484 HA GLU3298 HA GLU3298 0.946 5.753 -5.267 485 HB2 GLU3298 HB2 GLU3298 1.790 6.632 -7.323 486 HB3 GLU3298 HB3 GLU3298 3.029 6.787 -6.093 487 HG2 GLU3298 HG2 GLU3298 4.402 6.068 -7.723 488 HG3 GLU3298 HG3 GLU3298 3.885 4.486 -7.163 489 H SER3299 H SER3299 2.702 2.890 -6.373 490 HA SER3299 HA SER3299 0.837 2.040 -8.319 491 HB2 SER3299 HB2 SER3299 2.809 0.281 -6.812 492 HB3 SER3299 HB3 SER3299 2.240 0.177 -8.466 493 HG SER3299 HG SER3299 3.260 2.445 -8.601 494 H VAL3300 H VAL3300 1.339 1.264 -4.898 495 HA VAL3300 HA VAL3300 -0.690 -0.733 -4.645 496 HB VAL3300 HB VAL3300 0.639 1.163 -2.639 497 HG11 VAL3300 HG11 VAL3300 -1.233 -1.164 -2.078 498 HG12 VAL3300 HG12 VAL3300 -0.183 -0.400 -0.863 499 HG13 VAL3300 HG13 VAL3300 -1.468 0.540 -1.627 500 HG21 VAL3300 HG21 VAL3300 1.925 -0.833 -2.005 501 HG22 VAL3300 HG22 VAL3300 1.043 -1.809 -3.200 502 HG23 VAL3300 HG23 VAL3300 2.119 -0.516 -3.733 503 H GLN3301 H GLN3301 -0.737 2.846 -3.975 504 HA GLN3301 HA GLN3301 -3.538 2.742 -3.326 505 HB2 GLN3301 HB2 GLN3301 -3.553 5.046 -3.075 506 HB3 GLN3301 HB3 GLN3301 -1.984 4.462 -2.529 507 HG2 GLN3301 HG2 GLN3301 -1.182 6.194 -3.702 508 HG3 GLN3301 HG3 GLN3301 -1.327 5.059 -5.042 509 HE21 GLN3301 HE21 GLN3301 -4.351 5.305 -5.315 510 HE22 GLN3301 HE22 GLN3301 -4.487 6.783 -6.199 511 H LYS3302 H LYS3302 -1.784 3.138 -6.380 512 HA LYS3302 HA LYS3302 -3.997 3.990 -7.979 513 HB2 LYS3302 HB2 LYS3302 -1.320 2.731 -8.529 514 HB3 LYS3302 HB3 LYS3302 -2.525 2.785 -9.818 515 HG2 LYS3302 HG2 LYS3302 -2.681 5.097 -9.844 516 HG3 LYS3302 HG3 LYS3302 -1.934 5.298 -8.253 517 HD2 LYS3302 HD2 LYS3302 -0.494 6.062 -10.055 518 HD3 LYS3302 HD3 LYS3302 0.247 4.784 -9.107 519 HE2 LYS3302 HE2 LYS3302 -0.275 3.133 -10.874 520 HE3 LYS3302 HE3 LYS3302 -0.989 4.429 -11.850 521 HZ1 LYS3302 HZ1 LYS3302 1.823 4.326 -10.922 522 HZ2 LYS3302 HZ2 LYS3302 1.181 5.524 -11.804 523 HZ3 LYS3302 HZ3 LYS3302 1.327 4.030 -12.475 524 H GLU3303 H GLU3303 -3.078 0.860 -6.621 525 HA GLU3303 HA GLU3303 -4.785 -0.652 -8.438 526 HB2 GLU3303 HB2 GLU3303 -3.741 -2.420 -7.577 527 HB3 GLU3303 HB3 GLU3303 -2.768 -1.355 -6.573 528 HG2 GLU3303 HG2 GLU3303 -4.356 -1.573 -4.726 529 HG3 GLU3303 HG3 GLU3303 -5.478 -2.492 -5.729 530 H LEU3304 H LEU3304 -5.074 0.774 -5.193 531 HA LEU3304 HA LEU3304 -7.748 -0.193 -4.742 532 HB2 LEU3304 HB2 LEU3304 -6.147 2.041 -3.425 533 HB3 LEU3304 HB3 LEU3304 -7.642 1.345 -2.846 534 HG LEU3304 HG LEU3304 -4.898 0.053 -2.963 535 HD11 LEU3304 HD11 LEU3304 -5.271 -0.119 -0.570 536 HD12 LEU3304 HD12 LEU3304 -6.947 0.463 -0.781 537 HD13 LEU3304 HD13 LEU3304 -5.614 1.554 -1.117 538 HD21 LEU3304 HD21 LEU3304 -7.519 -1.356 -2.309 539 HD22 LEU3304 HD22 LEU3304 -5.896 -2.023 -2.062 540 HD23 LEU3304 HD23 LEU3304 -6.475 -1.712 -3.691 541 H GLU3305 H GLU3305 -6.609 2.890 -6.057 542 HA GLU3305 HA GLU3305 -9.055 4.301 -5.501 543 HB2 GLU3305 HB2 GLU3305 -8.278 5.967 -7.166 544 HB3 GLU3305 HB3 GLU3305 -7.045 5.541 -5.957 545 HG2 GLU3305 HG2 GLU3305 -6.021 3.979 -7.488 546 HG3 GLU3305 HG3 GLU3305 -7.252 4.245 -8.710 547 H ASN3306 H ASN3306 -8.562 1.739 -7.639 548 HA ASN3306 HA ASN3306 -10.917 2.536 -9.289 549 HB2 ASN3306 HB2 ASN3306 -10.265 0.959 -10.936 550 HB3 ASN3306 HB3 ASN3306 -8.903 2.035 -10.618 551 HD21 ASN3306 HD21 ASN3306 -6.921 1.089 -10.014 552 HD22 ASN3306 HD22 ASN3306 -6.821 -0.620 -9.617 553 H LEU3307 H LEU3307 -10.207 0.912 -6.437 554 HA LEU3307 HA LEU3307 -12.181 -1.229 -7.072 555 HB2 LEU3307 HB2 LEU3307 -10.177 -0.767 -4.899 556 HB3 LEU3307 HB3 LEU3307 -11.679 -1.517 -4.429 557 HG LEU3307 HG LEU3307 -10.601 -3.423 -4.839 558 HD11 LEU3307 HD11 LEU3307 -10.747 -4.432 -7.005 559 HD12 LEU3307 HD12 LEU3307 -10.817 -2.849 -7.815 560 HD13 LEU3307 HD13 LEU3307 -12.180 -3.408 -6.844 561 HD21 LEU3307 HD21 LEU3307 -8.472 -2.348 -5.078 562 HD22 LEU3307 HD22 LEU3307 -8.801 -2.122 -6.829 563 HD23 LEU3307 HD23 LEU3307 -8.672 -3.760 -6.134 564 H SER3308 H SER3308 -13.963 -1.584 -5.889 565 HA SER3308 HA SER3308 -15.556 0.761 -5.197 566 HB2 SER3308 HB2 SER3308 -16.217 -2.209 -5.416 567 HB3 SER3308 HB3 SER3308 -17.366 -0.866 -5.391 568 HG SER3308 HG SER3308 -16.465 -0.082 -7.298 569 H GLU3309 H GLU3309 -17.148 0.502 -3.177 570 HA GLU3309 HA GLU3309 -15.554 0.322 -0.877 571 HB2 GLU3309 HB2 GLU3309 -18.454 0.670 -1.636 572 HB3 GLU3309 HB3 GLU3309 -18.251 -0.223 -0.112 573 HG2 GLU3309 HG2 GLU3309 -17.154 1.468 0.952 574 HG3 GLU3309 HG3 GLU3309 -16.788 2.328 -0.567 575 H GLU3310 H GLU3310 -17.831 -1.963 -2.258 576 HA GLU3310 HA GLU3310 -17.870 -3.985 -0.599 577 HB2 GLU3310 HB2 GLU3310 -17.736 -4.036 -3.623 578 HB3 GLU3310 HB3 GLU3310 -18.421 -5.321 -2.620 579 HG2 GLU3310 HG2 GLU3310 -20.250 -3.946 -1.898 580 HG3 GLU3310 HG3 GLU3310 -19.492 -2.460 -2.382 581 H GLU3311 H GLU3311 -15.167 -3.094 -2.732 582 HA GLU3311 HA GLU3311 -13.738 -5.635 -2.379 583 HB2 GLU3311 HB2 GLU3311 -13.099 -2.978 -3.696 584 HB3 GLU3311 HB3 GLU3311 -12.033 -4.367 -3.712 585 HG2 GLU3311 HG2 GLU3311 -14.872 -4.740 -4.675 586 HG3 GLU3311 HG3 GLU3311 -13.866 -3.797 -5.638 587 H LEU3312 H LEU3312 -13.331 -2.236 -1.580 588 HA LEU3312 HA LEU3312 -10.942 -2.558 -0.022 589 HB2 LEU3312 HB2 LEU3312 -12.789 -0.147 0.007 590 HB3 LEU3312 HB3 LEU3312 -11.098 -0.143 0.350 591 HG LEU3312 HG LEU3312 -12.037 -0.935 -2.409 592 HD11 LEU3312 HD11 LEU3312 -11.886 1.436 -3.053 593 HD12 LEU3312 HD12 LEU3312 -11.869 1.875 -1.334 594 HD13 LEU3312 HD13 LEU3312 -13.260 0.988 -2.043 595 HD21 LEU3312 HD21 LEU3312 -9.786 -1.361 -2.187 596 HD22 LEU3312 HD22 LEU3312 -9.455 0.125 -1.290 597 HD23 LEU3312 HD23 LEU3312 -9.862 0.208 -3.015 598 H LEU3313 H LEU3313 -14.251 -1.542 0.796 599 HA LEU3313 HA LEU3313 -14.091 -1.271 3.550 600 HB2 LEU3313 HB2 LEU3313 -15.936 -0.354 2.174 601 HB3 LEU3313 HB3 LEU3313 -16.487 -2.012 1.814 602 HG LEU3313 HG LEU3313 -16.123 -1.828 4.677 603 HD11 LEU3313 HD11 LEU3313 -17.844 0.345 3.593 604 HD12 LEU3313 HD12 LEU3313 -16.504 0.367 4.806 605 HD13 LEU3313 HD13 LEU3313 -18.030 -0.400 5.210 606 HD21 LEU3313 HD21 LEU3313 -18.654 -2.241 3.069 607 HD22 LEU3313 HD22 LEU3313 -18.344 -2.725 4.755 608 HD23 LEU3313 HD23 LEU3313 -17.441 -3.488 3.432 609 H ALA3314 H ALA3314 -14.608 -4.129 1.453 610 HA ALA3314 HA ALA3314 -15.191 -5.953 3.603 611 HB1 ALA3314 HB1 ALA3314 -14.205 -7.647 1.871 612 HB2 ALA3314 HB2 ALA3314 -15.687 -6.772 1.502 613 HB3 ALA3314 HB3 ALA3314 -14.161 -6.214 0.782 614 H MET3315 H MET3315 -12.116 -4.657 2.478 615 HA MET3315 HA MET3315 -10.488 -6.647 3.886 616 HB2 MET3315 HB2 MET3315 -9.629 -3.931 2.893 617 HB3 MET3315 HB3 MET3315 -8.601 -5.331 3.181 618 HG2 MET3315 HG2 MET3315 -10.758 -5.799 1.247 619 HG3 MET3315 HG3 MET3315 -9.752 -4.515 0.739 620 HE1 MET3315 HE1 MET3315 -6.258 -6.443 0.276 621 HE2 MET3315 HE2 MET3315 -7.122 -4.915 0.012 622 HE3 MET3315 HE3 MET3315 -6.738 -5.456 1.673 623 H LEU3316 H LEU3316 -11.136 -3.145 4.303 624 HA LEU3316 HA LEU3316 -9.805 -2.968 6.854 625 HB2 LEU3316 HB2 LEU3316 -10.840 -0.729 7.042 626 HB3 LEU3316 HB3 LEU3316 -9.950 -1.018 5.555 627 HG LEU3316 HG LEU3316 -12.399 -1.722 4.676 628 HD11 LEU3316 HD11 LEU3316 -14.149 -0.176 5.535 629 HD12 LEU3316 HD12 LEU3316 -13.010 0.498 6.714 630 HD13 LEU3316 HD13 LEU3316 -13.584 -1.155 6.869 631 HD21 LEU3316 HD21 LEU3316 -12.416 0.210 3.452 632 HD22 LEU3316 HD22 LEU3316 -10.754 0.204 3.986 633 HD23 LEU3316 HD23 LEU3316 -11.927 1.235 4.821 634 H ASN3317 H ASN3317 -13.263 -3.525 5.945 635 HA ASN3317 HA ASN3317 -14.023 -3.415 8.776 636 HB2 ASN3317 HB2 ASN3317 -15.455 -2.847 6.589 637 HB3 ASN3317 HB3 ASN3317 -15.855 -4.562 6.668 638 HD21 ASN3317 HD21 ASN3317 -15.744 -1.515 8.602 639 HD22 ASN3317 HD22 ASN3317 -16.963 -2.018 9.735 640 H GLY3318 H GLY3318 -12.936 -5.785 6.505 641 HA2 GLY3318 HA2 GLY3318 -12.257 -7.951 6.869 642 HA3 GLY3318 HA3 GLY3318 -12.838 -7.871 8.531 643 H ASP3319 H ASP3319 -15.157 -6.978 6.249 644 HA ASP3319 HA ASP3319 -16.648 -9.530 6.519 645 HB2 ASP3319 HB2 ASP3319 -17.428 -6.667 6.468 646 HB3 ASP3319 HB3 ASP3319 -18.459 -7.709 5.516 647 H GLN3320 H GLN3320 -18.388 -9.510 4.510 648 HA GLN3320 HA GLN3320 -16.793 -9.563 2.017 649 HB2 GLN3320 HB2 GLN3320 -18.781 -11.722 2.688 650 HB3 GLN3320 HB3 GLN3320 -17.413 -11.772 1.561 651 HG2 GLN3320 HG2 GLN3320 -15.968 -11.734 3.727 652 HG3 GLN3320 HG3 GLN3320 -17.490 -12.058 4.576 653 HE21 GLN3320 HE21 GLN3320 -18.453 -13.793 2.171 654 HE22 GLN3320 HE22 GLN3320 -17.543 -15.273 2.334 655 H GLN3321 H GLN3321 -18.651 -7.513 2.843 656 HA GLN3321 HA GLN3321 -21.154 -8.113 1.522 657 HB2 GLN3321 HB2 GLN3321 -20.030 -5.306 1.998 658 HB3 GLN3321 HB3 GLN3321 -21.691 -5.741 1.652 659 HG2 GLN3321 HG2 GLN3321 -20.168 -6.281 4.226 660 HG3 GLN3321 HG3 GLN3321 -21.525 -5.191 3.975 661 HE21 GLN3321 HE21 GLN3321 -20.562 -8.553 4.557 662 HE22 GLN3321 HE22 GLN3321 -22.146 -9.229 4.460 Start of MODEL 9 1 H1 MET 1 H MET 1 -25.955 5.336 -4.464 2 HA MET 1 HA MET 1 -26.914 6.616 -6.964 3 HB2 MET 1 HB2 MET 1 -27.467 7.340 -4.069 4 HB3 MET 1 HB3 MET 1 -27.541 8.548 -5.333 5 HG2 MET 1 HG2 MET 1 -29.200 6.032 -5.235 6 HG3 MET 1 HG3 MET 1 -29.726 7.646 -4.782 7 HE1 MET 1 HE1 MET 1 -30.542 9.436 -8.001 8 HE2 MET 1 HE2 MET 1 -31.081 9.111 -6.339 9 HE3 MET 1 HE3 MET 1 -29.440 9.725 -6.637 10 H ASN 2 H ASN 2 -25.294 7.557 -3.897 11 HA ASN 2 HA ASN 2 -23.960 9.733 -5.010 12 HB2 ASN 2 HB2 ASN 2 -23.565 8.131 -2.460 13 HB3 ASN 2 HB3 ASN 2 -22.520 9.488 -2.839 14 HD21 ASN 2 HD21 ASN 2 -23.569 11.677 -3.245 15 HD22 ASN 2 HD22 ASN 2 -25.020 11.994 -2.345 16 H ILE 3 H ILE 3 -21.695 10.083 -5.024 17 HA ILE 3 HA ILE 3 -20.285 8.475 -6.815 18 HB ILE 3 HB ILE 3 -20.045 10.916 -6.374 19 HG12 ILE 3 HG12 ILE 3 -17.391 9.445 -6.334 20 HG13 ILE 3 HG13 ILE 3 -18.464 9.513 -7.732 21 HG21 ILE 3 HG21 ILE 3 -19.923 10.825 -3.896 22 HG22 ILE 3 HG22 ILE 3 -18.358 10.027 -4.008 23 HG23 ILE 3 HG23 ILE 3 -18.557 11.703 -4.587 24 HD11 ILE 3 HD11 ILE 3 -18.367 12.002 -7.706 25 HD12 ILE 3 HD12 ILE 3 -17.178 11.929 -6.394 26 HD13 ILE 3 HD13 ILE 3 -16.791 11.239 -7.981 27 H ASN 4 H ASN 4 -19.266 6.700 -6.688 28 HA ASN 4 HA ASN 4 -18.714 5.532 -4.060 29 HB2 ASN 4 HB2 ASN 4 -18.453 3.419 -5.393 30 HB3 ASN 4 HB3 ASN 4 -20.037 4.171 -5.585 31 HD21 ASN 4 HD21 ASN 4 -16.959 3.384 -7.239 32 HD22 ASN 4 HD22 ASN 4 -17.461 4.102 -8.759 33 H GLU 5 H GLU 5 -17.014 6.376 -7.062 34 HA GLU 5 HA GLU 5 -14.487 5.357 -6.541 35 HB2 GLU 5 HB2 GLU 5 -15.216 7.862 -8.072 36 HB3 GLU 5 HB3 GLU 5 -13.663 6.983 -8.132 37 HG2 GLU 5 HG2 GLU 5 -14.925 4.932 -8.864 38 HG3 GLU 5 HG3 GLU 5 -16.398 5.909 -8.890 39 H GLN 6 H GLN 6 -15.878 8.416 -5.616 40 HA GLN 6 HA GLN 6 -13.498 9.498 -4.386 41 HB2 GLN 6 HB2 GLN 6 -15.722 10.639 -5.182 42 HB3 GLN 6 HB3 GLN 6 -16.296 10.285 -3.550 43 HG2 GLN 6 HG2 GLN 6 -14.519 11.608 -2.572 44 HG3 GLN 6 HG3 GLN 6 -13.720 11.768 -4.149 45 HE21 GLN 6 HE21 GLN 6 -17.034 12.449 -2.683 46 HE22 GLN 6 HE22 GLN 6 -17.163 13.981 -3.539 47 H THR 7 H THR 7 -16.096 7.383 -3.315 48 HA THR 7 HA THR 7 -15.526 7.722 -0.473 49 HB THR 7 HB THR 7 -16.989 5.477 -1.875 50 HG1 THR 7 HG1 THR 7 -18.170 7.323 -2.198 51 HG21 THR 7 HG21 THR 7 -18.013 5.189 0.437 52 HG22 THR 7 HG22 THR 7 -16.761 6.317 1.044 53 HG23 THR 7 HG23 THR 7 -16.291 4.772 0.312 54 H LEU 8 H LEU 8 -14.401 5.427 -3.045 55 HA LEU 8 HA LEU 8 -13.132 3.488 -1.496 56 HB2 LEU 8 HB2 LEU 8 -11.577 4.584 -3.821 57 HB3 LEU 8 HB3 LEU 8 -11.850 2.935 -3.288 58 HG LEU 8 HG LEU 8 -13.858 4.681 -4.710 59 HD11 LEU 8 HD11 LEU 8 -12.406 2.252 -5.797 60 HD12 LEU 8 HD12 LEU 8 -11.935 3.927 -6.143 61 HD13 LEU 8 HD13 LEU 8 -13.505 3.314 -6.677 62 HD21 LEU 8 HD21 LEU 8 -15.034 3.159 -3.311 63 HD22 LEU 8 HD22 LEU 8 -14.091 1.786 -3.949 64 HD23 LEU 8 HD23 LEU 8 -15.216 2.691 -4.997 65 H ASP 9 H ASP 9 -12.267 6.876 -2.068 66 HA ASP 9 HA ASP 9 -9.560 6.943 -1.406 67 HB2 ASP 9 HB2 ASP 9 -11.050 8.835 -2.237 68 HB3 ASP 9 HB3 ASP 9 -11.529 9.060 -0.546 69 H LYS 10 H LYS 10 -12.395 7.022 0.851 70 HA LYS 10 HA LYS 10 -10.670 7.276 3.166 71 HB2 LYS 10 HB2 LYS 10 -12.547 7.145 4.542 72 HB3 LYS 10 HB3 LYS 10 -13.130 7.960 3.086 73 HG2 LYS 10 HG2 LYS 10 -14.052 5.843 2.306 74 HG3 LYS 10 HG3 LYS 10 -13.532 5.001 3.766 75 HD2 LYS 10 HD2 LYS 10 -15.513 7.311 3.709 76 HD3 LYS 10 HD3 LYS 10 -15.947 5.615 3.498 77 HE2 LYS 10 HE2 LYS 10 -14.674 5.172 5.704 78 HE3 LYS 10 HE3 LYS 10 -14.767 6.929 5.961 79 HZ1 LYS 10 HZ1 LYS 10 -17.093 5.161 5.465 80 HZ2 LYS 10 HZ2 LYS 10 -17.158 6.752 5.838 81 HZ3 LYS 10 HZ3 LYS 10 -16.601 5.661 6.959 82 H LEU 11 H LEU 11 -11.714 4.582 1.205 83 HA LEU 11 HA LEU 11 -11.138 2.528 3.182 84 HB2 LEU 11 HB2 LEU 11 -11.823 2.403 0.198 85 HB3 LEU 11 HB3 LEU 11 -11.400 1.024 1.204 86 HG LEU 11 HG LEU 11 -13.670 0.941 0.961 87 HD11 LEU 11 HD11 LEU 11 -13.106 0.378 3.172 88 HD12 LEU 11 HD12 LEU 11 -14.642 1.232 3.191 89 HD13 LEU 11 HD13 LEU 11 -13.186 2.081 3.728 90 HD21 LEU 11 HD21 LEU 11 -13.920 3.815 1.818 91 HD22 LEU 11 HD22 LEU 11 -15.280 2.728 1.532 92 HD23 LEU 11 HD23 LEU 11 -14.231 3.195 0.204 93 H ARG 12 H ARG 12 -9.614 3.630 0.112 94 HA ARG 12 HA ARG 12 -7.403 1.889 0.305 95 HB2 ARG 12 HB2 ARG 12 -6.225 3.554 -1.265 96 HB3 ARG 12 HB3 ARG 12 -7.651 2.704 -1.788 97 HG2 ARG 12 HG2 ARG 12 -8.767 4.516 -2.263 98 HG3 ARG 12 HG3 ARG 12 -8.438 5.247 -0.685 99 HD2 ARG 12 HD2 ARG 12 -6.688 6.448 -1.382 100 HD3 ARG 12 HD3 ARG 12 -6.219 5.288 -2.659 101 HE ARG 12 HE ARG 12 -8.717 6.427 -3.377 102 HH11 ARG 12 HH11 ARG 12 -5.369 7.615 -3.029 103 HH12 ARG 12 HH12 ARG 12 -5.515 8.577 -4.488 104 HH21 ARG 12 HH21 ARG 12 -8.901 7.938 -5.000 105 HH22 ARG 12 HH22 ARG 12 -7.584 9.013 -5.398 106 H GLN 13 H GLN 13 -7.691 5.170 1.587 107 HA GLN 13 HA GLN 13 -5.050 5.259 2.593 108 HB2 GLN 13 HB2 GLN 13 -5.719 7.195 3.777 109 HB3 GLN 13 HB3 GLN 13 -6.546 7.168 2.226 110 HG2 GLN 13 HG2 GLN 13 -8.293 7.759 3.609 111 HG3 GLN 13 HG3 GLN 13 -8.498 6.044 3.459 112 HE21 GLN 13 HE21 GLN 13 -9.559 5.641 5.446 113 HE22 GLN 13 HE22 GLN 13 -8.739 5.902 6.994 114 H ALA 14 H ALA 14 -7.967 3.683 3.899 115 HA ALA 14 HA ALA 14 -6.913 3.263 6.555 116 HB1 ALA 14 HB1 ALA 14 -8.866 1.634 6.661 117 HB2 ALA 14 HB2 ALA 14 -9.315 3.298 6.230 118 HB3 ALA 14 HB3 ALA 14 -9.223 2.061 4.979 119 H VAL 15 H VAL 15 -6.917 1.442 3.473 120 HA VAL 15 HA VAL 15 -5.852 -0.995 4.636 121 HB VAL 15 HB VAL 15 -5.883 -0.043 1.761 122 HG11 VAL 15 HG11 VAL 15 -4.247 -1.920 2.151 123 HG12 VAL 15 HG12 VAL 15 -5.541 -2.866 2.902 124 HG13 VAL 15 HG13 VAL 15 -5.624 -2.439 1.182 125 HG21 VAL 15 HG21 VAL 15 -7.874 -1.654 3.379 126 HG22 VAL 15 HG22 VAL 15 -8.156 -0.198 2.398 127 HG23 VAL 15 HG23 VAL 15 -7.776 -1.701 1.614 128 H LEU 16 H LEU 16 -4.418 1.655 2.583 129 HA LEU 16 HA LEU 16 -1.826 0.689 2.655 130 HB2 LEU 16 HB2 LEU 16 -0.999 2.741 1.903 131 HB3 LEU 16 HB3 LEU 16 -2.568 2.467 1.173 132 HG LEU 16 HG LEU 16 -3.425 3.971 3.174 133 HD11 LEU 16 HD11 LEU 16 -1.840 5.817 3.697 134 HD12 LEU 16 HD12 LEU 16 -0.547 4.894 2.917 135 HD13 LEU 16 HD13 LEU 16 -1.313 4.293 4.398 136 HD21 LEU 16 HD21 LEU 16 -3.628 4.530 0.773 137 HD22 LEU 16 HD22 LEU 16 -1.930 5.068 0.754 138 HD23 LEU 16 HD23 LEU 16 -3.131 5.966 1.679 139 H GLN 17 H GLN 17 -3.489 2.405 5.279 140 HA GLN 17 HA GLN 17 -1.250 3.125 6.806 141 HB2 GLN 17 HB2 GLN 17 -4.102 2.416 7.384 142 HB3 GLN 17 HB3 GLN 17 -2.981 2.450 8.757 143 HG2 GLN 17 HG2 GLN 17 -2.285 4.735 8.154 144 HG3 GLN 17 HG3 GLN 17 -3.327 4.701 6.749 145 HE21 GLN 17 HE21 GLN 17 -5.430 5.452 7.031 146 HE22 GLN 17 HE22 GLN 17 -6.030 5.916 8.587 147 H LYS 18 H LYS 18 -2.844 -0.183 6.625 148 HA LYS 18 HA LYS 18 -0.919 -1.167 8.594 149 HB2 LYS 18 HB2 LYS 18 -1.755 -3.337 8.237 150 HB3 LYS 18 HB3 LYS 18 -3.115 -2.227 8.307 151 HG2 LYS 18 HG2 LYS 18 -2.349 -2.525 5.537 152 HG3 LYS 18 HG3 LYS 18 -2.360 -4.108 6.250 153 HD2 LYS 18 HD2 LYS 18 -4.757 -2.284 6.627 154 HD3 LYS 18 HD3 LYS 18 -4.470 -3.146 5.110 155 HE2 LYS 18 HE2 LYS 18 -5.811 -4.627 6.277 156 HE3 LYS 18 HE3 LYS 18 -4.170 -5.270 6.414 157 HZ1 LYS 18 HZ1 LYS 18 -5.393 -3.658 8.571 158 HZ2 LYS 18 HZ2 LYS 18 -4.081 -4.651 8.655 159 HZ3 LYS 18 HZ3 LYS 18 -5.536 -5.308 8.453 160 H LYS 19 H LYS 19 -1.018 -1.018 5.031 161 HA LYS 19 HA LYS 19 1.195 -2.579 4.433 162 HB2 LYS 19 HB2 LYS 19 0.222 -0.050 3.030 163 HB3 LYS 19 HB3 LYS 19 1.520 -1.021 2.454 164 HG2 LYS 19 HG2 LYS 19 -0.131 -3.029 2.616 165 HG3 LYS 19 HG3 LYS 19 -1.404 -1.844 2.925 166 HD2 LYS 19 HD2 LYS 19 -0.967 -0.812 0.718 167 HD3 LYS 19 HD3 LYS 19 0.349 -1.972 0.448 168 HE2 LYS 19 HE2 LYS 19 -2.024 -3.443 1.176 169 HE3 LYS 19 HE3 LYS 19 -2.477 -2.307 -0.104 170 HZ1 LYS 19 HZ1 LYS 19 -1.738 -4.402 -0.988 171 HZ2 LYS 19 HZ2 LYS 19 -0.291 -4.269 -0.235 172 HZ3 LYS 19 HZ3 LYS 19 -0.745 -3.254 -1.502 173 H ILE 20 H ILE 20 1.173 0.729 5.742 174 HA ILE 20 HA ILE 20 3.861 1.359 5.261 175 HB ILE 20 HB ILE 20 2.376 2.071 7.827 176 HG12 ILE 20 HG12 ILE 20 0.796 2.609 6.200 177 HG13 ILE 20 HG13 ILE 20 1.561 4.104 6.631 178 HG21 ILE 20 HG21 ILE 20 3.679 4.146 7.727 179 HG22 ILE 20 HG22 ILE 20 4.735 2.740 7.789 180 HG23 ILE 20 HG23 ILE 20 4.499 3.582 6.250 181 HD11 ILE 20 HD11 ILE 20 2.052 2.463 4.077 182 HD12 ILE 20 HD12 ILE 20 1.203 4.017 4.220 183 HD13 ILE 20 HD13 ILE 20 2.935 3.941 4.568 184 H LYS 21 H LYS 21 2.361 -0.376 7.956 185 HA LYS 21 HA LYS 21 4.739 -0.901 9.454 186 HB2 LYS 21 HB2 LYS 21 2.184 -2.534 9.500 187 HB3 LYS 21 HB3 LYS 21 3.349 -2.289 10.794 188 HG2 LYS 21 HG2 LYS 21 2.706 0.250 10.634 189 HG3 LYS 21 HG3 LYS 21 1.331 -0.286 9.670 190 HD2 LYS 21 HD2 LYS 21 1.960 -1.187 12.499 191 HD3 LYS 21 HD3 LYS 21 0.799 0.087 12.083 192 HE2 LYS 21 HE2 LYS 21 -0.648 -1.461 10.943 193 HE3 LYS 21 HE3 LYS 21 0.578 -2.733 10.995 194 HZ1 LYS 21 HZ1 LYS 21 -0.961 -3.197 12.679 195 HZ2 LYS 21 HZ2 LYS 21 -0.979 -1.664 13.245 196 HZ3 LYS 21 HZ3 LYS 21 0.365 -2.623 13.467 197 H GLU 22 H GLU 22 3.094 -2.533 6.723 198 HA GLU 22 HA GLU 22 4.413 -5.057 7.141 199 HB2 GLU 22 HB2 GLU 22 3.087 -3.831 4.653 200 HB3 GLU 22 HB3 GLU 22 3.665 -5.487 4.787 201 HG2 GLU 22 HG2 GLU 22 2.098 -6.004 6.485 202 HG3 GLU 22 HG3 GLU 22 1.522 -4.351 6.621 203 H ARG 23 H ARG 23 4.901 -2.321 4.798 204 HA ARG 23 HA ARG 23 7.213 -3.484 3.647 205 HB2 ARG 23 HB2 ARG 23 7.706 -1.279 2.718 206 HB3 ARG 23 HB3 ARG 23 6.051 -1.803 2.479 207 HG2 ARG 23 HG2 ARG 23 5.708 0.390 2.944 208 HG3 ARG 23 HG3 ARG 23 5.499 -0.306 4.547 209 HD2 ARG 23 HD2 ARG 23 6.832 1.789 4.561 210 HD3 ARG 23 HD3 ARG 23 7.767 0.439 5.178 211 HE ARG 23 HE ARG 23 8.042 1.004 2.305 212 HH11 ARG 23 HH11 ARG 23 9.656 1.157 5.494 213 HH12 ARG 23 HH12 ARG 23 11.158 1.672 4.766 214 HH21 ARG 23 HH21 ARG 23 10.114 1.636 1.465 215 HH22 ARG 23 HH22 ARG 23 11.373 1.995 2.540 216 H ILE 24 H ILE 24 6.937 -1.432 6.545 217 HA ILE 24 HA ILE 24 9.803 -1.127 6.744 218 HB ILE 24 HB ILE 24 8.254 0.502 7.713 219 HG12 ILE 24 HG12 ILE 24 10.190 -0.832 9.642 220 HG13 ILE 24 HG13 ILE 24 10.438 0.594 8.630 221 HG21 ILE 24 HG21 ILE 24 7.591 -1.459 9.931 222 HG22 ILE 24 HG22 ILE 24 6.846 0.119 9.550 223 HG23 ILE 24 HG23 ILE 24 6.602 -1.244 8.480 224 HD11 ILE 24 HD11 ILE 24 8.615 1.741 10.005 225 HD12 ILE 24 HD12 ILE 24 8.653 0.323 11.083 226 HD13 ILE 24 HD13 ILE 24 10.104 1.331 10.906 227 H GLN 25 H GLN 25 7.394 -3.347 8.371 228 HA GLN 25 HA GLN 25 9.486 -4.578 9.903 229 HB2 GLN 25 HB2 GLN 25 7.070 -4.464 10.580 230 HB3 GLN 25 HB3 GLN 25 6.659 -5.579 9.263 231 HG2 GLN 25 HG2 GLN 25 8.209 -7.267 10.326 232 HG3 GLN 25 HG3 GLN 25 8.562 -6.075 11.583 233 HE21 GLN 25 HE21 GLN 25 7.461 -6.579 13.458 234 HE22 GLN 25 HE22 GLN 25 5.788 -7.132 13.465 235 H ASN 26 H ASN 26 7.630 -5.714 7.007 236 HA ASN 26 HA ASN 26 9.036 -8.239 6.888 237 HB2 ASN 26 HB2 ASN 26 7.487 -6.733 4.700 238 HB3 ASN 26 HB3 ASN 26 8.091 -8.351 4.547 239 HD21 ASN 26 HD21 ASN 26 5.777 -6.363 6.395 240 HD22 ASN 26 HD22 ASN 26 4.708 -7.698 6.786 241 H SER 27 H SER 27 9.249 -5.214 4.950 242 HA SER 27 HA SER 27 10.782 -4.432 3.536 243 HB2 SER 27 HB2 SER 27 11.836 -4.059 5.821 244 HB3 SER 27 HB3 SER 27 12.734 -5.572 5.562 245 HG SER 27 HG SER 27 13.649 -4.644 3.723 246 H LEU 28 H LEU 28 9.934 -7.166 3.082 247 HA LEU 28 HA LEU 28 12.045 -7.990 1.212 248 HB2 LEU 28 HB2 LEU 28 11.722 -10.367 1.883 249 HB3 LEU 28 HB3 LEU 28 12.362 -9.375 3.171 250 HG LEU 28 HG LEU 28 9.949 -9.166 4.027 251 HD11 LEU 28 HD11 LEU 28 8.826 -11.583 3.279 252 HD12 LEU 28 HD12 LEU 28 9.385 -10.834 1.758 253 HD13 LEU 28 HD13 LEU 28 8.344 -9.944 2.844 254 HD21 LEU 28 HD21 LEU 28 11.370 -11.789 4.290 255 HD22 LEU 28 HD22 LEU 28 9.988 -11.275 5.272 256 HD23 LEU 28 HD23 LEU 28 11.492 -10.377 5.327 257 H SER 29 H SER 29 11.166 -9.327 -0.423 258 HA SER 29 HA SER 29 8.459 -8.590 -1.313 259 HB2 SER 29 HB2 SER 29 10.896 -9.946 -2.534 260 HB3 SER 29 HB3 SER 29 9.356 -9.908 -3.374 261 HG SER 29 HG SER 29 9.435 -7.566 -3.104 262 H THR 30 H THR 30 10.252 -11.609 -0.588 263 HA THR 30 HA THR 30 7.838 -13.021 0.045 264 HB THR 30 HB THR 30 7.675 -13.015 -2.388 265 HG1 THR 30 HG1 THR 30 6.777 -14.753 -1.664 266 HG21 THR 30 HG21 THR 30 10.037 -12.820 -3.000 267 HG22 THR 30 HG22 THR 30 9.257 -14.174 -3.838 268 HG23 THR 30 HG23 THR 30 10.335 -14.480 -2.459 269 H GLU 31 H GLU 31 10.134 -12.327 1.414 270 HA GLU 31 HA GLU 31 11.791 -13.060 2.782 271 HB2 GLU 31 HB2 GLU 31 10.756 -15.867 2.335 272 HB3 GLU 31 HB3 GLU 31 11.724 -15.260 3.684 273 HG2 GLU 31 HG2 GLU 31 9.886 -13.648 4.243 274 HG3 GLU 31 HG3 GLU 31 8.890 -14.402 2.990 275 H LYS 32 H LYS 32 12.035 -13.082 -0.188 276 HA LYS 32 HA LYS 32 13.985 -14.690 -1.252 277 HB2 LYS 32 HB2 LYS 32 12.551 -12.626 -2.183 278 HB3 LYS 32 HB3 LYS 32 13.948 -11.674 -1.707 279 HG2 LYS 32 HG2 LYS 32 14.709 -12.115 -3.798 280 HG3 LYS 32 HG3 LYS 32 15.182 -13.662 -3.140 281 HD2 LYS 32 HD2 LYS 32 13.966 -14.233 -5.092 282 HD3 LYS 32 HD3 LYS 32 12.803 -14.491 -3.787 283 HE2 LYS 32 HE2 LYS 32 11.713 -13.385 -5.625 284 HE3 LYS 32 HE3 LYS 32 11.784 -12.277 -4.248 285 HZ1 LYS 32 HZ1 LYS 32 12.367 -11.247 -6.379 286 HZ2 LYS 32 HZ2 LYS 32 13.657 -12.219 -6.549 287 HZ3 LYS 32 HZ3 LYS 32 13.559 -11.102 -5.296 288 H TYR 33 H TYR 33 16.262 -14.634 -1.328 289 HA TYR 33 HA TYR 33 18.349 -14.476 -0.484 290 HB2 TYR 33 HB2 TYR 33 17.640 -11.534 -0.258 291 HB3 TYR 33 HB3 TYR 33 19.255 -12.199 -0.214 292 HD1 TYR 33 HD1 TYR 33 20.308 -13.200 -2.202 293 HD2 TYR 33 HD2 TYR 33 16.583 -11.067 -2.389 294 HE1 TYR 33 HE1 TYR 33 20.708 -12.723 -4.614 295 HE2 TYR 33 HE2 TYR 33 16.947 -10.590 -4.783 296 HH TYR 33 HH TYR 33 18.474 -10.780 -6.641 297 H GLY 34 H GLY 34 16.190 -15.015 1.551 298 HA2 GLY 34 HA2 GLY 34 16.357 -13.829 3.985 299 HA3 GLY 34 HA3 GLY 34 16.173 -15.567 3.747 300 H SER 35 H SER 35 18.163 -13.140 5.029 301 HA SER 35 HA SER 35 20.134 -13.081 6.095 302 HB2 SER 35 HB2 SER 35 18.821 -15.200 7.070 303 HB3 SER 35 HB3 SER 35 20.175 -16.073 6.371 304 HG SER 35 HG SER 35 21.228 -15.573 8.052 305 H GLY 36 H GLY 36 20.085 -13.838 3.043 306 HA2 GLY 36 HA2 GLY 36 22.686 -15.173 2.726 307 HA3 GLY 36 HA3 GLY 36 21.534 -14.734 1.467 308 H SER 37 H SER 37 24.457 -14.261 1.701 309 HA SER 37 HA SER 37 24.427 -11.490 0.824 310 HB2 SER 37 HB2 SER 37 26.474 -10.986 2.300 311 HB3 SER 37 HB3 SER 37 24.860 -10.913 2.994 312 HG SER 37 HG SER 37 25.983 -11.975 4.440 313 H GLY 38 H GLY 38 27.471 -12.941 1.651 314 HA2 GLY 38 HA2 GLY 38 29.075 -13.995 0.355 315 HA3 GLY 38 HA3 GLY 38 27.762 -14.639 -0.650 316 H SER 39 H SER 39 29.117 -14.273 -2.528 317 HA SER 39 HA SER 39 30.032 -11.626 -3.251 318 HB2 SER 39 HB2 SER 39 29.746 -14.151 -4.941 319 HB3 SER 39 HB3 SER 39 30.829 -12.783 -5.248 320 HG SER 39 HG SER 39 31.985 -13.360 -3.373 321 H GLY 40 H GLY 40 29.428 -11.117 -5.778 322 HA2 GLY 40 HA2 GLY 40 26.462 -11.006 -6.011 323 HA3 GLY 40 HA3 GLY 40 27.554 -9.663 -6.410 324 H SER 41 H SER 41 25.781 -10.917 -8.265 325 HA SER 41 HA SER 41 27.710 -11.773 -10.320 326 HB2 SER 41 HB2 SER 41 26.835 -13.825 -9.070 327 HB3 SER 41 HB3 SER 41 25.242 -13.453 -9.755 328 HG SER 41 HG SER 41 26.383 -13.497 -11.843 329 H GLY 42 H GLY 42 25.078 -9.770 -9.525 330 HA2 GLY 42 HA2 GLY 42 24.795 -8.627 -11.983 331 HA3 GLY 42 HA3 GLY 42 23.674 -9.980 -12.080 332 H SER 43 H SER 43 23.364 -9.386 -8.933 333 HA SER 43 HA SER 43 21.688 -8.626 -7.709 334 HB2 SER 43 HB2 SER 43 21.754 -6.184 -7.379 335 HB3 SER 43 HB3 SER 43 23.331 -6.980 -7.387 336 HG SER 43 HG SER 43 23.806 -6.135 -9.349 337 H GLY 44 H GLY 44 20.625 -9.487 -10.293 338 HA2 GLY 44 HA2 GLY 44 18.579 -7.687 -11.155 339 HA3 GLY 44 HA3 GLY 44 18.654 -9.432 -11.466 340 H SER 45 H SER 45 16.356 -7.715 -10.723 341 HA SER 45 HA SER 45 15.165 -9.453 -8.696 342 HB2 SER 45 HB2 SER 45 15.604 -6.499 -8.103 343 HB3 SER 45 HB3 SER 45 14.535 -7.562 -7.167 344 HG SER 45 HG SER 45 17.070 -8.549 -7.586 345 H GLY 46 H GLY 46 14.804 -7.362 -11.430 346 HA2 GLY 46 HA2 GLY 46 12.846 -7.302 -12.728 347 HA3 GLY 46 HA3 GLY 46 11.878 -7.830 -11.350 348 H SER 47 H SER 47 10.439 -5.989 -12.021 349 HA SER 47 HA SER 47 11.172 -3.533 -10.617 350 HB2 SER 47 HB2 SER 47 11.664 -3.574 -13.287 351 HB3 SER 47 HB3 SER 47 9.931 -3.221 -13.344 352 HG SER 47 HG SER 47 10.692 -1.288 -13.179 353 H GLY 48 H GLY 48 9.143 -2.151 -10.367 354 HA2 GLY 48 HA2 GLY 48 6.844 -3.862 -9.742 355 HA3 GLY 48 HA3 GLY 48 7.185 -2.230 -9.170 356 H SER 49 H SER 49 4.976 -1.903 -9.605 357 HA SER 49 HA SER 49 4.332 -0.811 -12.243 358 HB2 SER 49 HB2 SER 49 2.807 -3.044 -10.824 359 HB3 SER 49 HB3 SER 49 2.095 -2.077 -12.112 360 HG SER 49 HG SER 49 3.158 -4.162 -12.596 361 H GLY 50 H GLY 50 1.698 -0.084 -11.698 362 HA2 GLY 50 HA2 GLY 50 1.027 0.793 -9.139 363 HA3 GLY 50 HA3 GLY 50 1.946 2.111 -9.877 364 H SER 51 H SER 51 1.172 3.013 -11.853 365 HA SER 51 HA SER 51 -0.398 4.077 -13.085 366 HB2 SER 51 HB2 SER 51 0.161 1.912 -14.213 367 HB3 SER 51 HB3 SER 51 -1.365 1.261 -13.613 368 HG SER 51 HG SER 51 -0.880 2.552 -15.793 369 H GLY 52 H GLY 52 -1.452 5.155 -11.283 370 HA2 GLY 52 HA2 GLY 52 -4.196 4.102 -10.728 371 HA3 GLY 52 HA3 GLY 52 -3.186 4.865 -9.513 372 H SER 53 H SER 53 -5.674 5.906 -9.927 373 HA SER 53 HA SER 53 -5.896 7.917 -11.905 374 HB2 SER 53 HB2 SER 53 -7.264 7.826 -9.195 375 HB3 SER 53 HB3 SER 53 -7.856 8.563 -10.698 376 HG SER 53 HG SER 53 -7.945 6.404 -11.566 377 H GLY 54 H GLY 54 -4.970 8.139 -8.379 378 HA2 GLY 54 HA2 GLY 54 -3.135 10.172 -8.612 379 HA3 GLY 54 HA3 GLY 54 -4.701 10.983 -8.393 380 H SER 55 H SER 55 -2.421 10.900 -6.559 381 HA SER 55 HA SER 55 -3.156 9.192 -4.327 382 HB2 SER 55 HB2 SER 55 -1.111 10.307 -3.370 383 HB3 SER 55 HB3 SER 55 -0.843 9.466 -4.900 384 HG SER 55 HG SER 55 0.112 11.534 -4.697 385 H GLY 56 H GLY 56 -2.722 10.529 -2.144 386 HA2 GLY 56 HA2 GLY 56 -3.923 13.089 -1.798 387 HA3 GLY 56 HA3 GLY 56 -4.943 11.759 -1.210 388 H SER 57 H SER 57 -4.101 13.127 0.930 389 HA SER 57 HA SER 57 -1.391 12.345 1.708 390 HB2 SER 57 HB2 SER 57 -1.917 13.681 3.702 391 HB3 SER 57 HB3 SER 57 -2.245 14.569 2.199 392 HG SER 57 HG SER 57 -4.053 13.354 3.987 393 H GLY 58 H GLY 58 -1.036 11.356 3.863 394 HA2 GLY 58 HA2 GLY 58 -3.144 9.515 4.829 395 HA3 GLY 58 HA3 GLY 58 -1.605 8.833 4.272 396 H TYR 59 H TYR 59 -2.503 8.572 6.923 397 HA TYR 59 HA TYR 59 -1.344 10.577 8.632 398 HB2 TYR 59 HB2 TYR 59 -3.261 8.783 8.980 399 HB3 TYR 59 HB3 TYR 59 -1.949 7.767 9.536 400 HD1 TYR 59 HD1 TYR 59 -0.737 8.395 11.619 401 HD2 TYR 59 HD2 TYR 59 -3.999 10.783 10.129 402 HE1 TYR 59 HE1 TYR 59 -0.806 9.605 13.765 403 HE2 TYR 59 HE2 TYR 59 -4.111 11.976 12.281 404 HH TYR 59 HH TYR 59 -2.189 10.994 15.083 405 H GLN3288 H GLN3288 0.209 8.313 6.716 406 HA GLN3288 HA GLN3288 2.249 7.423 8.526 407 HB2 GLN3288 HB2 GLN3288 3.143 6.273 6.745 408 HB3 GLN3288 HB3 GLN3288 1.429 6.284 6.404 409 HG2 GLN3288 HG2 GLN3288 3.423 8.183 5.080 410 HG3 GLN3288 HG3 GLN3288 2.977 6.613 4.453 411 HE21 GLN3288 HE21 GLN3288 2.244 9.879 4.139 412 HE22 GLN3288 HE22 GLN3288 0.768 9.662 3.280 413 H ILE3289 H ILE3289 4.632 7.736 7.888 414 HA ILE3289 HA ILE3289 5.278 10.510 8.281 415 HB ILE3289 HB ILE3289 7.212 8.210 7.933 416 HG12 ILE3289 HG12 ILE3289 6.077 9.140 10.599 417 HG13 ILE3289 HG13 ILE3289 5.507 7.704 9.764 418 HG21 ILE3289 HG21 ILE3289 8.177 10.482 7.824 419 HG22 ILE3289 HG22 ILE3289 7.391 10.914 9.358 420 HG23 ILE3289 HG23 ILE3289 8.677 9.703 9.317 421 HD11 ILE3289 HD11 ILE3289 7.843 6.784 9.772 422 HD12 ILE3289 HD12 ILE3289 8.301 8.122 10.848 423 HD13 ILE3289 HD13 ILE3289 7.073 6.952 11.359 424 H GLU3290 H GLU3290 5.067 11.749 6.466 425 HA GLU3290 HA GLU3290 5.415 10.896 3.785 426 HB2 GLU3290 HB2 GLU3290 4.159 12.874 4.817 427 HB3 GLU3290 HB3 GLU3290 5.675 13.752 4.798 428 HG2 GLU3290 HG2 GLU3290 5.724 13.741 2.421 429 HG3 GLU3290 HG3 GLU3290 4.497 12.454 2.331 430 H THR3291 H THR3291 7.852 11.590 6.046 431 HA THR3291 HA THR3291 9.866 11.955 3.878 432 HB THR3291 HB THR3291 9.207 14.010 5.108 433 HG1 THR3291 HG1 THR3291 11.007 14.124 4.107 434 HG21 THR3291 HG21 THR3291 8.903 13.119 7.382 435 HG22 THR3291 HG22 THR3291 10.014 14.486 7.339 436 HG23 THR3291 HG23 THR3291 10.655 12.851 7.518 437 H PHE3292 H PHE3292 9.174 9.403 4.721 438 HA PHE3292 HA PHE3292 11.787 8.585 5.880 439 HB2 PHE3292 HB2 PHE3292 10.123 8.863 7.733 440 HB3 PHE3292 HB3 PHE3292 9.166 7.566 7.015 441 HD1 PHE3292 HD1 PHE3292 11.805 8.371 9.315 442 HD2 PHE3292 HD2 PHE3292 10.442 5.249 6.668 443 HE1 PHE3292 HE1 PHE3292 13.206 6.733 10.507 444 HE2 PHE3292 HE2 PHE3292 11.843 3.615 7.872 445 HZ PHE3292 HZ PHE3292 13.242 4.342 9.781 446 H PHE3293 H PHE3293 8.715 7.529 4.421 447 HA PHE3293 HA PHE3293 10.160 5.560 2.772 448 HB2 PHE3293 HB2 PHE3293 8.184 3.915 3.316 449 HB3 PHE3293 HB3 PHE3293 9.562 4.026 4.340 450 HD1 PHE3293 HD1 PHE3293 8.870 3.502 6.526 451 HD2 PHE3293 HD2 PHE3293 6.485 6.232 4.171 452 HE1 PHE3293 HE1 PHE3293 7.587 4.128 8.534 453 HE2 PHE3293 HE2 PHE3293 5.258 6.869 6.153 454 HZ PHE3293 HZ PHE3293 5.799 5.854 8.392 455 H ALA3294 H ALA3294 8.396 8.218 2.646 456 HA ALA3294 HA ALA3294 6.036 7.718 1.241 457 HB1 ALA3294 HB1 ALA3294 6.438 9.980 0.264 458 HB2 ALA3294 HB2 ALA3294 6.488 9.885 2.033 459 HB3 ALA3294 HB3 ALA3294 8.004 10.001 1.103 460 H GLN3295 H GLN3295 9.345 7.634 0.106 461 HA GLN3295 HA GLN3295 8.856 7.688 -2.717 462 HB2 GLN3295 HB2 GLN3295 11.017 6.255 -1.090 463 HB3 GLN3295 HB3 GLN3295 11.065 6.474 -2.838 464 HG2 GLN3295 HG2 GLN3295 10.993 8.733 -0.816 465 HG3 GLN3295 HG3 GLN3295 12.421 8.105 -1.650 466 HE21 GLN3295 HE21 GLN3295 9.629 10.279 -1.953 467 HE22 GLN3295 HE22 GLN3295 9.943 10.712 -3.601 468 H ASP3296 H ASP3296 8.920 4.969 -0.439 469 HA ASP3296 HA ASP3296 8.219 3.066 -2.595 470 HB2 ASP3296 HB2 ASP3296 8.908 2.866 0.345 471 HB3 ASP3296 HB3 ASP3296 7.872 1.616 -0.314 472 H ILE3297 H ILE3297 6.668 4.798 -0.014 473 HA ILE3297 HA ILE3297 4.245 3.338 0.058 474 HB ILE3297 HB ILE3297 5.353 5.765 1.201 475 HG12 ILE3297 HG12 ILE3297 3.862 5.207 3.028 476 HG13 ILE3297 HG13 ILE3297 3.073 3.966 2.039 477 HG21 ILE3297 HG21 ILE3297 3.303 7.058 1.599 478 HG22 ILE3297 HG22 ILE3297 3.776 7.039 -0.109 479 HG23 ILE3297 HG23 ILE3297 2.439 6.017 0.442 480 HD11 ILE3297 HD11 ILE3297 4.780 3.024 3.618 481 HD12 ILE3297 HD12 ILE3297 5.235 2.716 1.939 482 HD13 ILE3297 HD13 ILE3297 6.013 4.027 2.847 483 H GLU3298 H GLU3298 5.205 6.130 -1.983 484 HA GLU3298 HA GLU3298 2.659 6.494 -3.144 485 HB2 GLU3298 HB2 GLU3298 3.750 7.791 -4.814 486 HB3 GLU3298 HB3 GLU3298 4.513 8.098 -3.259 487 HG2 GLU3298 HG2 GLU3298 6.497 7.740 -4.308 488 HG3 GLU3298 HG3 GLU3298 6.086 6.059 -4.219 489 H SER3299 H SER3299 5.250 4.317 -3.868 490 HA SER3299 HA SER3299 4.237 3.311 -6.366 491 HB2 SER3299 HB2 SER3299 6.642 3.126 -5.332 492 HB3 SER3299 HB3 SER3299 6.017 1.724 -4.463 493 HG SER3299 HG SER3299 6.349 2.108 -7.244 494 H VAL3300 H VAL3300 3.940 2.017 -3.044 495 HA VAL3300 HA VAL3300 2.281 -0.136 -4.119 496 HB VAL3300 HB VAL3300 3.716 -0.521 -2.211 497 HG11 VAL3300 HG11 VAL3300 3.201 0.212 0.036 498 HG12 VAL3300 HG12 VAL3300 3.513 1.602 -1.006 499 HG13 VAL3300 HG13 VAL3300 1.841 1.200 -0.547 500 HG21 VAL3300 HG21 VAL3300 1.793 -1.953 -2.662 501 HG22 VAL3300 HG22 VAL3300 2.166 -1.871 -0.937 502 HG23 VAL3300 HG23 VAL3300 0.780 -0.955 -1.606 503 H GLN3301 H GLN3301 1.608 2.942 -2.328 504 HA GLN3301 HA GLN3301 -1.159 2.548 -2.157 505 HB2 GLN3301 HB2 GLN3301 -1.460 4.722 -1.516 506 HB3 GLN3301 HB3 GLN3301 0.092 4.224 -0.859 507 HG2 GLN3301 HG2 GLN3301 0.887 6.148 -1.692 508 HG3 GLN3301 HG3 GLN3301 0.807 5.350 -3.270 509 HE21 GLN3301 HE21 GLN3301 -2.051 5.425 -3.714 510 HE22 GLN3301 HE22 GLN3301 -2.195 7.024 -4.302 511 H LYS3302 H LYS3302 0.740 3.541 -4.908 512 HA LYS3302 HA LYS3302 -1.251 4.717 -6.530 513 HB2 LYS3302 HB2 LYS3302 1.384 3.382 -6.898 514 HB3 LYS3302 HB3 LYS3302 0.355 3.495 -8.342 515 HG2 LYS3302 HG2 LYS3302 0.240 5.870 -8.234 516 HG3 LYS3302 HG3 LYS3302 0.833 5.931 -6.588 517 HD2 LYS3302 HD2 LYS3302 2.732 6.579 -7.805 518 HD3 LYS3302 HD3 LYS3302 3.031 4.872 -7.529 519 HE2 LYS3302 HE2 LYS3302 3.455 4.902 -9.755 520 HE3 LYS3302 HE3 LYS3302 1.715 4.568 -9.810 521 HZ1 LYS3302 HZ1 LYS3302 2.320 6.369 -11.319 522 HZ2 LYS3302 HZ2 LYS3302 3.061 7.191 -10.113 523 HZ3 LYS3302 HZ3 LYS3302 1.425 7.027 -10.090 524 H GLU3303 H GLU3303 -0.774 1.390 -5.533 525 HA GLU3303 HA GLU3303 -2.469 0.332 -7.709 526 HB2 GLU3303 HB2 GLU3303 -1.886 -1.726 -7.098 527 HB3 GLU3303 HB3 GLU3303 -0.523 -0.881 -6.373 528 HG2 GLU3303 HG2 GLU3303 -1.856 -0.892 -4.202 529 HG3 GLU3303 HG3 GLU3303 -3.034 -1.913 -5.009 530 H LEU3304 H LEU3304 -2.786 1.131 -4.281 531 HA LEU3304 HA LEU3304 -5.432 0.223 -3.949 532 HB2 LEU3304 HB2 LEU3304 -3.833 2.289 -2.387 533 HB3 LEU3304 HB3 LEU3304 -5.413 1.650 -1.957 534 HG LEU3304 HG LEU3304 -4.170 -0.730 -2.293 535 HD11 LEU3304 HD11 LEU3304 -1.916 -0.766 -1.679 536 HD12 LEU3304 HD12 LEU3304 -1.951 0.875 -0.970 537 HD13 LEU3304 HD13 LEU3304 -1.994 0.646 -2.717 538 HD21 LEU3304 HD21 LEU3304 -4.064 1.130 0.072 539 HD22 LEU3304 HD22 LEU3304 -3.713 -0.629 0.155 540 HD23 LEU3304 HD23 LEU3304 -5.326 -0.062 -0.342 541 H GLU3305 H GLU3305 -4.223 3.344 -5.026 542 HA GLU3305 HA GLU3305 -6.720 4.740 -4.680 543 HB2 GLU3305 HB2 GLU3305 -5.736 6.469 -6.163 544 HB3 GLU3305 HB3 GLU3305 -4.673 5.978 -4.825 545 HG2 GLU3305 HG2 GLU3305 -3.427 4.539 -6.279 546 HG3 GLU3305 HG3 GLU3305 -4.484 4.896 -7.648 547 H ASN3306 H ASN3306 -5.939 2.321 -6.950 548 HA ASN3306 HA ASN3306 -8.240 3.178 -8.635 549 HB2 ASN3306 HB2 ASN3306 -7.325 2.159 -10.515 550 HB3 ASN3306 HB3 ASN3306 -6.032 3.137 -9.831 551 HD21 ASN3306 HD21 ASN3306 -4.081 2.061 -9.069 552 HD22 ASN3306 HD22 ASN3306 -3.919 0.347 -9.363 553 H LEU3307 H LEU3307 -7.481 1.181 -6.138 554 HA LEU3307 HA LEU3307 -8.814 -1.248 -7.167 555 HB2 LEU3307 HB2 LEU3307 -7.185 -0.485 -4.865 556 HB3 LEU3307 HB3 LEU3307 -8.647 -1.266 -4.341 557 HG LEU3307 HG LEU3307 -7.738 -3.193 -4.547 558 HD11 LEU3307 HD11 LEU3307 -8.644 -3.393 -6.825 559 HD12 LEU3307 HD12 LEU3307 -7.128 -4.274 -6.630 560 HD13 LEU3307 HD13 LEU3307 -7.129 -2.705 -7.464 561 HD21 LEU3307 HD21 LEU3307 -5.300 -2.054 -5.853 562 HD22 LEU3307 HD22 LEU3307 -5.470 -3.624 -5.037 563 HD23 LEU3307 HD23 LEU3307 -5.613 -2.137 -4.093 564 H SER3308 H SER3308 -10.813 -2.088 -6.363 565 HA SER3308 HA SER3308 -12.850 -0.051 -5.956 566 HB2 SER3308 HB2 SER3308 -13.105 -3.079 -5.912 567 HB3 SER3308 HB3 SER3308 -14.368 -1.900 -6.307 568 HG SER3308 HG SER3308 -13.025 -1.338 -8.163 569 H GLU3309 H GLU3309 -14.605 -0.417 -4.182 570 HA GLU3309 HA GLU3309 -13.407 -0.435 -1.607 571 HB2 GLU3309 HB2 GLU3309 -16.293 -0.762 -2.594 572 HB3 GLU3309 HB3 GLU3309 -15.886 -1.184 -0.934 573 HG2 GLU3309 HG2 GLU3309 -14.769 1.161 -0.827 574 HG3 GLU3309 HG3 GLU3309 -15.769 1.499 -2.236 575 H GLU3310 H GLU3310 -15.253 -3.094 -3.251 576 HA GLU3310 HA GLU3310 -15.023 -4.960 -1.255 577 HB2 GLU3310 HB2 GLU3310 -15.230 -6.651 -3.072 578 HB3 GLU3310 HB3 GLU3310 -16.353 -5.289 -3.230 579 HG2 GLU3310 HG2 GLU3310 -14.775 -4.213 -4.839 580 HG3 GLU3310 HG3 GLU3310 -13.743 -5.646 -4.742 581 H GLU3311 H GLU3311 -12.351 -3.764 -3.172 582 HA GLU3311 HA GLU3311 -10.639 -6.104 -2.669 583 HB2 GLU3311 HB2 GLU3311 -10.170 -3.379 -3.902 584 HB3 GLU3311 HB3 GLU3311 -8.979 -4.649 -3.827 585 HG2 GLU3311 HG2 GLU3311 -11.544 -5.389 -5.160 586 HG3 GLU3311 HG3 GLU3311 -10.583 -4.203 -5.974 587 H LEU3312 H LEU3312 -10.888 -2.635 -1.860 588 HA LEU3312 HA LEU3312 -8.734 -2.682 0.073 589 HB2 LEU3312 HB2 LEU3312 -10.786 -0.480 -0.156 590 HB3 LEU3312 HB3 LEU3312 -9.169 -0.327 0.388 591 HG LEU3312 HG LEU3312 -9.606 -1.184 -2.472 592 HD11 LEU3312 HD11 LEU3312 -9.696 1.201 -3.105 593 HD12 LEU3312 HD12 LEU3312 -10.015 1.605 -1.402 594 HD13 LEU3312 HD13 LEU3312 -11.130 0.540 -2.322 595 HD21 LEU3312 HD21 LEU3312 -7.551 0.186 -2.790 596 HD22 LEU3312 HD22 LEU3312 -7.343 -1.259 -1.779 597 HD23 LEU3312 HD23 LEU3312 -7.444 0.347 -1.036 598 H LEU3313 H LEU3313 -12.217 -2.097 0.321 599 HA LEU3313 HA LEU3313 -12.572 -1.761 3.058 600 HB2 LEU3313 HB2 LEU3313 -14.255 -1.203 1.316 601 HB3 LEU3313 HB3 LEU3313 -14.446 -2.913 0.923 602 HG LEU3313 HG LEU3313 -16.260 -1.880 2.274 603 HD11 LEU3313 HD11 LEU3313 -16.840 -3.909 3.364 604 HD12 LEU3313 HD12 LEU3313 -15.166 -4.467 3.415 605 HD13 LEU3313 HD13 LEU3313 -16.017 -4.307 1.859 606 HD21 LEU3313 HD21 LEU3313 -16.162 -1.941 4.687 607 HD22 LEU3313 HD22 LEU3313 -15.011 -0.768 4.060 608 HD23 LEU3313 HD23 LEU3313 -14.452 -2.353 4.651 609 H ALA3314 H ALA3314 -12.440 -4.706 1.008 610 HA ALA3314 HA ALA3314 -13.186 -6.429 3.160 611 HB1 ALA3314 HB1 ALA3314 -12.226 -8.188 1.706 612 HB2 ALA3314 HB2 ALA3314 -13.327 -7.097 0.846 613 HB3 ALA3314 HB3 ALA3314 -11.572 -6.917 0.629 614 H MET3315 H MET3315 -10.068 -4.981 2.327 615 HA MET3315 HA MET3315 -8.469 -6.828 3.900 616 HB2 MET3315 HB2 MET3315 -7.731 -4.021 2.973 617 HB3 MET3315 HB3 MET3315 -6.625 -5.291 3.475 618 HG2 MET3315 HG2 MET3315 -8.476 -6.078 1.321 619 HG3 MET3315 HG3 MET3315 -7.517 -4.701 0.904 620 HE1 MET3315 HE1 MET3315 -3.857 -6.168 0.936 621 HE2 MET3315 HE2 MET3315 -4.905 -4.833 0.411 622 HE3 MET3315 HE3 MET3315 -4.668 -5.145 2.139 623 H LEU3316 H LEU3316 -9.429 -3.421 4.318 624 HA LEU3316 HA LEU3316 -8.365 -3.161 6.984 625 HB2 LEU3316 HB2 LEU3316 -9.799 -1.124 7.119 626 HB3 LEU3316 HB3 LEU3316 -8.700 -1.199 5.751 627 HG LEU3316 HG LEU3316 -10.900 -2.232 4.539 628 HD11 LEU3316 HD11 LEU3316 -11.989 -0.383 6.715 629 HD12 LEU3316 HD12 LEU3316 -12.464 -2.067 6.450 630 HD13 LEU3316 HD13 LEU3316 -12.888 -0.826 5.275 631 HD21 LEU3316 HD21 LEU3316 -9.512 -0.007 4.160 632 HD22 LEU3316 HD22 LEU3316 -10.966 0.743 4.856 633 HD23 LEU3316 HD23 LEU3316 -11.055 -0.266 3.396 634 H ASN3317 H ASN3317 -11.493 -4.320 5.721 635 HA ASN3317 HA ASN3317 -12.591 -4.422 8.426 636 HB2 ASN3317 HB2 ASN3317 -13.820 -4.037 6.087 637 HB3 ASN3317 HB3 ASN3317 -13.913 -5.799 6.092 638 HD21 ASN3317 HD21 ASN3317 -14.400 -2.924 8.265 639 HD22 ASN3317 HD22 ASN3317 -15.825 -3.623 9.043 640 H GLY3318 H GLY3318 -10.757 -6.398 6.362 641 HA2 GLY3318 HA2 GLY3318 -9.807 -8.485 6.533 642 HA3 GLY3318 HA3 GLY3318 -10.109 -8.401 8.284 643 H ASP3319 H ASP3319 -12.185 -8.444 5.409 644 HA ASP3319 HA ASP3319 -13.527 -10.952 6.160 645 HB2 ASP3319 HB2 ASP3319 -14.713 -8.188 6.203 646 HB3 ASP3319 HB3 ASP3319 -15.675 -9.428 5.431 647 H GLN3320 H GLN3320 -15.322 -11.195 4.228 648 HA GLN3320 HA GLN3320 -14.068 -10.449 1.659 649 HB2 GLN3320 HB2 GLN3320 -13.190 -12.713 2.114 650 HB3 GLN3320 HB3 GLN3320 -14.835 -13.310 2.370 651 HG2 GLN3320 HG2 GLN3320 -15.371 -12.504 -0.040 652 HG3 GLN3320 HG3 GLN3320 -13.669 -12.155 -0.215 653 HE21 GLN3320 HE21 GLN3320 -12.176 -13.912 -0.305 654 HE22 GLN3320 HE22 GLN3320 -12.663 -15.569 -0.580 655 H GLN3321 H GLN3321 -15.709 -8.958 1.669 656 HA GLN3321 HA GLN3321 -18.511 -9.555 2.038 657 HB2 GLN3321 HB2 GLN3321 -18.927 -7.389 1.025 658 HB3 GLN3321 HB3 GLN3321 -17.586 -7.259 2.150 659 HG2 GLN3321 HG2 GLN3321 -16.719 -6.042 0.431 660 HG3 GLN3321 HG3 GLN3321 -16.099 -7.606 -0.065 661 HE21 GLN3321 HE21 GLN3321 -17.270 -8.716 -1.860 662 HE22 GLN3321 HE22 GLN3321 -18.084 -7.725 -3.069 Start of MODEL 10 1 H1 MET 1 H MET 1 -23.545 12.201 2.205 2 HA MET 1 HA MET 1 -24.068 10.355 4.422 3 HB2 MET 1 HB2 MET 1 -25.881 11.732 5.234 4 HB3 MET 1 HB3 MET 1 -24.336 12.568 5.284 5 HG2 MET 1 HG2 MET 1 -24.920 13.804 3.227 6 HG3 MET 1 HG3 MET 1 -26.505 13.009 3.229 7 HE1 MET 1 HE1 MET 1 -27.799 15.223 3.010 8 HE2 MET 1 HE2 MET 1 -27.420 16.671 3.954 9 HE3 MET 1 HE3 MET 1 -26.206 15.995 2.849 10 H ASN 2 H ASN 2 -25.858 11.870 1.541 11 HA ASN 2 HA ASN 2 -27.609 9.534 1.546 12 HB2 ASN 2 HB2 ASN 2 -27.434 11.898 -0.361 13 HB3 ASN 2 HB3 ASN 2 -28.643 10.616 -0.413 14 HD21 ASN 2 HD21 ASN 2 -27.755 13.572 1.159 15 HD22 ASN 2 HD22 ASN 2 -29.100 13.542 2.312 16 H ILE 3 H ILE 3 -25.035 8.522 1.266 17 HA ILE 3 HA ILE 3 -25.106 7.152 -1.254 18 HB ILE 3 HB ILE 3 -23.942 9.569 -1.551 19 HG12 ILE 3 HG12 ILE 3 -22.457 8.670 -3.292 20 HG13 ILE 3 HG13 ILE 3 -22.872 7.024 -2.796 21 HG21 ILE 3 HG21 ILE 3 -21.544 7.961 -0.629 22 HG22 ILE 3 HG22 ILE 3 -21.607 9.637 -1.190 23 HG23 ILE 3 HG23 ILE 3 -22.367 9.202 0.340 24 HD11 ILE 3 HD11 ILE 3 -24.186 7.934 -4.752 25 HD12 ILE 3 HD12 ILE 3 -25.227 7.437 -3.409 26 HD13 ILE 3 HD13 ILE 3 -24.877 9.158 -3.691 27 H ASN 4 H ASN 4 -23.218 5.728 -1.354 28 HA ASN 4 HA ASN 4 -21.996 4.901 1.194 29 HB2 ASN 4 HB2 ASN 4 -22.751 2.574 0.866 30 HB3 ASN 4 HB3 ASN 4 -24.075 3.669 1.242 31 HD21 ASN 4 HD21 ASN 4 -22.736 1.501 -1.193 32 HD22 ASN 4 HD22 ASN 4 -23.992 1.814 -2.386 33 H GLU 5 H GLU 5 -22.467 4.115 -2.270 34 HA GLU 5 HA GLU 5 -20.080 2.870 -2.828 35 HB2 GLU 5 HB2 GLU 5 -21.585 4.790 -4.640 36 HB3 GLU 5 HB3 GLU 5 -20.471 3.503 -5.127 37 HG2 GLU 5 HG2 GLU 5 -22.056 1.865 -3.990 38 HG3 GLU 5 HG3 GLU 5 -23.197 3.218 -3.813 39 H GLN 6 H GLN 6 -20.763 6.315 -2.865 40 HA GLN 6 HA GLN 6 -18.057 6.985 -3.787 41 HB2 GLN 6 HB2 GLN 6 -20.244 8.840 -2.802 42 HB3 GLN 6 HB3 GLN 6 -18.693 9.336 -3.495 43 HG2 GLN 6 HG2 GLN 6 -19.220 8.012 -5.564 44 HG3 GLN 6 HG3 GLN 6 -20.781 7.594 -4.872 45 HE21 GLN 6 HE21 GLN 6 -22.322 8.651 -6.013 46 HE22 GLN 6 HE22 GLN 6 -22.217 10.338 -6.514 47 H THR 7 H THR 7 -19.615 6.451 -0.668 48 HA THR 7 HA THR 7 -17.608 7.880 0.822 49 HB THR 7 HB THR 7 -19.379 5.603 1.721 50 HG1 THR 7 HG1 THR 7 -19.627 8.442 1.677 51 HG21 THR 7 HG21 THR 7 -17.517 5.909 3.205 52 HG22 THR 7 HG22 THR 7 -18.947 6.616 3.981 53 HG23 THR 7 HG23 THR 7 -17.712 7.666 3.212 54 H LEU 8 H LEU 8 -17.875 4.490 -0.402 55 HA LEU 8 HA LEU 8 -15.818 3.242 0.974 56 HB2 LEU 8 HB2 LEU 8 -15.984 2.891 -2.017 57 HB3 LEU 8 HB3 LEU 8 -15.687 1.736 -0.717 58 HG LEU 8 HG LEU 8 -18.356 3.017 -1.416 59 HD11 LEU 8 HD11 LEU 8 -17.520 1.400 -3.115 60 HD12 LEU 8 HD12 LEU 8 -19.053 0.939 -2.372 61 HD13 LEU 8 HD13 LEU 8 -17.557 0.146 -1.876 62 HD21 LEU 8 HD21 LEU 8 -17.758 0.888 0.604 63 HD22 LEU 8 HD22 LEU 8 -19.393 1.364 0.077 64 HD23 LEU 8 HD23 LEU 8 -18.380 2.520 0.919 65 H ASP 9 H ASP 9 -15.587 5.800 -1.515 66 HA ASP 9 HA ASP 9 -12.948 5.573 -2.416 67 HB2 ASP 9 HB2 ASP 9 -14.564 7.214 -3.262 68 HB3 ASP 9 HB3 ASP 9 -14.433 8.121 -1.746 69 H LYS 10 H LYS 10 -14.141 7.142 0.614 70 HA LYS 10 HA LYS 10 -11.471 8.030 1.342 71 HB2 LYS 10 HB2 LYS 10 -12.316 8.882 3.353 72 HB3 LYS 10 HB3 LYS 10 -13.589 9.138 2.159 73 HG2 LYS 10 HG2 LYS 10 -14.681 7.103 2.977 74 HG3 LYS 10 HG3 LYS 10 -13.497 6.904 4.245 75 HD2 LYS 10 HD2 LYS 10 -15.284 9.364 3.955 76 HD3 LYS 10 HD3 LYS 10 -15.828 7.858 4.706 77 HE2 LYS 10 HE2 LYS 10 -13.907 8.008 6.304 78 HE3 LYS 10 HE3 LYS 10 -13.554 9.625 5.659 79 HZ1 LYS 10 HZ1 LYS 10 -16.129 8.771 6.858 80 HZ2 LYS 10 HZ2 LYS 10 -15.812 10.266 6.308 81 HZ3 LYS 10 HZ3 LYS 10 -14.984 9.670 7.633 82 H LEU 11 H LEU 11 -13.206 5.048 1.662 83 HA LEU 11 HA LEU 11 -11.543 3.942 3.802 84 HB2 LEU 11 HB2 LEU 11 -13.719 2.713 2.026 85 HB3 LEU 11 HB3 LEU 11 -12.717 1.843 3.186 86 HG LEU 11 HG LEU 11 -14.701 2.142 4.199 87 HD11 LEU 11 HD11 LEU 11 -14.350 3.544 6.163 88 HD12 LEU 11 HD12 LEU 11 -12.976 4.346 5.388 89 HD13 LEU 11 HD13 LEU 11 -12.918 2.594 5.753 90 HD21 LEU 11 HD21 LEU 11 -14.677 5.077 3.470 91 HD22 LEU 11 HD22 LEU 11 -15.838 4.342 4.563 92 HD23 LEU 11 HD23 LEU 11 -15.805 3.865 2.887 93 H ARG 12 H ARG 12 -11.976 3.284 0.280 94 HA ARG 12 HA ARG 12 -9.843 1.418 0.132 95 HB2 ARG 12 HB2 ARG 12 -9.795 2.009 -2.348 96 HB3 ARG 12 HB3 ARG 12 -11.267 1.366 -1.645 97 HG2 ARG 12 HG2 ARG 12 -12.491 3.088 -2.210 98 HG3 ARG 12 HG3 ARG 12 -11.358 4.245 -1.533 99 HD2 ARG 12 HD2 ARG 12 -10.494 3.125 -4.100 100 HD3 ARG 12 HD3 ARG 12 -12.061 3.978 -4.135 101 HE ARG 12 HE ARG 12 -10.472 5.752 -2.807 102 HH11 ARG 12 HH11 ARG 12 -10.486 4.238 -6.023 103 HH12 ARG 12 HH12 ARG 12 -9.643 5.478 -6.814 104 HH21 ARG 12 HH21 ARG 12 -9.408 7.551 -3.894 105 HH22 ARG 12 HH22 ARG 12 -9.005 7.402 -5.552 106 H GLN 13 H GLN 13 -9.719 4.969 -0.203 107 HA GLN 13 HA GLN 13 -6.977 4.999 -0.901 108 HB2 GLN 13 HB2 GLN 13 -7.056 7.328 -0.582 109 HB3 GLN 13 HB3 GLN 13 -8.573 6.805 -1.291 110 HG2 GLN 13 HG2 GLN 13 -9.390 8.216 0.337 111 HG3 GLN 13 HG3 GLN 13 -9.421 6.693 1.160 112 HE21 GLN 13 HE21 GLN 13 -9.123 7.359 3.297 113 HE22 GLN 13 HE22 GLN 13 -7.656 8.181 3.834 114 H ALA 14 H ALA 14 -8.594 4.698 2.270 115 HA ALA 14 HA ALA 14 -6.248 5.225 3.862 116 HB1 ALA 14 HB1 ALA 14 -8.373 5.504 4.913 117 HB2 ALA 14 HB2 ALA 14 -8.962 3.931 4.362 118 HB3 ALA 14 HB3 ALA 14 -7.714 4.006 5.608 119 H VAL 15 H VAL 15 -7.873 2.281 2.595 120 HA VAL 15 HA VAL 15 -6.067 0.410 3.774 121 HB VAL 15 HB VAL 15 -7.840 0.160 1.318 122 HG11 VAL 15 HG11 VAL 15 -6.137 -1.630 1.328 123 HG12 VAL 15 HG12 VAL 15 -6.572 -2.048 2.993 124 HG13 VAL 15 HG13 VAL 15 -7.743 -2.270 1.686 125 HG21 VAL 15 HG21 VAL 15 -8.392 -0.365 4.267 126 HG22 VAL 15 HG22 VAL 15 -9.313 0.608 3.108 127 HG23 VAL 15 HG23 VAL 15 -9.307 -1.127 2.961 128 H LEU 16 H LEU 16 -6.152 1.842 0.448 129 HA LEU 16 HA LEU 16 -3.769 0.614 -0.390 130 HB2 LEU 16 HB2 LEU 16 -3.785 1.853 -2.329 131 HB3 LEU 16 HB3 LEU 16 -5.467 1.691 -1.864 132 HG LEU 16 HG LEU 16 -5.159 4.033 -0.805 133 HD11 LEU 16 HD11 LEU 16 -2.765 4.432 -1.167 134 HD12 LEU 16 HD12 LEU 16 -3.726 5.533 -2.122 135 HD13 LEU 16 HD13 LEU 16 -2.968 4.126 -2.905 136 HD21 LEU 16 HD21 LEU 16 -5.336 3.633 -3.821 137 HD22 LEU 16 HD22 LEU 16 -5.932 5.039 -2.930 138 HD23 LEU 16 HD23 LEU 16 -6.689 3.466 -2.672 139 H GLN 17 H GLN 17 -4.119 3.648 1.517 140 HA GLN 17 HA GLN 17 -1.529 4.636 1.101 141 HB2 GLN 17 HB2 GLN 17 -3.514 4.808 3.357 142 HB3 GLN 17 HB3 GLN 17 -1.844 5.274 3.685 143 HG2 GLN 17 HG2 GLN 17 -1.886 6.877 1.811 144 HG3 GLN 17 HG3 GLN 17 -3.552 6.428 1.463 145 HE21 GLN 17 HE21 GLN 17 -4.969 8.032 2.263 146 HE22 GLN 17 HE22 GLN 17 -4.690 8.835 3.790 147 H LYS 18 H LYS 18 -2.582 2.073 3.507 148 HA LYS 18 HA LYS 18 0.186 1.850 4.346 149 HB2 LYS 18 HB2 LYS 18 -0.419 0.105 5.724 150 HB3 LYS 18 HB3 LYS 18 -1.755 1.257 5.790 151 HG2 LYS 18 HG2 LYS 18 -2.344 -0.649 3.705 152 HG3 LYS 18 HG3 LYS 18 -1.717 -1.572 5.038 153 HD2 LYS 18 HD2 LYS 18 -4.000 0.476 5.388 154 HD3 LYS 18 HD3 LYS 18 -4.173 -1.123 4.719 155 HE2 LYS 18 HE2 LYS 18 -4.601 -1.366 7.053 156 HE3 LYS 18 HE3 LYS 18 -3.018 -2.078 6.747 157 HZ1 LYS 18 HZ1 LYS 18 -3.601 0.513 8.049 158 HZ2 LYS 18 HZ2 LYS 18 -2.047 0.020 7.632 159 HZ3 LYS 18 HZ3 LYS 18 -2.932 -0.825 8.686 160 H LYS 19 H LYS 19 -1.771 0.273 1.831 161 HA LYS 19 HA LYS 19 -0.166 -1.964 1.308 162 HB2 LYS 19 HB2 LYS 19 -1.695 -0.253 -0.696 163 HB3 LYS 19 HB3 LYS 19 -0.785 -1.676 -1.123 164 HG2 LYS 19 HG2 LYS 19 -2.113 -2.956 0.632 165 HG3 LYS 19 HG3 LYS 19 -3.190 -1.554 0.740 166 HD2 LYS 19 HD2 LYS 19 -3.704 -1.750 -1.677 167 HD3 LYS 19 HD3 LYS 19 -2.524 -3.057 -1.830 168 HE2 LYS 19 HE2 LYS 19 -4.875 -3.242 0.066 169 HE3 LYS 19 HE3 LYS 19 -5.010 -3.701 -1.651 170 HZ1 LYS 19 HZ1 LYS 19 -3.215 -4.960 0.332 171 HZ2 LYS 19 HZ2 LYS 19 -3.271 -5.345 -1.275 172 HZ3 LYS 19 HZ3 LYS 19 -4.572 -5.584 -0.354 173 H ILE 20 H ILE 20 0.402 1.456 0.393 174 HA ILE 20 HA ILE 20 2.505 1.033 -1.405 175 HB ILE 20 HB ILE 20 2.481 3.339 0.560 176 HG12 ILE 20 HG12 ILE 20 0.223 3.333 -0.178 177 HG13 ILE 20 HG13 ILE 20 1.056 4.586 -1.030 178 HG21 ILE 20 HG21 ILE 20 4.420 3.188 -0.932 179 HG22 ILE 20 HG22 ILE 20 3.367 3.085 -2.350 180 HG23 ILE 20 HG23 ILE 20 3.413 4.571 -1.368 181 HD11 ILE 20 HD11 ILE 20 0.384 1.846 -2.220 182 HD12 ILE 20 HD12 ILE 20 -0.520 3.351 -2.483 183 HD13 ILE 20 HD13 ILE 20 1.145 3.223 -3.064 184 H LYS 21 H LYS 21 2.662 1.386 2.177 185 HA LYS 21 HA LYS 21 5.500 1.019 2.447 186 HB2 LYS 21 HB2 LYS 21 3.370 0.136 4.440 187 HB3 LYS 21 HB3 LYS 21 5.027 0.617 4.768 188 HG2 LYS 21 HG2 LYS 21 4.388 2.967 4.080 189 HG3 LYS 21 HG3 LYS 21 2.708 2.437 3.952 190 HD2 LYS 21 HD2 LYS 21 4.390 2.109 6.478 191 HD3 LYS 21 HD3 LYS 21 3.337 3.497 6.172 192 HE2 LYS 21 HE2 LYS 21 1.376 2.023 5.984 193 HE3 LYS 21 HE3 LYS 21 2.390 0.601 6.254 194 HZ1 LYS 21 HZ1 LYS 21 2.847 1.485 8.504 195 HZ2 LYS 21 HZ2 LYS 21 1.258 1.229 8.238 196 HZ3 LYS 21 HZ3 LYS 21 1.833 2.748 8.217 197 H GLU 22 H GLU 22 2.737 -1.243 2.174 198 HA GLU 22 HA GLU 22 4.276 -3.486 3.195 199 HB2 GLU 22 HB2 GLU 22 1.616 -3.494 1.716 200 HB3 GLU 22 HB3 GLU 22 2.429 -4.904 2.428 201 HG2 GLU 22 HG2 GLU 22 2.490 -3.643 4.632 202 HG3 GLU 22 HG3 GLU 22 1.428 -2.440 3.897 203 H ARG 23 H ARG 23 3.186 -2.486 -0.095 204 HA ARG 23 HA ARG 23 4.475 -4.618 -1.396 205 HB2 ARG 23 HB2 ARG 23 4.238 -3.367 -3.447 206 HB3 ARG 23 HB3 ARG 23 2.794 -3.382 -2.458 207 HG2 ARG 23 HG2 ARG 23 2.699 -1.261 -3.221 208 HG3 ARG 23 HG3 ARG 23 3.484 -1.037 -1.677 209 HD2 ARG 23 HD2 ARG 23 4.445 0.343 -3.497 210 HD3 ARG 23 HD3 ARG 23 5.634 -0.710 -2.749 211 HE ARG 23 HE ARG 23 4.207 -1.521 -5.247 212 HH11 ARG 23 HH11 ARG 23 7.344 -1.098 -3.543 213 HH12 ARG 23 HH12 ARG 23 8.256 -1.660 -4.905 214 HH21 ARG 23 HH21 ARG 23 5.614 -2.138 -7.128 215 HH22 ARG 23 HH22 ARG 23 7.313 -2.129 -6.829 216 H ILE 24 H ILE 24 5.852 -1.503 -0.407 217 HA ILE 24 HA ILE 24 8.358 -1.996 -1.780 218 HB ILE 24 HB ILE 24 7.479 0.265 -1.371 219 HG12 ILE 24 HG12 ILE 24 10.173 -0.372 -0.106 220 HG13 ILE 24 HG13 ILE 24 9.828 0.181 -1.751 221 HG21 ILE 24 HG21 ILE 24 7.208 1.274 0.733 222 HG22 ILE 24 HG22 ILE 24 6.541 -0.324 0.938 223 HG23 ILE 24 HG23 ILE 24 8.139 0.015 1.584 224 HD11 ILE 24 HD11 ILE 24 9.472 1.744 0.846 225 HD12 ILE 24 HD12 ILE 24 10.690 2.037 -0.418 226 HD13 ILE 24 HD13 ILE 24 8.957 2.342 -0.738 227 H GLN 25 H GLN 25 7.274 -2.222 1.699 228 HA GLN 25 HA GLN 25 9.867 -3.023 2.559 229 HB2 GLN 25 HB2 GLN 25 8.129 -1.914 3.949 230 HB3 GLN 25 HB3 GLN 25 7.199 -3.429 3.972 231 HG2 GLN 25 HG2 GLN 25 8.929 -4.537 5.205 232 HG3 GLN 25 HG3 GLN 25 10.093 -3.250 4.846 233 HE21 GLN 25 HE21 GLN 25 10.401 -1.782 6.481 234 HE22 GLN 25 HE22 GLN 25 9.256 -1.526 7.809 235 H ASN 26 H ASN 26 6.938 -4.953 1.775 236 HA ASN 26 HA ASN 26 8.266 -7.460 2.514 237 HB2 ASN 26 HB2 ASN 26 5.692 -6.905 0.940 238 HB3 ASN 26 HB3 ASN 26 6.261 -8.502 1.369 239 HD21 ASN 26 HD21 ASN 26 5.096 -5.468 2.724 240 HD22 ASN 26 HD22 ASN 26 4.696 -6.121 4.312 241 H SER 27 H SER 27 7.275 -5.906 -0.551 242 HA SER 27 HA SER 27 7.943 -6.219 -2.727 243 HB2 SER 27 HB2 SER 27 9.945 -5.115 -1.475 244 HB3 SER 27 HB3 SER 27 10.741 -6.681 -1.670 245 HG SER 27 HG SER 27 11.379 -5.681 -3.370 246 H LEU 28 H LEU 28 7.060 -8.581 -1.322 247 HA LEU 28 HA LEU 28 8.104 -10.681 -3.092 248 HB2 LEU 28 HB2 LEU 28 8.241 -12.251 -1.169 249 HB3 LEU 28 HB3 LEU 28 9.365 -10.924 -1.054 250 HG LEU 28 HG LEU 28 7.635 -9.763 0.454 251 HD11 LEU 28 HD11 LEU 28 6.240 -11.367 1.803 252 HD12 LEU 28 HD12 LEU 28 6.425 -12.506 0.451 253 HD13 LEU 28 HD13 LEU 28 5.653 -10.921 0.217 254 HD21 LEU 28 HD21 LEU 28 9.744 -10.552 1.305 255 HD22 LEU 28 HD22 LEU 28 9.092 -12.169 1.520 256 HD23 LEU 28 HD23 LEU 28 8.452 -10.827 2.470 257 H SER 29 H SER 29 6.707 -12.665 -2.545 258 HA SER 29 HA SER 29 3.816 -11.973 -2.347 259 HB2 SER 29 HB2 SER 29 5.362 -13.619 -4.367 260 HB3 SER 29 HB3 SER 29 3.629 -13.830 -4.152 261 HG SER 29 HG SER 29 3.302 -11.716 -4.748 262 H THR 30 H THR 30 6.368 -14.427 -1.998 263 HA THR 30 HA THR 30 4.922 -15.795 0.106 264 HB THR 30 HB THR 30 3.996 -16.675 -1.992 265 HG1 THR 30 HG1 THR 30 4.223 -18.776 -1.577 266 HG21 THR 30 HG21 THR 30 5.316 -18.042 -3.517 267 HG22 THR 30 HG22 THR 30 6.791 -17.663 -2.619 268 HG23 THR 30 HG23 THR 30 5.926 -16.382 -3.517 269 H GLU 31 H GLU 31 7.194 -14.104 -0.018 270 HA GLU 31 HA GLU 31 9.427 -13.885 0.470 271 HB2 GLU 31 HB2 GLU 31 9.109 -16.543 1.879 272 HB3 GLU 31 HB3 GLU 31 10.206 -15.207 2.262 273 HG2 GLU 31 HG2 GLU 31 8.173 -13.756 2.706 274 HG3 GLU 31 HG3 GLU 31 7.164 -15.177 2.502 275 H LYS 32 H LYS 32 8.710 -15.307 -1.973 276 HA LYS 32 HA LYS 32 10.556 -17.281 -2.678 277 HB2 LYS 32 HB2 LYS 32 8.377 -16.494 -3.773 278 HB3 LYS 32 HB3 LYS 32 9.306 -15.240 -4.575 279 HG2 LYS 32 HG2 LYS 32 10.327 -16.738 -6.010 280 HG3 LYS 32 HG3 LYS 32 10.361 -18.037 -4.829 281 HD2 LYS 32 HD2 LYS 32 7.737 -17.082 -6.040 282 HD3 LYS 32 HD3 LYS 32 8.763 -18.296 -6.847 283 HE2 LYS 32 HE2 LYS 32 8.639 -19.805 -4.953 284 HE3 LYS 32 HE3 LYS 32 7.814 -18.597 -3.978 285 HZ1 LYS 32 HZ1 LYS 32 6.742 -20.110 -6.249 286 HZ2 LYS 32 HZ2 LYS 32 5.989 -18.726 -5.705 287 HZ3 LYS 32 HZ3 LYS 32 6.193 -20.041 -4.726 288 H TYR 33 H TYR 33 10.998 -13.742 -2.650 289 HA TYR 33 HA TYR 33 13.836 -14.100 -3.304 290 HB2 TYR 33 HB2 TYR 33 11.819 -12.432 -4.845 291 HB3 TYR 33 HB3 TYR 33 13.472 -11.877 -4.684 292 HD1 TYR 33 HD1 TYR 33 15.216 -12.698 -6.044 293 HD2 TYR 33 HD2 TYR 33 11.410 -14.702 -6.007 294 HE1 TYR 33 HE1 TYR 33 15.975 -14.153 -7.902 295 HE2 TYR 33 HE2 TYR 33 12.165 -16.191 -7.838 296 HH TYR 33 HH TYR 33 14.191 -17.026 -8.804 297 H GLY 34 H GLY 34 15.078 -12.353 -2.561 298 HA2 GLY 34 HA2 GLY 34 14.054 -10.071 -1.170 299 HA3 GLY 34 HA3 GLY 34 14.464 -11.368 -0.042 300 H SER 35 H SER 35 16.831 -12.338 -1.718 301 HA SER 35 HA SER 35 18.837 -10.791 -0.523 302 HB2 SER 35 HB2 SER 35 19.072 -12.492 -3.043 303 HB3 SER 35 HB3 SER 35 20.356 -12.100 -1.889 304 HG SER 35 HG SER 35 19.649 -14.114 -1.469 305 H GLY 36 H GLY 36 20.568 -9.498 -1.585 306 HA2 GLY 36 HA2 GLY 36 20.610 -8.558 -4.166 307 HA3 GLY 36 HA3 GLY 36 19.541 -7.451 -3.285 308 H SER 37 H SER 37 22.270 -7.006 -4.413 309 HA SER 37 HA SER 37 23.362 -5.435 -2.352 310 HB2 SER 37 HB2 SER 37 24.223 -7.849 -1.774 311 HB3 SER 37 HB3 SER 37 25.192 -7.688 -3.249 312 HG SER 37 HG SER 37 25.241 -6.073 -0.883 313 H GLY 38 H GLY 38 25.383 -4.410 -3.286 314 HA2 GLY 38 HA2 GLY 38 26.317 -4.540 -5.890 315 HA3 GLY 38 HA3 GLY 38 24.902 -3.460 -5.959 316 H SER 39 H SER 39 27.880 -4.121 -4.111 317 HA SER 39 HA SER 39 28.093 -1.252 -3.285 318 HB2 SER 39 HB2 SER 39 29.075 -3.869 -2.071 319 HB3 SER 39 HB3 SER 39 29.632 -2.277 -1.539 320 HG SER 39 HG SER 39 26.852 -2.980 -1.601 321 H GLY 40 H GLY 40 30.412 -0.531 -3.087 322 HA2 GLY 40 HA2 GLY 40 32.567 -1.752 -4.469 323 HA3 GLY 40 HA3 GLY 40 31.784 -0.543 -5.522 324 H SER 41 H SER 41 31.925 1.689 -4.947 325 HA SER 41 HA SER 41 33.995 2.363 -3.021 326 HB2 SER 41 HB2 SER 41 33.557 3.594 -5.204 327 HB3 SER 41 HB3 SER 41 32.084 4.247 -4.465 328 HG SER 41 HG SER 41 33.626 5.721 -4.064 329 H GLY 42 H GLY 42 33.324 4.286 -1.444 330 HA2 GLY 42 HA2 GLY 42 32.039 5.009 0.392 331 HA3 GLY 42 HA3 GLY 42 30.642 4.183 -0.311 332 H SER 43 H SER 43 33.858 3.102 0.840 333 HA SER 43 HA SER 43 32.711 0.737 2.144 334 HB2 SER 43 HB2 SER 43 34.871 0.779 0.793 335 HB3 SER 43 HB3 SER 43 35.599 1.714 2.115 336 HG SER 43 HG SER 43 35.882 -0.627 2.199 337 H GLY 44 H GLY 44 34.140 0.493 4.508 338 HA2 GLY 44 HA2 GLY 44 34.633 2.539 6.202 339 HA3 GLY 44 HA3 GLY 44 32.861 2.505 6.199 340 H SER 45 H SER 45 32.507 1.720 8.209 341 HA SER 45 HA SER 45 33.988 -0.454 9.392 342 HB2 SER 45 HB2 SER 45 32.790 1.487 10.570 343 HB3 SER 45 HB3 SER 45 31.269 0.638 10.233 344 HG SER 45 HG SER 45 32.146 0.158 12.295 345 H GLY 46 H GLY 46 32.650 -2.292 10.332 346 HA2 GLY 46 HA2 GLY 46 31.476 -3.866 8.133 347 HA3 GLY 46 HA3 GLY 46 31.921 -4.443 9.752 348 H SER 47 H SER 47 30.074 -5.153 10.778 349 HA SER 47 HA SER 47 27.474 -4.074 10.122 350 HB2 SER 47 HB2 SER 47 28.120 -6.493 10.761 351 HB3 SER 47 HB3 SER 47 28.149 -5.939 12.433 352 HG SER 47 HG SER 47 25.851 -5.096 11.225 353 H GLY 48 H GLY 48 27.669 -1.838 10.677 354 HA2 GLY 48 HA2 GLY 48 28.295 -1.084 13.486 355 HA3 GLY 48 HA3 GLY 48 28.033 0.003 12.120 356 H SER 49 H SER 49 25.592 -2.193 11.859 357 HA SER 49 HA SER 49 23.409 -2.115 12.032 358 HB2 SER 49 HB2 SER 49 24.299 -2.867 14.348 359 HB3 SER 49 HB3 SER 49 23.678 -1.310 14.925 360 HG SER 49 HG SER 49 21.655 -1.946 13.941 361 H GLY 50 H GLY 50 24.824 0.625 11.507 362 HA2 GLY 50 HA2 GLY 50 23.088 2.637 12.538 363 HA3 GLY 50 HA3 GLY 50 24.178 2.803 11.149 364 H SER 51 H SER 51 23.439 1.258 9.278 365 HA SER 51 HA SER 51 22.044 1.102 7.506 366 HB2 SER 51 HB2 SER 51 21.399 -0.682 9.348 367 HB3 SER 51 HB3 SER 51 19.894 0.232 9.452 368 HG SER 51 HG SER 51 19.303 -0.619 7.645 369 H GLY 52 H GLY 52 22.217 3.737 8.186 370 HA2 GLY 52 HA2 GLY 52 19.572 4.930 8.590 371 HA3 GLY 52 HA3 GLY 52 21.101 5.781 8.359 372 H SER 53 H SER 53 19.612 7.096 7.018 373 HA SER 53 HA SER 53 19.398 8.085 5.039 374 HB2 SER 53 HB2 SER 53 19.900 5.500 3.566 375 HB3 SER 53 HB3 SER 53 19.903 7.142 2.915 376 HG SER 53 HG SER 53 21.709 7.615 4.165 377 H GLY 54 H GLY 54 17.478 5.550 6.210 378 HA2 GLY 54 HA2 GLY 54 15.414 5.700 4.170 379 HA3 GLY 54 HA3 GLY 54 15.342 4.863 5.718 380 H SER 55 H SER 55 15.231 8.133 4.242 381 HA SER 55 HA SER 55 14.235 9.393 6.660 382 HB2 SER 55 HB2 SER 55 13.932 11.347 5.107 383 HB3 SER 55 HB3 SER 55 15.564 10.673 5.179 384 HG SER 55 HG SER 55 15.273 10.841 3.104 385 H GLY 56 H GLY 56 12.749 8.708 3.462 386 HA2 GLY 56 HA2 GLY 56 10.585 7.750 3.101 387 HA3 GLY 56 HA3 GLY 56 10.141 8.103 4.773 388 H SER 57 H SER 57 8.229 8.711 3.187 389 HA SER 57 HA SER 57 8.145 11.641 2.980 390 HB2 SER 57 HB2 SER 57 8.795 10.619 0.718 391 HB3 SER 57 HB3 SER 57 7.218 9.807 0.728 392 HG SER 57 HG SER 57 6.846 11.656 -0.326 393 H GLY 58 H GLY 58 5.756 12.321 2.857 394 HA2 GLY 58 HA2 GLY 58 4.143 10.578 4.592 395 HA3 GLY 58 HA3 GLY 58 3.839 12.254 4.134 396 H TYR 59 H TYR 59 4.180 11.501 1.190 397 HA TYR 59 HA TYR 59 1.495 10.262 0.815 398 HB2 TYR 59 HB2 TYR 59 1.265 11.680 -1.143 399 HB3 TYR 59 HB3 TYR 59 1.436 12.597 0.335 400 HD1 TYR 59 HD1 TYR 59 3.719 13.695 0.889 401 HD2 TYR 59 HD2 TYR 59 2.658 12.192 -3.024 402 HE1 TYR 59 HE1 TYR 59 5.542 15.024 -0.123 403 HE2 TYR 59 HE2 TYR 59 4.453 13.539 -4.021 404 HH TYR 59 HH TYR 59 6.822 15.395 -2.066 405 H GLN3288 H GLN3288 1.161 9.122 -1.250 406 HA GLN3288 HA GLN3288 3.356 7.299 -1.703 407 HB2 GLN3288 HB2 GLN3288 1.984 6.129 -3.192 408 HB3 GLN3288 HB3 GLN3288 0.993 6.615 -1.804 409 HG2 GLN3288 HG2 GLN3288 0.066 8.487 -3.160 410 HG3 GLN3288 HG3 GLN3288 0.970 7.886 -4.561 411 HE21 GLN3288 HE21 GLN3288 0.441 5.623 -5.293 412 HE22 GLN3288 HE22 GLN3288 -1.221 5.084 -5.088 413 H ILE3289 H ILE3289 4.698 7.104 -3.482 414 HA ILE3289 HA ILE3289 5.241 9.617 -4.848 415 HB ILE3289 HB ILE3289 6.708 6.972 -4.880 416 HG12 ILE3289 HG12 ILE3289 7.124 9.499 -3.238 417 HG13 ILE3289 HG13 ILE3289 6.666 7.919 -2.618 418 HG21 ILE3289 HG21 ILE3289 7.521 9.781 -5.810 419 HG22 ILE3289 HG22 ILE3289 8.587 8.367 -5.810 420 HG23 ILE3289 HG23 ILE3289 7.179 8.386 -6.863 421 HD11 ILE3289 HD11 ILE3289 8.951 8.308 -2.065 422 HD12 ILE3289 HD12 ILE3289 8.898 7.025 -3.282 423 HD13 ILE3289 HD13 ILE3289 9.382 8.680 -3.736 424 H GLU3290 H GLU3290 3.912 10.035 -6.508 425 HA GLU3290 HA GLU3290 2.501 8.130 -8.054 426 HB2 GLU3290 HB2 GLU3290 2.036 10.641 -7.535 427 HB3 GLU3290 HB3 GLU3290 3.060 10.960 -8.951 428 HG2 GLU3290 HG2 GLU3290 1.511 9.207 -10.117 429 HG3 GLU3290 HG3 GLU3290 0.450 9.422 -8.735 430 H THR3291 H THR3291 5.722 8.777 -8.255 431 HA THR3291 HA THR3291 5.932 7.574 -10.959 432 HB THR3291 HB THR3291 5.997 9.899 -11.360 433 HG1 THR3291 HG1 THR3291 7.803 9.955 -12.582 434 HG21 THR3291 HG21 THR3291 6.809 10.803 -9.240 435 HG22 THR3291 HG22 THR3291 7.727 11.424 -10.615 436 HG23 THR3291 HG23 THR3291 8.443 10.176 -9.585 437 H PHE3292 H PHE3292 6.154 5.814 -9.344 438 HA PHE3292 HA PHE3292 8.983 5.145 -9.096 439 HB2 PHE3292 HB2 PHE3292 8.715 6.502 -7.113 440 HB3 PHE3292 HB3 PHE3292 7.268 5.634 -6.644 441 HD1 PHE3292 HD1 PHE3292 10.360 3.801 -7.810 442 HD2 PHE3292 HD2 PHE3292 8.078 5.238 -4.437 443 HE1 PHE3292 HE1 PHE3292 11.703 2.413 -6.267 444 HE2 PHE3292 HE2 PHE3292 9.424 3.824 -2.924 445 HZ PHE3292 HZ PHE3292 11.241 2.413 -3.835 446 H PHE3293 H PHE3293 5.939 4.202 -7.468 447 HA PHE3293 HA PHE3293 6.161 1.439 -8.588 448 HB2 PHE3293 HB2 PHE3293 4.784 0.915 -6.427 449 HB3 PHE3293 HB3 PHE3293 6.518 1.079 -6.452 450 HD1 PHE3293 HD1 PHE3293 7.055 1.741 -4.230 451 HD2 PHE3293 HD2 PHE3293 3.900 3.824 -6.330 452 HE1 PHE3293 HE1 PHE3293 6.999 3.488 -2.465 453 HE2 PHE3293 HE2 PHE3293 3.966 5.594 -4.654 454 HZ PHE3293 HZ PHE3293 5.528 5.462 -2.712 455 H ALA3294 H ALA3294 4.668 4.119 -9.309 456 HA ALA3294 HA ALA3294 1.950 3.884 -9.105 457 HB1 ALA3294 HB1 ALA3294 3.559 4.982 -11.435 458 HB2 ALA3294 HB2 ALA3294 1.848 5.321 -11.093 459 HB3 ALA3294 HB3 ALA3294 3.091 5.845 -9.947 460 H GLN3295 H GLN3295 4.061 2.068 -11.353 461 HA GLN3295 HA GLN3295 1.921 1.270 -13.128 462 HB2 GLN3295 HB2 GLN3295 4.482 -0.254 -12.511 463 HB3 GLN3295 HB3 GLN3295 3.431 -0.489 -13.911 464 HG2 GLN3295 HG2 GLN3295 5.137 1.942 -13.292 465 HG3 GLN3295 HG3 GLN3295 5.422 0.741 -14.545 466 HE21 GLN3295 HE21 GLN3295 4.363 3.854 -14.043 467 HE22 GLN3295 HE22 GLN3295 3.196 3.999 -15.349 468 H ASP3296 H ASP3296 3.179 -0.058 -10.110 469 HA ASP3296 HA ASP3296 1.378 -2.410 -10.258 470 HB2 ASP3296 HB2 ASP3296 3.173 -1.484 -7.952 471 HB3 ASP3296 HB3 ASP3296 2.313 -3.025 -8.060 472 H ILE3297 H ILE3297 1.653 0.652 -8.671 473 HA ILE3297 HA ILE3297 -0.296 0.348 -6.684 474 HB ILE3297 HB ILE3297 1.333 2.439 -7.758 475 HG12 ILE3297 HG12 ILE3297 1.107 3.386 -5.512 476 HG13 ILE3297 HG13 ILE3297 -0.173 2.217 -5.141 477 HG21 ILE3297 HG21 ILE3297 -1.478 3.392 -7.203 478 HG22 ILE3297 HG22 ILE3297 -0.032 4.420 -7.402 479 HG23 ILE3297 HG23 ILE3297 -0.611 3.434 -8.753 480 HD11 ILE3297 HD11 ILE3297 1.450 0.358 -5.379 481 HD12 ILE3297 HD12 ILE3297 2.680 1.503 -5.946 482 HD13 ILE3297 HD13 ILE3297 2.116 1.567 -4.275 483 H GLU3298 H GLU3298 -0.692 1.417 -10.082 484 HA GLU3298 HA GLU3298 -3.460 2.041 -9.775 485 HB2 GLU3298 HB2 GLU3298 -3.561 2.075 -12.157 486 HB3 GLU3298 HB3 GLU3298 -2.109 2.891 -11.591 487 HG2 GLU3298 HG2 GLU3298 -0.792 1.600 -12.872 488 HG3 GLU3298 HG3 GLU3298 -1.396 0.139 -12.145 489 H SER3299 H SER3299 -1.775 -0.961 -10.465 490 HA SER3299 HA SER3299 -4.062 -2.495 -11.129 491 HB2 SER3299 HB2 SER3299 -1.255 -3.183 -10.268 492 HB3 SER3299 HB3 SER3299 -2.447 -4.332 -10.846 493 HG SER3299 HG SER3299 -0.891 -3.342 -12.406 494 H VAL3300 H VAL3300 -2.197 -2.078 -8.048 495 HA VAL3300 HA VAL3300 -3.977 -3.979 -6.742 496 HB VAL3300 HB VAL3300 -1.603 -3.739 -6.161 497 HG11 VAL3300 HG11 VAL3300 -1.386 -1.304 -6.198 498 HG12 VAL3300 HG12 VAL3300 -2.376 -1.160 -4.732 499 HG13 VAL3300 HG13 VAL3300 -0.800 -1.998 -4.686 500 HG21 VAL3300 HG21 VAL3300 -1.928 -4.090 -3.791 501 HG22 VAL3300 HG22 VAL3300 -3.537 -3.282 -3.872 502 HG23 VAL3300 HG23 VAL3300 -3.263 -4.798 -4.715 503 H GLN3301 H GLN3301 -3.839 -0.367 -6.945 504 HA GLN3301 HA GLN3301 -5.880 -0.043 -4.969 505 HB2 GLN3301 HB2 GLN3301 -5.985 2.213 -5.518 506 HB3 GLN3301 HB3 GLN3301 -4.308 1.692 -5.623 507 HG2 GLN3301 HG2 GLN3301 -4.207 2.691 -7.627 508 HG3 GLN3301 HG3 GLN3301 -5.261 1.407 -8.242 509 HE21 GLN3301 HE21 GLN3301 -7.798 1.937 -7.542 510 HE22 GLN3301 HE22 GLN3301 -8.213 3.506 -8.121 511 H LYS3302 H LYS3302 -6.014 -0.850 -8.387 512 HA LYS3302 HA LYS3302 -8.718 -0.225 -8.979 513 HB2 LYS3302 HB2 LYS3302 -6.608 -2.070 -9.991 514 HB3 LYS3302 HB3 LYS3302 -8.271 -2.556 -10.318 515 HG2 LYS3302 HG2 LYS3302 -8.728 -0.557 -11.536 516 HG3 LYS3302 HG3 LYS3302 -7.182 0.178 -11.037 517 HD2 LYS3302 HD2 LYS3302 -7.102 -0.685 -13.364 518 HD3 LYS3302 HD3 LYS3302 -5.922 -1.453 -12.295 519 HE2 LYS3302 HE2 LYS3302 -7.485 -3.396 -12.009 520 HE3 LYS3302 HE3 LYS3302 -8.595 -2.655 -13.172 521 HZ1 LYS3302 HZ1 LYS3302 -7.047 -2.942 -14.855 522 HZ2 LYS3302 HZ2 LYS3302 -7.007 -4.375 -14.020 523 HZ3 LYS3302 HZ3 LYS3302 -5.794 -3.271 -13.828 524 H GLU3303 H GLU3303 -7.256 -2.816 -7.039 525 HA GLU3303 HA GLU3303 -9.707 -4.426 -7.088 526 HB2 GLU3303 HB2 GLU3303 -8.627 -6.054 -6.097 527 HB3 GLU3303 HB3 GLU3303 -7.252 -5.191 -6.785 528 HG2 GLU3303 HG2 GLU3303 -7.156 -4.066 -4.416 529 HG3 GLU3303 HG3 GLU3303 -8.228 -5.363 -3.936 530 H LEU3304 H LEU3304 -8.350 -1.991 -4.997 531 HA LEU3304 HA LEU3304 -10.299 -2.312 -2.901 532 HB2 LEU3304 HB2 LEU3304 -8.360 -0.065 -3.611 533 HB3 LEU3304 HB3 LEU3304 -9.250 -0.198 -2.116 534 HG LEU3304 HG LEU3304 -7.148 -2.175 -3.127 535 HD11 LEU3304 HD11 LEU3304 -7.092 0.012 -1.053 536 HD12 LEU3304 HD12 LEU3304 -6.079 -0.232 -2.506 537 HD13 LEU3304 HD13 LEU3304 -5.897 -1.300 -1.107 538 HD21 LEU3304 HD21 LEU3304 -8.768 -3.391 -1.811 539 HD22 LEU3304 HD22 LEU3304 -8.701 -2.156 -0.527 540 HD23 LEU3304 HD23 LEU3304 -7.299 -3.205 -0.868 541 H GLU3305 H GLU3305 -10.158 -0.133 -5.716 542 HA GLU3305 HA GLU3305 -12.072 1.734 -4.735 543 HB2 GLU3305 HB2 GLU3305 -12.232 2.467 -7.119 544 HB3 GLU3305 HB3 GLU3305 -10.570 2.321 -6.541 545 HG2 GLU3305 HG2 GLU3305 -10.302 0.204 -7.574 546 HG3 GLU3305 HG3 GLU3305 -12.004 0.104 -8.063 547 H ASN3306 H ASN3306 -12.650 -1.457 -5.735 548 HA ASN3306 HA ASN3306 -15.524 -0.821 -6.154 549 HB2 ASN3306 HB2 ASN3306 -15.714 -2.768 -7.521 550 HB3 ASN3306 HB3 ASN3306 -14.343 -1.836 -8.117 551 HD21 ASN3306 HD21 ASN3306 -12.287 -2.809 -8.150 552 HD22 ASN3306 HD22 ASN3306 -11.965 -4.347 -7.379 553 H LEU3307 H LEU3307 -13.479 -1.901 -3.767 554 HA LEU3307 HA LEU3307 -15.103 -4.156 -2.836 555 HB2 LEU3307 HB2 LEU3307 -12.460 -3.014 -2.403 556 HB3 LEU3307 HB3 LEU3307 -13.329 -3.029 -0.888 557 HG LEU3307 HG LEU3307 -12.885 -5.102 -0.528 558 HD11 LEU3307 HD11 LEU3307 -14.726 -5.990 -1.741 559 HD12 LEU3307 HD12 LEU3307 -13.321 -7.023 -1.994 560 HD13 LEU3307 HD13 LEU3307 -13.805 -5.911 -3.287 561 HD21 LEU3307 HD21 LEU3307 -11.088 -6.207 -1.585 562 HD22 LEU3307 HD22 LEU3307 -10.754 -4.470 -1.504 563 HD23 LEU3307 HD23 LEU3307 -11.264 -5.223 -3.043 564 H SER3308 H SER3308 -16.335 -4.122 -0.883 565 HA SER3308 HA SER3308 -17.789 -1.613 -0.531 566 HB2 SER3308 HB2 SER3308 -18.041 -4.433 0.585 567 HB3 SER3308 HB3 SER3308 -19.072 -3.099 1.102 568 HG SER3308 HG SER3308 -18.763 -4.037 -1.579 569 H GLU3309 H GLU3309 -18.289 -0.820 1.822 570 HA GLU3309 HA GLU3309 -15.860 -0.006 3.040 571 HB2 GLU3309 HB2 GLU3309 -18.838 0.083 3.639 572 HB3 GLU3309 HB3 GLU3309 -17.796 0.133 5.071 573 HG2 GLU3309 HG2 GLU3309 -16.741 2.065 4.463 574 HG3 GLU3309 HG3 GLU3309 -17.312 2.046 2.790 575 H GLU3310 H GLU3310 -18.244 -2.510 4.074 576 HA GLU3310 HA GLU3310 -16.990 -3.342 6.253 577 HB2 GLU3310 HB2 GLU3310 -18.564 -5.071 4.312 578 HB3 GLU3310 HB3 GLU3310 -18.245 -5.437 6.022 579 HG2 GLU3310 HG2 GLU3310 -19.408 -3.296 6.663 580 HG3 GLU3310 HG3 GLU3310 -19.805 -3.021 4.974 581 H GLU3311 H GLU3311 -15.845 -3.900 2.919 582 HA GLU3311 HA GLU3311 -14.097 -6.116 3.687 583 HB2 GLU3311 HB2 GLU3311 -14.429 -4.394 1.218 584 HB3 GLU3311 HB3 GLU3311 -13.384 -5.782 1.317 585 HG2 GLU3311 HG2 GLU3311 -16.253 -6.280 2.034 586 HG3 GLU3311 HG3 GLU3311 -15.914 -5.879 0.378 587 H LEU3312 H LEU3312 -13.844 -2.734 2.625 588 HA LEU3312 HA LEU3312 -10.982 -2.509 2.971 589 HB2 LEU3312 HB2 LEU3312 -12.943 -0.210 2.791 590 HB3 LEU3312 HB3 LEU3312 -11.282 -0.151 2.377 591 HG LEU3312 HG LEU3312 -13.077 -2.042 0.872 592 HD11 LEU3312 HD11 LEU3312 -13.533 -0.212 -0.725 593 HD12 LEU3312 HD12 LEU3312 -12.971 0.948 0.503 594 HD13 LEU3312 HD13 LEU3312 -14.361 -0.140 0.838 595 HD21 LEU3312 HD21 LEU3312 -10.759 -2.312 0.456 596 HD22 LEU3312 HD22 LEU3312 -10.518 -0.566 0.205 597 HD23 LEU3312 HD23 LEU3312 -11.474 -1.512 -0.948 598 H LEU3313 H LEU3313 -13.726 -1.049 4.630 599 HA LEU3313 HA LEU3313 -12.393 0.469 6.587 600 HB2 LEU3313 HB2 LEU3313 -14.825 0.767 5.884 601 HB3 LEU3313 HB3 LEU3313 -15.185 -0.814 6.547 602 HG LEU3313 HG LEU3313 -15.890 1.054 7.959 603 HD11 LEU3313 HD11 LEU3313 -15.900 -1.253 8.666 604 HD12 LEU3313 HD12 LEU3313 -15.684 -0.136 9.986 605 HD13 LEU3313 HD13 LEU3313 -14.287 -1.067 9.408 606 HD21 LEU3313 HD21 LEU3313 -14.423 1.992 9.625 607 HD22 LEU3313 HD22 LEU3313 -13.850 2.436 8.028 608 HD23 LEU3313 HD23 LEU3313 -13.017 1.151 8.935 609 H ALA3314 H ALA3314 -13.485 -2.916 6.497 610 HA ALA3314 HA ALA3314 -12.848 -3.458 9.163 611 HB1 ALA3314 HB1 ALA3314 -12.954 -5.027 6.569 612 HB2 ALA3314 HB2 ALA3314 -12.216 -5.809 7.985 613 HB3 ALA3314 HB3 ALA3314 -13.901 -5.269 8.042 614 H MET3315 H MET3315 -10.739 -3.329 6.301 615 HA MET3315 HA MET3315 -8.465 -4.647 7.520 616 HB2 MET3315 HB2 MET3315 -8.414 -2.710 5.184 617 HB3 MET3315 HB3 MET3315 -7.261 -4.003 5.535 618 HG2 MET3315 HG2 MET3315 -9.987 -4.955 5.195 619 HG3 MET3315 HG3 MET3315 -9.472 -3.944 3.855 620 HE1 MET3315 HE1 MET3315 -7.565 -8.006 5.053 621 HE2 MET3315 HE2 MET3315 -7.371 -6.572 6.083 622 HE3 MET3315 HE3 MET3315 -8.986 -7.260 5.805 623 H LEU3316 H LEU3316 -8.980 -1.211 6.581 624 HA LEU3316 HA LEU3316 -6.699 -0.190 7.918 625 HB2 LEU3316 HB2 LEU3316 -7.795 2.019 7.654 626 HB3 LEU3316 HB3 LEU3316 -7.758 1.057 6.182 627 HG LEU3316 HG LEU3316 -10.188 0.290 7.078 628 HD11 LEU3316 HD11 LEU3316 -10.339 1.668 9.113 629 HD12 LEU3316 HD12 LEU3316 -11.389 2.401 7.920 630 HD13 LEU3316 HD13 LEU3316 -9.787 3.103 8.242 631 HD21 LEU3316 HD21 LEU3316 -11.047 1.505 5.350 632 HD22 LEU3316 HD22 LEU3316 -9.368 1.807 4.986 633 HD23 LEU3316 HD23 LEU3316 -10.306 3.021 5.880 634 H ASN3317 H ASN3317 -9.968 -0.908 9.091 635 HA ASN3317 HA ASN3317 -9.532 0.594 11.571 636 HB2 ASN3317 HB2 ASN3317 -11.832 -0.015 10.500 637 HB3 ASN3317 HB3 ASN3317 -11.623 -1.585 11.284 638 HD21 ASN3317 HD21 ASN3317 -11.728 1.935 11.715 639 HD22 ASN3317 HD22 ASN3317 -12.307 1.899 13.381 640 H GLY3318 H GLY3318 -8.983 -2.615 10.381 641 HA2 GLY3318 HA2 GLY3318 -7.567 -4.294 11.269 642 HA3 GLY3318 HA3 GLY3318 -7.300 -3.295 12.721 643 H ASP3319 H ASP3319 -10.009 -4.814 10.991 644 HA ASP3319 HA ASP3319 -10.963 -6.210 13.401 645 HB2 ASP3319 HB2 ASP3319 -12.040 -3.837 12.943 646 HB3 ASP3319 HB3 ASP3319 -12.777 -4.609 11.550 647 H GLN3320 H GLN3320 -13.120 -7.409 12.361 648 HA GLN3320 HA GLN3320 -13.816 -9.155 11.223 649 HB2 GLN3320 HB2 GLN3320 -14.242 -7.281 9.710 650 HB3 GLN3320 HB3 GLN3320 -12.746 -7.637 8.856 651 HG2 GLN3320 HG2 GLN3320 -13.591 -9.693 8.004 652 HG3 GLN3320 HG3 GLN3320 -15.006 -9.638 9.084 653 HE21 GLN3320 HE21 GLN3320 -13.545 -8.181 6.100 654 HE22 GLN3320 HE22 GLN3320 -14.940 -7.168 5.790 655 H GLN3321 H GLN3321 -12.176 -10.121 12.493 656 HA GLN3321 HA GLN3321 -10.520 -11.564 12.937 657 HB2 GLN3321 HB2 GLN3321 -10.643 -13.647 11.679 658 HB3 GLN3321 HB3 GLN3321 -12.234 -13.027 12.138 659 HG2 GLN3321 HG2 GLN3321 -12.721 -12.321 9.886 660 HG3 GLN3321 HG3 GLN3321 -11.064 -12.619 9.359 661 HE21 GLN3321 HE21 GLN3321 -13.009 -13.670 7.881 662 HE22 GLN3321 HE22 GLN3321 -13.232 -15.396 8.128 Start of MODEL 11 1 H1 MET 1 H MET 1 -21.999 13.610 2.004 2 HA MET 1 HA MET 1 -22.775 10.869 2.742 3 HB2 MET 1 HB2 MET 1 -24.863 11.792 3.641 4 HB3 MET 1 HB3 MET 1 -23.430 12.351 4.499 5 HG2 MET 1 HG2 MET 1 -23.548 14.509 3.257 6 HG3 MET 1 HG3 MET 1 -25.027 13.948 2.454 7 HE1 MET 1 HE1 MET 1 -24.851 16.700 3.805 8 HE2 MET 1 HE2 MET 1 -26.371 16.063 3.137 9 HE3 MET 1 HE3 MET 1 -26.341 16.761 4.773 10 H ASN 2 H ASN 2 -23.491 13.517 0.382 11 HA ASN 2 HA ASN 2 -25.570 11.841 -0.853 12 HB2 ASN 2 HB2 ASN 2 -24.499 14.610 -1.545 13 HB3 ASN 2 HB3 ASN 2 -25.823 13.798 -2.377 14 HD21 ASN 2 HD21 ASN 2 -27.530 12.827 -0.655 15 HD22 ASN 2 HD22 ASN 2 -27.789 13.800 0.764 16 H ILE 3 H ILE 3 -23.153 10.408 -0.888 17 HA ILE 3 HA ILE 3 -22.799 9.928 -3.659 18 HB ILE 3 HB ILE 3 -21.321 12.065 -3.010 19 HG12 ILE 3 HG12 ILE 3 -19.686 11.565 -4.650 20 HG13 ILE 3 HG13 ILE 3 -20.112 9.857 -4.690 21 HG21 ILE 3 HG21 ILE 3 -19.308 9.940 -2.269 22 HG22 ILE 3 HG22 ILE 3 -19.208 11.707 -2.114 23 HG23 ILE 3 HG23 ILE 3 -20.267 10.779 -1.052 24 HD11 ILE 3 HD11 ILE 3 -20.996 11.246 -6.577 25 HD12 ILE 3 HD12 ILE 3 -22.296 10.478 -5.668 26 HD13 ILE 3 HD13 ILE 3 -21.936 12.201 -5.409 27 H ASN 4 H ASN 4 -20.993 8.286 -3.952 28 HA ASN 4 HA ASN 4 -20.449 6.611 -1.613 29 HB2 ASN 4 HB2 ASN 4 -21.141 4.571 -2.856 30 HB3 ASN 4 HB3 ASN 4 -22.457 5.583 -2.276 31 HD21 ASN 4 HD21 ASN 4 -20.890 4.289 -5.111 32 HD22 ASN 4 HD22 ASN 4 -21.877 5.149 -6.290 33 H GLU 5 H GLU 5 -19.955 6.936 -5.179 34 HA GLU 5 HA GLU 5 -17.503 5.589 -5.287 35 HB2 GLU 5 HB2 GLU 5 -18.489 7.974 -6.855 36 HB3 GLU 5 HB3 GLU 5 -17.011 7.092 -7.253 37 HG2 GLU 5 HG2 GLU 5 -18.159 5.101 -7.788 38 HG3 GLU 5 HG3 GLU 5 -19.657 5.631 -7.013 39 H GLN 6 H GLN 6 -18.146 8.948 -4.648 40 HA GLN 6 HA GLN 6 -15.326 9.676 -4.342 41 HB2 GLN 6 HB2 GLN 6 -17.869 11.096 -3.705 42 HB3 GLN 6 HB3 GLN 6 -16.383 11.754 -3.085 43 HG2 GLN 6 HG2 GLN 6 -15.537 12.260 -5.219 44 HG3 GLN 6 HG3 GLN 6 -16.556 11.049 -6.011 45 HE21 GLN 6 HE21 GLN 6 -18.091 11.954 -7.240 46 HE22 GLN 6 HE22 GLN 6 -19.013 13.423 -6.895 47 H THR 7 H THR 7 -17.713 8.285 -2.111 48 HA THR 7 HA THR 7 -16.287 8.992 0.295 49 HB THR 7 HB THR 7 -18.218 6.708 -0.229 50 HG1 THR 7 HG1 THR 7 -19.773 8.121 0.482 51 HG21 THR 7 HG21 THR 7 -16.997 6.334 1.766 52 HG22 THR 7 HG22 THR 7 -18.614 6.922 2.228 53 HG23 THR 7 HG23 THR 7 -17.208 8.005 2.301 54 H LEU 8 H LEU 8 -16.177 6.201 -2.001 55 HA LEU 8 HA LEU 8 -14.761 4.296 -0.606 56 HB2 LEU 8 HB2 LEU 8 -14.037 4.979 -3.466 57 HB3 LEU 8 HB3 LEU 8 -14.121 3.413 -2.632 58 HG LEU 8 HG LEU 8 -16.476 5.113 -3.488 59 HD11 LEU 8 HD11 LEU 8 -15.542 2.491 -4.604 60 HD12 LEU 8 HD12 LEU 8 -15.349 4.071 -5.378 61 HD13 LEU 8 HD13 LEU 8 -16.962 3.387 -5.129 62 HD21 LEU 8 HD21 LEU 8 -17.826 3.042 -2.945 63 HD22 LEU 8 HD22 LEU 8 -17.233 3.996 -1.588 64 HD23 LEU 8 HD23 LEU 8 -16.386 2.501 -2.051 65 H ASP 9 H ASP 9 -13.596 7.412 -1.867 66 HA ASP 9 HA ASP 9 -10.801 7.095 -1.983 67 HB2 ASP 9 HB2 ASP 9 -11.912 9.169 -2.612 68 HB3 ASP 9 HB3 ASP 9 -12.433 9.409 -0.929 69 H LYS 10 H LYS 10 -12.879 7.852 0.903 70 HA LYS 10 HA LYS 10 -10.602 7.913 2.672 71 HB2 LYS 10 HB2 LYS 10 -12.028 8.200 4.477 72 HB3 LYS 10 HB3 LYS 10 -12.883 8.983 3.136 73 HG2 LYS 10 HG2 LYS 10 -14.302 7.050 2.882 74 HG3 LYS 10 HG3 LYS 10 -13.475 6.150 4.156 75 HD2 LYS 10 HD2 LYS 10 -14.973 8.739 4.604 76 HD3 LYS 10 HD3 LYS 10 -15.704 7.121 4.624 77 HE2 LYS 10 HE2 LYS 10 -13.880 6.477 6.335 78 HE3 LYS 10 HE3 LYS 10 -13.577 8.216 6.502 79 HZ1 LYS 10 HZ1 LYS 10 -15.191 7.488 8.142 80 HZ2 LYS 10 HZ2 LYS 10 -16.145 6.816 6.971 81 HZ3 LYS 10 HZ3 LYS 10 -15.956 8.438 7.043 82 H LEU 11 H LEU 11 -12.507 5.314 1.331 83 HA LEU 11 HA LEU 11 -11.750 3.392 3.409 84 HB2 LEU 11 HB2 LEU 11 -13.210 3.048 0.751 85 HB3 LEU 11 HB3 LEU 11 -12.737 1.758 1.854 86 HG LEU 11 HG LEU 11 -14.966 2.064 2.162 87 HD11 LEU 11 HD11 LEU 11 -13.653 3.471 4.511 88 HD12 LEU 11 HD12 LEU 11 -13.876 1.716 4.255 89 HD13 LEU 11 HD13 LEU 11 -15.270 2.758 4.491 90 HD21 LEU 11 HD21 LEU 11 -14.523 5.033 2.318 91 HD22 LEU 11 HD22 LEU 11 -15.993 4.272 2.936 92 HD23 LEU 11 HD23 LEU 11 -15.577 4.124 1.250 93 H ARG 12 H ARG 12 -10.980 3.834 -0.080 94 HA ARG 12 HA ARG 12 -9.008 1.817 -0.160 95 HB2 ARG 12 HB2 ARG 12 -8.244 2.963 -2.280 96 HB3 ARG 12 HB3 ARG 12 -9.890 2.421 -2.181 97 HG2 ARG 12 HG2 ARG 12 -10.682 4.380 -2.690 98 HG3 ARG 12 HG3 ARG 12 -9.838 5.168 -1.353 99 HD2 ARG 12 HD2 ARG 12 -8.353 4.492 -3.890 100 HD3 ARG 12 HD3 ARG 12 -9.461 5.870 -3.783 101 HE ARG 12 HE ARG 12 -7.182 5.518 -1.889 102 HH11 ARG 12 HH11 ARG 12 -8.838 7.546 -4.300 103 HH12 ARG 12 HH12 ARG 12 -7.932 8.956 -3.899 104 HH21 ARG 12 HH21 ARG 12 -6.240 7.566 -1.124 105 HH22 ARG 12 HH22 ARG 12 -6.593 8.975 -2.024 106 H GLN 13 H GLN 13 -8.611 5.237 0.641 107 HA GLN 13 HA GLN 13 -5.780 5.217 0.697 108 HB2 GLN 13 HB2 GLN 13 -5.899 7.201 2.049 109 HB3 GLN 13 HB3 GLN 13 -7.177 7.205 0.825 110 HG2 GLN 13 HG2 GLN 13 -8.368 7.941 2.620 111 HG3 GLN 13 HG3 GLN 13 -8.668 6.219 2.635 112 HE21 GLN 13 HE21 GLN 13 -9.253 6.077 4.777 113 HE22 GLN 13 HE22 GLN 13 -8.108 6.206 6.102 114 H ALA 14 H ALA 14 -8.113 3.902 3.058 115 HA ALA 14 HA ALA 14 -6.132 3.573 5.132 116 HB1 ALA 14 HB1 ALA 14 -8.836 2.231 4.612 117 HB2 ALA 14 HB2 ALA 14 -7.936 2.135 6.127 118 HB3 ALA 14 HB3 ALA 14 -8.591 3.701 5.582 119 H VAL 15 H VAL 15 -7.734 1.411 2.757 120 HA VAL 15 HA VAL 15 -6.367 -0.960 3.460 121 HB VAL 15 HB VAL 15 -7.332 -0.277 0.664 122 HG11 VAL 15 HG11 VAL 15 -7.783 -2.720 0.564 123 HG12 VAL 15 HG12 VAL 15 -6.073 -2.385 0.857 124 HG13 VAL 15 HG13 VAL 15 -7.109 -2.905 2.200 125 HG21 VAL 15 HG21 VAL 15 -8.943 -1.175 3.077 126 HG22 VAL 15 HG22 VAL 15 -9.240 0.227 1.996 127 HG23 VAL 15 HG23 VAL 15 -9.442 -1.396 1.409 128 H LEU 16 H LEU 16 -5.539 1.595 1.151 129 HA LEU 16 HA LEU 16 -3.209 0.276 0.154 130 HB2 LEU 16 HB2 LEU 16 -2.795 2.043 -1.184 131 HB3 LEU 16 HB3 LEU 16 -4.509 2.193 -0.906 132 HG LEU 16 HG LEU 16 -3.907 3.962 0.867 133 HD11 LEU 16 HD11 LEU 16 -1.430 3.636 0.845 134 HD12 LEU 16 HD12 LEU 16 -1.876 5.250 0.287 135 HD13 LEU 16 HD13 LEU 16 -1.415 4.006 -0.887 136 HD21 LEU 16 HD21 LEU 16 -5.105 4.346 -1.285 137 HD22 LEU 16 HD22 LEU 16 -3.541 4.493 -2.103 138 HD23 LEU 16 HD23 LEU 16 -4.011 5.679 -0.888 139 H GLN 17 H GLN 17 -3.617 2.713 2.798 140 HA GLN 17 HA GLN 17 -0.849 2.835 3.380 141 HB2 GLN 17 HB2 GLN 17 -3.331 3.474 5.000 142 HB3 GLN 17 HB3 GLN 17 -1.694 3.677 5.663 143 HG2 GLN 17 HG2 GLN 17 -1.063 5.245 3.961 144 HG3 GLN 17 HG3 GLN 17 -2.444 4.829 2.958 145 HE21 GLN 17 HE21 GLN 17 -3.700 6.540 2.761 146 HE22 GLN 17 HE22 GLN 17 -4.223 7.610 4.025 147 H LYS 18 H LYS 18 -3.386 0.529 4.894 148 HA LYS 18 HA LYS 18 -1.284 -0.683 6.421 149 HB2 LYS 18 HB2 LYS 18 -2.866 -2.492 6.798 150 HB3 LYS 18 HB3 LYS 18 -3.499 -0.879 7.092 151 HG2 LYS 18 HG2 LYS 18 -4.499 -1.081 4.694 152 HG3 LYS 18 HG3 LYS 18 -4.289 -2.808 4.892 153 HD2 LYS 18 HD2 LYS 18 -5.687 -0.963 6.868 154 HD3 LYS 18 HD3 LYS 18 -6.541 -1.728 5.516 155 HE2 LYS 18 HE2 LYS 18 -6.299 -3.936 6.363 156 HE3 LYS 18 HE3 LYS 18 -4.839 -3.522 7.250 157 HZ1 LYS 18 HZ1 LYS 18 -7.573 -2.966 8.237 158 HZ2 LYS 18 HZ2 LYS 18 -6.143 -2.533 8.980 159 HZ3 LYS 18 HZ3 LYS 18 -6.481 -4.081 8.724 160 H LYS 19 H LYS 19 -2.500 -1.364 3.145 161 HA LYS 19 HA LYS 19 -1.073 -3.715 2.700 162 HB2 LYS 19 HB2 LYS 19 -2.157 -1.629 0.848 163 HB3 LYS 19 HB3 LYS 19 -1.045 -2.834 0.205 164 HG2 LYS 19 HG2 LYS 19 -2.414 -4.675 0.992 165 HG3 LYS 19 HG3 LYS 19 -3.555 -3.566 1.775 166 HD2 LYS 19 HD2 LYS 19 -4.284 -2.702 -0.355 167 HD3 LYS 19 HD3 LYS 19 -2.971 -3.464 -1.202 168 HE2 LYS 19 HE2 LYS 19 -5.093 -4.590 -1.626 169 HE3 LYS 19 HE3 LYS 19 -3.861 -5.649 -0.955 170 HZ1 LYS 19 HZ1 LYS 19 -6.097 -5.939 -0.086 171 HZ2 LYS 19 HZ2 LYS 19 -6.058 -4.503 0.656 172 HZ3 LYS 19 HZ3 LYS 19 -5.014 -5.714 1.123 173 H ILE 20 H ILE 20 0.308 -0.422 2.839 174 HA ILE 20 HA ILE 20 2.641 -1.150 1.386 175 HB ILE 20 HB ILE 20 2.509 0.872 3.670 176 HG12 ILE 20 HG12 ILE 20 0.811 1.632 2.289 177 HG13 ILE 20 HG13 ILE 20 2.177 2.570 1.815 178 HG21 ILE 20 HG21 ILE 20 4.393 0.552 1.286 179 HG22 ILE 20 HG22 ILE 20 4.360 1.972 2.365 180 HG23 ILE 20 HG23 ILE 20 4.792 0.381 2.992 181 HD11 ILE 20 HD11 ILE 20 2.483 0.896 -0.131 182 HD12 ILE 20 HD12 ILE 20 0.881 0.290 0.263 183 HD13 ILE 20 HD13 ILE 20 1.077 1.988 -0.212 184 H LYS 21 H LYS 21 1.728 -1.430 4.813 185 HA LYS 21 HA LYS 21 4.163 -2.444 5.896 186 HB2 LYS 21 HB2 LYS 21 1.393 -3.260 6.826 187 HB3 LYS 21 HB3 LYS 21 2.870 -3.143 7.763 188 HG2 LYS 21 HG2 LYS 21 2.853 -0.698 7.550 189 HG3 LYS 21 HG3 LYS 21 1.400 -0.774 6.527 190 HD2 LYS 21 HD2 LYS 21 0.216 -1.990 8.386 191 HD3 LYS 21 HD3 LYS 21 1.587 -1.579 9.449 192 HE2 LYS 21 HE2 LYS 21 0.141 0.476 7.743 193 HE3 LYS 21 HE3 LYS 21 -0.502 0.027 9.333 194 HZ1 LYS 21 HZ1 LYS 21 1.070 2.028 9.183 195 HZ2 LYS 21 HZ2 LYS 21 2.286 0.929 9.061 196 HZ3 LYS 21 HZ3 LYS 21 1.357 0.927 10.395 197 H GLU 22 H GLU 22 1.522 -3.903 4.059 198 HA GLU 22 HA GLU 22 2.119 -6.647 4.843 199 HB2 GLU 22 HB2 GLU 22 0.425 -5.512 2.568 200 HB3 GLU 22 HB3 GLU 22 0.547 -7.232 2.975 201 HG2 GLU 22 HG2 GLU 22 -0.335 -6.797 5.187 202 HG3 GLU 22 HG3 GLU 22 -0.348 -5.071 4.921 203 H ARG 23 H ARG 23 2.673 -4.749 1.800 204 HA ARG 23 HA ARG 23 4.194 -6.864 0.644 205 HB2 ARG 23 HB2 ARG 23 5.106 -5.172 -0.951 206 HB3 ARG 23 HB3 ARG 23 3.358 -5.310 -0.859 207 HG2 ARG 23 HG2 ARG 23 3.447 -3.063 -0.926 208 HG3 ARG 23 HG3 ARG 23 3.633 -3.224 0.812 209 HD2 ARG 23 HD2 ARG 23 5.284 -1.668 -0.019 210 HD3 ARG 23 HD3 ARG 23 6.132 -3.113 0.495 211 HE ARG 23 HE ARG 23 5.389 -2.632 -2.373 212 HH11 ARG 23 HH11 ARG 23 7.980 -3.770 -0.126 213 HH12 ARG 23 HH12 ARG 23 9.157 -3.633 -1.378 214 HH21 ARG 23 HH21 ARG 23 7.153 -2.884 -4.047 215 HH22 ARG 23 HH22 ARG 23 8.686 -3.252 -3.409 216 H ILE 24 H ILE 24 5.329 -4.152 2.719 217 HA ILE 24 HA ILE 24 8.088 -4.843 2.339 218 HB ILE 24 HB ILE 24 7.370 -2.626 3.085 219 HG12 ILE 24 HG12 ILE 24 9.236 -4.122 4.993 220 HG13 ILE 24 HG13 ILE 24 9.655 -3.149 3.573 221 HG21 ILE 24 HG21 ILE 24 5.529 -3.553 4.604 222 HG22 ILE 24 HG22 ILE 24 6.757 -3.734 5.853 223 HG23 ILE 24 HG23 ILE 24 6.389 -2.138 5.163 224 HD11 ILE 24 HD11 ILE 24 8.698 -1.149 4.809 225 HD12 ILE 24 HD12 ILE 24 8.495 -2.190 6.227 226 HD13 ILE 24 HD13 ILE 24 10.130 -1.880 5.587 227 H GLN 25 H GLN 25 5.698 -5.802 4.900 228 HA GLN 25 HA GLN 25 7.700 -7.269 6.348 229 HB2 GLN 25 HB2 GLN 25 5.656 -6.194 7.367 230 HB3 GLN 25 HB3 GLN 25 4.665 -7.375 6.505 231 HG2 GLN 25 HG2 GLN 25 5.979 -9.170 7.783 232 HG3 GLN 25 HG3 GLN 25 6.708 -7.832 8.705 233 HE21 GLN 25 HE21 GLN 25 5.639 -8.111 10.744 234 HE22 GLN 25 HE22 GLN 25 3.882 -7.867 10.826 235 H ASN 26 H ASN 26 4.934 -8.315 4.236 236 HA ASN 26 HA ASN 26 5.582 -11.131 4.594 237 HB2 ASN 26 HB2 ASN 26 3.851 -9.736 2.480 238 HB3 ASN 26 HB3 ASN 26 4.025 -11.471 2.643 239 HD21 ASN 26 HD21 ASN 26 2.914 -8.593 4.346 240 HD22 ASN 26 HD22 ASN 26 1.850 -9.455 5.470 241 H SER 27 H SER 27 6.005 -8.805 1.923 242 HA SER 27 HA SER 27 7.307 -8.776 0.096 243 HB2 SER 27 HB2 SER 27 8.956 -8.763 2.155 244 HB3 SER 27 HB3 SER 27 9.412 -10.372 1.577 245 HG SER 27 HG SER 27 10.761 -8.944 0.667 246 H LEU 28 H LEU 28 5.622 -11.254 0.609 247 HA LEU 28 HA LEU 28 6.731 -12.897 -1.591 248 HB2 LEU 28 HB2 LEU 28 5.858 -14.874 -0.431 249 HB3 LEU 28 HB3 LEU 28 7.129 -14.040 0.457 250 HG LEU 28 HG LEU 28 5.330 -13.022 1.911 251 HD11 LEU 28 HD11 LEU 28 3.566 -14.943 0.368 252 HD12 LEU 28 HD12 LEU 28 3.349 -13.201 0.634 253 HD13 LEU 28 HD13 LEU 28 3.156 -14.307 1.983 254 HD21 LEU 28 HD21 LEU 28 6.698 -14.859 2.674 255 HD22 LEU 28 HD22 LEU 28 5.630 -16.031 1.893 256 HD23 LEU 28 HD23 LEU 28 5.049 -15.059 3.264 257 H SER 29 H SER 29 4.835 -14.512 -2.167 258 HA SER 29 HA SER 29 2.383 -12.878 -2.757 259 HB2 SER 29 HB2 SER 29 3.966 -14.818 -4.483 260 HB3 SER 29 HB3 SER 29 2.445 -14.052 -4.934 261 HG SER 29 HG SER 29 4.210 -12.891 -5.770 262 H THR 30 H THR 30 3.568 -16.317 -2.479 263 HA THR 30 HA THR 30 0.915 -17.104 -1.522 264 HB THR 30 HB THR 30 0.857 -17.097 -4.023 265 HG1 THR 30 HG1 THR 30 -0.536 -18.488 -2.979 266 HG21 THR 30 HG21 THR 30 2.847 -19.402 -3.864 267 HG22 THR 30 HG22 THR 30 3.191 -17.775 -4.506 268 HG23 THR 30 HG23 THR 30 2.010 -18.814 -5.300 269 H GLU 31 H GLU 31 3.727 -16.808 -0.553 270 HA GLU 31 HA GLU 31 5.242 -17.858 0.712 271 HB2 GLU 31 HB2 GLU 31 3.016 -19.815 1.296 272 HB3 GLU 31 HB3 GLU 31 4.430 -19.448 2.286 273 HG2 GLU 31 HG2 GLU 31 3.631 -17.003 2.294 274 HG3 GLU 31 HG3 GLU 31 2.140 -17.555 1.536 275 H LYS 32 H LYS 32 5.514 -18.320 -1.961 276 HA LYS 32 HA LYS 32 5.891 -21.075 -2.601 277 HB2 LYS 32 HB2 LYS 32 6.576 -20.468 -4.690 278 HB3 LYS 32 HB3 LYS 32 5.395 -19.272 -4.207 279 HG2 LYS 32 HG2 LYS 32 7.580 -17.868 -3.520 280 HG3 LYS 32 HG3 LYS 32 8.376 -19.007 -4.615 281 HD2 LYS 32 HD2 LYS 32 7.748 -17.528 -6.260 282 HD3 LYS 32 HD3 LYS 32 6.178 -18.319 -6.134 283 HE2 LYS 32 HE2 LYS 32 5.311 -16.324 -5.661 284 HE3 LYS 32 HE3 LYS 32 6.054 -16.525 -4.052 285 HZ1 LYS 32 HZ1 LYS 32 6.763 -14.382 -5.017 286 HZ2 LYS 32 HZ2 LYS 32 7.161 -15.098 -6.409 287 HZ3 LYS 32 HZ3 LYS 32 8.072 -15.360 -5.066 288 H TYR 33 H TYR 33 7.999 -18.712 -1.140 289 HA TYR 33 HA TYR 33 9.748 -20.332 0.100 290 HB2 TYR 33 HB2 TYR 33 10.565 -20.669 -2.516 291 HB3 TYR 33 HB3 TYR 33 11.477 -19.262 -2.082 292 HD1 TYR 33 HD1 TYR 33 13.694 -19.829 -1.424 293 HD2 TYR 33 HD2 TYR 33 10.433 -22.422 -0.241 294 HE1 TYR 33 HE1 TYR 33 15.298 -21.377 -0.391 295 HE2 TYR 33 HE2 TYR 33 12.065 -24.011 0.721 296 HH TYR 33 HH TYR 33 15.471 -23.273 1.049 297 H GLY 34 H GLY 34 11.672 -19.061 1.051 298 HA2 GLY 34 HA2 GLY 34 11.509 -16.124 0.638 299 HA3 GLY 34 HA3 GLY 34 11.235 -16.816 2.247 300 H SER 35 H SER 35 13.570 -15.347 0.484 301 HA SER 35 HA SER 35 15.741 -16.484 2.078 302 HB2 SER 35 HB2 SER 35 17.189 -16.826 0.143 303 HB3 SER 35 HB3 SER 35 15.768 -17.864 0.041 304 HG SER 35 HG SER 35 15.185 -16.916 -1.722 305 H GLY 36 H GLY 36 17.824 -15.031 0.856 306 HA2 GLY 36 HA2 GLY 36 17.265 -12.317 0.367 307 HA3 GLY 36 HA3 GLY 36 17.752 -12.554 2.067 308 H SER 37 H SER 37 19.600 -11.149 0.689 309 HA SER 37 HA SER 37 21.813 -13.061 0.352 310 HB2 SER 37 HB2 SER 37 20.692 -12.618 -1.888 311 HB3 SER 37 HB3 SER 37 21.238 -10.933 -1.746 312 HG SER 37 HG SER 37 22.517 -12.733 -2.851 313 H GLY 38 H GLY 38 23.834 -11.574 -0.149 314 HA2 GLY 38 HA2 GLY 38 24.072 -9.704 2.136 315 HA3 GLY 38 HA3 GLY 38 25.382 -10.444 1.209 316 H SER 39 H SER 39 26.374 -8.361 0.984 317 HA SER 39 HA SER 39 25.361 -6.804 -1.284 318 HB2 SER 39 HB2 SER 39 25.719 -4.663 -0.087 319 HB3 SER 39 HB3 SER 39 24.408 -5.607 0.604 320 HG SER 39 HG SER 39 26.160 -4.549 1.957 321 H GLY 40 H GLY 40 27.316 -4.845 -1.390 322 HA2 GLY 40 HA2 GLY 40 29.930 -6.251 -1.342 323 HA3 GLY 40 HA3 GLY 40 29.337 -5.421 -2.798 324 H SER 41 H SER 41 31.609 -4.361 -2.065 325 HA SER 41 HA SER 41 31.891 -2.613 -0.001 326 HB2 SER 41 HB2 SER 41 32.880 -2.036 -2.801 327 HB3 SER 41 HB3 SER 41 33.668 -1.678 -1.261 328 HG SER 41 HG SER 41 34.600 -3.510 -2.168 329 H GLY 42 H GLY 42 30.578 -1.720 -3.257 330 HA2 GLY 42 HA2 GLY 42 28.473 -0.357 -3.105 331 HA3 GLY 42 HA3 GLY 42 29.422 0.765 -2.115 332 H SER 43 H SER 43 28.218 1.574 -4.475 333 HA SER 43 HA SER 43 30.214 2.912 -5.934 334 HB2 SER 43 HB2 SER 43 28.922 0.477 -7.263 335 HB3 SER 43 HB3 SER 43 29.573 1.849 -8.181 336 HG SER 43 HG SER 43 31.157 0.561 -6.244 337 H GLY 44 H GLY 44 29.087 4.677 -6.824 338 HA2 GLY 44 HA2 GLY 44 26.152 4.527 -7.147 339 HA3 GLY 44 HA3 GLY 44 26.834 5.690 -6.001 340 H SER 45 H SER 45 25.623 7.125 -7.584 341 HA SER 45 HA SER 45 27.528 8.223 -9.540 342 HB2 SER 45 HB2 SER 45 25.770 8.416 -11.257 343 HB3 SER 45 HB3 SER 45 26.238 6.747 -10.928 344 HG SER 45 HG SER 45 24.321 6.426 -9.769 345 H GLY 46 H GLY 46 24.131 9.175 -9.400 346 HA2 GLY 46 HA2 GLY 46 24.192 10.986 -7.230 347 HA3 GLY 46 HA3 GLY 46 24.604 11.837 -8.742 348 H SER 47 H SER 47 22.167 12.051 -7.125 349 HA SER 47 HA SER 47 20.174 12.024 -9.199 350 HB2 SER 47 HB2 SER 47 20.072 9.652 -8.857 351 HB3 SER 47 HB3 SER 47 20.169 9.829 -7.105 352 HG SER 47 HG SER 47 18.000 10.182 -8.845 353 H GLY 48 H GLY 48 21.051 12.219 -5.753 354 HA2 GLY 48 HA2 GLY 48 20.302 13.390 -3.984 355 HA3 GLY 48 HA3 GLY 48 20.258 14.718 -5.145 356 H SER 49 H SER 49 18.115 11.831 -4.844 357 HA SER 49 HA SER 49 15.791 13.535 -5.153 358 HB2 SER 49 HB2 SER 49 16.181 11.315 -6.254 359 HB3 SER 49 HB3 SER 49 15.995 10.543 -4.671 360 HG SER 49 HG SER 49 13.958 12.237 -5.603 361 H GLY 50 H GLY 50 17.494 12.667 -2.230 362 HA2 GLY 50 HA2 GLY 50 15.358 13.731 -0.685 363 HA3 GLY 50 HA3 GLY 50 15.295 11.980 -0.576 364 H SER 51 H SER 51 17.007 10.853 0.455 365 HA SER 51 HA SER 51 18.439 10.500 2.173 366 HB2 SER 51 HB2 SER 51 19.962 12.942 1.207 367 HB3 SER 51 HB3 SER 51 20.599 11.454 1.919 368 HG SER 51 HG SER 51 19.779 12.032 -0.670 369 H GLY 52 H GLY 52 16.133 12.352 2.730 370 HA2 GLY 52 HA2 GLY 52 16.930 14.469 4.434 371 HA3 GLY 52 HA3 GLY 52 15.334 13.710 4.370 372 H SER 53 H SER 53 16.701 14.735 6.664 373 HA SER 53 HA SER 53 17.795 12.615 8.282 374 HB2 SER 53 HB2 SER 53 16.538 15.244 9.086 375 HB3 SER 53 HB3 SER 53 17.669 14.271 10.052 376 HG SER 53 HG SER 53 18.080 15.890 7.783 377 H GLY 54 H GLY 54 16.600 12.323 10.574 378 HA2 GLY 54 HA2 GLY 54 14.060 12.568 11.295 379 HA3 GLY 54 HA3 GLY 54 13.871 11.345 10.024 380 H SER 55 H SER 55 13.046 10.408 12.231 381 HA SER 55 HA SER 55 15.140 8.629 13.321 382 HB2 SER 55 HB2 SER 55 13.869 8.756 15.503 383 HB3 SER 55 HB3 SER 55 14.833 10.176 15.066 384 HG SER 55 HG SER 55 12.688 10.556 15.894 385 H GLY 56 H GLY 56 14.311 6.595 13.986 386 HA2 GLY 56 HA2 GLY 56 13.167 4.650 13.606 387 HA3 GLY 56 HA3 GLY 56 11.706 5.625 13.662 388 H SER 57 H SER 57 10.536 5.678 11.885 389 HA SER 57 HA SER 57 11.699 5.196 9.200 390 HB2 SER 57 HB2 SER 57 9.490 3.841 8.953 391 HB3 SER 57 HB3 SER 57 10.853 3.120 9.802 392 HG SER 57 HG SER 57 9.248 2.767 11.146 393 H GLY 58 H GLY 58 9.247 6.857 11.194 394 HA2 GLY 58 HA2 GLY 58 7.979 8.732 10.698 395 HA3 GLY 58 HA3 GLY 58 9.003 8.973 9.277 396 H TYR 59 H TYR 59 7.689 9.197 7.572 397 HA TYR 59 HA TYR 59 5.125 7.731 7.324 398 HB2 TYR 59 HB2 TYR 59 6.451 10.068 5.920 399 HB3 TYR 59 HB3 TYR 59 5.045 9.292 5.219 400 HD1 TYR 59 HD1 TYR 59 2.843 9.427 6.223 401 HD2 TYR 59 HD2 TYR 59 6.239 11.478 7.939 402 HE1 TYR 59 HE1 TYR 59 1.313 10.822 7.542 403 HE2 TYR 59 HE2 TYR 59 4.705 12.905 9.262 404 HH TYR 59 HH TYR 59 1.167 12.343 9.256 405 H GLN3288 H GLN3288 4.967 7.448 4.560 406 HA GLN3288 HA GLN3288 6.461 5.041 4.164 407 HB2 GLN3288 HB2 GLN3288 5.452 4.935 1.996 408 HB3 GLN3288 HB3 GLN3288 4.243 5.528 3.129 409 HG2 GLN3288 HG2 GLN3288 4.844 7.898 2.314 410 HG3 GLN3288 HG3 GLN3288 5.776 7.127 1.022 411 HE21 GLN3288 HE21 GLN3288 4.563 5.930 -0.686 412 HE22 GLN3288 HE22 GLN3288 2.797 5.983 -0.704 413 H ILE3289 H ILE3289 7.932 4.585 2.397 414 HA ILE3289 HA ILE3289 10.057 6.647 2.367 415 HB ILE3289 HB ILE3289 10.138 3.767 1.342 416 HG12 ILE3289 HG12 ILE3289 11.064 4.940 3.994 417 HG13 ILE3289 HG13 ILE3289 9.723 3.816 3.789 418 HG21 ILE3289 HG21 ILE3289 11.769 5.319 0.323 419 HG22 ILE3289 HG22 ILE3289 12.286 5.878 1.931 420 HG23 ILE3289 HG23 ILE3289 12.608 4.218 1.407 421 HD11 ILE3289 HD11 ILE3289 11.307 2.078 2.965 422 HD12 ILE3289 HD12 ILE3289 12.658 3.177 3.347 423 HD13 ILE3289 HD13 ILE3289 11.605 2.594 4.632 424 H GLU3290 H GLU3290 9.601 8.146 0.780 425 HA GLU3290 HA GLU3290 7.813 7.625 -1.355 426 HB2 GLU3290 HB2 GLU3290 8.348 9.843 -0.331 427 HB3 GLU3290 HB3 GLU3290 9.888 9.816 -1.229 428 HG2 GLU3290 HG2 GLU3290 8.720 9.811 -3.356 429 HG3 GLU3290 HG3 GLU3290 7.168 9.535 -2.544 430 H THR3291 H THR3291 11.298 7.051 -1.200 431 HA THR3291 HA THR3291 11.163 6.188 -4.049 432 HB THR3291 HB THR3291 12.159 8.317 -3.888 433 HG1 THR3291 HG1 THR3291 13.716 7.841 -5.264 434 HG21 THR3291 HG21 THR3291 13.183 8.316 -1.641 435 HG22 THR3291 HG22 THR3291 14.326 8.792 -2.902 436 HG23 THR3291 HG23 THR3291 14.414 7.165 -2.201 437 H PHE3292 H PHE3292 10.547 4.147 -2.974 438 HA PHE3292 HA PHE3292 12.925 2.421 -2.880 439 HB2 PHE3292 HB2 PHE3292 12.795 3.295 -0.610 440 HB3 PHE3292 HB3 PHE3292 11.108 2.796 -0.481 441 HD1 PHE3292 HD1 PHE3292 14.375 1.146 -1.511 442 HD2 PHE3292 HD2 PHE3292 10.836 0.974 0.942 443 HE1 PHE3292 HE1 PHE3292 15.102 -1.029 -0.614 444 HE2 PHE3292 HE2 PHE3292 11.576 -1.218 1.860 445 HZ PHE3292 HZ PHE3292 13.692 -2.232 1.071 446 H PHE3293 H PHE3293 9.394 2.775 -2.769 447 HA PHE3293 HA PHE3293 9.084 0.255 -4.233 448 HB2 PHE3293 HB2 PHE3293 7.088 -0.254 -2.579 449 HB3 PHE3293 HB3 PHE3293 8.702 -0.760 -2.212 450 HD1 PHE3293 HD1 PHE3293 8.715 -0.892 0.140 451 HD2 PHE3293 HD2 PHE3293 7.192 2.679 -1.744 452 HE1 PHE3293 HE1 PHE3293 8.576 0.237 2.346 453 HE2 PHE3293 HE2 PHE3293 7.131 3.794 0.407 454 HZ PHE3293 HZ PHE3293 7.772 2.571 2.515 455 H ALA3294 H ALA3294 8.674 3.378 -4.409 456 HA ALA3294 HA ALA3294 6.044 4.090 -4.649 457 HB1 ALA3294 HB1 ALA3294 6.768 5.770 -6.299 458 HB2 ALA3294 HB2 ALA3294 7.838 5.700 -4.896 459 HB3 ALA3294 HB3 ALA3294 8.338 4.961 -6.427 460 H GLN3295 H GLN3295 7.967 2.323 -6.781 461 HA GLN3295 HA GLN3295 6.548 2.235 -9.199 462 HB2 GLN3295 HB2 GLN3295 8.290 0.122 -7.832 463 HB3 GLN3295 HB3 GLN3295 7.886 0.166 -9.557 464 HG2 GLN3295 HG2 GLN3295 10.006 1.122 -9.402 465 HG3 GLN3295 HG3 GLN3295 8.836 2.480 -9.587 466 HE21 GLN3295 HE21 GLN3295 9.945 4.215 -8.686 467 HE22 GLN3295 HE22 GLN3295 10.538 4.179 -7.050 468 H ASP3296 H ASP3296 6.546 0.156 -6.492 469 HA ASP3296 HA ASP3296 4.280 -1.542 -7.398 470 HB2 ASP3296 HB2 ASP3296 5.794 -1.453 -4.756 471 HB3 ASP3296 HB3 ASP3296 4.393 -2.475 -5.004 472 H ILE3297 H ILE3297 4.784 1.058 -5.089 473 HA ILE3297 HA ILE3297 2.355 0.999 -3.681 474 HB ILE3297 HB ILE3297 4.610 2.797 -4.098 475 HG12 ILE3297 HG12 ILE3297 4.405 3.383 -1.752 476 HG13 ILE3297 HG13 ILE3297 2.781 2.671 -1.706 477 HG21 ILE3297 HG21 ILE3297 3.149 4.362 -5.093 478 HG22 ILE3297 HG22 ILE3297 1.967 4.220 -3.787 479 HG23 ILE3297 HG23 ILE3297 3.574 4.952 -3.473 480 HD11 ILE3297 HD11 ILE3297 4.664 1.252 -0.766 481 HD12 ILE3297 HD12 ILE3297 3.740 0.429 -2.045 482 HD13 ILE3297 HD13 ILE3297 5.324 1.136 -2.385 483 H GLU3298 H GLU3298 3.107 2.604 -6.792 484 HA GLU3298 HA GLU3298 0.495 3.783 -7.019 485 HB2 GLU3298 HB2 GLU3298 1.046 4.138 -9.371 486 HB3 GLU3298 HB3 GLU3298 2.279 4.750 -8.278 487 HG2 GLU3298 HG2 GLU3298 3.889 3.359 -9.070 488 HG3 GLU3298 HG3 GLU3298 2.802 1.991 -9.194 489 H SER3299 H SER3299 1.890 0.661 -7.960 490 HA SER3299 HA SER3299 -0.352 -0.161 -9.553 491 HB2 SER3299 HB2 SER3299 2.091 -1.518 -8.378 492 HB3 SER3299 HB3 SER3299 0.923 -2.321 -9.414 493 HG SER3299 HG SER3299 2.767 -1.233 -10.497 494 H VAL3300 H VAL3300 0.511 -0.536 -6.159 495 HA VAL3300 HA VAL3300 -1.617 -2.366 -5.486 496 HB VAL3300 HB VAL3300 0.184 -0.463 -3.918 497 HG11 VAL3300 HG11 VAL3300 -1.828 -0.685 -2.564 498 HG12 VAL3300 HG12 VAL3300 -1.817 -2.448 -2.804 499 HG13 VAL3300 HG13 VAL3300 -0.527 -1.655 -1.858 500 HG21 VAL3300 HG21 VAL3300 1.193 -2.506 -5.013 501 HG22 VAL3300 HG22 VAL3300 1.350 -2.479 -3.252 502 HG23 VAL3300 HG23 VAL3300 0.123 -3.509 -4.034 503 H GLN3301 H GLN3301 -1.210 1.232 -5.209 504 HA GLN3301 HA GLN3301 -3.906 1.553 -4.239 505 HB2 GLN3301 HB2 GLN3301 -3.595 3.902 -4.395 506 HB3 GLN3301 HB3 GLN3301 -2.106 3.139 -3.851 507 HG2 GLN3301 HG2 GLN3301 -1.207 4.626 -5.370 508 HG3 GLN3301 HG3 GLN3301 -1.480 3.189 -6.356 509 HE21 GLN3301 HE21 GLN3301 -4.567 4.226 -6.189 510 HE22 GLN3301 HE22 GLN3301 -4.537 5.129 -7.664 511 H LYS3302 H LYS3302 -2.573 1.387 -7.543 512 HA LYS3302 HA LYS3302 -4.766 2.462 -8.966 513 HB2 LYS3302 HB2 LYS3302 -2.526 0.566 -9.544 514 HB3 LYS3302 HB3 LYS3302 -3.856 0.644 -10.701 515 HG2 LYS3302 HG2 LYS3302 -3.490 2.846 -11.285 516 HG3 LYS3302 HG3 LYS3302 -2.631 3.220 -9.786 517 HD2 LYS3302 HD2 LYS3302 -1.264 3.179 -11.954 518 HD3 LYS3302 HD3 LYS3302 -0.606 2.427 -10.546 519 HE2 LYS3302 HE2 LYS3302 -1.593 0.184 -11.547 520 HE3 LYS3302 HE3 LYS3302 -1.628 1.136 -13.038 521 HZ1 LYS3302 HZ1 LYS3302 0.807 1.687 -12.297 522 HZ2 LYS3302 HZ2 LYS3302 0.499 0.259 -13.079 523 HZ3 LYS3302 HZ3 LYS3302 0.707 0.316 -11.446 524 H GLU3303 H GLU3303 -4.317 -0.595 -7.341 525 HA GLU3303 HA GLU3303 -6.607 -1.860 -8.683 526 HB2 GLU3303 HB2 GLU3303 -5.970 -3.757 -7.776 527 HB3 GLU3303 HB3 GLU3303 -4.512 -2.916 -7.276 528 HG2 GLU3303 HG2 GLU3303 -5.535 -2.506 -5.060 529 HG3 GLU3303 HG3 GLU3303 -6.985 -3.365 -5.559 530 H LEU3304 H LEU3304 -6.090 -0.377 -5.529 531 HA LEU3304 HA LEU3304 -8.717 -0.634 -4.579 532 HB2 LEU3304 HB2 LEU3304 -6.496 1.366 -3.916 533 HB3 LEU3304 HB3 LEU3304 -7.884 1.027 -2.924 534 HG LEU3304 HG LEU3304 -5.698 -0.942 -3.671 535 HD11 LEU3304 HD11 LEU3304 -6.176 0.587 -1.157 536 HD12 LEU3304 HD12 LEU3304 -4.784 0.602 -2.290 537 HD13 LEU3304 HD13 LEU3304 -5.072 -0.816 -1.289 538 HD21 LEU3304 HD21 LEU3304 -7.828 -2.132 -3.283 539 HD22 LEU3304 HD22 LEU3304 -7.886 -1.434 -1.638 540 HD23 LEU3304 HD23 LEU3304 -6.581 -2.542 -2.135 541 H GLU3305 H GLU3305 -7.319 2.002 -6.496 542 HA GLU3305 HA GLU3305 -9.380 3.901 -5.845 543 HB2 GLU3305 HB2 GLU3305 -8.633 5.120 -7.897 544 HB3 GLU3305 HB3 GLU3305 -7.311 4.707 -6.780 545 HG2 GLU3305 HG2 GLU3305 -6.713 2.805 -8.083 546 HG3 GLU3305 HG3 GLU3305 -8.068 3.011 -9.196 547 H ASN3306 H ASN3306 -9.605 1.021 -7.692 548 HA ASN3306 HA ASN3306 -12.100 2.026 -8.954 549 HB2 ASN3306 HB2 ASN3306 -11.854 0.694 -10.818 550 HB3 ASN3306 HB3 ASN3306 -10.307 1.516 -10.595 551 HD21 ASN3306 HD21 ASN3306 -8.388 0.192 -9.977 552 HD22 ASN3306 HD22 ASN3306 -8.503 -1.507 -10.309 553 H LEU3307 H LEU3307 -11.239 0.502 -6.280 554 HA LEU3307 HA LEU3307 -13.217 -1.721 -6.555 555 HB2 LEU3307 HB2 LEU3307 -10.912 -1.134 -4.767 556 HB3 LEU3307 HB3 LEU3307 -12.329 -1.679 -3.923 557 HG LEU3307 HG LEU3307 -11.551 -3.703 -4.185 558 HD11 LEU3307 HD11 LEU3307 -12.101 -3.515 -7.161 559 HD12 LEU3307 HD12 LEU3307 -13.347 -3.816 -5.925 560 HD13 LEU3307 HD13 LEU3307 -12.045 -4.988 -6.164 561 HD21 LEU3307 HD21 LEU3307 -9.347 -2.914 -4.851 562 HD22 LEU3307 HD22 LEU3307 -9.851 -3.064 -6.557 563 HD23 LEU3307 HD23 LEU3307 -9.815 -4.495 -5.515 564 H SER3308 H SER3308 -14.882 -2.020 -4.971 565 HA SER3308 HA SER3308 -16.334 0.446 -4.323 566 HB2 SER3308 HB2 SER3308 -17.021 -2.515 -4.054 567 HB3 SER3308 HB3 SER3308 -18.145 -1.158 -3.817 568 HG SER3308 HG SER3308 -18.324 -2.002 -5.893 569 H GLU3309 H GLU3309 -17.527 0.480 -2.068 570 HA GLU3309 HA GLU3309 -15.595 0.537 0.003 571 HB2 GLU3309 HB2 GLU3309 -18.589 0.747 -0.377 572 HB3 GLU3309 HB3 GLU3309 -18.124 0.169 1.233 573 HG2 GLU3309 HG2 GLU3309 -17.058 2.134 1.798 574 HG3 GLU3309 HG3 GLU3309 -17.000 2.716 0.131 575 H GLU3310 H GLU3310 -18.216 -1.881 -0.624 576 HA GLU3310 HA GLU3310 -17.645 -3.520 1.466 577 HB2 GLU3310 HB2 GLU3310 -18.291 -4.435 -1.332 578 HB3 GLU3310 HB3 GLU3310 -18.591 -5.325 0.155 579 HG2 GLU3310 HG2 GLU3310 -20.148 -3.447 0.866 580 HG3 GLU3310 HG3 GLU3310 -19.987 -2.780 -0.760 581 H GLU3311 H GLU3311 -15.618 -3.069 -1.350 582 HA GLU3311 HA GLU3311 -14.134 -5.578 -0.952 583 HB2 GLU3311 HB2 GLU3311 -13.705 -3.151 -2.764 584 HB3 GLU3311 HB3 GLU3311 -12.753 -4.607 -2.783 585 HG2 GLU3311 HG2 GLU3311 -15.703 -4.948 -3.137 586 HG3 GLU3311 HG3 GLU3311 -14.878 -4.134 -4.396 587 H LEU3312 H LEU3312 -13.632 -2.066 -0.702 588 HA LEU3312 HA LEU3312 -10.984 -2.332 0.429 589 HB2 LEU3312 HB2 LEU3312 -12.668 0.160 0.559 590 HB3 LEU3312 HB3 LEU3312 -10.966 0.090 0.563 591 HG LEU3312 HG LEU3312 -12.390 -0.954 -1.879 592 HD11 LEU3312 HD11 LEU3312 -12.419 1.282 -2.827 593 HD12 LEU3312 HD12 LEU3312 -12.070 1.949 -1.205 594 HD13 LEU3312 HD13 LEU3312 -13.564 1.000 -1.508 595 HD21 LEU3312 HD21 LEU3312 -10.366 0.001 -2.954 596 HD22 LEU3312 HD22 LEU3312 -10.142 -1.416 -1.917 597 HD23 LEU3312 HD23 LEU3312 -9.684 0.200 -1.327 598 H LEU3313 H LEU3313 -14.072 -1.183 1.684 599 HA LEU3313 HA LEU3313 -13.448 -0.589 4.354 600 HB2 LEU3313 HB2 LEU3313 -15.490 0.178 3.106 601 HB3 LEU3313 HB3 LEU3313 -16.056 -1.494 3.053 602 HG LEU3313 HG LEU3313 -17.144 -0.084 4.750 603 HD11 LEU3313 HD11 LEU3313 -17.463 -2.461 4.510 604 HD12 LEU3313 HD12 LEU3313 -17.631 -1.898 6.173 605 HD13 LEU3313 HD13 LEU3313 -16.167 -2.771 5.699 606 HD21 LEU3313 HD21 LEU3313 -15.273 0.925 5.931 607 HD22 LEU3313 HD22 LEU3313 -14.675 -0.681 6.403 608 HD23 LEU3313 HD23 LEU3313 -16.201 -0.084 7.029 609 H ALA3314 H ALA3314 -14.420 -3.640 2.717 610 HA ALA3314 HA ALA3314 -14.629 -5.043 5.168 611 HB1 ALA3314 HB1 ALA3314 -15.577 -5.982 3.172 612 HB2 ALA3314 HB2 ALA3314 -14.005 -5.981 2.331 613 HB3 ALA3314 HB3 ALA3314 -14.308 -7.107 3.675 614 H MET3315 H MET3315 -11.776 -4.204 3.224 615 HA MET3315 HA MET3315 -10.003 -6.156 4.439 616 HB2 MET3315 HB2 MET3315 -9.226 -3.546 3.144 617 HB3 MET3315 HB3 MET3315 -8.205 -4.969 3.348 618 HG2 MET3315 HG2 MET3315 -10.685 -5.523 1.903 619 HG3 MET3315 HG3 MET3315 -9.798 -4.244 1.150 620 HE1 MET3315 HE1 MET3315 -8.945 -7.772 2.900 621 HE2 MET3315 HE2 MET3315 -10.197 -8.002 1.647 622 HE3 MET3315 HE3 MET3315 -8.577 -8.692 1.423 623 H LEU3316 H LEU3316 -10.305 -2.636 4.697 624 HA LEU3316 HA LEU3316 -8.441 -2.280 6.789 625 HB2 LEU3316 HB2 LEU3316 -9.405 -0.037 7.083 626 HB3 LEU3316 HB3 LEU3316 -8.957 -0.449 5.431 627 HG LEU3316 HG LEU3316 -11.548 -1.167 5.279 628 HD11 LEU3316 HD11 LEU3316 -12.885 0.711 6.465 629 HD12 LEU3316 HD12 LEU3316 -11.439 1.045 7.427 630 HD13 LEU3316 HD13 LEU3316 -12.278 -0.498 7.578 631 HD21 LEU3316 HD21 LEU3316 -10.262 0.584 3.970 632 HD22 LEU3316 HD22 LEU3316 -10.876 1.777 5.159 633 HD23 LEU3316 HD23 LEU3316 -11.967 0.841 4.139 634 H ASN3317 H ASN3317 -11.948 -2.828 6.860 635 HA ASN3317 HA ASN3317 -12.084 -2.506 9.752 636 HB2 ASN3317 HB2 ASN3317 -13.976 -2.168 7.921 637 HB3 ASN3317 HB3 ASN3317 -14.196 -3.909 8.070 638 HD21 ASN3317 HD21 ASN3317 -14.549 -0.813 9.515 639 HD22 ASN3317 HD22 ASN3317 -15.277 -1.278 11.031 640 H GLY3318 H GLY3318 -11.651 -5.124 7.514 641 HA2 GLY3318 HA2 GLY3318 -10.999 -7.362 7.912 642 HA3 GLY3318 HA3 GLY3318 -11.026 -7.053 9.662 643 H ASP3319 H ASP3319 -13.259 -7.099 6.843 644 HA ASP3319 HA ASP3319 -15.254 -8.704 8.320 645 HB2 ASP3319 HB2 ASP3319 -15.608 -6.144 8.485 646 HB3 ASP3319 HB3 ASP3319 -15.981 -6.205 6.763 647 H GLN3320 H GLN3320 -17.212 -8.888 6.366 648 HA GLN3320 HA GLN3320 -15.940 -9.681 3.840 649 HB2 GLN3320 HB2 GLN3320 -17.195 -11.841 3.993 650 HB3 GLN3320 HB3 GLN3320 -15.866 -11.657 5.137 651 HG2 GLN3320 HG2 GLN3320 -17.164 -12.023 6.896 652 HG3 GLN3320 HG3 GLN3320 -18.287 -10.768 6.441 653 HE21 GLN3320 HE21 GLN3320 -19.883 -11.365 4.673 654 HE22 GLN3320 HE22 GLN3320 -20.735 -12.876 4.937 655 H GLN3321 H GLN3321 -17.048 -7.571 3.385 656 HA GLN3321 HA GLN3321 -20.016 -7.666 3.339 657 HB2 GLN3321 HB2 GLN3321 -18.024 -5.518 2.537 658 HB3 GLN3321 HB3 GLN3321 -19.783 -5.360 2.362 659 HG2 GLN3321 HG2 GLN3321 -18.336 -5.807 5.000 660 HG3 GLN3321 HG3 GLN3321 -18.879 -4.259 4.396 661 HE21 GLN3321 HE21 GLN3321 -19.839 -6.986 6.257 662 HE22 GLN3321 HE22 GLN3321 -21.581 -6.660 6.257 Start of MODEL 12 1 H1 MET 1 H MET 1 -15.150 16.996 -0.464 2 HA MET 1 HA MET 1 -15.910 14.408 0.693 3 HB2 MET 1 HB2 MET 1 -17.207 17.100 0.916 4 HB3 MET 1 HB3 MET 1 -18.231 15.658 0.844 5 HG2 MET 1 HG2 MET 1 -16.716 14.590 2.544 6 HG3 MET 1 HG3 MET 1 -15.989 16.174 2.800 7 HE1 MET 1 HE1 MET 1 -17.349 18.229 3.746 8 HE2 MET 1 HE2 MET 1 -18.772 18.030 2.697 9 HE3 MET 1 HE3 MET 1 -18.981 18.134 4.456 10 H ASN 2 H ASN 2 -16.765 16.643 -2.018 11 HA ASN 2 HA ASN 2 -18.405 14.547 -3.198 12 HB2 ASN 2 HB2 ASN 2 -17.820 17.417 -3.993 13 HB3 ASN 2 HB3 ASN 2 -18.774 16.299 -4.957 14 HD21 ASN 2 HD21 ASN 2 -18.896 18.445 -2.197 15 HD22 ASN 2 HD22 ASN 2 -20.492 17.965 -1.651 16 H ILE 3 H ILE 3 -16.419 13.075 -3.310 17 HA ILE 3 HA ILE 3 -15.397 12.715 -5.919 18 HB ILE 3 HB ILE 3 -13.982 14.666 -5.414 19 HG12 ILE 3 HG12 ILE 3 -11.773 13.737 -5.694 20 HG13 ILE 3 HG13 ILE 3 -12.313 12.141 -5.257 21 HG21 ILE 3 HG21 ILE 3 -13.993 14.532 -2.933 22 HG22 ILE 3 HG22 ILE 3 -12.955 13.089 -3.036 23 HG23 ILE 3 HG23 ILE 3 -12.379 14.670 -3.613 24 HD11 ILE 3 HD11 ILE 3 -12.086 12.250 -7.644 25 HD12 ILE 3 HD12 ILE 3 -13.837 12.290 -7.364 26 HD13 ILE 3 HD13 ILE 3 -12.940 13.790 -7.693 27 H ASN 4 H ASN 4 -14.070 10.965 -6.043 28 HA ASN 4 HA ASN 4 -14.224 8.932 -3.898 29 HB2 ASN 4 HB2 ASN 4 -14.560 7.305 -5.705 30 HB3 ASN 4 HB3 ASN 4 -15.876 8.473 -5.577 31 HD21 ASN 4 HD21 ASN 4 -13.434 7.207 -7.671 32 HD22 ASN 4 HD22 ASN 4 -13.668 8.390 -8.979 33 H GLU 5 H GLU 5 -12.430 9.693 -6.940 34 HA GLU 5 HA GLU 5 -10.201 8.105 -6.421 35 HB2 GLU 5 HB2 GLU 5 -10.448 10.645 -8.037 36 HB3 GLU 5 HB3 GLU 5 -8.907 9.809 -7.819 37 HG2 GLU 5 HG2 GLU 5 -10.091 7.665 -8.611 38 HG3 GLU 5 HG3 GLU 5 -11.375 8.744 -9.173 39 H GLN 6 H GLN 6 -10.780 11.371 -5.311 40 HA GLN 6 HA GLN 6 -8.139 11.665 -4.107 41 HB2 GLN 6 HB2 GLN 6 -10.627 13.344 -3.771 42 HB3 GLN 6 HB3 GLN 6 -9.069 13.729 -3.054 43 HG2 GLN 6 HG2 GLN 6 -8.008 13.967 -5.220 44 HG3 GLN 6 HG3 GLN 6 -9.428 13.369 -6.058 45 HE21 GLN 6 HE21 GLN 6 -10.366 15.029 -7.123 46 HE22 GLN 6 HE22 GLN 6 -10.656 16.650 -6.504 47 H THR 7 H THR 7 -11.256 10.288 -3.076 48 HA THR 7 HA THR 7 -10.586 10.409 -0.236 49 HB THR 7 HB THR 7 -12.530 8.675 -1.776 50 HG1 THR 7 HG1 THR 7 -14.001 10.277 -0.999 51 HG21 THR 7 HG21 THR 7 -12.154 9.173 1.198 52 HG22 THR 7 HG22 THR 7 -12.088 7.628 0.325 53 HG23 THR 7 HG23 THR 7 -13.638 8.468 0.506 54 H LEU 8 H LEU 8 -10.019 8.055 -2.876 55 HA LEU 8 HA LEU 8 -9.340 5.709 -1.507 56 HB2 LEU 8 HB2 LEU 8 -7.659 6.775 -3.798 57 HB3 LEU 8 HB3 LEU 8 -8.056 5.119 -3.356 58 HG LEU 8 HG LEU 8 -9.879 7.191 -4.600 59 HD11 LEU 8 HD11 LEU 8 -8.995 4.527 -5.726 60 HD12 LEU 8 HD12 LEU 8 -8.220 6.060 -6.131 61 HD13 LEU 8 HD13 LEU 8 -9.908 5.778 -6.576 62 HD21 LEU 8 HD21 LEU 8 -11.562 5.330 -4.835 63 HD22 LEU 8 HD22 LEU 8 -11.306 5.902 -3.187 64 HD23 LEU 8 HD23 LEU 8 -10.541 4.383 -3.724 65 H ASP 9 H ASP 9 -7.555 8.791 -1.767 66 HA ASP 9 HA ASP 9 -4.966 8.014 -1.020 67 HB2 ASP 9 HB2 ASP 9 -6.596 10.474 -0.586 68 HB3 ASP 9 HB3 ASP 9 -5.076 10.323 0.296 69 H LYS 10 H LYS 10 -7.811 8.689 1.186 70 HA LYS 10 HA LYS 10 -6.205 8.189 3.524 71 HB2 LYS 10 HB2 LYS 10 -8.085 8.343 4.849 72 HB3 LYS 10 HB3 LYS 10 -8.409 9.457 3.523 73 HG2 LYS 10 HG2 LYS 10 -9.832 7.785 2.460 74 HG3 LYS 10 HG3 LYS 10 -9.545 6.634 3.767 75 HD2 LYS 10 HD2 LYS 10 -10.986 9.289 3.926 76 HD3 LYS 10 HD3 LYS 10 -11.688 7.654 3.862 77 HE2 LYS 10 HE2 LYS 10 -10.277 7.133 5.955 78 HE3 LYS 10 HE3 LYS 10 -10.013 8.880 6.089 79 HZ1 LYS 10 HZ1 LYS 10 -11.827 8.285 7.430 80 HZ2 LYS 10 HZ2 LYS 10 -12.592 7.438 6.232 81 HZ3 LYS 10 HZ3 LYS 10 -12.464 9.093 6.151 82 H LEU 11 H LEU 11 -7.755 6.107 1.227 83 HA LEU 11 HA LEU 11 -7.827 3.760 2.979 84 HB2 LEU 11 HB2 LEU 11 -8.424 4.106 -0.009 85 HB3 LEU 11 HB3 LEU 11 -8.412 2.595 0.898 86 HG LEU 11 HG LEU 11 -10.617 3.158 0.625 87 HD11 LEU 11 HD11 LEU 11 -10.328 2.361 2.842 88 HD12 LEU 11 HD12 LEU 11 -11.543 3.621 2.875 89 HD13 LEU 11 HD13 LEU 11 -9.929 4.002 3.459 90 HD21 LEU 11 HD21 LEU 11 -10.694 5.415 -0.036 91 HD22 LEU 11 HD22 LEU 11 -9.999 5.969 1.478 92 HD23 LEU 11 HD23 LEU 11 -11.653 5.337 1.413 93 H ARG 12 H ARG 12 -5.957 4.700 0.021 94 HA ARG 12 HA ARG 12 -4.217 2.464 0.138 95 HB2 ARG 12 HB2 ARG 12 -2.734 3.780 -1.376 96 HB3 ARG 12 HB3 ARG 12 -4.389 3.650 -1.878 97 HG2 ARG 12 HG2 ARG 12 -4.871 5.880 -1.426 98 HG3 ARG 12 HG3 ARG 12 -3.532 6.079 -0.280 99 HD2 ARG 12 HD2 ARG 12 -2.181 5.566 -2.556 100 HD3 ARG 12 HD3 ARG 12 -3.707 6.328 -3.158 101 HE ARG 12 HE ARG 12 -3.168 8.342 -2.155 102 HH11 ARG 12 HH11 ARG 12 -0.338 6.236 -1.865 103 HH12 ARG 12 HH12 ARG 12 0.539 7.396 -0.920 104 HH21 ARG 12 HH21 ARG 12 -2.059 9.776 -1.118 105 HH22 ARG 12 HH22 ARG 12 -0.394 9.615 -0.691 106 H GLN 13 H GLN 13 -3.844 5.691 1.648 107 HA GLN 13 HA GLN 13 -1.248 5.221 2.602 108 HB2 GLN 13 HB2 GLN 13 -1.562 7.083 4.087 109 HB3 GLN 13 HB3 GLN 13 -2.319 7.386 2.518 110 HG2 GLN 13 HG2 GLN 13 -3.967 8.189 3.852 111 HG3 GLN 13 HG3 GLN 13 -4.474 6.508 3.659 112 HE21 GLN 13 HE21 GLN 13 -5.422 5.821 5.489 113 HE22 GLN 13 HE22 GLN 13 -4.699 5.971 7.100 114 H ALA 14 H ALA 14 -4.383 4.069 3.857 115 HA ALA 14 HA ALA 14 -3.380 3.205 6.419 116 HB1 ALA 14 HB1 ALA 14 -5.837 2.434 4.780 117 HB2 ALA 14 HB2 ALA 14 -5.560 1.952 6.462 118 HB3 ALA 14 HB3 ALA 14 -5.782 3.660 6.056 119 H VAL 15 H VAL 15 -4.150 1.617 3.304 120 HA VAL 15 HA VAL 15 -3.375 -1.022 4.056 121 HB VAL 15 HB VAL 15 -3.365 0.229 1.285 122 HG11 VAL 15 HG11 VAL 15 -3.567 -2.695 2.168 123 HG12 VAL 15 HG12 VAL 15 -3.736 -2.094 0.508 124 HG13 VAL 15 HG13 VAL 15 -2.187 -1.958 1.333 125 HG21 VAL 15 HG21 VAL 15 -5.603 0.498 2.084 126 HG22 VAL 15 HG22 VAL 15 -5.607 -0.968 1.173 127 HG23 VAL 15 HG23 VAL 15 -5.587 -1.070 2.932 128 H LEU 16 H LEU 16 -1.559 1.613 2.466 129 HA LEU 16 HA LEU 16 0.828 0.159 2.166 130 HB2 LEU 16 HB2 LEU 16 1.786 1.954 1.249 131 HB3 LEU 16 HB3 LEU 16 0.101 2.320 1.045 132 HG LEU 16 HG LEU 16 0.327 3.819 3.126 133 HD11 LEU 16 HD11 LEU 16 3.242 3.317 2.460 134 HD12 LEU 16 HD12 LEU 16 2.448 3.255 4.051 135 HD13 LEU 16 HD13 LEU 16 2.702 4.803 3.250 136 HD21 LEU 16 HD21 LEU 16 1.759 4.516 0.527 137 HD22 LEU 16 HD22 LEU 16 1.081 5.679 1.686 138 HD23 LEU 16 HD23 LEU 16 0.007 4.601 0.781 139 H GLN 17 H GLN 17 -0.312 2.096 4.959 140 HA GLN 17 HA GLN 17 2.105 2.028 6.443 141 HB2 GLN 17 HB2 GLN 17 -0.823 2.335 7.166 142 HB3 GLN 17 HB3 GLN 17 0.392 2.190 8.435 143 HG2 GLN 17 HG2 GLN 17 1.549 4.140 7.751 144 HG3 GLN 17 HG3 GLN 17 0.719 4.219 6.221 145 HE21 GLN 17 HE21 GLN 17 -0.906 5.536 6.104 146 HE22 GLN 17 HE22 GLN 17 -1.534 6.568 7.350 147 H LYS 18 H LYS 18 -0.704 -0.399 6.565 148 HA LYS 18 HA LYS 18 0.778 -1.987 8.442 149 HB2 LYS 18 HB2 LYS 18 -1.009 -3.634 8.033 150 HB3 LYS 18 HB3 LYS 18 -1.558 -2.008 8.437 151 HG2 LYS 18 HG2 LYS 18 -1.774 -1.664 5.866 152 HG3 LYS 18 HG3 LYS 18 -1.787 -3.420 5.789 153 HD2 LYS 18 HD2 LYS 18 -3.691 -1.648 7.431 154 HD3 LYS 18 HD3 LYS 18 -3.960 -2.174 5.781 155 HE2 LYS 18 HE2 LYS 18 -5.148 -3.741 7.116 156 HE3 LYS 18 HE3 LYS 18 -3.680 -4.562 6.576 157 HZ1 LYS 18 HZ1 LYS 18 -3.607 -3.318 9.203 158 HZ2 LYS 18 HZ2 LYS 18 -2.923 -4.743 8.617 159 HZ3 LYS 18 HZ3 LYS 18 -4.505 -4.679 9.013 160 H LYS 19 H LYS 19 0.531 -1.920 4.914 161 HA LYS 19 HA LYS 19 1.802 -4.348 4.303 162 HB2 LYS 19 HB2 LYS 19 1.626 -1.719 2.857 163 HB3 LYS 19 HB3 LYS 19 2.892 -2.812 2.372 164 HG2 LYS 19 HG2 LYS 19 0.984 -4.603 2.249 165 HG3 LYS 19 HG3 LYS 19 -0.074 -3.184 2.143 166 HD2 LYS 19 HD2 LYS 19 1.321 -2.429 0.137 167 HD3 LYS 19 HD3 LYS 19 2.218 -3.965 0.290 168 HE2 LYS 19 HE2 LYS 19 -0.101 -5.115 0.175 169 HE3 LYS 19 HE3 LYS 19 -0.704 -3.553 -0.363 170 HZ1 LYS 19 HZ1 LYS 19 -0.271 -4.827 -2.243 171 HZ2 LYS 19 HZ2 LYS 19 1.213 -5.310 -1.771 172 HZ3 LYS 19 HZ3 LYS 19 0.956 -3.755 -2.237 173 H ILE 20 H ILE 20 3.320 -1.349 5.495 174 HA ILE 20 HA ILE 20 5.957 -2.001 4.888 175 HB ILE 20 HB ILE 20 5.161 -0.654 7.489 176 HG12 ILE 20 HG12 ILE 20 3.955 0.618 5.903 177 HG13 ILE 20 HG13 ILE 20 5.388 1.524 6.287 178 HG21 ILE 20 HG21 ILE 20 7.640 -0.413 5.722 179 HG22 ILE 20 HG22 ILE 20 7.312 0.535 7.191 180 HG23 ILE 20 HG23 ILE 20 7.547 -1.203 7.302 181 HD11 ILE 20 HD11 ILE 20 6.417 0.854 4.174 182 HD12 ILE 20 HD12 ILE 20 5.018 -0.181 3.779 183 HD13 ILE 20 HD13 ILE 20 4.830 1.581 3.873 184 H LYS 21 H LYS 21 3.993 -3.018 7.687 185 HA LYS 21 HA LYS 21 6.087 -4.443 9.087 186 HB2 LYS 21 HB2 LYS 21 3.124 -5.156 9.135 187 HB3 LYS 21 HB3 LYS 21 4.330 -5.353 10.402 188 HG2 LYS 21 HG2 LYS 21 4.414 -2.875 10.694 189 HG3 LYS 21 HG3 LYS 21 3.198 -2.687 9.415 190 HD2 LYS 21 HD2 LYS 21 1.693 -4.198 10.802 191 HD3 LYS 21 HD3 LYS 21 2.875 -4.013 12.124 192 HE2 LYS 21 HE2 LYS 21 2.645 -1.447 11.637 193 HE3 LYS 21 HE3 LYS 21 1.218 -1.900 10.695 194 HZ1 LYS 21 HZ1 LYS 21 0.369 -2.923 12.803 195 HZ2 LYS 21 HZ2 LYS 21 0.562 -1.275 12.877 196 HZ3 LYS 21 HZ3 LYS 21 1.629 -2.252 13.607 197 H GLU 22 H GLU 22 3.787 -5.294 6.477 198 HA GLU 22 HA GLU 22 4.199 -8.138 6.768 199 HB2 GLU 22 HB2 GLU 22 3.026 -6.517 4.458 200 HB3 GLU 22 HB3 GLU 22 3.015 -8.286 4.591 201 HG2 GLU 22 HG2 GLU 22 1.778 -8.128 6.727 202 HG3 GLU 22 HG3 GLU 22 1.776 -6.353 6.610 203 H ARG 23 H ARG 23 5.406 -5.678 4.403 204 HA ARG 23 HA ARG 23 7.127 -7.529 3.103 205 HB2 ARG 23 HB2 ARG 23 8.241 -5.573 2.101 206 HB3 ARG 23 HB3 ARG 23 6.500 -5.582 1.975 207 HG2 ARG 23 HG2 ARG 23 6.729 -3.387 2.506 208 HG3 ARG 23 HG3 ARG 23 6.618 -4.022 4.127 209 HD2 ARG 23 HD2 ARG 23 8.378 -2.365 3.966 210 HD3 ARG 23 HD3 ARG 23 9.072 -3.950 4.332 211 HE ARG 23 HE ARG 23 8.824 -2.914 1.543 212 HH11 ARG 23 HH11 ARG 23 11.104 -3.909 4.075 213 HH12 ARG 23 HH12 ARG 23 12.326 -4.377 2.965 214 HH21 ARG 23 HH21 ARG 23 10.175 -4.128 0.125 215 HH22 ARG 23 HH22 ARG 23 11.648 -4.829 0.709 216 H ILE 24 H ILE 24 7.748 -5.571 6.017 217 HA ILE 24 HA ILE 24 10.581 -6.219 5.951 218 HB ILE 24 HB ILE 24 9.648 -4.173 7.009 219 HG12 ILE 24 HG12 ILE 24 11.304 -6.025 8.757 220 HG13 ILE 24 HG13 ILE 24 11.861 -4.742 7.659 221 HG21 ILE 24 HG21 ILE 24 8.732 -5.874 9.359 222 HG22 ILE 24 HG22 ILE 24 8.403 -4.153 9.011 223 HG23 ILE 24 HG23 ILE 24 7.679 -5.400 8.029 224 HD11 ILE 24 HD11 ILE 24 10.382 -4.491 10.293 225 HD12 ILE 24 HD12 ILE 24 12.023 -3.904 9.903 226 HD13 ILE 24 HD13 ILE 24 10.581 -3.120 9.183 227 H GLN 25 H GLN 25 7.686 -7.565 7.711 228 HA GLN 25 HA GLN 25 9.322 -9.373 9.200 229 HB2 GLN 25 HB2 GLN 25 7.100 -8.362 9.835 230 HB3 GLN 25 HB3 GLN 25 6.296 -9.456 8.701 231 HG2 GLN 25 HG2 GLN 25 7.238 -11.366 10.018 232 HG3 GLN 25 HG3 GLN 25 7.919 -10.184 11.154 233 HE21 GLN 25 HE21 GLN 25 5.396 -12.267 11.004 234 HE22 GLN 25 HE22 GLN 25 4.171 -11.264 11.763 235 H ASN 26 H ASN 26 7.056 -9.855 6.401 236 HA ASN 26 HA ASN 26 7.605 -12.700 6.236 237 HB2 ASN 26 HB2 ASN 26 6.336 -10.830 4.176 238 HB3 ASN 26 HB3 ASN 26 6.420 -12.581 4.053 239 HD21 ASN 26 HD21 ASN 26 4.980 -9.928 5.884 240 HD22 ASN 26 HD22 ASN 26 3.713 -10.904 6.629 241 H SER 27 H SER 27 8.575 -9.871 4.278 242 HA SER 27 HA SER 27 10.343 -9.513 2.862 243 HB2 SER 27 HB2 SER 27 11.308 -10.307 5.281 244 HB3 SER 27 HB3 SER 27 12.015 -11.579 4.293 245 HG SER 27 HG SER 27 13.252 -9.650 4.722 246 H LEU 28 H LEU 28 8.445 -11.752 2.161 247 HA LEU 28 HA LEU 28 10.113 -13.043 0.105 248 HB2 LEU 28 HB2 LEU 28 9.113 -15.245 0.650 249 HB3 LEU 28 HB3 LEU 28 10.094 -14.566 1.934 250 HG LEU 28 HG LEU 28 7.999 -13.813 3.111 251 HD11 LEU 28 HD11 LEU 28 6.650 -15.386 0.934 252 HD12 LEU 28 HD12 LEU 28 6.321 -13.722 1.515 253 HD13 LEU 28 HD13 LEU 28 5.940 -15.099 2.520 254 HD21 LEU 28 HD21 LEU 28 9.005 -15.586 4.114 255 HD22 LEU 28 HD22 LEU 28 8.850 -16.638 2.713 256 HD23 LEU 28 HD23 LEU 28 7.435 -16.291 3.733 257 H SER 29 H SER 29 8.311 -14.652 -1.026 258 HA SER 29 HA SER 29 6.079 -12.896 -2.018 259 HB2 SER 29 HB2 SER 29 8.017 -14.678 -3.560 260 HB3 SER 29 HB3 SER 29 6.582 -13.889 -4.258 261 HG SER 29 HG SER 29 8.838 -12.558 -3.117 262 H THR 30 H THR 30 7.164 -16.290 -1.419 263 HA THR 30 HA THR 30 4.404 -17.196 -1.540 264 HB THR 30 HB THR 30 5.012 -17.071 -3.895 265 HG1 THR 30 HG1 THR 30 5.145 -19.798 -3.413 266 HG21 THR 30 HG21 THR 30 7.316 -18.954 -3.304 267 HG22 THR 30 HG22 THR 30 7.445 -17.264 -3.845 268 HG23 THR 30 HG23 THR 30 6.743 -18.479 -4.908 269 H GLU 31 H GLU 31 6.900 -17.020 0.270 270 HA GLU 31 HA GLU 31 7.906 -18.247 1.873 271 HB2 GLU 31 HB2 GLU 31 6.037 -20.522 1.401 272 HB3 GLU 31 HB3 GLU 31 6.862 -20.064 2.880 273 HG2 GLU 31 HG2 GLU 31 5.452 -18.042 3.064 274 HG3 GLU 31 HG3 GLU 31 4.615 -18.461 1.571 275 H LYS 32 H LYS 32 8.896 -18.261 -0.831 276 HA LYS 32 HA LYS 32 9.674 -20.902 -1.618 277 HB2 LYS 32 HB2 LYS 32 11.284 -19.965 -3.033 278 HB3 LYS 32 HB3 LYS 32 9.831 -18.997 -3.182 279 HG2 LYS 32 HG2 LYS 32 11.977 -18.035 -1.257 280 HG3 LYS 32 HG3 LYS 32 12.349 -18.003 -2.949 281 HD2 LYS 32 HD2 LYS 32 9.792 -16.763 -1.858 282 HD3 LYS 32 HD3 LYS 32 11.311 -15.886 -1.865 283 HE2 LYS 32 HE2 LYS 32 9.950 -17.074 -4.324 284 HE3 LYS 32 HE3 LYS 32 9.934 -15.360 -3.863 285 HZ1 LYS 32 HZ1 LYS 32 12.265 -16.913 -4.743 286 HZ2 LYS 32 HZ2 LYS 32 12.398 -15.417 -4.051 287 HZ3 LYS 32 HZ3 LYS 32 11.619 -15.583 -5.460 288 H TYR 33 H TYR 33 11.831 -21.885 -1.394 289 HA TYR 33 HA TYR 33 13.068 -21.222 1.242 290 HB2 TYR 33 HB2 TYR 33 12.171 -23.512 0.831 291 HB3 TYR 33 HB3 TYR 33 13.279 -23.690 -0.524 292 HD1 TYR 33 HD1 TYR 33 15.494 -24.490 -0.153 293 HD2 TYR 33 HD2 TYR 33 13.163 -23.063 3.188 294 HE1 TYR 33 HE1 TYR 33 17.157 -25.453 1.416 295 HE2 TYR 33 HE2 TYR 33 14.802 -24.049 4.754 296 HH TYR 33 HH TYR 33 17.087 -24.856 4.877 297 H GLY 34 H GLY 34 15.354 -20.991 1.374 298 HA2 GLY 34 HA2 GLY 34 17.378 -20.182 0.757 299 HA3 GLY 34 HA3 GLY 34 17.241 -21.231 -0.669 300 H SER 35 H SER 35 18.309 -19.718 -1.989 301 HA SER 35 HA SER 35 17.337 -16.997 -2.392 302 HB2 SER 35 HB2 SER 35 19.317 -18.633 -4.022 303 HB3 SER 35 HB3 SER 35 19.163 -16.867 -3.937 304 HG SER 35 HG SER 35 20.904 -17.740 -2.679 305 H GLY 36 H GLY 36 16.387 -16.300 -4.603 306 HA2 GLY 36 HA2 GLY 36 15.818 -18.237 -6.593 307 HA3 GLY 36 HA3 GLY 36 14.417 -18.043 -5.524 308 H SER 37 H SER 37 14.090 -17.457 -8.078 309 HA SER 37 HA SER 37 14.592 -14.753 -8.848 310 HB2 SER 37 HB2 SER 37 12.632 -16.860 -9.864 311 HB3 SER 37 HB3 SER 37 13.076 -15.379 -10.726 312 HG SER 37 HG SER 37 14.345 -17.102 -11.452 313 H GLY 38 H GLY 38 13.022 -13.134 -9.239 314 HA2 GLY 38 HA2 GLY 38 11.514 -12.244 -7.110 315 HA3 GLY 38 HA3 GLY 38 11.493 -11.599 -8.750 316 H SER 39 H SER 39 9.273 -10.971 -8.150 317 HA SER 39 HA SER 39 7.290 -12.928 -8.975 318 HB2 SER 39 HB2 SER 39 5.903 -12.434 -6.928 319 HB3 SER 39 HB3 SER 39 7.378 -13.340 -6.597 320 HG SER 39 HG SER 39 7.441 -11.809 -5.117 321 H GLY 40 H GLY 40 4.994 -11.444 -8.551 322 HA2 GLY 40 HA2 GLY 40 5.505 -8.800 -9.838 323 HA3 GLY 40 HA3 GLY 40 4.295 -9.935 -10.452 324 H SER 41 H SER 41 3.391 -7.489 -9.888 325 HA SER 41 HA SER 41 1.859 -7.746 -7.349 326 HB2 SER 41 HB2 SER 41 2.785 -5.147 -8.578 327 HB3 SER 41 HB3 SER 41 2.086 -5.430 -6.980 328 HG SER 41 HG SER 41 4.206 -5.159 -6.715 329 H GLY 42 H GLY 42 0.009 -5.786 -7.567 330 HA2 GLY 42 HA2 GLY 42 -1.573 -6.559 -9.953 331 HA3 GLY 42 HA3 GLY 42 -2.174 -6.021 -8.383 332 H SER 43 H SER 43 -3.459 -4.647 -9.941 333 HA SER 43 HA SER 43 -2.541 -1.949 -9.923 334 HB2 SER 43 HB2 SER 43 -1.416 -2.921 -12.003 335 HB3 SER 43 HB3 SER 43 -3.043 -3.213 -12.659 336 HG SER 43 HG SER 43 -2.336 -1.273 -13.395 337 H GLY 44 H GLY 44 -4.343 -0.626 -11.061 338 HA2 GLY 44 HA2 GLY 44 -7.057 -1.764 -11.155 339 HA3 GLY 44 HA3 GLY 44 -6.691 -0.555 -9.905 340 H SER 45 H SER 45 -8.396 0.656 -11.136 341 HA SER 45 HA SER 45 -7.275 2.595 -12.954 342 HB2 SER 45 HB2 SER 45 -9.546 0.710 -13.781 343 HB3 SER 45 HB3 SER 45 -9.173 2.246 -14.585 344 HG SER 45 HG SER 45 -7.139 1.502 -15.057 345 H GLY 46 H GLY 46 -9.050 4.378 -13.274 346 HA2 GLY 46 HA2 GLY 46 -11.466 4.385 -11.817 347 HA3 GLY 46 HA3 GLY 46 -10.188 5.066 -10.790 348 H SER 47 H SER 47 -12.130 6.790 -11.334 349 HA SER 47 HA SER 47 -10.829 8.898 -12.809 350 HB2 SER 47 HB2 SER 47 -12.703 9.235 -14.407 351 HB3 SER 47 HB3 SER 47 -11.847 7.721 -14.696 352 HG SER 47 HG SER 47 -13.665 6.865 -13.180 353 H GLY 48 H GLY 48 -12.067 10.984 -12.503 354 HA2 GLY 48 HA2 GLY 48 -14.394 11.626 -11.468 355 HA3 GLY 48 HA3 GLY 48 -13.649 10.938 -10.016 356 H SER 49 H SER 49 -14.476 13.705 -10.497 357 HA SER 49 HA SER 49 -11.953 15.041 -9.786 358 HB2 SER 49 HB2 SER 49 -13.825 15.852 -12.040 359 HB3 SER 49 HB3 SER 49 -12.720 16.986 -11.230 360 HG SER 49 HG SER 49 -11.648 16.111 -12.979 361 H GLY 50 H GLY 50 -12.407 17.104 -8.595 362 HA2 GLY 50 HA2 GLY 50 -14.630 18.236 -7.716 363 HA3 GLY 50 HA3 GLY 50 -14.758 16.690 -6.863 364 H SER 51 H SER 51 -14.564 18.005 -4.870 365 HA SER 51 HA SER 51 -11.790 18.907 -4.293 366 HB2 SER 51 HB2 SER 51 -13.021 20.144 -2.403 367 HB3 SER 51 HB3 SER 51 -13.130 20.760 -4.060 368 HG SER 51 HG SER 51 -15.184 20.413 -4.082 369 H GLY 52 H GLY 52 -10.628 17.426 -3.278 370 HA2 GLY 52 HA2 GLY 52 -11.786 15.846 -1.024 371 HA3 GLY 52 HA3 GLY 52 -10.689 15.149 -2.230 372 H SER 53 H SER 53 -8.680 16.534 -2.642 373 HA SER 53 HA SER 53 -6.634 17.149 -1.921 374 HB2 SER 53 HB2 SER 53 -8.007 19.045 -0.010 375 HB3 SER 53 HB3 SER 53 -6.524 19.295 -0.943 376 HG SER 53 HG SER 53 -7.728 19.923 -2.604 377 H GLY 54 H GLY 54 -6.536 14.913 -0.979 378 HA2 GLY 54 HA2 GLY 54 -6.533 14.815 1.997 379 HA3 GLY 54 HA3 GLY 54 -6.597 13.452 0.878 380 H SER 55 H SER 55 -4.864 13.463 2.966 381 HA SER 55 HA SER 55 -2.193 13.439 1.706 382 HB2 SER 55 HB2 SER 55 -2.522 15.522 3.041 383 HB3 SER 55 HB3 SER 55 -3.037 14.552 4.422 384 HG SER 55 HG SER 55 -0.461 14.847 3.284 385 H GLY 56 H GLY 56 -0.761 12.166 3.463 386 HA2 GLY 56 HA2 GLY 56 -2.211 9.803 4.556 387 HA3 GLY 56 HA3 GLY 56 -0.747 9.636 3.561 388 H SER 57 H SER 57 1.018 9.248 5.025 389 HA SER 57 HA SER 57 1.609 11.295 6.962 390 HB2 SER 57 HB2 SER 57 1.626 9.752 8.941 391 HB3 SER 57 HB3 SER 57 0.019 10.158 8.345 392 HG SER 57 HG SER 57 0.041 8.004 8.712 393 H GLY 58 H GLY 58 3.613 10.667 8.223 394 HA2 GLY 58 HA2 GLY 58 5.516 8.966 6.666 395 HA3 GLY 58 HA3 GLY 58 5.896 10.615 7.177 396 H TYR 59 H TYR 59 5.261 7.330 8.302 397 HA TYR 59 HA TYR 59 6.503 8.030 10.947 398 HB2 TYR 59 HB2 TYR 59 3.990 6.421 10.404 399 HB3 TYR 59 HB3 TYR 59 4.939 6.157 11.847 400 HD1 TYR 59 HD1 TYR 59 5.532 8.224 13.328 401 HD2 TYR 59 HD2 TYR 59 2.248 8.088 10.529 402 HE1 TYR 59 HE1 TYR 59 4.359 9.967 14.627 403 HE2 TYR 59 HE2 TYR 59 1.068 9.841 11.824 404 HH TYR 59 HH TYR 59 1.175 11.317 13.698 405 H GLN3288 H GLN3288 6.672 6.005 8.192 406 HA GLN3288 HA GLN3288 7.963 3.756 9.577 407 HB2 GLN3288 HB2 GLN3288 7.983 2.724 7.369 408 HB3 GLN3288 HB3 GLN3288 6.391 3.373 7.720 409 HG2 GLN3288 HG2 GLN3288 7.387 5.521 6.436 410 HG3 GLN3288 HG3 GLN3288 8.505 4.346 5.796 411 HE21 GLN3288 HE21 GLN3288 7.833 4.021 3.717 412 HE22 GLN3288 HE22 GLN3288 6.162 3.904 3.195 413 H ILE3289 H ILE3289 9.992 2.954 8.019 414 HA ILE3289 HA ILE3289 12.068 4.920 8.593 415 HB ILE3289 HB ILE3289 12.438 2.144 7.439 416 HG12 ILE3289 HG12 ILE3289 12.533 2.849 10.406 417 HG13 ILE3289 HG13 ILE3289 11.168 2.029 9.647 418 HG21 ILE3289 HG21 ILE3289 14.248 4.066 8.992 419 HG22 ILE3289 HG22 ILE3289 14.700 2.457 8.449 420 HG23 ILE3289 HG23 ILE3289 14.350 3.695 7.256 421 HD11 ILE3289 HD11 ILE3289 12.711 0.191 8.898 422 HD12 ILE3289 HD12 ILE3289 13.994 0.936 9.870 423 HD13 ILE3289 HD13 ILE3289 12.525 0.349 10.657 424 H GLU3290 H GLU3290 12.028 6.535 7.099 425 HA GLU3290 HA GLU3290 11.533 6.114 4.285 426 HB2 GLU3290 HB2 GLU3290 10.860 8.100 5.605 427 HB3 GLU3290 HB3 GLU3290 12.542 8.537 5.809 428 HG2 GLU3290 HG2 GLU3290 12.766 8.824 3.346 429 HG3 GLU3290 HG3 GLU3290 11.145 8.171 3.105 430 H THR3291 H THR3291 14.242 5.432 6.168 431 HA THR3291 HA THR3291 16.003 5.619 3.796 432 HB THR3291 HB THR3291 16.512 7.405 5.298 433 HG1 THR3291 HG1 THR3291 18.161 6.473 4.151 434 HG21 THR3291 HG21 THR3291 17.408 7.136 7.519 435 HG22 THR3291 HG22 THR3291 17.198 5.375 7.443 436 HG23 THR3291 HG23 THR3291 15.779 6.451 7.437 437 H PHE3292 H PHE3292 14.591 3.359 3.963 438 HA PHE3292 HA PHE3292 16.731 1.435 4.455 439 HB2 PHE3292 HB2 PHE3292 15.663 1.694 6.673 440 HB3 PHE3292 HB3 PHE3292 14.118 1.158 6.023 441 HD1 PHE3292 HD1 PHE3292 17.308 0.206 7.446 442 HD2 PHE3292 HD2 PHE3292 14.014 -1.265 5.080 443 HE1 PHE3292 HE1 PHE3292 17.971 -2.112 7.950 444 HE2 PHE3292 HE2 PHE3292 14.647 -3.579 5.631 445 HZ PHE3292 HZ PHE3292 16.672 -4.033 6.976 446 H PHE3293 H PHE3293 13.179 1.164 4.230 447 HA PHE3293 HA PHE3293 13.501 -0.442 1.755 448 HB2 PHE3293 HB2 PHE3293 11.059 -1.061 2.383 449 HB3 PHE3293 HB3 PHE3293 12.428 -1.717 3.239 450 HD1 PHE3293 HD1 PHE3293 11.911 -2.121 5.486 451 HD2 PHE3293 HD2 PHE3293 10.506 1.521 3.621 452 HE1 PHE3293 HE1 PHE3293 11.096 -1.299 7.664 453 HE2 PHE3293 HE2 PHE3293 9.679 2.300 5.782 454 HZ PHE3293 HZ PHE3293 9.955 0.884 7.829 455 H ALA3294 H ALA3294 13.137 2.740 2.220 456 HA ALA3294 HA ALA3294 10.868 3.623 1.024 457 HB1 ALA3294 HB1 ALA3294 12.165 5.591 0.296 458 HB2 ALA3294 HB2 ALA3294 12.499 5.097 1.963 459 HB3 ALA3294 HB3 ALA3294 13.670 4.716 0.674 460 H GLN3295 H GLN3295 13.557 2.103 -0.633 461 HA GLN3295 HA GLN3295 12.891 2.857 -3.315 462 HB2 GLN3295 HB2 GLN3295 14.411 0.446 -2.232 463 HB3 GLN3295 HB3 GLN3295 14.423 0.989 -3.918 464 HG2 GLN3295 HG2 GLN3295 15.508 2.482 -1.492 465 HG3 GLN3295 HG3 GLN3295 16.453 1.736 -2.779 466 HE21 GLN3295 HE21 GLN3295 15.526 4.759 -1.740 467 HE22 GLN3295 HE22 GLN3295 15.368 5.564 -3.263 468 H ASP3296 H ASP3296 12.041 -0.008 -1.348 469 HA ASP3296 HA ASP3296 10.402 -1.059 -3.578 470 HB2 ASP3296 HB2 ASP3296 11.632 -2.661 -2.104 471 HB3 ASP3296 HB3 ASP3296 10.694 -2.076 -0.726 472 H ILE3297 H ILE3297 10.023 0.888 -0.738 473 HA ILE3297 HA ILE3297 7.228 0.643 -0.286 474 HB ILE3297 HB ILE3297 9.452 2.233 0.634 475 HG12 ILE3297 HG12 ILE3297 8.383 2.258 2.739 476 HG13 ILE3297 HG13 ILE3297 6.813 1.849 2.017 477 HG21 ILE3297 HG21 ILE3297 8.315 4.276 1.362 478 HG22 ILE3297 HG22 ILE3297 8.469 4.179 -0.388 479 HG23 ILE3297 HG23 ILE3297 6.904 3.830 0.370 480 HD11 ILE3297 HD11 ILE3297 8.315 0.047 3.254 481 HD12 ILE3297 HD12 ILE3297 7.379 -0.367 1.816 482 HD13 ILE3297 HD13 ILE3297 9.127 -0.041 1.675 483 H GLU3298 H GLU3298 9.134 2.916 -2.379 484 HA GLU3298 HA GLU3298 6.846 4.335 -3.276 485 HB2 GLU3298 HB2 GLU3298 8.258 5.308 -4.927 486 HB3 GLU3298 HB3 GLU3298 9.183 5.131 -3.454 487 HG2 GLU3298 HG2 GLU3298 10.811 4.086 -4.602 488 HG3 GLU3298 HG3 GLU3298 9.715 2.770 -4.917 489 H SER3299 H SER3299 8.375 1.428 -4.353 490 HA SER3299 HA SER3299 6.961 1.081 -6.820 491 HB2 SER3299 HB2 SER3299 9.195 0.146 -6.224 492 HB3 SER3299 HB3 SER3299 8.419 -0.975 -5.095 493 HG SER3299 HG SER3299 8.896 -1.841 -7.156 494 H VAL3300 H VAL3300 6.416 -0.306 -3.509 495 HA VAL3300 HA VAL3300 4.098 -1.757 -4.480 496 HB VAL3300 HB VAL3300 5.537 -2.567 -2.649 497 HG11 VAL3300 HG11 VAL3300 4.151 -0.465 -0.923 498 HG12 VAL3300 HG12 VAL3300 5.226 -1.756 -0.367 499 HG13 VAL3300 HG13 VAL3300 5.851 -0.456 -1.409 500 HG21 VAL3300 HG21 VAL3300 3.735 -3.513 -1.367 501 HG22 VAL3300 HG22 VAL3300 2.617 -2.218 -1.882 502 HG23 VAL3300 HG23 VAL3300 3.251 -3.383 -3.063 503 H GLN3301 H GLN3301 4.571 1.359 -2.733 504 HA GLN3301 HA GLN3301 1.777 1.724 -2.327 505 HB2 GLN3301 HB2 GLN3301 2.204 3.836 -1.582 506 HB3 GLN3301 HB3 GLN3301 3.597 2.849 -1.127 507 HG2 GLN3301 HG2 GLN3301 4.830 4.548 -1.934 508 HG3 GLN3301 HG3 GLN3301 4.430 3.913 -3.522 509 HE21 GLN3301 HE21 GLN3301 1.895 4.845 -4.167 510 HE22 GLN3301 HE22 GLN3301 1.969 6.580 -4.146 511 H LYS3302 H LYS3302 3.850 2.277 -5.123 512 HA LYS3302 HA LYS3302 2.203 4.028 -6.633 513 HB2 LYS3302 HB2 LYS3302 4.335 2.004 -7.240 514 HB3 LYS3302 HB3 LYS3302 3.293 2.505 -8.573 515 HG2 LYS3302 HG2 LYS3302 3.823 4.802 -8.283 516 HG3 LYS3302 HG3 LYS3302 4.636 4.515 -6.769 517 HD2 LYS3302 HD2 LYS3302 6.449 4.753 -8.242 518 HD3 LYS3302 HD3 LYS3302 6.279 3.006 -8.125 519 HE2 LYS3302 HE2 LYS3302 6.532 3.452 -10.445 520 HE3 LYS3302 HE3 LYS3302 4.801 3.129 -10.230 521 HZ1 LYS3302 HZ1 LYS3302 5.070 5.080 -11.560 522 HZ2 LYS3302 HZ2 LYS3302 6.127 5.750 -10.503 523 HZ3 LYS3302 HZ3 LYS3302 4.547 5.620 -10.085 524 H GLU3303 H GLU3303 1.981 0.563 -5.945 525 HA GLU3303 HA GLU3303 -0.072 0.112 -7.943 526 HB2 GLU3303 HB2 GLU3303 0.268 -2.011 -7.640 527 HB3 GLU3303 HB3 GLU3303 1.644 -1.546 -6.672 528 HG2 GLU3303 HG2 GLU3303 0.170 -1.799 -4.623 529 HG3 GLU3303 HG3 GLU3303 -1.121 -2.352 -5.697 530 H LEU3304 H LEU3304 -0.082 0.608 -4.414 531 HA LEU3304 HA LEU3304 -2.872 0.476 -4.102 532 HB2 LEU3304 HB2 LEU3304 -0.773 2.081 -2.546 533 HB3 LEU3304 HB3 LEU3304 -2.391 1.738 -1.990 534 HG LEU3304 HG LEU3304 -0.157 -0.249 -2.546 535 HD11 LEU3304 HD11 LEU3304 0.247 0.850 -0.555 536 HD12 LEU3304 HD12 LEU3304 -0.377 -0.746 -0.104 537 HD13 LEU3304 HD13 LEU3304 -1.444 0.680 0.002 538 HD21 LEU3304 HD21 LEU3304 -2.184 -1.386 -3.188 539 HD22 LEU3304 HD22 LEU3304 -2.958 -0.947 -1.645 540 HD23 LEU3304 HD23 LEU3304 -1.580 -2.062 -1.687 541 H GLU3305 H GLU3305 -0.899 3.272 -5.057 542 HA GLU3305 HA GLU3305 -3.114 5.080 -4.630 543 HB2 GLU3305 HB2 GLU3305 -1.783 6.800 -5.814 544 HB3 GLU3305 HB3 GLU3305 -0.914 6.015 -4.486 545 HG2 GLU3305 HG2 GLU3305 0.270 4.608 -5.965 546 HG3 GLU3305 HG3 GLU3305 -0.677 5.070 -7.374 547 H ASN3306 H ASN3306 -2.754 2.789 -7.042 548 HA ASN3306 HA ASN3306 -4.632 4.349 -8.772 549 HB2 ASN3306 HB2 ASN3306 -3.930 3.213 -10.685 550 HB3 ASN3306 HB3 ASN3306 -2.468 3.829 -9.917 551 HD21 ASN3306 HD21 ASN3306 -0.887 2.277 -9.104 552 HD22 ASN3306 HD22 ASN3306 -1.041 0.631 -9.619 553 H LEU3307 H LEU3307 -4.521 2.041 -6.359 554 HA LEU3307 HA LEU3307 -6.539 0.283 -7.596 555 HB2 LEU3307 HB2 LEU3307 -4.863 0.316 -5.144 556 HB3 LEU3307 HB3 LEU3307 -6.511 -0.144 -4.827 557 HG LEU3307 HG LEU3307 -5.901 -2.206 -5.220 558 HD11 LEU3307 HD11 LEU3307 -7.016 -1.806 -7.432 559 HD12 LEU3307 HD12 LEU3307 -5.812 -3.074 -7.451 560 HD13 LEU3307 HD13 LEU3307 -5.395 -1.476 -8.112 561 HD21 LEU3307 HD21 LEU3307 -3.444 -1.399 -6.726 562 HD22 LEU3307 HD22 LEU3307 -3.863 -3.006 -6.111 563 HD23 LEU3307 HD23 LEU3307 -3.565 -1.693 -4.964 564 H SER3308 H SER3308 -8.672 -0.028 -6.715 565 HA SER3308 HA SER3308 -9.978 2.545 -6.155 566 HB2 SER3308 HB2 SER3308 -11.097 -0.264 -6.537 567 HB3 SER3308 HB3 SER3308 -12.013 1.256 -6.539 568 HG SER3308 HG SER3308 -10.675 1.886 -8.352 569 H GLU3309 H GLU3309 -11.779 2.521 -4.417 570 HA GLU3309 HA GLU3309 -10.700 1.976 -1.868 571 HB2 GLU3309 HB2 GLU3309 -13.424 2.672 -3.041 572 HB3 GLU3309 HB3 GLU3309 -13.472 1.891 -1.462 573 HG2 GLU3309 HG2 GLU3309 -12.521 3.605 -0.349 574 HG3 GLU3309 HG3 GLU3309 -11.620 4.220 -1.734 575 H GLU3310 H GLU3310 -13.159 0.022 -3.725 576 HA GLU3310 HA GLU3310 -13.495 -1.940 -1.854 577 HB2 GLU3310 HB2 GLU3310 -14.216 -3.360 -3.730 578 HB3 GLU3310 HB3 GLU3310 -14.786 -1.694 -3.946 579 HG2 GLU3310 HG2 GLU3310 -12.794 -1.251 -5.402 580 HG3 GLU3310 HG3 GLU3310 -12.330 -2.936 -5.227 581 H GLU3311 H GLU3311 -10.569 -1.381 -3.680 582 HA GLU3311 HA GLU3311 -9.552 -4.126 -3.331 583 HB2 GLU3311 HB2 GLU3311 -8.308 -1.574 -4.407 584 HB3 GLU3311 HB3 GLU3311 -7.567 -3.159 -4.448 585 HG2 GLU3311 HG2 GLU3311 -10.257 -2.780 -5.734 586 HG3 GLU3311 HG3 GLU3311 -8.927 -2.157 -6.542 587 H LEU3312 H LEU3312 -8.832 -0.800 -2.328 588 HA LEU3312 HA LEU3312 -6.790 -1.550 -0.435 589 HB2 LEU3312 HB2 LEU3312 -8.194 1.139 -0.522 590 HB3 LEU3312 HB3 LEU3312 -6.603 0.824 0.053 591 HG LEU3312 HG LEU3312 -7.210 0.271 -2.850 592 HD11 LEU3312 HD11 LEU3312 -8.181 2.342 -2.621 593 HD12 LEU3312 HD12 LEU3312 -6.611 2.592 -3.376 594 HD13 LEU3312 HD13 LEU3312 -6.804 3.006 -1.661 595 HD21 LEU3312 HD21 LEU3312 -5.116 -0.511 -2.062 596 HD22 LEU3312 HD22 LEU3312 -4.721 1.055 -1.322 597 HD23 LEU3312 HD23 LEU3312 -4.846 0.899 -3.077 598 H LEU3313 H LEU3313 -9.989 -0.104 -0.114 599 HA LEU3313 HA LEU3313 -10.257 0.112 2.684 600 HB2 LEU3313 HB2 LEU3313 -11.682 1.295 1.001 601 HB3 LEU3313 HB3 LEU3313 -12.317 -0.271 0.450 602 HG LEU3313 HG LEU3313 -13.882 0.966 1.823 603 HD11 LEU3313 HD11 LEU3313 -13.401 -1.806 2.924 604 HD12 LEU3313 HD12 LEU3313 -13.985 -1.489 1.273 605 HD13 LEU3313 HD13 LEU3313 -14.908 -0.952 2.668 606 HD21 LEU3313 HD21 LEU3313 -12.280 0.016 4.208 607 HD22 LEU3313 HD22 LEU3313 -13.871 0.782 4.234 608 HD23 LEU3313 HD23 LEU3313 -12.474 1.718 3.703 609 H ALA3314 H ALA3314 -10.938 -2.592 0.387 610 HA ALA3314 HA ALA3314 -12.044 -4.255 2.399 611 HB1 ALA3314 HB1 ALA3314 -12.313 -4.718 0.053 612 HB2 ALA3314 HB2 ALA3314 -10.567 -4.920 -0.178 613 HB3 ALA3314 HB3 ALA3314 -11.504 -6.096 0.806 614 H MET3315 H MET3315 -8.648 -3.535 1.661 615 HA MET3315 HA MET3315 -7.578 -5.872 3.021 616 HB2 MET3315 HB2 MET3315 -6.110 -3.304 2.341 617 HB3 MET3315 HB3 MET3315 -5.437 -4.914 2.623 618 HG2 MET3315 HG2 MET3315 -7.437 -4.923 0.526 619 HG3 MET3315 HG3 MET3315 -6.168 -3.784 0.189 620 HE1 MET3315 HE1 MET3315 -7.254 -6.792 -1.151 621 HE2 MET3315 HE2 MET3315 -6.232 -5.646 -2.037 622 HE3 MET3315 HE3 MET3315 -5.720 -7.340 -1.850 623 H LEU3316 H LEU3316 -7.567 -2.383 3.776 624 HA LEU3316 HA LEU3316 -6.617 -2.655 6.437 625 HB2 LEU3316 HB2 LEU3316 -7.499 -0.360 6.788 626 HB3 LEU3316 HB3 LEU3316 -6.451 -0.570 5.393 627 HG LEU3316 HG LEU3316 -8.815 -0.895 4.129 628 HD11 LEU3316 HD11 LEU3316 -9.432 0.928 6.543 629 HD12 LEU3316 HD12 LEU3316 -10.345 -0.503 6.072 630 HD13 LEU3316 HD13 LEU3316 -10.393 0.927 5.057 631 HD21 LEU3316 HD21 LEU3316 -7.969 1.909 4.866 632 HD22 LEU3316 HD22 LEU3316 -8.607 1.281 3.333 633 HD23 LEU3316 HD23 LEU3316 -6.997 0.845 3.790 634 H ASN3317 H ASN3317 -9.905 -2.786 5.083 635 HA ASN3317 HA ASN3317 -11.173 -2.815 7.709 636 HB2 ASN3317 HB2 ASN3317 -12.168 -2.077 5.397 637 HB3 ASN3317 HB3 ASN3317 -12.523 -3.789 5.172 638 HD21 ASN3317 HD21 ASN3317 -12.990 -0.917 7.229 639 HD22 ASN3317 HD22 ASN3317 -14.552 -1.439 7.854 640 H GLY3318 H GLY3318 -9.752 -5.101 5.590 641 HA2 GLY3318 HA2 GLY3318 -9.332 -7.378 5.750 642 HA3 GLY3318 HA3 GLY3318 -9.826 -7.302 7.456 643 H ASP3319 H ASP3319 -11.409 -6.645 4.305 644 HA ASP3319 HA ASP3319 -13.651 -8.443 5.000 645 HB2 ASP3319 HB2 ASP3319 -14.059 -5.935 5.327 646 HB3 ASP3319 HB3 ASP3319 -13.854 -5.752 3.578 647 H GLN3320 H GLN3320 -14.882 -9.118 3.043 648 HA GLN3320 HA GLN3320 -13.472 -9.019 0.486 649 HB2 GLN3320 HB2 GLN3320 -14.280 -11.695 1.714 650 HB3 GLN3320 HB3 GLN3320 -13.305 -11.367 0.288 651 HG2 GLN3320 HG2 GLN3320 -11.561 -10.373 1.939 652 HG3 GLN3320 HG3 GLN3320 -12.566 -11.108 3.216 653 HE21 GLN3320 HE21 GLN3320 -11.353 -12.964 3.902 654 HE22 GLN3320 HE22 GLN3320 -10.827 -14.178 2.754 655 H GLN3321 H GLN3321 -15.951 -7.887 1.489 656 HA GLN3321 HA GLN3321 -17.803 -8.997 -0.490 657 HB2 GLN3321 HB2 GLN3321 -19.535 -9.551 1.071 658 HB3 GLN3321 HB3 GLN3321 -18.083 -10.338 1.619 659 HG2 GLN3321 HG2 GLN3321 -17.911 -8.031 3.065 660 HG3 GLN3321 HG3 GLN3321 -19.643 -8.115 2.879 661 HE21 GLN3321 HE21 GLN3321 -16.820 -9.679 4.290 662 HE22 GLN3321 HE22 GLN3321 -17.653 -10.960 5.175 Start of MODEL 13 1 H1 MET 1 H MET 1 -27.792 7.325 -4.266 2 HA MET 1 HA MET 1 -28.634 8.696 -1.777 3 HB2 MET 1 HB2 MET 1 -26.519 7.582 -0.809 4 HB3 MET 1 HB3 MET 1 -27.938 6.580 -1.067 5 HG2 MET 1 HG2 MET 1 -25.633 6.745 -3.033 6 HG3 MET 1 HG3 MET 1 -25.723 5.568 -1.732 7 HE1 MET 1 HE1 MET 1 -26.575 3.280 -1.989 8 HE2 MET 1 HE2 MET 1 -28.096 4.015 -1.425 9 HE3 MET 1 HE3 MET 1 -28.101 2.887 -2.803 10 H ASN 2 H ASN 2 -25.775 9.189 -1.058 11 HA ASN 2 HA ASN 2 -25.465 11.673 -2.565 12 HB2 ASN 2 HB2 ASN 2 -23.714 10.490 -0.363 13 HB3 ASN 2 HB3 ASN 2 -23.568 12.093 -1.080 14 HD21 ASN 2 HD21 ASN 2 -25.398 10.161 1.217 15 HD22 ASN 2 HD22 ASN 2 -26.441 11.513 1.680 16 H ILE 3 H ILE 3 -22.527 11.405 -2.409 17 HA ILE 3 HA ILE 3 -22.056 9.994 -4.930 18 HB ILE 3 HB ILE 3 -21.064 12.248 -4.084 19 HG12 ILE 3 HG12 ILE 3 -18.913 11.922 -5.189 20 HG13 ILE 3 HG13 ILE 3 -19.212 10.184 -5.298 21 HG21 ILE 3 HG21 ILE 3 -19.150 10.436 -2.569 22 HG22 ILE 3 HG22 ILE 3 -19.054 12.202 -2.749 23 HG23 ILE 3 HG23 ILE 3 -20.383 11.479 -1.842 24 HD11 ILE 3 HD11 ILE 3 -19.775 11.461 -7.394 25 HD12 ILE 3 HD12 ILE 3 -21.194 10.640 -6.743 26 HD13 ILE 3 HD13 ILE 3 -20.987 12.378 -6.471 27 H ASN 4 H ASN 4 -20.212 8.382 -5.038 28 HA ASN 4 HA ASN 4 -19.995 6.705 -2.603 29 HB2 ASN 4 HB2 ASN 4 -20.569 4.669 -3.930 30 HB3 ASN 4 HB3 ASN 4 -21.912 5.762 -3.626 31 HD21 ASN 4 HD21 ASN 4 -19.738 4.508 -6.157 32 HD22 ASN 4 HD22 ASN 4 -20.590 5.268 -7.485 33 H GLU 5 H GLU 5 -18.934 7.311 -5.983 34 HA GLU 5 HA GLU 5 -16.545 5.765 -5.888 35 HB2 GLU 5 HB2 GLU 5 -17.409 8.221 -7.429 36 HB3 GLU 5 HB3 GLU 5 -15.851 7.459 -7.718 37 HG2 GLU 5 HG2 GLU 5 -16.750 5.460 -8.502 38 HG3 GLU 5 HG3 GLU 5 -18.285 5.692 -7.703 39 H GLN 6 H GLN 6 -17.338 8.977 -4.906 40 HA GLN 6 HA GLN 6 -14.584 9.755 -4.168 41 HB2 GLN 6 HB2 GLN 6 -17.288 11.070 -3.927 42 HB3 GLN 6 HB3 GLN 6 -15.932 11.683 -2.995 43 HG2 GLN 6 HG2 GLN 6 -16.245 12.865 -5.151 44 HG3 GLN 6 HG3 GLN 6 -14.647 12.173 -4.904 45 HE21 GLN 6 HE21 GLN 6 -17.790 11.565 -6.645 46 HE22 GLN 6 HE22 GLN 6 -17.001 10.657 -7.932 47 H THR 7 H THR 7 -17.348 8.175 -2.600 48 HA THR 7 HA THR 7 -16.425 8.666 0.077 49 HB THR 7 HB THR 7 -18.118 6.417 -0.996 50 HG1 THR 7 HG1 THR 7 -18.877 8.694 0.522 51 HG21 THR 7 HG21 THR 7 -17.514 7.182 1.871 52 HG22 THR 7 HG22 THR 7 -17.145 5.659 1.046 53 HG23 THR 7 HG23 THR 7 -18.835 6.085 1.363 54 H LEU 8 H LEU 8 -15.662 6.189 -2.397 55 HA LEU 8 HA LEU 8 -14.276 4.222 -1.001 56 HB2 LEU 8 HB2 LEU 8 -13.204 5.483 -3.567 57 HB3 LEU 8 HB3 LEU 8 -13.058 3.834 -2.963 58 HG LEU 8 HG LEU 8 -15.609 5.101 -3.998 59 HD11 LEU 8 HD11 LEU 8 -13.959 2.950 -5.324 60 HD12 LEU 8 HD12 LEU 8 -13.917 4.654 -5.785 61 HD13 LEU 8 HD13 LEU 8 -15.415 3.713 -5.956 62 HD21 LEU 8 HD21 LEU 8 -16.229 3.533 -2.415 63 HD22 LEU 8 HD22 LEU 8 -14.971 2.366 -2.899 64 HD23 LEU 8 HD23 LEU 8 -16.370 2.647 -3.951 65 H ASP 9 H ASP 9 -13.306 7.608 -1.677 66 HA ASP 9 HA ASP 9 -10.565 7.521 -1.277 67 HB2 ASP 9 HB2 ASP 9 -11.937 9.518 -1.892 68 HB3 ASP 9 HB3 ASP 9 -12.479 9.619 -0.214 69 H LYS 10 H LYS 10 -13.171 7.646 1.258 70 HA LYS 10 HA LYS 10 -11.213 7.744 3.400 71 HB2 LYS 10 HB2 LYS 10 -12.922 7.541 4.967 72 HB3 LYS 10 HB3 LYS 10 -13.629 8.468 3.648 73 HG2 LYS 10 HG2 LYS 10 -14.682 6.377 2.823 74 HG3 LYS 10 HG3 LYS 10 -14.071 5.498 4.214 75 HD2 LYS 10 HD2 LYS 10 -16.034 7.824 4.226 76 HD3 LYS 10 HD3 LYS 10 -16.446 6.106 4.327 77 HE2 LYS 10 HE2 LYS 10 -15.000 5.979 6.403 78 HE3 LYS 10 HE3 LYS 10 -14.896 7.756 6.345 79 HZ1 LYS 10 HZ1 LYS 10 -16.749 7.478 7.649 80 HZ2 LYS 10 HZ2 LYS 10 -17.185 6.062 6.952 81 HZ3 LYS 10 HZ3 LYS 10 -17.493 7.495 6.189 82 H LEU 11 H LEU 11 -12.520 5.156 1.454 83 HA LEU 11 HA LEU 11 -11.854 3.025 3.328 84 HB2 LEU 11 HB2 LEU 11 -12.829 2.973 0.423 85 HB3 LEU 11 HB3 LEU 11 -12.396 1.580 1.405 86 HG LEU 11 HG LEU 11 -14.679 1.615 1.384 87 HD11 LEU 11 HD11 LEU 11 -13.928 2.841 4.054 88 HD12 LEU 11 HD12 LEU 11 -13.916 1.104 3.547 89 HD13 LEU 11 HD13 LEU 11 -15.428 1.995 3.672 90 HD21 LEU 11 HD21 LEU 11 -14.605 4.572 1.837 91 HD22 LEU 11 HD22 LEU 11 -16.061 3.626 2.222 92 HD23 LEU 11 HD23 LEU 11 -15.439 3.662 0.595 93 H ARG 12 H ARG 12 -10.584 4.129 0.124 94 HA ARG 12 HA ARG 12 -8.414 2.309 0.113 95 HB2 ARG 12 HB2 ARG 12 -7.368 3.875 -1.562 96 HB3 ARG 12 HB3 ARG 12 -8.969 3.299 -1.928 97 HG2 ARG 12 HG2 ARG 12 -9.974 5.356 -1.566 98 HG3 ARG 12 HG3 ARG 12 -8.711 5.919 -0.462 99 HD2 ARG 12 HD2 ARG 12 -7.375 5.647 -2.844 100 HD3 ARG 12 HD3 ARG 12 -9.034 6.136 -3.313 101 HE ARG 12 HE ARG 12 -8.700 8.010 -1.527 102 HH11 ARG 12 HH11 ARG 12 -5.960 6.904 -3.507 103 HH12 ARG 12 HH12 ARG 12 -5.453 8.546 -3.844 104 HH21 ARG 12 HH21 ARG 12 -7.843 9.941 -1.630 105 HH22 ARG 12 HH22 ARG 12 -6.461 10.372 -2.618 106 H GLN 13 H GLN 13 -8.536 5.624 1.486 107 HA GLN 13 HA GLN 13 -5.792 5.696 2.123 108 HB2 GLN 13 HB2 GLN 13 -6.319 7.555 3.501 109 HB3 GLN 13 HB3 GLN 13 -7.270 7.610 2.019 110 HG2 GLN 13 HG2 GLN 13 -8.890 8.200 3.503 111 HG3 GLN 13 HG3 GLN 13 -9.084 6.446 3.466 112 HE21 GLN 13 HE21 GLN 13 -9.855 5.995 5.448 113 HE22 GLN 13 HE22 GLN 13 -9.091 6.391 6.964 114 H ALA 14 H ALA 14 -8.509 4.066 3.755 115 HA ALA 14 HA ALA 14 -7.071 3.557 6.212 116 HB1 ALA 14 HB1 ALA 14 -9.524 3.586 6.166 117 HB2 ALA 14 HB2 ALA 14 -9.553 2.318 4.939 118 HB3 ALA 14 HB3 ALA 14 -8.977 1.939 6.568 119 H VAL 15 H VAL 15 -7.820 1.715 3.216 120 HA VAL 15 HA VAL 15 -6.473 -0.680 4.005 121 HB VAL 15 HB VAL 15 -7.128 0.338 1.213 122 HG11 VAL 15 HG11 VAL 15 -6.433 -2.466 2.193 123 HG12 VAL 15 HG12 VAL 15 -7.096 -2.075 0.587 124 HG13 VAL 15 HG13 VAL 15 -5.509 -1.477 1.044 125 HG21 VAL 15 HG21 VAL 15 -9.188 0.159 2.325 126 HG22 VAL 15 HG22 VAL 15 -8.990 -1.360 1.516 127 HG23 VAL 15 HG23 VAL 15 -8.688 -1.285 3.248 128 H LEU 16 H LEU 16 -5.366 2.173 2.170 129 HA LEU 16 HA LEU 16 -2.795 1.070 1.611 130 HB2 LEU 16 HB2 LEU 16 -2.155 3.011 0.649 131 HB3 LEU 16 HB3 LEU 16 -3.897 3.004 0.467 132 HG LEU 16 HG LEU 16 -3.938 4.582 2.510 133 HD11 LEU 16 HD11 LEU 16 -1.988 6.079 2.636 134 HD12 LEU 16 HD12 LEU 16 -1.115 5.058 1.456 135 HD13 LEU 16 HD13 LEU 16 -1.520 4.440 3.060 136 HD21 LEU 16 HD21 LEU 16 -4.663 5.165 0.202 137 HD22 LEU 16 HD22 LEU 16 -2.983 5.429 -0.290 138 HD23 LEU 16 HD23 LEU 16 -3.741 6.490 0.913 139 H GLN 17 H GLN 17 -3.985 2.882 4.475 140 HA GLN 17 HA GLN 17 -1.471 3.199 5.708 141 HB2 GLN 17 HB2 GLN 17 -4.289 2.994 6.769 142 HB3 GLN 17 HB3 GLN 17 -2.908 3.132 7.865 143 HG2 GLN 17 HG2 GLN 17 -2.248 5.253 6.936 144 HG3 GLN 17 HG3 GLN 17 -3.331 5.077 5.578 145 HE21 GLN 17 HE21 GLN 17 -5.204 6.024 5.787 146 HE22 GLN 17 HE22 GLN 17 -5.925 6.695 7.238 147 H LYS 18 H LYS 18 -3.821 0.275 6.195 148 HA LYS 18 HA LYS 18 -1.898 -0.906 7.952 149 HB2 LYS 18 HB2 LYS 18 -3.191 -3.007 7.469 150 HB3 LYS 18 HB3 LYS 18 -4.160 -1.626 7.992 151 HG2 LYS 18 HG2 LYS 18 -4.554 -1.187 5.473 152 HG3 LYS 18 HG3 LYS 18 -3.983 -2.838 5.195 153 HD2 LYS 18 HD2 LYS 18 -6.161 -1.995 7.107 154 HD3 LYS 18 HD3 LYS 18 -6.489 -2.227 5.394 155 HE2 LYS 18 HE2 LYS 18 -6.751 -4.406 5.549 156 HE3 LYS 18 HE3 LYS 18 -5.109 -4.597 6.100 157 HZ1 LYS 18 HZ1 LYS 18 -7.268 -4.007 8.041 158 HZ2 LYS 18 HZ2 LYS 18 -5.833 -4.767 8.299 159 HZ3 LYS 18 HZ3 LYS 18 -6.986 -5.531 7.479 160 H LYS 19 H LYS 19 -2.305 -0.984 4.403 161 HA LYS 19 HA LYS 19 -0.485 -2.984 3.778 162 HB2 LYS 19 HB2 LYS 19 -1.733 -0.703 2.412 163 HB3 LYS 19 HB3 LYS 19 -0.181 -1.087 1.730 164 HG2 LYS 19 HG2 LYS 19 -0.835 -3.290 1.117 165 HG3 LYS 19 HG3 LYS 19 -2.219 -3.285 2.233 166 HD2 LYS 19 HD2 LYS 19 -3.353 -1.606 0.946 167 HD3 LYS 19 HD3 LYS 19 -2.037 -1.457 -0.204 168 HE2 LYS 19 HE2 LYS 19 -3.410 -4.095 0.309 169 HE3 LYS 19 HE3 LYS 19 -4.138 -2.937 -0.789 170 HZ1 LYS 19 HZ1 LYS 19 -1.366 -3.884 -1.253 171 HZ2 LYS 19 HZ2 LYS 19 -2.402 -3.228 -2.340 172 HZ3 LYS 19 HZ3 LYS 19 -2.657 -4.723 -1.707 173 H ILE 20 H ILE 20 0.288 0.391 4.798 174 HA ILE 20 HA ILE 20 2.957 0.322 3.968 175 HB ILE 20 HB ILE 20 1.995 1.641 6.543 176 HG12 ILE 20 HG12 ILE 20 0.446 2.445 4.962 177 HG13 ILE 20 HG13 ILE 20 1.628 3.702 5.201 178 HG21 ILE 20 HG21 ILE 20 3.763 3.330 6.005 179 HG22 ILE 20 HG22 ILE 20 4.398 1.721 6.339 180 HG23 ILE 20 HG23 ILE 20 4.299 2.299 4.657 181 HD11 ILE 20 HD11 ILE 20 1.045 3.465 2.819 182 HD12 ILE 20 HD12 ILE 20 2.754 3.086 3.132 183 HD13 ILE 20 HD13 ILE 20 1.585 1.772 2.832 184 H LYS 21 H LYS 21 1.427 -0.785 6.947 185 HA LYS 21 HA LYS 21 3.814 -1.692 8.299 186 HB2 LYS 21 HB2 LYS 21 1.018 -2.807 8.755 187 HB3 LYS 21 HB3 LYS 21 2.346 -2.652 9.901 188 HG2 LYS 21 HG2 LYS 21 2.049 -0.123 9.748 189 HG3 LYS 21 HG3 LYS 21 0.611 -0.406 8.779 190 HD2 LYS 21 HD2 LYS 21 0.994 -1.613 11.549 191 HD3 LYS 21 HD3 LYS 21 0.246 -0.030 11.293 192 HE2 LYS 21 HE2 LYS 21 -1.567 -0.956 10.011 193 HE3 LYS 21 HE3 LYS 21 -0.756 -2.526 9.883 194 HZ1 LYS 21 HZ1 LYS 21 -1.791 -1.409 12.417 195 HZ2 LYS 21 HZ2 LYS 21 -1.039 -2.868 12.174 196 HZ3 LYS 21 HZ3 LYS 21 -2.491 -2.597 11.489 197 H GLU 22 H GLU 22 1.672 -3.090 5.868 198 HA GLU 22 HA GLU 22 2.463 -5.816 6.504 199 HB2 GLU 22 HB2 GLU 22 1.031 -4.780 4.024 200 HB3 GLU 22 HB3 GLU 22 1.302 -6.471 4.473 201 HG2 GLU 22 HG2 GLU 22 0.136 -5.875 6.713 202 HG3 GLU 22 HG3 GLU 22 -0.401 -4.436 5.902 203 H ARG 23 H ARG 23 3.247 -3.510 3.774 204 HA ARG 23 HA ARG 23 5.108 -5.370 2.693 205 HB2 ARG 23 HB2 ARG 23 6.062 -3.489 1.428 206 HB3 ARG 23 HB3 ARG 23 4.336 -3.755 1.256 207 HG2 ARG 23 HG2 ARG 23 4.245 -1.510 1.396 208 HG3 ARG 23 HG3 ARG 23 4.208 -1.819 3.149 209 HD2 ARG 23 HD2 ARG 23 5.765 -0.044 2.485 210 HD3 ARG 23 HD3 ARG 23 6.555 -1.413 3.281 211 HE ARG 23 HE ARG 23 6.524 -1.509 0.328 212 HH11 ARG 23 HH11 ARG 23 8.404 -0.795 3.255 213 HH12 ARG 23 HH12 ARG 23 9.906 -1.272 2.563 214 HH21 ARG 23 HH21 ARG 23 8.577 -1.963 -0.672 215 HH22 ARG 23 HH22 ARG 23 10.002 -1.885 0.317 216 H ILE 24 H ILE 24 5.639 -2.969 5.275 217 HA ILE 24 HA ILE 24 8.498 -3.345 5.195 218 HB ILE 24 HB ILE 24 7.536 -1.319 6.081 219 HG12 ILE 24 HG12 ILE 24 9.088 -2.900 8.166 220 HG13 ILE 24 HG13 ILE 24 9.712 -1.791 6.940 221 HG21 ILE 24 HG21 ILE 24 6.127 -1.137 7.976 222 HG22 ILE 24 HG22 ILE 24 5.486 -2.502 7.089 223 HG23 ILE 24 HG23 ILE 24 6.467 -2.806 8.503 224 HD11 ILE 24 HD11 ILE 24 7.999 -1.148 9.346 225 HD12 ILE 24 HD12 ILE 24 9.684 -0.659 9.080 226 HD13 ILE 24 HD13 ILE 24 8.368 0.049 8.090 227 H GLN 25 H GLN 25 5.826 -4.802 7.175 228 HA GLN 25 HA GLN 25 7.733 -6.266 8.758 229 HB2 GLN 25 HB2 GLN 25 5.456 -5.476 9.496 230 HB3 GLN 25 HB3 GLN 25 4.732 -6.708 8.443 231 HG2 GLN 25 HG2 GLN 25 6.043 -8.443 9.765 232 HG3 GLN 25 HG3 GLN 25 6.529 -7.149 10.860 233 HE21 GLN 25 HE21 GLN 25 4.449 -5.773 11.789 234 HE22 GLN 25 HE22 GLN 25 3.112 -6.838 12.187 235 H ASN 26 H ASN 26 5.491 -7.183 6.117 236 HA ASN 26 HA ASN 26 6.311 -9.967 6.161 237 HB2 ASN 26 HB2 ASN 26 4.657 -8.443 4.093 238 HB3 ASN 26 HB3 ASN 26 4.861 -10.167 4.160 239 HD21 ASN 26 HD21 ASN 26 3.473 -7.478 5.878 240 HD22 ASN 26 HD22 ASN 26 2.290 -8.419 6.805 241 H SER 27 H SER 27 6.755 -7.262 3.825 242 HA SER 27 HA SER 27 8.054 -6.962 2.048 243 HB2 SER 27 HB2 SER 27 9.584 -6.945 4.206 244 HB3 SER 27 HB3 SER 27 10.339 -8.342 3.408 245 HG SER 27 HG SER 27 11.379 -6.513 2.643 246 H LEU 28 H LEU 28 6.534 -9.420 1.980 247 HA LEU 28 HA LEU 28 8.053 -10.910 -0.070 248 HB2 LEU 28 HB2 LEU 28 7.235 -13.032 0.923 249 HB3 LEU 28 HB3 LEU 28 8.269 -12.120 2.002 250 HG LEU 28 HG LEU 28 6.224 -11.284 3.159 251 HD11 LEU 28 HD11 LEU 28 4.866 -13.359 1.394 252 HD12 LEU 28 HD12 LEU 28 4.407 -11.668 1.662 253 HD13 LEU 28 HD13 LEU 28 4.188 -12.830 2.953 254 HD21 LEU 28 HD21 LEU 28 7.540 -12.920 4.202 255 HD22 LEU 28 HD22 LEU 28 6.906 -14.214 3.189 256 HD23 LEU 28 HD23 LEU 28 5.869 -13.438 4.410 257 H SER 29 H SER 29 6.444 -12.579 -0.956 258 HA SER 29 HA SER 29 3.813 -11.419 -1.756 259 HB2 SER 29 HB2 SER 29 6.041 -12.771 -3.339 260 HB3 SER 29 HB3 SER 29 4.455 -12.344 -3.995 261 HG SER 29 HG SER 29 6.380 -10.877 -4.268 262 H THR 30 H THR 30 5.919 -14.329 -1.517 263 HA THR 30 HA THR 30 3.601 -16.015 -0.921 264 HB THR 30 HB THR 30 3.639 -16.101 -3.294 265 HG1 THR 30 HG1 THR 30 3.369 -18.116 -2.381 266 HG21 THR 30 HG21 THR 30 6.625 -16.625 -3.095 267 HG22 THR 30 HG22 THR 30 5.812 -15.278 -3.922 268 HG23 THR 30 HG23 THR 30 5.675 -16.912 -4.573 269 H GLU 31 H GLU 31 6.321 -14.896 0.259 270 HA GLU 31 HA GLU 31 7.837 -15.608 1.771 271 HB2 GLU 31 HB2 GLU 31 6.539 -18.329 1.887 272 HB3 GLU 31 HB3 GLU 31 7.496 -17.527 3.110 273 HG2 GLU 31 HG2 GLU 31 5.743 -16.005 3.669 274 HG3 GLU 31 HG3 GLU 31 4.816 -16.358 2.211 275 H LYS 32 H LYS 32 8.672 -15.403 -0.656 276 HA LYS 32 HA LYS 32 10.003 -17.767 -1.773 277 HB2 LYS 32 HB2 LYS 32 9.226 -15.254 -2.749 278 HB3 LYS 32 HB3 LYS 32 10.910 -14.966 -2.415 279 HG2 LYS 32 HG2 LYS 32 10.922 -15.522 -4.630 280 HG3 LYS 32 HG3 LYS 32 11.298 -17.089 -3.939 281 HD2 LYS 32 HD2 LYS 32 8.515 -16.095 -4.775 282 HD3 LYS 32 HD3 LYS 32 9.550 -17.102 -5.782 283 HE2 LYS 32 HE2 LYS 32 8.486 -17.942 -3.052 284 HE3 LYS 32 HE3 LYS 32 7.710 -18.342 -4.580 285 HZ1 LYS 32 HZ1 LYS 32 10.500 -19.128 -4.018 286 HZ2 LYS 32 HZ2 LYS 32 9.469 -19.693 -5.197 287 HZ3 LYS 32 HZ3 LYS 32 9.228 -20.060 -3.625 288 H TYR 33 H TYR 33 12.508 -17.806 -1.908 289 HA TYR 33 HA TYR 33 13.808 -16.347 0.355 290 HB2 TYR 33 HB2 TYR 33 14.182 -19.284 -0.300 291 HB3 TYR 33 HB3 TYR 33 14.909 -18.393 1.027 292 HD1 TYR 33 HD1 TYR 33 13.464 -17.640 2.966 293 HD2 TYR 33 HD2 TYR 33 12.024 -20.295 -0.119 294 HE1 TYR 33 HE1 TYR 33 11.645 -18.404 4.455 295 HE2 TYR 33 HE2 TYR 33 10.203 -21.054 1.373 296 HH TYR 33 HH TYR 33 9.278 -20.892 3.481 297 H GLY 34 H GLY 34 16.108 -16.129 0.086 298 HA2 GLY 34 HA2 GLY 34 18.035 -17.016 -1.383 299 HA3 GLY 34 HA3 GLY 34 17.039 -16.468 -2.733 300 H SER 35 H SER 35 18.763 -15.397 0.189 301 HA SER 35 HA SER 35 19.044 -12.682 -0.986 302 HB2 SER 35 HB2 SER 35 17.460 -12.455 0.747 303 HB3 SER 35 HB3 SER 35 18.336 -13.550 1.829 304 HG SER 35 HG SER 35 19.791 -12.058 2.266 305 H GLY 36 H GLY 36 20.953 -11.642 -0.467 306 HA2 GLY 36 HA2 GLY 36 23.131 -11.383 0.334 307 HA3 GLY 36 HA3 GLY 36 23.192 -13.100 0.788 308 H SER 37 H SER 37 25.194 -11.694 -0.723 309 HA SER 37 HA SER 37 25.405 -13.497 -3.005 310 HB2 SER 37 HB2 SER 37 24.060 -11.506 -3.831 311 HB3 SER 37 HB3 SER 37 25.455 -10.477 -3.478 312 HG SER 37 HG SER 37 25.471 -12.755 -5.203 313 H GLY 38 H GLY 38 26.710 -10.528 -1.419 314 HA2 GLY 38 HA2 GLY 38 28.757 -10.104 -0.496 315 HA3 GLY 38 HA3 GLY 38 29.171 -11.826 -0.654 316 H SER 39 H SER 39 31.288 -10.686 -1.243 317 HA SER 39 HA SER 39 32.917 -10.163 -2.650 318 HB2 SER 39 HB2 SER 39 31.257 -11.413 -4.848 319 HB3 SER 39 HB3 SER 39 33.023 -11.316 -4.714 320 HG SER 39 HG SER 39 31.200 -12.951 -3.367 321 H GLY 40 H GLY 40 29.951 -8.561 -3.303 322 HA2 GLY 40 HA2 GLY 40 30.892 -6.929 -5.521 323 HA3 GLY 40 HA3 GLY 40 29.401 -6.727 -4.583 324 H SER 41 H SER 41 32.934 -6.640 -3.946 325 HA SER 41 HA SER 41 33.005 -4.935 -1.782 326 HB2 SER 41 HB2 SER 41 35.114 -5.241 -3.947 327 HB3 SER 41 HB3 SER 41 35.377 -4.820 -2.241 328 HG SER 41 HG SER 41 35.727 -7.073 -2.740 329 H GLY 42 H GLY 42 32.132 -3.866 -4.936 330 HA2 GLY 42 HA2 GLY 42 33.415 -1.288 -4.927 331 HA3 GLY 42 HA3 GLY 42 31.994 -1.753 -5.883 332 H SER 43 H SER 43 30.618 -2.569 -3.253 333 HA SER 43 HA SER 43 29.093 -1.756 -1.865 334 HB2 SER 43 HB2 SER 43 31.292 -1.143 -0.759 335 HB3 SER 43 HB3 SER 43 31.031 0.515 -1.326 336 HG SER 43 HG SER 43 28.943 0.341 -0.224 337 H GLY 44 H GLY 44 29.388 -0.187 -4.766 338 HA2 GLY 44 HA2 GLY 44 27.640 2.111 -4.149 339 HA3 GLY 44 HA3 GLY 44 28.450 1.742 -5.672 340 H SER 45 H SER 45 27.386 0.525 -7.203 341 HA SER 45 HA SER 45 25.712 -0.383 -8.344 342 HB2 SER 45 HB2 SER 45 26.448 -2.241 -6.838 343 HB3 SER 45 HB3 SER 45 25.066 -1.870 -5.786 344 HG SER 45 HG SER 45 23.718 -2.219 -7.557 345 H GLY 46 H GLY 46 24.953 2.090 -6.524 346 HA2 GLY 46 HA2 GLY 46 22.357 2.107 -5.683 347 HA3 GLY 46 HA3 GLY 46 23.160 3.473 -6.468 348 H SER 47 H SER 47 20.578 1.331 -6.650 349 HA SER 47 HA SER 47 20.007 2.029 -9.500 350 HB2 SER 47 HB2 SER 47 19.234 -0.518 -8.030 351 HB3 SER 47 HB3 SER 47 19.000 -0.164 -9.747 352 HG SER 47 HG SER 47 21.564 -0.289 -8.490 353 H GLY 48 H GLY 48 17.659 2.307 -9.909 354 HA2 GLY 48 HA2 GLY 48 15.538 1.982 -8.219 355 HA3 GLY 48 HA3 GLY 48 16.250 3.504 -7.674 356 H SER 49 H SER 49 15.518 5.260 -8.674 357 HA SER 49 HA SER 49 14.664 6.727 -10.135 358 HB2 SER 49 HB2 SER 49 15.290 4.872 -12.445 359 HB3 SER 49 HB3 SER 49 15.152 6.636 -12.437 360 HG SER 49 HG SER 49 16.999 6.423 -10.823 361 H GLY 50 H GLY 50 12.546 6.470 -9.206 362 HA2 GLY 50 HA2 GLY 50 10.602 5.216 -11.058 363 HA3 GLY 50 HA3 GLY 50 10.562 4.839 -9.328 364 H SER 51 H SER 51 8.407 6.088 -10.771 365 HA SER 51 HA SER 51 7.937 8.422 -9.123 366 HB2 SER 51 HB2 SER 51 8.298 8.658 -12.149 367 HB3 SER 51 HB3 SER 51 7.414 9.857 -11.188 368 HG SER 51 HG SER 51 9.827 9.189 -10.089 369 H GLY 52 H GLY 52 5.663 9.262 -9.533 370 HA2 GLY 52 HA2 GLY 52 3.790 7.558 -10.987 371 HA3 GLY 52 HA3 GLY 52 3.722 7.445 -9.218 372 H SER 53 H SER 53 1.766 8.519 -8.856 373 HA SER 53 HA SER 53 1.664 11.385 -9.688 374 HB2 SER 53 HB2 SER 53 -0.064 9.457 -10.572 375 HB3 SER 53 HB3 SER 53 -0.905 10.011 -9.109 376 HG SER 53 HG SER 53 -1.565 11.489 -10.462 377 H GLY 54 H GLY 54 1.596 9.140 -6.921 378 HA2 GLY 54 HA2 GLY 54 1.761 11.349 -5.123 379 HA3 GLY 54 HA3 GLY 54 0.136 10.639 -5.102 380 H SER 55 H SER 55 1.685 10.586 -2.854 381 HA SER 55 HA SER 55 2.326 7.690 -2.546 382 HB2 SER 55 HB2 SER 55 3.792 10.053 -1.301 383 HB3 SER 55 HB3 SER 55 4.117 8.340 -0.973 384 HG SER 55 HG SER 55 5.171 9.839 -2.815 385 H GLY 56 H GLY 56 1.985 6.902 -0.404 386 HA2 GLY 56 HA2 GLY 56 -0.490 7.454 0.736 387 HA3 GLY 56 HA3 GLY 56 0.809 6.563 1.549 388 H SER 57 H SER 57 -1.189 8.471 2.593 389 HA SER 57 HA SER 57 0.280 10.845 3.431 390 HB2 SER 57 HB2 SER 57 -2.548 9.833 3.937 391 HB3 SER 57 HB3 SER 57 -1.985 11.489 4.198 392 HG SER 57 HG SER 57 -3.060 11.189 2.169 393 H GLY 58 H GLY 58 -0.198 11.551 5.781 394 HA2 GLY 58 HA2 GLY 58 -0.208 11.213 8.039 395 HA3 GLY 58 HA3 GLY 58 -0.323 9.464 7.819 396 H TYR 59 H TYR 59 1.188 9.689 9.683 397 HA TYR 59 HA TYR 59 3.846 10.611 9.499 398 HB2 TYR 59 HB2 TYR 59 2.918 8.488 11.414 399 HB3 TYR 59 HB3 TYR 59 4.108 9.752 11.668 400 HD1 TYR 59 HD1 TYR 59 2.776 12.258 10.991 401 HD2 TYR 59 HD2 TYR 59 1.155 8.742 12.915 402 HE1 TYR 59 HE1 TYR 59 0.979 13.621 11.950 403 HE2 TYR 59 HE2 TYR 59 -0.655 10.109 13.884 404 HH TYR 59 HH TYR 59 -1.069 13.562 13.060 405 H GLN3288 H GLN3288 3.399 8.840 7.212 406 HA GLN3288 HA GLN3288 4.982 6.411 7.804 407 HB2 GLN3288 HB2 GLN3288 4.510 5.775 5.520 408 HB3 GLN3288 HB3 GLN3288 3.036 6.174 6.373 409 HG2 GLN3288 HG2 GLN3288 2.820 8.280 5.186 410 HG3 GLN3288 HG3 GLN3288 4.432 8.100 4.468 411 HE21 GLN3288 HE21 GLN3288 4.335 7.401 2.359 412 HE22 GLN3288 HE22 GLN3288 3.247 6.141 1.808 413 H ILE3289 H ILE3289 6.843 6.072 5.995 414 HA ILE3289 HA ILE3289 8.551 8.477 6.168 415 HB ILE3289 HB ILE3289 9.425 5.628 5.669 416 HG12 ILE3289 HG12 ILE3289 9.569 7.097 8.337 417 HG13 ILE3289 HG13 ILE3289 8.294 5.943 7.974 418 HG21 ILE3289 HG21 ILE3289 10.959 7.453 4.931 419 HG22 ILE3289 HG22 ILE3289 10.880 8.179 6.548 420 HG23 ILE3289 HG23 ILE3289 11.637 6.596 6.306 421 HD11 ILE3289 HD11 ILE3289 10.046 4.861 9.240 422 HD12 ILE3289 HD12 ILE3289 9.898 4.142 7.630 423 HD13 ILE3289 HD13 ILE3289 11.244 5.240 8.002 424 H GLU3290 H GLU3290 7.932 9.640 4.468 425 HA GLU3290 HA GLU3290 7.283 8.798 1.876 426 HB2 GLU3290 HB2 GLU3290 6.732 10.864 3.217 427 HB3 GLU3290 HB3 GLU3290 8.338 11.489 2.836 428 HG2 GLU3290 HG2 GLU3290 7.775 11.929 0.630 429 HG3 GLU3290 HG3 GLU3290 6.670 10.555 0.519 430 H THR3291 H THR3291 10.340 8.836 3.294 431 HA THR3291 HA THR3291 11.696 8.894 0.658 432 HB THR3291 HB THR3291 11.867 11.011 1.962 433 HG1 THR3291 HG1 THR3291 13.358 10.447 0.373 434 HG21 THR3291 HG21 THR3291 12.056 10.182 4.235 435 HG22 THR3291 HG22 THR3291 13.483 11.141 3.827 436 HG23 THR3291 HG23 THR3291 13.601 9.382 3.859 437 H PHE3292 H PHE3292 10.667 6.608 1.984 438 HA PHE3292 HA PHE3292 13.191 5.062 2.111 439 HB2 PHE3292 HB2 PHE3292 12.649 5.667 4.407 440 HB3 PHE3292 HB3 PHE3292 11.028 4.993 4.219 441 HD1 PHE3292 HD1 PHE3292 14.435 3.599 3.302 442 HD2 PHE3292 HD2 PHE3292 10.881 3.178 5.676 443 HE1 PHE3292 HE1 PHE3292 15.137 1.307 3.962 444 HE2 PHE3292 HE2 PHE3292 11.563 0.871 6.308 445 HZ PHE3292 HZ PHE3292 13.687 -0.068 5.419 446 H PHE3293 H PHE3293 9.571 4.971 1.934 447 HA PHE3293 HA PHE3293 9.881 2.676 0.075 448 HB2 PHE3293 HB2 PHE3293 7.693 1.758 1.263 449 HB3 PHE3293 HB3 PHE3293 9.274 1.368 1.837 450 HD1 PHE3293 HD1 PHE3293 9.441 1.414 4.206 451 HD2 PHE3293 HD2 PHE3293 6.875 4.271 2.237 452 HE1 PHE3293 HE1 PHE3293 8.757 2.334 6.402 453 HE2 PHE3293 HE2 PHE3293 6.247 5.198 4.356 454 HZ PHE3293 HZ PHE3293 7.093 4.169 6.531 455 H ALA3294 H ALA3294 8.998 5.760 0.130 456 HA ALA3294 HA ALA3294 6.335 5.884 -0.749 457 HB1 ALA3294 HB1 ALA3294 7.758 7.783 -0.178 458 HB2 ALA3294 HB2 ALA3294 8.561 7.616 -1.769 459 HB3 ALA3294 HB3 ALA3294 6.838 7.984 -1.671 460 H GLN3295 H GLN3295 9.232 4.923 -2.436 461 HA GLN3295 HA GLN3295 8.318 4.997 -5.137 462 HB2 GLN3295 HB2 GLN3295 10.281 3.051 -3.859 463 HB3 GLN3295 HB3 GLN3295 10.150 3.408 -5.581 464 HG2 GLN3295 HG2 GLN3295 10.866 5.530 -3.499 465 HG3 GLN3295 HG3 GLN3295 12.035 4.521 -4.320 466 HE21 GLN3295 HE21 GLN3295 9.372 6.941 -5.090 467 HE22 GLN3295 HE22 GLN3295 10.218 7.484 -6.522 468 H ASP3296 H ASP3296 7.961 2.467 -2.656 469 HA ASP3296 HA ASP3296 6.499 0.693 -4.525 470 HB2 ASP3296 HB2 ASP3296 7.238 0.606 -1.537 471 HB3 ASP3296 HB3 ASP3296 5.984 -0.448 -2.162 472 H ILE3297 H ILE3297 5.915 2.805 -1.797 473 HA ILE3297 HA ILE3297 3.234 2.206 -1.283 474 HB ILE3297 HB ILE3297 5.205 4.239 -0.600 475 HG12 ILE3297 HG12 ILE3297 4.063 4.247 1.553 476 HG13 ILE3297 HG13 ILE3297 2.786 3.250 0.871 477 HG21 ILE3297 HG21 ILE3297 3.807 6.098 0.014 478 HG22 ILE3297 HG22 ILE3297 3.804 5.841 -1.722 479 HG23 ILE3297 HG23 ILE3297 2.402 5.286 -0.770 480 HD11 ILE3297 HD11 ILE3297 4.362 1.843 2.121 481 HD12 ILE3297 HD12 ILE3297 4.603 1.481 0.400 482 HD13 ILE3297 HD13 ILE3297 5.714 2.556 1.247 483 H GLU3298 H GLU3298 4.550 4.483 -3.688 484 HA GLU3298 HA GLU3298 2.099 5.648 -4.494 485 HB2 GLU3298 HB2 GLU3298 3.447 6.598 -6.236 486 HB3 GLU3298 HB3 GLU3298 4.441 6.452 -4.816 487 HG2 GLU3298 HG2 GLU3298 5.928 5.585 -6.395 488 HG3 GLU3298 HG3 GLU3298 5.138 4.152 -5.827 489 H SER3299 H SER3299 3.824 2.779 -5.459 490 HA SER3299 HA SER3299 2.237 2.053 -7.740 491 HB2 SER3299 HB2 SER3299 4.485 1.279 -7.584 492 HB3 SER3299 HB3 SER3299 4.226 0.558 -6.006 493 HG SER3299 HG SER3299 2.996 -1.073 -6.925 494 H VAL3300 H VAL3300 2.305 1.018 -4.356 495 HA VAL3300 HA VAL3300 0.152 -0.872 -4.544 496 HB VAL3300 HB VAL3300 1.424 0.648 -2.234 497 HG11 VAL3300 HG11 VAL3300 0.385 -1.145 -0.781 498 HG12 VAL3300 HG12 VAL3300 -0.761 0.015 -1.473 499 HG13 VAL3300 HG13 VAL3300 -0.599 -1.602 -2.189 500 HG21 VAL3300 HG21 VAL3300 1.780 -2.242 -3.108 501 HG22 VAL3300 HG22 VAL3300 2.938 -0.956 -3.411 502 HG23 VAL3300 HG23 VAL3300 2.600 -1.450 -1.752 503 H GLN3301 H GLN3301 0.263 2.558 -3.381 504 HA GLN3301 HA GLN3301 -2.533 2.616 -2.869 505 HB2 GLN3301 HB2 GLN3301 -2.328 4.857 -2.383 506 HB3 GLN3301 HB3 GLN3301 -0.898 4.053 -1.787 507 HG2 GLN3301 HG2 GLN3301 0.360 5.583 -2.837 508 HG3 GLN3301 HG3 GLN3301 -0.214 4.953 -4.393 509 HE21 GLN3301 HE21 GLN3301 -2.617 5.821 -4.924 510 HE22 GLN3301 HE22 GLN3301 -2.578 7.526 -4.875 511 H LYS3302 H LYS3302 -0.714 3.115 -5.854 512 HA LYS3302 HA LYS3302 -2.684 4.442 -7.376 513 HB2 LYS3302 HB2 LYS3302 -0.282 2.794 -7.919 514 HB3 LYS3302 HB3 LYS3302 -1.496 2.796 -9.196 515 HG2 LYS3302 HG2 LYS3302 -1.441 5.182 -9.412 516 HG3 LYS3302 HG3 LYS3302 -0.414 5.333 -7.982 517 HD2 LYS3302 HD2 LYS3302 0.870 5.581 -10.096 518 HD3 LYS3302 HD3 LYS3302 1.418 4.200 -9.117 519 HE2 LYS3302 HE2 LYS3302 0.310 2.621 -10.537 520 HE3 LYS3302 HE3 LYS3302 -0.503 3.891 -11.457 521 HZ1 LYS3302 HZ1 LYS3302 2.411 3.947 -11.411 522 HZ2 LYS3302 HZ2 LYS3302 1.367 4.317 -12.622 523 HZ3 LYS3302 HZ3 LYS3302 1.689 2.746 -12.274 524 H GLU3303 H GLU3303 -2.473 1.126 -6.249 525 HA GLU3303 HA GLU3303 -4.485 0.177 -8.155 526 HB2 GLU3303 HB2 GLU3303 -3.957 -1.878 -7.569 527 HB3 GLU3303 HB3 GLU3303 -2.511 -1.098 -6.958 528 HG2 GLU3303 HG2 GLU3303 -3.846 -0.985 -4.698 529 HG3 GLU3303 HG3 GLU3303 -4.876 -2.188 -5.460 530 H LEU3304 H LEU3304 -4.442 1.139 -4.738 531 HA LEU3304 HA LEU3304 -7.125 0.518 -4.209 532 HB2 LEU3304 HB2 LEU3304 -5.276 2.552 -2.890 533 HB3 LEU3304 HB3 LEU3304 -6.735 1.874 -2.192 534 HG LEU3304 HG LEU3304 -4.231 0.308 -2.949 535 HD11 LEU3304 HD11 LEU3304 -5.248 1.232 -0.287 536 HD12 LEU3304 HD12 LEU3304 -3.738 1.661 -1.151 537 HD13 LEU3304 HD13 LEU3304 -3.947 0.033 -0.519 538 HD21 LEU3304 HD21 LEU3304 -6.220 -1.132 -3.111 539 HD22 LEU3304 HD22 LEU3304 -6.657 -0.708 -1.440 540 HD23 LEU3304 HD23 LEU3304 -5.172 -1.610 -1.806 541 H GLU3305 H GLU3305 -5.731 3.499 -5.487 542 HA GLU3305 HA GLU3305 -8.019 5.164 -5.031 543 HB2 GLU3305 HB2 GLU3305 -6.985 6.646 -6.801 544 HB3 GLU3305 HB3 GLU3305 -5.879 6.189 -5.498 545 HG2 GLU3305 HG2 GLU3305 -4.969 4.387 -6.838 546 HG3 GLU3305 HG3 GLU3305 -6.050 4.766 -8.183 547 H ASN3306 H ASN3306 -7.736 2.517 -7.114 548 HA ASN3306 HA ASN3306 -10.028 3.486 -8.739 549 HB2 ASN3306 HB2 ASN3306 -9.362 2.266 -10.610 550 HB3 ASN3306 HB3 ASN3306 -7.975 3.238 -10.144 551 HD21 ASN3306 HD21 ASN3306 -6.028 2.136 -9.513 552 HD22 ASN3306 HD22 ASN3306 -5.883 0.423 -9.772 553 H LEU3307 H LEU3307 -9.182 1.418 -6.216 554 HA LEU3307 HA LEU3307 -10.893 -0.792 -7.143 555 HB2 LEU3307 HB2 LEU3307 -9.085 -0.287 -4.825 556 HB3 LEU3307 HB3 LEU3307 -10.548 -1.124 -4.410 557 HG LEU3307 HG LEU3307 -9.459 -2.968 -4.771 558 HD11 LEU3307 HD11 LEU3307 -10.862 -2.969 -6.827 559 HD12 LEU3307 HD12 LEU3307 -9.416 -3.971 -6.952 560 HD13 LEU3307 HD13 LEU3307 -9.457 -2.367 -7.731 561 HD21 LEU3307 HD21 LEU3307 -7.381 -3.348 -5.755 562 HD22 LEU3307 HD22 LEU3307 -7.304 -1.864 -4.814 563 HD23 LEU3307 HD23 LEU3307 -7.417 -1.776 -6.590 564 H SER3308 H SER3308 -12.814 -1.500 -6.092 565 HA SER3308 HA SER3308 -14.686 0.635 -5.470 566 HB2 SER3308 HB2 SER3308 -14.976 -2.397 -5.709 567 HB3 SER3308 HB3 SER3308 -16.307 -1.226 -5.584 568 HG SER3308 HG SER3308 -14.371 -1.416 -7.667 569 H GLU3309 H GLU3309 -16.420 0.036 -3.539 570 HA GLU3309 HA GLU3309 -14.863 0.100 -1.128 571 HB2 GLU3309 HB2 GLU3309 -17.839 -0.163 -1.786 572 HB3 GLU3309 HB3 GLU3309 -17.287 -0.628 -0.181 573 HG2 GLU3309 HG2 GLU3309 -16.092 1.716 -0.226 574 HG3 GLU3309 HG3 GLU3309 -17.351 2.061 -1.437 575 H GLU3310 H GLU3310 -16.969 -2.431 -2.529 576 HA GLU3310 HA GLU3310 -16.598 -4.384 -0.656 577 HB2 GLU3310 HB2 GLU3310 -16.580 -4.990 -3.630 578 HB3 GLU3310 HB3 GLU3310 -17.240 -5.980 -2.323 579 HG2 GLU3310 HG2 GLU3310 -18.298 -3.327 -3.359 580 HG3 GLU3310 HG3 GLU3310 -19.043 -4.876 -3.584 581 H GLU3311 H GLU3311 -14.121 -3.157 -2.804 582 HA GLU3311 HA GLU3311 -12.409 -5.550 -2.523 583 HB2 GLU3311 HB2 GLU3311 -11.979 -2.798 -3.709 584 HB3 GLU3311 HB3 GLU3311 -10.831 -4.114 -3.754 585 HG2 GLU3311 HG2 GLU3311 -13.523 -4.760 -4.893 586 HG3 GLU3311 HG3 GLU3311 -12.682 -3.471 -5.707 587 H LEU3312 H LEU3312 -12.470 -2.095 -1.647 588 HA LEU3312 HA LEU3312 -10.101 -2.249 0.024 589 HB2 LEU3312 HB2 LEU3312 -12.054 0.047 0.050 590 HB3 LEU3312 HB3 LEU3312 -10.389 0.112 0.430 591 HG LEU3312 HG LEU3312 -11.129 -0.684 -2.377 592 HD11 LEU3312 HD11 LEU3312 -12.600 1.071 -2.002 593 HD12 LEU3312 HD12 LEU3312 -11.275 1.662 -2.998 594 HD13 LEU3312 HD13 LEU3312 -11.323 2.117 -1.279 595 HD21 LEU3312 HD21 LEU3312 -9.068 0.684 -2.829 596 HD22 LEU3312 HD22 LEU3312 -8.860 -0.850 -1.972 597 HD23 LEU3312 HD23 LEU3312 -8.781 0.677 -1.079 598 H LEU3313 H LEU3313 -13.501 -1.492 0.673 599 HA LEU3313 HA LEU3313 -13.487 -1.158 3.427 600 HB2 LEU3313 HB2 LEU3313 -15.312 -0.446 1.893 601 HB3 LEU3313 HB3 LEU3313 -15.661 -2.138 1.528 602 HG LEU3313 HG LEU3313 -17.256 -1.115 3.049 603 HD11 LEU3313 HD11 LEU3313 -17.156 -3.536 2.694 604 HD12 LEU3313 HD12 LEU3313 -17.702 -3.076 4.316 605 HD13 LEU3313 HD13 LEU3313 -16.080 -3.704 4.092 606 HD21 LEU3313 HD21 LEU3313 -16.912 -1.063 5.397 607 HD22 LEU3313 HD22 LEU3313 -15.736 0.006 4.649 608 HD23 LEU3313 HD23 LEU3313 -15.229 -1.600 5.241 609 H ALA3314 H ALA3314 -13.806 -4.122 1.378 610 HA ALA3314 HA ALA3314 -14.292 -5.798 3.573 611 HB1 ALA3314 HB1 ALA3314 -14.747 -6.508 1.313 612 HB2 ALA3314 HB2 ALA3314 -13.034 -6.335 0.839 613 HB3 ALA3314 HB3 ALA3314 -13.529 -7.608 1.975 614 H MET3315 H MET3315 -11.258 -4.495 2.405 615 HA MET3315 HA MET3315 -9.540 -6.429 3.754 616 HB2 MET3315 HB2 MET3315 -8.694 -3.656 2.830 617 HB3 MET3315 HB3 MET3315 -7.681 -5.069 3.079 618 HG2 MET3315 HG2 MET3315 -9.828 -5.583 1.189 619 HG3 MET3315 HG3 MET3315 -8.939 -4.167 0.714 620 HE1 MET3315 HE1 MET3315 -6.662 -4.137 -0.323 621 HE2 MET3315 HE2 MET3315 -5.897 -4.655 1.208 622 HE3 MET3315 HE3 MET3315 -5.507 -5.465 -0.324 623 H LEU3316 H LEU3316 -10.351 -2.996 4.284 624 HA LEU3316 HA LEU3316 -8.982 -2.815 6.817 625 HB2 LEU3316 HB2 LEU3316 -10.247 -0.713 7.147 626 HB3 LEU3316 HB3 LEU3316 -9.339 -0.823 5.647 627 HG LEU3316 HG LEU3316 -11.723 -1.710 4.722 628 HD11 LEU3316 HD11 LEU3316 -13.524 -0.198 5.713 629 HD12 LEU3316 HD12 LEU3316 -12.441 0.161 7.051 630 HD13 LEU3316 HD13 LEU3316 -13.041 -1.490 6.802 631 HD21 LEU3316 HD21 LEU3316 -11.524 1.273 5.093 632 HD22 LEU3316 HD22 LEU3316 -11.941 0.314 3.656 633 HD23 LEU3316 HD23 LEU3316 -10.283 0.410 4.157 634 H ASN3317 H ASN3317 -12.309 -3.784 5.880 635 HA ASN3317 HA ASN3317 -13.107 -3.842 8.695 636 HB2 ASN3317 HB2 ASN3317 -14.635 -3.459 6.518 637 HB3 ASN3317 HB3 ASN3317 -14.781 -5.214 6.607 638 HD21 ASN3317 HD21 ASN3317 -14.736 -2.337 8.810 639 HD22 ASN3317 HD22 ASN3317 -16.078 -2.896 9.785 640 H GLY3318 H GLY3318 -11.670 -5.937 6.418 641 HA2 GLY3318 HA2 GLY3318 -10.794 -8.083 6.593 642 HA3 GLY3318 HA3 GLY3318 -10.884 -7.901 8.362 643 H ASP3319 H ASP3319 -13.253 -7.934 5.716 644 HA ASP3319 HA ASP3319 -15.074 -9.649 7.278 645 HB2 ASP3319 HB2 ASP3319 -16.816 -8.908 5.897 646 HB3 ASP3319 HB3 ASP3319 -15.898 -7.511 6.401 647 H GLN3320 H GLN3320 -16.521 -10.784 5.286 648 HA GLN3320 HA GLN3320 -14.735 -12.684 3.899 649 HB2 GLN3320 HB2 GLN3320 -16.254 -14.508 4.661 650 HB3 GLN3320 HB3 GLN3320 -15.416 -13.727 5.986 651 HG2 GLN3320 HG2 GLN3320 -18.288 -13.041 5.199 652 HG3 GLN3320 HG3 GLN3320 -17.866 -14.227 6.421 653 HE21 GLN3320 HE21 GLN3320 -16.166 -13.339 8.098 654 HE22 GLN3320 HE22 GLN3320 -16.454 -11.731 8.732 655 H GLN3321 H GLN3321 -16.195 -10.363 2.924 656 HA GLN3321 HA GLN3321 -18.390 -11.556 1.332 657 HB2 GLN3321 HB2 GLN3321 -17.320 -8.744 1.686 658 HB3 GLN3321 HB3 GLN3321 -18.412 -9.141 0.361 659 HG2 GLN3321 HG2 GLN3321 -20.238 -9.504 1.719 660 HG3 GLN3321 HG3 GLN3321 -19.277 -10.112 3.064 661 HE21 GLN3321 HE21 GLN3321 -18.430 -8.749 4.468 662 HE22 GLN3321 HE22 GLN3321 -18.165 -7.100 4.166 Start of MODEL 14 1 H1 MET 1 H MET 1 -20.946 11.620 0.220 2 HA MET 1 HA MET 1 -22.821 9.699 1.431 3 HB2 MET 1 HB2 MET 1 -22.721 11.894 2.551 4 HB3 MET 1 HB3 MET 1 -23.189 12.679 1.036 5 HG2 MET 1 HG2 MET 1 -25.071 12.487 2.529 6 HG3 MET 1 HG3 MET 1 -25.359 11.515 1.100 7 HE1 MET 1 HE1 MET 1 -27.401 10.386 2.380 8 HE2 MET 1 HE2 MET 1 -27.268 9.681 4.010 9 HE3 MET 1 HE3 MET 1 -27.034 11.427 3.776 10 H ASN 2 H ASN 2 -22.101 11.369 -1.730 11 HA ASN 2 HA ASN 2 -24.487 9.914 -2.804 12 HB2 ASN 2 HB2 ASN 2 -23.602 12.720 -3.540 13 HB3 ASN 2 HB3 ASN 2 -24.956 11.834 -4.216 14 HD21 ASN 2 HD21 ASN 2 -27.011 12.078 -3.172 15 HD22 ASN 2 HD22 ASN 2 -27.140 12.784 -1.563 16 H ILE 3 H ILE 3 -21.764 8.859 -2.850 17 HA ILE 3 HA ILE 3 -21.472 8.446 -5.694 18 HB ILE 3 HB ILE 3 -20.480 10.689 -5.494 19 HG12 ILE 3 HG12 ILE 3 -18.168 8.810 -5.895 20 HG13 ILE 3 HG13 ILE 3 -19.583 8.778 -6.957 21 HG21 ILE 3 HG21 ILE 3 -18.449 9.564 -3.531 22 HG22 ILE 3 HG22 ILE 3 -18.552 11.227 -4.171 23 HG23 ILE 3 HG23 ILE 3 -19.794 10.632 -3.100 24 HD11 ILE 3 HD11 ILE 3 -17.827 10.184 -7.869 25 HD12 ILE 3 HD12 ILE 3 -19.322 11.090 -7.540 26 HD13 ILE 3 HD13 ILE 3 -17.948 11.236 -6.435 27 H ASN 4 H ASN 4 -19.745 6.924 -6.171 28 HA ASN 4 HA ASN 4 -18.963 5.264 -3.837 29 HB2 ASN 4 HB2 ASN 4 -18.938 3.326 -5.369 30 HB3 ASN 4 HB3 ASN 4 -20.533 3.974 -5.009 31 HD21 ASN 4 HD21 ASN 4 -18.017 3.744 -7.620 32 HD22 ASN 4 HD22 ASN 4 -19.085 4.496 -8.793 33 H GLU 5 H GLU 5 -17.833 6.273 -7.120 34 HA GLU 5 HA GLU 5 -15.226 5.269 -6.851 35 HB2 GLU 5 HB2 GLU 5 -16.281 7.668 -8.377 36 HB3 GLU 5 HB3 GLU 5 -14.580 7.180 -8.430 37 HG2 GLU 5 HG2 GLU 5 -15.150 4.950 -9.189 38 HG3 GLU 5 HG3 GLU 5 -16.864 5.286 -9.076 39 H GLN 6 H GLN 6 -16.445 8.362 -5.812 40 HA GLN 6 HA GLN 6 -13.853 9.205 -4.706 41 HB2 GLN 6 HB2 GLN 6 -16.572 10.475 -4.846 42 HB3 GLN 6 HB3 GLN 6 -15.468 11.001 -3.585 43 HG2 GLN 6 HG2 GLN 6 -14.947 12.461 -5.227 44 HG3 GLN 6 HG3 GLN 6 -13.697 11.242 -5.445 45 HE21 GLN 6 HE21 GLN 6 -14.117 9.589 -7.360 46 HE22 GLN 6 HE22 GLN 6 -15.123 10.172 -8.670 47 H THR 7 H THR 7 -16.476 7.273 -3.560 48 HA THR 7 HA THR 7 -15.877 7.784 -0.701 49 HB THR 7 HB THR 7 -17.491 5.623 -2.062 50 HG1 THR 7 HG1 THR 7 -18.874 7.204 -1.996 51 HG21 THR 7 HG21 THR 7 -18.305 5.114 0.275 52 HG22 THR 7 HG22 THR 7 -16.888 6.057 0.856 53 HG23 THR 7 HG23 THR 7 -16.673 4.614 -0.132 54 H LEU 8 H LEU 8 -14.779 5.530 -3.301 55 HA LEU 8 HA LEU 8 -13.531 3.504 -1.860 56 HB2 LEU 8 HB2 LEU 8 -12.221 4.921 -4.212 57 HB3 LEU 8 HB3 LEU 8 -12.073 3.243 -3.709 58 HG LEU 8 HG LEU 8 -14.513 4.566 -4.944 59 HD11 LEU 8 HD11 LEU 8 -12.828 2.347 -6.077 60 HD12 LEU 8 HD12 LEU 8 -12.792 4.065 -6.568 61 HD13 LEU 8 HD13 LEU 8 -14.242 3.088 -6.826 62 HD21 LEU 8 HD21 LEU 8 -15.490 2.254 -4.997 63 HD22 LEU 8 HD22 LEU 8 -15.365 3.025 -3.420 64 HD23 LEU 8 HD23 LEU 8 -14.181 1.768 -3.885 65 H ASP 9 H ASP 9 -12.581 6.896 -2.342 66 HA ASP 9 HA ASP 9 -9.901 6.961 -1.575 67 HB2 ASP 9 HB2 ASP 9 -12.172 8.831 -1.065 68 HB3 ASP 9 HB3 ASP 9 -10.618 9.175 -0.330 69 H LYS 10 H LYS 10 -12.816 7.057 0.613 70 HA LYS 10 HA LYS 10 -11.153 7.122 2.975 71 HB2 LYS 10 HB2 LYS 10 -12.982 7.029 4.277 72 HB3 LYS 10 HB3 LYS 10 -13.542 7.894 2.855 73 HG2 LYS 10 HG2 LYS 10 -14.589 5.819 2.058 74 HG3 LYS 10 HG3 LYS 10 -14.040 4.942 3.481 75 HD2 LYS 10 HD2 LYS 10 -16.006 7.253 3.414 76 HD3 LYS 10 HD3 LYS 10 -16.376 5.525 3.463 77 HE2 LYS 10 HE2 LYS 10 -16.578 6.082 5.702 78 HE3 LYS 10 HE3 LYS 10 -14.943 5.387 5.587 79 HZ1 LYS 10 HZ1 LYS 10 -15.399 8.336 5.489 80 HZ2 LYS 10 HZ2 LYS 10 -14.013 7.526 5.840 81 HZ3 LYS 10 HZ3 LYS 10 -15.211 7.513 6.900 82 H LEU 11 H LEU 11 -12.213 4.539 0.921 83 HA LEU 11 HA LEU 11 -11.721 2.428 2.896 84 HB2 LEU 11 HB2 LEU 11 -12.318 2.344 -0.111 85 HB3 LEU 11 HB3 LEU 11 -11.935 0.963 0.927 86 HG LEU 11 HG LEU 11 -14.193 0.928 0.596 87 HD11 LEU 11 HD11 LEU 11 -13.757 0.413 2.885 88 HD12 LEU 11 HD12 LEU 11 -15.274 1.278 2.773 89 HD13 LEU 11 HD13 LEU 11 -13.859 2.145 3.373 90 HD21 LEU 11 HD21 LEU 11 -14.502 3.785 1.490 91 HD22 LEU 11 HD22 LEU 11 -15.778 2.687 0.963 92 HD23 LEU 11 HD23 LEU 11 -14.585 3.222 -0.180 93 H ARG 12 H ARG 12 -10.079 3.477 -0.177 94 HA ARG 12 HA ARG 12 -7.833 1.764 0.113 95 HB2 ARG 12 HB2 ARG 12 -6.713 3.294 -1.498 96 HB3 ARG 12 HB3 ARG 12 -8.274 2.722 -1.986 97 HG2 ARG 12 HG2 ARG 12 -9.295 4.828 -1.649 98 HG3 ARG 12 HG3 ARG 12 -7.969 5.429 -0.635 99 HD2 ARG 12 HD2 ARG 12 -6.629 5.048 -2.869 100 HD3 ARG 12 HD3 ARG 12 -8.317 5.136 -3.534 101 HE ARG 12 HE ARG 12 -8.201 7.325 -3.402 102 HH11 ARG 12 HH11 ARG 12 -5.613 6.109 -1.291 103 HH12 ARG 12 HH12 ARG 12 -5.245 7.706 -0.665 104 HH21 ARG 12 HH21 ARG 12 -7.637 9.394 -2.508 105 HH22 ARG 12 HH22 ARG 12 -6.271 9.534 -1.436 106 H GLN 13 H GLN 13 -8.269 5.082 1.307 107 HA GLN 13 HA GLN 13 -5.683 5.346 2.298 108 HB2 GLN 13 HB2 GLN 13 -6.430 7.232 3.586 109 HB3 GLN 13 HB3 GLN 13 -7.200 7.179 1.995 110 HG2 GLN 13 HG2 GLN 13 -9.010 7.716 3.241 111 HG3 GLN 13 HG3 GLN 13 -9.108 5.953 3.238 112 HE21 GLN 13 HE21 GLN 13 -9.835 5.231 5.092 113 HE22 GLN 13 HE22 GLN 13 -9.393 5.747 6.697 114 H ALA 14 H ALA 14 -8.424 3.549 3.632 115 HA ALA 14 HA ALA 14 -7.363 3.274 6.335 116 HB1 ALA 14 HB1 ALA 14 -9.798 3.098 5.889 117 HB2 ALA 14 HB2 ALA 14 -9.509 1.740 4.802 118 HB3 ALA 14 HB3 ALA 14 -9.176 1.568 6.527 119 H VAL 15 H VAL 15 -7.619 1.272 3.384 120 HA VAL 15 HA VAL 15 -6.272 -1.013 4.413 121 HB VAL 15 HB VAL 15 -6.446 -0.059 1.524 122 HG11 VAL 15 HG11 VAL 15 -5.997 -2.873 2.591 123 HG12 VAL 15 HG12 VAL 15 -6.185 -2.412 0.894 124 HG13 VAL 15 HG13 VAL 15 -4.771 -1.862 1.802 125 HG21 VAL 15 HG21 VAL 15 -8.343 -1.786 1.436 126 HG22 VAL 15 HG22 VAL 15 -8.434 -1.671 3.189 127 HG23 VAL 15 HG23 VAL 15 -8.718 -0.258 2.162 128 H LEU 16 H LEU 16 -5.015 1.670 2.407 129 HA LEU 16 HA LEU 16 -2.346 0.897 2.354 130 HB2 LEU 16 HB2 LEU 16 -1.809 2.876 1.386 131 HB3 LEU 16 HB3 LEU 16 -3.519 2.689 1.029 132 HG LEU 16 HG LEU 16 -3.961 4.313 2.940 133 HD11 LEU 16 HD11 LEU 16 -0.988 4.730 2.545 134 HD12 LEU 16 HD12 LEU 16 -1.879 4.587 4.055 135 HD13 LEU 16 HD13 LEU 16 -2.055 6.047 3.084 136 HD21 LEU 16 HD21 LEU 16 -3.655 6.200 1.332 137 HD22 LEU 16 HD22 LEU 16 -4.263 4.769 0.488 138 HD23 LEU 16 HD23 LEU 16 -2.553 5.205 0.369 139 H GLN 17 H GLN 17 -3.979 2.637 5.017 140 HA GLN 17 HA GLN 17 -1.624 3.470 6.361 141 HB2 GLN 17 HB2 GLN 17 -4.450 2.814 7.202 142 HB3 GLN 17 HB3 GLN 17 -3.221 3.017 8.445 143 HG2 GLN 17 HG2 GLN 17 -2.707 5.266 7.679 144 HG3 GLN 17 HG3 GLN 17 -3.770 5.098 6.288 145 HE21 GLN 17 HE21 GLN 17 -5.956 5.481 6.616 146 HE22 GLN 17 HE22 GLN 17 -6.550 6.082 8.171 147 H LYS 18 H LYS 18 -3.433 0.314 6.646 148 HA LYS 18 HA LYS 18 -1.441 -0.606 8.535 149 HB2 LYS 18 HB2 LYS 18 -2.498 -2.651 8.611 150 HB3 LYS 18 HB3 LYS 18 -3.767 -1.451 8.431 151 HG2 LYS 18 HG2 LYS 18 -3.028 -2.336 5.791 152 HG3 LYS 18 HG3 LYS 18 -3.124 -3.755 6.787 153 HD2 LYS 18 HD2 LYS 18 -5.448 -1.714 6.579 154 HD3 LYS 18 HD3 LYS 18 -5.059 -2.976 5.477 155 HE2 LYS 18 HE2 LYS 18 -6.727 -3.742 7.106 156 HE3 LYS 18 HE3 LYS 18 -5.244 -4.666 7.251 157 HZ1 LYS 18 HZ1 LYS 18 -6.281 -3.989 9.368 158 HZ2 LYS 18 HZ2 LYS 18 -5.885 -2.415 9.078 159 HZ3 LYS 18 HZ3 LYS 18 -4.712 -3.559 9.246 160 H LYS 19 H LYS 19 -1.687 -0.744 5.004 161 HA LYS 19 HA LYS 19 0.266 -2.726 4.524 162 HB2 LYS 19 HB2 LYS 19 -0.459 -0.255 2.931 163 HB3 LYS 19 HB3 LYS 19 0.828 -1.330 2.453 164 HG2 LYS 19 HG2 LYS 19 -1.056 -3.207 2.700 165 HG3 LYS 19 HG3 LYS 19 -2.159 -1.839 2.525 166 HD2 LYS 19 HD2 LYS 19 -1.060 -1.247 0.368 167 HD3 LYS 19 HD3 LYS 19 0.112 -2.564 0.628 168 HE2 LYS 19 HE2 LYS 19 -1.951 -4.132 0.692 169 HE3 LYS 19 HE3 LYS 19 -2.838 -2.782 -0.037 170 HZ1 LYS 19 HZ1 LYS 19 -2.052 -4.128 -1.781 171 HZ2 LYS 19 HZ2 LYS 19 -0.585 -4.331 -1.145 172 HZ3 LYS 19 HZ3 LYS 19 -1.004 -2.894 -1.828 173 H ILE 20 H ILE 20 0.772 0.681 5.572 174 HA ILE 20 HA ILE 20 3.548 0.673 5.036 175 HB ILE 20 HB ILE 20 2.391 2.159 7.406 176 HG12 ILE 20 HG12 ILE 20 0.807 2.672 5.670 177 HG13 ILE 20 HG13 ILE 20 1.827 4.056 5.950 178 HG21 ILE 20 HG21 ILE 20 4.646 2.767 5.418 179 HG22 ILE 20 HG22 ILE 20 4.095 3.851 6.716 180 HG23 ILE 20 HG23 ILE 20 4.813 2.286 7.112 181 HD11 ILE 20 HD11 ILE 20 1.357 3.631 3.530 182 HD12 ILE 20 HD12 ILE 20 3.087 3.636 3.913 183 HD13 ILE 20 HD13 ILE 20 2.235 2.093 3.650 184 H LYS 21 H LYS 21 1.690 -0.558 7.801 185 HA LYS 21 HA LYS 21 3.901 -1.215 9.532 186 HB2 LYS 21 HB2 LYS 21 1.150 -2.515 9.477 187 HB3 LYS 21 HB3 LYS 21 2.285 -2.404 10.811 188 HG2 LYS 21 HG2 LYS 21 1.999 0.207 10.492 189 HG3 LYS 21 HG3 LYS 21 0.561 -0.215 9.571 190 HD2 LYS 21 HD2 LYS 21 1.103 -1.132 12.429 191 HD3 LYS 21 HD3 LYS 21 0.233 0.340 11.994 192 HE2 LYS 21 HE2 LYS 21 -1.441 -1.060 10.767 193 HE3 LYS 21 HE3 LYS 21 -0.624 -2.506 11.403 194 HZ1 LYS 21 HZ1 LYS 21 -1.741 -0.329 13.068 195 HZ2 LYS 21 HZ2 LYS 21 -1.071 -1.700 13.640 196 HZ3 LYS 21 HZ3 LYS 21 -2.498 -1.770 12.817 197 H GLU 22 H GLU 22 2.201 -2.808 6.850 198 HA GLU 22 HA GLU 22 3.177 -5.476 7.459 199 HB2 GLU 22 HB2 GLU 22 1.917 -4.276 4.949 200 HB3 GLU 22 HB3 GLU 22 2.310 -5.989 5.157 201 HG2 GLU 22 HG2 GLU 22 0.869 -6.154 7.102 202 HG3 GLU 22 HG3 GLU 22 0.491 -4.444 7.041 203 H ARG 23 H ARG 23 4.036 -2.964 5.008 204 HA ARG 23 HA ARG 23 6.288 -4.441 4.065 205 HB2 ARG 23 HB2 ARG 23 6.994 -2.373 2.935 206 HB3 ARG 23 HB3 ARG 23 5.316 -2.826 2.669 207 HG2 ARG 23 HG2 ARG 23 4.925 -0.626 3.020 208 HG3 ARG 23 HG3 ARG 23 4.908 -1.118 4.700 209 HD2 ARG 23 HD2 ARG 23 6.260 0.810 4.578 210 HD3 ARG 23 HD3 ARG 23 7.363 -0.553 4.835 211 HE ARG 23 HE ARG 23 6.707 0.445 2.090 212 HH11 ARG 23 HH11 ARG 23 9.448 -0.444 4.349 213 HH12 ARG 23 HH12 ARG 23 10.558 -0.033 3.075 214 HH21 ARG 23 HH21 ARG 23 8.251 0.455 0.570 215 HH22 ARG 23 HH22 ARG 23 9.945 0.349 0.979 216 H ILE 24 H ILE 24 6.042 -2.283 6.902 217 HA ILE 24 HA ILE 24 8.954 -2.177 7.158 218 HB ILE 24 HB ILE 24 7.565 -0.351 8.014 219 HG12 ILE 24 HG12 ILE 24 9.295 -1.839 10.019 220 HG13 ILE 24 HG13 ILE 24 9.708 -0.449 9.012 221 HG21 ILE 24 HG21 ILE 24 6.620 -2.202 10.236 222 HG22 ILE 24 HG22 ILE 24 6.094 -0.546 9.861 223 HG23 ILE 24 HG23 ILE 24 5.715 -1.845 8.759 224 HD11 ILE 24 HD11 ILE 24 9.426 0.290 11.300 225 HD12 ILE 24 HD12 ILE 24 8.028 0.886 10.367 226 HD13 ILE 24 HD13 ILE 24 7.847 -0.514 11.428 227 H GLN 25 H GLN 25 6.286 -4.131 8.690 228 HA GLN 25 HA GLN 25 8.158 -5.510 10.406 229 HB2 GLN 25 HB2 GLN 25 5.688 -5.134 10.809 230 HB3 GLN 25 HB3 GLN 25 5.349 -6.337 9.557 231 HG2 GLN 25 HG2 GLN 25 6.811 -7.947 10.960 232 HG3 GLN 25 HG3 GLN 25 6.706 -6.728 12.236 233 HE21 GLN 25 HE21 GLN 25 5.321 -9.614 11.422 234 HE22 GLN 25 HE22 GLN 25 3.661 -9.262 11.833 235 H ASN 26 H ASN 26 6.405 -6.475 7.438 236 HA ASN 26 HA ASN 26 7.729 -9.077 7.371 237 HB2 ASN 26 HB2 ASN 26 5.997 -7.680 5.255 238 HB3 ASN 26 HB3 ASN 26 6.527 -9.342 5.213 239 HD21 ASN 26 HD21 ASN 26 4.504 -7.085 7.083 240 HD22 ASN 26 HD22 ASN 26 3.502 -8.311 7.821 241 H SER 27 H SER 27 7.816 -6.122 5.333 242 HA SER 27 HA SER 27 9.226 -5.369 3.795 243 HB2 SER 27 HB2 SER 27 10.484 -5.276 6.142 244 HB3 SER 27 HB3 SER 27 11.596 -6.398 5.341 245 HG SER 27 HG SER 27 12.310 -4.353 4.964 246 H LEU 28 H LEU 28 8.369 -8.214 3.471 247 HA LEU 28 HA LEU 28 10.316 -9.106 1.409 248 HB2 LEU 28 HB2 LEU 28 9.910 -11.422 2.210 249 HB3 LEU 28 HB3 LEU 28 10.637 -10.401 3.422 250 HG LEU 28 HG LEU 28 8.358 -10.072 4.452 251 HD11 LEU 28 HD11 LEU 28 7.580 -12.321 2.611 252 HD12 LEU 28 HD12 LEU 28 6.790 -10.732 2.821 253 HD13 LEU 28 HD13 LEU 28 6.725 -11.906 4.113 254 HD21 LEU 28 HD21 LEU 28 9.385 -12.897 4.457 255 HD22 LEU 28 HD22 LEU 28 8.454 -12.094 5.729 256 HD23 LEU 28 HD23 LEU 28 10.095 -11.552 5.365 257 H SER 29 H SER 29 9.143 -11.071 0.349 258 HA SER 29 HA SER 29 6.357 -10.363 -0.461 259 HB2 SER 29 HB2 SER 29 8.788 -11.182 -2.096 260 HB3 SER 29 HB3 SER 29 7.150 -11.365 -2.727 261 HG SER 29 HG SER 29 6.771 -9.176 -2.413 262 H THR 30 H THR 30 8.880 -12.912 -0.172 263 HA THR 30 HA THR 30 6.836 -14.886 0.497 264 HB THR 30 HB THR 30 6.836 -14.735 -1.985 265 HG1 THR 30 HG1 THR 30 6.382 -16.767 -1.129 266 HG21 THR 30 HG21 THR 30 9.220 -14.066 -2.303 267 HG22 THR 30 HG22 THR 30 8.754 -15.433 -3.306 268 HG23 THR 30 HG23 THR 30 9.701 -15.722 -1.852 269 H GLU 31 H GLU 31 8.982 -13.608 1.990 270 HA GLU 31 HA GLU 31 10.749 -14.134 3.362 271 HB2 GLU 31 HB2 GLU 31 9.938 -17.027 2.976 272 HB3 GLU 31 HB3 GLU 31 10.664 -16.279 4.390 273 HG2 GLU 31 HG2 GLU 31 8.579 -15.026 4.823 274 HG3 GLU 31 HG3 GLU 31 7.823 -15.722 3.386 275 H LYS 32 H LYS 32 11.364 -13.925 0.534 276 HA LYS 32 HA LYS 32 13.003 -15.857 -0.546 277 HB2 LYS 32 HB2 LYS 32 12.264 -13.216 -1.135 278 HB3 LYS 32 HB3 LYS 32 13.990 -13.089 -0.896 279 HG2 LYS 32 HG2 LYS 32 14.143 -13.606 -3.066 280 HG3 LYS 32 HG3 LYS 32 13.955 -15.270 -2.510 281 HD2 LYS 32 HD2 LYS 32 12.450 -14.945 -4.353 282 HD3 LYS 32 HD3 LYS 32 11.506 -15.080 -2.886 283 HE2 LYS 32 HE2 LYS 32 10.552 -13.301 -4.183 284 HE3 LYS 32 HE3 LYS 32 11.370 -12.535 -2.818 285 HZ1 LYS 32 HZ1 LYS 32 11.821 -11.426 -4.893 286 HZ2 LYS 32 HZ2 LYS 32 12.417 -12.794 -5.559 287 HZ3 LYS 32 HZ3 LYS 32 13.229 -12.038 -4.327 288 H TYR 33 H TYR 33 15.168 -16.458 -0.468 289 HA TYR 33 HA TYR 33 16.633 -16.163 1.922 290 HB2 TYR 33 HB2 TYR 33 17.521 -16.832 -0.919 291 HB3 TYR 33 HB3 TYR 33 18.640 -16.774 0.420 292 HD1 TYR 33 HD1 TYR 33 18.781 -18.488 2.083 293 HD2 TYR 33 HD2 TYR 33 15.749 -18.640 -1.001 294 HE1 TYR 33 HE1 TYR 33 18.425 -20.882 2.545 295 HE2 TYR 33 HE2 TYR 33 15.303 -20.995 -0.446 296 HH TYR 33 HH TYR 33 15.743 -22.727 1.104 297 H GLY 34 H GLY 34 16.864 -14.382 -1.175 298 HA2 GLY 34 HA2 GLY 34 17.566 -12.209 -1.557 299 HA3 GLY 34 HA3 GLY 34 17.884 -12.002 0.183 300 H SER 35 H SER 35 19.968 -11.025 -0.305 301 HA SER 35 HA SER 35 22.127 -12.948 -0.651 302 HB2 SER 35 HB2 SER 35 23.157 -11.573 -2.490 303 HB3 SER 35 HB3 SER 35 21.672 -12.401 -2.967 304 HG SER 35 HG SER 35 21.930 -10.117 -3.571 305 H GLY 36 H GLY 36 24.233 -11.244 -0.818 306 HA2 GLY 36 HA2 GLY 36 24.026 -9.054 1.073 307 HA3 GLY 36 HA3 GLY 36 24.952 -10.477 1.622 308 H SER 37 H SER 37 26.619 -8.602 1.526 309 HA SER 37 HA SER 37 28.158 -8.888 -0.951 310 HB2 SER 37 HB2 SER 37 26.731 -6.763 -1.112 311 HB3 SER 37 HB3 SER 37 27.699 -6.127 0.237 312 HG SER 37 HG SER 37 28.751 -5.501 -1.596 313 H GLY 38 H GLY 38 30.193 -7.251 -0.316 314 HA2 GLY 38 HA2 GLY 38 31.555 -6.790 1.840 315 HA3 GLY 38 HA3 GLY 38 31.473 -8.547 2.051 316 H SER 39 H SER 39 31.515 -8.121 -1.256 317 HA SER 39 HA SER 39 34.391 -7.804 -1.628 318 HB2 SER 39 HB2 SER 39 34.353 -9.984 -2.951 319 HB3 SER 39 HB3 SER 39 34.223 -10.158 -1.197 320 HG SER 39 HG SER 39 32.682 -11.446 -2.329 321 H GLY 40 H GLY 40 34.339 -8.514 -4.364 322 HA2 GLY 40 HA2 GLY 40 32.988 -6.185 -5.501 323 HA3 GLY 40 HA3 GLY 40 34.046 -7.342 -6.335 324 H SER 41 H SER 41 32.269 -7.032 -7.982 325 HA SER 41 HA SER 41 30.464 -7.667 -9.151 326 HB2 SER 41 HB2 SER 41 29.945 -10.200 -8.960 327 HB3 SER 41 HB3 SER 41 31.488 -9.637 -9.609 328 HG SER 41 HG SER 41 31.196 -10.246 -6.877 329 H GLY 42 H GLY 42 29.088 -6.147 -8.031 330 HA2 GLY 42 HA2 GLY 42 27.315 -7.098 -5.923 331 HA3 GLY 42 HA3 GLY 42 27.227 -5.553 -6.803 332 H SER 43 H SER 43 24.934 -7.205 -6.256 333 HA SER 43 HA SER 43 23.965 -7.629 -8.994 334 HB2 SER 43 HB2 SER 43 24.363 -9.769 -6.882 335 HB3 SER 43 HB3 SER 43 22.966 -9.877 -7.958 336 HG SER 43 HG SER 43 25.288 -10.730 -8.504 337 H GLY 44 H GLY 44 21.713 -7.481 -9.139 338 HA2 GLY 44 HA2 GLY 44 19.809 -7.464 -7.112 339 HA3 GLY 44 HA3 GLY 44 20.419 -5.814 -7.220 340 H SER 45 H SER 45 17.758 -6.625 -7.830 341 HA SER 45 HA SER 45 17.411 -5.558 -10.522 342 HB2 SER 45 HB2 SER 45 16.256 -8.242 -9.617 343 HB3 SER 45 HB3 SER 45 15.834 -7.398 -11.103 344 HG SER 45 HG SER 45 17.865 -7.753 -11.901 345 H GLY 46 H GLY 46 15.034 -4.923 -10.762 346 HA2 GLY 46 HA2 GLY 46 13.266 -5.070 -8.482 347 HA3 GLY 46 HA3 GLY 46 13.958 -3.451 -8.781 348 H SER 47 H SER 47 11.164 -3.961 -9.090 349 HA SER 47 HA SER 47 10.783 -3.149 -11.829 350 HB2 SER 47 HB2 SER 47 10.827 -5.743 -11.710 351 HB3 SER 47 HB3 SER 47 9.276 -5.612 -10.859 352 HG SER 47 HG SER 47 10.047 -4.885 -13.470 353 H GLY 48 H GLY 48 8.745 -2.134 -12.074 354 HA2 GLY 48 HA2 GLY 48 6.535 -2.188 -10.423 355 HA3 GLY 48 HA3 GLY 48 7.601 -0.889 -9.817 356 H SER 49 H SER 49 5.125 -0.282 -11.004 357 HA SER 49 HA SER 49 5.845 1.569 -13.074 358 HB2 SER 49 HB2 SER 49 4.132 -0.836 -13.872 359 HB3 SER 49 HB3 SER 49 4.238 0.663 -14.802 360 HG SER 49 HG SER 49 6.619 -0.578 -14.047 361 H GLY 50 H GLY 50 2.667 -0.076 -12.682 362 HA2 GLY 50 HA2 GLY 50 0.763 0.547 -11.646 363 HA3 GLY 50 HA3 GLY 50 1.679 1.653 -10.614 364 H SER 51 H SER 51 -0.802 2.423 -11.455 365 HA SER 51 HA SER 51 -0.285 4.579 -13.444 366 HB2 SER 51 HB2 SER 51 -1.490 2.668 -14.399 367 HB3 SER 51 HB3 SER 51 -2.690 2.750 -13.116 368 HG SER 51 HG SER 51 -3.397 3.663 -15.005 369 H GLY 52 H GLY 52 -1.100 6.597 -12.755 370 HA2 GLY 52 HA2 GLY 52 -2.525 7.996 -11.478 371 HA3 GLY 52 HA3 GLY 52 -2.744 6.722 -10.274 372 H SER 53 H SER 53 -2.319 8.501 -8.802 373 HA SER 53 HA SER 53 0.162 8.502 -7.586 374 HB2 SER 53 HB2 SER 53 0.526 10.144 -9.673 375 HB3 SER 53 HB3 SER 53 -0.334 11.296 -8.662 376 HG SER 53 HG SER 53 1.221 11.019 -7.076 377 H GLY 54 H GLY 54 -0.716 8.561 -5.543 378 HA2 GLY 54 HA2 GLY 54 -2.571 10.731 -4.763 379 HA3 GLY 54 HA3 GLY 54 -3.181 9.092 -4.725 380 H SER 55 H SER 55 0.164 10.102 -3.929 381 HA SER 55 HA SER 55 0.145 8.639 -1.441 382 HB2 SER 55 HB2 SER 55 2.039 10.648 -2.707 383 HB3 SER 55 HB3 SER 55 2.307 10.017 -1.075 384 HG SER 55 HG SER 55 3.377 8.803 -2.664 385 H GLY 56 H GLY 56 0.813 9.929 0.682 386 HA2 GLY 56 HA2 GLY 56 0.531 11.806 2.045 387 HA3 GLY 56 HA3 GLY 56 -0.560 12.525 0.886 388 H SER 57 H SER 57 -1.725 12.998 2.791 389 HA SER 57 HA SER 57 -3.340 12.861 4.298 390 HB2 SER 57 HB2 SER 57 -5.407 11.678 3.624 391 HB3 SER 57 HB3 SER 57 -4.702 12.781 2.441 392 HG SER 57 HG SER 57 -4.528 9.942 2.390 393 H GLY 58 H GLY 58 -1.089 11.366 5.053 394 HA2 GLY 58 HA2 GLY 58 -2.338 9.569 7.011 395 HA3 GLY 58 HA3 GLY 58 -1.063 8.926 5.949 396 H TYR 59 H TYR 59 -0.332 8.700 8.365 397 HA TYR 59 HA TYR 59 1.311 11.072 9.151 398 HB2 TYR 59 HB2 TYR 59 0.141 8.816 10.809 399 HB3 TYR 59 HB3 TYR 59 1.267 10.028 11.403 400 HD1 TYR 59 HD1 TYR 59 0.540 12.150 12.170 401 HD2 TYR 59 HD2 TYR 59 -2.193 9.626 9.980 402 HE1 TYR 59 HE1 TYR 59 -1.331 13.665 12.748 403 HE2 TYR 59 HE2 TYR 59 -4.048 11.153 10.526 404 HH TYR 59 HH TYR 59 -4.694 13.113 11.605 405 H GLN3288 H GLN3288 1.592 8.706 7.230 406 HA GLN3288 HA GLN3288 3.646 6.937 8.121 407 HB2 GLN3288 HB2 GLN3288 3.703 6.348 5.694 408 HB3 GLN3288 HB3 GLN3288 2.064 6.379 6.336 409 HG2 GLN3288 HG2 GLN3288 1.743 8.681 5.371 410 HG3 GLN3288 HG3 GLN3288 3.367 8.581 4.682 411 HE21 GLN3288 HE21 GLN3288 3.726 7.177 2.911 412 HE22 GLN3288 HE22 GLN3288 2.383 6.498 1.981 413 H ILE3289 H ILE3289 5.863 6.893 7.361 414 HA ILE3289 HA ILE3289 7.085 9.472 7.538 415 HB ILE3289 HB ILE3289 8.421 6.833 6.963 416 HG12 ILE3289 HG12 ILE3289 7.637 8.216 9.576 417 HG13 ILE3289 HG13 ILE3289 7.167 6.611 9.031 418 HG21 ILE3289 HG21 ILE3289 10.395 8.025 7.846 419 HG22 ILE3289 HG22 ILE3289 9.773 8.845 6.430 420 HG23 ILE3289 HG23 ILE3289 9.446 9.506 8.046 421 HD11 ILE3289 HD11 ILE3289 9.896 7.480 10.013 422 HD12 ILE3289 HD12 ILE3289 8.795 6.294 10.718 423 HD13 ILE3289 HD13 ILE3289 9.608 5.939 9.172 424 H GLU3290 H GLU3290 6.672 10.781 5.952 425 HA GLU3290 HA GLU3290 6.496 10.176 3.173 426 HB2 GLU3290 HB2 GLU3290 5.363 11.992 4.417 427 HB3 GLU3290 HB3 GLU3290 6.917 12.815 4.617 428 HG2 GLU3290 HG2 GLU3290 7.072 13.293 2.278 429 HG3 GLU3290 HG3 GLU3290 5.850 12.075 1.871 430 H THR3291 H THR3291 9.260 10.367 5.153 431 HA THR3291 HA THR3291 10.993 10.845 2.782 432 HB THR3291 HB THR3291 10.680 12.820 4.178 433 HG1 THR3291 HG1 THR3291 12.503 12.730 3.065 434 HG21 THR3291 HG21 THR3291 10.406 11.860 6.417 435 HG22 THR3291 HG22 THR3291 11.684 13.075 6.379 436 HG23 THR3291 HG23 THR3291 12.106 11.355 6.422 437 H PHE3292 H PHE3292 10.263 8.252 3.343 438 HA PHE3292 HA PHE3292 12.893 7.166 4.027 439 HB2 PHE3292 HB2 PHE3292 11.865 7.326 6.238 440 HB3 PHE3292 HB3 PHE3292 10.452 6.425 5.693 441 HD1 PHE3292 HD1 PHE3292 14.211 5.854 5.264 442 HD2 PHE3292 HD2 PHE3292 10.485 4.387 6.836 443 HE1 PHE3292 HE1 PHE3292 15.283 3.701 5.796 444 HE2 PHE3292 HE2 PHE3292 11.538 2.189 7.307 445 HZ PHE3292 HZ PHE3292 13.946 1.834 6.771 446 H PHE3293 H PHE3293 9.484 6.206 3.457 447 HA PHE3293 HA PHE3293 10.430 4.259 1.390 448 HB2 PHE3293 HB2 PHE3293 8.220 3.006 2.142 449 HB3 PHE3293 HB3 PHE3293 9.738 2.761 2.959 450 HD1 PHE3293 HD1 PHE3293 9.455 2.487 5.240 451 HD2 PHE3293 HD2 PHE3293 6.923 5.296 3.165 452 HE1 PHE3293 HE1 PHE3293 8.420 3.146 7.381 453 HE2 PHE3293 HE2 PHE3293 5.891 5.940 5.286 454 HZ PHE3293 HZ PHE3293 6.607 4.848 7.422 455 H ALA3294 H ALA3294 9.147 7.203 1.560 456 HA ALA3294 HA ALA3294 6.644 7.171 0.392 457 HB1 ALA3294 HB1 ALA3294 8.918 9.143 -0.031 458 HB2 ALA3294 HB2 ALA3294 7.214 9.439 -0.435 459 HB3 ALA3294 HB3 ALA3294 7.680 9.164 1.251 460 H GLN3295 H GLN3295 9.677 6.416 -1.213 461 HA GLN3295 HA GLN3295 8.580 6.821 -3.907 462 HB2 GLN3295 HB2 GLN3295 11.065 5.284 -3.122 463 HB3 GLN3295 HB3 GLN3295 10.647 5.960 -4.700 464 HG2 GLN3295 HG2 GLN3295 11.361 7.481 -2.176 465 HG3 GLN3295 HG3 GLN3295 12.292 7.399 -3.670 466 HE21 GLN3295 HE21 GLN3295 10.981 9.796 -2.094 467 HE22 GLN3295 HE22 GLN3295 10.113 10.599 -3.392 468 H ASP3296 H ASP3296 8.823 4.162 -1.631 469 HA ASP3296 HA ASP3296 7.914 2.114 -3.595 470 HB2 ASP3296 HB2 ASP3296 8.402 2.102 -0.587 471 HB3 ASP3296 HB3 ASP3296 7.710 0.736 -1.471 472 H ILE3297 H ILE3297 6.720 4.083 -0.973 473 HA ILE3297 HA ILE3297 4.168 3.004 -0.574 474 HB ILE3297 HB ILE3297 5.706 5.332 0.164 475 HG12 ILE3297 HG12 ILE3297 4.571 5.228 2.237 476 HG13 ILE3297 HG13 ILE3297 3.257 4.254 1.561 477 HG21 ILE3297 HG21 ILE3297 4.078 7.040 0.563 478 HG22 ILE3297 HG22 ILE3297 4.283 6.715 -1.151 479 HG23 ILE3297 HG23 ILE3297 2.844 6.094 -0.322 480 HD11 ILE3297 HD11 ILE3297 6.134 3.308 1.558 481 HD12 ILE3297 HD12 ILE3297 5.098 3.082 2.974 482 HD13 ILE3297 HD13 ILE3297 4.654 2.327 1.440 483 H GLU3298 H GLU3298 5.235 5.408 -2.980 484 HA GLU3298 HA GLU3298 2.627 6.052 -3.906 485 HB2 GLU3298 HB2 GLU3298 3.723 6.972 -5.871 486 HB3 GLU3298 HB3 GLU3298 4.365 7.539 -4.325 487 HG2 GLU3298 HG2 GLU3298 6.435 6.836 -4.769 488 HG3 GLU3298 HG3 GLU3298 5.863 5.228 -5.214 489 H SER3299 H SER3299 4.973 3.600 -4.770 490 HA SER3299 HA SER3299 3.655 2.576 -7.059 491 HB2 SER3299 HB2 SER3299 5.980 2.064 -6.616 492 HB3 SER3299 HB3 SER3299 5.553 1.153 -5.161 493 HG SER3299 HG SER3299 4.572 -0.360 -6.330 494 H VAL3300 H VAL3300 3.406 1.561 -3.623 495 HA VAL3300 HA VAL3300 1.399 -0.408 -4.316 496 HB VAL3300 HB VAL3300 3.038 -0.851 -2.637 497 HG11 VAL3300 HG11 VAL3300 2.860 0.150 -0.355 498 HG12 VAL3300 HG12 VAL3300 3.495 1.206 -1.609 499 HG13 VAL3300 HG13 VAL3300 1.827 1.410 -1.057 500 HG21 VAL3300 HG21 VAL3300 1.604 -1.863 -0.986 501 HG22 VAL3300 HG22 VAL3300 0.250 -0.809 -1.472 502 HG23 VAL3300 HG23 VAL3300 0.900 -2.013 -2.605 503 H GLN3301 H GLN3301 1.205 2.997 -3.196 504 HA GLN3301 HA GLN3301 -1.642 2.753 -2.581 505 HB2 GLN3301 HB2 GLN3301 -1.741 5.178 -2.442 506 HB3 GLN3301 HB3 GLN3301 -0.384 4.521 -1.559 507 HG2 GLN3301 HG2 GLN3301 0.693 6.263 -2.536 508 HG3 GLN3301 HG3 GLN3301 0.918 4.951 -3.711 509 HE21 GLN3301 HE21 GLN3301 -2.232 5.870 -4.296 510 HE22 GLN3301 HE22 GLN3301 -1.821 6.705 -5.742 511 H LYS3302 H LYS3302 0.287 3.398 -5.511 512 HA LYS3302 HA LYS3302 -1.743 4.364 -7.205 513 HB2 LYS3302 HB2 LYS3302 0.881 2.941 -7.569 514 HB3 LYS3302 HB3 LYS3302 -0.189 3.135 -8.957 515 HG2 LYS3302 HG2 LYS3302 -0.098 5.497 -8.884 516 HG3 LYS3302 HG3 LYS3302 0.501 5.528 -7.236 517 HD2 LYS3302 HD2 LYS3302 2.365 6.119 -8.598 518 HD3 LYS3302 HD3 LYS3302 2.659 4.480 -8.045 519 HE2 LYS3302 HE2 LYS3302 3.207 4.175 -10.225 520 HE3 LYS3302 HE3 LYS3302 1.478 3.795 -10.305 521 HZ1 LYS3302 HZ1 LYS3302 2.866 6.239 -11.181 522 HZ2 LYS3302 HZ2 LYS3302 1.256 6.281 -10.897 523 HZ3 LYS3302 HZ3 LYS3302 1.880 5.311 -12.053 524 H GLU3303 H GLU3303 -1.173 1.186 -5.907 525 HA GLU3303 HA GLU3303 -2.853 -0.162 -7.909 526 HB2 GLU3303 HB2 GLU3303 -2.015 -2.041 -7.154 527 HB3 GLU3303 HB3 GLU3303 -0.886 -1.054 -6.233 528 HG2 GLU3303 HG2 GLU3303 -2.439 -1.249 -4.256 529 HG3 GLU3303 HG3 GLU3303 -3.477 -2.296 -5.230 530 H LEU3304 H LEU3304 -3.179 0.772 -4.467 531 HA LEU3304 HA LEU3304 -5.855 -0.018 -4.166 532 HB2 LEU3304 HB2 LEU3304 -4.206 2.121 -2.781 533 HB3 LEU3304 HB3 LEU3304 -5.763 1.581 -2.226 534 HG LEU3304 HG LEU3304 -3.158 0.050 -2.391 535 HD11 LEU3304 HD11 LEU3304 -3.465 -0.215 0.030 536 HD12 LEU3304 HD12 LEU3304 -4.941 0.792 -0.090 537 HD13 LEU3304 HD13 LEU3304 -3.352 1.444 -0.574 538 HD21 LEU3304 HD21 LEU3304 -4.243 -1.958 -1.439 539 HD22 LEU3304 HD22 LEU3304 -4.722 -1.607 -3.087 540 HD23 LEU3304 HD23 LEU3304 -5.823 -1.209 -1.741 541 H GLU3305 H GLU3305 -4.626 3.090 -5.360 542 HA GLU3305 HA GLU3305 -7.158 4.396 -4.997 543 HB2 GLU3305 HB2 GLU3305 -6.285 6.224 -6.297 544 HB3 GLU3305 HB3 GLU3305 -5.167 5.692 -5.042 545 HG2 GLU3305 HG2 GLU3305 -3.858 4.478 -6.595 546 HG3 GLU3305 HG3 GLU3305 -4.996 4.756 -7.914 547 H ASN3306 H ASN3306 -6.451 2.051 -7.220 548 HA ASN3306 HA ASN3306 -8.641 3.000 -8.993 549 HB2 ASN3306 HB2 ASN3306 -7.744 1.837 -10.834 550 HB3 ASN3306 HB3 ASN3306 -6.478 2.844 -10.153 551 HD21 ASN3306 HD21 ASN3306 -4.589 1.855 -9.354 552 HD22 ASN3306 HD22 ASN3306 -4.431 0.107 -9.292 553 H LEU3307 H LEU3307 -7.971 1.011 -6.424 554 HA LEU3307 HA LEU3307 -9.446 -1.364 -7.451 555 HB2 LEU3307 HB2 LEU3307 -7.848 -0.684 -5.056 556 HB3 LEU3307 HB3 LEU3307 -9.327 -1.515 -4.668 557 HG LEU3307 HG LEU3307 -8.272 -3.380 -4.886 558 HD11 LEU3307 HD11 LEU3307 -9.304 -3.567 -7.115 559 HD12 LEU3307 HD12 LEU3307 -7.780 -4.437 -6.989 560 HD13 LEU3307 HD13 LEU3307 -7.833 -2.882 -7.844 561 HD21 LEU3307 HD21 LEU3307 -6.165 -2.267 -4.580 562 HD22 LEU3307 HD22 LEU3307 -5.960 -2.196 -6.358 563 HD23 LEU3307 HD23 LEU3307 -6.056 -3.760 -5.514 564 H SER3308 H SER3308 -11.414 -2.084 -6.501 565 HA SER3308 HA SER3308 -13.444 -0.011 -6.129 566 HB2 SER3308 HB2 SER3308 -13.726 -3.035 -6.217 567 HB3 SER3308 HB3 SER3308 -14.957 -1.816 -6.580 568 HG SER3308 HG SER3308 -13.671 -1.168 -8.384 569 H GLU3309 H GLU3309 -15.281 -0.565 -4.402 570 HA GLU3309 HA GLU3309 -14.002 -0.573 -1.811 571 HB2 GLU3309 HB2 GLU3309 -16.907 -0.987 -2.749 572 HB3 GLU3309 HB3 GLU3309 -16.462 -1.222 -1.062 573 HG2 GLU3309 HG2 GLU3309 -15.613 1.125 -0.993 574 HG3 GLU3309 HG3 GLU3309 -16.212 1.313 -2.630 575 H GLU3310 H GLU3310 -15.828 -3.122 -3.585 576 HA GLU3310 HA GLU3310 -15.698 -5.095 -1.705 577 HB2 GLU3310 HB2 GLU3310 -15.198 -5.508 -4.688 578 HB3 GLU3310 HB3 GLU3310 -15.771 -6.733 -3.548 579 HG2 GLU3310 HG2 GLU3310 -17.829 -5.345 -3.156 580 HG3 GLU3310 HG3 GLU3310 -17.269 -4.216 -4.393 581 H GLU3311 H GLU3311 -12.967 -3.808 -3.435 582 HA GLU3311 HA GLU3311 -11.233 -6.138 -2.869 583 HB2 GLU3311 HB2 GLU3311 -10.784 -3.433 -4.127 584 HB3 GLU3311 HB3 GLU3311 -9.584 -4.719 -4.060 585 HG2 GLU3311 HG2 GLU3311 -12.230 -5.305 -5.407 586 HG3 GLU3311 HG3 GLU3311 -11.123 -4.283 -6.218 587 H LEU3312 H LEU3312 -11.473 -2.649 -2.144 588 HA LEU3312 HA LEU3312 -9.407 -2.732 -0.127 589 HB2 LEU3312 HB2 LEU3312 -11.370 -0.470 -0.394 590 HB3 LEU3312 HB3 LEU3312 -9.742 -0.379 0.145 591 HG LEU3312 HG LEU3312 -10.212 -1.241 -2.710 592 HD11 LEU3312 HD11 LEU3312 -10.378 1.048 -3.429 593 HD12 LEU3312 HD12 LEU3312 -10.538 1.597 -1.739 594 HD13 LEU3312 HD13 LEU3312 -11.756 0.508 -2.486 595 HD21 LEU3312 HD21 LEU3312 -7.994 -1.348 -2.051 596 HD22 LEU3312 HD22 LEU3312 -8.021 0.262 -1.297 597 HD23 LEU3312 HD23 LEU3312 -8.161 0.102 -3.052 598 H LEU3313 H LEU3313 -12.882 -2.112 0.052 599 HA LEU3313 HA LEU3313 -13.235 -1.730 2.816 600 HB2 LEU3313 HB2 LEU3313 -14.888 -1.025 1.115 601 HB3 LEU3313 HB3 LEU3313 -15.143 -2.683 0.622 602 HG LEU3313 HG LEU3313 -16.950 -1.790 1.951 603 HD11 LEU3313 HD11 LEU3313 -17.533 -3.844 2.929 604 HD12 LEU3313 HD12 LEU3313 -15.868 -4.332 3.198 605 HD13 LEU3313 HD13 LEU3313 -16.519 -4.248 1.546 606 HD21 LEU3313 HD21 LEU3313 -16.917 -1.847 4.361 607 HD22 LEU3313 HD22 LEU3313 -15.759 -0.655 3.783 608 HD23 LEU3313 HD23 LEU3313 -15.198 -2.239 4.376 609 H ALA3314 H ALA3314 -13.200 -4.692 0.735 610 HA ALA3314 HA ALA3314 -13.958 -6.363 2.914 611 HB1 ALA3314 HB1 ALA3314 -13.119 -8.178 1.482 612 HB2 ALA3314 HB2 ALA3314 -14.172 -7.051 0.619 613 HB3 ALA3314 HB3 ALA3314 -12.405 -6.959 0.374 614 H MET3315 H MET3315 -10.796 -4.984 2.055 615 HA MET3315 HA MET3315 -9.233 -6.840 3.654 616 HB2 MET3315 HB2 MET3315 -8.508 -4.018 2.784 617 HB3 MET3315 HB3 MET3315 -7.410 -5.315 3.213 618 HG2 MET3315 HG2 MET3315 -9.159 -6.051 1.037 619 HG3 MET3315 HG3 MET3315 -8.308 -4.545 0.710 620 HE1 MET3315 HE1 MET3315 -7.060 -5.380 -1.401 621 HE2 MET3315 HE2 MET3315 -6.254 -6.962 -1.484 622 HE3 MET3315 HE3 MET3315 -8.012 -6.867 -1.218 623 H LEU3316 H LEU3316 -9.992 -3.370 4.172 624 HA LEU3316 HA LEU3316 -9.122 -3.199 6.840 625 HB2 LEU3316 HB2 LEU3316 -10.516 -1.141 6.912 626 HB3 LEU3316 HB3 LEU3316 -9.391 -1.246 5.565 627 HG LEU3316 HG LEU3316 -11.579 -2.251 4.318 628 HD11 LEU3316 HD11 LEU3316 -12.735 -0.349 6.427 629 HD12 LEU3316 HD12 LEU3316 -13.198 -2.038 6.169 630 HD13 LEU3316 HD13 LEU3316 -13.569 -0.828 4.954 631 HD21 LEU3316 HD21 LEU3316 -11.477 0.733 4.705 632 HD22 LEU3316 HD22 LEU3316 -11.784 -0.218 3.235 633 HD23 LEU3316 HD23 LEU3316 -10.165 -0.140 3.858 634 H ASN3317 H ASN3317 -12.077 -4.419 5.519 635 HA ASN3317 HA ASN3317 -13.371 -4.401 8.206 636 HB2 ASN3317 HB2 ASN3317 -14.562 -3.857 5.878 637 HB3 ASN3317 HB3 ASN3317 -14.739 -5.606 5.799 638 HD21 ASN3317 HD21 ASN3317 -15.059 -2.868 8.108 639 HD22 ASN3317 HD22 ASN3317 -16.426 -3.588 8.976 640 H GLY3318 H GLY3318 -11.686 -6.445 6.081 641 HA2 GLY3318 HA2 GLY3318 -10.906 -8.607 6.207 642 HA3 GLY3318 HA3 GLY3318 -11.349 -8.608 7.933 643 H ASP3319 H ASP3319 -13.066 -8.422 4.778 644 HA ASP3319 HA ASP3319 -14.668 -10.776 5.462 645 HB2 ASP3319 HB2 ASP3319 -15.663 -8.206 6.057 646 HB3 ASP3319 HB3 ASP3319 -16.484 -8.613 4.591 647 H GLN3320 H GLN3320 -16.644 -10.154 3.371 648 HA GLN3320 HA GLN3320 -15.031 -10.189 0.915 649 HB2 GLN3320 HB2 GLN3320 -15.556 -12.564 1.968 650 HB3 GLN3320 HB3 GLN3320 -17.205 -12.256 1.451 651 HG2 GLN3320 HG2 GLN3320 -16.119 -13.588 -0.215 652 HG3 GLN3320 HG3 GLN3320 -16.339 -11.993 -0.908 653 HE21 GLN3320 HE21 GLN3320 -14.317 -10.565 -1.180 654 HE22 GLN3320 HE22 GLN3320 -12.756 -11.292 -0.878 655 H GLN3321 H GLN3321 -16.633 -8.105 2.050 656 HA GLN3321 HA GLN3321 -19.099 -8.075 0.406 657 HB2 GLN3321 HB2 GLN3321 -18.095 -6.396 2.744 658 HB3 GLN3321 HB3 GLN3321 -19.450 -5.892 1.745 659 HG2 GLN3321 HG2 GLN3321 -20.478 -6.865 3.530 660 HG3 GLN3321 HG3 GLN3321 -20.599 -8.070 2.255 661 HE21 GLN3321 HE21 GLN3321 -19.084 -10.022 2.454 662 HE22 GLN3321 HE22 GLN3321 -18.592 -10.458 4.100 Start of MODEL 15 1 H1 MET 1 H MET 1 -24.948 11.929 3.432 2 HA MET 1 HA MET 1 -26.015 10.042 2.324 3 HB2 MET 1 HB2 MET 1 -28.215 10.230 3.296 4 HB3 MET 1 HB3 MET 1 -26.950 10.749 4.397 5 HG2 MET 1 HG2 MET 1 -27.553 13.109 4.015 6 HG3 MET 1 HG3 MET 1 -28.784 12.611 2.846 7 HE1 MET 1 HE1 MET 1 -31.280 13.650 5.528 8 HE2 MET 1 HE2 MET 1 -29.833 14.504 4.954 9 HE3 MET 1 HE3 MET 1 -30.857 13.618 3.802 10 H ASN 2 H ASN 2 -25.382 11.369 -0.111 11 HA ASN 2 HA ASN 2 -27.950 11.095 -1.512 12 HB2 ASN 2 HB2 ASN 2 -26.065 13.447 -1.945 13 HB3 ASN 2 HB3 ASN 2 -27.497 13.070 -2.888 14 HD21 ASN 2 HD21 ASN 2 -26.379 14.467 0.135 15 HD22 ASN 2 HD22 ASN 2 -28.016 14.798 0.764 16 H ILE 3 H ILE 3 -25.188 9.669 -1.158 17 HA ILE 3 HA ILE 3 -24.991 8.873 -3.939 18 HB ILE 3 HB ILE 3 -23.608 11.039 -3.559 19 HG12 ILE 3 HG12 ILE 3 -21.923 8.939 -4.882 20 HG13 ILE 3 HG13 ILE 3 -23.549 9.207 -5.496 21 HG21 ILE 3 HG21 ILE 3 -21.561 9.078 -2.455 22 HG22 ILE 3 HG22 ILE 3 -21.364 10.805 -2.756 23 HG23 ILE 3 HG23 ILE 3 -22.463 10.261 -1.488 24 HD11 ILE 3 HD11 ILE 3 -21.555 11.457 -5.099 25 HD12 ILE 3 HD12 ILE 3 -21.886 10.639 -6.647 26 HD13 ILE 3 HD13 ILE 3 -23.159 11.568 -5.827 27 H ASN 4 H ASN 4 -23.132 7.264 -4.211 28 HA ASN 4 HA ASN 4 -22.576 5.624 -1.820 29 HB2 ASN 4 HB2 ASN 4 -23.447 3.586 -2.959 30 HB3 ASN 4 HB3 ASN 4 -24.665 4.716 -2.380 31 HD21 ASN 4 HD21 ASN 4 -23.331 3.184 -5.178 32 HD22 ASN 4 HD22 ASN 4 -24.372 3.951 -6.386 33 H GLU 5 H GLU 5 -22.297 5.640 -5.415 34 HA GLU 5 HA GLU 5 -19.858 4.221 -5.503 35 HB2 GLU 5 HB2 GLU 5 -21.149 6.120 -7.444 36 HB3 GLU 5 HB3 GLU 5 -19.534 5.446 -7.748 37 HG2 GLU 5 HG2 GLU 5 -20.519 3.133 -7.335 38 HG3 GLU 5 HG3 GLU 5 -22.114 3.895 -7.348 39 H GLN 6 H GLN 6 -20.411 7.617 -5.038 40 HA GLN 6 HA GLN 6 -17.541 8.291 -5.171 41 HB2 GLN 6 HB2 GLN 6 -19.945 9.906 -4.288 42 HB3 GLN 6 HB3 GLN 6 -18.306 10.443 -3.962 43 HG2 GLN 6 HG2 GLN 6 -17.772 10.277 -6.397 44 HG3 GLN 6 HG3 GLN 6 -19.467 9.894 -6.712 45 HE21 GLN 6 HE21 GLN 6 -19.396 11.832 -8.091 46 HE22 GLN 6 HE22 GLN 6 -19.565 13.430 -7.391 47 H THR 7 H THR 7 -19.837 7.264 -2.596 48 HA THR 7 HA THR 7 -18.021 8.051 -0.490 49 HB THR 7 HB THR 7 -20.239 6.029 -0.584 50 HG1 THR 7 HG1 THR 7 -20.041 8.776 -0.432 51 HG21 THR 7 HG21 THR 7 -18.855 5.556 1.295 52 HG22 THR 7 HG22 THR 7 -20.298 6.392 1.898 53 HG23 THR 7 HG23 THR 7 -18.720 7.267 1.735 54 H LEU 8 H LEU 8 -18.346 5.042 -2.446 55 HA LEU 8 HA LEU 8 -16.746 3.296 -0.949 56 HB2 LEU 8 HB2 LEU 8 -16.224 3.572 -3.891 57 HB3 LEU 8 HB3 LEU 8 -16.280 2.136 -2.886 58 HG LEU 8 HG LEU 8 -18.607 3.813 -3.926 59 HD11 LEU 8 HD11 LEU 8 -19.072 1.978 -5.438 60 HD12 LEU 8 HD12 LEU 8 -17.793 0.971 -4.691 61 HD13 LEU 8 HD13 LEU 8 -17.382 2.417 -5.621 62 HD21 LEU 8 HD21 LEU 8 -19.328 2.891 -1.857 63 HD22 LEU 8 HD22 LEU 8 -18.639 1.297 -2.240 64 HD23 LEU 8 HD23 LEU 8 -20.061 1.919 -3.125 65 H ASP 9 H ASP 9 -15.830 6.167 -2.815 66 HA ASP 9 HA ASP 9 -13.084 5.815 -3.251 67 HB2 ASP 9 HB2 ASP 9 -14.416 7.693 -4.109 68 HB3 ASP 9 HB3 ASP 9 -14.501 8.362 -2.467 69 H LYS 10 H LYS 10 -14.770 7.087 -0.315 70 HA LYS 10 HA LYS 10 -12.256 7.538 1.085 71 HB2 LYS 10 HB2 LYS 10 -13.452 8.253 2.909 72 HB3 LYS 10 HB3 LYS 10 -14.513 8.682 1.559 73 HG2 LYS 10 HG2 LYS 10 -15.921 6.807 1.986 74 HG3 LYS 10 HG3 LYS 10 -14.872 6.181 3.269 75 HD2 LYS 10 HD2 LYS 10 -16.317 8.833 3.336 76 HD3 LYS 10 HD3 LYS 10 -16.960 7.283 3.943 77 HE2 LYS 10 HE2 LYS 10 -14.946 7.015 5.377 78 HE3 LYS 10 HE3 LYS 10 -14.374 8.613 4.874 79 HZ1 LYS 10 HZ1 LYS 10 -15.560 8.531 6.994 80 HZ2 LYS 10 HZ2 LYS 10 -16.954 8.136 6.267 81 HZ3 LYS 10 HZ3 LYS 10 -16.247 9.599 5.936 82 H LEU 11 H LEU 11 -14.279 4.779 0.594 83 HA LEU 11 HA LEU 11 -13.256 3.236 2.856 84 HB2 LEU 11 HB2 LEU 11 -15.022 2.463 0.488 85 HB3 LEU 11 HB3 LEU 11 -14.413 1.351 1.708 86 HG LEU 11 HG LEU 11 -16.603 1.746 2.255 87 HD11 LEU 11 HD11 LEU 11 -16.614 2.871 4.442 88 HD12 LEU 11 HD12 LEU 11 -14.939 3.377 4.186 89 HD13 LEU 11 HD13 LEU 11 -15.391 1.637 4.226 90 HD21 LEU 11 HD21 LEU 11 -17.181 3.743 1.039 91 HD22 LEU 11 HD22 LEU 11 -16.110 4.708 2.049 92 HD23 LEU 11 HD23 LEU 11 -17.580 4.010 2.724 93 H ARG 12 H ARG 12 -12.868 3.117 -0.743 94 HA ARG 12 HA ARG 12 -10.910 1.071 -0.658 95 HB2 ARG 12 HB2 ARG 12 -10.142 1.986 -2.943 96 HB3 ARG 12 HB3 ARG 12 -11.695 1.284 -2.704 97 HG2 ARG 12 HG2 ARG 12 -12.671 3.046 -3.625 98 HG3 ARG 12 HG3 ARG 12 -12.139 4.044 -2.297 99 HD2 ARG 12 HD2 ARG 12 -10.144 3.611 -4.436 100 HD3 ARG 12 HD3 ARG 12 -11.617 4.555 -4.814 101 HE ARG 12 HE ARG 12 -10.717 5.629 -2.436 102 HH11 ARG 12 HH11 ARG 12 -9.884 5.734 -5.897 103 HH12 ARG 12 HH12 ARG 12 -9.142 7.258 -5.774 104 HH21 ARG 12 HH21 ARG 12 -9.707 7.727 -2.347 105 HH22 ARG 12 HH22 ARG 12 -8.788 8.255 -3.699 106 H GLN 13 H GLN 13 -10.413 4.580 -0.481 107 HA GLN 13 HA GLN 13 -7.604 4.326 -0.435 108 HB2 GLN 13 HB2 GLN 13 -7.522 6.595 0.179 109 HB3 GLN 13 HB3 GLN 13 -8.854 6.347 -0.941 110 HG2 GLN 13 HG2 GLN 13 -9.942 7.668 0.586 111 HG3 GLN 13 HG3 GLN 13 -10.299 6.079 1.184 112 HE21 GLN 13 HE21 GLN 13 -10.508 6.438 3.381 113 HE22 GLN 13 HE22 GLN 13 -9.136 6.885 4.382 114 H ALA 14 H ALA 14 -9.973 3.826 2.200 115 HA ALA 14 HA ALA 14 -8.011 3.843 4.296 116 HB1 ALA 14 HB1 ALA 14 -10.403 4.170 4.744 117 HB2 ALA 14 HB2 ALA 14 -10.765 2.579 4.066 118 HB3 ALA 14 HB3 ALA 14 -9.844 2.702 5.573 119 H VAL 15 H VAL 15 -9.399 1.357 2.112 120 HA VAL 15 HA VAL 15 -8.012 -0.846 3.350 121 HB VAL 15 HB VAL 15 -9.233 -0.728 0.565 122 HG11 VAL 15 HG11 VAL 15 -8.678 -3.100 2.405 123 HG12 VAL 15 HG12 VAL 15 -9.493 -3.172 0.832 124 HG13 VAL 15 HG13 VAL 15 -7.791 -2.717 0.917 125 HG21 VAL 15 HG21 VAL 15 -10.512 -1.300 3.259 126 HG22 VAL 15 HG22 VAL 15 -11.032 -0.169 1.988 127 HG23 VAL 15 HG23 VAL 15 -11.166 -1.877 1.725 128 H LEU 16 H LEU 16 -7.282 1.397 0.702 129 HA LEU 16 HA LEU 16 -4.936 -0.067 -0.125 130 HB2 LEU 16 HB2 LEU 16 -4.520 1.442 -1.725 131 HB3 LEU 16 HB3 LEU 16 -6.241 1.635 -1.495 132 HG LEU 16 HG LEU 16 -5.594 3.658 -0.008 133 HD11 LEU 16 HD11 LEU 16 -3.605 4.850 -0.733 134 HD12 LEU 16 HD12 LEU 16 -3.101 3.455 -1.718 135 HD13 LEU 16 HD13 LEU 16 -3.185 3.332 0.053 136 HD21 LEU 16 HD21 LEU 16 -5.177 3.963 -3.006 137 HD22 LEU 16 HD22 LEU 16 -5.857 5.124 -1.870 138 HD23 LEU 16 HD23 LEU 16 -6.781 3.683 -2.290 139 H GLN 17 H GLN 17 -5.448 2.590 2.279 140 HA GLN 17 HA GLN 17 -2.759 3.031 2.884 141 HB2 GLN 17 HB2 GLN 17 -5.291 3.279 4.525 142 HB3 GLN 17 HB3 GLN 17 -3.707 3.524 5.274 143 HG2 GLN 17 HG2 GLN 17 -3.136 5.223 3.587 144 HG3 GLN 17 HG3 GLN 17 -4.721 5.033 2.837 145 HE21 GLN 17 HE21 GLN 17 -5.945 6.868 3.365 146 HE22 GLN 17 HE22 GLN 17 -5.808 7.722 4.876 147 H LYS 18 H LYS 18 -4.873 0.441 4.536 148 HA LYS 18 HA LYS 18 -2.650 -0.418 6.096 149 HB2 LYS 18 HB2 LYS 18 -4.032 -2.430 6.486 150 HB3 LYS 18 HB3 LYS 18 -4.980 -0.948 6.655 151 HG2 LYS 18 HG2 LYS 18 -5.644 -1.248 4.233 152 HG3 LYS 18 HG3 LYS 18 -4.969 -2.886 4.274 153 HD2 LYS 18 HD2 LYS 18 -7.144 -1.651 5.915 154 HD3 LYS 18 HD3 LYS 18 -7.408 -2.682 4.499 155 HE2 LYS 18 HE2 LYS 18 -6.206 -3.510 7.199 156 HE3 LYS 18 HE3 LYS 18 -7.741 -4.063 6.500 157 HZ1 LYS 18 HZ1 LYS 18 -6.095 -5.729 6.300 158 HZ2 LYS 18 HZ2 LYS 18 -4.982 -4.784 5.576 159 HZ3 LYS 18 HZ3 LYS 18 -6.345 -5.193 4.763 160 H LYS 19 H LYS 19 -3.793 -1.390 2.833 161 HA LYS 19 HA LYS 19 -2.131 -3.611 2.488 162 HB2 LYS 19 HB2 LYS 19 -3.437 -1.653 0.616 163 HB3 LYS 19 HB3 LYS 19 -2.238 -2.757 -0.047 164 HG2 LYS 19 HG2 LYS 19 -3.445 -4.690 0.575 165 HG3 LYS 19 HG3 LYS 19 -4.517 -3.801 1.663 166 HD2 LYS 19 HD2 LYS 19 -5.720 -2.804 -0.095 167 HD3 LYS 19 HD3 LYS 19 -4.558 -3.225 -1.334 168 HE2 LYS 19 HE2 LYS 19 -6.049 -5.316 0.295 169 HE3 LYS 19 HE3 LYS 19 -6.739 -4.639 -1.180 170 HZ1 LYS 19 HZ1 LYS 19 -5.259 -5.717 -2.487 171 HZ2 LYS 19 HZ2 LYS 19 -5.363 -6.778 -1.260 172 HZ3 LYS 19 HZ3 LYS 19 -4.057 -5.795 -1.345 173 H ILE 20 H ILE 20 -1.182 -0.141 2.385 174 HA ILE 20 HA ILE 20 1.243 -0.605 1.029 175 HB ILE 20 HB ILE 20 0.906 1.504 3.163 176 HG12 ILE 20 HG12 ILE 20 -0.977 1.970 1.869 177 HG13 ILE 20 HG13 ILE 20 0.259 3.007 1.209 178 HG21 ILE 20 HG21 ILE 20 2.496 2.731 1.627 179 HG22 ILE 20 HG22 ILE 20 3.178 1.290 2.369 180 HG23 ILE 20 HG23 ILE 20 2.657 1.243 0.678 181 HD11 ILE 20 HD11 ILE 20 -0.925 2.141 -0.653 182 HD12 ILE 20 HD12 ILE 20 0.591 1.205 -0.602 183 HD13 ILE 20 HD13 ILE 20 -0.908 0.486 -0.044 184 H LYS 21 H LYS 21 0.438 -0.833 4.514 185 HA LYS 21 HA LYS 21 3.084 -1.395 5.491 186 HB2 LYS 21 HB2 LYS 21 0.498 -2.575 6.585 187 HB3 LYS 21 HB3 LYS 21 1.990 -2.254 7.445 188 HG2 LYS 21 HG2 LYS 21 1.571 0.219 7.146 189 HG3 LYS 21 HG3 LYS 21 0.005 -0.162 6.418 190 HD2 LYS 21 HD2 LYS 21 0.850 -1.139 9.177 191 HD3 LYS 21 HD3 LYS 21 -0.008 0.387 8.924 192 HE2 LYS 21 HE2 LYS 21 -1.964 -0.670 8.100 193 HE3 LYS 21 HE3 LYS 21 -1.139 -2.216 7.843 194 HZ1 LYS 21 HZ1 LYS 21 -2.542 -2.229 9.828 195 HZ2 LYS 21 HZ2 LYS 21 -1.674 -1.023 10.497 196 HZ3 LYS 21 HZ3 LYS 21 -0.976 -2.485 10.220 197 H GLU 22 H GLU 22 0.623 -3.323 3.890 198 HA GLU 22 HA GLU 22 1.760 -5.884 4.737 199 HB2 GLU 22 HB2 GLU 22 -0.542 -5.224 2.843 200 HB3 GLU 22 HB3 GLU 22 -0.056 -6.855 3.353 201 HG2 GLU 22 HG2 GLU 22 -0.365 -6.229 5.718 202 HG3 GLU 22 HG3 GLU 22 -0.809 -4.601 5.283 203 H ARG 23 H ARG 23 1.525 -4.065 1.632 204 HA ARG 23 HA ARG 23 3.169 -5.895 0.230 205 HB2 ARG 23 HB2 ARG 23 3.415 -4.242 -1.506 206 HB3 ARG 23 HB3 ARG 23 1.752 -4.376 -0.963 207 HG2 ARG 23 HG2 ARG 23 1.901 -2.106 -1.150 208 HG3 ARG 23 HG3 ARG 23 2.341 -2.313 0.515 209 HD2 ARG 23 HD2 ARG 23 3.753 -0.664 -0.685 210 HD3 ARG 23 HD3 ARG 23 4.678 -1.953 0.044 211 HE ARG 23 HE ARG 23 3.898 -2.001 -2.849 212 HH11 ARG 23 HH11 ARG 23 6.405 -2.540 -0.420 213 HH12 ARG 23 HH12 ARG 23 7.685 -2.812 -1.544 214 HH21 ARG 23 HH21 ARG 23 5.724 -2.234 -4.447 215 HH22 ARG 23 HH22 ARG 23 7.204 -2.792 -3.865 216 H ILE 24 H ILE 24 4.120 -3.307 2.400 217 HA ILE 24 HA ILE 24 6.890 -3.310 1.440 218 HB ILE 24 HB ILE 24 5.786 -1.285 2.360 219 HG12 ILE 24 HG12 ILE 24 8.291 -2.324 3.728 220 HG13 ILE 24 HG13 ILE 24 8.143 -1.252 2.320 221 HG21 ILE 24 HG21 ILE 24 6.016 -2.493 5.139 222 HG22 ILE 24 HG22 ILE 24 5.210 -0.990 4.634 223 HG23 ILE 24 HG23 ILE 24 4.540 -2.539 4.174 224 HD11 ILE 24 HD11 ILE 24 8.732 0.120 4.183 225 HD12 ILE 24 HD12 ILE 24 6.999 0.418 3.908 226 HD13 ILE 24 HD13 ILE 24 7.524 -0.650 5.229 227 H GLN 25 H GLN 25 5.077 -4.602 4.320 228 HA GLN 25 HA GLN 25 7.470 -5.751 5.401 229 HB2 GLN 25 HB2 GLN 25 5.417 -5.099 6.699 230 HB3 GLN 25 HB3 GLN 25 4.567 -6.502 6.031 231 HG2 GLN 25 HG2 GLN 25 6.471 -7.940 7.003 232 HG3 GLN 25 HG3 GLN 25 7.088 -6.471 7.767 233 HE21 GLN 25 HE21 GLN 25 5.089 -9.186 8.254 234 HE22 GLN 25 HE22 GLN 25 4.124 -8.521 9.554 235 H ASN 26 H ASN 26 4.697 -7.179 3.609 236 HA ASN 26 HA ASN 26 5.834 -9.874 3.715 237 HB2 ASN 26 HB2 ASN 26 3.580 -8.704 2.014 238 HB3 ASN 26 HB3 ASN 26 3.983 -10.394 2.103 239 HD21 ASN 26 HD21 ASN 26 2.875 -7.675 4.141 240 HD22 ASN 26 HD22 ASN 26 2.037 -8.667 5.322 241 H SER 27 H SER 27 5.259 -7.465 1.096 242 HA SER 27 HA SER 27 6.114 -7.191 -0.911 243 HB2 SER 27 HB2 SER 27 7.967 -6.392 0.726 244 HB3 SER 27 HB3 SER 27 8.862 -7.826 0.212 245 HG SER 27 HG SER 27 9.072 -7.009 -1.787 246 H LEU 28 H LEU 28 5.145 -9.796 -0.393 247 HA LEU 28 HA LEU 28 6.571 -11.332 -2.491 248 HB2 LEU 28 HB2 LEU 28 6.342 -13.378 -1.064 249 HB3 LEU 28 HB3 LEU 28 7.382 -12.143 -0.407 250 HG LEU 28 HG LEU 28 5.486 -11.391 1.062 251 HD11 LEU 28 HD11 LEU 28 3.519 -12.184 0.119 252 HD12 LEU 28 HD12 LEU 28 3.744 -13.130 1.572 253 HD13 LEU 28 HD13 LEU 28 4.136 -13.841 -0.024 254 HD21 LEU 28 HD21 LEU 28 6.591 -14.148 1.488 255 HD22 LEU 28 HD22 LEU 28 5.809 -13.146 2.731 256 HD23 LEU 28 HD23 LEU 28 7.311 -12.616 1.972 257 H SER 29 H SER 29 5.179 -13.472 -2.745 258 HA SER 29 HA SER 29 2.385 -12.687 -3.461 259 HB2 SER 29 HB2 SER 29 4.584 -14.249 -4.845 260 HB3 SER 29 HB3 SER 29 2.906 -14.591 -5.207 261 HG SER 29 HG SER 29 4.381 -12.204 -5.593 262 H THR 30 H THR 30 4.474 -15.494 -2.473 263 HA THR 30 HA THR 30 2.169 -16.692 -1.120 264 HB THR 30 HB THR 30 1.842 -17.347 -3.425 265 HG1 THR 30 HG1 THR 30 2.604 -19.303 -1.591 266 HG21 THR 30 HG21 THR 30 4.104 -17.262 -4.337 267 HG22 THR 30 HG22 THR 30 3.421 -18.870 -4.582 268 HG23 THR 30 HG23 THR 30 4.601 -18.615 -3.295 269 H GLU 31 H GLU 31 4.757 -15.586 -0.294 270 HA GLU 31 HA GLU 31 6.555 -16.097 1.043 271 HB2 GLU 31 HB2 GLU 31 5.064 -18.630 1.778 272 HB3 GLU 31 HB3 GLU 31 6.289 -17.764 2.706 273 HG2 GLU 31 HG2 GLU 31 4.719 -15.776 2.797 274 HG3 GLU 31 HG3 GLU 31 3.497 -16.775 1.986 275 H LYS 32 H LYS 32 6.776 -16.751 -1.708 276 HA LYS 32 HA LYS 32 8.089 -19.309 -2.034 277 HB2 LYS 32 HB2 LYS 32 6.810 -17.828 -3.723 278 HB3 LYS 32 HB3 LYS 32 8.264 -16.830 -3.807 279 HG2 LYS 32 HG2 LYS 32 9.471 -18.442 -4.949 280 HG3 LYS 32 HG3 LYS 32 8.538 -19.779 -4.278 281 HD2 LYS 32 HD2 LYS 32 7.353 -17.796 -6.268 282 HD3 LYS 32 HD3 LYS 32 8.173 -19.284 -6.754 283 HE2 LYS 32 HE2 LYS 32 5.634 -19.068 -5.089 284 HE3 LYS 32 HE3 LYS 32 5.774 -19.599 -6.764 285 HZ1 LYS 32 HZ1 LYS 32 7.301 -21.400 -5.753 286 HZ2 LYS 32 HZ2 LYS 32 5.658 -21.546 -5.554 287 HZ3 LYS 32 HZ3 LYS 32 6.576 -20.996 -4.330 288 H TYR 33 H TYR 33 10.467 -19.286 -2.983 289 HA TYR 33 HA TYR 33 12.139 -18.091 -0.949 290 HB2 TYR 33 HB2 TYR 33 12.664 -19.815 -3.394 291 HB3 TYR 33 HB3 TYR 33 13.984 -19.182 -2.441 292 HD1 TYR 33 HD1 TYR 33 12.934 -19.454 0.389 293 HD2 TYR 33 HD2 TYR 33 12.948 -22.172 -2.987 294 HE1 TYR 33 HE1 TYR 33 12.896 -21.332 1.917 295 HE2 TYR 33 HE2 TYR 33 12.862 -24.081 -1.422 296 HH TYR 33 HH TYR 33 13.188 -23.595 2.112 297 H GLY 34 H GLY 34 14.405 -17.255 -1.974 298 HA2 GLY 34 HA2 GLY 34 14.545 -15.557 -4.137 299 HA3 GLY 34 HA3 GLY 34 13.966 -14.568 -2.778 300 H SER 35 H SER 35 16.597 -14.339 -4.027 301 HA SER 35 HA SER 35 18.274 -14.186 -1.755 302 HB2 SER 35 HB2 SER 35 18.350 -16.714 -2.069 303 HB3 SER 35 HB3 SER 35 19.055 -16.433 -3.662 304 HG SER 35 HG SER 35 20.640 -16.799 -2.263 305 H GLY 36 H GLY 36 19.903 -12.779 -2.225 306 HA2 GLY 36 HA2 GLY 36 20.805 -12.222 -5.003 307 HA3 GLY 36 HA3 GLY 36 20.258 -10.929 -3.925 308 H SER 37 H SER 37 22.903 -10.760 -4.776 309 HA SER 37 HA SER 37 24.408 -11.318 -2.288 310 HB2 SER 37 HB2 SER 37 24.756 -13.048 -4.175 311 HB3 SER 37 HB3 SER 37 25.639 -11.765 -5.022 312 HG SER 37 HG SER 37 26.757 -13.315 -3.489 313 H GLY 38 H GLY 38 26.476 -10.021 -2.321 314 HA2 GLY 38 HA2 GLY 38 25.852 -7.232 -3.159 315 HA3 GLY 38 HA3 GLY 38 27.005 -7.725 -1.919 316 H SER 39 H SER 39 27.822 -5.848 -3.687 317 HA SER 39 HA SER 39 29.545 -7.317 -5.644 318 HB2 SER 39 HB2 SER 39 28.733 -4.397 -5.728 319 HB3 SER 39 HB3 SER 39 29.698 -5.292 -6.909 320 HG SER 39 HG SER 39 26.950 -5.382 -6.392 321 H GLY 40 H GLY 40 30.277 -4.000 -4.607 322 HA2 GLY 40 HA2 GLY 40 31.863 -4.250 -2.412 323 HA3 GLY 40 HA3 GLY 40 32.910 -4.697 -3.786 324 H SER 41 H SER 41 33.957 -2.535 -2.959 325 HA SER 41 HA SER 41 32.967 -0.311 -4.608 326 HB2 SER 41 HB2 SER 41 33.796 -0.021 -1.684 327 HB3 SER 41 HB3 SER 41 33.274 1.273 -2.779 328 HG SER 41 HG SER 41 31.504 0.684 -1.557 329 H GLY 42 H GLY 42 34.856 1.445 -4.611 330 HA2 GLY 42 HA2 GLY 42 37.505 0.076 -4.582 331 HA3 GLY 42 HA3 GLY 42 36.953 1.099 -5.918 332 H SER 43 H SER 43 39.315 1.725 -4.657 333 HA SER 43 HA SER 43 38.996 3.650 -2.532 334 HB2 SER 43 HB2 SER 43 41.500 3.965 -3.193 335 HB3 SER 43 HB3 SER 43 40.995 2.394 -2.553 336 HG SER 43 HG SER 43 41.390 3.059 -5.287 337 H GLY 44 H GLY 44 39.846 5.913 -2.785 338 HA2 GLY 44 HA2 GLY 44 39.111 7.131 -5.407 339 HA3 GLY 44 HA3 GLY 44 38.818 7.862 -3.815 340 H SER 45 H SER 45 40.415 8.999 -5.990 341 HA SER 45 HA SER 45 43.224 8.725 -5.241 342 HB2 SER 45 HB2 SER 45 42.487 8.992 -7.585 343 HB3 SER 45 HB3 SER 45 41.805 10.583 -7.200 344 HG SER 45 HG SER 45 43.855 11.303 -6.718 345 H GLY 46 H GLY 46 42.651 9.337 -2.877 346 HA2 GLY 46 HA2 GLY 46 43.615 11.878 -2.251 347 HA3 GLY 46 HA3 GLY 46 41.841 11.991 -2.229 348 H SER 47 H SER 47 42.365 12.430 0.193 349 HA SER 47 HA SER 47 42.080 9.932 1.663 350 HB2 SER 47 HB2 SER 47 43.778 10.826 3.368 351 HB3 SER 47 HB3 SER 47 44.414 10.090 1.893 352 HG SER 47 HG SER 47 44.841 12.103 1.071 353 H GLY 48 H GLY 48 41.329 10.449 3.931 354 HA2 GLY 48 HA2 GLY 48 40.564 12.617 5.186 355 HA3 GLY 48 HA3 GLY 48 39.363 12.606 3.867 356 H SER 49 H SER 49 37.824 12.186 5.871 357 HA SER 49 HA SER 49 37.270 9.380 5.932 358 HB2 SER 49 HB2 SER 49 39.091 9.993 7.828 359 HB3 SER 49 HB3 SER 49 37.647 10.564 8.683 360 HG SER 49 HG SER 49 38.287 7.988 7.707 361 H GLY 50 H GLY 50 35.223 9.030 7.196 362 HA2 GLY 50 HA2 GLY 50 33.474 10.668 8.372 363 HA3 GLY 50 HA3 GLY 50 33.285 11.127 6.661 364 H SER 51 H SER 51 31.161 9.856 8.081 365 HA SER 51 HA SER 51 30.457 7.719 6.397 366 HB2 SER 51 HB2 SER 51 32.097 6.514 7.964 367 HB3 SER 51 HB3 SER 51 31.043 6.971 9.306 368 HG SER 51 HG SER 51 30.585 4.902 8.625 369 H GLY 52 H GLY 52 28.143 7.074 7.092 370 HA2 GLY 52 HA2 GLY 52 26.756 7.904 9.288 371 HA3 GLY 52 HA3 GLY 52 26.759 9.356 8.271 372 H SER 53 H SER 53 24.349 8.425 8.842 373 HA SER 53 HA SER 53 23.077 7.890 6.388 374 HB2 SER 53 HB2 SER 53 23.411 5.573 8.332 375 HB3 SER 53 HB3 SER 53 21.965 5.711 7.314 376 HG SER 53 HG SER 53 24.604 5.860 6.302 377 H GLY 54 H GLY 54 20.689 7.851 6.737 378 HA2 GLY 54 HA2 GLY 54 19.507 8.383 9.287 379 HA3 GLY 54 HA3 GLY 54 19.681 9.823 8.261 380 H SER 55 H SER 55 17.123 8.902 8.852 381 HA SER 55 HA SER 55 15.976 8.306 6.239 382 HB2 SER 55 HB2 SER 55 15.540 6.381 8.578 383 HB3 SER 55 HB3 SER 55 14.768 6.275 7.003 384 HG SER 55 HG SER 55 16.943 6.001 6.127 385 H GLY 56 H GLY 56 13.479 8.187 6.512 386 HA2 GLY 56 HA2 GLY 56 12.060 8.861 8.811 387 HA3 GLY 56 HA3 GLY 56 12.536 10.389 8.047 388 H SER 57 H SER 57 9.922 9.880 8.219 389 HA SER 57 HA SER 57 8.621 10.552 6.146 390 HB2 SER 57 HB2 SER 57 7.598 8.605 4.957 391 HB3 SER 57 HB3 SER 57 9.280 8.922 4.566 392 HG SER 57 HG SER 57 9.423 6.880 4.935 393 H GLY 58 H GLY 58 6.412 10.581 6.372 394 HA2 GLY 58 HA2 GLY 58 5.376 9.507 8.975 395 HA3 GLY 58 HA3 GLY 58 4.807 10.962 8.149 396 H TYR 59 H TYR 59 4.095 10.500 5.782 397 HA TYR 59 HA TYR 59 2.005 8.423 5.862 398 HB2 TYR 59 HB2 TYR 59 2.553 10.659 3.859 399 HB3 TYR 59 HB3 TYR 59 1.095 9.669 3.950 400 HD1 TYR 59 HD1 TYR 59 -0.400 9.810 5.960 401 HD2 TYR 59 HD2 TYR 59 2.818 12.599 5.308 402 HE1 TYR 59 HE1 TYR 59 -1.318 11.267 7.739 403 HE2 TYR 59 HE2 TYR 59 1.907 14.071 7.068 404 HH TYR 59 HH TYR 59 -0.848 13.081 9.129 405 H GLN3288 H GLN3288 1.677 7.781 3.202 406 HA GLN3288 HA GLN3288 3.610 5.759 2.806 407 HB2 GLN3288 HB2 GLN3288 2.569 5.365 0.669 408 HB3 GLN3288 HB3 GLN3288 1.310 5.765 1.821 409 HG2 GLN3288 HG2 GLN3288 1.438 8.185 0.917 410 HG3 GLN3288 HG3 GLN3288 2.487 7.562 -0.363 411 HE21 GLN3288 HE21 GLN3288 1.520 6.331 -2.095 412 HE22 GLN3288 HE22 GLN3288 -0.225 6.182 -2.185 413 H ILE3289 H ILE3289 5.190 5.532 1.139 414 HA ILE3289 HA ILE3289 6.665 8.007 0.630 415 HB ILE3289 HB ILE3289 7.580 5.140 0.305 416 HG12 ILE3289 HG12 ILE3289 8.005 7.096 2.620 417 HG13 ILE3289 HG13 ILE3289 6.984 5.659 2.679 418 HG21 ILE3289 HG21 ILE3289 9.826 6.208 0.238 419 HG22 ILE3289 HG22 ILE3289 8.798 6.825 -1.048 420 HG23 ILE3289 HG23 ILE3289 9.075 7.811 0.403 421 HD11 ILE3289 HD11 ILE3289 9.995 5.692 2.405 422 HD12 ILE3289 HD12 ILE3289 9.016 5.100 3.754 423 HD13 ILE3289 HD13 ILE3289 8.986 4.237 2.202 424 H GLU3290 H GLU3290 5.807 8.988 -1.055 425 HA GLU3290 HA GLU3290 4.616 7.760 -3.340 426 HB2 GLU3290 HB2 GLU3290 4.126 9.960 -2.229 427 HB3 GLU3290 HB3 GLU3290 5.599 10.617 -2.943 428 HG2 GLU3290 HG2 GLU3290 4.696 10.545 -5.133 429 HG3 GLU3290 HG3 GLU3290 3.466 9.349 -4.691 430 H THR3291 H THR3291 7.833 8.126 -2.529 431 HA THR3291 HA THR3291 8.718 7.792 -5.353 432 HB THR3291 HB THR3291 9.170 10.007 -4.667 433 HG1 THR3291 HG1 THR3291 11.074 8.411 -5.434 434 HG21 THR3291 HG21 THR3291 10.534 8.921 -2.182 435 HG22 THR3291 HG22 THR3291 9.124 10.000 -2.279 436 HG23 THR3291 HG23 THR3291 10.712 10.578 -2.785 437 H PHE3292 H PHE3292 8.018 5.503 -4.296 438 HA PHE3292 HA PHE3292 10.520 4.119 -3.915 439 HB2 PHE3292 HB2 PHE3292 10.158 4.910 -1.623 440 HB3 PHE3292 HB3 PHE3292 8.535 4.226 -1.606 441 HD1 PHE3292 HD1 PHE3292 11.796 2.683 -2.808 442 HD2 PHE3292 HD2 PHE3292 8.676 2.696 0.166 443 HE1 PHE3292 HE1 PHE3292 12.727 0.645 -1.842 444 HE2 PHE3292 HE2 PHE3292 9.615 0.603 1.147 445 HZ PHE3292 HZ PHE3292 11.637 -0.424 0.160 446 H PHE3293 H PHE3293 7.078 3.558 -3.044 447 HA PHE3293 HA PHE3293 7.007 1.227 -4.920 448 HB2 PHE3293 HB2 PHE3293 5.153 0.458 -3.260 449 HB3 PHE3293 HB3 PHE3293 6.842 0.249 -2.915 450 HD1 PHE3293 HD1 PHE3293 6.978 0.227 -0.542 451 HD2 PHE3293 HD2 PHE3293 4.725 3.365 -2.482 452 HE1 PHE3293 HE1 PHE3293 6.726 1.420 1.623 453 HE2 PHE3293 HE2 PHE3293 4.544 4.538 -0.385 454 HZ PHE3293 HZ PHE3293 5.526 3.597 1.719 455 H ALA3294 H ALA3294 6.135 4.280 -5.101 456 HA ALA3294 HA ALA3294 3.407 4.524 -5.287 457 HB1 ALA3294 HB1 ALA3294 5.541 5.805 -7.013 458 HB2 ALA3294 HB2 ALA3294 3.858 6.348 -6.860 459 HB3 ALA3294 HB3 ALA3294 4.904 6.358 -5.441 460 H GLN3295 H GLN3295 5.498 2.874 -7.638 461 HA GLN3295 HA GLN3295 3.433 2.868 -9.731 462 HB2 GLN3295 HB2 GLN3295 5.828 1.032 -9.441 463 HB3 GLN3295 HB3 GLN3295 4.891 1.313 -10.911 464 HG2 GLN3295 HG2 GLN3295 6.568 3.388 -9.448 465 HG3 GLN3295 HG3 GLN3295 7.035 2.548 -10.912 466 HE21 GLN3295 HE21 GLN3295 4.579 4.963 -9.650 467 HE22 GLN3295 HE22 GLN3295 4.282 5.642 -11.226 468 H ASP3296 H ASP3296 4.249 0.793 -7.035 469 HA ASP3296 HA ASP3296 2.493 -1.407 -7.993 470 HB2 ASP3296 HB2 ASP3296 3.905 -0.940 -5.328 471 HB3 ASP3296 HB3 ASP3296 2.876 -2.335 -5.704 472 H ILE3297 H ILE3297 2.492 1.302 -5.846 473 HA ILE3297 HA ILE3297 0.188 0.876 -4.294 474 HB ILE3297 HB ILE3297 2.053 3.023 -4.923 475 HG12 ILE3297 HG12 ILE3297 1.744 3.668 -2.613 476 HG13 ILE3297 HG13 ILE3297 0.329 2.619 -2.486 477 HG21 ILE3297 HG21 ILE3297 -0.786 3.957 -4.454 478 HG22 ILE3297 HG22 ILE3297 0.670 4.965 -4.284 479 HG23 ILE3297 HG23 ILE3297 0.252 4.291 -5.857 480 HD11 ILE3297 HD11 ILE3297 1.738 0.623 -2.692 481 HD12 ILE3297 HD12 ILE3297 3.130 1.616 -3.147 482 HD13 ILE3297 HD13 ILE3297 2.512 1.709 -1.517 483 H GLU3298 H GLU3298 0.562 2.466 -7.486 484 HA GLU3298 HA GLU3298 -2.211 3.146 -7.672 485 HB2 GLU3298 HB2 GLU3298 -1.789 3.443 -10.074 486 HB3 GLU3298 HB3 GLU3298 -0.682 4.337 -9.040 487 HG2 GLU3298 HG2 GLU3298 1.162 3.153 -9.681 488 HG3 GLU3298 HG3 GLU3298 0.281 1.655 -9.929 489 H SER3299 H SER3299 -0.362 0.319 -8.549 490 HA SER3299 HA SER3299 -2.457 -0.971 -10.056 491 HB2 SER3299 HB2 SER3299 0.045 -1.433 -10.139 492 HB3 SER3299 HB3 SER3299 -0.166 -2.403 -8.678 493 HG SER3299 HG SER3299 -0.327 -3.694 -10.496 494 H VAL3300 H VAL3300 -1.393 -1.341 -6.629 495 HA VAL3300 HA VAL3300 -3.433 -3.305 -6.123 496 HB VAL3300 HB VAL3300 -1.302 -3.096 -4.856 497 HG11 VAL3300 HG11 VAL3300 -1.088 -1.617 -2.966 498 HG12 VAL3300 HG12 VAL3300 -1.261 -0.696 -4.458 499 HG13 VAL3300 HG13 VAL3300 -2.641 -0.826 -3.342 500 HG21 VAL3300 HG21 VAL3300 -2.350 -3.695 -2.657 501 HG22 VAL3300 HG22 VAL3300 -3.924 -3.227 -3.373 502 HG23 VAL3300 HG23 VAL3300 -2.993 -4.556 -4.069 503 H GLN3301 H GLN3301 -3.340 0.291 -5.742 504 HA GLN3301 HA GLN3301 -5.971 0.258 -4.544 505 HB2 GLN3301 HB2 GLN3301 -5.996 2.552 -4.579 506 HB3 GLN3301 HB3 GLN3301 -4.385 2.017 -4.093 507 HG2 GLN3301 HG2 GLN3301 -3.513 3.404 -5.609 508 HG3 GLN3301 HG3 GLN3301 -4.214 2.381 -6.872 509 HE21 GLN3301 HE21 GLN3301 -6.603 2.941 -7.450 510 HE22 GLN3301 HE22 GLN3301 -7.059 4.601 -7.416 511 H LYS3302 H LYS3302 -4.830 0.236 -7.887 512 HA LYS3302 HA LYS3302 -7.238 1.006 -9.148 513 HB2 LYS3302 HB2 LYS3302 -4.784 -0.475 -9.981 514 HB3 LYS3302 HB3 LYS3302 -6.193 -0.623 -11.001 515 HG2 LYS3302 HG2 LYS3302 -6.343 1.728 -11.400 516 HG3 LYS3302 HG3 LYS3302 -5.252 2.103 -10.081 517 HD2 LYS3302 HD2 LYS3302 -3.992 2.443 -12.064 518 HD3 LYS3302 HD3 LYS3302 -3.384 0.970 -11.333 519 HE2 LYS3302 HE2 LYS3302 -3.501 0.467 -13.600 520 HE3 LYS3302 HE3 LYS3302 -4.918 -0.336 -12.911 521 HZ1 LYS3302 HZ1 LYS3302 -6.239 1.571 -13.721 522 HZ2 LYS3302 HZ2 LYS3302 -5.411 0.836 -14.953 523 HZ3 LYS3302 HZ3 LYS3302 -4.886 2.257 -14.358 524 H GLU3303 H GLU3303 -6.321 -1.912 -7.503 525 HA GLU3303 HA GLU3303 -8.506 -3.538 -8.605 526 HB2 GLU3303 HB2 GLU3303 -7.456 -5.266 -7.716 527 HB3 GLU3303 HB3 GLU3303 -6.115 -4.155 -7.524 528 HG2 GLU3303 HG2 GLU3303 -7.195 -3.715 -5.147 529 HG3 GLU3303 HG3 GLU3303 -8.074 -5.185 -5.464 530 H LEU3304 H LEU3304 -8.068 -1.462 -5.770 531 HA LEU3304 HA LEU3304 -10.543 -2.182 -4.519 532 HB2 LEU3304 HB2 LEU3304 -8.644 0.172 -4.126 533 HB3 LEU3304 HB3 LEU3304 -9.916 -0.318 -3.025 534 HG LEU3304 HG LEU3304 -7.488 -2.019 -3.746 535 HD11 LEU3304 HD11 LEU3304 -6.807 -0.126 -2.541 536 HD12 LEU3304 HD12 LEU3304 -6.773 -1.501 -1.445 537 HD13 LEU3304 HD13 LEU3304 -8.099 -0.317 -1.334 538 HD21 LEU3304 HD21 LEU3304 -9.729 -2.439 -1.752 539 HD22 LEU3304 HD22 LEU3304 -8.238 -3.407 -1.814 540 HD23 LEU3304 HD23 LEU3304 -9.346 -3.439 -3.180 541 H GLU3305 H GLU3305 -9.621 0.500 -6.677 542 HA GLU3305 HA GLU3305 -11.763 2.244 -6.055 543 HB2 GLU3305 HB2 GLU3305 -11.336 3.192 -8.348 544 HB3 GLU3305 HB3 GLU3305 -9.909 3.063 -7.300 545 HG2 GLU3305 HG2 GLU3305 -9.249 1.012 -8.387 546 HG3 GLU3305 HG3 GLU3305 -10.659 1.018 -9.443 547 H ASN3306 H ASN3306 -11.900 -0.782 -7.778 548 HA ASN3306 HA ASN3306 -14.582 -0.026 -8.799 549 HB2 ASN3306 HB2 ASN3306 -14.441 -1.555 -10.467 550 HB3 ASN3306 HB3 ASN3306 -12.822 -0.877 -10.415 551 HD21 ASN3306 HD21 ASN3306 -11.042 -2.196 -9.552 552 HD22 ASN3306 HD22 ASN3306 -11.289 -3.916 -9.462 553 H LEU3307 H LEU3307 -13.356 -1.371 -6.004 554 HA LEU3307 HA LEU3307 -15.366 -3.536 -5.845 555 HB2 LEU3307 HB2 LEU3307 -13.002 -2.564 -4.303 556 HB3 LEU3307 HB3 LEU3307 -14.335 -3.034 -3.313 557 HG LEU3307 HG LEU3307 -13.475 -5.023 -3.276 558 HD11 LEU3307 HD11 LEU3307 -13.968 -6.633 -4.932 559 HD12 LEU3307 HD12 LEU3307 -14.102 -5.410 -6.223 560 HD13 LEU3307 HD13 LEU3307 -15.316 -5.500 -4.930 561 HD21 LEU3307 HD21 LEU3307 -11.894 -4.581 -5.757 562 HD22 LEU3307 HD22 LEU3307 -11.689 -5.869 -4.537 563 HD23 LEU3307 HD23 LEU3307 -11.355 -4.196 -4.097 564 H SER3308 H SER3308 -16.971 -3.588 -4.149 565 HA SER3308 HA SER3308 -18.368 -1.038 -3.818 566 HB2 SER3308 HB2 SER3308 -19.110 -3.945 -3.251 567 HB3 SER3308 HB3 SER3308 -20.185 -2.562 -2.972 568 HG SER3308 HG SER3308 -19.967 -2.003 -5.164 569 H GLU3309 H GLU3309 -19.555 -0.712 -1.516 570 HA GLU3309 HA GLU3309 -17.445 -0.308 0.367 571 HB2 GLU3309 HB2 GLU3309 -20.504 -0.217 0.531 572 HB3 GLU3309 HB3 GLU3309 -19.557 -0.292 2.013 573 HG2 GLU3309 HG2 GLU3309 -18.208 1.687 0.909 574 HG3 GLU3309 HG3 GLU3309 -19.711 1.912 0.020 575 H GLU3310 H GLU3310 -20.038 -2.775 0.261 576 HA GLU3310 HA GLU3310 -19.391 -4.146 2.496 577 HB2 GLU3310 HB2 GLU3310 -20.252 -5.345 -0.171 578 HB3 GLU3310 HB3 GLU3310 -20.401 -6.140 1.408 579 HG2 GLU3310 HG2 GLU3310 -21.798 -4.199 2.193 580 HG3 GLU3310 HG3 GLU3310 -21.776 -3.554 0.557 581 H GLU3311 H GLU3311 -17.408 -4.056 -0.390 582 HA GLU3311 HA GLU3311 -15.886 -6.484 0.295 583 HB2 GLU3311 HB2 GLU3311 -15.544 -4.302 -1.802 584 HB3 GLU3311 HB3 GLU3311 -14.588 -5.755 -1.703 585 HG2 GLU3311 HG2 GLU3311 -17.540 -6.161 -1.935 586 HG3 GLU3311 HG3 GLU3311 -16.760 -5.413 -3.290 587 H LEU3312 H LEU3312 -15.444 -2.979 -0.021 588 HA LEU3312 HA LEU3312 -12.775 -2.946 1.055 589 HB2 LEU3312 HB2 LEU3312 -14.588 -0.538 0.758 590 HB3 LEU3312 HB3 LEU3312 -12.868 -0.524 0.762 591 HG LEU3312 HG LEU3312 -14.304 -2.060 -1.409 592 HD11 LEU3312 HD11 LEU3312 -14.307 -0.032 -2.776 593 HD12 LEU3312 HD12 LEU3312 -13.964 0.926 -1.317 594 HD13 LEU3312 HD13 LEU3312 -15.452 -0.071 -1.433 595 HD21 LEU3312 HD21 LEU3312 -12.030 -2.514 -1.404 596 HD22 LEU3312 HD22 LEU3312 -11.574 -0.824 -1.133 597 HD23 LEU3312 HD23 LEU3312 -12.265 -1.317 -2.687 598 H LEU3313 H LEU3313 -15.829 -1.638 2.207 599 HA LEU3313 HA LEU3313 -15.118 -0.527 4.662 600 HB2 LEU3313 HB2 LEU3313 -17.241 -0.055 3.491 601 HB3 LEU3313 HB3 LEU3313 -17.749 -1.723 3.720 602 HG LEU3313 HG LEU3313 -18.886 -0.219 5.206 603 HD11 LEU3313 HD11 LEU3313 -18.619 -2.683 5.627 604 HD12 LEU3313 HD12 LEU3313 -19.073 -1.676 7.004 605 HD13 LEU3313 HD13 LEU3313 -17.416 -2.268 6.865 606 HD21 LEU3313 HD21 LEU3313 -17.895 0.542 7.299 607 HD22 LEU3313 HD22 LEU3313 -17.104 1.301 5.923 608 HD23 LEU3313 HD23 LEU3313 -16.302 -0.040 6.784 609 H ALA3314 H ALA3314 -16.069 -3.878 3.711 610 HA ALA3314 HA ALA3314 -16.044 -4.865 6.352 611 HB1 ALA3314 HB1 ALA3314 -15.686 -7.092 5.184 612 HB2 ALA3314 HB2 ALA3314 -17.013 -6.102 4.528 613 HB3 ALA3314 HB3 ALA3314 -15.478 -6.191 3.658 614 H MET3315 H MET3315 -13.310 -4.226 4.174 615 HA MET3315 HA MET3315 -11.403 -5.891 5.648 616 HB2 MET3315 HB2 MET3315 -10.807 -3.633 3.717 617 HB3 MET3315 HB3 MET3315 -9.737 -4.962 4.134 618 HG2 MET3315 HG2 MET3315 -12.335 -5.851 3.093 619 HG3 MET3315 HG3 MET3315 -11.552 -4.778 1.987 620 HE1 MET3315 HE1 MET3315 -11.146 -8.440 0.529 621 HE2 MET3315 HE2 MET3315 -12.463 -7.865 1.573 622 HE3 MET3315 HE3 MET3315 -11.843 -6.825 0.278 623 H LEU3316 H LEU3316 -11.805 -2.419 5.186 624 HA LEU3316 HA LEU3316 -9.850 -1.586 7.118 625 HB2 LEU3316 HB2 LEU3316 -10.904 0.642 6.920 626 HB3 LEU3316 HB3 LEU3316 -10.498 -0.100 5.383 627 HG LEU3316 HG LEU3316 -13.081 -0.901 5.546 628 HD11 LEU3316 HD11 LEU3316 -13.645 0.234 7.680 629 HD12 LEU3316 HD12 LEU3316 -14.433 1.100 6.368 630 HD13 LEU3316 HD13 LEU3316 -12.952 1.754 7.088 631 HD21 LEU3316 HD21 LEU3316 -11.834 0.667 3.860 632 HD22 LEU3316 HD22 LEU3316 -12.732 1.950 4.721 633 HD23 LEU3316 HD23 LEU3316 -13.563 0.611 3.915 634 H ASN3317 H ASN3317 -13.365 -2.278 7.384 635 HA ASN3317 HA ASN3317 -13.456 -1.270 10.118 636 HB2 ASN3317 HB2 ASN3317 -15.375 -1.430 8.369 637 HB3 ASN3317 HB3 ASN3317 -15.472 -3.140 8.814 638 HD21 ASN3317 HD21 ASN3317 -15.829 0.209 9.784 639 HD22 ASN3317 HD22 ASN3317 -16.717 -0.098 11.284 640 H GLY3318 H GLY3318 -12.843 -4.295 8.494 641 HA2 GLY3318 HA2 GLY3318 -11.831 -6.184 9.276 642 HA3 GLY3318 HA3 GLY3318 -11.892 -5.574 10.944 643 H ASP3319 H ASP3319 -14.429 -6.095 8.533 644 HA ASP3319 HA ASP3319 -16.470 -6.950 8.644 645 HB2 ASP3319 HB2 ASP3319 -15.086 -8.658 7.623 646 HB3 ASP3319 HB3 ASP3319 -14.855 -9.430 9.202 647 H GLN3320 H GLN3320 -16.937 -5.664 10.665 648 HA GLN3320 HA GLN3320 -18.147 -7.402 12.636 649 HB2 GLN3320 HB2 GLN3320 -17.022 -6.298 14.494 650 HB3 GLN3320 HB3 GLN3320 -15.882 -7.120 13.416 651 HG2 GLN3320 HG2 GLN3320 -15.247 -4.981 12.393 652 HG3 GLN3320 HG3 GLN3320 -16.343 -4.122 13.477 653 HE21 GLN3320 HE21 GLN3320 -13.194 -4.340 13.130 654 HE22 GLN3320 HE22 GLN3320 -12.702 -4.537 14.827 655 H GLN3321 H GLN3321 -19.223 -5.674 10.564 656 HA GLN3321 HA GLN3321 -20.488 -3.488 12.054 657 HB2 GLN3321 HB2 GLN3321 -19.170 -3.012 9.959 658 HB3 GLN3321 HB3 GLN3321 -20.133 -4.227 9.111 659 HG2 GLN3321 HG2 GLN3321 -20.959 -2.130 8.508 660 HG3 GLN3321 HG3 GLN3321 -22.141 -2.955 9.526 661 HE21 GLN3321 HE21 GLN3321 -19.457 -1.604 11.353 662 HE22 GLN3321 HE22 GLN3321 -20.329 -0.207 11.940 Start of MODEL 16 1 H1 MET 1 H MET 1 -29.936 8.096 0.774 2 HA MET 1 HA MET 1 -30.908 9.481 -1.665 3 HB2 MET 1 HB2 MET 1 -30.493 10.638 1.139 4 HB3 MET 1 HB3 MET 1 -30.888 11.559 -0.306 5 HG2 MET 1 HG2 MET 1 -32.959 10.292 -0.585 6 HG3 MET 1 HG3 MET 1 -32.601 9.348 0.873 7 HE1 MET 1 HE1 MET 1 -32.671 10.254 3.320 8 HE2 MET 1 HE2 MET 1 -31.522 11.571 2.972 9 HE3 MET 1 HE3 MET 1 -33.069 11.928 3.764 10 H ASN 2 H ASN 2 -28.474 9.913 0.994 11 HA ASN 2 HA ASN 2 -26.858 11.505 -0.647 12 HB2 ASN 2 HB2 ASN 2 -26.229 9.916 1.880 13 HB3 ASN 2 HB3 ASN 2 -25.129 11.073 1.163 14 HD21 ASN 2 HD21 ASN 2 -25.293 13.153 1.990 15 HD22 ASN 2 HD22 ASN 2 -26.741 13.744 2.845 16 H ILE 3 H ILE 3 -24.900 11.024 -1.721 17 HA ILE 3 HA ILE 3 -24.870 8.609 -3.159 18 HB ILE 3 HB ILE 3 -23.851 10.864 -3.766 19 HG12 ILE 3 HG12 ILE 3 -21.978 8.545 -4.321 20 HG13 ILE 3 HG13 ILE 3 -23.605 8.617 -5.004 21 HG21 ILE 3 HG21 ILE 3 -21.467 11.242 -3.231 22 HG22 ILE 3 HG22 ILE 3 -22.418 11.166 -1.747 23 HG23 ILE 3 HG23 ILE 3 -21.411 9.788 -2.249 24 HD11 ILE 3 HD11 ILE 3 -21.863 9.495 -6.528 25 HD12 ILE 3 HD12 ILE 3 -23.147 10.666 -6.165 26 HD13 ILE 3 HD13 ILE 3 -21.559 10.826 -5.398 27 H ASN 4 H ASN 4 -23.361 6.917 -3.217 28 HA ASN 4 HA ASN 4 -21.890 6.264 -0.711 29 HB2 ASN 4 HB2 ASN 4 -22.669 3.921 -0.940 30 HB3 ASN 4 HB3 ASN 4 -23.926 5.064 -0.464 31 HD21 ASN 4 HD21 ASN 4 -22.764 3.015 -3.119 32 HD22 ASN 4 HD22 ASN 4 -24.070 3.387 -4.248 33 H GLU 5 H GLU 5 -22.370 5.740 -4.207 34 HA GLU 5 HA GLU 5 -20.139 4.142 -4.805 35 HB2 GLU 5 HB2 GLU 5 -21.526 6.392 -6.305 36 HB3 GLU 5 HB3 GLU 5 -20.234 5.442 -7.054 37 HG2 GLU 5 HG2 GLU 5 -21.443 3.438 -6.977 38 HG3 GLU 5 HG3 GLU 5 -22.566 4.041 -5.775 39 H GLN 6 H GLN 6 -20.383 7.563 -4.293 40 HA GLN 6 HA GLN 6 -17.542 8.040 -4.955 41 HB2 GLN 6 HB2 GLN 6 -19.764 9.888 -4.163 42 HB3 GLN 6 HB3 GLN 6 -18.074 10.399 -3.984 43 HG2 GLN 6 HG2 GLN 6 -17.586 9.923 -6.319 44 HG3 GLN 6 HG3 GLN 6 -19.183 9.218 -6.566 45 HE21 GLN 6 HE21 GLN 6 -18.084 12.349 -5.085 46 HE22 GLN 6 HE22 GLN 6 -19.236 13.323 -5.969 47 H THR 7 H THR 7 -19.524 7.652 -1.974 48 HA THR 7 HA THR 7 -17.557 8.335 -0.128 49 HB THR 7 HB THR 7 -19.708 6.228 0.063 50 HG1 THR 7 HG1 THR 7 -20.768 8.133 1.116 51 HG21 THR 7 HG21 THR 7 -18.147 7.639 2.228 52 HG22 THR 7 HG22 THR 7 -18.228 5.897 1.862 53 HG23 THR 7 HG23 THR 7 -19.653 6.711 2.511 54 H LEU 8 H LEU 8 -17.883 5.270 -1.978 55 HA LEU 8 HA LEU 8 -16.284 3.546 -0.470 56 HB2 LEU 8 HB2 LEU 8 -15.742 3.770 -3.438 57 HB3 LEU 8 HB3 LEU 8 -15.804 2.376 -2.369 58 HG LEU 8 HG LEU 8 -18.262 3.899 -3.312 59 HD11 LEU 8 HD11 LEU 8 -16.956 2.642 -5.133 60 HD12 LEU 8 HD12 LEU 8 -18.639 2.173 -4.912 61 HD13 LEU 8 HD13 LEU 8 -17.327 1.156 -4.251 62 HD21 LEU 8 HD21 LEU 8 -17.891 1.339 -1.749 63 HD22 LEU 8 HD22 LEU 8 -19.413 1.781 -2.557 64 HD23 LEU 8 HD23 LEU 8 -18.776 2.821 -1.285 65 H ASP 9 H ASP 9 -15.347 6.481 -2.316 66 HA ASP 9 HA ASP 9 -12.598 6.168 -2.710 67 HB2 ASP 9 HB2 ASP 9 -13.820 8.098 -3.517 68 HB3 ASP 9 HB3 ASP 9 -14.158 8.611 -1.848 69 H LYS 10 H LYS 10 -14.284 7.495 0.237 70 HA LYS 10 HA LYS 10 -11.792 7.813 1.601 71 HB2 LYS 10 HB2 LYS 10 -12.906 8.364 3.546 72 HB3 LYS 10 HB3 LYS 10 -13.905 9.001 2.236 73 HG2 LYS 10 HG2 LYS 10 -15.451 7.139 2.460 74 HG3 LYS 10 HG3 LYS 10 -14.433 6.384 3.713 75 HD2 LYS 10 HD2 LYS 10 -15.863 9.038 3.975 76 HD3 LYS 10 HD3 LYS 10 -16.423 7.450 4.530 77 HE2 LYS 10 HE2 LYS 10 -15.472 8.021 6.482 78 HE3 LYS 10 HE3 LYS 10 -14.010 7.399 5.721 79 HZ1 LYS 10 HZ1 LYS 10 -14.822 10.241 5.824 80 HZ2 LYS 10 HZ2 LYS 10 -13.419 9.705 5.172 81 HZ3 LYS 10 HZ3 LYS 10 -13.685 9.542 6.787 82 H LEU 11 H LEU 11 -13.771 5.040 1.125 83 HA LEU 11 HA LEU 11 -12.613 3.441 3.272 84 HB2 LEU 11 HB2 LEU 11 -14.485 2.744 0.929 85 HB3 LEU 11 HB3 LEU 11 -13.818 1.604 2.098 86 HG LEU 11 HG LEU 11 -15.981 1.965 2.726 87 HD11 LEU 11 HD11 LEU 11 -15.924 3.059 4.933 88 HD12 LEU 11 HD12 LEU 11 -14.327 3.723 4.573 89 HD13 LEU 11 HD13 LEU 11 -14.581 1.959 4.665 90 HD21 LEU 11 HD21 LEU 11 -15.604 4.939 2.495 91 HD22 LEU 11 HD22 LEU 11 -17.023 4.165 3.228 92 HD23 LEU 11 HD23 LEU 11 -16.652 3.902 1.535 93 H ARG 12 H ARG 12 -12.385 3.396 -0.348 94 HA ARG 12 HA ARG 12 -10.340 1.427 -0.337 95 HB2 ARG 12 HB2 ARG 12 -9.837 2.269 -2.721 96 HB3 ARG 12 HB3 ARG 12 -11.380 1.551 -2.340 97 HG2 ARG 12 HG2 ARG 12 -12.510 3.237 -3.120 98 HG3 ARG 12 HG3 ARG 12 -11.681 4.362 -2.032 99 HD2 ARG 12 HD2 ARG 12 -10.082 4.943 -3.505 100 HD3 ARG 12 HD3 ARG 12 -10.323 3.522 -4.551 101 HE ARG 12 HE ARG 12 -12.696 4.660 -4.910 102 HH11 ARG 12 HH11 ARG 12 -9.491 6.274 -4.891 103 HH12 ARG 12 HH12 ARG 12 -10.003 7.416 -6.103 104 HH21 ARG 12 HH21 ARG 12 -13.398 6.531 -6.075 105 HH22 ARG 12 HH22 ARG 12 -12.241 7.762 -6.439 106 H GLN 13 H GLN 13 -10.011 4.937 -0.295 107 HA GLN 13 HA GLN 13 -7.200 4.958 -0.453 108 HB2 GLN 13 HB2 GLN 13 -7.319 7.250 0.098 109 HB3 GLN 13 HB3 GLN 13 -8.719 6.851 -0.884 110 HG2 GLN 13 HG2 GLN 13 -9.685 8.138 0.756 111 HG3 GLN 13 HG3 GLN 13 -9.905 6.518 1.382 112 HE21 GLN 13 HE21 GLN 13 -9.945 6.827 3.547 113 HE22 GLN 13 HE22 GLN 13 -8.574 7.530 4.427 114 H ALA 14 H ALA 14 -9.351 4.210 2.292 115 HA ALA 14 HA ALA 14 -7.304 4.508 4.329 116 HB1 ALA 14 HB1 ALA 14 -10.062 3.192 4.255 117 HB2 ALA 14 HB2 ALA 14 -9.050 3.309 5.704 118 HB3 ALA 14 HB3 ALA 14 -9.670 4.778 4.923 119 H VAL 15 H VAL 15 -8.864 1.845 2.460 120 HA VAL 15 HA VAL 15 -7.380 -0.241 3.702 121 HB VAL 15 HB VAL 15 -8.691 -0.149 0.990 122 HG11 VAL 15 HG11 VAL 15 -8.706 -2.605 1.061 123 HG12 VAL 15 HG12 VAL 15 -7.033 -2.058 1.157 124 HG13 VAL 15 HG13 VAL 15 -7.869 -2.599 2.624 125 HG21 VAL 15 HG21 VAL 15 -10.388 0.185 2.570 126 HG22 VAL 15 HG22 VAL 15 -10.400 -1.525 2.222 127 HG23 VAL 15 HG23 VAL 15 -9.668 -0.957 3.730 128 H LEU 16 H LEU 16 -6.747 1.629 0.634 129 HA LEU 16 HA LEU 16 -4.418 0.215 0.006 130 HB2 LEU 16 HB2 LEU 16 -3.918 1.748 -1.624 131 HB3 LEU 16 HB3 LEU 16 -5.657 1.742 -1.499 132 HG LEU 16 HG LEU 16 -5.232 3.879 0.012 133 HD11 LEU 16 HD11 LEU 16 -2.683 3.693 -1.650 134 HD12 LEU 16 HD12 LEU 16 -2.815 3.947 0.114 135 HD13 LEU 16 HD13 LEU 16 -3.295 5.210 -1.008 136 HD21 LEU 16 HD21 LEU 16 -4.953 3.842 -3.022 137 HD22 LEU 16 HD22 LEU 16 -5.471 5.218 -2.057 138 HD23 LEU 16 HD23 LEU 16 -6.495 3.787 -2.125 139 H GLN 17 H GLN 17 -4.848 2.848 2.374 140 HA GLN 17 HA GLN 17 -2.107 3.469 2.726 141 HB2 GLN 17 HB2 GLN 17 -4.520 3.674 4.524 142 HB3 GLN 17 HB3 GLN 17 -2.911 3.980 5.154 143 HG2 GLN 17 HG2 GLN 17 -2.569 5.781 3.544 144 HG3 GLN 17 HG3 GLN 17 -4.096 5.424 2.766 145 HE21 GLN 17 HE21 GLN 17 -5.687 6.939 3.416 146 HE22 GLN 17 HE22 GLN 17 -5.728 7.652 5.005 147 H LYS 18 H LYS 18 -4.148 0.781 4.353 148 HA LYS 18 HA LYS 18 -1.837 0.062 5.916 149 HB2 LYS 18 HB2 LYS 18 -2.958 -1.738 6.684 150 HB3 LYS 18 HB3 LYS 18 -4.139 -0.454 6.573 151 HG2 LYS 18 HG2 LYS 18 -4.264 -1.921 4.088 152 HG3 LYS 18 HG3 LYS 18 -4.131 -3.109 5.325 153 HD2 LYS 18 HD2 LYS 18 -6.164 -0.909 5.806 154 HD3 LYS 18 HD3 LYS 18 -6.405 -1.972 4.412 155 HE2 LYS 18 HE2 LYS 18 -7.540 -2.994 6.142 156 HE3 LYS 18 HE3 LYS 18 -6.054 -3.926 5.776 157 HZ1 LYS 18 HZ1 LYS 18 -6.335 -2.103 8.084 158 HZ2 LYS 18 HZ2 LYS 18 -5.074 -3.149 7.725 159 HZ3 LYS 18 HZ3 LYS 18 -6.533 -3.746 8.129 160 H LYS 19 H LYS 19 -3.081 -0.945 2.716 161 HA LYS 19 HA LYS 19 -1.401 -3.118 2.253 162 HB2 LYS 19 HB2 LYS 19 -2.785 -1.124 0.491 163 HB3 LYS 19 HB3 LYS 19 -1.660 -2.272 -0.228 164 HG2 LYS 19 HG2 LYS 19 -2.960 -4.144 0.644 165 HG3 LYS 19 HG3 LYS 19 -4.071 -3.040 1.477 166 HD2 LYS 19 HD2 LYS 19 -4.932 -2.172 -0.568 167 HD3 LYS 19 HD3 LYS 19 -3.645 -2.874 -1.541 168 HE2 LYS 19 HE2 LYS 19 -5.256 -4.808 0.067 169 HE3 LYS 19 HE3 LYS 19 -6.130 -4.004 -1.239 170 HZ1 LYS 19 HZ1 LYS 19 -3.550 -5.350 -1.700 171 HZ2 LYS 19 HZ2 LYS 19 -4.653 -4.881 -2.831 172 HZ3 LYS 19 HZ3 LYS 19 -4.989 -6.126 -1.838 173 H ILE 20 H ILE 20 -0.550 0.388 1.991 174 HA ILE 20 HA ILE 20 1.855 -0.059 0.621 175 HB ILE 20 HB ILE 20 1.691 2.039 2.799 176 HG12 ILE 20 HG12 ILE 20 -0.374 2.432 1.742 177 HG13 ILE 20 HG13 ILE 20 0.746 3.662 1.203 178 HG21 ILE 20 HG21 ILE 20 3.841 1.799 1.663 179 HG22 ILE 20 HG22 ILE 20 3.070 1.949 0.077 180 HG23 ILE 20 HG23 ILE 20 3.094 3.328 1.194 181 HD11 ILE 20 HD11 ILE 20 -0.687 2.822 -0.634 182 HD12 ILE 20 HD12 ILE 20 1.035 2.538 -0.932 183 HD13 ILE 20 HD13 ILE 20 -0.001 1.200 -0.410 184 H LYS 21 H LYS 21 1.138 0.030 4.116 185 HA LYS 21 HA LYS 21 3.709 -0.505 5.156 186 HB2 LYS 21 HB2 LYS 21 1.187 -1.596 6.436 187 HB3 LYS 21 HB3 LYS 21 2.654 -1.001 7.201 188 HG2 LYS 21 HG2 LYS 21 2.030 1.326 6.474 189 HG3 LYS 21 HG3 LYS 21 0.549 0.666 5.769 190 HD2 LYS 21 HD2 LYS 21 -0.014 -0.298 8.060 191 HD3 LYS 21 HD3 LYS 21 1.322 0.694 8.697 192 HE2 LYS 21 HE2 LYS 21 0.251 2.695 7.623 193 HE3 LYS 21 HE3 LYS 21 -1.095 1.665 7.098 194 HZ1 LYS 21 HZ1 LYS 21 -1.714 1.333 9.339 195 HZ2 LYS 21 HZ2 LYS 21 -1.480 2.953 9.172 196 HZ3 LYS 21 HZ3 LYS 21 -0.361 2.045 9.937 197 H GLU 22 H GLU 22 1.223 -2.629 3.690 198 HA GLU 22 HA GLU 22 2.382 -5.041 4.827 199 HB2 GLU 22 HB2 GLU 22 0.353 -4.690 2.579 200 HB3 GLU 22 HB3 GLU 22 0.857 -6.233 3.284 201 HG2 GLU 22 HG2 GLU 22 0.044 -5.532 5.491 202 HG3 GLU 22 HG3 GLU 22 -0.366 -3.950 4.903 203 H ARG 23 H ARG 23 2.375 -3.496 1.531 204 HA ARG 23 HA ARG 23 4.188 -5.473 0.524 205 HB2 ARG 23 HB2 ARG 23 4.700 -3.964 -1.349 206 HB3 ARG 23 HB3 ARG 23 3.023 -4.292 -1.087 207 HG2 ARG 23 HG2 ARG 23 2.863 -2.134 -1.556 208 HG3 ARG 23 HG3 ARG 23 2.950 -2.025 0.200 209 HD2 ARG 23 HD2 ARG 23 4.287 -0.302 -1.115 210 HD3 ARG 23 HD3 ARG 23 5.220 -1.203 0.068 211 HE ARG 23 HE ARG 23 6.637 -1.732 -1.556 212 HH11 ARG 23 HH11 ARG 23 3.491 -1.539 -3.292 213 HH12 ARG 23 HH12 ARG 23 4.228 -2.014 -4.793 214 HH21 ARG 23 HH21 ARG 23 7.506 -2.303 -3.637 215 HH22 ARG 23 HH22 ARG 23 6.463 -2.123 -5.030 216 H ILE 24 H ILE 24 4.907 -2.303 2.087 217 HA ILE 24 HA ILE 24 7.709 -2.585 1.608 218 HB ILE 24 HB ILE 24 6.556 -0.459 2.103 219 HG12 ILE 24 HG12 ILE 24 8.898 -1.216 3.890 220 HG13 ILE 24 HG13 ILE 24 8.931 -0.437 2.298 221 HG21 ILE 24 HG21 ILE 24 5.712 0.160 4.201 222 HG22 ILE 24 HG22 ILE 24 5.176 -1.503 4.004 223 HG23 ILE 24 HG23 ILE 24 6.546 -1.170 5.054 224 HD11 ILE 24 HD11 ILE 24 7.718 1.525 3.347 225 HD12 ILE 24 HD12 ILE 24 7.884 0.718 4.917 226 HD13 ILE 24 HD13 ILE 24 9.343 1.219 4.036 227 H GLN 25 H GLN 25 5.681 -3.546 4.495 228 HA GLN 25 HA GLN 25 8.018 -4.315 5.957 229 HB2 GLN 25 HB2 GLN 25 5.816 -3.560 6.917 230 HB3 GLN 25 HB3 GLN 25 5.102 -5.091 6.394 231 HG2 GLN 25 HG2 GLN 25 7.045 -6.154 7.859 232 HG3 GLN 25 HG3 GLN 25 7.157 -4.529 8.550 233 HE21 GLN 25 HE21 GLN 25 5.413 -7.552 8.605 234 HE22 GLN 25 HE22 GLN 25 4.011 -6.988 9.478 235 H ASN 26 H ASN 26 5.423 -6.199 4.265 236 HA ASN 26 HA ASN 26 6.632 -8.747 4.906 237 HB2 ASN 26 HB2 ASN 26 4.542 -8.114 2.771 238 HB3 ASN 26 HB3 ASN 26 5.040 -9.710 3.270 239 HD21 ASN 26 HD21 ASN 26 3.511 -6.788 4.465 240 HD22 ASN 26 HD22 ASN 26 2.688 -7.511 5.853 241 H SER 27 H SER 27 6.502 -6.735 1.960 242 HA SER 27 HA SER 27 7.730 -6.788 0.003 243 HB2 SER 27 HB2 SER 27 9.222 -5.822 1.950 244 HB3 SER 27 HB3 SER 27 10.199 -7.269 1.677 245 HG SER 27 HG SER 27 10.991 -6.285 -0.001 246 H LEU 28 H LEU 28 6.481 -9.104 0.179 247 HA LEU 28 HA LEU 28 8.300 -10.984 -1.074 248 HB2 LEU 28 HB2 LEU 28 7.698 -12.860 0.499 249 HB3 LEU 28 HB3 LEU 28 8.612 -11.578 1.243 250 HG LEU 28 HG LEU 28 6.455 -10.622 2.108 251 HD11 LEU 28 HD11 LEU 28 4.621 -12.303 2.474 252 HD12 LEU 28 HD12 LEU 28 5.351 -13.278 1.190 253 HD13 LEU 28 HD13 LEU 28 4.728 -11.650 0.849 254 HD21 LEU 28 HD21 LEU 28 7.165 -13.353 3.165 255 HD22 LEU 28 HD22 LEU 28 6.407 -12.033 4.048 256 HD23 LEU 28 HD23 LEU 28 8.083 -11.874 3.497 257 H SER 29 H SER 29 6.927 -13.038 -1.266 258 HA SER 29 HA SER 29 4.325 -12.403 -2.597 259 HB2 SER 29 HB2 SER 29 6.612 -14.221 -3.472 260 HB3 SER 29 HB3 SER 29 5.010 -14.231 -4.199 261 HG SER 29 HG SER 29 5.361 -11.946 -4.657 262 H THR 30 H THR 30 6.321 -15.020 -1.087 263 HA THR 30 HA THR 30 3.967 -16.059 0.200 264 HB THR 30 HB THR 30 3.894 -16.988 -2.106 265 HG1 THR 30 HG1 THR 30 3.328 -18.141 0.083 266 HG21 THR 30 HG21 THR 30 6.295 -17.284 -2.512 267 HG22 THR 30 HG22 THR 30 5.377 -18.782 -2.810 268 HG23 THR 30 HG23 THR 30 6.377 -18.607 -1.348 269 H GLU 31 H GLU 31 6.401 -14.839 1.067 270 HA GLU 31 HA GLU 31 8.113 -15.091 2.573 271 HB2 GLU 31 HB2 GLU 31 6.997 -17.785 3.366 272 HB3 GLU 31 HB3 GLU 31 7.957 -16.653 4.312 273 HG2 GLU 31 HG2 GLU 31 6.032 -15.017 4.201 274 HG3 GLU 31 HG3 GLU 31 5.059 -16.280 3.430 275 H LYS 32 H LYS 32 8.577 -15.833 -0.160 276 HA LYS 32 HA LYS 32 10.178 -18.223 -0.194 277 HB2 LYS 32 HB2 LYS 32 9.592 -16.000 -2.115 278 HB3 LYS 32 HB3 LYS 32 11.090 -16.899 -2.370 279 HG2 LYS 32 HG2 LYS 32 9.853 -19.033 -2.342 280 HG3 LYS 32 HG3 LYS 32 8.352 -18.160 -2.085 281 HD2 LYS 32 HD2 LYS 32 10.166 -18.077 -4.524 282 HD3 LYS 32 HD3 LYS 32 8.553 -18.822 -4.397 283 HE2 LYS 32 HE2 LYS 32 7.544 -16.587 -4.050 284 HE3 LYS 32 HE3 LYS 32 9.154 -15.839 -4.217 285 HZ1 LYS 32 HZ1 LYS 32 9.265 -16.738 -6.438 286 HZ2 LYS 32 HZ2 LYS 32 7.924 -15.798 -6.265 287 HZ3 LYS 32 HZ3 LYS 32 7.753 -17.424 -6.264 288 H TYR 33 H TYR 33 12.700 -17.932 -0.717 289 HA TYR 33 HA TYR 33 13.903 -16.241 1.298 290 HB2 TYR 33 HB2 TYR 33 15.098 -17.914 -0.951 291 HB3 TYR 33 HB3 TYR 33 16.051 -16.931 0.147 292 HD1 TYR 33 HD1 TYR 33 16.510 -17.563 2.401 293 HD2 TYR 33 HD2 TYR 33 13.776 -19.895 -0.003 294 HE1 TYR 33 HE1 TYR 33 16.518 -19.318 4.109 295 HE2 TYR 33 HE2 TYR 33 13.793 -21.675 1.717 296 HH TYR 33 HH TYR 33 15.647 -21.297 4.764 297 H GLY 34 H GLY 34 13.921 -16.225 -2.238 298 HA2 GLY 34 HA2 GLY 34 14.459 -14.645 -3.808 299 HA3 GLY 34 HA3 GLY 34 13.465 -13.594 -2.793 300 H SER 35 H SER 35 16.863 -14.879 -2.930 301 HA SER 35 HA SER 35 17.829 -12.131 -2.313 302 HB2 SER 35 HB2 SER 35 18.002 -13.815 -0.391 303 HB3 SER 35 HB3 SER 35 19.227 -14.642 -1.363 304 HG SER 35 HG SER 35 19.572 -12.623 0.224 305 H GLY 36 H GLY 36 20.471 -12.510 -2.771 306 HA2 GLY 36 HA2 GLY 36 21.901 -13.581 -4.517 307 HA3 GLY 36 HA3 GLY 36 20.611 -13.266 -5.678 308 H SER 37 H SER 37 23.308 -11.927 -3.946 309 HA SER 37 HA SER 37 23.298 -9.524 -5.634 310 HB2 SER 37 HB2 SER 37 23.653 -9.348 -2.609 311 HB3 SER 37 HB3 SER 37 23.658 -8.011 -3.768 312 HG SER 37 HG SER 37 21.460 -8.457 -4.207 313 H GLY 38 H GLY 38 25.533 -8.441 -5.474 314 HA2 GLY 38 HA2 GLY 38 27.785 -9.398 -4.209 315 HA3 GLY 38 HA3 GLY 38 27.609 -10.426 -5.640 316 H SER 39 H SER 39 28.636 -7.274 -4.497 317 HA SER 39 HA SER 39 29.490 -6.595 -7.203 318 HB2 SER 39 HB2 SER 39 28.369 -4.471 -7.269 319 HB3 SER 39 HB3 SER 39 27.160 -5.729 -7.038 320 HG SER 39 HG SER 39 27.570 -5.109 -4.627 321 H GLY 40 H GLY 40 30.708 -4.321 -7.055 322 HA2 GLY 40 HA2 GLY 40 31.910 -3.783 -4.434 323 HA3 GLY 40 HA3 GLY 40 33.003 -4.550 -5.589 324 H SER 41 H SER 41 32.976 -3.423 -7.847 325 HA SER 41 HA SER 41 33.440 -1.685 -9.151 326 HB2 SER 41 HB2 SER 41 31.041 -1.138 -8.718 327 HB3 SER 41 HB3 SER 41 31.568 -0.015 -7.446 328 HG SER 41 HG SER 41 32.924 0.898 -9.176 329 H GLY 42 H GLY 42 34.876 -1.815 -6.162 330 HA2 GLY 42 HA2 GLY 42 36.715 0.316 -6.882 331 HA3 GLY 42 HA3 GLY 42 35.773 0.614 -5.402 332 H SER 43 H SER 43 38.577 0.294 -5.334 333 HA SER 43 HA SER 43 38.940 -2.324 -3.966 334 HB2 SER 43 HB2 SER 43 41.379 -1.896 -4.665 335 HB3 SER 43 HB3 SER 43 40.230 -2.373 -5.930 336 HG SER 43 HG SER 43 41.607 -0.541 -6.461 337 H GLY 44 H GLY 44 39.213 1.176 -3.684 338 HA2 GLY 44 HA2 GLY 44 39.193 1.593 -1.058 339 HA3 GLY 44 HA3 GLY 44 40.860 1.008 -1.245 340 H SER 45 H SER 45 38.622 3.654 -1.986 341 HA SER 45 HA SER 45 40.902 5.391 -2.597 342 HB2 SER 45 HB2 SER 45 38.594 5.130 -4.570 343 HB3 SER 45 HB3 SER 45 40.021 6.173 -4.702 344 HG SER 45 HG SER 45 41.075 3.868 -4.401 345 H GLY 46 H GLY 46 40.323 6.231 -0.497 346 HA2 GLY 46 HA2 GLY 46 38.834 8.479 -0.364 347 HA3 GLY 46 HA3 GLY 46 37.662 7.202 0.039 348 H SER 47 H SER 47 37.781 8.470 2.177 349 HA SER 47 HA SER 47 39.450 7.026 4.045 350 HB2 SER 47 HB2 SER 47 41.011 8.824 3.361 351 HB3 SER 47 HB3 SER 47 39.778 10.047 3.698 352 HG SER 47 HG SER 47 41.165 8.371 5.500 353 H GLY 48 H GLY 48 38.015 10.244 4.617 354 HA2 GLY 48 HA2 GLY 48 36.084 9.157 6.441 355 HA3 GLY 48 HA3 GLY 48 36.141 10.833 5.834 356 H SER 49 H SER 49 33.714 9.158 6.164 357 HA SER 49 HA SER 49 32.571 9.507 3.530 358 HB2 SER 49 HB2 SER 49 31.692 7.141 3.523 359 HB3 SER 49 HB3 SER 49 33.425 7.278 3.222 360 HG SER 49 HG SER 49 33.864 6.477 5.169 361 H GLY 50 H GLY 50 30.075 8.516 3.936 362 HA2 GLY 50 HA2 GLY 50 29.146 9.096 6.628 363 HA3 GLY 50 HA3 GLY 50 28.650 10.260 5.367 364 H SER 51 H SER 51 26.710 8.782 6.718 365 HA SER 51 HA SER 51 25.413 7.367 4.560 366 HB2 SER 51 HB2 SER 51 26.907 5.584 5.450 367 HB3 SER 51 HB3 SER 51 26.272 5.867 7.075 368 HG SER 51 HG SER 51 25.240 4.391 4.997 369 H GLY 52 H GLY 52 23.174 6.670 5.394 370 HA2 GLY 52 HA2 GLY 52 22.108 7.571 7.855 371 HA3 GLY 52 HA3 GLY 52 21.804 8.777 6.583 372 H SER 53 H SER 53 19.673 7.372 7.782 373 HA SER 53 HA SER 53 18.522 6.010 5.480 374 HB2 SER 53 HB2 SER 53 19.682 4.237 6.901 375 HB3 SER 53 HB3 SER 53 18.593 4.683 8.222 376 HG SER 53 HG SER 53 18.082 3.300 5.819 377 H GLY 54 H GLY 54 16.102 5.357 6.598 378 HA2 GLY 54 HA2 GLY 54 15.044 7.414 8.344 379 HA3 GLY 54 HA3 GLY 54 14.562 7.601 6.642 380 H SER 55 H SER 55 12.546 7.145 8.305 381 HA SER 55 HA SER 55 11.120 4.993 7.410 382 HB2 SER 55 HB2 SER 55 12.798 3.677 8.944 383 HB3 SER 55 HB3 SER 55 11.955 4.442 10.291 384 HG SER 55 HG SER 55 11.118 2.397 9.755 385 H GLY 56 H GLY 56 9.148 4.692 9.163 386 HA2 GLY 56 HA2 GLY 56 8.357 6.250 11.155 387 HA3 GLY 56 HA3 GLY 56 8.282 7.422 9.823 388 H SER 57 H SER 57 6.007 7.438 10.472 389 HA SER 57 HA SER 57 4.400 5.353 9.081 390 HB2 SER 57 HB2 SER 57 2.577 5.940 10.716 391 HB3 SER 57 HB3 SER 57 3.943 5.044 11.385 392 HG SER 57 HG SER 57 4.746 6.910 12.305 393 H GLY 58 H GLY 58 2.474 6.247 8.002 394 HA2 GLY 58 HA2 GLY 58 1.414 7.716 6.657 395 HA3 GLY 58 HA3 GLY 58 1.980 9.028 7.710 396 H TYR 59 H TYR 59 1.973 9.951 5.352 397 HA TYR 59 HA TYR 59 3.020 10.706 3.526 398 HB2 TYR 59 HB2 TYR 59 5.378 10.616 5.414 399 HB3 TYR 59 HB3 TYR 59 5.388 11.419 3.856 400 HD1 TYR 59 HD1 TYR 59 4.795 13.694 3.730 401 HD2 TYR 59 HD2 TYR 59 3.423 11.363 7.112 402 HE1 TYR 59 HE1 TYR 59 3.819 15.710 4.734 403 HE2 TYR 59 HE2 TYR 59 2.457 13.367 8.112 404 HH TYR 59 HH TYR 59 2.691 16.613 6.595 405 H GLN3288 H GLN3288 2.618 8.964 2.157 406 HA GLN3288 HA GLN3288 4.231 6.662 1.904 407 HB2 GLN3288 HB2 GLN3288 3.078 6.302 -0.181 408 HB3 GLN3288 HB3 GLN3288 1.946 6.944 1.007 409 HG2 GLN3288 HG2 GLN3288 2.612 9.294 -0.113 410 HG3 GLN3288 HG3 GLN3288 3.088 8.272 -1.467 411 HE21 GLN3288 HE21 GLN3288 1.402 6.740 -2.239 412 HE22 GLN3288 HE22 GLN3288 -0.271 7.301 -2.261 413 H ILE3289 H ILE3289 5.681 6.078 0.185 414 HA ILE3289 HA ILE3289 7.562 8.253 -0.463 415 HB ILE3289 HB ILE3289 8.033 5.274 -0.684 416 HG12 ILE3289 HG12 ILE3289 8.856 7.132 1.589 417 HG13 ILE3289 HG13 ILE3289 7.529 5.980 1.706 418 HG21 ILE3289 HG21 ILE3289 10.417 5.976 -0.766 419 HG22 ILE3289 HG22 ILE3289 9.522 6.792 -2.039 420 HG23 ILE3289 HG23 ILE3289 9.945 7.673 -0.558 421 HD11 ILE3289 HD11 ILE3289 9.465 5.060 2.781 422 HD12 ILE3289 HD12 ILE3289 9.078 4.097 1.347 423 HD13 ILE3289 HD13 ILE3289 10.448 5.236 1.328 424 H GLU3290 H GLU3290 6.546 9.205 -2.085 425 HA GLU3290 HA GLU3290 5.370 7.949 -4.338 426 HB2 GLU3290 HB2 GLU3290 4.976 10.287 -3.229 427 HB3 GLU3290 HB3 GLU3290 6.342 10.803 -4.221 428 HG2 GLU3290 HG2 GLU3290 4.493 11.279 -5.548 429 HG3 GLU3290 HG3 GLU3290 5.078 9.743 -6.183 430 H THR3291 H THR3291 8.522 8.191 -3.583 431 HA THR3291 HA THR3291 9.465 7.995 -6.415 432 HB THR3291 HB THR3291 9.966 10.135 -5.429 433 HG1 THR3291 HG1 THR3291 11.339 9.739 -6.892 434 HG21 THR3291 HG21 THR3291 11.651 10.433 -3.685 435 HG22 THR3291 HG22 THR3291 11.682 8.680 -3.399 436 HG23 THR3291 HG23 THR3291 10.202 9.620 -3.081 437 H PHE3292 H PHE3292 8.502 5.826 -5.109 438 HA PHE3292 HA PHE3292 10.837 4.069 -5.152 439 HB2 PHE3292 HB2 PHE3292 10.806 4.763 -2.801 440 HB3 PHE3292 HB3 PHE3292 9.107 4.321 -2.655 441 HD1 PHE3292 HD1 PHE3292 11.338 1.953 -4.496 442 HD2 PHE3292 HD2 PHE3292 9.708 3.068 -0.653 443 HE1 PHE3292 HE1 PHE3292 11.961 -0.240 -3.589 444 HE2 PHE3292 HE2 PHE3292 10.406 0.873 0.271 445 HZ PHE3292 HZ PHE3292 11.537 -0.791 -1.195 446 H PHE3293 H PHE3293 7.390 4.106 -4.093 447 HA PHE3293 HA PHE3293 6.844 1.882 -6.020 448 HB2 PHE3293 HB2 PHE3293 5.072 1.220 -4.260 449 HB3 PHE3293 HB3 PHE3293 6.748 0.820 -4.041 450 HD1 PHE3293 HD1 PHE3293 7.434 1.004 -1.805 451 HD2 PHE3293 HD2 PHE3293 4.604 3.876 -3.321 452 HE1 PHE3293 HE1 PHE3293 7.390 2.125 0.395 453 HE2 PHE3293 HE2 PHE3293 4.582 5.008 -1.188 454 HZ PHE3293 HZ PHE3293 5.920 4.099 0.766 455 H ALA3294 H ALA3294 6.417 5.042 -6.085 456 HA ALA3294 HA ALA3294 3.677 5.565 -6.051 457 HB1 ALA3294 HB1 ALA3294 5.120 7.351 -6.388 458 HB2 ALA3294 HB2 ALA3294 5.904 6.634 -7.825 459 HB3 ALA3294 HB3 ALA3294 4.242 7.242 -7.902 460 H GLN3295 H GLN3295 5.538 3.878 -8.538 461 HA GLN3295 HA GLN3295 3.377 3.956 -10.508 462 HB2 GLN3295 HB2 GLN3295 5.781 2.110 -10.447 463 HB3 GLN3295 HB3 GLN3295 4.815 2.581 -11.851 464 HG2 GLN3295 HG2 GLN3295 6.773 4.261 -10.256 465 HG3 GLN3295 HG3 GLN3295 6.874 3.794 -11.954 466 HE21 GLN3295 HE21 GLN3295 6.850 6.555 -10.506 467 HE22 GLN3295 HE22 GLN3295 5.513 7.431 -11.188 468 H ASP3296 H ASP3296 4.236 1.964 -7.831 469 HA ASP3296 HA ASP3296 2.697 -0.411 -8.702 470 HB2 ASP3296 HB2 ASP3296 4.193 0.293 -6.163 471 HB3 ASP3296 HB3 ASP3296 3.211 -1.163 -6.340 472 H ILE3297 H ILE3297 2.466 2.319 -6.560 473 HA ILE3297 HA ILE3297 0.185 1.699 -5.074 474 HB ILE3297 HB ILE3297 1.840 4.044 -5.738 475 HG12 ILE3297 HG12 ILE3297 1.770 4.465 -3.414 476 HG13 ILE3297 HG13 ILE3297 0.307 3.497 -3.185 477 HG21 ILE3297 HG21 ILE3297 -0.189 5.038 -6.524 478 HG22 ILE3297 HG22 ILE3297 -1.063 4.553 -5.058 479 HG23 ILE3297 HG23 ILE3297 0.250 5.758 -4.962 480 HD11 ILE3297 HD11 ILE3297 2.891 2.202 -4.112 481 HD12 ILE3297 HD12 ILE3297 2.581 2.501 -2.413 482 HD13 ILE3297 HD13 ILE3297 1.496 1.446 -3.333 483 H GLU3298 H GLU3298 0.383 3.255 -8.281 484 HA GLU3298 HA GLU3298 -2.438 3.741 -8.509 485 HB2 GLU3298 HB2 GLU3298 -1.912 3.873 -10.988 486 HB3 GLU3298 HB3 GLU3298 -1.060 5.007 -9.931 487 HG2 GLU3298 HG2 GLU3298 0.999 3.884 -10.127 488 HG3 GLU3298 HG3 GLU3298 0.238 2.377 -10.630 489 H SER3299 H SER3299 -0.391 1.098 -9.316 490 HA SER3299 HA SER3299 -2.338 -0.490 -10.759 491 HB2 SER3299 HB2 SER3299 0.070 -0.840 -11.033 492 HB3 SER3299 HB3 SER3299 0.227 -1.365 -9.358 493 HG SER3299 HG SER3299 -0.919 -3.218 -9.798 494 H VAL3300 H VAL3300 -1.177 -0.662 -7.357 495 HA VAL3300 HA VAL3300 -3.083 -2.735 -6.725 496 HB VAL3300 HB VAL3300 -0.884 -2.524 -5.679 497 HG11 VAL3300 HG11 VAL3300 -0.454 -0.925 -3.909 498 HG12 VAL3300 HG12 VAL3300 -0.782 -0.102 -5.415 499 HG13 VAL3300 HG13 VAL3300 -2.029 -0.134 -4.172 500 HG21 VAL3300 HG21 VAL3300 -2.538 -3.884 -4.589 501 HG22 VAL3300 HG22 VAL3300 -1.598 -3.031 -3.359 502 HG23 VAL3300 HG23 VAL3300 -3.244 -2.487 -3.780 503 H GLN3301 H GLN3301 -3.215 0.853 -6.511 504 HA GLN3301 HA GLN3301 -5.672 0.750 -4.938 505 HB2 GLN3301 HB2 GLN3301 -5.845 3.063 -5.094 506 HB3 GLN3301 HB3 GLN3301 -4.138 2.667 -4.919 507 HG2 GLN3301 HG2 GLN3301 -3.844 4.143 -6.584 508 HG3 GLN3301 HG3 GLN3301 -4.287 2.781 -7.603 509 HE21 GLN3301 HE21 GLN3301 -7.278 2.914 -7.060 510 HE22 GLN3301 HE22 GLN3301 -7.727 4.277 -8.038 511 H LYS3302 H LYS3302 -4.910 0.632 -8.405 512 HA LYS3302 HA LYS3302 -7.393 1.304 -9.489 513 HB2 LYS3302 HB2 LYS3302 -5.019 -0.258 -10.354 514 HB3 LYS3302 HB3 LYS3302 -6.530 -0.634 -11.183 515 HG2 LYS3302 HG2 LYS3302 -6.834 1.582 -11.961 516 HG3 LYS3302 HG3 LYS3302 -5.608 2.231 -10.856 517 HD2 LYS3302 HD2 LYS3302 -4.868 2.074 -13.240 518 HD3 LYS3302 HD3 LYS3302 -3.828 1.283 -12.052 519 HE2 LYS3302 HE2 LYS3302 -4.689 -0.913 -12.652 520 HE3 LYS3302 HE3 LYS3302 -5.852 -0.199 -13.780 521 HZ1 LYS3302 HZ1 LYS3302 -4.131 0.441 -15.192 522 HZ2 LYS3302 HZ2 LYS3302 -3.700 -1.070 -14.745 523 HZ3 LYS3302 HZ3 LYS3302 -2.939 0.220 -14.071 524 H GLU3303 H GLU3303 -6.409 -1.546 -7.769 525 HA GLU3303 HA GLU3303 -8.715 -3.126 -8.705 526 HB2 GLU3303 HB2 GLU3303 -7.942 -4.934 -7.590 527 HB3 GLU3303 HB3 GLU3303 -6.503 -4.091 -8.132 528 HG2 GLU3303 HG2 GLU3303 -6.890 -3.017 -5.637 529 HG3 GLU3303 HG3 GLU3303 -7.587 -4.595 -5.412 530 H LEU3304 H LEU3304 -7.882 -1.346 -5.735 531 HA LEU3304 HA LEU3304 -10.314 -1.895 -4.364 532 HB2 LEU3304 HB2 LEU3304 -8.302 0.400 -4.129 533 HB3 LEU3304 HB3 LEU3304 -9.567 0.074 -2.975 534 HG LEU3304 HG LEU3304 -7.024 -1.470 -3.539 535 HD11 LEU3304 HD11 LEU3304 -6.841 -1.277 -1.100 536 HD12 LEU3304 HD12 LEU3304 -8.497 -0.637 -1.036 537 HD13 LEU3304 HD13 LEU3304 -7.214 0.306 -1.812 538 HD21 LEU3304 HD21 LEU3304 -8.628 -3.301 -3.612 539 HD22 LEU3304 HD22 LEU3304 -9.469 -2.680 -2.185 540 HD23 LEU3304 HD23 LEU3304 -7.828 -3.328 -2.048 541 H GLU3305 H GLU3305 -9.530 0.704 -6.627 542 HA GLU3305 HA GLU3305 -11.685 2.431 -5.806 543 HB2 GLU3305 HB2 GLU3305 -11.399 3.524 -8.035 544 HB3 GLU3305 HB3 GLU3305 -9.903 3.376 -7.107 545 HG2 GLU3305 HG2 GLU3305 -9.200 1.479 -8.350 546 HG3 GLU3305 HG3 GLU3305 -10.735 1.314 -9.195 547 H ASN3306 H ASN3306 -11.863 -0.604 -7.419 548 HA ASN3306 HA ASN3306 -14.589 0.075 -8.400 549 HB2 ASN3306 HB2 ASN3306 -14.496 -1.726 -9.890 550 HB3 ASN3306 HB3 ASN3306 -13.006 -0.826 -10.102 551 HD21 ASN3306 HD21 ASN3306 -11.129 -2.053 -10.124 552 HD22 ASN3306 HD22 ASN3306 -11.019 -3.650 -9.419 553 H LEU3307 H LEU3307 -13.148 -1.141 -5.603 554 HA LEU3307 HA LEU3307 -15.138 -3.297 -5.287 555 HB2 LEU3307 HB2 LEU3307 -12.637 -2.417 -3.901 556 HB3 LEU3307 HB3 LEU3307 -13.896 -2.943 -2.840 557 HG LEU3307 HG LEU3307 -13.063 -4.945 -2.995 558 HD11 LEU3307 HD11 LEU3307 -15.049 -5.305 -4.492 559 HD12 LEU3307 HD12 LEU3307 -13.736 -6.450 -4.704 560 HD13 LEU3307 HD13 LEU3307 -13.942 -5.137 -5.884 561 HD21 LEU3307 HD21 LEU3307 -10.997 -4.139 -3.886 562 HD22 LEU3307 HD22 LEU3307 -11.635 -4.317 -5.549 563 HD23 LEU3307 HD23 LEU3307 -11.418 -5.741 -4.503 564 H SER3308 H SER3308 -16.582 -3.391 -3.539 565 HA SER3308 HA SER3308 -18.003 -0.882 -3.053 566 HB2 SER3308 HB2 SER3308 -18.533 -3.782 -2.245 567 HB3 SER3308 HB3 SER3308 -19.679 -2.450 -2.051 568 HG SER3308 HG SER3308 -19.779 -2.220 -4.262 569 H GLU3309 H GLU3309 -18.887 -0.520 -0.707 570 HA GLU3309 HA GLU3309 -16.664 -0.160 1.040 571 HB2 GLU3309 HB2 GLU3309 -19.674 -0.253 1.540 572 HB3 GLU3309 HB3 GLU3309 -18.524 0.022 2.828 573 HG2 GLU3309 HG2 GLU3309 -18.171 2.132 2.316 574 HG3 GLU3309 HG3 GLU3309 -17.992 1.830 0.597 575 H GLU3310 H GLU3310 -19.205 -2.652 0.908 576 HA GLU3310 HA GLU3310 -18.591 -4.080 3.189 577 HB2 GLU3310 HB2 GLU3310 -19.410 -5.316 0.520 578 HB3 GLU3310 HB3 GLU3310 -19.630 -5.999 2.126 579 HG2 GLU3310 HG2 GLU3310 -21.019 -3.886 2.659 580 HG3 GLU3310 HG3 GLU3310 -21.014 -3.580 0.917 581 H GLU3311 H GLU3311 -16.693 -3.869 0.238 582 HA GLU3311 HA GLU3311 -15.102 -6.261 0.837 583 HB2 GLU3311 HB2 GLU3311 -14.970 -4.110 -1.262 584 HB3 GLU3311 HB3 GLU3311 -14.043 -5.584 -1.273 585 HG2 GLU3311 HG2 GLU3311 -17.080 -5.491 -1.328 586 HG3 GLU3311 HG3 GLU3311 -16.196 -5.544 -2.726 587 H LEU3312 H LEU3312 -14.640 -2.748 0.386 588 HA LEU3312 HA LEU3312 -12.008 -2.686 1.469 589 HB2 LEU3312 HB2 LEU3312 -13.811 -0.269 1.223 590 HB3 LEU3312 HB3 LEU3312 -12.091 -0.297 1.112 591 HG LEU3312 HG LEU3312 -13.680 -1.823 -0.961 592 HD11 LEU3312 HD11 LEU3312 -13.416 1.175 -0.842 593 HD12 LEU3312 HD12 LEU3312 -14.880 0.141 -0.913 594 HD13 LEU3312 HD13 LEU3312 -13.805 0.242 -2.305 595 HD21 LEU3312 HD21 LEU3312 -11.790 -1.105 -2.391 596 HD22 LEU3312 HD22 LEU3312 -11.334 -2.138 -1.029 597 HD23 LEU3312 HD23 LEU3312 -11.006 -0.409 -0.961 598 H LEU3313 H LEU3313 -15.023 -1.358 2.719 599 HA LEU3313 HA LEU3313 -14.151 -0.226 5.150 600 HB2 LEU3313 HB2 LEU3313 -16.304 0.366 4.124 601 HB3 LEU3313 HB3 LEU3313 -16.920 -1.265 4.269 602 HG LEU3313 HG LEU3313 -17.872 0.245 5.880 603 HD11 LEU3313 HD11 LEU3313 -17.873 -2.246 6.159 604 HD12 LEU3313 HD12 LEU3313 -18.109 -1.295 7.620 605 HD13 LEU3313 HD13 LEU3313 -16.556 -2.060 7.334 606 HD21 LEU3313 HD21 LEU3313 -16.783 0.803 7.961 607 HD22 LEU3313 HD22 LEU3313 -15.930 1.554 6.613 608 HD23 LEU3313 HD23 LEU3313 -15.257 0.109 7.400 609 H ALA3314 H ALA3314 -15.159 -3.545 4.275 610 HA ALA3314 HA ALA3314 -15.046 -4.412 7.007 611 HB1 ALA3314 HB1 ALA3314 -14.974 -5.755 4.324 612 HB2 ALA3314 HB2 ALA3314 -14.851 -6.708 5.803 613 HB3 ALA3314 HB3 ALA3314 -16.292 -5.709 5.530 614 H MET3315 H MET3315 -12.489 -3.975 4.574 615 HA MET3315 HA MET3315 -10.550 -5.694 5.885 616 HB2 MET3315 HB2 MET3315 -9.985 -3.319 4.066 617 HB3 MET3315 HB3 MET3315 -8.895 -4.657 4.415 618 HG2 MET3315 HG2 MET3315 -11.482 -5.529 3.405 619 HG3 MET3315 HG3 MET3315 -10.738 -4.395 2.309 620 HE1 MET3315 HE1 MET3315 -11.341 -6.668 0.874 621 HE2 MET3315 HE2 MET3315 -10.333 -8.136 0.899 622 HE3 MET3315 HE3 MET3315 -11.492 -7.822 2.211 623 H LEU3316 H LEU3316 -10.964 -2.179 5.635 624 HA LEU3316 HA LEU3316 -8.897 -1.521 7.511 625 HB2 LEU3316 HB2 LEU3316 -9.898 0.728 7.524 626 HB3 LEU3316 HB3 LEU3316 -9.558 0.135 5.919 627 HG LEU3316 HG LEU3316 -12.114 -0.661 6.043 628 HD11 LEU3316 HD11 LEU3316 -12.998 0.143 8.101 629 HD12 LEU3316 HD12 LEU3316 -13.356 1.483 7.057 630 HD13 LEU3316 HD13 LEU3316 -11.940 1.541 8.133 631 HD21 LEU3316 HD21 LEU3316 -10.904 1.039 4.504 632 HD22 LEU3316 HD22 LEU3316 -11.608 2.278 5.571 633 HD23 LEU3316 HD23 LEU3316 -12.631 1.144 4.660 634 H ASN3317 H ASN3317 -12.428 -2.084 7.894 635 HA ASN3317 HA ASN3317 -12.343 -1.329 10.688 636 HB2 ASN3317 HB2 ASN3317 -14.417 -1.442 9.043 637 HB3 ASN3317 HB3 ASN3317 -14.486 -3.138 9.525 638 HD21 ASN3317 HD21 ASN3317 -14.952 0.145 10.360 639 HD22 ASN3317 HD22 ASN3317 -15.673 -0.108 11.957 640 H GLY3318 H GLY3318 -11.893 -4.246 8.847 641 HA2 GLY3318 HA2 GLY3318 -10.840 -6.228 9.430 642 HA3 GLY3318 HA3 GLY3318 -10.787 -5.726 11.128 643 H ASP3319 H ASP3319 -13.792 -5.578 9.359 644 HA ASP3319 HA ASP3319 -14.873 -7.936 10.831 645 HB2 ASP3319 HB2 ASP3319 -15.716 -5.182 10.935 646 HB3 ASP3319 HB3 ASP3319 -16.990 -6.085 10.173 647 H GLN3320 H GLN3320 -17.367 -8.022 9.464 648 HA GLN3320 HA GLN3320 -16.700 -8.290 6.641 649 HB2 GLN3320 HB2 GLN3320 -17.448 -10.620 6.588 650 HB3 GLN3320 HB3 GLN3320 -16.060 -10.427 7.669 651 HG2 GLN3320 HG2 GLN3320 -17.467 -10.515 9.634 652 HG3 GLN3320 HG3 GLN3320 -18.936 -10.525 8.653 653 HE21 GLN3320 HE21 GLN3320 -18.482 -12.442 10.573 654 HE22 GLN3320 HE22 GLN3320 -18.415 -13.988 9.715 655 H GLN3321 H GLN3321 -18.387 -6.515 8.218 656 HA GLN3321 HA GLN3321 -20.711 -6.492 6.578 657 HB2 GLN3321 HB2 GLN3321 -22.408 -6.830 8.099 658 HB3 GLN3321 HB3 GLN3321 -21.349 -8.188 8.402 659 HG2 GLN3321 HG2 GLN3321 -21.640 -5.676 10.117 660 HG3 GLN3321 HG3 GLN3321 -22.374 -7.234 10.433 661 HE21 GLN3321 HE21 GLN3321 -19.648 -8.575 9.616 662 HE22 GLN3321 HE22 GLN3321 -18.659 -8.312 11.080 Start of MODEL 17 1 H1 MET 1 H MET 1 -30.035 10.502 -2.258 2 HA MET 1 HA MET 1 -30.947 10.349 0.557 3 HB2 MET 1 HB2 MET 1 -30.538 7.942 0.399 4 HB3 MET 1 HB3 MET 1 -31.744 8.471 -0.767 5 HG2 MET 1 HG2 MET 1 -30.081 8.405 -2.578 6 HG3 MET 1 HG3 MET 1 -28.809 7.941 -1.442 7 HE1 MET 1 HE1 MET 1 -29.203 5.692 0.186 8 HE2 MET 1 HE2 MET 1 -29.237 4.256 -0.859 9 HE3 MET 1 HE3 MET 1 -28.076 5.560 -1.180 10 H ASN 2 H ASN 2 -29.067 8.650 1.683 11 HA ASN 2 HA ASN 2 -26.755 10.439 1.871 12 HB2 ASN 2 HB2 ASN 2 -27.172 7.640 3.005 13 HB3 ASN 2 HB3 ASN 2 -25.863 8.727 3.390 14 HD21 ASN 2 HD21 ASN 2 -29.407 8.308 3.712 15 HD22 ASN 2 HD22 ASN 2 -29.575 9.465 5.023 16 H ILE 3 H ILE 3 -25.192 10.298 0.276 17 HA ILE 3 HA ILE 3 -25.314 8.208 -1.710 18 HB ILE 3 HB ILE 3 -24.483 10.684 -1.824 19 HG12 ILE 3 HG12 ILE 3 -22.820 8.665 -3.342 20 HG13 ILE 3 HG13 ILE 3 -24.554 8.874 -3.621 21 HG21 ILE 3 HG21 ILE 3 -22.104 11.082 -1.594 22 HG22 ILE 3 HG22 ILE 3 -22.705 10.432 -0.067 23 HG23 ILE 3 HG23 ILE 3 -21.805 9.383 -1.164 24 HD11 ILE 3 HD11 ILE 3 -23.157 10.177 -5.188 25 HD12 ILE 3 HD12 ILE 3 -24.334 11.146 -4.273 26 HD13 ILE 3 HD13 ILE 3 -22.624 11.187 -3.825 27 H ASN 4 H ASN 4 -23.629 6.703 -2.214 28 HA ASN 4 HA ASN 4 -22.133 5.665 0.132 29 HB2 ASN 4 HB2 ASN 4 -22.871 3.389 -0.419 30 HB3 ASN 4 HB3 ASN 4 -24.167 4.419 0.166 31 HD21 ASN 4 HD21 ASN 4 -22.944 2.658 -2.696 32 HD22 ASN 4 HD22 ASN 4 -24.276 3.124 -3.723 33 H GLU 5 H GLU 5 -22.633 5.554 -3.438 34 HA GLU 5 HA GLU 5 -20.229 4.248 -4.132 35 HB2 GLU 5 HB2 GLU 5 -21.887 6.369 -5.534 36 HB3 GLU 5 HB3 GLU 5 -20.483 5.608 -6.299 37 HG2 GLU 5 HG2 GLU 5 -21.478 3.461 -6.329 38 HG3 GLU 5 HG3 GLU 5 -22.671 3.893 -5.117 39 H GLN 6 H GLN 6 -20.924 7.566 -3.477 40 HA GLN 6 HA GLN 6 -18.183 8.530 -3.928 41 HB2 GLN 6 HB2 GLN 6 -20.780 9.804 -3.332 42 HB3 GLN 6 HB3 GLN 6 -19.399 10.617 -2.593 43 HG2 GLN 6 HG2 GLN 6 -18.326 10.951 -4.702 44 HG3 GLN 6 HG3 GLN 6 -19.372 9.789 -5.518 45 HE21 GLN 6 HE21 GLN 6 -20.004 12.738 -3.455 46 HE22 GLN 6 HE22 GLN 6 -21.080 13.457 -4.644 47 H THR 7 H THR 7 -19.881 7.154 -1.177 48 HA THR 7 HA THR 7 -18.032 8.232 0.799 49 HB THR 7 HB THR 7 -20.035 6.005 0.885 50 HG1 THR 7 HG1 THR 7 -20.071 8.656 1.926 51 HG21 THR 7 HG21 THR 7 -18.501 5.506 2.555 52 HG22 THR 7 HG22 THR 7 -19.855 6.281 3.394 53 HG23 THR 7 HG23 THR 7 -18.338 7.201 3.059 54 H LEU 8 H LEU 8 -18.198 5.323 -1.328 55 HA LEU 8 HA LEU 8 -16.458 3.548 -0.017 56 HB2 LEU 8 HB2 LEU 8 -16.268 4.255 -2.971 57 HB3 LEU 8 HB3 LEU 8 -15.913 2.740 -2.139 58 HG LEU 8 HG LEU 8 -18.645 3.950 -2.683 59 HD11 LEU 8 HD11 LEU 8 -17.531 2.949 -4.681 60 HD12 LEU 8 HD12 LEU 8 -19.065 2.175 -4.229 61 HD13 LEU 8 HD13 LEU 8 -17.543 1.382 -3.830 62 HD21 LEU 8 HD21 LEU 8 -18.988 2.815 -0.703 63 HD22 LEU 8 HD22 LEU 8 -17.869 1.494 -1.152 64 HD23 LEU 8 HD23 LEU 8 -19.474 1.640 -1.915 65 H ASP 9 H ASP 9 -15.756 6.633 -1.669 66 HA ASP 9 HA ASP 9 -13.009 6.535 -2.082 67 HB2 ASP 9 HB2 ASP 9 -14.951 8.656 -1.504 68 HB3 ASP 9 HB3 ASP 9 -13.274 9.084 -1.205 69 H LYS 10 H LYS 10 -14.660 7.495 1.032 70 HA LYS 10 HA LYS 10 -12.088 7.855 2.304 71 HB2 LYS 10 HB2 LYS 10 -13.221 8.157 4.363 72 HB3 LYS 10 HB3 LYS 10 -14.218 8.884 3.105 73 HG2 LYS 10 HG2 LYS 10 -15.559 6.814 3.086 74 HG3 LYS 10 HG3 LYS 10 -14.696 6.213 4.482 75 HD2 LYS 10 HD2 LYS 10 -16.273 8.830 4.305 76 HD3 LYS 10 HD3 LYS 10 -16.977 7.291 4.830 77 HE2 LYS 10 HE2 LYS 10 -15.458 7.117 6.685 78 HE3 LYS 10 HE3 LYS 10 -14.630 8.622 6.221 79 HZ1 LYS 10 HZ1 LYS 10 -17.486 8.419 6.991 80 HZ2 LYS 10 HZ2 LYS 10 -16.713 9.801 6.588 81 HZ3 LYS 10 HZ3 LYS 10 -16.271 8.992 7.945 82 H LEU 11 H LEU 11 -13.964 5.004 1.615 83 HA LEU 11 HA LEU 11 -12.702 3.302 3.619 84 HB2 LEU 11 HB2 LEU 11 -14.636 2.719 1.303 85 HB3 LEU 11 HB3 LEU 11 -13.871 1.525 2.349 86 HG LEU 11 HG LEU 11 -15.982 1.711 3.092 87 HD11 LEU 11 HD11 LEU 11 -15.952 2.648 5.351 88 HD12 LEU 11 HD12 LEU 11 -14.415 3.460 5.022 89 HD13 LEU 11 HD13 LEU 11 -14.546 1.661 4.974 90 HD21 LEU 11 HD21 LEU 11 -17.176 3.782 3.729 91 HD22 LEU 11 HD22 LEU 11 -16.763 3.729 2.025 92 HD23 LEU 11 HD23 LEU 11 -15.804 4.718 3.116 93 H ARG 12 H ARG 12 -12.611 3.622 0.024 94 HA ARG 12 HA ARG 12 -10.588 1.670 -0.320 95 HB2 ARG 12 HB2 ARG 12 -10.252 2.677 -2.584 96 HB3 ARG 12 HB3 ARG 12 -11.881 2.256 -2.183 97 HG2 ARG 12 HG2 ARG 12 -12.548 4.505 -1.930 98 HG3 ARG 12 HG3 ARG 12 -10.858 5.134 -1.882 99 HD2 ARG 12 HD2 ARG 12 -10.640 4.199 -4.183 100 HD3 ARG 12 HD3 ARG 12 -12.429 3.904 -4.055 101 HE ARG 12 HE ARG 12 -12.831 6.267 -3.992 102 HH11 ARG 12 HH11 ARG 12 -9.679 5.419 -5.468 103 HH12 ARG 12 HH12 ARG 12 -9.906 6.625 -6.723 104 HH21 ARG 12 HH21 ARG 12 -12.905 7.860 -5.438 105 HH22 ARG 12 HH22 ARG 12 -11.652 8.062 -6.668 106 H GLN 13 H GLN 13 -10.253 5.177 0.234 107 HA GLN 13 HA GLN 13 -7.462 5.112 -0.141 108 HB2 GLN 13 HB2 GLN 13 -7.415 7.326 0.641 109 HB3 GLN 13 HB3 GLN 13 -8.875 7.092 -0.300 110 HG2 GLN 13 HG2 GLN 13 -9.797 8.199 1.488 111 HG3 GLN 13 HG3 GLN 13 -9.997 6.539 1.996 112 HE21 GLN 13 HE21 GLN 13 -9.917 6.801 4.209 113 HE22 GLN 13 HE22 GLN 13 -8.450 7.346 5.034 114 H ALA 14 H ALA 14 -9.502 4.234 2.640 115 HA ALA 14 HA ALA 14 -7.354 4.162 4.580 116 HB1 ALA 14 HB1 ALA 14 -9.071 2.819 5.878 117 HB2 ALA 14 HB2 ALA 14 -9.649 4.410 5.342 118 HB3 ALA 14 HB3 ALA 14 -10.152 2.948 4.484 119 H VAL 15 H VAL 15 -9.002 1.753 2.462 120 HA VAL 15 HA VAL 15 -7.455 -0.469 3.428 121 HB VAL 15 HB VAL 15 -8.868 -0.208 0.761 122 HG11 VAL 15 HG11 VAL 15 -8.049 -2.704 2.318 123 HG12 VAL 15 HG12 VAL 15 -8.869 -2.643 0.758 124 HG13 VAL 15 HG13 VAL 15 -7.198 -2.092 0.884 125 HG21 VAL 15 HG21 VAL 15 -10.538 0.058 2.438 126 HG22 VAL 15 HG22 VAL 15 -10.559 -1.618 1.948 127 HG23 VAL 15 HG23 VAL 15 -9.801 -1.177 3.487 128 H LEU 16 H LEU 16 -7.056 1.664 0.542 129 HA LEU 16 HA LEU 16 -4.661 0.410 -0.319 130 HB2 LEU 16 HB2 LEU 16 -4.243 2.091 -1.827 131 HB3 LEU 16 HB3 LEU 16 -5.975 2.018 -1.643 132 HG LEU 16 HG LEU 16 -5.701 3.985 -0.022 133 HD11 LEU 16 HD11 LEU 16 -3.963 5.551 -0.707 134 HD12 LEU 16 HD12 LEU 16 -3.287 4.347 -1.824 135 HD13 LEU 16 HD13 LEU 16 -3.230 4.097 -0.064 136 HD21 LEU 16 HD21 LEU 16 -5.546 4.228 -3.063 137 HD22 LEU 16 HD22 LEU 16 -6.144 5.480 -1.963 138 HD23 LEU 16 HD23 LEU 16 -7.032 3.956 -2.130 139 H GLN 17 H GLN 17 -5.052 2.975 2.175 140 HA GLN 17 HA GLN 17 -2.313 3.506 2.558 141 HB2 GLN 17 HB2 GLN 17 -4.728 3.577 4.386 142 HB3 GLN 17 HB3 GLN 17 -3.119 3.778 5.053 143 HG2 GLN 17 HG2 GLN 17 -2.715 5.705 3.551 144 HG3 GLN 17 HG3 GLN 17 -4.322 5.536 2.883 145 HE21 GLN 17 HE21 GLN 17 -5.740 7.067 3.850 146 HE22 GLN 17 HE22 GLN 17 -5.622 7.533 5.520 147 H LYS 18 H LYS 18 -4.335 0.807 4.168 148 HA LYS 18 HA LYS 18 -2.065 -0.075 5.604 149 HB2 LYS 18 HB2 LYS 18 -3.409 -1.775 6.343 150 HB3 LYS 18 HB3 LYS 18 -4.579 -0.533 5.945 151 HG2 LYS 18 HG2 LYS 18 -4.532 -1.930 3.590 152 HG3 LYS 18 HG3 LYS 18 -3.999 -3.177 4.644 153 HD2 LYS 18 HD2 LYS 18 -6.449 -1.536 5.332 154 HD3 LYS 18 HD3 LYS 18 -6.561 -2.679 4.002 155 HE2 LYS 18 HE2 LYS 18 -5.583 -3.309 6.823 156 HE3 LYS 18 HE3 LYS 18 -7.215 -3.679 6.236 157 HZ1 LYS 18 HZ1 LYS 18 -6.011 -5.128 4.504 158 HZ2 LYS 18 HZ2 LYS 18 -5.973 -5.656 6.064 159 HZ3 LYS 18 HZ3 LYS 18 -4.671 -4.949 5.383 160 H LYS 19 H LYS 19 -3.304 -0.922 2.358 161 HA LYS 19 HA LYS 19 -1.717 -3.143 1.830 162 HB2 LYS 19 HB2 LYS 19 -2.943 -1.045 0.037 163 HB3 LYS 19 HB3 LYS 19 -1.957 -2.347 -0.622 164 HG2 LYS 19 HG2 LYS 19 -3.389 -4.049 0.226 165 HG3 LYS 19 HG3 LYS 19 -4.276 -2.920 1.262 166 HD2 LYS 19 HD2 LYS 19 -5.497 -2.015 -0.475 167 HD3 LYS 19 HD3 LYS 19 -4.305 -2.397 -1.687 168 HE2 LYS 19 HE2 LYS 19 -6.313 -3.755 -2.003 169 HE3 LYS 19 HE3 LYS 19 -4.870 -4.733 -1.697 170 HZ1 LYS 19 HZ1 LYS 19 -6.756 -5.535 -0.484 171 HZ2 LYS 19 HZ2 LYS 19 -6.940 -4.120 0.322 172 HZ3 LYS 19 HZ3 LYS 19 -5.598 -5.066 0.540 173 H ILE 20 H ILE 20 -0.732 0.298 1.727 174 HA ILE 20 HA ILE 20 1.680 -0.254 0.326 175 HB ILE 20 HB ILE 20 1.471 2.017 2.305 176 HG12 ILE 20 HG12 ILE 20 -0.555 2.384 1.191 177 HG13 ILE 20 HG13 ILE 20 0.598 3.424 0.405 178 HG21 ILE 20 HG21 ILE 20 2.903 3.158 0.648 179 HG22 ILE 20 HG22 ILE 20 3.633 1.643 1.165 180 HG23 ILE 20 HG23 ILE 20 2.853 1.736 -0.414 181 HD11 ILE 20 HD11 ILE 20 -0.626 0.874 -0.719 182 HD12 ILE 20 HD12 ILE 20 -0.734 2.524 -1.334 183 HD13 ILE 20 HD13 ILE 20 0.798 1.633 -1.429 184 H LYS 21 H LYS 21 0.828 -0.425 3.786 185 HA LYS 21 HA LYS 21 3.521 -0.877 4.793 186 HB2 LYS 21 HB2 LYS 21 0.949 -1.936 6.047 187 HB3 LYS 21 HB3 LYS 21 2.454 -1.493 6.815 188 HG2 LYS 21 HG2 LYS 21 1.939 0.943 6.042 189 HG3 LYS 21 HG3 LYS 21 0.309 0.369 5.726 190 HD2 LYS 21 HD2 LYS 21 1.732 0.117 8.425 191 HD3 LYS 21 HD3 LYS 21 0.657 1.425 7.972 192 HE2 LYS 21 HE2 LYS 21 -1.051 0.247 8.748 193 HE3 LYS 21 HE3 LYS 21 -0.895 -0.803 7.351 194 HZ1 LYS 21 HZ1 LYS 21 0.457 -2.292 8.740 195 HZ2 LYS 21 HZ2 LYS 21 -0.977 -1.955 9.457 196 HZ3 LYS 21 HZ3 LYS 21 0.417 -1.234 9.974 197 H GLU 22 H GLU 22 0.880 -2.888 3.467 198 HA GLU 22 HA GLU 22 1.892 -5.373 4.512 199 HB2 GLU 22 HB2 GLU 22 -0.155 -4.729 2.361 200 HB3 GLU 22 HB3 GLU 22 0.220 -6.369 2.929 201 HG2 GLU 22 HG2 GLU 22 -0.393 -5.780 5.199 202 HG3 GLU 22 HG3 GLU 22 -0.627 -4.100 4.775 203 H ARG 23 H ARG 23 1.928 -3.830 1.239 204 HA ARG 23 HA ARG 23 3.595 -5.810 0.119 205 HB2 ARG 23 HB2 ARG 23 4.104 -4.247 -1.718 206 HB3 ARG 23 HB3 ARG 23 2.408 -4.396 -1.332 207 HG2 ARG 23 HG2 ARG 23 2.471 -2.180 -1.619 208 HG3 ARG 23 HG3 ARG 23 2.773 -2.223 0.094 209 HD2 ARG 23 HD2 ARG 23 4.177 -0.587 -1.208 210 HD3 ARG 23 HD3 ARG 23 5.084 -1.696 -0.190 211 HE ARG 23 HE ARG 23 6.224 -2.371 -2.002 212 HH11 ARG 23 HH11 ARG 23 2.993 -1.449 -3.375 213 HH12 ARG 23 HH12 ARG 23 3.568 -1.812 -4.970 214 HH21 ARG 23 HH21 ARG 23 6.803 -2.758 -4.142 215 HH22 ARG 23 HH22 ARG 23 5.677 -2.494 -5.420 216 H ILE 24 H ILE 24 4.635 -2.971 1.995 217 HA ILE 24 HA ILE 24 7.427 -3.438 1.331 218 HB ILE 24 HB ILE 24 6.596 -1.209 1.875 219 HG12 ILE 24 HG12 ILE 24 8.716 -2.318 3.759 220 HG13 ILE 24 HG13 ILE 24 8.931 -1.454 2.231 221 HG21 ILE 24 HG21 ILE 24 4.919 -1.997 3.575 222 HG22 ILE 24 HG22 ILE 24 6.212 -2.066 4.770 223 HG23 ILE 24 HG23 ILE 24 5.751 -0.528 3.996 224 HD11 ILE 24 HD11 ILE 24 9.422 0.039 4.095 225 HD12 ILE 24 HD12 ILE 24 7.888 0.570 3.354 226 HD13 ILE 24 HD13 ILE 24 7.867 -0.363 4.858 227 H GLN 25 H GLN 25 5.285 -4.302 4.135 228 HA GLN 25 HA GLN 25 7.470 -5.395 5.660 229 HB2 GLN 25 HB2 GLN 25 5.313 -4.487 6.556 230 HB3 GLN 25 HB3 GLN 25 4.471 -5.907 5.918 231 HG2 GLN 25 HG2 GLN 25 6.068 -7.304 7.370 232 HG3 GLN 25 HG3 GLN 25 6.591 -5.770 8.078 233 HE21 GLN 25 HE21 GLN 25 4.213 -8.291 8.229 234 HE22 GLN 25 HE22 GLN 25 3.255 -7.484 9.467 235 H ASN 26 H ASN 26 4.844 -6.882 3.679 236 HA ASN 26 HA ASN 26 5.870 -9.579 4.200 237 HB2 ASN 26 HB2 ASN 26 3.845 -8.558 2.137 238 HB3 ASN 26 HB3 ASN 26 4.172 -10.245 2.477 239 HD21 ASN 26 HD21 ASN 26 2.687 -7.298 3.800 240 HD22 ASN 26 HD22 ASN 26 1.870 -8.110 5.140 241 H SER 27 H SER 27 5.697 -7.409 1.304 242 HA SER 27 HA SER 27 6.872 -7.381 -0.640 243 HB2 SER 27 HB2 SER 27 8.413 -6.549 1.304 244 HB3 SER 27 HB3 SER 27 9.323 -8.033 1.006 245 HG SER 27 HG SER 27 10.049 -6.168 -0.096 246 H LEU 28 H LEU 28 5.585 -9.805 -0.268 247 HA LEU 28 HA LEU 28 7.256 -11.633 -1.788 248 HB2 LEU 28 HB2 LEU 28 6.802 -13.544 -0.215 249 HB3 LEU 28 HB3 LEU 28 7.805 -12.286 0.451 250 HG LEU 28 HG LEU 28 5.745 -11.334 1.586 251 HD11 LEU 28 HD11 LEU 28 3.877 -12.236 0.583 252 HD12 LEU 28 HD12 LEU 28 3.984 -13.068 2.122 253 HD13 LEU 28 HD13 LEU 28 4.518 -13.897 0.649 254 HD21 LEU 28 HD21 LEU 28 5.900 -12.766 3.498 255 HD22 LEU 28 HD22 LEU 28 7.501 -12.558 2.781 256 HD23 LEU 28 HD23 LEU 28 6.604 -14.061 2.529 257 H SER 29 H SER 29 5.793 -13.738 -1.969 258 HA SER 29 HA SER 29 3.117 -12.882 -3.004 259 HB2 SER 29 HB2 SER 29 5.179 -14.840 -4.055 260 HB3 SER 29 HB3 SER 29 3.468 -15.053 -4.428 261 HG SER 29 HG SER 29 3.319 -13.236 -5.429 262 H THR 30 H THR 30 4.849 -15.753 -1.629 263 HA THR 30 HA THR 30 2.507 -16.362 0.025 264 HB THR 30 HB THR 30 1.942 -17.227 -2.204 265 HG1 THR 30 HG1 THR 30 1.330 -19.177 -1.608 266 HG21 THR 30 HG21 THR 30 4.464 -18.882 -1.981 267 HG22 THR 30 HG22 THR 30 4.086 -17.670 -3.217 268 HG23 THR 30 HG23 THR 30 3.180 -19.191 -3.141 269 H GLU 31 H GLU 31 5.113 -15.522 0.653 270 HA GLU 31 HA GLU 31 6.929 -15.982 1.981 271 HB2 GLU 31 HB2 GLU 31 5.634 -18.587 2.788 272 HB3 GLU 31 HB3 GLU 31 6.761 -17.578 3.678 273 HG2 GLU 31 HG2 GLU 31 4.953 -15.803 3.804 274 HG3 GLU 31 HG3 GLU 31 3.828 -17.024 3.179 275 H LYS 32 H LYS 32 6.566 -17.325 -0.784 276 HA LYS 32 HA LYS 32 7.995 -19.673 -0.966 277 HB2 LYS 32 HB2 LYS 32 6.712 -18.215 -2.787 278 HB3 LYS 32 HB3 LYS 32 8.291 -17.537 -3.093 279 HG2 LYS 32 HG2 LYS 32 8.614 -19.230 -4.508 280 HG3 LYS 32 HG3 LYS 32 8.860 -20.263 -3.103 281 HD2 LYS 32 HD2 LYS 32 6.250 -19.774 -4.600 282 HD3 LYS 32 HD3 LYS 32 7.216 -21.247 -4.678 283 HE2 LYS 32 HE2 LYS 32 5.915 -20.195 -2.135 284 HE3 LYS 32 HE3 LYS 32 5.138 -21.346 -3.221 285 HZ1 LYS 32 HZ1 LYS 32 6.260 -22.254 -1.260 286 HZ2 LYS 32 HZ2 LYS 32 7.728 -21.923 -1.904 287 HZ3 LYS 32 HZ3 LYS 32 6.717 -22.965 -2.676 288 H TYR 33 H TYR 33 9.564 -16.420 -1.651 289 HA TYR 33 HA TYR 33 11.782 -17.020 -0.022 290 HB2 TYR 33 HB2 TYR 33 12.021 -18.451 -2.355 291 HB3 TYR 33 HB3 TYR 33 12.726 -16.931 -2.866 292 HD1 TYR 33 HD1 TYR 33 14.923 -16.243 -1.994 293 HD2 TYR 33 HD2 TYR 33 12.815 -19.591 -0.247 294 HE1 TYR 33 HE1 TYR 33 16.838 -16.719 -0.549 295 HE2 TYR 33 HE2 TYR 33 14.733 -20.076 1.175 296 HH TYR 33 HH TYR 33 16.755 -19.166 2.025 297 H GLY 34 H GLY 34 13.503 -15.284 -0.300 298 HA2 GLY 34 HA2 GLY 34 13.116 -12.951 -1.897 299 HA3 GLY 34 HA3 GLY 34 12.539 -12.709 -0.230 300 H SER 35 H SER 35 14.986 -11.552 -1.578 301 HA SER 35 HA SER 35 16.917 -11.878 0.512 302 HB2 SER 35 HB2 SER 35 17.831 -12.811 -2.256 303 HB3 SER 35 HB3 SER 35 18.755 -12.823 -0.750 304 HG SER 35 HG SER 35 16.771 -14.272 -0.157 305 H GLY 36 H GLY 36 19.071 -10.632 -0.293 306 HA2 GLY 36 HA2 GLY 36 18.951 -8.852 -2.508 307 HA3 GLY 36 HA3 GLY 36 18.488 -8.031 -1.002 308 H SER 37 H SER 37 20.869 -7.434 -2.482 309 HA SER 37 HA SER 37 22.875 -7.393 -0.457 310 HB2 SER 37 HB2 SER 37 23.068 -9.347 -2.785 311 HB3 SER 37 HB3 SER 37 24.520 -8.592 -2.122 312 HG SER 37 HG SER 37 22.629 -9.814 -0.422 313 H GLY 38 H GLY 38 24.972 -6.445 -1.713 314 HA2 GLY 38 HA2 GLY 38 25.092 -5.268 -4.117 315 HA3 GLY 38 HA3 GLY 38 24.005 -4.163 -3.253 316 H SER 39 H SER 39 27.278 -5.047 -3.761 317 HA SER 39 HA SER 39 28.200 -3.004 -1.861 318 HB2 SER 39 HB2 SER 39 28.199 -5.249 -0.719 319 HB3 SER 39 HB3 SER 39 29.359 -5.813 -1.935 320 HG SER 39 HG SER 39 30.203 -5.038 0.088 321 H GLY 40 H GLY 40 30.629 -2.692 -2.282 322 HA2 GLY 40 HA2 GLY 40 32.428 -3.079 -3.984 323 HA3 GLY 40 HA3 GLY 40 31.210 -2.827 -5.230 324 H SER 41 H SER 41 29.887 -0.519 -3.908 325 HA SER 41 HA SER 41 31.622 1.522 -4.894 326 HB2 SER 41 HB2 SER 41 29.839 3.077 -4.243 327 HB3 SER 41 HB3 SER 41 29.255 1.699 -5.178 328 HG SER 41 HG SER 41 28.103 2.432 -3.168 329 H GLY 42 H GLY 42 32.640 0.040 -2.433 330 HA2 GLY 42 HA2 GLY 42 33.154 2.347 -0.591 331 HA3 GLY 42 HA3 GLY 42 33.217 0.627 -0.145 332 H SER 43 H SER 43 34.773 3.161 -2.164 333 HA SER 43 HA SER 43 37.360 1.820 -1.948 334 HB2 SER 43 HB2 SER 43 35.962 2.431 -4.596 335 HB3 SER 43 HB3 SER 43 37.705 2.159 -4.446 336 HG SER 43 HG SER 43 35.825 0.272 -3.478 337 H GLY 44 H GLY 44 39.110 3.410 -2.619 338 HA2 GLY 44 HA2 GLY 44 38.654 6.061 -3.355 339 HA3 GLY 44 HA3 GLY 44 38.661 5.980 -1.577 340 H SER 45 H SER 45 40.723 7.426 -2.509 341 HA SER 45 HA SER 45 43.073 5.804 -3.101 342 HB2 SER 45 HB2 SER 45 44.119 8.121 -3.037 343 HB3 SER 45 HB3 SER 45 42.822 7.908 -4.228 344 HG SER 45 HG SER 45 42.680 9.154 -1.698 345 H GLY 46 H GLY 46 42.372 4.605 -0.939 346 HA2 GLY 46 HA2 GLY 46 44.027 4.272 0.942 347 HA3 GLY 46 HA3 GLY 46 43.597 5.921 1.441 348 H SER 47 H SER 47 42.717 5.077 3.447 349 HA SER 47 HA SER 47 40.378 3.306 3.281 350 HB2 SER 47 HB2 SER 47 41.784 4.517 5.695 351 HB3 SER 47 HB3 SER 47 40.612 3.181 5.695 352 HG SER 47 HG SER 47 42.748 2.391 5.781 353 H GLY 48 H GLY 48 38.325 3.918 4.171 354 HA2 GLY 48 HA2 GLY 48 37.606 6.715 3.791 355 HA3 GLY 48 HA3 GLY 48 36.531 5.363 4.212 356 H SER 49 H SER 49 38.026 8.174 5.456 357 HA SER 49 HA SER 49 38.408 7.333 8.181 358 HB2 SER 49 HB2 SER 49 38.588 9.935 8.374 359 HB3 SER 49 HB3 SER 49 39.816 9.030 7.479 360 HG SER 49 HG SER 49 39.038 10.891 6.355 361 H GLY 50 H GLY 50 35.499 7.523 6.588 362 HA2 GLY 50 HA2 GLY 50 33.996 7.855 9.001 363 HA3 GLY 50 HA3 GLY 50 33.783 9.208 7.862 364 H SER 51 H SER 51 31.604 7.645 8.415 365 HA SER 51 HA SER 51 31.218 5.921 6.026 366 HB2 SER 51 HB2 SER 51 29.886 5.807 8.765 367 HB3 SER 51 HB3 SER 51 29.638 4.677 7.423 368 HG SER 51 HG SER 51 31.120 3.908 9.014 369 H GLY 52 H GLY 52 28.689 5.700 5.638 370 HA2 GLY 52 HA2 GLY 52 27.621 8.421 5.224 371 HA3 GLY 52 HA3 GLY 52 27.144 6.911 4.419 372 H SER 53 H SER 53 25.157 8.542 5.436 373 HA SER 53 HA SER 53 24.027 6.827 7.562 374 HB2 SER 53 HB2 SER 53 24.066 9.864 7.677 375 HB3 SER 53 HB3 SER 53 23.280 8.783 8.832 376 HG SER 53 HG SER 53 25.335 9.550 9.550 377 H GLY 54 H GLY 54 21.797 6.649 7.398 378 HA2 GLY 54 HA2 GLY 54 20.548 7.696 4.906 379 HA3 GLY 54 HA3 GLY 54 20.020 6.301 5.857 380 H SER 55 H SER 55 18.094 8.106 5.249 381 HA SER 55 HA SER 55 17.244 9.150 7.826 382 HB2 SER 55 HB2 SER 55 17.870 10.894 5.402 383 HB3 SER 55 HB3 SER 55 16.686 11.380 6.615 384 HG SER 55 HG SER 55 18.215 11.406 8.182 385 H GLY 56 H GLY 56 14.967 10.351 7.151 386 HA2 GLY 56 HA2 GLY 56 13.471 8.633 5.240 387 HA3 GLY 56 HA3 GLY 56 12.907 8.896 6.898 388 H SER 57 H SER 57 11.042 9.747 5.320 389 HA SER 57 HA SER 57 11.419 12.690 5.049 390 HB2 SER 57 HB2 SER 57 9.921 10.949 3.074 391 HB3 SER 57 HB3 SER 57 10.184 12.704 2.991 392 HG SER 57 HG SER 57 11.762 11.714 1.744 393 H GLY 58 H GLY 58 8.331 10.972 4.342 394 HA2 GLY 58 HA2 GLY 58 7.300 11.260 6.999 395 HA3 GLY 58 HA3 GLY 58 6.881 12.672 6.024 396 H TYR 59 H TYR 59 5.797 12.221 3.903 397 HA TYR 59 HA TYR 59 3.577 10.434 4.305 398 HB2 TYR 59 HB2 TYR 59 3.607 12.775 3.272 399 HB3 TYR 59 HB3 TYR 59 4.286 12.050 1.824 400 HD1 TYR 59 HD1 TYR 59 2.654 11.803 0.121 401 HD2 TYR 59 HD2 TYR 59 1.460 11.269 4.242 402 HE1 TYR 59 HE1 TYR 59 0.349 11.215 -0.609 403 HE2 TYR 59 HE2 TYR 59 -0.823 10.711 3.516 404 HH TYR 59 HH TYR 59 -2.268 10.491 1.730 405 H GLN3288 H GLN3288 3.130 9.630 1.553 406 HA GLN3288 HA GLN3288 4.523 7.117 1.618 407 HB2 GLN3288 HB2 GLN3288 3.221 6.475 -0.269 408 HB3 GLN3288 HB3 GLN3288 2.210 7.362 0.858 409 HG2 GLN3288 HG2 GLN3288 2.554 9.419 -0.653 410 HG3 GLN3288 HG3 GLN3288 3.291 8.321 -1.823 411 HE21 GLN3288 HE21 GLN3288 1.671 8.066 -3.442 412 HE22 GLN3288 HE22 GLN3288 0.030 7.603 -3.081 413 H ILE3289 H ILE3289 5.391 6.290 -0.700 414 HA ILE3289 HA ILE3289 7.576 8.163 -1.358 415 HB ILE3289 HB ILE3289 7.816 5.170 -1.469 416 HG12 ILE3289 HG12 ILE3289 8.746 7.021 0.772 417 HG13 ILE3289 HG13 ILE3289 7.339 5.981 0.913 418 HG21 ILE3289 HG21 ILE3289 9.381 6.574 -2.841 419 HG22 ILE3289 HG22 ILE3289 9.850 7.461 -1.381 420 HG23 ILE3289 HG23 ILE3289 10.229 5.737 -1.541 421 HD11 ILE3289 HD11 ILE3289 10.162 4.967 0.575 422 HD12 ILE3289 HD12 ILE3289 9.147 4.949 2.029 423 HD13 ILE3289 HD13 ILE3289 8.678 3.974 0.635 424 H GLU3290 H GLU3290 6.727 9.178 -3.031 425 HA GLU3290 HA GLU3290 5.256 7.967 -5.198 426 HB2 GLU3290 HB2 GLU3290 5.073 10.314 -4.270 427 HB3 GLU3290 HB3 GLU3290 6.630 10.687 -5.021 428 HG2 GLU3290 HG2 GLU3290 5.671 10.234 -7.247 429 HG3 GLU3290 HG3 GLU3290 4.143 9.732 -6.513 430 H THR3291 H THR3291 8.574 8.030 -4.410 431 HA THR3291 HA THR3291 9.386 7.400 -7.207 432 HB THR3291 HB THR3291 10.053 9.588 -6.572 433 HG1 THR3291 HG1 THR3291 11.490 8.739 -7.901 434 HG21 THR3291 HG21 THR3291 11.794 8.519 -4.354 435 HG22 THR3291 HG22 THR3291 10.242 9.325 -4.095 436 HG23 THR3291 HG23 THR3291 11.567 10.201 -4.854 437 H PHE3292 H PHE3292 8.440 5.238 -6.292 438 HA PHE3292 HA PHE3292 10.614 3.563 -5.703 439 HB2 PHE3292 HB2 PHE3292 10.429 4.386 -3.421 440 HB3 PHE3292 HB3 PHE3292 8.689 4.132 -3.410 441 HD1 PHE3292 HD1 PHE3292 10.811 1.452 -4.928 442 HD2 PHE3292 HD2 PHE3292 9.022 2.945 -1.293 443 HE1 PHE3292 HE1 PHE3292 11.071 -0.733 -3.902 444 HE2 PHE3292 HE2 PHE3292 9.377 0.714 -0.221 445 HZ PHE3292 HZ PHE3292 10.378 -1.134 -1.541 446 H PHE3293 H PHE3293 7.252 3.363 -4.531 447 HA PHE3293 HA PHE3293 6.667 1.196 -6.476 448 HB2 PHE3293 HB2 PHE3293 4.895 0.659 -4.665 449 HB3 PHE3293 HB3 PHE3293 6.593 0.344 -4.375 450 HD1 PHE3293 HD1 PHE3293 6.824 0.418 -2.035 451 HD2 PHE3293 HD2 PHE3293 4.765 3.659 -4.030 452 HE1 PHE3293 HE1 PHE3293 6.840 1.755 0.050 453 HE2 PHE3293 HE2 PHE3293 4.782 4.938 -1.989 454 HZ PHE3293 HZ PHE3293 5.857 4.048 0.069 455 H ALA3294 H ALA3294 6.274 4.273 -6.812 456 HA ALA3294 HA ALA3294 3.609 5.004 -6.772 457 HB1 ALA3294 HB1 ALA3294 5.236 6.598 -7.287 458 HB2 ALA3294 HB2 ALA3294 5.810 5.707 -8.734 459 HB3 ALA3294 HB3 ALA3294 4.229 6.487 -8.730 460 H GLN3295 H GLN3295 5.133 2.868 -9.114 461 HA GLN3295 HA GLN3295 2.868 3.019 -10.988 462 HB2 GLN3295 HB2 GLN3295 5.025 0.871 -10.794 463 HB3 GLN3295 HB3 GLN3295 3.904 1.139 -12.127 464 HG2 GLN3295 HG2 GLN3295 6.123 2.982 -11.211 465 HG3 GLN3295 HG3 GLN3295 6.043 2.065 -12.724 466 HE21 GLN3295 HE21 GLN3295 6.007 5.171 -11.939 467 HE22 GLN3295 HE22 GLN3295 4.622 5.799 -12.784 468 H ASP3296 H ASP3296 3.806 0.859 -8.353 469 HA ASP3296 HA ASP3296 1.623 -1.027 -8.981 470 HB2 ASP3296 HB2 ASP3296 3.169 -0.657 -6.401 471 HB3 ASP3296 HB3 ASP3296 2.088 -2.011 -6.756 472 H ILE3297 H ILE3297 2.047 1.877 -7.078 473 HA ILE3297 HA ILE3297 -0.103 1.611 -5.267 474 HB ILE3297 HB ILE3297 1.790 3.660 -6.162 475 HG12 ILE3297 HG12 ILE3297 1.545 4.584 -3.913 476 HG13 ILE3297 HG13 ILE3297 0.129 3.572 -3.615 477 HG21 ILE3297 HG21 ILE3297 -0.955 4.829 -5.688 478 HG22 ILE3297 HG22 ILE3297 0.577 5.728 -5.722 479 HG23 ILE3297 HG23 ILE3297 0.017 4.899 -7.175 480 HD11 ILE3297 HD11 ILE3297 2.338 2.741 -2.658 481 HD12 ILE3297 HD12 ILE3297 1.483 1.567 -3.682 482 HD13 ILE3297 HD13 ILE3297 2.869 2.448 -4.320 483 H GLU3298 H GLU3298 -0.078 2.951 -8.581 484 HA GLU3298 HA GLU3298 -2.848 3.719 -8.516 485 HB2 GLU3298 HB2 GLU3298 -2.533 3.868 -11.014 486 HB3 GLU3298 HB3 GLU3298 -1.460 4.874 -10.023 487 HG2 GLU3298 HG2 GLU3298 0.415 3.510 -10.396 488 HG3 GLU3298 HG3 GLU3298 -0.560 2.147 -10.925 489 H SER3299 H SER3299 -1.084 0.830 -9.511 490 HA SER3299 HA SER3299 -3.318 -0.491 -10.745 491 HB2 SER3299 HB2 SER3299 -0.896 -1.100 -11.033 492 HB3 SER3299 HB3 SER3299 -0.905 -1.788 -9.400 493 HG SER3299 HG SER3299 -2.483 -3.271 -10.081 494 H VAL3300 H VAL3300 -2.076 -0.410 -7.449 495 HA VAL3300 HA VAL3300 -3.863 -2.386 -6.330 496 HB VAL3300 HB VAL3300 -1.985 -0.235 -5.274 497 HG11 VAL3300 HG11 VAL3300 -2.153 -1.349 -3.056 498 HG12 VAL3300 HG12 VAL3300 -3.617 -0.470 -3.519 499 HG13 VAL3300 HG13 VAL3300 -3.567 -2.247 -3.685 500 HG21 VAL3300 HG21 VAL3300 -1.763 -3.261 -5.075 501 HG22 VAL3300 HG22 VAL3300 -1.165 -2.382 -6.480 502 HG23 VAL3300 HG23 VAL3300 -0.492 -2.016 -4.908 503 H GLN3301 H GLN3301 -3.808 1.229 -6.370 504 HA GLN3301 HA GLN3301 -6.296 1.341 -4.957 505 HB2 GLN3301 HB2 GLN3301 -6.293 3.598 -5.163 506 HB3 GLN3301 HB3 GLN3301 -4.607 3.121 -5.026 507 HG2 GLN3301 HG2 GLN3301 -4.218 4.479 -6.771 508 HG3 GLN3301 HG3 GLN3301 -4.994 3.230 -7.760 509 HE21 GLN3301 HE21 GLN3301 -7.685 3.497 -7.292 510 HE22 GLN3301 HE22 GLN3301 -8.130 4.961 -8.078 511 H LYS3302 H LYS3302 -5.550 0.951 -8.358 512 HA LYS3302 HA LYS3302 -8.109 1.543 -9.485 513 HB2 LYS3302 HB2 LYS3302 -5.740 -0.101 -10.303 514 HB3 LYS3302 HB3 LYS3302 -7.259 -0.364 -11.148 515 HG2 LYS3302 HG2 LYS3302 -7.361 1.815 -11.995 516 HG3 LYS3302 HG3 LYS3302 -6.203 2.454 -10.829 517 HD2 LYS3302 HD2 LYS3302 -5.324 2.223 -13.170 518 HD3 LYS3302 HD3 LYS3302 -4.346 1.437 -11.934 519 HE2 LYS3302 HE2 LYS3302 -5.237 -0.758 -12.515 520 HE3 LYS3302 HE3 LYS3302 -6.365 -0.031 -13.677 521 HZ1 LYS3302 HZ1 LYS3302 -4.543 0.660 -14.999 522 HZ2 LYS3302 HZ2 LYS3302 -4.371 -0.945 -14.710 523 HZ3 LYS3302 HZ3 LYS3302 -3.416 0.139 -13.911 524 H GLU3303 H GLU3303 -6.865 -1.221 -7.680 525 HA GLU3303 HA GLU3303 -9.107 -2.994 -8.372 526 HB2 GLU3303 HB2 GLU3303 -7.877 -4.597 -7.496 527 HB3 GLU3303 HB3 GLU3303 -6.581 -3.426 -7.332 528 HG2 GLU3303 HG2 GLU3303 -7.433 -2.960 -4.996 529 HG3 GLU3303 HG3 GLU3303 -8.594 -4.260 -5.191 530 H LEU3304 H LEU3304 -8.370 -0.774 -5.787 531 HA LEU3304 HA LEU3304 -10.680 -1.368 -4.187 532 HB2 LEU3304 HB2 LEU3304 -8.725 0.953 -4.201 533 HB3 LEU3304 HB3 LEU3304 -9.862 0.611 -2.924 534 HG LEU3304 HG LEU3304 -7.618 -1.255 -3.848 535 HD11 LEU3304 HD11 LEU3304 -6.753 0.669 -2.944 536 HD12 LEU3304 HD12 LEU3304 -6.487 -0.652 -1.820 537 HD13 LEU3304 HD13 LEU3304 -7.773 0.542 -1.470 538 HD21 LEU3304 HD21 LEU3304 -9.396 -1.514 -1.406 539 HD22 LEU3304 HD22 LEU3304 -8.002 -2.533 -1.801 540 HD23 LEU3304 HD23 LEU3304 -9.405 -2.571 -2.846 541 H GLU3305 H GLU3305 -10.041 1.203 -6.594 542 HA GLU3305 HA GLU3305 -12.194 2.881 -5.761 543 HB2 GLU3305 HB2 GLU3305 -11.919 3.997 -7.935 544 HB3 GLU3305 HB3 GLU3305 -10.395 3.741 -7.060 545 HG2 GLU3305 HG2 GLU3305 -9.920 1.770 -8.377 546 HG3 GLU3305 HG3 GLU3305 -11.418 1.938 -9.295 547 H ASN3306 H ASN3306 -12.319 -0.080 -7.501 548 HA ASN3306 HA ASN3306 -15.124 0.525 -8.329 549 HB2 ASN3306 HB2 ASN3306 -14.981 -1.107 -9.976 550 HB3 ASN3306 HB3 ASN3306 -13.430 -0.264 -10.086 551 HD21 ASN3306 HD21 ASN3306 -11.479 -1.309 -9.218 552 HD22 ASN3306 HD22 ASN3306 -11.524 -3.022 -8.951 553 H LEU3307 H LEU3307 -13.636 -0.571 -5.593 554 HA LEU3307 HA LEU3307 -15.290 -2.997 -5.306 555 HB2 LEU3307 HB2 LEU3307 -12.745 -2.027 -4.395 556 HB3 LEU3307 HB3 LEU3307 -13.790 -2.094 -2.995 557 HG LEU3307 HG LEU3307 -13.622 -4.235 -2.804 558 HD11 LEU3307 HD11 LEU3307 -13.773 -4.684 -5.784 559 HD12 LEU3307 HD12 LEU3307 -15.014 -5.011 -4.526 560 HD13 LEU3307 HD13 LEU3307 -13.554 -5.981 -4.591 561 HD21 LEU3307 HD21 LEU3307 -11.299 -3.889 -4.648 562 HD22 LEU3307 HD22 LEU3307 -11.533 -5.255 -3.546 563 HD23 LEU3307 HD23 LEU3307 -11.363 -3.610 -2.909 564 H SER3308 H SER3308 -16.801 -3.236 -3.610 565 HA SER3308 HA SER3308 -18.368 -0.878 -2.966 566 HB2 SER3308 HB2 SER3308 -18.580 -3.813 -2.175 567 HB3 SER3308 HB3 SER3308 -19.836 -2.590 -1.890 568 HG SER3308 HG SER3308 -20.471 -2.817 -3.846 569 H GLU3309 H GLU3309 -19.181 -0.542 -0.584 570 HA GLU3309 HA GLU3309 -16.973 -0.120 1.124 571 HB2 GLU3309 HB2 GLU3309 -20.011 -0.018 1.286 572 HB3 GLU3309 HB3 GLU3309 -19.209 -0.332 2.820 573 HG2 GLU3309 HG2 GLU3309 -18.058 1.645 2.846 574 HG3 GLU3309 HG3 GLU3309 -18.332 2.002 1.149 575 H GLU3310 H GLU3310 -19.500 -2.679 1.140 576 HA GLU3310 HA GLU3310 -18.610 -4.106 3.321 577 HB2 GLU3310 HB2 GLU3310 -19.770 -6.018 2.295 578 HB3 GLU3310 HB3 GLU3310 -20.669 -4.529 1.954 579 HG2 GLU3310 HG2 GLU3310 -19.321 -4.412 -0.248 580 HG3 GLU3310 HG3 GLU3310 -18.796 -6.047 0.132 581 H GLU3311 H GLU3311 -16.879 -3.826 0.244 582 HA GLU3311 HA GLU3311 -15.303 -6.252 0.723 583 HB2 GLU3311 HB2 GLU3311 -15.339 -4.096 -1.404 584 HB3 GLU3311 HB3 GLU3311 -14.289 -5.511 -1.395 585 HG2 GLU3311 HG2 GLU3311 -17.237 -6.032 -1.238 586 HG3 GLU3311 HG3 GLU3311 -16.635 -5.404 -2.721 587 H LEU3312 H LEU3312 -14.934 -2.706 0.459 588 HA LEU3312 HA LEU3312 -12.173 -2.705 1.275 589 HB2 LEU3312 HB2 LEU3312 -14.021 -0.303 1.365 590 HB3 LEU3312 HB3 LEU3312 -12.317 -0.272 1.161 591 HG LEU3312 HG LEU3312 -13.967 -1.632 -0.956 592 HD11 LEU3312 HD11 LEU3312 -15.205 0.313 -0.637 593 HD12 LEU3312 HD12 LEU3312 -14.225 0.554 -2.083 594 HD13 LEU3312 HD13 LEU3312 -13.741 1.357 -0.575 595 HD21 LEU3312 HD21 LEU3312 -11.632 -1.860 -1.208 596 HD22 LEU3312 HD22 LEU3312 -11.348 -0.129 -0.958 597 HD23 LEU3312 HD23 LEU3312 -12.186 -0.685 -2.414 598 H LEU3313 H LEU3313 -15.144 -1.517 2.795 599 HA LEU3313 HA LEU3313 -14.208 -0.587 5.263 600 HB2 LEU3313 HB2 LEU3313 -16.444 -0.076 4.238 601 HB3 LEU3313 HB3 LEU3313 -16.923 -1.769 4.435 602 HG LEU3313 HG LEU3313 -17.866 -0.205 6.093 603 HD11 LEU3313 HD11 LEU3313 -18.040 -1.854 7.791 604 HD12 LEU3313 HD12 LEU3313 -16.572 -2.678 7.258 605 HD13 LEU3313 HD13 LEU3313 -18.001 -2.651 6.219 606 HD21 LEU3313 HD21 LEU3313 -15.867 1.007 6.863 607 HD22 LEU3313 HD22 LEU3313 -15.216 -0.510 7.527 608 HD23 LEU3313 HD23 LEU3313 -16.699 0.190 8.181 609 H ALA3314 H ALA3314 -15.235 -3.859 4.146 610 HA ALA3314 HA ALA3314 -15.023 -4.952 6.733 611 HB1 ALA3314 HB1 ALA3314 -14.896 -7.140 5.574 612 HB2 ALA3314 HB2 ALA3314 -16.137 -6.089 4.903 613 HB3 ALA3314 HB3 ALA3314 -14.624 -6.285 4.013 614 H MET3315 H MET3315 -12.475 -4.235 4.370 615 HA MET3315 HA MET3315 -10.467 -5.968 5.575 616 HB2 MET3315 HB2 MET3315 -9.987 -3.562 3.768 617 HB3 MET3315 HB3 MET3315 -8.903 -4.921 4.043 618 HG2 MET3315 HG2 MET3315 -11.564 -5.737 3.127 619 HG3 MET3315 HG3 MET3315 -10.846 -4.594 2.041 620 HE1 MET3315 HE1 MET3315 -11.342 -6.812 0.346 621 HE2 MET3315 HE2 MET3315 -10.634 -8.415 0.659 622 HE3 MET3315 HE3 MET3315 -11.827 -7.729 1.779 623 H LEU3316 H LEU3316 -10.910 -2.425 5.441 624 HA LEU3316 HA LEU3316 -8.797 -1.825 7.300 625 HB2 LEU3316 HB2 LEU3316 -9.877 0.396 7.477 626 HB3 LEU3316 HB3 LEU3316 -9.540 -0.135 5.839 627 HG LEU3316 HG LEU3316 -12.099 -0.992 6.001 628 HD11 LEU3316 HD11 LEU3316 -12.635 -0.169 8.283 629 HD12 LEU3316 HD12 LEU3316 -13.459 0.856 7.118 630 HD13 LEU3316 HD13 LEU3316 -11.980 1.426 7.889 631 HD21 LEU3316 HD21 LEU3316 -10.934 0.821 4.491 632 HD22 LEU3316 HD22 LEU3316 -11.814 1.956 5.549 633 HD23 LEU3316 HD23 LEU3316 -12.669 0.719 4.607 634 H ASN3317 H ASN3317 -12.256 -2.603 7.749 635 HA ASN3317 HA ASN3317 -12.140 -1.958 10.589 636 HB2 ASN3317 HB2 ASN3317 -14.200 -2.076 8.920 637 HB3 ASN3317 HB3 ASN3317 -14.254 -3.773 9.407 638 HD21 ASN3317 HD21 ASN3317 -15.393 -0.813 9.922 639 HD22 ASN3317 HD22 ASN3317 -15.922 -0.931 11.619 640 H GLY3318 H GLY3318 -11.657 -4.716 8.573 641 HA2 GLY3318 HA2 GLY3318 -10.595 -6.758 8.954 642 HA3 GLY3318 HA3 GLY3318 -10.320 -6.292 10.652 643 H ASP3319 H ASP3319 -13.290 -6.504 8.653 644 HA ASP3319 HA ASP3319 -14.447 -8.482 10.520 645 HB2 ASP3319 HB2 ASP3319 -15.222 -5.878 10.600 646 HB3 ASP3319 HB3 ASP3319 -16.364 -6.511 9.420 647 H GLN3320 H GLN3320 -16.824 -8.896 9.305 648 HA GLN3320 HA GLN3320 -16.208 -9.871 6.563 649 HB2 GLN3320 HB2 GLN3320 -17.637 -11.882 7.159 650 HB3 GLN3320 HB3 GLN3320 -16.107 -11.791 8.033 651 HG2 GLN3320 HG2 GLN3320 -17.159 -11.047 10.045 652 HG3 GLN3320 HG3 GLN3320 -18.677 -10.690 9.221 653 HE21 GLN3320 HE21 GLN3320 -20.119 -11.994 10.108 654 HE22 GLN3320 HE22 GLN3320 -19.995 -13.718 10.395 655 H GLN3321 H GLN3321 -17.420 -7.358 7.374 656 HA GLN3321 HA GLN3321 -19.964 -7.548 5.908 657 HB2 GLN3321 HB2 GLN3321 -19.634 -6.072 8.560 658 HB3 GLN3321 HB3 GLN3321 -21.055 -6.063 7.512 659 HG2 GLN3321 HG2 GLN3321 -21.097 -8.618 7.859 660 HG3 GLN3321 HG3 GLN3321 -20.015 -8.328 9.237 661 HE21 GLN3321 HE21 GLN3321 -22.847 -9.245 8.989 662 HE22 GLN3321 HE22 GLN3321 -23.905 -8.088 9.770 Start of MODEL 18 1 H1 MET 1 H MET 1 -20.759 15.210 -2.838 2 HA MET 1 HA MET 1 -21.322 13.841 -0.283 3 HB2 MET 1 HB2 MET 1 -23.099 15.799 -1.746 4 HB3 MET 1 HB3 MET 1 -23.744 14.557 -0.673 5 HG2 MET 1 HG2 MET 1 -22.297 15.337 1.133 6 HG3 MET 1 HG3 MET 1 -21.683 16.621 0.079 7 HE1 MET 1 HE1 MET 1 -25.927 16.438 1.954 8 HE2 MET 1 HE2 MET 1 -25.479 15.326 0.647 9 HE3 MET 1 HE3 MET 1 -24.629 15.251 2.209 10 H ASN 2 H ASN 2 -23.401 14.074 -3.204 11 HA ASN 2 HA ASN 2 -23.745 11.205 -3.023 12 HB2 ASN 2 HB2 ASN 2 -24.837 13.094 -5.145 13 HB3 ASN 2 HB3 ASN 2 -25.435 11.487 -4.739 14 HD21 ASN 2 HD21 ASN 2 -25.845 11.520 -1.919 15 HD22 ASN 2 HD22 ASN 2 -26.842 12.915 -1.584 16 H ILE 3 H ILE 3 -21.538 10.545 -3.409 17 HA ILE 3 HA ILE 3 -20.781 10.144 -6.191 18 HB ILE 3 HB ILE 3 -19.976 12.445 -5.568 19 HG12 ILE 3 HG12 ILE 3 -17.592 10.644 -5.987 20 HG13 ILE 3 HG13 ILE 3 -18.809 10.967 -7.236 21 HG21 ILE 3 HG21 ILE 3 -18.140 12.714 -3.971 22 HG22 ILE 3 HG22 ILE 3 -19.577 12.095 -3.168 23 HG23 ILE 3 HG23 ILE 3 -18.251 10.993 -3.539 24 HD11 ILE 3 HD11 ILE 3 -17.199 13.169 -5.897 25 HD12 ILE 3 HD12 ILE 3 -16.863 12.446 -7.474 26 HD13 ILE 3 HD13 ILE 3 -18.375 13.337 -7.211 27 H ASN 4 H ASN 4 -19.156 8.525 -6.342 28 HA ASN 4 HA ASN 4 -18.790 6.908 -3.869 29 HB2 ASN 4 HB2 ASN 4 -18.967 4.863 -5.230 30 HB3 ASN 4 HB3 ASN 4 -20.484 5.748 -5.091 31 HD21 ASN 4 HD21 ASN 4 -17.808 4.890 -7.420 32 HD22 ASN 4 HD22 ASN 4 -18.597 5.706 -8.735 33 H GLU 5 H GLU 5 -17.539 7.736 -7.115 34 HA GLU 5 HA GLU 5 -15.048 6.469 -6.910 35 HB2 GLU 5 HB2 GLU 5 -15.938 8.977 -8.363 36 HB3 GLU 5 HB3 GLU 5 -14.298 8.331 -8.493 37 HG2 GLU 5 HG2 GLU 5 -15.327 6.074 -9.126 38 HG3 GLU 5 HG3 GLU 5 -16.891 6.894 -9.212 39 H GLN 6 H GLN 6 -16.062 9.571 -5.634 40 HA GLN 6 HA GLN 6 -13.424 10.347 -4.687 41 HB2 GLN 6 HB2 GLN 6 -15.454 11.794 -5.305 42 HB3 GLN 6 HB3 GLN 6 -16.085 11.429 -3.700 43 HG2 GLN 6 HG2 GLN 6 -14.263 12.487 -2.616 44 HG3 GLN 6 HG3 GLN 6 -13.294 12.491 -4.098 45 HE21 GLN 6 HE21 GLN 6 -13.426 14.223 -5.491 46 HE22 GLN 6 HE22 GLN 6 -14.601 15.512 -5.402 47 H THR 7 H THR 7 -16.185 8.583 -3.448 48 HA THR 7 HA THR 7 -15.360 8.718 -0.682 49 HB THR 7 HB THR 7 -16.997 6.552 -2.015 50 HG1 THR 7 HG1 THR 7 -18.681 7.756 -1.796 51 HG21 THR 7 HG21 THR 7 -16.226 5.909 0.163 52 HG22 THR 7 HG22 THR 7 -17.919 6.387 0.359 53 HG23 THR 7 HG23 THR 7 -16.598 7.492 0.862 54 H LEU 8 H LEU 8 -14.674 6.321 -3.332 55 HA LEU 8 HA LEU 8 -13.465 4.268 -1.946 56 HB2 LEU 8 HB2 LEU 8 -12.035 5.356 -4.376 57 HB3 LEU 8 HB3 LEU 8 -12.327 3.708 -3.846 58 HG LEU 8 HG LEU 8 -14.336 5.624 -5.089 59 HD11 LEU 8 HD11 LEU 8 -13.045 3.174 -6.315 60 HD12 LEU 8 HD12 LEU 8 -12.615 4.850 -6.677 61 HD13 LEU 8 HD13 LEU 8 -14.222 4.240 -7.092 62 HD21 LEU 8 HD21 LEU 8 -15.601 4.145 -3.691 63 HD22 LEU 8 HD22 LEU 8 -14.620 2.768 -4.221 64 HD23 LEU 8 HD23 LEU 8 -15.769 3.539 -5.344 65 H ASP 9 H ASP 9 -12.239 7.526 -2.572 66 HA ASP 9 HA ASP 9 -9.501 7.308 -2.193 67 HB2 ASP 9 HB2 ASP 9 -10.853 9.317 -2.824 68 HB3 ASP 9 HB3 ASP 9 -11.212 9.551 -1.104 69 H LYS 10 H LYS 10 -12.066 7.663 0.317 70 HA LYS 10 HA LYS 10 -10.159 7.685 2.494 71 HB2 LYS 10 HB2 LYS 10 -11.940 7.878 3.965 72 HB3 LYS 10 HB3 LYS 10 -12.536 8.647 2.485 73 HG2 LYS 10 HG2 LYS 10 -13.730 6.651 1.903 74 HG3 LYS 10 HG3 LYS 10 -13.238 5.822 3.359 75 HD2 LYS 10 HD2 LYS 10 -14.754 8.466 3.335 76 HD3 LYS 10 HD3 LYS 10 -15.588 6.926 3.103 77 HE2 LYS 10 HE2 LYS 10 -14.757 6.112 5.271 78 HE3 LYS 10 HE3 LYS 10 -13.967 7.676 5.570 79 HZ1 LYS 10 HZ1 LYS 10 -16.103 8.719 5.521 80 HZ2 LYS 10 HZ2 LYS 10 -16.204 7.474 6.575 81 HZ3 LYS 10 HZ3 LYS 10 -16.866 7.335 5.066 82 H LEU 11 H LEU 11 -11.683 5.171 0.638 83 HA LEU 11 HA LEU 11 -11.269 3.047 2.614 84 HB2 LEU 11 HB2 LEU 11 -12.191 3.005 -0.299 85 HB3 LEU 11 HB3 LEU 11 -11.835 1.583 0.687 86 HG LEU 11 HG LEU 11 -14.077 1.764 0.659 87 HD11 LEU 11 HD11 LEU 11 -13.281 2.894 3.364 88 HD12 LEU 11 HD12 LEU 11 -13.501 1.184 2.886 89 HD13 LEU 11 HD13 LEU 11 -14.874 2.272 2.952 90 HD21 LEU 11 HD21 LEU 11 -14.286 4.138 -0.071 91 HD22 LEU 11 HD22 LEU 11 -13.965 4.622 1.593 92 HD23 LEU 11 HD23 LEU 11 -15.409 3.715 1.207 93 H ARG 12 H ARG 12 -9.814 3.960 -0.558 94 HA ARG 12 HA ARG 12 -7.821 1.939 -0.473 95 HB2 ARG 12 HB2 ARG 12 -6.589 3.424 -2.149 96 HB3 ARG 12 HB3 ARG 12 -8.178 2.831 -2.521 97 HG2 ARG 12 HG2 ARG 12 -8.952 4.821 -2.953 98 HG3 ARG 12 HG3 ARG 12 -8.605 5.354 -1.325 99 HD2 ARG 12 HD2 ARG 12 -6.198 5.399 -2.929 100 HD3 ARG 12 HD3 ARG 12 -7.561 6.274 -3.681 101 HE ARG 12 HE ARG 12 -7.561 7.188 -1.086 102 HH11 ARG 12 HH11 ARG 12 -5.307 7.272 -3.852 103 HH12 ARG 12 HH12 ARG 12 -4.501 8.699 -3.303 104 HH21 ARG 12 HH21 ARG 12 -6.891 9.366 -0.792 105 HH22 ARG 12 HH22 ARG 12 -5.560 9.991 -1.681 106 H GLN 13 H GLN 13 -7.714 5.261 0.857 107 HA GLN 13 HA GLN 13 -5.039 4.975 1.754 108 HB2 GLN 13 HB2 GLN 13 -5.335 6.992 2.895 109 HB3 GLN 13 HB3 GLN 13 -6.193 7.093 1.359 110 HG2 GLN 13 HG2 GLN 13 -7.806 7.988 2.721 111 HG3 GLN 13 HG3 GLN 13 -8.241 6.308 2.739 112 HE21 GLN 13 HE21 GLN 13 -9.250 6.220 4.772 113 HE22 GLN 13 HE22 GLN 13 -8.393 6.462 6.253 114 H ALA 14 H ALA 14 -8.103 3.841 3.147 115 HA ALA 14 HA ALA 14 -7.041 3.329 5.789 116 HB1 ALA 14 HB1 ALA 14 -9.521 2.408 4.261 117 HB2 ALA 14 HB2 ALA 14 -9.155 1.898 5.917 118 HB3 ALA 14 HB3 ALA 14 -9.421 3.611 5.547 119 H VAL 15 H VAL 15 -7.566 1.458 2.783 120 HA VAL 15 HA VAL 15 -6.623 -1.056 3.712 121 HB VAL 15 HB VAL 15 -6.935 0.124 0.931 122 HG11 VAL 15 HG11 VAL 15 -6.238 -2.739 1.713 123 HG12 VAL 15 HG12 VAL 15 -6.826 -2.240 0.119 124 HG13 VAL 15 HG13 VAL 15 -5.296 -1.618 0.691 125 HG21 VAL 15 HG21 VAL 15 -9.086 -0.207 1.860 126 HG22 VAL 15 HG22 VAL 15 -8.767 -1.630 0.901 127 HG23 VAL 15 HG23 VAL 15 -8.617 -1.737 2.653 128 H LEU 16 H LEU 16 -4.915 1.530 1.786 129 HA LEU 16 HA LEU 16 -2.519 0.162 1.516 130 HB2 LEU 16 HB2 LEU 16 -1.476 2.093 0.814 131 HB3 LEU 16 HB3 LEU 16 -3.156 2.261 0.373 132 HG LEU 16 HG LEU 16 -3.349 3.697 2.544 133 HD11 LEU 16 HD11 LEU 16 -0.393 4.047 1.865 134 HD12 LEU 16 HD12 LEU 16 -1.010 3.358 3.370 135 HD13 LEU 16 HD13 LEU 16 -1.330 5.048 2.987 136 HD21 LEU 16 HD21 LEU 16 -1.958 4.745 0.036 137 HD22 LEU 16 HD22 LEU 16 -2.923 5.696 1.169 138 HD23 LEU 16 HD23 LEU 16 -3.705 4.468 0.169 139 H GLN 17 H GLN 17 -3.591 2.000 4.376 140 HA GLN 17 HA GLN 17 -1.137 1.975 5.740 141 HB2 GLN 17 HB2 GLN 17 -4.007 1.920 6.699 142 HB3 GLN 17 HB3 GLN 17 -2.653 1.938 7.835 143 HG2 GLN 17 HG2 GLN 17 -1.839 4.040 6.988 144 HG3 GLN 17 HG3 GLN 17 -2.917 3.991 5.603 145 HE21 GLN 17 HE21 GLN 17 -4.923 4.900 5.843 146 HE22 GLN 17 HE22 GLN 17 -5.472 5.589 7.368 147 H LYS 18 H LYS 18 -3.657 -0.783 5.704 148 HA LYS 18 HA LYS 18 -1.993 -2.225 7.528 149 HB2 LYS 18 HB2 LYS 18 -3.367 -4.109 7.193 150 HB3 LYS 18 HB3 LYS 18 -4.403 -2.692 7.220 151 HG2 LYS 18 HG2 LYS 18 -3.693 -3.171 4.467 152 HG3 LYS 18 HG3 LYS 18 -4.020 -4.727 5.146 153 HD2 LYS 18 HD2 LYS 18 -6.039 -2.510 5.690 154 HD3 LYS 18 HD3 LYS 18 -5.836 -3.099 4.035 155 HE2 LYS 18 HE2 LYS 18 -7.434 -4.519 4.748 156 HE3 LYS 18 HE3 LYS 18 -5.936 -5.444 4.942 157 HZ1 LYS 18 HZ1 LYS 18 -7.349 -4.103 7.201 158 HZ2 LYS 18 HZ2 LYS 18 -6.057 -5.166 7.277 159 HZ3 LYS 18 HZ3 LYS 18 -7.467 -5.679 6.752 160 H LYS 19 H LYS 19 -2.022 -2.037 3.989 161 HA LYS 19 HA LYS 19 -0.304 -4.216 3.430 162 HB2 LYS 19 HB2 LYS 19 -0.912 -1.612 2.012 163 HB3 LYS 19 HB3 LYS 19 0.272 -2.747 1.376 164 HG2 LYS 19 HG2 LYS 19 -1.301 -4.462 1.075 165 HG3 LYS 19 HG3 LYS 19 -2.482 -3.754 2.180 166 HD2 LYS 19 HD2 LYS 19 -3.323 -2.314 0.635 167 HD3 LYS 19 HD3 LYS 19 -1.802 -2.096 -0.209 168 HE2 LYS 19 HE2 LYS 19 -3.413 -3.279 -1.626 169 HE3 LYS 19 HE3 LYS 19 -1.956 -4.215 -1.287 170 HZ1 LYS 19 HZ1 LYS 19 -3.373 -5.360 0.460 171 HZ2 LYS 19 HZ2 LYS 19 -3.582 -5.683 -1.115 172 HZ3 LYS 19 HZ3 LYS 19 -4.678 -4.711 -0.391 173 H ILE 20 H ILE 20 0.503 -0.868 4.537 174 HA ILE 20 HA ILE 20 3.275 -1.175 4.024 175 HB ILE 20 HB ILE 20 2.184 0.489 6.293 176 HG12 ILE 20 HG12 ILE 20 0.791 1.324 4.656 177 HG13 ILE 20 HG13 ILE 20 2.145 2.406 4.605 178 HG21 ILE 20 HG21 ILE 20 4.100 1.955 5.759 179 HG22 ILE 20 HG22 ILE 20 4.652 0.317 6.103 180 HG23 ILE 20 HG23 ILE 20 4.569 0.881 4.426 181 HD11 ILE 20 HD11 ILE 20 1.413 0.285 2.556 182 HD12 ILE 20 HD12 ILE 20 1.582 2.026 2.342 183 HD13 ILE 20 HD13 ILE 20 3.020 1.009 2.605 184 H LYS 21 H LYS 21 1.215 -2.213 6.743 185 HA LYS 21 HA LYS 21 3.350 -3.024 8.516 186 HB2 LYS 21 HB2 LYS 21 0.619 -4.336 8.398 187 HB3 LYS 21 HB3 LYS 21 1.735 -4.182 9.738 188 HG2 LYS 21 HG2 LYS 21 1.373 -1.655 9.621 189 HG3 LYS 21 HG3 LYS 21 0.032 -1.980 8.530 190 HD2 LYS 21 HD2 LYS 21 0.249 -3.125 11.355 191 HD3 LYS 21 HD3 LYS 21 -0.551 -1.621 10.958 192 HE2 LYS 21 HE2 LYS 21 -2.341 -3.012 11.004 193 HE3 LYS 21 HE3 LYS 21 -1.961 -3.048 9.278 194 HZ1 LYS 21 HZ1 LYS 21 -0.963 -5.094 11.183 195 HZ2 LYS 21 HZ2 LYS 21 -1.028 -5.219 9.552 196 HZ3 LYS 21 HZ3 LYS 21 -2.401 -5.253 10.435 197 H GLU 22 H GLU 22 1.668 -4.484 5.737 198 HA GLU 22 HA GLU 22 2.426 -7.202 6.376 199 HB2 GLU 22 HB2 GLU 22 1.444 -5.963 3.773 200 HB3 GLU 22 HB3 GLU 22 1.789 -7.684 4.005 201 HG2 GLU 22 HG2 GLU 22 0.209 -7.749 5.896 202 HG3 GLU 22 HG3 GLU 22 -0.235 -6.051 5.595 203 H ARG 23 H ARG 23 3.633 -4.745 4.024 204 HA ARG 23 HA ARG 23 5.816 -6.385 3.212 205 HB2 ARG 23 HB2 ARG 23 6.909 -4.354 2.330 206 HB3 ARG 23 HB3 ARG 23 5.276 -4.641 1.795 207 HG2 ARG 23 HG2 ARG 23 4.963 -2.533 2.107 208 HG3 ARG 23 HG3 ARG 23 4.634 -2.957 3.747 209 HD2 ARG 23 HD2 ARG 23 6.082 -0.995 3.631 210 HD3 ARG 23 HD3 ARG 23 6.956 -2.340 4.367 211 HE ARG 23 HE ARG 23 8.485 -2.263 2.676 212 HH11 ARG 23 HH11 ARG 23 5.519 -0.815 1.358 213 HH12 ARG 23 HH12 ARG 23 6.115 -0.626 -0.220 214 HH21 ARG 23 HH21 ARG 23 9.353 -1.987 0.585 215 HH22 ARG 23 HH22 ARG 23 8.499 -1.135 -0.623 216 H ILE 24 H ILE 24 5.794 -3.937 5.886 217 HA ILE 24 HA ILE 24 8.532 -4.393 6.489 218 HB ILE 24 HB ILE 24 7.277 -2.430 7.243 219 HG12 ILE 24 HG12 ILE 24 8.578 -4.078 9.452 220 HG13 ILE 24 HG13 ILE 24 9.289 -2.794 8.469 221 HG21 ILE 24 HG21 ILE 24 5.583 -2.439 8.892 222 HG22 ILE 24 HG22 ILE 24 5.196 -3.749 7.799 223 HG23 ILE 24 HG23 ILE 24 5.914 -4.128 9.363 224 HD11 ILE 24 HD11 ILE 24 7.167 -2.548 10.635 225 HD12 ILE 24 HD12 ILE 24 8.835 -1.940 10.660 226 HD13 ILE 24 HD13 ILE 24 7.631 -1.203 9.568 227 H GLN 25 H GLN 25 5.586 -6.086 7.707 228 HA GLN 25 HA GLN 25 7.063 -7.587 9.673 229 HB2 GLN 25 HB2 GLN 25 4.624 -6.988 9.755 230 HB3 GLN 25 HB3 GLN 25 4.336 -8.158 8.465 231 HG2 GLN 25 HG2 GLN 25 5.530 -9.821 10.197 232 HG3 GLN 25 HG3 GLN 25 5.077 -8.572 11.356 233 HE21 GLN 25 HE21 GLN 25 3.983 -11.332 9.647 234 HE22 GLN 25 HE22 GLN 25 2.268 -11.198 9.931 235 H ASN 26 H ASN 26 5.714 -8.394 6.435 236 HA ASN 26 HA ASN 26 6.718 -11.148 6.582 237 HB2 ASN 26 HB2 ASN 26 5.433 -9.599 4.283 238 HB3 ASN 26 HB3 ASN 26 5.782 -11.319 4.291 239 HD21 ASN 26 HD21 ASN 26 3.587 -8.848 5.594 240 HD22 ASN 26 HD22 ASN 26 2.547 -10.040 6.371 241 H SER 27 H SER 27 7.494 -8.278 4.690 242 HA SER 27 HA SER 27 9.248 -7.635 3.464 243 HB2 SER 27 HB2 SER 27 10.109 -7.973 5.933 244 HB3 SER 27 HB3 SER 27 11.096 -9.251 5.221 245 HG SER 27 HG SER 27 12.147 -7.273 5.392 246 H LEU 28 H LEU 28 8.363 -10.663 3.261 247 HA LEU 28 HA LEU 28 10.334 -11.640 1.320 248 HB2 LEU 28 HB2 LEU 28 9.218 -13.804 1.639 249 HB3 LEU 28 HB3 LEU 28 9.802 -13.077 3.126 250 HG LEU 28 HG LEU 28 7.490 -12.360 3.654 251 HD11 LEU 28 HD11 LEU 28 6.320 -12.404 1.536 252 HD12 LEU 28 HD12 LEU 28 5.635 -13.663 2.530 253 HD13 LEU 28 HD13 LEU 28 6.784 -14.096 1.243 254 HD21 LEU 28 HD21 LEU 28 8.061 -15.333 3.271 255 HD22 LEU 28 HD22 LEU 28 6.827 -14.670 4.359 256 HD23 LEU 28 HD23 LEU 28 8.525 -14.315 4.654 257 H SER 29 H SER 29 9.159 -13.097 -0.241 258 HA SER 29 HA SER 29 6.934 -11.703 -1.716 259 HB2 SER 29 HB2 SER 29 9.595 -12.738 -2.748 260 HB3 SER 29 HB3 SER 29 8.222 -12.346 -3.791 261 HG SER 29 HG SER 29 10.077 -10.728 -3.003 262 H THR 30 H THR 30 8.836 -14.745 -1.313 263 HA THR 30 HA THR 30 6.418 -16.297 -1.590 264 HB THR 30 HB THR 30 6.876 -15.848 -3.909 265 HG1 THR 30 HG1 THR 30 6.791 -18.293 -2.890 266 HG21 THR 30 HG21 THR 30 9.313 -15.427 -3.773 267 HG22 THR 30 HG22 THR 30 8.890 -16.549 -5.071 268 HG23 THR 30 HG23 THR 30 9.583 -17.170 -3.559 269 H GLU 31 H GLU 31 8.234 -15.838 0.482 270 HA GLU 31 HA GLU 31 9.616 -16.863 2.050 271 HB2 GLU 31 HB2 GLU 31 8.449 -19.457 0.963 272 HB3 GLU 31 HB3 GLU 31 9.075 -19.134 2.579 273 HG2 GLU 31 HG2 GLU 31 7.190 -17.545 2.972 274 HG3 GLU 31 HG3 GLU 31 6.556 -17.901 1.356 275 H LYS 32 H LYS 32 10.686 -16.256 -0.453 276 HA LYS 32 HA LYS 32 12.303 -18.276 -1.632 277 HB2 LYS 32 HB2 LYS 32 11.335 -16.093 -2.573 278 HB3 LYS 32 HB3 LYS 32 12.624 -15.232 -1.752 279 HG2 LYS 32 HG2 LYS 32 14.231 -15.942 -3.237 280 HG3 LYS 32 HG3 LYS 32 13.438 -17.495 -3.509 281 HD2 LYS 32 HD2 LYS 32 13.438 -16.070 -5.507 282 HD3 LYS 32 HD3 LYS 32 11.829 -16.587 -5.009 283 HE2 LYS 32 HE2 LYS 32 11.207 -14.451 -4.227 284 HE3 LYS 32 HE3 LYS 32 12.887 -13.894 -4.114 285 HZ1 LYS 32 HZ1 LYS 32 11.612 -14.490 -6.727 286 HZ2 LYS 32 HZ2 LYS 32 13.054 -13.793 -6.435 287 HZ3 LYS 32 HZ3 LYS 32 11.675 -12.987 -6.059 288 H TYR 33 H TYR 33 14.572 -18.518 -1.501 289 HA TYR 33 HA TYR 33 15.915 -17.316 0.854 290 HB2 TYR 33 HB2 TYR 33 16.889 -19.516 1.332 291 HB3 TYR 33 HB3 TYR 33 15.137 -19.578 1.441 292 HD1 TYR 33 HD1 TYR 33 13.809 -20.891 -0.168 293 HD2 TYR 33 HD2 TYR 33 18.112 -20.594 -0.576 294 HE1 TYR 33 HE1 TYR 33 13.781 -22.658 -1.901 295 HE2 TYR 33 HE2 TYR 33 18.080 -22.370 -2.263 296 HH TYR 33 HH TYR 33 16.770 -23.992 -3.335 297 H GLY 34 H GLY 34 18.291 -17.691 0.681 298 HA2 GLY 34 HA2 GLY 34 20.108 -18.330 -0.998 299 HA3 GLY 34 HA3 GLY 34 19.261 -17.237 -2.105 300 H SER 35 H SER 35 21.670 -17.403 0.245 301 HA SER 35 HA SER 35 21.817 -14.464 0.554 302 HB2 SER 35 HB2 SER 35 22.488 -16.401 2.759 303 HB3 SER 35 HB3 SER 35 22.310 -14.656 2.862 304 HG SER 35 HG SER 35 20.114 -14.861 2.541 305 H GLY 36 H GLY 36 24.127 -13.862 1.158 306 HA2 GLY 36 HA2 GLY 36 26.301 -15.689 0.943 307 HA3 GLY 36 HA3 GLY 36 26.019 -14.852 -0.605 308 H SER 37 H SER 37 28.250 -13.876 -0.033 309 HA SER 37 HA SER 37 28.538 -12.127 2.207 310 HB2 SER 37 HB2 SER 37 30.403 -13.038 0.737 311 HB3 SER 37 HB3 SER 37 29.912 -11.863 -0.506 312 HG SER 37 HG SER 37 31.587 -11.072 0.879 313 H GLY 38 H GLY 38 28.555 -9.736 2.151 314 HA2 GLY 38 HA2 GLY 38 26.491 -8.593 0.291 315 HA3 GLY 38 HA3 GLY 38 26.723 -8.130 1.965 316 H SER 39 H SER 39 29.859 -8.354 1.271 317 HA SER 39 HA SER 39 30.236 -5.575 0.953 318 HB2 SER 39 HB2 SER 39 32.269 -7.763 0.390 319 HB3 SER 39 HB3 SER 39 32.559 -6.118 0.990 320 HG SER 39 HG SER 39 31.185 -6.836 2.862 321 H GLY 40 H GLY 40 30.082 -4.356 -0.864 322 HA2 GLY 40 HA2 GLY 40 31.209 -4.453 -3.257 323 HA3 GLY 40 HA3 GLY 40 29.871 -5.600 -3.511 324 H SER 41 H SER 41 29.353 -3.733 -5.132 325 HA SER 41 HA SER 41 27.494 -1.834 -3.811 326 HB2 SER 41 HB2 SER 41 29.652 -0.714 -4.530 327 HB3 SER 41 HB3 SER 41 29.265 -1.168 -6.197 328 HG SER 41 HG SER 41 28.580 0.936 -5.707 329 H GLY 42 H GLY 42 25.737 -1.212 -5.277 330 HA2 GLY 42 HA2 GLY 42 25.129 -2.187 -7.789 331 HA3 GLY 42 HA3 GLY 42 24.609 -3.453 -6.653 332 H SER 43 H SER 43 24.038 -0.158 -7.760 333 HA SER 43 HA SER 43 22.400 0.822 -5.669 334 HB2 SER 43 HB2 SER 43 22.211 1.330 -8.667 335 HB3 SER 43 HB3 SER 43 21.530 2.335 -7.387 336 HG SER 43 HG SER 43 23.666 2.866 -8.408 337 H GLY 44 H GLY 44 21.504 -0.882 -8.732 338 HA2 GLY 44 HA2 GLY 44 19.688 -2.641 -8.049 339 HA3 GLY 44 HA3 GLY 44 18.720 -1.167 -7.851 340 H SER 45 H SER 45 17.405 -1.275 -9.635 341 HA SER 45 HA SER 45 18.656 -0.909 -12.288 342 HB2 SER 45 HB2 SER 45 18.468 -3.349 -12.045 343 HB3 SER 45 HB3 SER 45 16.738 -3.211 -11.701 344 HG SER 45 HG SER 45 17.575 -3.740 -13.913 345 H GLY 46 H GLY 46 15.635 -1.144 -10.339 346 HA2 GLY 46 HA2 GLY 46 13.953 0.446 -10.196 347 HA3 GLY 46 HA3 GLY 46 14.584 1.280 -11.625 348 H SER 47 H SER 47 11.881 0.768 -11.350 349 HA SER 47 HA SER 47 11.362 -1.119 -13.602 350 HB2 SER 47 HB2 SER 47 9.635 -1.021 -11.107 351 HB3 SER 47 HB3 SER 47 9.521 -2.155 -12.463 352 HG SER 47 HG SER 47 11.569 -3.006 -11.834 353 H GLY 48 H GLY 48 11.002 2.070 -12.485 354 HA2 GLY 48 HA2 GLY 48 9.328 2.808 -14.607 355 HA3 GLY 48 HA3 GLY 48 8.314 2.650 -13.155 356 H SER 49 H SER 49 8.865 5.117 -14.575 357 HA SER 49 HA SER 49 10.841 6.640 -13.148 358 HB2 SER 49 HB2 SER 49 9.630 8.517 -14.440 359 HB3 SER 49 HB3 SER 49 10.435 7.245 -15.378 360 HG SER 49 HG SER 49 8.467 7.423 -16.276 361 H GLY 50 H GLY 50 7.316 7.174 -13.412 362 HA2 GLY 50 HA2 GLY 50 6.446 7.023 -10.804 363 HA3 GLY 50 HA3 GLY 50 7.132 8.654 -10.942 364 H SER 51 H SER 51 4.649 8.923 -10.467 365 HA SER 51 HA SER 51 3.375 9.866 -12.877 366 HB2 SER 51 HB2 SER 51 2.643 7.525 -12.990 367 HB3 SER 51 HB3 SER 51 2.084 7.577 -11.307 368 HG SER 51 HG SER 51 1.120 9.046 -13.530 369 H GLY 52 H GLY 52 1.762 8.913 -9.803 370 HA2 GLY 52 HA2 GLY 52 1.343 11.696 -9.116 371 HA3 GLY 52 HA3 GLY 52 0.862 10.262 -8.176 372 H SER 53 H SER 53 1.754 11.873 -6.404 373 HA SER 53 HA SER 53 4.679 11.384 -6.069 374 HB2 SER 53 HB2 SER 53 3.278 13.708 -4.824 375 HB3 SER 53 HB3 SER 53 4.998 13.412 -5.031 376 HG SER 53 HG SER 53 4.561 14.803 -6.547 377 H GLY 54 H GLY 54 1.826 10.180 -5.004 378 HA2 GLY 54 HA2 GLY 54 1.296 8.892 -3.229 379 HA3 GLY 54 HA3 GLY 54 2.981 8.959 -2.712 380 H SER 55 H SER 55 1.481 8.858 -0.683 381 HA SER 55 HA SER 55 1.773 11.183 0.829 382 HB2 SER 55 HB2 SER 55 -0.264 11.904 -0.565 383 HB3 SER 55 HB3 SER 55 -1.142 10.543 0.141 384 HG SER 55 HG SER 55 -1.463 12.530 1.258 385 H GLY 56 H GLY 56 -0.739 10.119 2.338 386 HA2 GLY 56 HA2 GLY 56 -1.336 7.846 3.176 387 HA3 GLY 56 HA3 GLY 56 0.396 7.526 3.311 388 H SER 57 H SER 57 -0.661 7.139 5.626 389 HA SER 57 HA SER 57 0.242 9.230 7.316 390 HB2 SER 57 HB2 SER 57 -1.964 10.196 6.708 391 HB3 SER 57 HB3 SER 57 -2.779 8.707 7.195 392 HG SER 57 HG SER 57 -2.580 9.228 9.231 393 H GLY 58 H GLY 58 -0.408 8.568 9.653 394 HA2 GLY 58 HA2 GLY 58 -0.804 6.911 11.281 395 HA3 GLY 58 HA3 GLY 58 -0.683 5.641 10.053 396 H TYR 59 H TYR 59 1.427 8.377 11.038 397 HA TYR 59 HA TYR 59 3.614 8.543 11.461 398 HB2 TYR 59 HB2 TYR 59 3.326 5.969 13.014 399 HB3 TYR 59 HB3 TYR 59 4.405 7.320 13.328 400 HD1 TYR 59 HD1 TYR 59 2.968 9.711 13.513 401 HD2 TYR 59 HD2 TYR 59 1.565 5.755 14.521 402 HE1 TYR 59 HE1 TYR 59 1.217 10.700 14.964 403 HE2 TYR 59 HE2 TYR 59 -0.154 6.721 15.988 404 HH TYR 59 HH TYR 59 -1.018 8.673 16.898 405 H GLN3288 H GLN3288 3.152 7.405 8.950 406 HA GLN3288 HA GLN3288 4.709 5.056 8.560 407 HB2 GLN3288 HB2 GLN3288 4.520 5.423 6.204 408 HB3 GLN3288 HB3 GLN3288 2.989 5.718 7.006 409 HG2 GLN3288 HG2 GLN3288 3.353 8.171 6.813 410 HG3 GLN3288 HG3 GLN3288 4.886 7.864 5.978 411 HE21 GLN3288 HE21 GLN3288 4.523 8.342 3.822 412 HE22 GLN3288 HE22 GLN3288 3.112 7.863 2.905 413 H ILE3289 H ILE3289 6.593 5.073 6.928 414 HA ILE3289 HA ILE3289 8.644 6.916 8.015 415 HB ILE3289 HB ILE3289 9.235 4.188 6.887 416 HG12 ILE3289 HG12 ILE3289 8.948 4.939 9.828 417 HG13 ILE3289 HG13 ILE3289 7.769 3.975 8.943 418 HG21 ILE3289 HG21 ILE3289 11.013 5.995 6.974 419 HG22 ILE3289 HG22 ILE3289 10.758 6.100 8.728 420 HG23 ILE3289 HG23 ILE3289 11.397 4.606 8.005 421 HD11 ILE3289 HD11 ILE3289 9.123 2.475 10.198 422 HD12 ILE3289 HD12 ILE3289 9.493 2.253 8.483 423 HD13 ILE3289 HD13 ILE3289 10.621 3.143 9.538 424 H GLU3290 H GLU3290 8.133 8.474 6.682 425 HA GLU3290 HA GLU3290 7.609 8.448 3.927 426 HB2 GLU3290 HB2 GLU3290 7.060 10.132 5.754 427 HB3 GLU3290 HB3 GLU3290 8.746 10.644 5.701 428 HG2 GLU3290 HG2 GLU3290 7.306 12.130 4.409 429 HG3 GLU3290 HG3 GLU3290 8.500 11.338 3.381 430 H THR3291 H THR3291 10.597 7.930 5.430 431 HA THR3291 HA THR3291 12.106 8.525 2.932 432 HB THR3291 HB THR3291 12.512 10.298 4.468 433 HG1 THR3291 HG1 THR3291 14.413 9.879 3.612 434 HG21 THR3291 HG21 THR3291 13.215 8.251 6.599 435 HG22 THR3291 HG22 THR3291 11.807 9.336 6.602 436 HG23 THR3291 HG23 THR3291 13.431 10.008 6.716 437 H PHE3292 H PHE3292 10.898 6.132 3.309 438 HA PHE3292 HA PHE3292 13.256 4.343 3.635 439 HB2 PHE3292 HB2 PHE3292 12.317 4.454 5.860 440 HB3 PHE3292 HB3 PHE3292 10.712 4.031 5.246 441 HD1 PHE3292 HD1 PHE3292 14.153 2.493 4.748 442 HD2 PHE3292 HD2 PHE3292 10.150 2.033 6.240 443 HE1 PHE3292 HE1 PHE3292 14.651 0.148 5.394 444 HE2 PHE3292 HE2 PHE3292 10.634 -0.314 6.860 445 HZ PHE3292 HZ PHE3292 12.891 -1.271 6.411 446 H PHE3293 H PHE3293 9.710 4.070 3.276 447 HA PHE3293 HA PHE3293 10.128 2.500 0.764 448 HB2 PHE3293 HB2 PHE3293 7.942 1.355 1.480 449 HB3 PHE3293 HB3 PHE3293 9.457 0.911 2.217 450 HD1 PHE3293 HD1 PHE3293 8.720 0.021 4.320 451 HD2 PHE3293 HD2 PHE3293 7.354 3.943 3.103 452 HE1 PHE3293 HE1 PHE3293 7.872 0.477 6.611 453 HE2 PHE3293 HE2 PHE3293 6.589 4.381 5.329 454 HZ PHE3293 HZ PHE3293 6.847 2.681 7.143 455 H ALA3294 H ALA3294 9.357 5.504 1.540 456 HA ALA3294 HA ALA3294 6.782 6.017 0.641 457 HB1 ALA3294 HB1 ALA3294 8.123 7.715 1.657 458 HB2 ALA3294 HB2 ALA3294 9.283 7.687 0.304 459 HB3 ALA3294 HB3 ALA3294 7.620 8.257 0.050 460 H GLN3295 H GLN3295 9.673 5.219 -1.309 461 HA GLN3295 HA GLN3295 8.416 6.066 -3.791 462 HB2 GLN3295 HB2 GLN3295 10.604 3.983 -3.496 463 HB3 GLN3295 HB3 GLN3295 10.192 4.932 -4.934 464 HG2 GLN3295 HG2 GLN3295 11.597 5.789 -2.419 465 HG3 GLN3295 HG3 GLN3295 12.121 5.978 -4.084 466 HE21 GLN3295 HE21 GLN3295 10.929 7.759 -1.425 467 HE22 GLN3295 HE22 GLN3295 10.153 9.029 -2.315 468 H ASP3296 H ASP3296 8.386 3.105 -1.942 469 HA ASP3296 HA ASP3296 7.014 1.548 -4.030 470 HB2 ASP3296 HB2 ASP3296 8.036 1.002 -1.251 471 HB3 ASP3296 HB3 ASP3296 6.757 -0.017 -1.899 472 H ILE3297 H ILE3297 6.160 3.627 -1.381 473 HA ILE3297 HA ILE3297 3.517 2.723 -0.844 474 HB ILE3297 HB ILE3297 5.234 4.961 -0.148 475 HG12 ILE3297 HG12 ILE3297 4.024 4.894 1.999 476 HG13 ILE3297 HG13 ILE3297 2.831 3.791 1.292 477 HG21 ILE3297 HG21 ILE3297 2.307 5.676 -0.431 478 HG22 ILE3297 HG22 ILE3297 3.540 6.631 0.436 479 HG23 ILE3297 HG23 ILE3297 3.678 6.395 -1.308 480 HD11 ILE3297 HD11 ILE3297 4.555 2.682 2.724 481 HD12 ILE3297 HD12 ILE3297 4.581 2.056 1.057 482 HD13 ILE3297 HD13 ILE3297 5.800 3.219 1.608 483 H GLU3298 H GLU3298 4.757 5.153 -3.227 484 HA GLU3298 HA GLU3298 2.166 5.851 -4.175 485 HB2 GLU3298 HB2 GLU3298 3.209 6.802 -6.106 486 HB3 GLU3298 HB3 GLU3298 4.044 7.270 -4.631 487 HG2 GLU3298 HG2 GLU3298 6.016 6.448 -5.337 488 HG3 GLU3298 HG3 GLU3298 5.301 4.905 -5.752 489 H SER3299 H SER3299 4.282 3.237 -4.928 490 HA SER3299 HA SER3299 2.916 2.322 -7.306 491 HB2 SER3299 HB2 SER3299 5.288 1.806 -6.828 492 HB3 SER3299 HB3 SER3299 4.812 0.832 -5.431 493 HG SER3299 HG SER3299 4.801 0.211 -8.108 494 H VAL3300 H VAL3300 2.700 1.276 -3.835 495 HA VAL3300 HA VAL3300 0.644 -0.675 -4.539 496 HB VAL3300 HB VAL3300 2.178 -0.976 -2.641 497 HG11 VAL3300 HG11 VAL3300 2.204 1.290 -1.703 498 HG12 VAL3300 HG12 VAL3300 0.504 1.137 -1.200 499 HG13 VAL3300 HG13 VAL3300 1.741 0.112 -0.477 500 HG21 VAL3300 HG21 VAL3300 0.543 -1.954 -1.114 501 HG22 VAL3300 HG22 VAL3300 -0.764 -1.030 -1.910 502 HG23 VAL3300 HG23 VAL3300 0.131 -2.270 -2.805 503 H GLN3301 H GLN3301 0.614 2.705 -3.303 504 HA GLN3301 HA GLN3301 -2.204 2.631 -2.817 505 HB2 GLN3301 HB2 GLN3301 -2.140 4.855 -2.308 506 HB3 GLN3301 HB3 GLN3301 -0.606 4.166 -1.781 507 HG2 GLN3301 HG2 GLN3301 0.345 5.934 -2.753 508 HG3 GLN3301 HG3 GLN3301 0.049 5.092 -4.274 509 HE21 GLN3301 HE21 GLN3301 -2.735 5.502 -4.720 510 HE22 GLN3301 HE22 GLN3301 -2.882 7.212 -4.974 511 H LYS3302 H LYS3302 -0.305 3.180 -5.709 512 HA LYS3302 HA LYS3302 -2.331 4.269 -7.420 513 HB2 LYS3302 HB2 LYS3302 0.225 2.743 -7.760 514 HB3 LYS3302 HB3 LYS3302 -0.884 2.769 -9.122 515 HG2 LYS3302 HG2 LYS3302 -0.859 5.164 -9.251 516 HG3 LYS3302 HG3 LYS3302 0.005 5.290 -7.719 517 HD2 LYS3302 HD2 LYS3302 1.733 3.660 -9.118 518 HD3 LYS3302 HD3 LYS3302 1.026 4.621 -10.461 519 HE2 LYS3302 HE2 LYS3302 1.522 6.660 -9.073 520 HE3 LYS3302 HE3 LYS3302 2.212 5.559 -7.860 521 HZ1 LYS3302 HZ1 LYS3302 3.307 5.859 -10.641 522 HZ2 LYS3302 HZ2 LYS3302 3.885 4.900 -9.459 523 HZ3 LYS3302 HZ3 LYS3302 3.971 6.493 -9.235 524 H GLU3303 H GLU3303 -1.423 1.108 -6.360 525 HA GLU3303 HA GLU3303 -3.092 -0.476 -8.159 526 HB2 GLU3303 HB2 GLU3303 -1.815 -2.084 -7.366 527 HB3 GLU3303 HB3 GLU3303 -1.126 -1.004 -6.180 528 HG2 GLU3303 HG2 GLU3303 -3.001 -1.588 -4.626 529 HG3 GLU3303 HG3 GLU3303 -3.575 -2.777 -5.784 530 H LEU3304 H LEU3304 -3.659 0.814 -4.930 531 HA LEU3304 HA LEU3304 -6.357 -0.177 -4.777 532 HB2 LEU3304 HB2 LEU3304 -4.784 1.943 -3.217 533 HB3 LEU3304 HB3 LEU3304 -6.306 1.248 -2.702 534 HG LEU3304 HG LEU3304 -3.738 -0.345 -3.136 535 HD11 LEU3304 HD11 LEU3304 -3.551 -0.423 -0.736 536 HD12 LEU3304 HD12 LEU3304 -4.912 0.732 -0.602 537 HD13 LEU3304 HD13 LEU3304 -3.391 1.182 -1.445 538 HD21 LEU3304 HD21 LEU3304 -6.390 -1.153 -1.932 539 HD22 LEU3304 HD22 LEU3304 -4.918 -2.121 -1.868 540 HD23 LEU3304 HD23 LEU3304 -5.645 -1.779 -3.426 541 H GLU3305 H GLU3305 -5.106 3.076 -5.711 542 HA GLU3305 HA GLU3305 -7.580 4.448 -5.311 543 HB2 GLU3305 HB2 GLU3305 -6.655 6.144 -6.912 544 HB3 GLU3305 HB3 GLU3305 -5.531 5.707 -5.609 545 HG2 GLU3305 HG2 GLU3305 -4.382 4.178 -7.035 546 HG3 GLU3305 HG3 GLU3305 -5.499 4.426 -8.379 547 H ASN3306 H ASN3306 -6.785 2.116 -7.690 548 HA ASN3306 HA ASN3306 -8.989 3.020 -9.466 549 HB2 ASN3306 HB2 ASN3306 -8.090 1.612 -11.174 550 HB3 ASN3306 HB3 ASN3306 -6.789 2.591 -10.532 551 HD21 ASN3306 HD21 ASN3306 -5.094 1.542 -9.356 552 HD22 ASN3306 HD22 ASN3306 -5.201 -0.146 -8.998 553 H LEU3307 H LEU3307 -8.623 1.024 -6.738 554 HA LEU3307 HA LEU3307 -10.448 -1.058 -7.775 555 HB2 LEU3307 HB2 LEU3307 -8.674 -0.668 -5.398 556 HB3 LEU3307 HB3 LEU3307 -10.231 -1.321 -5.015 557 HG LEU3307 HG LEU3307 -9.337 -3.297 -5.293 558 HD11 LEU3307 HD11 LEU3307 -9.076 -2.755 -8.250 559 HD12 LEU3307 HD12 LEU3307 -10.613 -3.206 -7.449 560 HD13 LEU3307 HD13 LEU3307 -9.254 -4.332 -7.449 561 HD21 LEU3307 HD21 LEU3307 -7.117 -2.440 -5.178 562 HD22 LEU3307 HD22 LEU3307 -7.092 -2.227 -6.952 563 HD23 LEU3307 HD23 LEU3307 -7.266 -3.845 -6.231 564 H SER3308 H SER3308 -12.527 -1.432 -6.783 565 HA SER3308 HA SER3308 -13.879 1.100 -6.169 566 HB2 SER3308 HB2 SER3308 -14.960 -1.696 -6.657 567 HB3 SER3308 HB3 SER3308 -15.924 -0.218 -6.480 568 HG SER3308 HG SER3308 -14.650 0.643 -8.284 569 H GLU3309 H GLU3309 -15.699 0.946 -4.327 570 HA GLU3309 HA GLU3309 -14.372 0.645 -1.879 571 HB2 GLU3309 HB2 GLU3309 -17.149 1.190 -2.851 572 HB3 GLU3309 HB3 GLU3309 -17.114 0.321 -1.304 573 HG2 GLU3309 HG2 GLU3309 -15.890 1.982 -0.267 574 HG3 GLU3309 HG3 GLU3309 -15.525 2.846 -1.770 575 H GLU3310 H GLU3310 -16.712 -1.587 -3.489 576 HA GLU3310 HA GLU3310 -16.751 -3.488 -1.504 577 HB2 GLU3310 HB2 GLU3310 -17.404 -5.086 -3.323 578 HB3 GLU3310 HB3 GLU3310 -18.313 -3.574 -3.258 579 HG2 GLU3310 HG2 GLU3310 -16.865 -2.645 -5.060 580 HG3 GLU3310 HG3 GLU3310 -16.028 -4.191 -5.159 581 H GLU3311 H GLU3311 -14.041 -2.774 -3.585 582 HA GLU3311 HA GLU3311 -12.760 -5.393 -3.148 583 HB2 GLU3311 HB2 GLU3311 -11.891 -2.782 -4.446 584 HB3 GLU3311 HB3 GLU3311 -10.891 -4.205 -4.334 585 HG2 GLU3311 HG2 GLU3311 -13.633 -4.422 -5.526 586 HG3 GLU3311 HG3 GLU3311 -12.502 -3.644 -6.436 587 H LEU3312 H LEU3312 -12.289 -1.993 -2.344 588 HA LEU3312 HA LEU3312 -10.056 -2.427 -0.557 589 HB2 LEU3312 HB2 LEU3312 -11.799 0.049 -0.697 590 HB3 LEU3312 HB3 LEU3312 -10.156 -0.017 -0.166 591 HG LEU3312 HG LEU3312 -10.813 -0.787 -3.021 592 HD11 LEU3312 HD11 LEU3312 -11.968 1.208 -2.807 593 HD12 LEU3312 HD12 LEU3312 -10.469 1.556 -3.668 594 HD13 LEU3312 HD13 LEU3312 -10.615 2.026 -1.957 595 HD21 LEU3312 HD21 LEU3312 -8.620 -1.326 -2.360 596 HD22 LEU3312 HD22 LEU3312 -8.360 0.267 -1.613 597 HD23 LEU3312 HD23 LEU3312 -8.528 0.121 -3.371 598 H LEU3313 H LEU3313 -13.366 -1.330 -0.068 599 HA LEU3313 HA LEU3313 -13.480 -1.024 2.732 600 HB2 LEU3313 HB2 LEU3313 -15.141 -0.099 1.101 601 HB3 LEU3313 HB3 LEU3313 -15.678 -1.722 0.662 602 HG LEU3313 HG LEU3313 -17.166 -0.467 2.167 603 HD11 LEU3313 HD11 LEU3313 -17.987 -2.376 3.281 604 HD12 LEU3313 HD12 LEU3313 -16.456 -3.240 3.082 605 HD13 LEU3313 HD13 LEU3313 -17.431 -2.801 1.655 606 HD21 LEU3313 HD21 LEU3313 -16.943 -0.583 4.553 607 HD22 LEU3313 HD22 LEU3313 -15.631 0.383 3.869 608 HD23 LEU3313 HD23 LEU3313 -15.319 -1.288 4.408 609 H ALA3314 H ALA3314 -14.023 -3.825 0.572 610 HA ALA3314 HA ALA3314 -14.876 -5.522 2.662 611 HB1 ALA3314 HB1 ALA3314 -15.221 -6.213 0.412 612 HB2 ALA3314 HB2 ALA3314 -13.481 -6.089 0.006 613 HB3 ALA3314 HB3 ALA3314 -14.057 -7.375 1.080 614 H MET3315 H MET3315 -11.591 -4.553 1.680 615 HA MET3315 HA MET3315 -10.258 -6.700 3.133 616 HB2 MET3315 HB2 MET3315 -8.946 -4.074 2.317 617 HB3 MET3315 HB3 MET3315 -8.210 -5.649 2.588 618 HG2 MET3315 HG2 MET3315 -10.254 -5.775 0.548 619 HG3 MET3315 HG3 MET3315 -9.160 -4.471 0.192 620 HE1 MET3315 HE1 MET3315 -9.712 -8.356 0.478 621 HE2 MET3315 HE2 MET3315 -10.050 -7.514 -1.048 622 HE3 MET3315 HE3 MET3315 -8.746 -8.713 -0.974 623 H LEU3316 H LEU3316 -10.525 -3.164 3.608 624 HA LEU3316 HA LEU3316 -9.210 -3.169 6.144 625 HB2 LEU3316 HB2 LEU3316 -10.205 -0.915 6.467 626 HB3 LEU3316 HB3 LEU3316 -9.319 -1.143 4.966 627 HG LEU3316 HG LEU3316 -11.812 -1.740 4.069 628 HD11 LEU3316 HD11 LEU3316 -12.279 0.280 6.346 629 HD12 LEU3316 HD12 LEU3316 -12.987 -1.326 6.252 630 HD13 LEU3316 HD13 LEU3316 -13.448 -0.108 5.074 631 HD21 LEU3316 HD21 LEU3316 -11.596 0.147 2.872 632 HD22 LEU3316 HD22 LEU3316 -10.067 0.355 3.688 633 HD23 LEU3316 HD23 LEU3316 -11.493 1.198 4.306 634 H ASN3317 H ASN3317 -12.582 -3.701 5.242 635 HA ASN3317 HA ASN3317 -13.427 -3.659 8.048 636 HB2 ASN3317 HB2 ASN3317 -14.757 -2.863 5.908 637 HB3 ASN3317 HB3 ASN3317 -15.124 -4.567 5.731 638 HD21 ASN3317 HD21 ASN3317 -15.207 -1.806 7.989 639 HD22 ASN3317 HD22 ASN3317 -16.573 -2.404 8.934 640 H GLY3318 H GLY3318 -12.406 -5.935 5.729 641 HA2 GLY3318 HA2 GLY3318 -11.852 -8.169 5.846 642 HA3 GLY3318 HA3 GLY3318 -12.262 -8.159 7.564 643 H ASP3319 H ASP3319 -13.899 -7.887 4.429 644 HA ASP3319 HA ASP3319 -16.045 -8.441 3.760 645 HB2 ASP3319 HB2 ASP3319 -14.425 -10.957 4.133 646 HB3 ASP3319 HB3 ASP3319 -16.060 -11.044 3.477 647 H GLN3320 H GLN3320 -16.906 -7.528 5.858 648 HA GLN3320 HA GLN3320 -18.776 -9.433 7.054 649 HB2 GLN3320 HB2 GLN3320 -16.751 -9.493 8.480 650 HB3 GLN3320 HB3 GLN3320 -16.802 -7.735 8.664 651 HG2 GLN3320 HG2 GLN3320 -18.874 -7.849 9.859 652 HG3 GLN3320 HG3 GLN3320 -19.096 -9.565 9.466 653 HE21 GLN3320 HE21 GLN3320 -17.261 -7.274 11.478 654 HE22 GLN3320 HE22 GLN3320 -16.464 -8.507 12.457 655 H GLN3321 H GLN3321 -19.899 -8.061 5.381 656 HA GLN3321 HA GLN3321 -20.697 -5.377 6.423 657 HB2 GLN3321 HB2 GLN3321 -20.456 -6.502 3.615 658 HB3 GLN3321 HB3 GLN3321 -21.462 -5.107 3.993 659 HG2 GLN3321 HG2 GLN3321 -19.523 -4.119 3.306 660 HG3 GLN3321 HG3 GLN3321 -19.363 -4.057 5.061 661 HE21 GLN3321 HE21 GLN3321 -17.642 -5.424 6.096 662 HE22 GLN3321 HE22 GLN3321 -16.374 -5.972 4.994 Start of MODEL 19 1 H1 MET 1 H MET 1 -27.645 7.980 -4.422 2 HA MET 1 HA MET 1 -27.769 10.631 -5.708 3 HB2 MET 1 HB2 MET 1 -28.412 10.236 -2.764 4 HB3 MET 1 HB3 MET 1 -28.697 11.629 -3.804 5 HG2 MET 1 HG2 MET 1 -30.101 8.960 -3.771 6 HG3 MET 1 HG3 MET 1 -30.764 10.541 -3.360 7 HE1 MET 1 HE1 MET 1 -32.863 9.588 -6.535 8 HE2 MET 1 HE2 MET 1 -32.312 8.506 -5.237 9 HE3 MET 1 HE3 MET 1 -32.914 10.135 -4.845 10 H ASN 2 H ASN 2 -26.619 9.241 -2.589 11 HA ASN 2 HA ASN 2 -24.466 11.011 -2.381 12 HB2 ASN 2 HB2 ASN 2 -24.791 8.240 -1.141 13 HB3 ASN 2 HB3 ASN 2 -23.622 9.446 -0.627 14 HD21 ASN 2 HD21 ASN 2 -24.854 11.821 -0.178 15 HD22 ASN 2 HD22 ASN 2 -26.174 11.537 0.924 16 H ILE 3 H ILE 3 -22.454 10.978 -3.317 17 HA ILE 3 HA ILE 3 -21.911 9.246 -5.446 18 HB ILE 3 HB ILE 3 -21.065 11.518 -5.232 19 HG12 ILE 3 HG12 ILE 3 -18.641 9.717 -5.388 20 HG13 ILE 3 HG13 ILE 3 -19.928 9.609 -6.592 21 HG21 ILE 3 HG21 ILE 3 -19.105 12.027 -3.754 22 HG22 ILE 3 HG22 ILE 3 -20.555 11.641 -2.840 23 HG23 ILE 3 HG23 ILE 3 -19.287 10.422 -3.006 24 HD11 ILE 3 HD11 ILE 3 -19.677 11.903 -7.233 25 HD12 ILE 3 HD12 ILE 3 -18.469 12.195 -5.963 26 HD13 ILE 3 HD13 ILE 3 -18.105 11.100 -7.309 27 H ASN 4 H ASN 4 -20.457 7.606 -5.745 28 HA ASN 4 HA ASN 4 -19.697 6.016 -3.360 29 HB2 ASN 4 HB2 ASN 4 -19.770 4.082 -5.006 30 HB3 ASN 4 HB3 ASN 4 -21.312 4.818 -4.569 31 HD21 ASN 4 HD21 ASN 4 -18.955 4.448 -7.197 32 HD22 ASN 4 HD22 ASN 4 -19.902 5.240 -8.418 33 H GLU 5 H GLU 5 -18.467 6.788 -6.658 34 HA GLU 5 HA GLU 5 -15.938 5.677 -6.367 35 HB2 GLU 5 HB2 GLU 5 -16.684 8.196 -7.891 36 HB3 GLU 5 HB3 GLU 5 -15.149 7.323 -8.040 37 HG2 GLU 5 HG2 GLU 5 -16.571 5.247 -8.622 38 HG3 GLU 5 HG3 GLU 5 -17.911 6.385 -8.842 39 H GLN 6 H GLN 6 -17.052 8.827 -5.250 40 HA GLN 6 HA GLN 6 -14.444 9.794 -4.457 41 HB2 GLN 6 HB2 GLN 6 -16.605 11.129 -4.945 42 HB3 GLN 6 HB3 GLN 6 -17.098 10.702 -3.299 43 HG2 GLN 6 HG2 GLN 6 -15.008 11.743 -2.443 44 HG3 GLN 6 HG3 GLN 6 -14.591 12.202 -4.105 45 HE21 GLN 6 HE21 GLN 6 -16.527 13.446 -5.279 46 HE22 GLN 6 HE22 GLN 6 -17.319 14.666 -4.278 47 H THR 7 H THR 7 -17.176 8.127 -2.796 48 HA THR 7 HA THR 7 -16.172 8.289 -0.186 49 HB THR 7 HB THR 7 -17.834 6.119 -1.479 50 HG1 THR 7 HG1 THR 7 -19.204 7.779 -1.465 51 HG21 THR 7 HG21 THR 7 -16.947 5.231 0.558 52 HG22 THR 7 HG22 THR 7 -18.631 5.632 0.857 53 HG23 THR 7 HG23 THR 7 -17.319 6.708 1.454 54 H LEU 8 H LEU 8 -15.335 5.943 -2.805 55 HA LEU 8 HA LEU 8 -14.018 3.949 -1.387 56 HB2 LEU 8 HB2 LEU 8 -12.872 5.219 -3.876 57 HB3 LEU 8 HB3 LEU 8 -12.763 3.539 -3.353 58 HG LEU 8 HG LEU 8 -15.166 5.000 -4.482 59 HD11 LEU 8 HD11 LEU 8 -13.453 4.342 -6.157 60 HD12 LEU 8 HD12 LEU 8 -14.999 3.513 -6.391 61 HD13 LEU 8 HD13 LEU 8 -13.650 2.657 -5.645 62 HD21 LEU 8 HD21 LEU 8 -14.983 2.210 -3.379 63 HD22 LEU 8 HD22 LEU 8 -16.288 2.745 -4.474 64 HD23 LEU 8 HD23 LEU 8 -16.081 3.535 -2.911 65 H ASP 9 H ASP 9 -13.015 7.346 -1.937 66 HA ASP 9 HA ASP 9 -10.252 7.280 -1.455 67 HB2 ASP 9 HB2 ASP 9 -11.461 9.307 -2.112 68 HB3 ASP 9 HB3 ASP 9 -12.250 9.374 -0.532 69 H LYS 10 H LYS 10 -12.973 7.413 0.924 70 HA LYS 10 HA LYS 10 -11.149 7.521 3.165 71 HB2 LYS 10 HB2 LYS 10 -12.912 7.453 4.599 72 HB3 LYS 10 HB3 LYS 10 -13.553 8.326 3.194 73 HG2 LYS 10 HG2 LYS 10 -14.615 6.260 2.432 74 HG3 LYS 10 HG3 LYS 10 -14.078 5.392 3.853 75 HD2 LYS 10 HD2 LYS 10 -16.019 7.737 3.693 76 HD3 LYS 10 HD3 LYS 10 -16.416 6.032 3.863 77 HE2 LYS 10 HE2 LYS 10 -16.522 6.738 6.073 78 HE3 LYS 10 HE3 LYS 10 -14.910 6.016 5.927 79 HZ1 LYS 10 HZ1 LYS 10 -13.974 8.209 5.838 80 HZ2 LYS 10 HZ2 LYS 10 -15.049 8.238 7.082 81 HZ3 LYS 10 HZ3 LYS 10 -15.432 8.933 5.631 82 H LEU 11 H LEU 11 -12.337 4.942 1.215 83 HA LEU 11 HA LEU 11 -11.859 2.823 3.187 84 HB2 LEU 11 HB2 LEU 11 -12.684 2.772 0.237 85 HB3 LEU 11 HB3 LEU 11 -12.292 1.360 1.222 86 HG LEU 11 HG LEU 11 -14.554 1.390 1.113 87 HD11 LEU 11 HD11 LEU 11 -13.978 0.866 3.298 88 HD12 LEU 11 HD12 LEU 11 -15.439 1.828 3.360 89 HD13 LEU 11 HD13 LEU 11 -13.933 2.607 3.833 90 HD21 LEU 11 HD21 LEU 11 -14.576 4.319 1.782 91 HD22 LEU 11 HD22 LEU 11 -16.030 3.304 1.740 92 HD23 LEU 11 HD23 LEU 11 -15.096 3.559 0.284 93 H ARG 12 H ARG 12 -10.403 3.817 0.026 94 HA ARG 12 HA ARG 12 -8.231 2.028 0.219 95 HB2 ARG 12 HB2 ARG 12 -7.133 3.539 -1.521 96 HB3 ARG 12 HB3 ARG 12 -8.666 2.831 -1.872 97 HG2 ARG 12 HG2 ARG 12 -9.700 4.766 -2.129 98 HG3 ARG 12 HG3 ARG 12 -9.037 5.447 -0.642 99 HD2 ARG 12 HD2 ARG 12 -6.986 5.367 -2.642 100 HD3 ARG 12 HD3 ARG 12 -8.502 6.057 -3.307 101 HE ARG 12 HE ARG 12 -7.749 7.184 -0.751 102 HH11 ARG 12 HH11 ARG 12 -7.576 7.615 -4.304 103 HH12 ARG 12 HH12 ARG 12 -6.626 9.039 -4.195 104 HH21 ARG 12 HH21 ARG 12 -6.944 9.339 -0.721 105 HH22 ARG 12 HH22 ARG 12 -6.529 10.141 -2.182 106 H GLN 13 H GLN 13 -8.394 5.362 1.437 107 HA GLN 13 HA GLN 13 -5.708 5.512 2.247 108 HB2 GLN 13 HB2 GLN 13 -6.339 7.393 3.577 109 HB3 GLN 13 HB3 GLN 13 -7.250 7.356 2.063 110 HG2 GLN 13 HG2 GLN 13 -8.939 7.912 3.485 111 HG3 GLN 13 HG3 GLN 13 -9.060 6.147 3.425 112 HE21 GLN 13 HE21 GLN 13 -9.832 5.549 5.372 113 HE22 GLN 13 HE22 GLN 13 -9.117 5.998 6.914 114 H ALA 14 H ALA 14 -8.394 3.738 3.717 115 HA ALA 14 HA ALA 14 -7.074 3.324 6.268 116 HB1 ALA 14 HB1 ALA 14 -9.565 3.245 5.990 117 HB2 ALA 14 HB2 ALA 14 -9.378 1.837 4.933 118 HB3 ALA 14 HB3 ALA 14 -8.918 1.720 6.633 119 H VAL 15 H VAL 15 -7.665 1.455 3.237 120 HA VAL 15 HA VAL 15 -6.291 -0.865 4.121 121 HB VAL 15 HB VAL 15 -6.708 -0.098 1.232 122 HG11 VAL 15 HG11 VAL 15 -6.442 -2.803 2.623 123 HG12 VAL 15 HG12 VAL 15 -6.723 -2.540 0.891 124 HG13 VAL 15 HG13 VAL 15 -5.196 -2.036 1.618 125 HG21 VAL 15 HG21 VAL 15 -8.625 -1.425 3.169 126 HG22 VAL 15 HG22 VAL 15 -8.889 0.028 2.161 127 HG23 VAL 15 HG23 VAL 15 -8.718 -1.541 1.409 128 H LEU 16 H LEU 16 -5.162 2.027 2.382 129 HA LEU 16 HA LEU 16 -2.545 0.945 1.925 130 HB2 LEU 16 HB2 LEU 16 -1.773 2.965 1.195 131 HB3 LEU 16 HB3 LEU 16 -3.447 2.905 0.749 132 HG LEU 16 HG LEU 16 -3.819 4.381 2.878 133 HD11 LEU 16 HD11 LEU 16 -1.938 5.961 3.220 134 HD12 LEU 16 HD12 LEU 16 -0.937 5.027 2.097 135 HD13 LEU 16 HD13 LEU 16 -1.428 4.325 3.641 136 HD21 LEU 16 HD21 LEU 16 -3.578 6.359 1.371 137 HD22 LEU 16 HD22 LEU 16 -4.401 5.015 0.563 138 HD23 LEU 16 HD23 LEU 16 -2.698 5.345 0.212 139 H GLN 17 H GLN 17 -3.862 2.795 4.736 140 HA GLN 17 HA GLN 17 -1.454 2.945 6.164 141 HB2 GLN 17 HB2 GLN 17 -4.356 2.839 7.034 142 HB3 GLN 17 HB3 GLN 17 -3.049 2.890 8.229 143 HG2 GLN 17 HG2 GLN 17 -2.198 4.946 7.389 144 HG3 GLN 17 HG3 GLN 17 -3.208 4.889 5.943 145 HE21 GLN 17 HE21 GLN 17 -5.173 5.921 6.061 146 HE22 GLN 17 HE22 GLN 17 -5.689 6.789 7.515 147 H LYS 18 H LYS 18 -3.876 0.066 6.320 148 HA LYS 18 HA LYS 18 -2.084 -1.256 8.130 149 HB2 LYS 18 HB2 LYS 18 -3.436 -3.266 7.516 150 HB3 LYS 18 HB3 LYS 18 -4.381 -1.874 8.059 151 HG2 LYS 18 HG2 LYS 18 -4.670 -1.326 5.568 152 HG3 LYS 18 HG3 LYS 18 -4.158 -2.984 5.236 153 HD2 LYS 18 HD2 LYS 18 -6.462 -2.009 6.958 154 HD3 LYS 18 HD3 LYS 18 -6.600 -2.510 5.276 155 HE2 LYS 18 HE2 LYS 18 -7.235 -4.486 6.209 156 HE3 LYS 18 HE3 LYS 18 -5.492 -4.739 6.021 157 HZ1 LYS 18 HZ1 LYS 18 -6.798 -3.893 8.544 158 HZ2 LYS 18 HZ2 LYS 18 -5.215 -4.379 8.343 159 HZ3 LYS 18 HZ3 LYS 18 -6.419 -5.446 8.173 160 H LYS 19 H LYS 19 -2.382 -1.211 4.548 161 HA LYS 19 HA LYS 19 -0.544 -3.255 4.058 162 HB2 LYS 19 HB2 LYS 19 -1.468 -0.905 2.433 163 HB3 LYS 19 HB3 LYS 19 -0.086 -1.851 1.876 164 HG2 LYS 19 HG2 LYS 19 -1.352 -3.911 1.890 165 HG3 LYS 19 HG3 LYS 19 -2.755 -3.119 2.620 166 HD2 LYS 19 HD2 LYS 19 -3.202 -1.849 0.617 167 HD3 LYS 19 HD3 LYS 19 -1.632 -2.252 -0.066 168 HE2 LYS 19 HE2 LYS 19 -3.462 -3.499 -1.153 169 HE3 LYS 19 HE3 LYS 19 -2.209 -4.522 -0.452 170 HZ1 LYS 19 HZ1 LYS 19 -4.263 -5.464 -0.036 171 HZ2 LYS 19 HZ2 LYS 19 -4.939 -4.119 0.568 172 HZ3 LYS 19 HZ3 LYS 19 -3.737 -4.933 1.411 173 H ILE 20 H ILE 20 0.235 0.163 5.033 174 HA ILE 20 HA ILE 20 2.947 -0.169 4.300 175 HB ILE 20 HB ILE 20 2.203 1.527 6.677 176 HG12 ILE 20 HG12 ILE 20 0.574 2.250 5.102 177 HG13 ILE 20 HG13 ILE 20 1.838 3.451 5.195 178 HG21 ILE 20 HG21 ILE 20 4.326 1.740 4.477 179 HG22 ILE 20 HG22 ILE 20 4.057 2.936 5.762 180 HG23 ILE 20 HG23 ILE 20 4.584 1.307 6.177 181 HD11 ILE 20 HD11 ILE 20 1.670 1.395 2.956 182 HD12 ILE 20 HD12 ILE 20 1.054 3.056 2.874 183 HD13 ILE 20 HD13 ILE 20 2.788 2.769 3.072 184 H LYS 21 H LYS 21 1.116 -1.140 7.209 185 HA LYS 21 HA LYS 21 3.427 -1.956 8.768 186 HB2 LYS 21 HB2 LYS 21 0.593 -3.055 8.972 187 HB3 LYS 21 HB3 LYS 21 1.878 -3.092 10.175 188 HG2 LYS 21 HG2 LYS 21 1.762 -0.520 10.139 189 HG3 LYS 21 HG3 LYS 21 0.278 -0.699 9.203 190 HD2 LYS 21 HD2 LYS 21 0.456 -2.342 11.718 191 HD3 LYS 21 HD3 LYS 21 0.442 -0.607 11.964 192 HE2 LYS 21 HE2 LYS 21 -1.593 -1.779 10.087 193 HE3 LYS 21 HE3 LYS 21 -1.802 -2.061 11.821 194 HZ1 LYS 21 HZ1 LYS 21 -2.898 -0.017 10.969 195 HZ2 LYS 21 HZ2 LYS 21 -1.387 0.654 10.768 196 HZ3 LYS 21 HZ3 LYS 21 -1.887 0.182 12.258 197 H GLU 22 H GLU 22 1.308 -3.445 6.318 198 HA GLU 22 HA GLU 22 2.089 -6.158 6.837 199 HB2 GLU 22 HB2 GLU 22 0.983 -4.837 4.299 200 HB3 GLU 22 HB3 GLU 22 1.220 -6.574 4.487 201 HG2 GLU 22 HG2 GLU 22 -0.285 -6.691 6.309 202 HG3 GLU 22 HG3 GLU 22 -0.470 -4.950 6.416 203 H ARG 23 H ARG 23 3.164 -3.794 4.325 204 HA ARG 23 HA ARG 23 5.175 -5.526 3.295 205 HB2 ARG 23 HB2 ARG 23 6.117 -3.502 2.202 206 HB3 ARG 23 HB3 ARG 23 4.390 -3.724 1.981 207 HG2 ARG 23 HG2 ARG 23 4.298 -1.538 2.429 208 HG3 ARG 23 HG3 ARG 23 4.203 -2.095 4.057 209 HD2 ARG 23 HD2 ARG 23 5.778 -0.228 3.882 210 HD3 ARG 23 HD3 ARG 23 6.583 -1.679 4.448 211 HE ARG 23 HE ARG 23 7.899 -1.723 2.570 212 HH11 ARG 23 HH11 ARG 23 5.158 0.403 1.892 213 HH12 ARG 23 HH12 ARG 23 5.346 0.322 0.162 214 HH21 ARG 23 HH21 ARG 23 8.267 -1.620 0.292 215 HH22 ARG 23 HH22 ARG 23 7.167 -0.809 -0.762 216 H ILE 24 H ILE 24 5.378 -3.211 6.056 217 HA ILE 24 HA ILE 24 8.261 -3.573 6.217 218 HB ILE 24 HB ILE 24 7.216 -1.505 6.981 219 HG12 ILE 24 HG12 ILE 24 8.619 -3.097 9.165 220 HG13 ILE 24 HG13 ILE 24 9.329 -1.951 8.021 221 HG21 ILE 24 HG21 ILE 24 6.004 -2.979 9.338 222 HG22 ILE 24 HG22 ILE 24 5.710 -1.306 8.782 223 HG23 ILE 24 HG23 ILE 24 5.145 -2.669 7.846 224 HD11 ILE 24 HD11 ILE 24 7.428 -1.342 10.326 225 HD12 ILE 24 HD12 ILE 24 9.143 -0.908 10.208 226 HD13 ILE 24 HD13 ILE 24 7.947 -0.134 9.129 227 H GLN 25 H GLN 25 5.399 -4.959 7.995 228 HA GLN 25 HA GLN 25 7.083 -6.445 9.734 229 HB2 GLN 25 HB2 GLN 25 4.760 -5.646 10.187 230 HB3 GLN 25 HB3 GLN 25 4.131 -6.898 9.094 231 HG2 GLN 25 HG2 GLN 25 4.949 -8.633 10.580 232 HG3 GLN 25 HG3 GLN 25 5.948 -7.467 11.475 233 HE21 GLN 25 HE21 GLN 25 5.094 -6.721 13.376 234 HE22 GLN 25 HE22 GLN 25 3.401 -6.827 13.801 235 H ASN 26 H ASN 26 5.217 -7.429 6.782 236 HA ASN 26 HA ASN 26 6.220 -10.172 6.969 237 HB2 ASN 26 HB2 ASN 26 4.889 -8.665 4.653 238 HB3 ASN 26 HB3 ASN 26 5.260 -10.379 4.658 239 HD21 ASN 26 HD21 ASN 26 3.336 -7.933 6.381 240 HD22 ASN 26 HD22 ASN 26 2.084 -9.046 6.927 241 H SER 27 H SER 27 6.886 -7.382 4.824 242 HA SER 27 HA SER 27 8.572 -6.837 3.444 243 HB2 SER 27 HB2 SER 27 9.574 -6.700 5.773 244 HB3 SER 27 HB3 SER 27 10.420 -8.207 5.417 245 HG SER 27 HG SER 27 11.389 -7.177 3.669 246 H LEU 28 H LEU 28 7.406 -9.650 3.162 247 HA LEU 28 HA LEU 28 9.421 -10.725 1.263 248 HB2 LEU 28 HB2 LEU 28 8.515 -12.982 1.841 249 HB3 LEU 28 HB3 LEU 28 9.233 -12.133 3.185 250 HG LEU 28 HG LEU 28 6.995 -11.517 4.045 251 HD11 LEU 28 HD11 LEU 28 5.048 -12.906 3.254 252 HD12 LEU 28 HD12 LEU 28 5.992 -13.297 1.800 253 HD13 LEU 28 HD13 LEU 28 5.522 -11.618 2.162 254 HD21 LEU 28 HD21 LEU 28 7.378 -14.494 3.727 255 HD22 LEU 28 HD22 LEU 28 6.503 -13.659 5.012 256 HD23 LEU 28 HD23 LEU 28 8.250 -13.469 4.885 257 H SER 29 H SER 29 8.040 -12.511 -0.045 258 HA SER 29 HA SER 29 5.713 -11.150 -1.354 259 HB2 SER 29 HB2 SER 29 7.959 -12.738 -2.640 260 HB3 SER 29 HB3 SER 29 6.576 -12.045 -3.465 261 HG SER 29 HG SER 29 7.351 -9.955 -2.624 262 H THR 30 H THR 30 7.384 -14.307 -0.851 263 HA THR 30 HA THR 30 4.821 -15.579 -0.593 264 HB THR 30 HB THR 30 5.205 -15.469 -3.011 265 HG1 THR 30 HG1 THR 30 5.009 -17.916 -3.200 266 HG21 THR 30 HG21 THR 30 7.470 -17.462 -2.691 267 HG22 THR 30 HG22 THR 30 7.701 -15.733 -3.006 268 HG23 THR 30 HG23 THR 30 6.845 -16.745 -4.179 269 H GLU 31 H GLU 31 7.046 -14.967 1.147 270 HA GLU 31 HA GLU 31 8.492 -15.928 2.678 271 HB2 GLU 31 HB2 GLU 31 7.028 -18.510 2.086 272 HB3 GLU 31 HB3 GLU 31 7.856 -18.073 3.571 273 HG2 GLU 31 HG2 GLU 31 6.201 -16.419 4.125 274 HG3 GLU 31 HG3 GLU 31 5.444 -16.495 2.535 275 H LYS 32 H LYS 32 9.575 -15.447 0.342 276 HA LYS 32 HA LYS 32 10.824 -17.600 -1.061 277 HB2 LYS 32 HB2 LYS 32 11.924 -16.010 -2.302 278 HB3 LYS 32 HB3 LYS 32 10.313 -15.380 -1.988 279 HG2 LYS 32 HG2 LYS 32 11.359 -13.932 -0.156 280 HG3 LYS 32 HG3 LYS 32 12.940 -14.532 -0.694 281 HD2 LYS 32 HD2 LYS 32 12.801 -12.603 -1.955 282 HD3 LYS 32 HD3 LYS 32 12.104 -13.795 -3.087 283 HE2 LYS 32 HE2 LYS 32 9.873 -13.141 -2.524 284 HE3 LYS 32 HE3 LYS 32 10.440 -12.092 -1.197 285 HZ1 LYS 32 HZ1 LYS 32 11.401 -10.613 -2.810 286 HZ2 LYS 32 HZ2 LYS 32 9.830 -10.868 -3.191 287 HZ3 LYS 32 HZ3 LYS 32 10.977 -11.620 -4.064 288 H TYR 33 H TYR 33 13.200 -17.974 -1.177 289 HA TYR 33 HA TYR 33 14.524 -17.583 1.475 290 HB2 TYR 33 HB2 TYR 33 14.004 -19.929 1.054 291 HB3 TYR 33 HB3 TYR 33 14.821 -19.856 -0.512 292 HD1 TYR 33 HD1 TYR 33 17.135 -20.421 -0.616 293 HD2 TYR 33 HD2 TYR 33 15.432 -19.140 3.131 294 HE1 TYR 33 HE1 TYR 33 19.280 -20.826 0.498 295 HE2 TYR 33 HE2 TYR 33 17.582 -19.556 4.270 296 HH TYR 33 HH TYR 33 20.349 -21.041 2.565 297 H GLY 34 H GLY 34 14.874 -17.374 -2.064 298 HA2 GLY 34 HA2 GLY 34 17.634 -16.859 -2.229 299 HA3 GLY 34 HA3 GLY 34 16.428 -16.198 -3.342 300 H SER 35 H SER 35 18.917 -15.077 -1.742 301 HA SER 35 HA SER 35 17.573 -12.567 -0.887 302 HB2 SER 35 HB2 SER 35 19.086 -12.607 1.141 303 HB3 SER 35 HB3 SER 35 17.779 -13.802 1.146 304 HG SER 35 HG SER 35 20.078 -14.433 1.721 305 H GLY 36 H GLY 36 20.841 -13.965 -0.849 306 HA2 GLY 36 HA2 GLY 36 22.745 -13.393 -2.074 307 HA3 GLY 36 HA3 GLY 36 21.845 -12.098 -2.896 308 H SER 37 H SER 37 24.469 -11.795 -1.733 309 HA SER 37 HA SER 37 24.005 -9.543 0.070 310 HB2 SER 37 HB2 SER 37 26.009 -11.686 0.833 311 HB3 SER 37 HB3 SER 37 25.446 -10.325 1.801 312 HG SER 37 HG SER 37 24.537 -12.187 2.556 313 H GLY 38 H GLY 38 26.412 -8.526 0.434 314 HA2 GLY 38 HA2 GLY 38 28.470 -9.157 -1.398 315 HA3 GLY 38 HA3 GLY 38 27.465 -7.853 -2.072 316 H SER 39 H SER 39 30.302 -7.737 -1.047 317 HA SER 39 HA SER 39 30.030 -5.322 0.517 318 HB2 SER 39 HB2 SER 39 29.877 -7.263 2.207 319 HB3 SER 39 HB3 SER 39 31.542 -7.666 1.749 320 HG SER 39 HG SER 39 31.566 -6.329 3.527 321 H GLY 40 H GLY 40 32.089 -4.261 0.648 322 HA2 GLY 40 HA2 GLY 40 33.953 -3.368 -0.320 323 HA3 GLY 40 HA3 GLY 40 34.606 -4.988 -0.095 324 H SER 41 H SER 41 31.993 -4.689 -2.466 325 HA SER 41 HA SER 41 33.787 -4.242 -4.719 326 HB2 SER 41 HB2 SER 41 33.141 -6.529 -5.675 327 HB3 SER 41 HB3 SER 41 34.306 -6.560 -4.343 328 HG SER 41 HG SER 41 32.674 -7.148 -2.925 329 H GLY 42 H GLY 42 32.519 -4.139 -6.760 330 HA2 GLY 42 HA2 GLY 42 29.831 -4.550 -7.139 331 HA3 GLY 42 HA3 GLY 42 29.969 -2.915 -6.453 332 H SER 43 H SER 43 29.320 -3.804 -9.297 333 HA SER 43 HA SER 43 31.123 -1.914 -10.648 334 HB2 SER 43 HB2 SER 43 30.831 -4.793 -11.608 335 HB3 SER 43 HB3 SER 43 31.741 -3.495 -12.401 336 HG SER 43 HG SER 43 32.670 -3.512 -9.994 337 H GLY 44 H GLY 44 28.440 -1.566 -9.924 338 HA2 GLY 44 HA2 GLY 44 26.811 -0.413 -11.232 339 HA3 GLY 44 HA3 GLY 44 27.113 -1.496 -12.599 340 H SER 45 H SER 45 25.065 -2.390 -12.830 341 HA SER 45 HA SER 45 23.354 -3.817 -12.515 342 HB2 SER 45 HB2 SER 45 25.363 -5.174 -11.551 343 HB3 SER 45 HB3 SER 45 24.602 -4.875 -9.984 344 HG SER 45 HG SER 45 24.082 -6.847 -11.026 345 H GLY 46 H GLY 46 23.255 -1.098 -11.424 346 HA2 GLY 46 HA2 GLY 46 21.428 -1.393 -9.104 347 HA3 GLY 46 HA3 GLY 46 22.386 0.022 -9.490 348 H SER 47 H SER 47 19.287 -0.679 -9.352 349 HA SER 47 HA SER 47 18.563 1.217 -11.431 350 HB2 SER 47 HB2 SER 47 16.973 -0.220 -12.577 351 HB3 SER 47 HB3 SER 47 18.593 -0.913 -12.696 352 HG SER 47 HG SER 47 18.057 -2.371 -11.053 353 H GLY 48 H GLY 48 15.920 1.370 -11.343 354 HA2 GLY 48 HA2 GLY 48 14.541 0.653 -9.034 355 HA3 GLY 48 HA3 GLY 48 15.240 2.246 -8.759 356 H SER 49 H SER 49 12.581 2.330 -8.797 357 HA SER 49 HA SER 49 11.960 3.649 -11.342 358 HB2 SER 49 HB2 SER 49 11.293 1.058 -11.179 359 HB3 SER 49 HB3 SER 49 9.954 1.694 -10.211 360 HG SER 49 HG SER 49 10.664 2.275 -12.922 361 H GLY 50 H GLY 50 9.646 4.694 -11.012 362 HA2 GLY 50 HA2 GLY 50 8.399 5.255 -8.646 363 HA3 GLY 50 HA3 GLY 50 9.784 6.363 -8.676 364 H SER 51 H SER 51 7.391 7.600 -8.741 365 HA SER 51 HA SER 51 7.352 8.730 -11.438 366 HB2 SER 51 HB2 SER 51 4.961 8.524 -11.696 367 HB3 SER 51 HB3 SER 51 5.678 6.927 -11.503 368 HG SER 51 HG SER 51 5.036 7.018 -9.272 369 H GLY 52 H GLY 52 5.285 10.555 -11.013 370 HA2 GLY 52 HA2 GLY 52 6.602 12.306 -9.035 371 HA3 GLY 52 HA3 GLY 52 5.409 12.748 -10.238 372 H SER 53 H SER 53 3.404 10.683 -9.433 373 HA SER 53 HA SER 53 2.158 12.245 -7.331 374 HB2 SER 53 HB2 SER 53 1.048 11.165 -9.378 375 HB3 SER 53 HB3 SER 53 1.122 9.638 -8.502 376 HG SER 53 HG SER 53 -0.205 10.526 -6.922 377 H GLY 54 H GLY 54 3.297 11.973 -5.324 378 HA2 GLY 54 HA2 GLY 54 2.954 9.333 -4.044 379 HA3 GLY 54 HA3 GLY 54 4.597 9.981 -4.183 380 H SER 55 H SER 55 2.016 9.793 -2.102 381 HA SER 55 HA SER 55 2.883 12.183 -0.581 382 HB2 SER 55 HB2 SER 55 0.504 12.747 -0.126 383 HB3 SER 55 HB3 SER 55 0.974 12.953 -1.819 384 HG SER 55 HG SER 55 -0.943 11.940 -1.879 385 H GLY 56 H GLY 56 0.394 9.667 -0.292 386 HA2 GLY 56 HA2 GLY 56 0.448 7.745 1.135 387 HA3 GLY 56 HA3 GLY 56 1.686 8.532 2.139 388 H SER 57 H SER 57 -0.188 7.637 3.747 389 HA SER 57 HA SER 57 -1.616 10.015 4.647 390 HB2 SER 57 HB2 SER 57 -3.257 7.521 4.016 391 HB3 SER 57 HB3 SER 57 -3.824 9.021 4.753 392 HG SER 57 HG SER 57 -2.647 9.722 2.514 393 H GLY 58 H GLY 58 -1.300 10.036 6.784 394 HA2 GLY 58 HA2 GLY 58 -1.595 9.121 8.967 395 HA3 GLY 58 HA3 GLY 58 -1.195 7.503 8.355 396 H TYR 59 H TYR 59 0.202 8.165 10.453 397 HA TYR 59 HA TYR 59 2.599 9.681 10.043 398 HB2 TYR 59 HB2 TYR 59 2.026 7.587 12.156 399 HB3 TYR 59 HB3 TYR 59 3.204 8.883 12.245 400 HD1 TYR 59 HD1 TYR 59 1.256 11.171 11.182 401 HD2 TYR 59 HD2 TYR 59 0.887 8.050 14.171 402 HE1 TYR 59 HE1 TYR 59 -0.361 12.540 12.424 403 HE2 TYR 59 HE2 TYR 59 -0.730 9.447 15.413 404 HH TYR 59 HH TYR 59 -1.885 12.597 14.235 405 H GLN3288 H GLN3288 2.598 7.981 7.876 406 HA GLN3288 HA GLN3288 4.218 5.602 8.397 407 HB2 GLN3288 HB2 GLN3288 4.263 5.357 5.958 408 HB3 GLN3288 HB3 GLN3288 2.645 5.564 6.582 409 HG2 GLN3288 HG2 GLN3288 2.794 8.029 5.879 410 HG3 GLN3288 HG3 GLN3288 4.314 7.617 5.071 411 HE21 GLN3288 HE21 GLN3288 4.103 6.910 2.904 412 HE22 GLN3288 HE22 GLN3288 2.627 6.232 2.258 413 H ILE3289 H ILE3289 6.288 5.399 6.943 414 HA ILE3289 HA ILE3289 8.075 7.541 7.899 415 HB ILE3289 HB ILE3289 8.759 4.936 6.468 416 HG12 ILE3289 HG12 ILE3289 8.856 5.625 9.447 417 HG13 ILE3289 HG13 ILE3289 7.618 4.612 8.725 418 HG21 ILE3289 HG21 ILE3289 10.448 6.752 6.252 419 HG22 ILE3289 HG22 ILE3289 10.418 6.984 8.004 420 HG23 ILE3289 HG23 ILE3289 11.043 5.478 7.316 421 HD11 ILE3289 HD11 ILE3289 9.323 3.278 9.850 422 HD12 ILE3289 HD12 ILE3289 9.226 2.910 8.127 423 HD13 ILE3289 HD13 ILE3289 10.565 3.904 8.762 424 H GLU3290 H GLU3290 7.937 9.305 6.598 425 HA GLU3290 HA GLU3290 7.034 9.174 3.865 426 HB2 GLU3290 HB2 GLU3290 6.370 10.964 5.219 427 HB3 GLU3290 HB3 GLU3290 8.011 11.333 5.699 428 HG2 GLU3290 HG2 GLU3290 8.491 12.121 3.361 429 HG3 GLU3290 HG3 GLU3290 6.823 11.705 2.906 430 H THR3291 H THR3291 10.234 8.818 5.239 431 HA THR3291 HA THR3291 11.285 8.928 2.438 432 HB THR3291 HB THR3291 11.799 10.945 3.362 433 HG1 THR3291 HG1 THR3291 13.480 9.759 2.229 434 HG21 THR3291 HG21 THR3291 13.052 9.592 5.737 435 HG22 THR3291 HG22 THR3291 11.635 10.666 5.739 436 HG23 THR3291 HG23 THR3291 13.229 11.325 5.349 437 H PHE3292 H PHE3292 10.719 6.692 2.541 438 HA PHE3292 HA PHE3292 13.090 5.124 3.149 439 HB2 PHE3292 HB2 PHE3292 12.023 5.151 5.292 440 HB3 PHE3292 HB3 PHE3292 10.464 4.735 4.613 441 HD1 PHE3292 HD1 PHE3292 13.590 2.930 3.508 442 HD2 PHE3292 HD2 PHE3292 10.192 2.897 6.155 443 HE1 PHE3292 HE1 PHE3292 14.067 0.593 4.091 444 HE2 PHE3292 HE2 PHE3292 10.683 0.544 6.749 445 HZ PHE3292 HZ PHE3292 12.633 -0.620 5.715 446 H PHE3293 H PHE3293 9.615 4.432 2.741 447 HA PHE3293 HA PHE3293 10.110 2.940 0.229 448 HB2 PHE3293 HB2 PHE3293 7.730 1.998 0.996 449 HB3 PHE3293 HB3 PHE3293 9.231 1.415 1.621 450 HD1 PHE3293 HD1 PHE3293 8.815 0.768 3.883 451 HD2 PHE3293 HD2 PHE3293 7.147 4.486 2.439 452 HE1 PHE3293 HE1 PHE3293 7.897 1.243 6.125 453 HE2 PHE3293 HE2 PHE3293 6.284 4.968 4.658 454 HZ PHE3293 HZ PHE3293 6.609 3.324 6.539 455 H ALA3294 H ALA3294 9.349 5.987 0.718 456 HA ALA3294 HA ALA3294 6.869 6.591 -0.224 457 HB1 ALA3294 HB1 ALA3294 9.539 7.983 -0.630 458 HB2 ALA3294 HB2 ALA3294 8.014 8.666 -1.217 459 HB3 ALA3294 HB3 ALA3294 8.222 8.386 0.501 460 H GLN3295 H GLN3295 9.609 5.516 -2.140 461 HA GLN3295 HA GLN3295 8.274 6.311 -4.675 462 HB2 GLN3295 HB2 GLN3295 10.604 4.412 -4.342 463 HB3 GLN3295 HB3 GLN3295 10.071 5.205 -5.840 464 HG2 GLN3295 HG2 GLN3295 11.415 6.345 -3.426 465 HG3 GLN3295 HG3 GLN3295 11.942 6.447 -5.105 466 HE21 GLN3295 HE21 GLN3295 10.826 8.325 -2.615 467 HE22 GLN3295 HE22 GLN3295 9.870 9.512 -3.473 468 H ASP3296 H ASP3296 8.366 3.536 -2.662 469 HA ASP3296 HA ASP3296 7.014 1.782 -4.655 470 HB2 ASP3296 HB2 ASP3296 8.816 1.087 -2.840 471 HB3 ASP3296 HB3 ASP3296 7.437 1.071 -1.739 472 H ILE3297 H ILE3297 6.234 3.712 -1.845 473 HA ILE3297 HA ILE3297 3.693 2.820 -1.134 474 HB ILE3297 HB ILE3297 5.436 5.102 -0.663 475 HG12 ILE3297 HG12 ILE3297 4.779 5.032 1.591 476 HG13 ILE3297 HG13 ILE3297 3.194 4.354 1.195 477 HG21 ILE3297 HG21 ILE3297 3.761 6.506 -1.697 478 HG22 ILE3297 HG22 ILE3297 2.499 5.836 -0.654 479 HG23 ILE3297 HG23 ILE3297 3.829 6.806 0.034 480 HD11 ILE3297 HD11 ILE3297 5.730 2.814 0.712 481 HD12 ILE3297 HD12 ILE3297 4.920 2.823 2.289 482 HD13 ILE3297 HD13 ILE3297 4.064 2.201 0.871 483 H GLU3298 H GLU3298 4.603 5.192 -3.593 484 HA GLU3298 HA GLU3298 2.010 5.978 -4.397 485 HB2 GLU3298 HB2 GLU3298 3.211 6.639 -6.524 486 HB3 GLU3298 HB3 GLU3298 3.789 7.372 -5.011 487 HG2 GLU3298 HG2 GLU3298 5.749 6.133 -4.978 488 HG3 GLU3298 HG3 GLU3298 5.082 4.863 -6.002 489 H SER3299 H SER3299 3.995 3.202 -5.224 490 HA SER3299 HA SER3299 2.376 2.500 -7.544 491 HB2 SER3299 HB2 SER3299 4.770 1.868 -7.331 492 HB3 SER3299 HB3 SER3299 4.305 0.648 -6.123 493 HG SER3299 HG SER3299 3.182 -0.447 -7.649 494 H VAL3300 H VAL3300 2.707 1.223 -4.240 495 HA VAL3300 HA VAL3300 0.581 -0.694 -4.631 496 HB VAL3300 HB VAL3300 2.451 -0.912 -3.009 497 HG11 VAL3300 HG11 VAL3300 2.172 0.078 -0.748 498 HG12 VAL3300 HG12 VAL3300 2.474 1.276 -2.013 499 HG13 VAL3300 HG13 VAL3300 0.844 1.086 -1.381 500 HG21 VAL3300 HG21 VAL3300 0.569 -2.410 -2.942 501 HG22 VAL3300 HG22 VAL3300 1.115 -2.065 -1.292 502 HG23 VAL3300 HG23 VAL3300 -0.352 -1.285 -1.943 503 H GLN3301 H GLN3301 0.579 2.671 -3.478 504 HA GLN3301 HA GLN3301 -2.197 2.568 -2.609 505 HB2 GLN3301 HB2 GLN3301 -2.134 4.890 -2.255 506 HB3 GLN3301 HB3 GLN3301 -0.606 4.184 -1.769 507 HG2 GLN3301 HG2 GLN3301 0.289 5.904 -2.858 508 HG3 GLN3301 HG3 GLN3301 0.068 4.887 -4.259 509 HE21 GLN3301 HE21 GLN3301 -2.929 5.373 -4.502 510 HE22 GLN3301 HE22 GLN3301 -2.955 6.941 -5.243 511 H LYS3302 H LYS3302 -0.557 3.110 -5.712 512 HA LYS3302 HA LYS3302 -2.704 4.304 -7.116 513 HB2 LYS3302 HB2 LYS3302 -0.178 2.910 -7.832 514 HB3 LYS3302 HB3 LYS3302 -1.440 2.939 -9.058 515 HG2 LYS3302 HG2 LYS3302 -1.591 5.371 -8.980 516 HG3 LYS3302 HG3 LYS3302 -0.498 5.441 -7.596 517 HD2 LYS3302 HD2 LYS3302 0.801 5.974 -9.523 518 HD3 LYS3302 HD3 LYS3302 1.246 4.336 -9.021 519 HE2 LYS3302 HE2 LYS3302 -0.455 3.475 -10.746 520 HE3 LYS3302 HE3 LYS3302 -0.542 5.140 -11.344 521 HZ1 LYS3302 HZ1 LYS3302 1.884 4.992 -11.659 522 HZ2 LYS3302 HZ2 LYS3302 1.053 3.906 -12.586 523 HZ3 LYS3302 HZ3 LYS3302 1.850 3.400 -11.231 524 H GLU3303 H GLU3303 -2.061 0.997 -6.100 525 HA GLU3303 HA GLU3303 -3.899 -0.219 -7.978 526 HB2 GLU3303 HB2 GLU3303 -3.175 -2.183 -7.173 527 HB3 GLU3303 HB3 GLU3303 -1.906 -1.210 -6.435 528 HG2 GLU3303 HG2 GLU3303 -3.414 -1.103 -4.352 529 HG3 GLU3303 HG3 GLU3303 -4.458 -2.266 -5.161 530 H LEU3304 H LEU3304 -4.107 0.932 -4.655 531 HA LEU3304 HA LEU3304 -6.786 0.133 -4.160 532 HB2 LEU3304 HB2 LEU3304 -5.181 2.303 -2.864 533 HB3 LEU3304 HB3 LEU3304 -6.639 1.573 -2.237 534 HG LEU3304 HG LEU3304 -3.897 0.312 -2.544 535 HD11 LEU3304 HD11 LEU3304 -4.170 0.212 -0.029 536 HD12 LEU3304 HD12 LEU3304 -5.696 1.087 -0.234 537 HD13 LEU3304 HD13 LEU3304 -4.210 1.849 -0.768 538 HD21 LEU3304 HD21 LEU3304 -4.731 -1.709 -1.450 539 HD22 LEU3304 HD22 LEU3304 -5.500 -1.484 -3.005 540 HD23 LEU3304 HD23 LEU3304 -6.391 -1.089 -1.514 541 H GLU3305 H GLU3305 -5.472 3.268 -5.324 542 HA GLU3305 HA GLU3305 -7.889 4.738 -4.884 543 HB2 GLU3305 HB2 GLU3305 -6.908 6.409 -6.462 544 HB3 GLU3305 HB3 GLU3305 -5.822 5.908 -5.147 545 HG2 GLU3305 HG2 GLU3305 -4.693 4.381 -6.629 546 HG3 GLU3305 HG3 GLU3305 -5.784 4.741 -7.968 547 H ASN3306 H ASN3306 -7.205 2.364 -7.270 548 HA ASN3306 HA ASN3306 -9.560 3.283 -8.854 549 HB2 ASN3306 HB2 ASN3306 -8.711 2.256 -10.746 550 HB3 ASN3306 HB3 ASN3306 -7.330 3.084 -10.039 551 HD21 ASN3306 HD21 ASN3306 -5.494 1.784 -9.268 552 HD22 ASN3306 HD22 ASN3306 -5.499 0.090 -9.697 553 H LEU3307 H LEU3307 -8.864 1.238 -6.295 554 HA LEU3307 HA LEU3307 -10.334 -1.086 -7.250 555 HB2 LEU3307 HB2 LEU3307 -8.404 -0.364 -5.285 556 HB3 LEU3307 HB3 LEU3307 -9.858 -0.727 -4.392 557 HG LEU3307 HG LEU3307 -9.575 -2.870 -4.566 558 HD11 LEU3307 HD11 LEU3307 -8.574 -2.572 -7.392 559 HD12 LEU3307 HD12 LEU3307 -10.151 -3.205 -6.857 560 HD13 LEU3307 HD13 LEU3307 -8.706 -4.151 -6.547 561 HD21 LEU3307 HD21 LEU3307 -6.791 -2.190 -5.459 562 HD22 LEU3307 HD22 LEU3307 -7.313 -3.699 -4.684 563 HD23 LEU3307 HD23 LEU3307 -7.429 -2.182 -3.793 564 H SER3308 H SER3308 -12.322 -1.761 -6.314 565 HA SER3308 HA SER3308 -14.198 0.395 -5.772 566 HB2 SER3308 HB2 SER3308 -14.547 -2.627 -5.975 567 HB3 SER3308 HB3 SER3308 -15.832 -1.414 -6.036 568 HG SER3308 HG SER3308 -14.554 -0.531 -7.928 569 H GLU3309 H GLU3309 -15.889 0.022 -3.880 570 HA GLU3309 HA GLU3309 -14.488 -0.028 -1.400 571 HB2 GLU3309 HB2 GLU3309 -17.396 -0.349 -2.247 572 HB3 GLU3309 HB3 GLU3309 -16.958 -0.777 -0.600 573 HG2 GLU3309 HG2 GLU3309 -16.001 1.562 -0.391 574 HG3 GLU3309 HG3 GLU3309 -16.956 1.934 -1.837 575 H GLU3310 H GLU3310 -16.560 -2.485 -2.947 576 HA GLU3310 HA GLU3310 -16.471 -4.467 -1.126 577 HB2 GLU3310 HB2 GLU3310 -16.261 -4.807 -4.138 578 HB3 GLU3310 HB3 GLU3310 -16.905 -6.004 -3.009 579 HG2 GLU3310 HG2 GLU3310 -18.781 -4.502 -2.450 580 HG3 GLU3310 HG3 GLU3310 -18.117 -3.222 -3.463 581 H GLU3311 H GLU3311 -13.780 -3.400 -3.074 582 HA GLU3311 HA GLU3311 -12.174 -5.828 -2.626 583 HB2 GLU3311 HB2 GLU3311 -11.666 -3.150 -3.923 584 HB3 GLU3311 HB3 GLU3311 -10.550 -4.497 -3.921 585 HG2 GLU3311 HG2 GLU3311 -13.259 -5.035 -5.108 586 HG3 GLU3311 HG3 GLU3311 -12.200 -3.944 -5.972 587 H LEU3312 H LEU3312 -12.145 -2.323 -1.827 588 HA LEU3312 HA LEU3312 -9.886 -2.500 -0.034 589 HB2 LEU3312 HB2 LEU3312 -11.828 -0.184 -0.099 590 HB3 LEU3312 HB3 LEU3312 -10.180 -0.133 0.333 591 HG LEU3312 HG LEU3312 -10.824 -0.947 -2.492 592 HD11 LEU3312 HD11 LEU3312 -12.304 0.825 -2.229 593 HD12 LEU3312 HD12 LEU3312 -10.919 1.423 -3.136 594 HD13 LEU3312 HD13 LEU3312 -11.079 1.867 -1.423 595 HD21 LEU3312 HD21 LEU3312 -8.567 -1.080 -1.947 596 HD22 LEU3312 HD22 LEU3312 -8.539 0.495 -1.137 597 HD23 LEU3312 HD23 LEU3312 -8.749 0.398 -2.897 598 H LEU3313 H LEU3313 -13.301 -1.727 0.476 599 HA LEU3313 HA LEU3313 -13.426 -1.376 3.233 600 HB2 LEU3313 HB2 LEU3313 -15.148 -0.642 1.588 601 HB3 LEU3313 HB3 LEU3313 -15.491 -2.315 1.193 602 HG LEU3313 HG LEU3313 -17.159 -1.279 2.595 603 HD11 LEU3313 HD11 LEU3313 -16.131 -3.836 3.817 604 HD12 LEU3313 HD12 LEU3313 -16.960 -3.724 2.245 605 HD13 LEU3313 HD13 LEU3313 -17.776 -3.209 3.720 606 HD21 LEU3313 HD21 LEU3313 -15.278 -1.736 4.921 607 HD22 LEU3313 HD22 LEU3313 -16.983 -1.260 4.986 608 HD23 LEU3313 HD23 LEU3313 -15.803 -0.147 4.311 609 H ALA3314 H ALA3314 -13.628 -4.316 1.154 610 HA ALA3314 HA ALA3314 -14.307 -6.011 3.317 611 HB1 ALA3314 HB1 ALA3314 -12.842 -6.493 0.676 612 HB2 ALA3314 HB2 ALA3314 -13.379 -7.805 1.749 613 HB3 ALA3314 HB3 ALA3314 -14.576 -6.720 1.041 614 H MET3315 H MET3315 -11.160 -4.719 2.295 615 HA MET3315 HA MET3315 -9.534 -6.594 3.798 616 HB2 MET3315 HB2 MET3315 -8.750 -3.800 2.866 617 HB3 MET3315 HB3 MET3315 -7.677 -5.125 3.274 618 HG2 MET3315 HG2 MET3315 -9.632 -5.839 1.203 619 HG3 MET3315 HG3 MET3315 -8.735 -4.419 0.769 620 HE1 MET3315 HE1 MET3315 -7.148 -7.681 -1.065 621 HE2 MET3315 HE2 MET3315 -8.779 -7.690 -0.355 622 HE3 MET3315 HE3 MET3315 -8.226 -6.282 -1.282 623 H LEU3316 H LEU3316 -10.255 -3.141 4.239 624 HA LEU3316 HA LEU3316 -9.003 -2.884 6.817 625 HB2 LEU3316 HB2 LEU3316 -10.263 -0.753 6.976 626 HB3 LEU3316 HB3 LEU3316 -9.359 -0.963 5.486 627 HG LEU3316 HG LEU3316 -11.713 -1.929 4.582 628 HD11 LEU3316 HD11 LEU3316 -13.527 -0.293 5.481 629 HD12 LEU3316 HD12 LEU3316 -12.487 -0.113 6.897 630 HD13 LEU3316 HD13 LEU3316 -13.180 -1.671 6.492 631 HD21 LEU3316 HD21 LEU3316 -12.045 0.146 3.541 632 HD22 LEU3316 HD22 LEU3316 -10.348 0.141 3.879 633 HD23 LEU3316 HD23 LEU3316 -11.458 1.065 4.942 634 H ASN3317 H ASN3317 -12.269 -3.877 5.809 635 HA ASN3317 HA ASN3317 -13.177 -3.791 8.588 636 HB2 ASN3317 HB2 ASN3317 -14.601 -3.436 6.357 637 HB3 ASN3317 HB3 ASN3317 -14.738 -5.192 6.411 638 HD21 ASN3317 HD21 ASN3317 -14.768 -2.412 8.767 639 HD22 ASN3317 HD22 ASN3317 -16.212 -3.006 9.601 640 H GLY3318 H GLY3318 -11.830 -6.121 6.379 641 HA2 GLY3318 HA2 GLY3318 -10.902 -8.219 6.880 642 HA3 GLY3318 HA3 GLY3318 -11.393 -8.031 8.566 643 H ASP3319 H ASP3319 -13.530 -7.732 5.758 644 HA ASP3319 HA ASP3319 -15.066 -10.223 6.367 645 HB2 ASP3319 HB2 ASP3319 -15.951 -7.331 6.194 646 HB3 ASP3319 HB3 ASP3319 -17.003 -8.591 5.596 647 H GLN3320 H GLN3320 -16.684 -10.477 4.460 648 HA GLN3320 HA GLN3320 -15.641 -9.637 1.900 649 HB2 GLN3320 HB2 GLN3320 -14.238 -11.614 2.301 650 HB3 GLN3320 HB3 GLN3320 -15.668 -12.616 2.560 651 HG2 GLN3320 HG2 GLN3320 -15.676 -11.044 -0.004 652 HG3 GLN3320 HG3 GLN3320 -14.372 -12.204 0.150 653 HE21 GLN3320 HE21 GLN3320 -17.897 -11.928 -0.370 654 HE22 GLN3320 HE22 GLN3320 -18.122 -13.679 -0.420 655 H GLN3321 H GLN3321 -17.535 -8.603 1.863 656 HA GLN3321 HA GLN3321 -20.135 -9.900 2.238 657 HB2 GLN3321 HB2 GLN3321 -21.139 -7.904 1.605 658 HB3 GLN3321 HB3 GLN3321 -19.674 -7.351 2.389 659 HG2 GLN3321 HG2 GLN3321 -20.140 -7.538 -0.635 660 HG3 GLN3321 HG3 GLN3321 -20.303 -6.100 0.346 661 HE21 GLN3321 HE21 GLN3321 -17.880 -8.526 -0.723 662 HE22 GLN3321 HE22 GLN3321 -16.532 -7.379 -0.717 Start of MODEL 20 1 H1 MET 1 H MET 1 -27.236 7.036 -5.158 2 HA MET 1 HA MET 1 -27.347 9.254 -7.109 3 HB2 MET 1 HB2 MET 1 -28.239 9.500 -4.216 4 HB3 MET 1 HB3 MET 1 -28.461 10.631 -5.549 5 HG2 MET 1 HG2 MET 1 -29.907 8.815 -6.634 6 HG3 MET 1 HG3 MET 1 -29.821 7.974 -5.078 7 HE1 MET 1 HE1 MET 1 -30.757 9.046 -2.774 8 HE2 MET 1 HE2 MET 1 -29.964 10.621 -3.036 9 HE3 MET 1 HE3 MET 1 -31.705 10.549 -2.703 10 H ASN 2 H ASN 2 -26.286 8.460 -3.715 11 HA ASN 2 HA ASN 2 -24.449 10.608 -3.755 12 HB2 ASN 2 HB2 ASN 2 -25.005 8.345 -1.875 13 HB3 ASN 2 HB3 ASN 2 -23.434 9.134 -1.755 14 HD21 ASN 2 HD21 ASN 2 -26.425 9.336 -0.417 15 HD22 ASN 2 HD22 ASN 2 -26.562 11.089 -0.186 16 H ILE 3 H ILE 3 -22.258 10.658 -4.028 17 HA ILE 3 HA ILE 3 -21.253 9.083 -6.103 18 HB ILE 3 HB ILE 3 -20.605 11.440 -5.325 19 HG12 ILE 3 HG12 ILE 3 -18.392 11.385 -6.250 20 HG13 ILE 3 HG13 ILE 3 -18.327 9.618 -6.143 21 HG21 ILE 3 HG21 ILE 3 -18.740 11.715 -3.818 22 HG22 ILE 3 HG22 ILE 3 -20.007 10.819 -2.983 23 HG23 ILE 3 HG23 ILE 3 -18.586 9.967 -3.593 24 HD11 ILE 3 HD11 ILE 3 -20.416 11.151 -7.761 25 HD12 ILE 3 HD12 ILE 3 -18.877 10.607 -8.432 26 HD13 ILE 3 HD13 ILE 3 -20.032 9.408 -7.852 27 H ASN 4 H ASN 4 -19.781 7.572 -6.328 28 HA ASN 4 HA ASN 4 -19.221 5.790 -4.031 29 HB2 ASN 4 HB2 ASN 4 -19.313 3.982 -5.663 30 HB3 ASN 4 HB3 ASN 4 -20.828 4.872 -5.550 31 HD21 ASN 4 HD21 ASN 4 -18.298 3.905 -7.687 32 HD22 ASN 4 HD22 ASN 4 -18.652 5.096 -8.982 33 H GLU 5 H GLU 5 -17.722 6.667 -7.202 34 HA GLU 5 HA GLU 5 -15.195 5.612 -6.650 35 HB2 GLU 5 HB2 GLU 5 -15.907 8.028 -8.316 36 HB3 GLU 5 HB3 GLU 5 -14.293 7.332 -8.250 37 HG2 GLU 5 HG2 GLU 5 -14.803 5.796 -9.782 38 HG3 GLU 5 HG3 GLU 5 -16.102 5.157 -8.772 39 H GLN 6 H GLN 6 -16.429 8.786 -5.812 40 HA GLN 6 HA GLN 6 -13.910 9.739 -4.716 41 HB2 GLN 6 HB2 GLN 6 -16.710 10.845 -4.768 42 HB3 GLN 6 HB3 GLN 6 -15.465 11.576 -3.759 43 HG2 GLN 6 HG2 GLN 6 -15.570 12.676 -5.965 44 HG3 GLN 6 HG3 GLN 6 -14.016 11.946 -5.630 45 HE21 GLN 6 HE21 GLN 6 -16.999 11.573 -7.566 46 HE22 GLN 6 HE22 GLN 6 -16.322 10.468 -8.749 47 H THR 7 H THR 7 -16.537 7.858 -3.447 48 HA THR 7 HA THR 7 -15.902 8.392 -0.643 49 HB THR 7 HB THR 7 -17.494 6.189 -1.970 50 HG1 THR 7 HG1 THR 7 -19.009 7.695 -1.989 51 HG21 THR 7 HG21 THR 7 -18.424 5.782 0.301 52 HG22 THR 7 HG22 THR 7 -17.207 6.913 0.962 53 HG23 THR 7 HG23 THR 7 -16.691 5.410 0.178 54 H LEU 8 H LEU 8 -14.938 5.923 -3.137 55 HA LEU 8 HA LEU 8 -13.700 3.989 -1.638 56 HB2 LEU 8 HB2 LEU 8 -12.373 5.170 -4.102 57 HB3 LEU 8 HB3 LEU 8 -12.354 3.514 -3.501 58 HG LEU 8 HG LEU 8 -14.700 4.941 -4.763 59 HD11 LEU 8 HD11 LEU 8 -14.377 3.375 -6.645 60 HD12 LEU 8 HD12 LEU 8 -12.968 2.692 -5.815 61 HD13 LEU 8 HD13 LEU 8 -12.941 4.373 -6.381 62 HD21 LEU 8 HD21 LEU 8 -15.783 2.681 -4.815 63 HD22 LEU 8 HD22 LEU 8 -15.626 3.396 -3.213 64 HD23 LEU 8 HD23 LEU 8 -14.484 2.122 -3.728 65 H ASP 9 H ASP 9 -12.664 7.345 -2.225 66 HA ASP 9 HA ASP 9 -9.921 7.329 -1.625 67 HB2 ASP 9 HB2 ASP 9 -11.240 9.253 -2.406 68 HB3 ASP 9 HB3 ASP 9 -12.073 9.285 -0.844 69 H LYS 10 H LYS 10 -12.758 7.446 0.686 70 HA LYS 10 HA LYS 10 -11.006 7.574 2.952 71 HB2 LYS 10 HB2 LYS 10 -12.834 7.286 4.375 72 HB3 LYS 10 HB3 LYS 10 -13.468 8.176 2.995 73 HG2 LYS 10 HG2 LYS 10 -14.477 6.096 2.123 74 HG3 LYS 10 HG3 LYS 10 -13.809 5.157 3.440 75 HD2 LYS 10 HD2 LYS 10 -15.564 7.501 4.062 76 HD3 LYS 10 HD3 LYS 10 -16.303 6.031 3.416 77 HE2 LYS 10 HE2 LYS 10 -14.346 5.756 5.694 78 HE3 LYS 10 HE3 LYS 10 -15.976 6.387 6.044 79 HZ1 LYS 10 HZ1 LYS 10 -16.072 4.122 6.349 80 HZ2 LYS 10 HZ2 LYS 10 -15.239 3.764 4.978 81 HZ3 LYS 10 HZ3 LYS 10 -16.818 4.357 4.929 82 H LEU 11 H LEU 11 -12.121 4.941 0.984 83 HA LEU 11 HA LEU 11 -11.560 2.816 2.873 84 HB2 LEU 11 HB2 LEU 11 -12.203 2.773 -0.137 85 HB3 LEU 11 HB3 LEU 11 -11.890 1.369 0.882 86 HG LEU 11 HG LEU 11 -14.124 1.475 0.492 87 HD11 LEU 11 HD11 LEU 11 -15.208 1.686 2.675 88 HD12 LEU 11 HD12 LEU 11 -13.771 2.497 3.319 89 HD13 LEU 11 HD13 LEU 11 -13.685 0.799 2.733 90 HD21 LEU 11 HD21 LEU 11 -15.136 3.871 1.715 91 HD22 LEU 11 HD22 LEU 11 -15.296 3.323 0.048 92 HD23 LEU 11 HD23 LEU 11 -13.916 4.307 0.528 93 H ARG 12 H ARG 12 -10.005 4.016 -0.157 94 HA ARG 12 HA ARG 12 -7.816 2.183 0.030 95 HB2 ARG 12 HB2 ARG 12 -6.660 3.923 -1.525 96 HB3 ARG 12 HB3 ARG 12 -8.003 2.950 -2.064 97 HG2 ARG 12 HG2 ARG 12 -9.399 4.625 -2.377 98 HG3 ARG 12 HG3 ARG 12 -8.834 5.545 -0.964 99 HD2 ARG 12 HD2 ARG 12 -7.172 6.559 -2.000 100 HD3 ARG 12 HD3 ARG 12 -6.958 5.301 -3.217 101 HE ARG 12 HE ARG 12 -8.325 7.717 -3.559 102 HH11 ARG 12 HH11 ARG 12 -9.031 4.307 -4.498 103 HH12 ARG 12 HH12 ARG 12 -10.091 4.841 -5.752 104 HH21 ARG 12 HH21 ARG 12 -9.705 8.282 -5.069 105 HH22 ARG 12 HH22 ARG 12 -10.567 7.175 -6.081 106 H GLN 13 H GLN 13 -8.073 5.546 1.216 107 HA GLN 13 HA GLN 13 -5.436 5.535 2.219 108 HB2 GLN 13 HB2 GLN 13 -5.960 7.528 3.376 109 HB3 GLN 13 HB3 GLN 13 -6.785 7.523 1.815 110 HG2 GLN 13 HG2 GLN 13 -8.512 8.253 3.143 111 HG3 GLN 13 HG3 GLN 13 -8.797 6.544 3.121 112 HE21 GLN 13 HE21 GLN 13 -9.793 6.208 4.970 113 HE22 GLN 13 HE22 GLN 13 -9.177 6.536 6.566 114 H ALA 14 H ALA 14 -8.428 4.115 3.564 115 HA ALA 14 HA ALA 14 -7.354 3.656 6.195 116 HB1 ALA 14 HB1 ALA 14 -9.643 2.436 4.623 117 HB2 ALA 14 HB2 ALA 14 -9.282 2.009 6.304 118 HB3 ALA 14 HB3 ALA 14 -9.744 3.676 5.880 119 H VAL 15 H VAL 15 -7.269 1.893 3.092 120 HA VAL 15 HA VAL 15 -6.168 -0.513 4.225 121 HB VAL 15 HB VAL 15 -6.319 0.431 1.333 122 HG11 VAL 15 HG11 VAL 15 -5.978 -1.957 0.757 123 HG12 VAL 15 HG12 VAL 15 -4.574 -1.286 1.572 124 HG13 VAL 15 HG13 VAL 15 -5.694 -2.331 2.471 125 HG21 VAL 15 HG21 VAL 15 -8.153 -1.296 3.029 126 HG22 VAL 15 HG22 VAL 15 -8.569 0.114 2.046 127 HG23 VAL 15 HG23 VAL 15 -8.093 -1.348 1.259 128 H LEU 16 H LEU 16 -4.749 2.305 2.376 129 HA LEU 16 HA LEU 16 -2.128 1.264 2.385 130 HB2 LEU 16 HB2 LEU 16 -1.244 3.356 1.836 131 HB3 LEU 16 HB3 LEU 16 -2.750 3.105 0.989 132 HG LEU 16 HG LEU 16 -3.752 4.512 2.972 133 HD11 LEU 16 HD11 LEU 16 -1.695 4.806 4.261 134 HD12 LEU 16 HD12 LEU 16 -2.245 6.364 3.633 135 HD13 LEU 16 HD13 LEU 16 -0.897 5.512 2.864 136 HD21 LEU 16 HD21 LEU 16 -3.497 6.527 1.486 137 HD22 LEU 16 HD22 LEU 16 -3.958 5.087 0.583 138 HD23 LEU 16 HD23 LEU 16 -2.271 5.649 0.553 139 H GLN 17 H GLN 17 -3.855 3.002 4.947 140 HA GLN 17 HA GLN 17 -1.762 3.524 6.689 141 HB2 GLN 17 HB2 GLN 17 -4.644 2.748 7.073 142 HB3 GLN 17 HB3 GLN 17 -3.600 2.906 8.480 143 HG2 GLN 17 HG2 GLN 17 -3.156 5.259 7.914 144 HG3 GLN 17 HG3 GLN 17 -4.089 5.114 6.444 145 HE21 GLN 17 HE21 GLN 17 -6.192 6.030 6.733 146 HE22 GLN 17 HE22 GLN 17 -7.008 6.006 8.288 147 H LYS 18 H LYS 18 -3.574 0.234 6.443 148 HA LYS 18 HA LYS 18 -1.765 -0.745 8.452 149 HB2 LYS 18 HB2 LYS 18 -2.739 -2.841 8.182 150 HB3 LYS 18 HB3 LYS 18 -4.007 -1.623 8.160 151 HG2 LYS 18 HG2 LYS 18 -3.339 -2.002 5.448 152 HG3 LYS 18 HG3 LYS 18 -3.135 -3.577 6.121 153 HD2 LYS 18 HD2 LYS 18 -5.709 -2.301 6.981 154 HD3 LYS 18 HD3 LYS 18 -5.498 -2.363 5.227 155 HE2 LYS 18 HE2 LYS 18 -6.437 -4.430 5.611 156 HE3 LYS 18 HE3 LYS 18 -4.686 -4.712 5.503 157 HZ1 LYS 18 HZ1 LYS 18 -6.433 -5.000 7.830 158 HZ2 LYS 18 HZ2 LYS 18 -4.901 -4.499 8.110 159 HZ3 LYS 18 HZ3 LYS 18 -5.201 -5.916 7.327 160 H LYS 19 H LYS 19 -1.704 -0.729 4.907 161 HA LYS 19 HA LYS 19 0.399 -2.552 4.494 162 HB2 LYS 19 HB2 LYS 19 -0.573 -0.156 2.962 163 HB3 LYS 19 HB3 LYS 19 0.919 -0.952 2.478 164 HG2 LYS 19 HG2 LYS 19 -0.135 -3.034 2.107 165 HG3 LYS 19 HG3 LYS 19 -1.600 -2.565 3.000 166 HD2 LYS 19 HD2 LYS 19 -2.389 -1.191 1.263 167 HD3 LYS 19 HD3 LYS 19 -0.827 -1.093 0.476 168 HE2 LYS 19 HE2 LYS 19 -2.440 -2.543 -0.740 169 HE3 LYS 19 HE3 LYS 19 -0.925 -3.348 -0.296 170 HZ1 LYS 19 HZ1 LYS 19 -3.057 -4.576 -0.027 171 HZ2 LYS 19 HZ2 LYS 19 -3.319 -3.723 1.379 172 HZ3 LYS 19 HZ3 LYS 19 -2.018 -4.691 1.197 173 H ILE 20 H ILE 20 0.601 0.850 5.675 174 HA ILE 20 HA ILE 20 3.384 1.109 5.324 175 HB ILE 20 HB ILE 20 1.952 2.317 7.717 176 HG12 ILE 20 HG12 ILE 20 0.473 2.932 5.988 177 HG13 ILE 20 HG13 ILE 20 1.455 4.320 6.332 178 HG21 ILE 20 HG21 ILE 20 3.574 4.158 7.352 179 HG22 ILE 20 HG22 ILE 20 4.383 2.613 7.625 180 HG23 ILE 20 HG23 ILE 20 4.285 3.273 5.985 181 HD11 ILE 20 HD11 ILE 20 1.074 4.040 3.906 182 HD12 ILE 20 HD12 ILE 20 2.801 3.950 4.317 183 HD13 ILE 20 HD13 ILE 20 1.893 2.466 3.949 184 H LYS 21 H LYS 21 1.534 -0.238 8.086 185 HA LYS 21 HA LYS 21 3.727 -0.887 9.823 186 HB2 LYS 21 HB2 LYS 21 1.147 -2.505 9.465 187 HB3 LYS 21 HB3 LYS 21 2.171 -2.448 10.864 188 HG2 LYS 21 HG2 LYS 21 1.585 -0.014 11.173 189 HG3 LYS 21 HG3 LYS 21 0.444 -0.154 9.820 190 HD2 LYS 21 HD2 LYS 21 0.294 -1.961 12.260 191 HD3 LYS 21 HD3 LYS 21 -0.476 -0.370 12.236 192 HE2 LYS 21 HE2 LYS 21 -1.893 -0.977 10.384 193 HE3 LYS 21 HE3 LYS 21 -1.034 -2.521 10.157 194 HZ1 LYS 21 HZ1 LYS 21 -2.591 -1.843 12.583 195 HZ2 LYS 21 HZ2 LYS 21 -1.889 -3.276 12.242 196 HZ3 LYS 21 HZ3 LYS 21 -3.159 -2.740 11.340 197 H GLU 22 H GLU 22 2.335 -2.470 7.000 198 HA GLU 22 HA GLU 22 3.471 -5.080 7.651 199 HB2 GLU 22 HB2 GLU 22 2.046 -4.096 5.156 200 HB3 GLU 22 HB3 GLU 22 2.661 -5.736 5.418 201 HG2 GLU 22 HG2 GLU 22 1.279 -5.880 7.515 202 HG3 GLU 22 HG3 GLU 22 0.627 -4.293 7.141 203 H ARG 23 H ARG 23 4.104 -2.533 5.155 204 HA ARG 23 HA ARG 23 6.411 -3.923 4.240 205 HB2 ARG 23 HB2 ARG 23 7.068 -1.916 3.053 206 HB3 ARG 23 HB3 ARG 23 5.392 -2.371 2.805 207 HG2 ARG 23 HG2 ARG 23 5.118 -0.121 2.999 208 HG3 ARG 23 HG3 ARG 23 4.895 -0.582 4.691 209 HD2 ARG 23 HD2 ARG 23 6.362 1.368 4.478 210 HD3 ARG 23 HD3 ARG 23 7.236 0.001 5.164 211 HE ARG 23 HE ARG 23 7.430 0.273 2.227 212 HH11 ARG 23 HH11 ARG 23 9.100 0.737 5.350 213 HH12 ARG 23 HH12 ARG 23 10.584 1.150 4.623 214 HH21 ARG 23 HH21 ARG 23 9.532 0.800 1.267 215 HH22 ARG 23 HH22 ARG 23 10.770 1.369 2.322 216 H ILE 24 H ILE 24 6.150 -1.622 6.954 217 HA ILE 24 HA ILE 24 9.008 -1.431 7.271 218 HB ILE 24 HB ILE 24 7.560 0.242 8.246 219 HG12 ILE 24 HG12 ILE 24 9.015 -1.387 10.402 220 HG13 ILE 24 HG13 ILE 24 9.705 -0.102 9.418 221 HG21 ILE 24 HG21 ILE 24 5.940 -0.092 9.917 222 HG22 ILE 24 HG22 ILE 24 5.696 -1.418 8.805 223 HG23 ILE 24 HG23 ILE 24 6.542 -1.716 10.324 224 HD11 ILE 24 HD11 ILE 24 8.201 1.526 10.522 225 HD12 ILE 24 HD12 ILE 24 7.491 0.199 11.483 226 HD13 ILE 24 HD13 ILE 24 9.194 0.633 11.702 227 H GLN 25 H GLN 25 6.526 -3.618 8.727 228 HA GLN 25 HA GLN 25 8.479 -4.877 10.418 229 HB2 GLN 25 HB2 GLN 25 5.988 -4.729 10.842 230 HB3 GLN 25 HB3 GLN 25 5.742 -5.896 9.539 231 HG2 GLN 25 HG2 GLN 25 7.448 -7.381 10.971 232 HG3 GLN 25 HG3 GLN 25 7.027 -6.264 12.249 233 HE21 GLN 25 HE21 GLN 25 5.781 -8.631 9.936 234 HE22 GLN 25 HE22 GLN 25 4.431 -9.171 10.872 235 H ASN 26 H ASN 26 6.828 -5.873 7.371 236 HA ASN 26 HA ASN 26 8.118 -8.479 7.250 237 HB2 ASN 26 HB2 ASN 26 6.607 -6.809 5.159 238 HB3 ASN 26 HB3 ASN 26 7.248 -8.390 4.834 239 HD21 ASN 26 HD21 ASN 26 4.891 -6.659 6.879 240 HD22 ASN 26 HD22 ASN 26 3.877 -8.057 7.165 241 H SER 27 H SER 27 8.422 -5.481 5.411 242 HA SER 27 HA SER 27 9.940 -4.542 4.113 243 HB2 SER 27 HB2 SER 27 11.111 -4.549 6.378 244 HB3 SER 27 HB3 SER 27 12.098 -5.890 5.760 245 HG SER 27 HG SER 27 11.896 -3.226 4.806 246 H LEU 28 H LEU 28 9.732 -7.707 4.050 247 HA LEU 28 HA LEU 28 11.521 -8.317 1.804 248 HB2 LEU 28 HB2 LEU 28 10.818 -10.646 2.223 249 HB3 LEU 28 HB3 LEU 28 11.413 -9.838 3.670 250 HG LEU 28 HG LEU 28 9.022 -9.452 4.386 251 HD11 LEU 28 HD11 LEU 28 7.702 -9.780 2.461 252 HD12 LEU 28 HD12 LEU 28 7.348 -11.096 3.541 253 HD13 LEU 28 HD13 LEU 28 8.426 -11.373 2.133 254 HD21 LEU 28 HD21 LEU 28 8.799 -11.775 5.256 255 HD22 LEU 28 HD22 LEU 28 10.378 -11.027 5.487 256 HD23 LEU 28 HD23 LEU 28 10.178 -12.229 4.217 257 H SER 29 H SER 29 10.479 -9.909 0.263 258 HA SER 29 HA SER 29 7.904 -8.826 -0.823 259 HB2 SER 29 HB2 SER 29 10.348 -9.946 -2.232 260 HB3 SER 29 HB3 SER 29 8.864 -9.388 -3.028 261 HG SER 29 HG SER 29 9.394 -7.307 -2.501 262 H THR 30 H THR 30 10.093 -11.635 -1.189 263 HA THR 30 HA THR 30 7.884 -13.496 -0.612 264 HB THR 30 HB THR 30 8.038 -13.015 -3.006 265 HG1 THR 30 HG1 THR 30 7.567 -14.888 -3.500 266 HG21 THR 30 HG21 THR 30 10.376 -12.492 -3.280 267 HG22 THR 30 HG22 THR 30 9.953 -13.858 -4.325 268 HG23 THR 30 HG23 THR 30 10.851 -14.141 -2.819 269 H GLU 31 H GLU 31 9.853 -12.563 1.147 270 HA GLU 31 HA GLU 31 11.424 -13.213 2.656 271 HB2 GLU 31 HB2 GLU 31 10.712 -16.053 1.894 272 HB3 GLU 31 HB3 GLU 31 11.375 -15.482 3.430 273 HG2 GLU 31 HG2 GLU 31 9.288 -14.181 3.835 274 HG3 GLU 31 HG3 GLU 31 8.605 -14.782 2.326 275 H LYS 32 H LYS 32 12.160 -12.773 -0.088 276 HA LYS 32 HA LYS 32 14.269 -14.440 -1.004 277 HB2 LYS 32 HB2 LYS 32 12.730 -12.918 -2.301 278 HB3 LYS 32 HB3 LYS 32 13.626 -11.530 -1.685 279 HG2 LYS 32 HG2 LYS 32 15.669 -12.300 -2.766 280 HG3 LYS 32 HG3 LYS 32 14.885 -13.818 -3.241 281 HD2 LYS 32 HD2 LYS 32 14.054 -11.052 -4.179 282 HD3 LYS 32 HD3 LYS 32 15.060 -12.163 -5.100 283 HE2 LYS 32 HE2 LYS 32 12.138 -12.488 -4.345 284 HE3 LYS 32 HE3 LYS 32 12.822 -12.310 -5.957 285 HZ1 LYS 32 HZ1 LYS 32 13.082 -14.663 -4.192 286 HZ2 LYS 32 HZ2 LYS 32 13.886 -14.470 -5.625 287 HZ3 LYS 32 HZ3 LYS 32 12.228 -14.545 -5.594 288 H TYR 33 H TYR 33 16.364 -14.506 -0.214 289 HA TYR 33 HA TYR 33 17.253 -12.585 1.773 290 HB2 TYR 33 HB2 TYR 33 19.348 -13.906 1.715 291 HB3 TYR 33 HB3 TYR 33 17.906 -14.853 2.023 292 HD1 TYR 33 HD1 TYR 33 17.101 -16.534 0.423 293 HD2 TYR 33 HD2 TYR 33 20.662 -14.232 -0.376 294 HE1 TYR 33 HE1 TYR 33 17.618 -18.006 -1.496 295 HE2 TYR 33 HE2 TYR 33 21.205 -15.705 -2.262 296 HH TYR 33 HH TYR 33 20.536 -17.508 -3.529 297 H GLY 34 H GLY 34 17.831 -13.168 -1.706 298 HA2 GLY 34 HA2 GLY 34 18.523 -11.640 -3.309 299 HA3 GLY 34 HA3 GLY 34 18.851 -10.430 -2.048 300 H SER 35 H SER 35 20.952 -10.276 -1.185 301 HA SER 35 HA SER 35 22.860 -12.316 -1.092 302 HB2 SER 35 HB2 SER 35 24.430 -11.315 -2.887 303 HB3 SER 35 HB3 SER 35 23.092 -12.318 -3.429 304 HG SER 35 HG SER 35 23.274 -9.482 -3.446 305 H GLY 36 H GLY 36 25.162 -11.193 -0.801 306 HA2 GLY 36 HA2 GLY 36 25.461 -8.501 -0.167 307 HA3 GLY 36 HA3 GLY 36 24.878 -9.272 1.313 308 H SER 37 H SER 37 27.414 -9.691 -1.289 309 HA SER 37 HA SER 37 29.445 -10.077 0.724 310 HB2 SER 37 HB2 SER 37 30.142 -12.294 -0.082 311 HB3 SER 37 HB3 SER 37 28.496 -12.352 0.559 312 HG SER 37 HG SER 37 28.315 -13.390 -1.281 313 H GLY 38 H GLY 38 31.562 -10.658 -0.624 314 HA2 GLY 38 HA2 GLY 38 31.715 -8.721 -2.897 315 HA3 GLY 38 HA3 GLY 38 33.053 -9.181 -1.827 316 H SER 39 H SER 39 33.547 -11.648 -1.806 317 HA SER 39 HA SER 39 33.967 -12.539 -4.524 318 HB2 SER 39 HB2 SER 39 34.565 -13.908 -1.865 319 HB3 SER 39 HB3 SER 39 35.306 -14.257 -3.437 320 HG SER 39 HG SER 39 36.290 -12.241 -3.375 321 H GLY 40 H GLY 40 31.510 -12.568 -4.904 322 HA2 GLY 40 HA2 GLY 40 30.552 -15.241 -5.000 323 HA3 GLY 40 HA3 GLY 40 29.708 -14.318 -3.726 324 H SER 41 H SER 41 27.783 -14.663 -5.312 325 HA SER 41 HA SER 41 27.495 -12.273 -6.925 326 HB2 SER 41 HB2 SER 41 27.339 -15.024 -8.248 327 HB3 SER 41 HB3 SER 41 26.843 -13.489 -8.984 328 HG SER 41 HG SER 41 29.330 -13.221 -8.029 329 H GLY 42 H GLY 42 25.369 -11.740 -7.216 330 HA2 GLY 42 HA2 GLY 42 23.086 -13.379 -6.918 331 HA3 GLY 42 HA3 GLY 42 23.416 -12.456 -5.435 332 H SER 43 H SER 43 21.136 -11.605 -6.556 333 HA SER 43 HA SER 43 21.705 -8.954 -7.475 334 HB2 SER 43 HB2 SER 43 20.587 -9.146 -9.674 335 HB3 SER 43 HB3 SER 43 22.032 -10.149 -9.617 336 HG SER 43 HG SER 43 20.466 -11.367 -10.487 337 H GLY 44 H GLY 44 19.136 -8.315 -8.497 338 HA2 GLY 44 HA2 GLY 44 17.051 -9.443 -6.867 339 HA3 GLY 44 HA3 GLY 44 17.570 -7.819 -6.351 340 H SER 45 H SER 45 15.089 -7.965 -7.156 341 HA SER 45 HA SER 45 14.919 -6.288 -9.527 342 HB2 SER 45 HB2 SER 45 13.633 -9.062 -9.399 343 HB3 SER 45 HB3 SER 45 12.982 -7.748 -10.389 344 HG SER 45 HG SER 45 14.249 -8.982 -11.662 345 H GLY 46 H GLY 46 13.514 -4.703 -8.788 346 HA2 GLY 46 HA2 GLY 46 12.004 -5.142 -6.322 347 HA3 GLY 46 HA3 GLY 46 12.103 -3.660 -7.291 348 H SER 47 H SER 47 11.365 -4.669 -9.778 349 HA SER 47 HA SER 47 9.548 -4.744 -11.076 350 HB2 SER 47 HB2 SER 47 10.287 -7.150 -10.444 351 HB3 SER 47 HB3 SER 47 8.762 -7.247 -9.559 352 HG SER 47 HG SER 47 8.906 -6.417 -12.288 353 H GLY 48 H GLY 48 8.985 -2.840 -9.194 354 HA2 GLY 48 HA2 GLY 48 6.031 -3.052 -8.978 355 HA3 GLY 48 HA3 GLY 48 6.974 -2.664 -7.535 356 H SER 49 H SER 49 5.553 -1.417 -10.404 357 HA SER 49 HA SER 49 6.820 1.257 -10.001 358 HB2 SER 49 HB2 SER 49 7.735 0.209 -12.006 359 HB3 SER 49 HB3 SER 49 6.113 -0.189 -12.581 360 HG SER 49 HG SER 49 6.085 1.626 -13.494 361 H GLY 50 H GLY 50 4.039 -0.217 -11.790 362 HA2 GLY 50 HA2 GLY 50 1.787 0.061 -11.541 363 HA3 GLY 50 HA3 GLY 50 2.059 1.103 -10.135 364 H SER 51 H SER 51 0.110 1.963 -11.706 365 HA SER 51 HA SER 51 1.214 4.322 -13.125 366 HB2 SER 51 HB2 SER 51 -0.920 3.914 -14.645 367 HB3 SER 51 HB3 SER 51 0.633 3.163 -14.993 368 HG SER 51 HG SER 51 -1.633 1.997 -13.753 369 H GLY 52 H GLY 52 -0.615 6.032 -13.379 370 HA2 GLY 52 HA2 GLY 52 -2.844 6.564 -12.320 371 HA3 GLY 52 HA3 GLY 52 -2.066 6.107 -10.791 372 H SER 53 H SER 53 -2.506 8.076 -9.965 373 HA SER 53 HA SER 53 -0.574 10.251 -10.535 374 HB2 SER 53 HB2 SER 53 -2.683 11.751 -9.892 375 HB3 SER 53 HB3 SER 53 -2.315 11.305 -11.562 376 HG SER 53 HG SER 53 -4.121 9.880 -9.874 377 H GLY 54 H GLY 54 0.583 9.561 -8.714 378 HA2 GLY 54 HA2 GLY 54 -0.513 8.724 -6.277 379 HA3 GLY 54 HA3 GLY 54 1.111 9.380 -6.508 380 H SER 55 H SER 55 -0.287 9.735 -4.223 381 HA SER 55 HA SER 55 -0.782 12.658 -4.062 382 HB2 SER 55 HB2 SER 55 -2.901 11.335 -4.063 383 HB3 SER 55 HB3 SER 55 -2.310 10.411 -2.668 384 HG SER 55 HG SER 55 -3.168 11.894 -1.519 385 H GLY 56 H GLY 56 -0.796 13.100 -1.529 386 HA2 GLY 56 HA2 GLY 56 1.710 11.979 -0.343 387 HA3 GLY 56 HA3 GLY 56 1.119 13.642 -0.139 388 H SER 57 H SER 57 1.611 12.542 2.159 389 HA SER 57 HA SER 57 -1.034 12.064 3.374 390 HB2 SER 57 HB2 SER 57 1.348 10.235 3.858 391 HB3 SER 57 HB3 SER 57 -0.246 10.086 4.600 392 HG SER 57 HG SER 57 -0.163 8.599 3.058 393 H GLY 58 H GLY 58 -0.683 11.971 5.858 394 HA2 GLY 58 HA2 GLY 58 1.648 13.640 6.746 395 HA3 GLY 58 HA3 GLY 58 -0.002 14.066 7.184 396 H TYR 59 H TYR 59 -0.528 10.957 7.397 397 HA TYR 59 HA TYR 59 0.271 10.791 10.220 398 HB2 TYR 59 HB2 TYR 59 -1.589 9.169 8.470 399 HB3 TYR 59 HB3 TYR 59 -1.241 8.765 10.142 400 HD1 TYR 59 HD1 TYR 59 -1.365 10.982 11.801 401 HD2 TYR 59 HD2 TYR 59 -3.656 10.328 8.199 402 HE1 TYR 59 HE1 TYR 59 -3.229 12.294 12.754 403 HE2 TYR 59 HE2 TYR 59 -5.478 11.680 9.127 404 HH TYR 59 HH TYR 59 -6.117 13.108 10.849 405 H GLN3288 H GLN3288 2.071 10.002 7.543 406 HA GLN3288 HA GLN3288 3.343 7.723 8.846 407 HB2 GLN3288 HB2 GLN3288 3.485 6.716 6.631 408 HB3 GLN3288 HB3 GLN3288 1.815 7.087 7.038 409 HG2 GLN3288 HG2 GLN3288 2.083 9.222 5.681 410 HG3 GLN3288 HG3 GLN3288 3.570 8.518 5.041 411 HE21 GLN3288 HE21 GLN3288 3.223 7.405 3.132 412 HE22 GLN3288 HE22 GLN3288 1.663 6.757 2.605 413 H ILE3289 H ILE3289 5.614 7.607 7.269 414 HA ILE3289 HA ILE3289 6.805 10.279 7.732 415 HB ILE3289 HB ILE3289 8.222 7.605 7.566 416 HG12 ILE3289 HG12 ILE3289 7.472 9.284 10.012 417 HG13 ILE3289 HG13 ILE3289 6.758 7.729 9.577 418 HG21 ILE3289 HG21 ILE3289 9.152 10.389 8.450 419 HG22 ILE3289 HG22 ILE3289 10.145 8.916 8.408 420 HG23 ILE3289 HG23 ILE3289 9.571 9.604 6.909 421 HD11 ILE3289 HD11 ILE3289 8.991 6.652 9.797 422 HD12 ILE3289 HD12 ILE3289 9.634 8.187 10.432 423 HD13 ILE3289 HD13 ILE3289 8.369 7.326 11.305 424 H GLU3290 H GLU3290 6.220 11.266 5.892 425 HA GLU3290 HA GLU3290 6.287 10.373 3.262 426 HB2 GLU3290 HB2 GLU3290 5.406 12.605 4.507 427 HB3 GLU3290 HB3 GLU3290 6.951 13.222 3.991 428 HG2 GLU3290 HG2 GLU3290 5.716 13.782 2.174 429 HG3 GLU3290 HG3 GLU3290 6.260 12.193 1.636 430 H THR3291 H THR3291 8.922 10.869 5.193 431 HA THR3291 HA THR3291 10.813 11.249 2.923 432 HB THR3291 HB THR3291 10.442 13.258 4.304 433 HG1 THR3291 HG1 THR3291 12.355 13.089 3.310 434 HG21 THR3291 HG21 THR3291 10.011 12.213 6.497 435 HG22 THR3291 HG22 THR3291 11.271 13.450 6.563 436 HG23 THR3291 HG23 THR3291 11.726 11.738 6.598 437 H PHE3292 H PHE3292 9.859 8.688 3.998 438 HA PHE3292 HA PHE3292 12.566 7.589 4.565 439 HB2 PHE3292 HB2 PHE3292 11.505 8.045 6.714 440 HB3 PHE3292 HB3 PHE3292 10.088 7.115 6.234 441 HD1 PHE3292 HD1 PHE3292 13.609 5.911 5.602 442 HD2 PHE3292 HD2 PHE3292 10.132 5.707 8.157 443 HE1 PHE3292 HE1 PHE3292 14.577 3.992 6.786 444 HE2 PHE3292 HE2 PHE3292 11.129 3.781 9.356 445 HZ PHE3292 HZ PHE3292 13.358 2.932 8.697 446 H PHE3293 H PHE3293 9.140 6.797 3.862 447 HA PHE3293 HA PHE3293 10.141 4.629 2.064 448 HB2 PHE3293 HB2 PHE3293 7.998 3.382 2.894 449 HB3 PHE3293 HB3 PHE3293 9.494 3.346 3.768 450 HD1 PHE3293 HD1 PHE3293 9.301 3.445 6.082 451 HD2 PHE3293 HD2 PHE3293 6.496 5.668 3.669 452 HE1 PHE3293 HE1 PHE3293 8.169 4.229 8.119 453 HE2 PHE3293 HE2 PHE3293 5.431 6.502 5.675 454 HZ PHE3293 HZ PHE3293 6.199 5.668 7.988 455 H ALA3294 H ALA3294 8.605 7.510 2.089 456 HA ALA3294 HA ALA3294 6.210 7.262 0.783 457 HB1 ALA3294 HB1 ALA3294 8.406 9.282 0.302 458 HB2 ALA3294 HB2 ALA3294 6.690 9.455 -0.169 459 HB3 ALA3294 HB3 ALA3294 7.124 9.344 1.538 460 H GLN3295 H GLN3295 9.423 6.850 -0.557 461 HA GLN3295 HA GLN3295 8.895 6.969 -3.323 462 HB2 GLN3295 HB2 GLN3295 10.897 5.163 -1.928 463 HB3 GLN3295 HB3 GLN3295 10.989 5.766 -3.577 464 HG2 GLN3295 HG2 GLN3295 11.159 7.547 -1.105 465 HG3 GLN3295 HG3 GLN3295 12.532 6.883 -1.964 466 HE21 GLN3295 HE21 GLN3295 10.274 9.548 -1.965 467 HE22 GLN3295 HE22 GLN3295 10.865 10.216 -3.469 468 H ASP3296 H ASP3296 8.771 4.099 -1.135 469 HA ASP3296 HA ASP3296 7.817 2.333 -3.298 470 HB2 ASP3296 HB2 ASP3296 8.091 1.998 -0.270 471 HB3 ASP3296 HB3 ASP3296 7.380 0.783 -1.326 472 H ILE3297 H ILE3297 6.547 4.295 -0.748 473 HA ILE3297 HA ILE3297 4.013 3.081 -0.353 474 HB ILE3297 HB ILE3297 5.474 5.371 0.585 475 HG12 ILE3297 HG12 ILE3297 4.119 5.185 2.567 476 HG13 ILE3297 HG13 ILE3297 2.986 4.116 1.743 477 HG21 ILE3297 HG21 ILE3297 4.110 6.886 -0.618 478 HG22 ILE3297 HG22 ILE3297 2.637 6.040 -0.145 479 HG23 ILE3297 HG23 ILE3297 3.578 6.923 1.060 480 HD11 ILE3297 HD11 ILE3297 4.662 2.979 3.279 481 HD12 ILE3297 HD12 ILE3297 4.675 2.356 1.619 482 HD13 ILE3297 HD13 ILE3297 5.932 3.483 2.157 483 H GLU3298 H GLU3298 5.148 5.681 -2.542 484 HA GLU3298 HA GLU3298 2.554 6.260 -3.536 485 HB2 GLU3298 HB2 GLU3298 3.657 7.340 -5.382 486 HB3 GLU3298 HB3 GLU3298 4.245 7.848 -3.799 487 HG2 GLU3298 HG2 GLU3298 6.341 6.979 -4.109 488 HG3 GLU3298 HG3 GLU3298 5.809 5.671 -5.145 489 H SER3299 H SER3299 4.912 3.773 -4.339 490 HA SER3299 HA SER3299 3.613 2.957 -6.771 491 HB2 SER3299 HB2 SER3299 6.023 2.523 -6.105 492 HB3 SER3299 HB3 SER3299 5.420 1.231 -5.052 493 HG SER3299 HG SER3299 5.192 1.525 -7.871 494 H VAL3300 H VAL3300 3.327 1.758 -3.353 495 HA VAL3300 HA VAL3300 1.382 -0.235 -4.223 496 HB VAL3300 HB VAL3300 2.869 -0.654 -2.340 497 HG11 VAL3300 HG11 VAL3300 1.200 1.351 -0.762 498 HG12 VAL3300 HG12 VAL3300 2.451 0.264 -0.123 499 HG13 VAL3300 HG13 VAL3300 2.901 1.531 -1.264 500 HG21 VAL3300 HG21 VAL3300 -0.104 -0.777 -1.702 501 HG22 VAL3300 HG22 VAL3300 0.849 -1.969 -2.597 502 HG23 VAL3300 HG23 VAL3300 1.176 -1.709 -0.881 503 H GLN3301 H GLN3301 1.124 3.062 -2.719 504 HA GLN3301 HA GLN3301 -1.718 2.885 -2.445 505 HB2 GLN3301 HB2 GLN3301 -1.793 5.212 -2.029 506 HB3 GLN3301 HB3 GLN3301 -0.386 4.525 -1.240 507 HG2 GLN3301 HG2 GLN3301 0.705 6.280 -2.120 508 HG3 GLN3301 HG3 GLN3301 0.742 5.268 -3.561 509 HE21 GLN3301 HE21 GLN3301 -2.196 5.789 -4.237 510 HE22 GLN3301 HE22 GLN3301 -1.966 7.234 -5.156 511 H LYS3302 H LYS3302 0.363 3.560 -5.234 512 HA LYS3302 HA LYS3302 -1.533 4.731 -6.960 513 HB2 LYS3302 HB2 LYS3302 1.046 3.291 -7.296 514 HB3 LYS3302 HB3 LYS3302 -0.013 3.344 -8.698 515 HG2 LYS3302 HG2 LYS3302 -0.092 5.722 -8.741 516 HG3 LYS3302 HG3 LYS3302 0.598 5.870 -7.119 517 HD2 LYS3302 HD2 LYS3302 2.212 6.435 -8.906 518 HD3 LYS3302 HD3 LYS3302 2.763 5.096 -7.882 519 HE2 LYS3302 HE2 LYS3302 2.312 3.462 -9.519 520 HE3 LYS3302 HE3 LYS3302 1.307 4.574 -10.474 521 HZ1 LYS3302 HZ1 LYS3302 3.531 4.165 -11.394 522 HZ2 LYS3302 HZ2 LYS3302 4.206 4.915 -10.095 523 HZ3 LYS3302 HZ3 LYS3302 3.202 5.758 -11.123 524 H GLU3303 H GLU3303 -1.190 1.469 -5.797 525 HA GLU3303 HA GLU3303 -2.862 0.246 -7.880 526 HB2 GLU3303 HB2 GLU3303 -2.148 -1.687 -7.055 527 HB3 GLU3303 HB3 GLU3303 -0.989 -0.743 -6.147 528 HG2 GLU3303 HG2 GLU3303 -2.717 -0.745 -4.247 529 HG3 GLU3303 HG3 GLU3303 -3.620 -1.914 -5.187 530 H LEU3304 H LEU3304 -3.290 1.177 -4.444 531 HA LEU3304 HA LEU3304 -5.984 0.627 -4.213 532 HB2 LEU3304 HB2 LEU3304 -4.341 2.756 -2.815 533 HB3 LEU3304 HB3 LEU3304 -5.825 2.050 -2.247 534 HG LEU3304 HG LEU3304 -3.147 0.658 -2.573 535 HD11 LEU3304 HD11 LEU3304 -4.698 1.406 -0.100 536 HD12 LEU3304 HD12 LEU3304 -3.279 2.222 -0.788 537 HD13 LEU3304 HD13 LEU3304 -3.119 0.568 -0.160 538 HD21 LEU3304 HD21 LEU3304 -4.936 -0.993 -2.997 539 HD22 LEU3304 HD22 LEU3304 -5.676 -0.579 -1.425 540 HD23 LEU3304 HD23 LEU3304 -4.067 -1.324 -1.515 541 H GLU3305 H GLU3305 -4.505 3.589 -5.455 542 HA GLU3305 HA GLU3305 -6.837 5.210 -5.143 543 HB2 GLU3305 HB2 GLU3305 -5.769 6.771 -6.750 544 HB3 GLU3305 HB3 GLU3305 -4.766 6.331 -5.356 545 HG2 GLU3305 HG2 GLU3305 -3.588 4.712 -6.606 546 HG3 GLU3305 HG3 GLU3305 -4.625 4.887 -8.016 547 H ASN3306 H ASN3306 -6.282 2.649 -7.322 548 HA ASN3306 HA ASN3306 -8.623 3.547 -8.893 549 HB2 ASN3306 HB2 ASN3306 -7.871 2.750 -10.888 550 HB3 ASN3306 HB3 ASN3306 -6.522 3.646 -10.193 551 HD21 ASN3306 HD21 ASN3306 -4.660 2.362 -9.229 552 HD22 ASN3306 HD22 ASN3306 -4.360 0.861 -10.079 553 H LEU3307 H LEU3307 -8.003 1.622 -6.415 554 HA LEU3307 HA LEU3307 -9.351 -0.792 -7.526 555 HB2 LEU3307 HB2 LEU3307 -7.805 -0.178 -5.083 556 HB3 LEU3307 HB3 LEU3307 -9.261 -1.085 -4.784 557 HG LEU3307 HG LEU3307 -8.069 -2.890 -5.053 558 HD11 LEU3307 HD11 LEU3307 -7.731 -2.323 -8.019 559 HD12 LEU3307 HD12 LEU3307 -9.222 -2.954 -7.316 560 HD13 LEU3307 HD13 LEU3307 -7.748 -3.899 -7.209 561 HD21 LEU3307 HD21 LEU3307 -5.941 -1.543 -6.671 562 HD22 LEU3307 HD22 LEU3307 -5.851 -3.079 -5.807 563 HD23 LEU3307 HD23 LEU3307 -6.006 -1.591 -4.887 564 H SER3308 H SER3308 -11.286 -1.592 -6.585 565 HA SER3308 HA SER3308 -13.297 0.509 -6.064 566 HB2 SER3308 HB2 SER3308 -13.354 -2.435 -6.802 567 HB3 SER3308 HB3 SER3308 -14.805 -1.527 -6.373 568 HG SER3308 HG SER3308 -13.209 -0.245 -8.244 569 H GLU3309 H GLU3309 -15.079 -0.051 -4.361 570 HA GLU3309 HA GLU3309 -13.873 -0.135 -1.822 571 HB2 GLU3309 HB2 GLU3309 -16.659 -0.281 -2.986 572 HB3 GLU3309 HB3 GLU3309 -16.488 -1.108 -1.430 573 HG2 GLU3309 HG2 GLU3309 -15.872 0.759 -0.281 574 HG3 GLU3309 HG3 GLU3309 -15.566 1.716 -1.741 575 H GLU3310 H GLU3310 -15.604 -2.753 -3.554 576 HA GLU3310 HA GLU3310 -15.435 -4.780 -1.758 577 HB2 GLU3310 HB2 GLU3310 -14.941 -4.840 -4.761 578 HB3 GLU3310 HB3 GLU3310 -15.306 -6.282 -3.823 579 HG2 GLU3310 HG2 GLU3310 -17.200 -3.881 -3.872 580 HG3 GLU3310 HG3 GLU3310 -17.222 -5.128 -5.112 581 H GLU3311 H GLU3311 -12.732 -3.368 -3.493 582 HA GLU3311 HA GLU3311 -10.960 -5.678 -3.043 583 HB2 GLU3311 HB2 GLU3311 -10.410 -2.927 -4.163 584 HB3 GLU3311 HB3 GLU3311 -9.417 -4.355 -4.355 585 HG2 GLU3311 HG2 GLU3311 -12.257 -4.127 -5.485 586 HG3 GLU3311 HG3 GLU3311 -10.916 -3.621 -6.345 587 H LEU3312 H LEU3312 -11.232 -2.252 -2.216 588 HA LEU3312 HA LEU3312 -9.113 -2.237 -0.280 589 HB2 LEU3312 HB2 LEU3312 -11.235 -0.100 -0.504 590 HB3 LEU3312 HB3 LEU3312 -9.625 0.100 0.055 591 HG LEU3312 HG LEU3312 -10.058 -0.769 -2.810 592 HD11 LEU3312 HD11 LEU3312 -10.423 2.028 -1.763 593 HD12 LEU3312 HD12 LEU3312 -11.572 0.962 -2.638 594 HD13 LEU3312 HD13 LEU3312 -10.148 1.586 -3.469 595 HD21 LEU3312 HD21 LEU3312 -7.829 -0.906 -2.248 596 HD22 LEU3312 HD22 LEU3312 -7.844 0.596 -1.306 597 HD23 LEU3312 HD23 LEU3312 -7.985 0.664 -3.066 598 H LEU3313 H LEU3313 -12.603 -1.760 0.035 599 HA LEU3313 HA LEU3313 -12.875 -1.447 2.821 600 HB2 LEU3313 HB2 LEU3313 -14.581 -0.780 1.128 601 HB3 LEU3313 HB3 LEU3313 -14.783 -2.454 0.639 602 HG LEU3313 HG LEU3313 -16.606 -1.685 1.936 603 HD11 LEU3313 HD11 LEU3313 -15.897 -4.133 1.676 604 HD12 LEU3313 HD12 LEU3313 -17.099 -3.703 2.888 605 HD13 LEU3313 HD13 LEU3313 -15.440 -4.050 3.387 606 HD21 LEU3313 HD21 LEU3313 -15.476 -0.376 3.703 607 HD22 LEU3313 HD22 LEU3313 -14.863 -1.910 4.395 608 HD23 LEU3313 HD23 LEU3313 -16.610 -1.589 4.299 609 H ALA3314 H ALA3314 -12.734 -4.362 0.679 610 HA ALA3314 HA ALA3314 -13.352 -6.122 2.785 611 HB1 ALA3314 HB1 ALA3314 -12.280 -7.837 1.283 612 HB2 ALA3314 HB2 ALA3314 -13.469 -6.807 0.473 613 HB3 ALA3314 HB3 ALA3314 -11.734 -6.512 0.224 614 H MET3315 H MET3315 -10.257 -4.534 1.982 615 HA MET3315 HA MET3315 -8.621 -6.349 3.544 616 HB2 MET3315 HB2 MET3315 -7.752 -3.503 3.062 617 HB3 MET3315 HB3 MET3315 -6.797 -4.970 3.129 618 HG2 MET3315 HG2 MET3315 -8.546 -5.212 0.912 619 HG3 MET3315 HG3 MET3315 -7.969 -3.578 0.876 620 HE1 MET3315 HE1 MET3315 -7.481 -6.274 -1.129 621 HE2 MET3315 HE2 MET3315 -7.182 -4.597 -1.636 622 HE3 MET3315 HE3 MET3315 -5.899 -5.815 -1.772 623 H LEU3316 H LEU3316 -9.738 -2.989 4.074 624 HA LEU3316 HA LEU3316 -8.678 -2.775 6.747 625 HB2 LEU3316 HB2 LEU3316 -10.152 -0.791 6.930 626 HB3 LEU3316 HB3 LEU3316 -9.122 -0.801 5.503 627 HG LEU3316 HG LEU3316 -11.336 -1.878 4.391 628 HD11 LEU3316 HD11 LEU3316 -13.330 -0.495 5.272 629 HD12 LEU3316 HD12 LEU3316 -12.374 -0.164 6.718 630 HD13 LEU3316 HD13 LEU3316 -12.862 -1.813 6.338 631 HD21 LEU3316 HD21 LEU3316 -10.090 0.277 3.835 632 HD22 LEU3316 HD22 LEU3316 -11.298 1.088 4.885 633 HD23 LEU3316 HD23 LEU3316 -11.789 0.205 3.441 634 H ASN3317 H ASN3317 -11.809 -3.905 5.455 635 HA ASN3317 HA ASN3317 -12.992 -4.094 8.111 636 HB2 ASN3317 HB2 ASN3317 -14.140 -3.804 5.770 637 HB3 ASN3317 HB3 ASN3317 -13.925 -5.547 5.592 638 HD21 ASN3317 HD21 ASN3317 -15.658 -2.975 6.997 639 HD22 ASN3317 HD22 ASN3317 -16.868 -3.944 7.843 640 H GLY3318 H GLY3318 -11.241 -6.168 5.903 641 HA2 GLY3318 HA2 GLY3318 -10.193 -8.230 6.208 642 HA3 GLY3318 HA3 GLY3318 -10.645 -8.203 7.931 643 H ASP3319 H ASP3319 -12.340 -8.084 4.803 644 HA ASP3319 HA ASP3319 -14.766 -9.344 5.578 645 HB2 ASP3319 HB2 ASP3319 -14.457 -7.883 3.591 646 HB3 ASP3319 HB3 ASP3319 -13.524 -9.163 2.802 647 H GLN3320 H GLN3320 -14.859 -11.416 6.362 648 HA GLN3320 HA GLN3320 -13.681 -13.594 4.799 649 HB2 GLN3320 HB2 GLN3320 -11.927 -12.907 6.427 650 HB3 GLN3320 HB3 GLN3320 -13.085 -13.163 7.747 651 HG2 GLN3320 HG2 GLN3320 -13.287 -15.556 7.023 652 HG3 GLN3320 HG3 GLN3320 -12.001 -15.274 5.832 653 HE21 GLN3320 HE21 GLN3320 -12.143 -17.004 8.315 654 HE22 GLN3320 HE22 GLN3320 -10.804 -16.489 9.356 655 H GLN3321 H GLN3321 -15.799 -14.172 4.296 656 HA GLN3321 HA GLN3321 -17.448 -15.284 6.485 657 HB2 GLN3321 HB2 GLN3321 -18.463 -13.396 4.317 658 HB3 GLN3321 HB3 GLN3321 -19.490 -14.325 5.404 659 HG2 GLN3321 HG2 GLN3321 -17.526 -12.171 6.330 660 HG3 GLN3321 HG3 GLN3321 -19.205 -11.880 5.933 661 HE21 GLN3321 HE21 GLN3321 -17.108 -13.676 8.217 662 HE22 GLN3321 HE22 GLN3321 -18.281 -13.555 9.530
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