NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
637677 | 5zfo | 36171 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ASN 1 H ASN 1 1.808 0.001 0.855 2 HA ASN 1 HA ASN 1 1.696 0.776 -1.877 3 HB2 ASN 1 HB2 ASN 1 3.939 -0.419 -0.236 4 HB3 ASN 1 HB3 ASN 1 4.131 0.198 -1.874 5 HD21 ASN 1 HD21 ASN 1 5.073 0.987 0.934 6 HD22 ASN 1 HD22 ASN 1 4.793 2.691 0.983 7 H ARG 2 H ARG 2 0.010 -1.017 -2.264 8 HA ARG 2 HA ARG 2 0.651 -3.708 -2.421 9 HB2 ARG 2 HB2 ARG 2 -1.209 -1.992 -4.052 10 HB3 ARG 2 HB3 ARG 2 -1.061 -3.721 -4.337 11 HG2 ARG 2 HG2 ARG 2 -1.661 -2.674 -1.601 12 HG3 ARG 2 HG3 ARG 2 -2.940 -2.860 -2.802 13 HD2 ARG 2 HD2 ARG 2 -1.976 -5.254 -3.080 14 HD3 ARG 2 HD3 ARG 2 -1.235 -4.952 -1.509 15 HE ARG 2 HE ARG 2 -3.917 -4.300 -1.269 16 HH11 ARG 2 HH11 ARG 2 -2.000 -7.121 -1.965 17 HH12 ARG 2 HH12 ARG 2 -3.149 -8.229 -1.291 18 HH21 ARG 2 HH21 ARG 2 -5.438 -5.748 -0.378 19 HH22 ARG 2 HH22 ARG 2 -5.105 -7.447 -0.389 20 H LEU 3 H LEU 3 1.046 -5.021 -4.375 21 HA LEU 3 HA LEU 3 2.564 -3.670 -6.476 22 HB2 LEU 3 HB2 LEU 3 3.930 -4.700 -4.416 23 HB3 LEU 3 HB3 LEU 3 3.772 -6.150 -5.405 24 HG LEU 3 HG LEU 3 5.029 -3.555 -6.296 25 HD11 LEU 3 HD11 LEU 3 6.572 -6.066 -6.008 26 HD12 LEU 3 HD12 LEU 3 6.145 -5.201 -4.533 27 HD13 LEU 3 HD13 LEU 3 7.077 -4.390 -5.792 28 HD21 LEU 3 HD21 LEU 3 4.487 -4.398 -8.312 29 HD22 LEU 3 HD22 LEU 3 4.241 -6.028 -7.684 30 HD23 LEU 3 HD23 LEU 3 5.873 -5.450 -8.025 31 H CYS 4 H CYS 4 2.334 -4.582 -8.448 32 HA CYS 4 HA CYS 4 0.795 -7.091 -8.582 33 HB2 CYS 4 HB2 CYS 4 -0.502 -5.277 -9.476 34 HB3 CYS 4 HB3 CYS 4 0.853 -4.720 -10.454 35 H THR 5 H THR 5 2.194 -8.697 -8.947 36 HA THR 5 HA THR 5 3.523 -8.943 -11.416 37 HB THR 5 HB THR 5 5.083 -7.313 -10.350 38 HG1 THR 5 HG1 THR 5 6.825 -8.377 -11.145 39 HG21 THR 5 HG21 THR 5 5.961 -9.538 -8.539 40 HG22 THR 5 HG22 THR 5 4.722 -8.391 -8.030 41 HG23 THR 5 HG23 THR 5 6.336 -7.818 -8.448 42 H ASN 6 H ASN 6 4.587 -10.988 -11.667 43 HA ASN 6 HA ASN 6 3.940 -12.899 -9.519 44 HB2 ASN 6 HB2 ASN 6 2.611 -13.017 -11.724 45 HB3 ASN 6 HB3 ASN 6 4.099 -13.638 -12.434 46 HD21 ASN 6 HD21 ASN 6 2.191 -15.316 -12.694 47 HD22 ASN 6 HD22 ASN 6 2.225 -16.592 -11.530 48 H CYS 7 H CYS 7 5.390 -14.594 -9.126 49 HA CYS 7 HA CYS 7 8.113 -13.958 -9.335 50 HB2 CYS 7 HB2 CYS 7 7.365 -15.388 -7.558 51 HB3 CYS 7 HB3 CYS 7 6.723 -16.564 -8.700 52 H CYS 8 H CYS 8 6.116 -16.245 -11.170 53 HA CYS 8 HA CYS 8 8.133 -17.364 -12.741 54 HB2 CYS 8 HB2 CYS 8 5.642 -18.026 -12.517 55 HB3 CYS 8 HB3 CYS 8 5.364 -16.851 -13.797 56 H ALA 9 H ALA 9 5.949 -14.661 -13.537 57 HA ALA 9 HA ALA 9 7.673 -13.948 -15.786 58 HB1 ALA 9 HB1 ALA 9 5.447 -13.926 -16.459 59 HB2 ALA 9 HB2 ALA 9 4.901 -13.158 -14.967 60 HB3 ALA 9 HB3 ALA 9 5.800 -12.223 -16.163 61 H GLY 10 H GLY 10 8.597 -13.554 -13.057 62 HA2 GLY 10 HA2 GLY 10 8.405 -10.710 -12.540 63 HA3 GLY 10 HA3 GLY 10 9.326 -11.882 -11.610 64 H ARG 11 H ARG 11 11.301 -10.970 -11.523 65 HA ARG 11 HA ARG 11 12.657 -10.512 -14.092 66 HB2 ARG 11 HB2 ARG 11 12.982 -8.801 -11.621 67 HB3 ARG 11 HB3 ARG 11 13.819 -8.586 -13.152 68 HG2 ARG 11 HG2 ARG 11 10.894 -8.605 -13.347 69 HG3 ARG 11 HG3 ARG 11 11.573 -7.265 -12.420 70 HD2 ARG 11 HD2 ARG 11 12.873 -7.909 -15.000 71 HD3 ARG 11 HD3 ARG 11 11.262 -7.196 -15.077 72 HE ARG 11 HE ARG 11 13.691 -5.877 -14.360 73 HH11 ARG 11 HH11 ARG 11 10.251 -5.921 -13.822 74 HH12 ARG 11 HH12 ARG 11 10.166 -4.246 -13.387 75 HH21 ARG 11 HH21 ARG 11 13.592 -3.671 -13.790 76 HH22 ARG 11 HH22 ARG 11 12.067 -2.967 -13.370 77 H LYS 12 H LYS 12 14.467 -11.647 -14.300 78 HA LYS 12 HA LYS 12 15.383 -13.497 -12.465 79 HB2 LYS 12 HB2 LYS 12 15.949 -13.472 -14.884 80 HB3 LYS 12 HB3 LYS 12 17.036 -12.120 -14.590 81 HG2 LYS 12 HG2 LYS 12 17.412 -14.619 -13.021 82 HG3 LYS 12 HG3 LYS 12 17.927 -14.583 -14.709 83 HD2 LYS 12 HD2 LYS 12 18.789 -12.193 -13.377 84 HD3 LYS 12 HD3 LYS 12 19.309 -13.609 -12.461 85 HE2 LYS 12 HE2 LYS 12 19.918 -14.405 -14.963 86 HE3 LYS 12 HE3 LYS 12 20.129 -12.664 -15.133 87 HZ1 LYS 12 HZ1 LYS 12 21.560 -12.799 -13.092 88 HZ2 LYS 12 HZ2 LYS 12 22.201 -13.529 -14.477 89 HZ3 LYS 12 HZ3 LYS 12 21.521 -14.483 -13.255 90 H GLY 13 H GLY 13 16.508 -13.377 -10.633 91 HA2 GLY 13 HA2 GLY 13 18.329 -12.630 -9.305 92 HA3 GLY 13 HA3 GLY 13 18.356 -11.137 -10.231 93 H CYS 14 H CYS 14 15.454 -12.566 -8.866 94 HA CYS 14 HA CYS 14 15.450 -10.657 -6.665 95 HB2 CYS 14 HB2 CYS 14 13.481 -10.638 -8.940 96 HB3 CYS 14 HB3 CYS 14 13.028 -10.050 -7.343 97 H ASN 15 H ASN 15 13.073 -10.934 -5.583 98 HA ASN 15 HA ASN 15 12.353 -13.766 -5.540 99 HB2 ASN 15 HB2 ASN 15 13.975 -13.692 -3.790 100 HB3 ASN 15 HB3 ASN 15 13.312 -12.191 -3.151 101 HD21 ASN 15 HD21 ASN 15 11.893 -15.302 -4.098 102 HD22 ASN 15 HD22 ASN 15 11.082 -15.581 -2.598 103 H TYR 16 H TYR 16 10.249 -14.179 -4.908 104 HA TYR 16 HA TYR 16 8.593 -11.859 -4.192 105 HB2 TYR 16 HB2 TYR 16 7.868 -13.936 -6.269 106 HB3 TYR 16 HB3 TYR 16 6.848 -12.601 -5.743 107 HD1 TYR 16 HD1 TYR 16 7.139 -10.408 -6.625 108 HD2 TYR 16 HD2 TYR 16 9.939 -13.470 -7.567 109 HE1 TYR 16 HE1 TYR 16 8.115 -8.971 -8.366 110 HE2 TYR 16 HE2 TYR 16 10.924 -12.041 -9.310 111 HH TYR 16 HH TYR 16 9.938 -8.698 -9.720 112 H TYR 17 H TYR 17 7.278 -12.221 -2.525 113 HA TYR 17 HA TYR 17 6.727 -15.016 -1.769 114 HB2 TYR 17 HB2 TYR 17 7.148 -14.580 0.451 115 HB3 TYR 17 HB3 TYR 17 8.303 -13.485 -0.300 116 HD1 TYR 17 HD1 TYR 17 7.076 -11.107 -0.944 117 HD2 TYR 17 HD2 TYR 17 6.045 -13.702 2.265 118 HE1 TYR 17 HE1 TYR 17 6.066 -9.212 0.256 119 HE2 TYR 17 HE2 TYR 17 5.031 -11.815 3.474 120 HH TYR 17 HH TYR 17 4.345 -9.675 3.303 121 H SER 18 H SER 18 4.713 -15.417 -0.706 122 HA SER 18 HA SER 18 2.527 -14.085 -1.892 123 HB2 SER 18 HB2 SER 18 2.577 -16.484 -1.078 124 HB3 SER 18 HB3 SER 18 2.401 -15.851 0.559 125 HG SER 18 HG SER 18 0.349 -15.830 0.145 126 H ALA 19 H ALA 19 0.600 -13.634 -0.111 127 HA ALA 19 HA ALA 19 1.458 -11.175 1.141 128 HB1 ALA 19 HB1 ALA 19 -1.183 -12.471 0.622 129 HB2 ALA 19 HB2 ALA 19 -1.064 -11.151 1.786 130 HB3 ALA 19 HB3 ALA 19 -0.586 -10.892 0.109 131 H ASP 20 H ASP 20 0.032 -14.253 2.196 132 HA ASP 20 HA ASP 20 -0.108 -13.645 4.934 133 HB2 ASP 20 HB2 ASP 20 -0.103 -16.161 3.326 134 HB3 ASP 20 HB3 ASP 20 0.125 -16.282 5.068 135 H GLY 21 H GLY 21 2.565 -14.354 2.916 136 HA2 GLY 21 HA2 GLY 21 4.760 -13.766 3.831 137 HA3 GLY 21 HA3 GLY 21 4.280 -14.584 5.311 138 H THR 22 H THR 22 3.406 -16.036 2.309 139 HA THR 22 HA THR 22 5.325 -18.189 2.832 140 HB THR 22 HB THR 22 2.865 -18.161 1.072 141 HG1 THR 22 HG1 THR 22 1.861 -18.915 2.784 142 HG21 THR 22 HG21 THR 22 4.042 -19.812 0.037 143 HG22 THR 22 HG22 THR 22 3.413 -20.761 1.384 144 HG23 THR 22 HG23 THR 22 5.056 -20.122 1.446 145 H PHE 23 H PHE 23 7.205 -17.814 1.818 146 HA PHE 23 HA PHE 23 7.651 -16.291 -0.443 147 HB2 PHE 23 HB2 PHE 23 9.795 -17.467 -0.644 148 HB3 PHE 23 HB3 PHE 23 9.448 -17.071 1.036 149 HD1 PHE 23 HD1 PHE 23 8.744 -18.842 2.603 150 HD2 PHE 23 HD2 PHE 23 9.990 -19.716 -1.372 151 HE1 PHE 23 HE1 PHE 23 9.064 -21.201 3.225 152 HE2 PHE 23 HE2 PHE 23 10.310 -22.076 -0.757 153 HZ PHE 23 HZ PHE 23 9.846 -22.822 1.544 154 H ILE 24 H ILE 24 7.506 -16.592 -2.594 155 HA ILE 24 HA ILE 24 6.147 -18.989 -3.522 156 HB ILE 24 HB ILE 24 6.938 -16.607 -5.189 157 HG12 ILE 24 HG12 ILE 24 5.626 -15.844 -3.251 158 HG13 ILE 24 HG13 ILE 24 4.710 -15.690 -4.747 159 HG21 ILE 24 HG21 ILE 24 6.017 -17.766 -6.840 160 HG22 ILE 24 HG22 ILE 24 5.635 -19.082 -5.730 161 HG23 ILE 24 HG23 ILE 24 4.484 -17.767 -5.969 162 HD11 ILE 24 HD11 ILE 24 3.608 -17.866 -4.176 163 HD12 ILE 24 HD12 ILE 24 4.386 -17.759 -2.596 164 HD13 ILE 24 HD13 ILE 24 3.235 -16.521 -3.098 165 H CYS 25 H CYS 25 8.896 -17.069 -4.748 166 HA CYS 25 HA CYS 25 10.726 -19.175 -4.868 167 HB2 CYS 25 HB2 CYS 25 10.711 -19.422 -7.431 168 HB3 CYS 25 HB3 CYS 25 9.484 -20.292 -6.517 169 H GLU 26 H GLU 26 12.639 -18.638 -6.258 170 HA GLU 26 HA GLU 26 12.820 -15.798 -6.944 171 HB2 GLU 26 HB2 GLU 26 15.109 -15.790 -5.797 172 HB3 GLU 26 HB3 GLU 26 13.688 -15.707 -4.764 173 HG2 GLU 26 HG2 GLU 26 15.259 -17.217 -3.790 174 HG3 GLU 26 HG3 GLU 26 13.878 -18.142 -4.378 175 H GLY 27 H GLY 27 14.997 -15.335 -8.025 176 HA2 GLY 27 HA2 GLY 27 16.353 -15.710 -9.839 177 HA3 GLY 27 HA3 GLY 27 16.608 -17.303 -9.142 178 H GLU 28 H GLU 28 14.099 -15.523 -10.947 179 HA GLU 28 HA GLU 28 13.448 -18.014 -12.355 180 HB2 GLU 28 HB2 GLU 28 11.924 -15.633 -11.551 181 HB3 GLU 28 HB3 GLU 28 11.581 -16.192 -13.182 182 HG2 GLU 28 HG2 GLU 28 10.056 -17.146 -11.521 183 HG3 GLU 28 HG3 GLU 28 10.995 -18.379 -12.359 184 H SER 29 H SER 29 12.525 -17.390 -14.694 185 HA SER 29 HA SER 29 14.729 -16.845 -16.293 186 HB2 SER 29 HB2 SER 29 12.304 -17.842 -16.808 187 HB3 SER 29 HB3 SER 29 12.033 -16.198 -17.383 188 HG SER 29 HG SER 29 14.176 -17.871 -18.198 189 H ASP 30 H ASP 30 14.938 -15.057 -17.894 190 HA ASP 30 HA ASP 30 14.834 -12.528 -16.508 191 HB2 ASP 30 HB2 ASP 30 16.195 -13.619 -18.884 192 HB3 ASP 30 HB3 ASP 30 15.755 -11.917 -19.000 193 HA PRO 31 HA PRO 31 11.250 -10.781 -18.333 194 HB2 PRO 31 HB2 PRO 31 12.012 -8.212 -18.767 195 HB3 PRO 31 HB3 PRO 31 11.702 -8.862 -17.153 196 HG2 PRO 31 HG2 PRO 31 14.312 -8.455 -18.562 197 HG3 PRO 31 HG3 PRO 31 13.886 -8.112 -16.875 198 HD2 PRO 31 HD2 PRO 31 15.258 -10.327 -17.609 199 HD3 PRO 31 HD3 PRO 31 14.138 -10.311 -16.233 200 H ASN 32 H ASN 32 14.278 -10.282 -20.068 201 HA ASN 32 HA ASN 32 13.339 -9.272 -22.467 202 HB2 ASN 32 HB2 ASN 32 15.603 -11.235 -22.037 203 HB3 ASN 32 HB3 ASN 32 15.352 -10.278 -23.494 204 HD21 ASN 32 HD21 ASN 32 17.713 -10.034 -22.329 205 HD22 ASN 32 HD22 ASN 32 17.859 -8.527 -21.497 206 H ASN 33 H ASN 33 13.856 -12.702 -21.636 207 HA ASN 33 HA ASN 33 11.609 -13.433 -23.334 208 HB2 ASN 33 HB2 ASN 33 13.860 -13.460 -24.647 209 HB3 ASN 33 HB3 ASN 33 14.184 -14.927 -23.729 210 HD21 ASN 33 HD21 ASN 33 13.428 -14.135 -26.631 211 HD22 ASN 33 HD22 ASN 33 12.245 -15.322 -27.051 212 HA PRO 34 HA PRO 34 11.950 -15.827 -19.369 213 HB2 PRO 34 HB2 PRO 34 9.352 -15.477 -18.664 214 HB3 PRO 34 HB3 PRO 34 10.622 -14.317 -18.258 215 HG2 PRO 34 HG2 PRO 34 8.624 -14.236 -20.485 216 HG3 PRO 34 HG3 PRO 34 9.159 -12.928 -19.414 217 HD2 PRO 34 HD2 PRO 34 10.100 -13.222 -21.936 218 HD3 PRO 34 HD3 PRO 34 11.089 -12.561 -20.619 219 H LYS 35 H LYS 35 11.266 -17.919 -19.023 220 HA LYS 35 HA LYS 35 10.392 -19.408 -21.251 221 HB2 LYS 35 HB2 LYS 35 10.491 -20.170 -18.327 222 HB3 LYS 35 HB3 LYS 35 10.242 -21.301 -19.651 223 HG2 LYS 35 HG2 LYS 35 12.503 -20.221 -20.508 224 HG3 LYS 35 HG3 LYS 35 12.706 -19.899 -18.784 225 HD2 LYS 35 HD2 LYS 35 11.946 -22.623 -19.791 226 HD3 LYS 35 HD3 LYS 35 13.632 -22.105 -19.722 227 HE2 LYS 35 HE2 LYS 35 11.799 -21.945 -17.345 228 HE3 LYS 35 HE3 LYS 35 12.728 -23.395 -17.720 229 HZ1 LYS 35 HZ1 LYS 35 14.131 -22.293 -16.304 230 HZ2 LYS 35 HZ2 LYS 35 13.680 -20.756 -16.848 231 HZ3 LYS 35 HZ3 LYS 35 14.695 -21.723 -17.794 232 H ALA 36 H ALA 36 8.529 -21.179 -20.559 233 HA ALA 36 HA ALA 36 6.109 -19.950 -21.050 234 HB1 ALA 36 HB1 ALA 36 6.005 -22.429 -19.441 235 HB2 ALA 36 HB2 ALA 36 5.199 -22.022 -20.956 236 HB3 ALA 36 HB3 ALA 36 6.895 -22.503 -20.962 237 H CYS 37 H CYS 37 5.342 -18.328 -19.828 238 HA CYS 37 HA CYS 37 4.694 -18.927 -17.040 239 HB2 CYS 37 HB2 CYS 37 6.345 -16.609 -18.005 240 HB3 CYS 37 HB3 CYS 37 5.374 -16.470 -16.543 241 HA PRO 38 HA PRO 38 0.844 -17.017 -17.917 242 HB2 PRO 38 HB2 PRO 38 0.239 -15.848 -15.543 243 HB3 PRO 38 HB3 PRO 38 0.190 -17.598 -15.793 244 HG2 PRO 38 HG2 PRO 38 2.329 -15.923 -14.535 245 HG3 PRO 38 HG3 PRO 38 1.676 -17.485 -14.007 246 HD2 PRO 38 HD2 PRO 38 4.022 -17.264 -15.341 247 HD3 PRO 38 HD3 PRO 38 2.954 -18.672 -15.513 248 H ARG 39 H ARG 39 -0.337 -14.931 -17.932 249 HA ARG 39 HA ARG 39 1.536 -12.672 -18.195 250 HB2 ARG 39 HB2 ARG 39 -0.929 -13.415 -19.750 251 HB3 ARG 39 HB3 ARG 39 -0.316 -11.767 -19.747 252 HG2 ARG 39 HG2 ARG 39 1.225 -14.203 -20.618 253 HG3 ARG 39 HG3 ARG 39 0.452 -13.034 -21.690 254 HD2 ARG 39 HD2 ARG 39 2.781 -12.606 -19.837 255 HD3 ARG 39 HD3 ARG 39 2.742 -12.443 -21.592 256 HE ARG 39 HE ARG 39 0.928 -10.613 -20.705 257 HH11 ARG 39 HH11 ARG 39 4.290 -11.246 -20.060 258 HH12 ARG 39 HH12 ARG 39 4.673 -9.589 -19.729 259 HH21 ARG 39 HH21 ARG 39 1.419 -8.428 -20.271 260 HH22 ARG 39 HH22 ARG 39 3.039 -7.987 -19.848 261 H ASN 40 H ASN 40 -1.610 -13.708 -17.024 262 HA ASN 40 HA ASN 40 -2.718 -11.298 -16.252 263 HB2 ASN 40 HB2 ASN 40 -3.004 -14.114 -15.416 264 HB3 ASN 40 HB3 ASN 40 -3.518 -12.927 -14.221 265 HD21 ASN 40 HD21 ASN 40 -4.821 -14.882 -16.245 266 HD22 ASN 40 HD22 ASN 40 -6.095 -13.932 -16.923 267 H CYS 41 H CYS 41 -3.049 -10.667 -13.856 268 HA CYS 41 HA CYS 41 -0.407 -10.135 -12.770 269 HB2 CYS 41 HB2 CYS 41 -2.055 -8.305 -12.984 270 HB3 CYS 41 HB3 CYS 41 -3.120 -9.147 -11.863 271 H ASP 42 H ASP 42 0.284 -10.692 -10.714 272 HA ASP 42 HA ASP 42 -1.242 -12.866 -9.445 273 HB2 ASP 42 HB2 ASP 42 1.152 -13.228 -10.384 274 HB3 ASP 42 HB3 ASP 42 1.677 -12.347 -8.952 275 HA PRO 43 HA PRO 43 -1.606 -9.436 -6.425 276 HB2 PRO 43 HB2 PRO 43 -4.024 -10.242 -5.491 277 HB3 PRO 43 HB3 PRO 43 -3.837 -9.244 -6.938 278 HG2 PRO 43 HG2 PRO 43 -4.276 -12.197 -6.717 279 HG3 PRO 43 HG3 PRO 43 -5.021 -11.036 -7.831 280 HD2 PRO 43 HD2 PRO 43 -2.976 -12.652 -8.565 281 HD3 PRO 43 HD3 PRO 43 -3.196 -11.024 -9.239 282 H ASN 44 H ASN 44 -1.315 -12.803 -6.257 283 HA ASN 44 HA ASN 44 -1.706 -13.209 -3.477 284 HB2 ASN 44 HB2 ASN 44 -1.375 -14.872 -5.590 285 HB3 ASN 44 HB3 ASN 44 0.233 -14.953 -4.875 286 HD21 ASN 44 HD21 ASN 44 -3.120 -14.867 -3.704 287 HD22 ASN 44 HD22 ASN 44 -2.949 -16.194 -2.611 288 H ILE 45 H ILE 45 0.991 -12.133 -5.411 289 HA ILE 45 HA ILE 45 2.890 -12.384 -3.240 290 HB ILE 45 HB ILE 45 3.131 -11.200 -6.003 291 HG12 ILE 45 HG12 ILE 45 4.969 -13.271 -5.618 292 HG13 ILE 45 HG13 ILE 45 3.490 -13.840 -4.851 293 HG21 ILE 45 HG21 ILE 45 5.574 -11.084 -5.506 294 HG22 ILE 45 HG22 ILE 45 4.591 -9.934 -4.601 295 HG23 ILE 45 HG23 ILE 45 5.189 -11.394 -3.813 296 HD11 ILE 45 HD11 ILE 45 2.835 -12.684 -7.369 297 HD12 ILE 45 HD12 ILE 45 4.149 -13.842 -7.583 298 HD13 ILE 45 HD13 ILE 45 2.642 -14.350 -6.822 299 H ALA 46 H ALA 46 3.251 -10.897 -1.736 300 HA ALA 46 HA ALA 46 1.812 -8.445 -1.678 301 HB1 ALA 46 HB1 ALA 46 2.333 -8.467 0.486 302 HB2 ALA 46 HB2 ALA 46 3.107 -10.024 0.188 303 HB3 ALA 46 HB3 ALA 46 4.063 -8.542 0.146 304 H TYR 47 H TYR 47 5.293 -9.162 -1.966 305 HA TYR 47 HA TYR 47 5.698 -7.006 -3.798 306 HB2 TYR 47 HB2 TYR 47 7.318 -5.769 -2.324 307 HB3 TYR 47 HB3 TYR 47 5.630 -5.617 -1.849 308 HD1 TYR 47 HD1 TYR 47 8.634 -7.720 -1.128 309 HD2 TYR 47 HD2 TYR 47 5.075 -5.936 0.373 310 HE1 TYR 47 HE1 TYR 47 9.208 -8.494 1.135 311 HE2 TYR 47 HE2 TYR 47 5.640 -6.704 2.641 312 HH TYR 47 HH TYR 47 7.723 -7.339 3.904 313 H SER 48 H SER 48 8.061 -6.755 -4.327 314 HA SER 48 HA SER 48 9.310 -9.405 -4.272 315 HB2 SER 48 HB2 SER 48 10.294 -8.909 -6.301 316 HB3 SER 48 HB3 SER 48 8.831 -7.931 -6.418 317 HG SER 48 HG SER 48 10.282 -6.434 -6.826 318 H LEU 49 H LEU 49 11.508 -9.680 -3.759 319 HA LEU 49 HA LEU 49 12.724 -7.449 -2.268 320 HB2 LEU 49 HB2 LEU 49 12.782 -10.381 -1.573 321 HB3 LEU 49 HB3 LEU 49 13.683 -9.122 -0.732 322 HG LEU 49 HG LEU 49 11.844 -9.559 0.642 323 HD11 LEU 49 HD11 LEU 49 10.571 -7.336 -0.843 324 HD12 LEU 49 HD12 LEU 49 12.227 -7.096 -0.287 325 HD13 LEU 49 HD13 LEU 49 10.956 -7.485 0.872 326 HD21 LEU 49 HD21 LEU 49 9.864 -9.229 -1.575 327 HD22 LEU 49 HD22 LEU 49 9.684 -10.051 -0.025 328 HD23 LEU 49 HD23 LEU 49 10.649 -10.786 -1.306 329 H CYS 50 H CYS 50 14.229 -6.775 -3.701 330 HA CYS 50 HA CYS 50 16.062 -8.794 -4.812 331 HB2 CYS 50 HB2 CYS 50 15.711 -5.964 -5.802 332 HB3 CYS 50 HB3 CYS 50 16.523 -7.297 -6.615 Start of MODEL 2 1 H1 ASN 1 H ASN 1 2.155 -2.768 1.768 2 HA ASN 1 HA ASN 1 2.386 -0.655 -0.268 3 HB2 ASN 1 HB2 ASN 1 4.379 -2.702 0.581 4 HB3 ASN 1 HB3 ASN 1 4.291 -2.305 -1.133 5 HD21 ASN 1 HD21 ASN 1 5.260 -1.275 1.986 6 HD22 ASN 1 HD22 ASN 1 5.984 0.220 1.512 7 H ARG 2 H ARG 2 1.651 -1.140 -2.287 8 HA ARG 2 HA ARG 2 0.482 -3.821 -2.647 9 HB2 ARG 2 HB2 ARG 2 -0.482 -1.203 -3.812 10 HB3 ARG 2 HB3 ARG 2 -1.224 -2.778 -4.059 11 HG2 ARG 2 HG2 ARG 2 -1.547 -2.867 -1.549 12 HG3 ARG 2 HG3 ARG 2 -1.105 -1.158 -1.535 13 HD2 ARG 2 HD2 ARG 2 -3.229 -2.110 -3.403 14 HD3 ARG 2 HD3 ARG 2 -3.615 -1.886 -1.697 15 HE ARG 2 HE ARG 2 -2.303 0.404 -2.692 16 HH11 ARG 2 HH11 ARG 2 -5.349 -1.274 -2.866 17 HH12 ARG 2 HH12 ARG 2 -6.267 0.159 -3.192 18 HH21 ARG 2 HH21 ARG 2 -3.501 2.296 -3.122 19 HH22 ARG 2 HH22 ARG 2 -5.216 2.188 -3.339 20 H LEU 3 H LEU 3 1.596 -4.980 -4.065 21 HA LEU 3 HA LEU 3 2.603 -3.648 -6.487 22 HB2 LEU 3 HB2 LEU 3 4.251 -4.489 -4.528 23 HB3 LEU 3 HB3 LEU 3 4.129 -5.965 -5.483 24 HG LEU 3 HG LEU 3 5.091 -3.279 -6.468 25 HD11 LEU 3 HD11 LEU 3 7.216 -3.992 -6.194 26 HD12 LEU 3 HD12 LEU 3 6.808 -5.680 -6.499 27 HD13 LEU 3 HD13 LEU 3 6.482 -4.965 -4.920 28 HD21 LEU 3 HD21 LEU 3 4.192 -4.181 -8.375 29 HD22 LEU 3 HD22 LEU 3 4.446 -5.844 -7.843 30 HD23 LEU 3 HD23 LEU 3 5.809 -4.883 -8.418 31 H CYS 4 H CYS 4 2.243 -4.693 -8.373 32 HA CYS 4 HA CYS 4 0.902 -7.311 -8.207 33 HB2 CYS 4 HB2 CYS 4 -0.238 -5.102 -9.160 34 HB3 CYS 4 HB3 CYS 4 0.614 -5.588 -10.622 35 H THR 5 H THR 5 2.375 -8.831 -8.644 36 HA THR 5 HA THR 5 3.536 -8.980 -11.247 37 HB THR 5 HB THR 5 5.143 -7.433 -10.145 38 HG1 THR 5 HG1 THR 5 6.730 -8.409 -11.195 39 HG21 THR 5 HG21 THR 5 6.478 -8.086 -8.315 40 HG22 THR 5 HG22 THR 5 5.954 -9.766 -8.428 41 HG23 THR 5 HG23 THR 5 4.833 -8.528 -7.861 42 H ASN 6 H ASN 6 4.500 -11.021 -11.679 43 HA ASN 6 HA ASN 6 3.854 -13.060 -9.653 44 HB2 ASN 6 HB2 ASN 6 2.596 -13.046 -11.888 45 HB3 ASN 6 HB3 ASN 6 4.112 -13.577 -12.611 46 HD21 ASN 6 HD21 ASN 6 1.930 -15.141 -12.851 47 HD22 ASN 6 HD22 ASN 6 2.090 -16.557 -11.873 48 H CYS 7 H CYS 7 5.361 -14.555 -9.078 49 HA CYS 7 HA CYS 7 8.072 -13.954 -9.326 50 HB2 CYS 7 HB2 CYS 7 7.328 -15.312 -7.498 51 HB3 CYS 7 HB3 CYS 7 6.679 -16.530 -8.591 52 H CYS 8 H CYS 8 6.007 -16.055 -11.240 53 HA CYS 8 HA CYS 8 8.047 -17.347 -12.703 54 HB2 CYS 8 HB2 CYS 8 5.531 -17.930 -12.510 55 HB3 CYS 8 HB3 CYS 8 5.316 -16.778 -13.825 56 H ALA 9 H ALA 9 5.944 -14.610 -13.600 57 HA ALA 9 HA ALA 9 7.738 -13.981 -15.820 58 HB1 ALA 9 HB1 ALA 9 5.382 -14.036 -16.344 59 HB2 ALA 9 HB2 ALA 9 5.041 -12.855 -15.079 60 HB3 ALA 9 HB3 ALA 9 5.982 -12.384 -16.494 61 H GLY 10 H GLY 10 8.603 -13.548 -13.078 62 HA2 GLY 10 HA2 GLY 10 8.438 -10.707 -12.583 63 HA3 GLY 10 HA3 GLY 10 9.373 -11.876 -11.663 64 H ARG 11 H ARG 11 11.344 -10.952 -11.596 65 HA ARG 11 HA ARG 11 12.674 -10.495 -14.179 66 HB2 ARG 11 HB2 ARG 11 13.018 -8.772 -11.719 67 HB3 ARG 11 HB3 ARG 11 13.830 -8.557 -13.263 68 HG2 ARG 11 HG2 ARG 11 10.914 -8.603 -13.454 69 HG3 ARG 11 HG3 ARG 11 11.557 -7.276 -12.485 70 HD2 ARG 11 HD2 ARG 11 13.230 -7.162 -14.583 71 HD3 ARG 11 HD3 ARG 11 11.797 -7.811 -15.381 72 HE ARG 11 HE ARG 11 10.834 -5.753 -15.196 73 HH11 ARG 11 HH11 ARG 11 13.424 -5.978 -12.882 74 HH12 ARG 11 HH12 ARG 11 13.296 -4.324 -12.382 75 HH21 ARG 11 HH21 ARG 11 10.655 -3.574 -14.547 76 HH22 ARG 11 HH22 ARG 11 11.720 -2.958 -13.329 77 H LYS 12 H LYS 12 14.437 -11.693 -14.396 78 HA LYS 12 HA LYS 12 15.394 -13.489 -12.532 79 HB2 LYS 12 HB2 LYS 12 15.885 -13.460 -15.000 80 HB3 LYS 12 HB3 LYS 12 17.070 -12.198 -14.689 81 HG2 LYS 12 HG2 LYS 12 17.290 -14.703 -13.120 82 HG3 LYS 12 HG3 LYS 12 17.729 -14.757 -14.830 83 HD2 LYS 12 HD2 LYS 12 18.804 -12.496 -13.253 84 HD3 LYS 12 HD3 LYS 12 19.458 -14.094 -12.891 85 HE2 LYS 12 HE2 LYS 12 19.624 -14.234 -15.522 86 HE3 LYS 12 HE3 LYS 12 19.643 -12.477 -15.384 87 HZ1 LYS 12 HZ1 LYS 12 21.531 -14.364 -14.084 88 HZ2 LYS 12 HZ2 LYS 12 21.522 -12.691 -13.840 89 HZ3 LYS 12 HZ3 LYS 12 21.878 -13.321 -15.369 90 H GLY 13 H GLY 13 16.365 -13.201 -10.641 91 HA2 GLY 13 HA2 GLY 13 18.318 -12.463 -9.430 92 HA3 GLY 13 HA3 GLY 13 18.287 -10.983 -10.376 93 H CYS 14 H CYS 14 15.453 -12.445 -8.908 94 HA CYS 14 HA CYS 14 15.488 -10.558 -6.698 95 HB2 CYS 14 HB2 CYS 14 13.532 -10.429 -8.974 96 HB3 CYS 14 HB3 CYS 14 13.056 -9.913 -7.359 97 H ASN 15 H ASN 15 13.142 -10.809 -5.576 98 HA ASN 15 HA ASN 15 12.382 -13.638 -5.579 99 HB2 ASN 15 HB2 ASN 15 13.944 -13.619 -3.799 100 HB3 ASN 15 HB3 ASN 15 13.364 -12.067 -3.201 101 HD21 ASN 15 HD21 ASN 15 11.964 -15.238 -3.981 102 HD22 ASN 15 HD22 ASN 15 11.062 -15.387 -2.515 103 H TYR 16 H TYR 16 10.280 -14.059 -4.863 104 HA TYR 16 HA TYR 16 8.615 -11.727 -4.224 105 HB2 TYR 16 HB2 TYR 16 7.881 -13.838 -6.263 106 HB3 TYR 16 HB3 TYR 16 6.886 -12.468 -5.779 107 HD1 TYR 16 HD1 TYR 16 7.279 -10.278 -6.665 108 HD2 TYR 16 HD2 TYR 16 9.919 -13.478 -7.611 109 HE1 TYR 16 HE1 TYR 16 8.297 -8.908 -8.437 110 HE2 TYR 16 HE2 TYR 16 10.944 -12.117 -9.384 111 HH TYR 16 HH TYR 16 10.080 -8.738 -9.838 112 H TYR 17 H TYR 17 7.246 -12.068 -2.590 113 HA TYR 17 HA TYR 17 6.723 -14.852 -1.778 114 HB2 TYR 17 HB2 TYR 17 7.102 -14.365 0.438 115 HB3 TYR 17 HB3 TYR 17 8.254 -13.269 -0.317 116 HD1 TYR 17 HD1 TYR 17 6.988 -10.927 -1.040 117 HD2 TYR 17 HD2 TYR 17 5.976 -13.460 2.225 118 HE1 TYR 17 HE1 TYR 17 5.933 -9.022 0.103 119 HE2 TYR 17 HE2 TYR 17 4.917 -11.562 3.376 120 HH TYR 17 HH TYR 17 4.329 -9.425 3.245 121 H SER 18 H SER 18 4.699 -15.243 -0.711 122 HA SER 18 HA SER 18 2.516 -13.960 -1.969 123 HB2 SER 18 HB2 SER 18 2.630 -16.356 -1.069 124 HB3 SER 18 HB3 SER 18 2.307 -15.657 0.517 125 HG SER 18 HG SER 18 0.386 -16.311 -0.541 126 H ALA 19 H ALA 19 0.556 -13.519 -0.211 127 HA ALA 19 HA ALA 19 1.361 -11.028 1.013 128 HB1 ALA 19 HB1 ALA 19 -1.314 -11.527 1.658 129 HB2 ALA 19 HB2 ALA 19 -0.695 -10.491 0.371 130 HB3 ALA 19 HB3 ALA 19 -1.086 -12.178 0.034 131 H ASP 20 H ASP 20 -0.022 -14.115 2.093 132 HA ASP 20 HA ASP 20 -0.216 -13.476 4.820 133 HB2 ASP 20 HB2 ASP 20 -1.274 -15.450 3.668 134 HB3 ASP 20 HB3 ASP 20 0.309 -16.222 3.673 135 H GLY 21 H GLY 21 2.505 -14.149 2.853 136 HA2 GLY 21 HA2 GLY 21 4.675 -13.506 3.775 137 HA3 GLY 21 HA3 GLY 21 4.189 -14.282 5.275 138 H THR 22 H THR 22 3.384 -15.852 2.315 139 HA THR 22 HA THR 22 5.331 -17.952 2.939 140 HB THR 22 HB THR 22 2.903 -18.022 1.137 141 HG1 THR 22 HG1 THR 22 1.895 -18.908 2.819 142 HG21 THR 22 HG21 THR 22 3.466 -20.595 1.507 143 HG22 THR 22 HG22 THR 22 5.104 -19.954 1.640 144 HG23 THR 22 HG23 THR 22 4.161 -19.669 0.177 145 H PHE 23 H PHE 23 7.208 -17.740 1.907 146 HA PHE 23 HA PHE 23 7.711 -16.223 -0.361 147 HB2 PHE 23 HB2 PHE 23 9.836 -17.423 -0.516 148 HB3 PHE 23 HB3 PHE 23 9.470 -17.031 1.160 149 HD1 PHE 23 HD1 PHE 23 8.677 -18.807 2.694 150 HD2 PHE 23 HD2 PHE 23 10.051 -19.663 -1.242 151 HE1 PHE 23 HE1 PHE 23 8.953 -21.174 3.309 152 HE2 PHE 23 HE2 PHE 23 10.328 -22.031 -0.634 153 HZ PHE 23 HZ PHE 23 9.778 -22.789 1.644 154 H ILE 24 H ILE 24 7.442 -16.513 -2.484 155 HA ILE 24 HA ILE 24 6.106 -18.920 -3.396 156 HB ILE 24 HB ILE 24 6.905 -16.552 -5.081 157 HG12 ILE 24 HG12 ILE 24 5.598 -15.779 -3.141 158 HG13 ILE 24 HG13 ILE 24 4.686 -15.621 -4.638 159 HG21 ILE 24 HG21 ILE 24 4.448 -17.695 -5.859 160 HG22 ILE 24 HG22 ILE 24 5.985 -17.728 -6.721 161 HG23 ILE 24 HG23 ILE 24 5.577 -19.025 -5.599 162 HD11 ILE 24 HD11 ILE 24 3.561 -17.780 -4.069 163 HD12 ILE 24 HD12 ILE 24 4.346 -17.693 -2.492 164 HD13 ILE 24 HD13 ILE 24 3.208 -16.438 -2.981 165 H CYS 25 H CYS 25 8.862 -17.027 -4.652 166 HA CYS 25 HA CYS 25 10.677 -19.146 -4.765 167 HB2 CYS 25 HB2 CYS 25 10.650 -19.416 -7.322 168 HB3 CYS 25 HB3 CYS 25 9.412 -20.262 -6.400 169 H GLU 26 H GLU 26 12.576 -18.634 -6.202 170 HA GLU 26 HA GLU 26 12.779 -15.788 -6.862 171 HB2 GLU 26 HB2 GLU 26 15.095 -15.825 -5.780 172 HB3 GLU 26 HB3 GLU 26 13.708 -15.753 -4.702 173 HG2 GLU 26 HG2 GLU 26 13.910 -18.068 -4.169 174 HG3 GLU 26 HG3 GLU 26 15.142 -18.299 -5.409 175 H GLY 27 H GLY 27 14.977 -15.359 -7.960 176 HA2 GLY 27 HA2 GLY 27 16.284 -15.727 -9.811 177 HA3 GLY 27 HA3 GLY 27 16.485 -17.352 -9.173 178 H GLU 28 H GLU 28 13.943 -15.444 -10.797 179 HA GLU 28 HA GLU 28 13.146 -17.844 -12.263 180 HB2 GLU 28 HB2 GLU 28 11.177 -16.537 -12.935 181 HB3 GLU 28 HB3 GLU 28 11.365 -16.576 -11.187 182 HG2 GLU 28 HG2 GLU 28 12.545 -14.294 -12.671 183 HG3 GLU 28 HG3 GLU 28 10.795 -14.352 -12.477 184 H SER 29 H SER 29 12.369 -17.309 -14.603 185 HA SER 29 HA SER 29 14.595 -16.831 -16.178 186 HB2 SER 29 HB2 SER 29 13.107 -16.812 -18.069 187 HB3 SER 29 HB3 SER 29 12.469 -17.967 -16.900 188 HG SER 29 HG SER 29 10.714 -16.834 -16.906 189 H ASP 30 H ASP 30 14.866 -15.092 -17.823 190 HA ASP 30 HA ASP 30 14.774 -12.522 -16.507 191 HB2 ASP 30 HB2 ASP 30 16.165 -13.690 -18.840 192 HB3 ASP 30 HB3 ASP 30 15.796 -11.972 -18.956 193 HA PRO 31 HA PRO 31 11.278 -10.771 -18.493 194 HB2 PRO 31 HB2 PRO 31 12.097 -8.228 -18.973 195 HB3 PRO 31 HB3 PRO 31 11.726 -8.827 -17.353 196 HG2 PRO 31 HG2 PRO 31 14.385 -8.502 -18.689 197 HG3 PRO 31 HG3 PRO 31 13.912 -8.104 -17.026 198 HD2 PRO 31 HD2 PRO 31 15.269 -10.362 -17.654 199 HD3 PRO 31 HD3 PRO 31 14.106 -10.288 -16.315 200 H ASN 32 H ASN 32 14.367 -10.366 -20.143 201 HA ASN 32 HA ASN 32 13.510 -9.416 -22.600 202 HB2 ASN 32 HB2 ASN 32 15.796 -11.226 -21.838 203 HB3 ASN 32 HB3 ASN 32 15.539 -10.709 -23.502 204 HD21 ASN 32 HD21 ASN 32 17.803 -10.145 -21.872 205 HD22 ASN 32 HD22 ASN 32 17.891 -8.429 -21.689 206 H ASN 33 H ASN 33 13.986 -12.821 -21.651 207 HA ASN 33 HA ASN 33 11.800 -13.593 -23.413 208 HB2 ASN 33 HB2 ASN 33 14.080 -13.690 -24.642 209 HB3 ASN 33 HB3 ASN 33 14.395 -15.096 -23.630 210 HD21 ASN 33 HD21 ASN 33 14.248 -16.762 -24.971 211 HD22 ASN 33 HD22 ASN 33 12.895 -17.111 -25.988 212 HA PRO 34 HA PRO 34 11.923 -15.837 -19.351 213 HB2 PRO 34 HB2 PRO 34 9.296 -15.445 -18.791 214 HB3 PRO 34 HB3 PRO 34 10.553 -14.277 -18.367 215 HG2 PRO 34 HG2 PRO 34 8.670 -14.271 -20.694 216 HG3 PRO 34 HG3 PRO 34 9.160 -12.926 -19.648 217 HD2 PRO 34 HD2 PRO 34 10.225 -13.323 -22.106 218 HD3 PRO 34 HD3 PRO 34 11.152 -12.617 -20.767 219 H LYS 35 H LYS 35 11.256 -17.920 -18.992 220 HA LYS 35 HA LYS 35 10.419 -19.458 -21.210 221 HB2 LYS 35 HB2 LYS 35 10.509 -20.184 -18.276 222 HB3 LYS 35 HB3 LYS 35 10.303 -21.330 -19.594 223 HG2 LYS 35 HG2 LYS 35 12.701 -19.536 -19.315 224 HG3 LYS 35 HG3 LYS 35 12.618 -21.174 -18.661 225 HD2 LYS 35 HD2 LYS 35 11.979 -20.696 -21.541 226 HD3 LYS 35 HD3 LYS 35 13.664 -20.752 -21.018 227 HE2 LYS 35 HE2 LYS 35 13.026 -22.961 -19.877 228 HE3 LYS 35 HE3 LYS 35 11.577 -22.905 -20.880 229 HZ1 LYS 35 HZ1 LYS 35 14.345 -23.393 -21.641 230 HZ2 LYS 35 HZ2 LYS 35 13.422 -22.477 -22.722 231 HZ3 LYS 35 HZ3 LYS 35 12.916 -24.031 -22.285 232 H ALA 36 H ALA 36 8.576 -21.240 -20.486 233 HA ALA 36 HA ALA 36 6.143 -20.050 -21.001 234 HB1 ALA 36 HB1 ALA 36 5.214 -22.214 -19.880 235 HB2 ALA 36 HB2 ALA 36 6.152 -22.323 -21.370 236 HB3 ALA 36 HB3 ALA 36 6.914 -22.681 -19.820 237 H CYS 37 H CYS 37 5.307 -18.440 -19.821 238 HA CYS 37 HA CYS 37 4.674 -18.982 -17.022 239 HB2 CYS 37 HB2 CYS 37 6.325 -16.679 -18.019 240 HB3 CYS 37 HB3 CYS 37 5.328 -16.500 -16.578 241 HA PRO 38 HA PRO 38 0.814 -17.115 -17.948 242 HB2 PRO 38 HB2 PRO 38 0.194 -15.900 -15.601 243 HB3 PRO 38 HB3 PRO 38 0.158 -17.654 -15.813 244 HG2 PRO 38 HG2 PRO 38 2.282 -15.938 -14.586 245 HG3 PRO 38 HG3 PRO 38 1.637 -17.492 -14.026 246 HD2 PRO 38 HD2 PRO 38 3.986 -17.283 -15.358 247 HD3 PRO 38 HD3 PRO 38 2.929 -18.702 -15.503 248 H ARG 39 H ARG 39 -0.377 -15.043 -18.030 249 HA ARG 39 HA ARG 39 1.480 -12.778 -18.338 250 HB2 ARG 39 HB2 ARG 39 -0.987 -13.570 -19.865 251 HB3 ARG 39 HB3 ARG 39 -0.385 -11.918 -19.901 252 HG2 ARG 39 HG2 ARG 39 1.170 -14.361 -20.725 253 HG3 ARG 39 HG3 ARG 39 0.383 -13.222 -21.819 254 HD2 ARG 39 HD2 ARG 39 2.713 -12.729 -19.981 255 HD3 ARG 39 HD3 ARG 39 2.674 -12.619 -21.740 256 HE ARG 39 HE ARG 39 0.842 -10.778 -20.891 257 HH11 ARG 39 HH11 ARG 39 4.222 -11.358 -20.294 258 HH12 ARG 39 HH12 ARG 39 4.595 -9.688 -20.028 259 HH21 ARG 39 HH21 ARG 39 1.321 -8.576 -20.544 260 HH22 ARG 39 HH22 ARG 39 2.944 -8.106 -20.170 261 H ASN 40 H ASN 40 -1.657 -13.801 -17.132 262 HA ASN 40 HA ASN 40 -2.765 -11.374 -16.406 263 HB2 ASN 40 HB2 ASN 40 -3.674 -13.822 -16.197 264 HB3 ASN 40 HB3 ASN 40 -3.002 -13.734 -14.571 265 HD21 ASN 40 HD21 ASN 40 -4.805 -11.535 -16.700 266 HD22 ASN 40 HD22 ASN 40 -6.007 -11.119 -15.530 267 H CYS 41 H CYS 41 -3.100 -10.719 -14.010 268 HA CYS 41 HA CYS 41 -0.458 -10.160 -12.938 269 HB2 CYS 41 HB2 CYS 41 -2.784 -8.681 -13.122 270 HB3 CYS 41 HB3 CYS 41 -2.741 -9.137 -11.422 271 H ASP 42 H ASP 42 0.242 -10.689 -10.877 272 HA ASP 42 HA ASP 42 -1.268 -12.857 -9.579 273 HB2 ASP 42 HB2 ASP 42 1.139 -13.193 -10.524 274 HB3 ASP 42 HB3 ASP 42 1.643 -12.327 -9.075 275 HA PRO 43 HA PRO 43 -1.639 -9.393 -6.598 276 HB2 PRO 43 HB2 PRO 43 -4.053 -10.198 -5.650 277 HB3 PRO 43 HB3 PRO 43 -3.873 -9.215 -7.109 278 HG2 PRO 43 HG2 PRO 43 -4.300 -12.167 -6.854 279 HG3 PRO 43 HG3 PRO 43 -5.052 -11.021 -7.979 280 HD2 PRO 43 HD2 PRO 43 -3.003 -12.638 -8.699 281 HD3 PRO 43 HD3 PRO 43 -3.230 -11.019 -9.391 282 H ASN 44 H ASN 44 -1.326 -12.753 -6.394 283 HA ASN 44 HA ASN 44 -1.716 -13.137 -3.611 284 HB2 ASN 44 HB2 ASN 44 0.005 -14.739 -5.516 285 HB3 ASN 44 HB3 ASN 44 -0.569 -15.271 -3.939 286 HD21 ASN 44 HD21 ASN 44 -2.250 -16.557 -4.002 287 HD22 ASN 44 HD22 ASN 44 -3.474 -16.583 -5.220 288 H ILE 45 H ILE 45 0.972 -12.050 -5.550 289 HA ILE 45 HA ILE 45 2.866 -12.258 -3.367 290 HB ILE 45 HB ILE 45 3.116 -11.110 -6.145 291 HG12 ILE 45 HG12 ILE 45 4.947 -13.161 -5.799 292 HG13 ILE 45 HG13 ILE 45 3.527 -13.734 -4.931 293 HG21 ILE 45 HG21 ILE 45 4.570 -9.832 -4.743 294 HG22 ILE 45 HG22 ILE 45 5.164 -11.287 -3.944 295 HG23 ILE 45 HG23 ILE 45 5.556 -10.989 -5.637 296 HD11 ILE 45 HD11 ILE 45 2.591 -12.705 -7.362 297 HD12 ILE 45 HD12 ILE 45 4.025 -13.659 -7.741 298 HD13 ILE 45 HD13 ILE 45 2.684 -14.393 -6.861 299 H ALA 46 H ALA 46 3.185 -10.749 -1.878 300 HA ALA 46 HA ALA 46 1.740 -8.299 -1.885 301 HB1 ALA 46 HB1 ALA 46 2.214 -8.294 0.289 302 HB2 ALA 46 HB2 ALA 46 3.010 -9.847 0.028 303 HB3 ALA 46 HB3 ALA 46 3.951 -8.356 -0.015 304 H TYR 47 H TYR 47 5.215 -9.041 -2.151 305 HA TYR 47 HA TYR 47 5.661 -6.917 -3.996 306 HB2 TYR 47 HB2 TYR 47 7.238 -5.633 -2.515 307 HB3 TYR 47 HB3 TYR 47 5.538 -5.478 -2.087 308 HD1 TYR 47 HD1 TYR 47 8.535 -7.540 -1.236 309 HD2 TYR 47 HD2 TYR 47 4.927 -5.744 0.128 310 HE1 TYR 47 HE1 TYR 47 9.057 -8.250 1.061 311 HE2 TYR 47 HE2 TYR 47 5.440 -6.448 2.428 312 HH TYR 47 HH TYR 47 7.807 -7.021 3.694 313 H SER 48 H SER 48 8.039 -6.662 -4.466 314 HA SER 48 HA SER 48 9.297 -9.305 -4.315 315 HB2 SER 48 HB2 SER 48 10.167 -8.917 -6.378 316 HB3 SER 48 HB3 SER 48 8.889 -7.706 -6.474 317 HG SER 48 HG SER 48 10.484 -6.211 -5.592 318 H LEU 49 H LEU 49 11.487 -9.553 -3.745 319 HA LEU 49 HA LEU 49 12.651 -7.281 -2.275 320 HB2 LEU 49 HB2 LEU 49 12.703 -10.196 -1.510 321 HB3 LEU 49 HB3 LEU 49 13.582 -8.915 -0.678 322 HG LEU 49 HG LEU 49 11.712 -9.322 0.663 323 HD11 LEU 49 HD11 LEU 49 10.822 -7.245 0.823 324 HD12 LEU 49 HD12 LEU 49 10.463 -7.142 -0.900 325 HD13 LEU 49 HD13 LEU 49 12.110 -6.881 -0.326 326 HD21 LEU 49 HD21 LEU 49 9.784 -9.053 -1.606 327 HD22 LEU 49 HD22 LEU 49 9.570 -9.837 -0.041 328 HD23 LEU 49 HD23 LEU 49 10.565 -10.601 -1.281 329 H CYS 50 H CYS 50 14.190 -6.633 -3.686 330 HA CYS 50 HA CYS 50 16.033 -8.664 -4.748 331 HB2 CYS 50 HB2 CYS 50 15.774 -5.805 -5.684 332 HB3 CYS 50 HB3 CYS 50 16.579 -7.139 -6.504 Start of MODEL 3 1 H1 ASN 1 H ASN 1 1.148 1.456 -1.169 2 HA ASN 1 HA ASN 1 -1.195 0.473 -2.641 3 HB2 ASN 1 HB2 ASN 1 0.374 2.249 -3.623 4 HB3 ASN 1 HB3 ASN 1 1.545 0.946 -3.804 5 HD21 ASN 1 HD21 ASN 1 -1.765 1.870 -4.619 6 HD22 ASN 1 HD22 ASN 1 -1.814 1.033 -6.130 7 H ARG 2 H ARG 2 -0.854 -1.460 -4.017 8 HA ARG 2 HA ARG 2 0.863 -3.417 -2.638 9 HB2 ARG 2 HB2 ARG 2 -1.903 -3.582 -3.726 10 HB3 ARG 2 HB3 ARG 2 -0.894 -5.017 -3.850 11 HG2 ARG 2 HG2 ARG 2 -0.498 -4.866 -1.395 12 HG3 ARG 2 HG3 ARG 2 -1.677 -3.554 -1.341 13 HD2 ARG 2 HD2 ARG 2 -3.418 -5.007 -2.122 14 HD3 ARG 2 HD3 ARG 2 -2.264 -6.307 -2.417 15 HE ARG 2 HE ARG 2 -2.334 -5.418 0.316 16 HH11 ARG 2 HH11 ARG 2 -3.762 -7.543 -2.044 17 HH12 ARG 2 HH12 ARG 2 -4.355 -8.666 -0.866 18 HH21 ARG 2 HH21 ARG 2 -3.110 -6.890 1.877 19 HH22 ARG 2 HH22 ARG 2 -3.984 -8.293 1.364 20 H LEU 3 H LEU 3 2.484 -4.231 -3.781 21 HA LEU 3 HA LEU 3 2.977 -3.529 -6.462 22 HB2 LEU 3 HB2 LEU 3 4.509 -4.448 -4.478 23 HB3 LEU 3 HB3 LEU 3 4.262 -5.957 -5.353 24 HG LEU 3 HG LEU 3 5.424 -3.441 -6.546 25 HD11 LEU 3 HD11 LEU 3 6.670 -5.007 -4.730 26 HD12 LEU 3 HD12 LEU 3 7.495 -4.139 -6.025 27 HD13 LEU 3 HD13 LEU 3 7.088 -5.843 -6.226 28 HD21 LEU 3 HD21 LEU 3 4.702 -6.116 -7.612 29 HD22 LEU 3 HD22 LEU 3 6.182 -5.362 -8.205 30 HD23 LEU 3 HD23 LEU 3 4.636 -4.532 -8.384 31 H CYS 4 H CYS 4 2.611 -4.543 -8.365 32 HA CYS 4 HA CYS 4 1.084 -7.061 -8.257 33 HB2 CYS 4 HB2 CYS 4 0.087 -4.781 -9.188 34 HB3 CYS 4 HB3 CYS 4 0.946 -5.276 -10.644 35 H THR 5 H THR 5 2.467 -8.663 -8.695 36 HA THR 5 HA THR 5 3.638 -8.876 -11.280 37 HB THR 5 HB THR 5 5.316 -7.392 -10.214 38 HG1 THR 5 HG1 THR 5 6.131 -8.732 -11.782 39 HG21 THR 5 HG21 THR 5 6.546 -7.984 -8.328 40 HG22 THR 5 HG22 THR 5 6.110 -9.688 -8.457 41 HG23 THR 5 HG23 THR 5 4.916 -8.511 -7.909 42 H ASN 6 H ASN 6 4.875 -10.929 -11.526 43 HA ASN 6 HA ASN 6 4.036 -12.928 -9.531 44 HB2 ASN 6 HB2 ASN 6 2.656 -13.104 -11.554 45 HB3 ASN 6 HB3 ASN 6 4.107 -13.259 -12.539 46 HD21 ASN 6 HD21 ASN 6 3.499 -15.262 -13.322 47 HD22 ASN 6 HD22 ASN 6 3.539 -16.688 -12.347 48 H CYS 7 H CYS 7 5.455 -14.602 -9.087 49 HA CYS 7 HA CYS 7 8.195 -14.044 -9.264 50 HB2 CYS 7 HB2 CYS 7 7.361 -15.453 -7.498 51 HB3 CYS 7 HB3 CYS 7 6.742 -16.623 -8.658 52 H CYS 8 H CYS 8 6.084 -16.014 -11.268 53 HA CYS 8 HA CYS 8 8.111 -17.291 -12.771 54 HB2 CYS 8 HB2 CYS 8 5.615 -17.890 -12.600 55 HB3 CYS 8 HB3 CYS 8 5.363 -16.653 -13.826 56 H ALA 9 H ALA 9 6.030 -14.508 -13.577 57 HA ALA 9 HA ALA 9 7.829 -13.821 -15.775 58 HB1 ALA 9 HB1 ALA 9 5.466 -13.841 -16.291 59 HB2 ALA 9 HB2 ALA 9 5.146 -12.687 -14.995 60 HB3 ALA 9 HB3 ALA 9 6.088 -12.194 -16.402 61 H GLY 10 H GLY 10 8.700 -13.486 -13.022 62 HA2 GLY 10 HA2 GLY 10 8.570 -10.652 -12.455 63 HA3 GLY 10 HA3 GLY 10 9.464 -11.861 -11.545 64 H ARG 11 H ARG 11 11.485 -11.099 -11.443 65 HA ARG 11 HA ARG 11 12.850 -10.557 -13.988 66 HB2 ARG 11 HB2 ARG 11 13.197 -8.937 -11.459 67 HB3 ARG 11 HB3 ARG 11 14.074 -8.704 -12.965 68 HG2 ARG 11 HG2 ARG 11 11.129 -8.604 -13.132 69 HG3 ARG 11 HG3 ARG 11 11.922 -7.278 -12.280 70 HD2 ARG 11 HD2 ARG 11 12.839 -8.186 -14.990 71 HD3 ARG 11 HD3 ARG 11 11.528 -7.023 -14.800 72 HE ARG 11 HE ARG 11 13.853 -6.271 -13.326 73 HH11 ARG 11 HH11 ARG 11 12.423 -6.281 -16.501 74 HH12 ARG 11 HH12 ARG 11 13.330 -4.913 -17.056 75 HH21 ARG 11 HH21 ARG 11 15.052 -4.469 -14.045 76 HH22 ARG 11 HH22 ARG 11 14.826 -3.884 -15.659 77 H LYS 12 H LYS 12 14.576 -11.802 -14.234 78 HA LYS 12 HA LYS 12 15.451 -13.698 -12.427 79 HB2 LYS 12 HB2 LYS 12 15.975 -13.699 -14.847 80 HB3 LYS 12 HB3 LYS 12 17.103 -12.375 -14.587 81 HG2 LYS 12 HG2 LYS 12 18.436 -13.819 -13.116 82 HG3 LYS 12 HG3 LYS 12 17.319 -15.149 -13.435 83 HD2 LYS 12 HD2 LYS 12 18.947 -15.601 -14.984 84 HD3 LYS 12 HD3 LYS 12 17.878 -14.576 -15.944 85 HE2 LYS 12 HE2 LYS 12 19.280 -12.672 -15.597 86 HE3 LYS 12 HE3 LYS 12 20.259 -13.541 -14.415 87 HZ1 LYS 12 HZ1 LYS 12 20.698 -13.351 -17.136 88 HZ2 LYS 12 HZ2 LYS 12 20.202 -14.946 -16.871 89 HZ3 LYS 12 HZ3 LYS 12 21.532 -14.324 -16.031 90 H GLY 13 H GLY 13 16.478 -13.552 -10.549 91 HA2 GLY 13 HA2 GLY 13 18.411 -12.915 -9.279 92 HA3 GLY 13 HA3 GLY 13 18.465 -11.412 -10.188 93 H CYS 14 H CYS 14 15.543 -12.768 -8.792 94 HA CYS 14 HA CYS 14 15.639 -10.900 -6.559 95 HB2 CYS 14 HB2 CYS 14 13.636 -10.766 -8.801 96 HB3 CYS 14 HB3 CYS 14 13.237 -10.184 -7.188 97 H ASN 15 H ASN 15 13.267 -11.108 -5.450 98 HA ASN 15 HA ASN 15 12.480 -13.929 -5.429 99 HB2 ASN 15 HB2 ASN 15 14.078 -13.860 -3.653 100 HB3 ASN 15 HB3 ASN 15 13.417 -12.350 -3.031 101 HD21 ASN 15 HD21 ASN 15 11.961 -15.435 -4.003 102 HD22 ASN 15 HD22 ASN 15 11.133 -15.709 -2.512 103 H TYR 16 H TYR 16 10.360 -14.307 -4.843 104 HA TYR 16 HA TYR 16 8.724 -11.960 -4.166 105 HB2 TYR 16 HB2 TYR 16 8.017 -14.044 -6.242 106 HB3 TYR 16 HB3 TYR 16 6.991 -12.707 -5.736 107 HD1 TYR 16 HD1 TYR 16 7.325 -10.501 -6.591 108 HD2 TYR 16 HD2 TYR 16 10.082 -13.600 -7.538 109 HE1 TYR 16 HE1 TYR 16 8.330 -9.070 -8.320 110 HE2 TYR 16 HE2 TYR 16 11.096 -12.177 -9.269 111 HH TYR 16 HH TYR 16 9.681 -9.122 -10.197 112 H TYR 17 H TYR 17 7.468 -12.291 -2.459 113 HA TYR 17 HA TYR 17 6.840 -15.071 -1.704 114 HB2 TYR 17 HB2 TYR 17 7.245 -14.617 0.514 115 HB3 TYR 17 HB3 TYR 17 8.412 -13.531 -0.234 116 HD1 TYR 17 HD1 TYR 17 7.199 -11.155 -0.911 117 HD2 TYR 17 HD2 TYR 17 6.127 -13.720 2.309 118 HE1 TYR 17 HE1 TYR 17 6.182 -9.247 0.262 119 HE2 TYR 17 HE2 TYR 17 5.106 -11.820 3.491 120 HH TYR 17 HH TYR 17 5.020 -9.522 3.552 121 H SER 18 H SER 18 4.811 -15.434 -0.647 122 HA SER 18 HA SER 18 2.652 -14.095 -1.879 123 HB2 SER 18 HB2 SER 18 1.299 -15.681 -0.888 124 HB3 SER 18 HB3 SER 18 2.853 -16.509 -0.806 125 HG SER 18 HG SER 18 1.462 -16.319 1.188 126 H ALA 19 H ALA 19 0.709 -13.605 -0.124 127 HA ALA 19 HA ALA 19 1.579 -11.141 1.110 128 HB1 ALA 19 HB1 ALA 19 -1.161 -11.801 1.674 129 HB2 ALA 19 HB2 ALA 19 -0.502 -10.483 0.705 130 HB3 ALA 19 HB3 ALA 19 -0.803 -12.055 -0.035 131 H ASP 20 H ASP 20 0.103 -14.189 2.180 132 HA ASP 20 HA ASP 20 -0.060 -13.548 4.911 133 HB2 ASP 20 HB2 ASP 20 0.093 -16.173 3.438 134 HB3 ASP 20 HB3 ASP 20 -0.038 -16.097 5.193 135 H GLY 21 H GLY 21 2.623 -14.325 2.929 136 HA2 GLY 21 HA2 GLY 21 4.819 -13.765 3.857 137 HA3 GLY 21 HA3 GLY 21 4.309 -14.550 5.345 138 H THR 22 H THR 22 3.440 -16.034 2.357 139 HA THR 22 HA THR 22 5.296 -18.223 2.943 140 HB THR 22 HB THR 22 2.890 -18.143 1.112 141 HG1 THR 22 HG1 THR 22 1.985 -19.479 2.748 142 HG21 THR 22 HG21 THR 22 4.202 -19.782 0.140 143 HG22 THR 22 HG22 THR 22 3.283 -20.719 1.319 144 HG23 THR 22 HG23 THR 22 4.944 -20.243 1.671 145 H PHE 23 H PHE 23 7.204 -18.000 1.959 146 HA PHE 23 HA PHE 23 7.787 -16.474 -0.275 147 HB2 PHE 23 HB2 PHE 23 9.875 -17.741 -0.425 148 HB3 PHE 23 HB3 PHE 23 9.496 -17.369 1.254 149 HD1 PHE 23 HD1 PHE 23 8.620 -19.147 2.741 150 HD2 PHE 23 HD2 PHE 23 10.028 -19.973 -1.190 151 HE1 PHE 23 HE1 PHE 23 8.809 -21.533 3.313 152 HE2 PHE 23 HE2 PHE 23 10.218 -22.360 -0.625 153 HZ PHE 23 HZ PHE 23 9.608 -23.143 1.629 154 H ILE 24 H ILE 24 7.573 -16.721 -2.414 155 HA ILE 24 HA ILE 24 6.189 -19.085 -3.389 156 HB ILE 24 HB ILE 24 6.994 -16.661 -4.991 157 HG12 ILE 24 HG12 ILE 24 5.660 -15.978 -3.029 158 HG13 ILE 24 HG13 ILE 24 4.775 -15.750 -4.534 159 HG21 ILE 24 HG21 ILE 24 4.540 -17.836 -5.800 160 HG22 ILE 24 HG22 ILE 24 6.059 -17.737 -6.689 161 HG23 ILE 24 HG23 ILE 24 5.739 -19.119 -5.641 162 HD11 ILE 24 HD11 ILE 24 3.105 -16.894 -3.654 163 HD12 ILE 24 HD12 ILE 24 4.136 -18.325 -3.638 164 HD13 ILE 24 HD13 ILE 24 4.065 -17.274 -2.225 165 H CYS 25 H CYS 25 8.930 -17.160 -4.627 166 HA CYS 25 HA CYS 25 10.760 -19.263 -4.780 167 HB2 CYS 25 HB2 CYS 25 10.709 -19.507 -7.341 168 HB3 CYS 25 HB3 CYS 25 9.490 -20.375 -6.413 169 H GLU 26 H GLU 26 12.642 -18.722 -6.229 170 HA GLU 26 HA GLU 26 12.813 -15.873 -6.882 171 HB2 GLU 26 HB2 GLU 26 15.126 -15.878 -5.794 172 HB3 GLU 26 HB3 GLU 26 13.735 -15.819 -4.721 173 HG2 GLU 26 HG2 GLU 26 15.335 -17.339 -3.816 174 HG3 GLU 26 HG3 GLU 26 13.946 -18.262 -4.387 175 H GLY 27 H GLY 27 14.978 -15.407 -8.001 176 HA2 GLY 27 HA2 GLY 27 16.265 -15.758 -9.871 177 HA3 GLY 27 HA3 GLY 27 16.559 -17.349 -9.185 178 H GLU 28 H GLU 28 14.148 -15.535 -11.066 179 HA GLU 28 HA GLU 28 13.435 -18.051 -12.416 180 HB2 GLU 28 HB2 GLU 28 11.855 -15.887 -11.375 181 HB3 GLU 28 HB3 GLU 28 11.587 -16.031 -13.107 182 HG2 GLU 28 HG2 GLU 28 11.188 -18.145 -11.010 183 HG3 GLU 28 HG3 GLU 28 9.959 -17.359 -11.999 184 H SER 29 H SER 29 12.406 -17.366 -14.720 185 HA SER 29 HA SER 29 14.554 -16.811 -16.385 186 HB2 SER 29 HB2 SER 29 11.740 -16.175 -17.225 187 HB3 SER 29 HB3 SER 29 13.043 -16.893 -18.171 188 HG SER 29 HG SER 29 12.816 -18.680 -16.520 189 H ASP 30 H ASP 30 14.738 -14.986 -17.946 190 HA ASP 30 HA ASP 30 14.705 -12.488 -16.490 191 HB2 ASP 30 HB2 ASP 30 16.021 -13.542 -18.909 192 HB3 ASP 30 HB3 ASP 30 15.607 -11.831 -18.975 193 HA PRO 31 HA PRO 31 11.123 -10.654 -18.232 194 HB2 PRO 31 HB2 PRO 31 11.913 -8.084 -18.608 195 HB3 PRO 31 HB3 PRO 31 11.611 -8.772 -17.008 196 HG2 PRO 31 HG2 PRO 31 14.212 -8.360 -18.432 197 HG3 PRO 31 HG3 PRO 31 13.806 -8.056 -16.733 198 HD2 PRO 31 HD2 PRO 31 15.143 -10.268 -17.537 199 HD3 PRO 31 HD3 PRO 31 14.036 -10.274 -16.149 200 H ASN 32 H ASN 32 14.140 -10.109 -19.981 201 HA ASN 32 HA ASN 32 13.173 -9.046 -22.346 202 HB2 ASN 32 HB2 ASN 32 15.411 -11.070 -22.163 203 HB3 ASN 32 HB3 ASN 32 15.199 -9.821 -23.387 204 HD21 ASN 32 HD21 ASN 32 17.539 -10.104 -21.955 205 HD22 ASN 32 HD22 ASN 32 17.740 -8.735 -20.921 206 H ASN 33 H ASN 33 13.721 -12.492 -21.606 207 HA ASN 33 HA ASN 33 11.464 -13.196 -23.303 208 HB2 ASN 33 HB2 ASN 33 13.019 -15.056 -24.304 209 HB3 ASN 33 HB3 ASN 33 13.023 -13.439 -25.001 210 HD21 ASN 33 HD21 ASN 33 15.023 -13.081 -25.654 211 HD22 ASN 33 HD22 ASN 33 16.449 -13.297 -24.703 212 HA PRO 34 HA PRO 34 11.836 -15.682 -19.401 213 HB2 PRO 34 HB2 PRO 34 9.233 -15.382 -18.690 214 HB3 PRO 34 HB3 PRO 34 10.488 -14.215 -18.257 215 HG2 PRO 34 HG2 PRO 34 8.490 -14.109 -20.483 216 HG3 PRO 34 HG3 PRO 34 9.007 -12.819 -19.383 217 HD2 PRO 34 HD2 PRO 34 9.953 -13.044 -21.910 218 HD3 PRO 34 HD3 PRO 34 10.933 -12.400 -20.577 219 H LYS 35 H LYS 35 10.964 -17.744 -18.963 220 HA LYS 35 HA LYS 35 10.179 -19.219 -21.271 221 HB2 LYS 35 HB2 LYS 35 10.229 -20.059 -18.366 222 HB3 LYS 35 HB3 LYS 35 10.078 -21.144 -19.742 223 HG2 LYS 35 HG2 LYS 35 12.278 -20.859 -20.380 224 HG3 LYS 35 HG3 LYS 35 12.429 -19.314 -19.539 225 HD2 LYS 35 HD2 LYS 35 13.641 -20.774 -18.193 226 HD3 LYS 35 HD3 LYS 35 12.069 -20.703 -17.393 227 HE2 LYS 35 HE2 LYS 35 12.476 -22.972 -17.424 228 HE3 LYS 35 HE3 LYS 35 11.523 -22.762 -18.892 229 HZ1 LYS 35 HZ1 LYS 35 13.592 -22.693 -20.161 230 HZ2 LYS 35 HZ2 LYS 35 13.438 -24.148 -19.313 231 HZ3 LYS 35 HZ3 LYS 35 14.484 -22.946 -18.746 232 H ALA 36 H ALA 36 8.322 -21.012 -20.574 233 HA ALA 36 HA ALA 36 5.898 -19.793 -21.066 234 HB1 ALA 36 HB1 ALA 36 6.742 -22.454 -20.113 235 HB2 ALA 36 HB2 ALA 36 5.059 -22.017 -19.810 236 HB3 ALA 36 HB3 ALA 36 5.690 -22.007 -21.457 237 H CYS 37 H CYS 37 5.147 -18.158 -19.847 238 HA CYS 37 HA CYS 37 4.535 -18.745 -17.042 239 HB2 CYS 37 HB2 CYS 37 6.053 -16.364 -18.082 240 HB3 CYS 37 HB3 CYS 37 5.139 -16.276 -16.580 241 HA PRO 38 HA PRO 38 0.599 -17.004 -17.891 242 HB2 PRO 38 HB2 PRO 38 -0.018 -15.835 -15.519 243 HB3 PRO 38 HB3 PRO 38 -0.002 -17.588 -15.751 244 HG2 PRO 38 HG2 PRO 38 2.088 -15.818 -14.542 245 HG3 PRO 38 HG3 PRO 38 1.503 -17.398 -13.989 246 HD2 PRO 38 HD2 PRO 38 3.820 -17.099 -15.359 247 HD3 PRO 38 HD3 PRO 38 2.806 -18.550 -15.501 248 H ARG 39 H ARG 39 -0.584 -15.037 -18.189 249 HA ARG 39 HA ARG 39 1.175 -12.719 -18.526 250 HB2 ARG 39 HB2 ARG 39 -1.493 -13.462 -19.717 251 HB3 ARG 39 HB3 ARG 39 -0.803 -11.853 -19.889 252 HG2 ARG 39 HG2 ARG 39 0.493 -14.411 -20.810 253 HG3 ARG 39 HG3 ARG 39 -0.369 -13.266 -21.839 254 HD2 ARG 39 HD2 ARG 39 2.202 -12.844 -20.337 255 HD3 ARG 39 HD3 ARG 39 1.942 -12.795 -22.080 256 HE ARG 39 HE ARG 39 0.334 -10.823 -21.091 257 HH11 ARG 39 HH11 ARG 39 3.727 -11.576 -20.880 258 HH12 ARG 39 HH12 ARG 39 4.218 -9.922 -20.731 259 HH21 ARG 39 HH21 ARG 39 0.969 -8.641 -20.895 260 HH22 ARG 39 HH22 ARG 39 2.649 -8.253 -20.738 261 H ASN 40 H ASN 40 -1.913 -13.663 -17.085 262 HA ASN 40 HA ASN 40 -2.818 -11.216 -16.185 263 HB2 ASN 40 HB2 ASN 40 -3.140 -14.027 -15.252 264 HB3 ASN 40 HB3 ASN 40 -3.657 -12.743 -14.163 265 HD21 ASN 40 HD21 ASN 40 -4.673 -14.781 -16.497 266 HD22 ASN 40 HD22 ASN 40 -6.039 -13.903 -17.088 267 H CYS 41 H CYS 41 -2.918 -10.571 -13.793 268 HA CYS 41 HA CYS 41 -0.178 -10.262 -12.878 269 HB2 CYS 41 HB2 CYS 41 -2.331 -8.560 -12.929 270 HB3 CYS 41 HB3 CYS 41 -2.309 -9.072 -11.244 271 H ASP 42 H ASP 42 0.502 -10.711 -10.734 272 HA ASP 42 HA ASP 42 -1.021 -12.891 -9.473 273 HB2 ASP 42 HB2 ASP 42 1.884 -12.381 -9.846 274 HB3 ASP 42 HB3 ASP 42 1.393 -13.165 -8.347 275 HA PRO 43 HA PRO 43 -1.441 -9.447 -6.475 276 HB2 PRO 43 HB2 PRO 43 -3.868 -10.260 -5.569 277 HB3 PRO 43 HB3 PRO 43 -3.666 -9.267 -7.017 278 HG2 PRO 43 HG2 PRO 43 -4.096 -12.221 -6.790 279 HG3 PRO 43 HG3 PRO 43 -4.831 -11.067 -7.918 280 HD2 PRO 43 HD2 PRO 43 -2.770 -12.678 -8.618 281 HD3 PRO 43 HD3 PRO 43 -2.988 -11.054 -9.302 282 H ASN 44 H ASN 44 -1.157 -12.818 -6.287 283 HA ASN 44 HA ASN 44 -1.570 -13.201 -3.505 284 HB2 ASN 44 HB2 ASN 44 -0.583 -15.366 -3.818 285 HB3 ASN 44 HB3 ASN 44 -1.562 -15.019 -5.240 286 HD21 ASN 44 HD21 ASN 44 -0.582 -14.717 -7.207 287 HD22 ASN 44 HD22 ASN 44 1.088 -15.063 -7.487 288 H ILE 45 H ILE 45 1.146 -12.159 -5.432 289 HA ILE 45 HA ILE 45 3.029 -12.404 -3.246 290 HB ILE 45 HB ILE 45 3.299 -11.247 -6.019 291 HG12 ILE 45 HG12 ILE 45 5.110 -13.348 -5.564 292 HG13 ILE 45 HG13 ILE 45 3.584 -13.883 -4.869 293 HG21 ILE 45 HG21 ILE 45 4.766 -9.986 -4.618 294 HG22 ILE 45 HG22 ILE 45 5.337 -11.445 -3.811 295 HG23 ILE 45 HG23 ILE 45 5.742 -11.158 -5.503 296 HD11 ILE 45 HD11 ILE 45 2.796 -14.349 -6.878 297 HD12 ILE 45 HD12 ILE 45 3.106 -12.701 -7.425 298 HD13 ILE 45 HD13 ILE 45 4.368 -13.927 -7.557 299 H ALA 46 H ALA 46 3.373 -10.910 -1.748 300 HA ALA 46 HA ALA 46 1.962 -8.440 -1.736 301 HB1 ALA 46 HB1 ALA 46 3.211 -10.019 0.164 302 HB2 ALA 46 HB2 ALA 46 4.179 -8.545 0.128 303 HB3 ALA 46 HB3 ALA 46 2.445 -8.453 0.437 304 H TYR 47 H TYR 47 5.440 -9.199 -1.953 305 HA TYR 47 HA TYR 47 5.901 -7.064 -3.797 306 HB2 TYR 47 HB2 TYR 47 7.516 -5.840 -2.304 307 HB3 TYR 47 HB3 TYR 47 5.823 -5.661 -1.859 308 HD1 TYR 47 HD1 TYR 47 8.788 -7.793 -1.073 309 HD2 TYR 47 HD2 TYR 47 5.222 -5.964 0.355 310 HE1 TYR 47 HE1 TYR 47 9.314 -8.560 1.204 311 HE2 TYR 47 HE2 TYR 47 5.738 -6.725 2.636 312 HH TYR 47 HH TYR 47 7.563 -7.452 3.965 313 H SER 48 H SER 48 8.276 -6.847 -4.290 314 HA SER 48 HA SER 48 9.487 -9.514 -4.201 315 HB2 SER 48 HB2 SER 48 10.418 -9.080 -6.244 316 HB3 SER 48 HB3 SER 48 9.072 -7.945 -6.342 317 HG SER 48 HG SER 48 11.567 -7.351 -6.592 318 H LEU 49 H LEU 49 11.669 -9.817 -3.646 319 HA LEU 49 HA LEU 49 12.894 -7.593 -2.152 320 HB2 LEU 49 HB2 LEU 49 12.897 -10.522 -1.437 321 HB3 LEU 49 HB3 LEU 49 13.804 -9.270 -0.590 322 HG LEU 49 HG LEU 49 11.937 -9.669 0.758 323 HD11 LEU 49 HD11 LEU 49 12.375 -7.220 -0.174 324 HD12 LEU 49 HD12 LEU 49 11.072 -7.581 0.957 325 HD13 LEU 49 HD13 LEU 49 10.727 -7.435 -0.766 326 HD21 LEU 49 HD21 LEU 49 9.780 -10.129 0.059 327 HD22 LEU 49 HD22 LEU 49 10.753 -10.893 -1.197 328 HD23 LEU 49 HD23 LEU 49 10.000 -9.326 -1.495 329 H CYS 50 H CYS 50 14.433 -6.952 -3.565 330 HA CYS 50 HA CYS 50 16.247 -9.004 -4.644 331 HB2 CYS 50 HB2 CYS 50 15.975 -6.163 -5.625 332 HB3 CYS 50 HB3 CYS 50 16.771 -7.510 -6.432 Start of MODEL 4 1 H1 ASN 1 H ASN 1 3.299 -1.906 0.485 2 HA ASN 1 HA ASN 1 2.519 -0.279 -1.755 3 HB2 ASN 1 HB2 ASN 1 4.796 -2.220 -1.335 4 HB3 ASN 1 HB3 ASN 1 4.562 -1.310 -2.824 5 HD21 ASN 1 HD21 ASN 1 4.167 1.122 -2.356 6 HD22 ASN 1 HD22 ASN 1 5.300 1.844 -1.269 7 H ARG 2 H ARG 2 0.939 -0.908 -3.066 8 HA ARG 2 HA ARG 2 0.238 -3.677 -3.397 9 HB2 ARG 2 HB2 ARG 2 -0.850 -1.063 -4.305 10 HB3 ARG 2 HB3 ARG 2 -1.260 -2.482 -5.259 11 HG2 ARG 2 HG2 ARG 2 -2.519 -3.412 -3.594 12 HG3 ARG 2 HG3 ARG 2 -1.614 -2.606 -2.311 13 HD2 ARG 2 HD2 ARG 2 -3.552 -1.398 -2.241 14 HD3 ARG 2 HD3 ARG 2 -2.644 -0.445 -3.414 15 HE ARG 2 HE ARG 2 -4.028 -2.302 -4.892 16 HH11 ARG 2 HH11 ARG 2 -4.837 0.221 -2.633 17 HH12 ARG 2 HH12 ARG 2 -6.376 0.553 -3.355 18 HH21 ARG 2 HH21 ARG 2 -6.052 -1.874 -5.851 19 HH22 ARG 2 HH22 ARG 2 -7.067 -0.640 -5.185 20 H LEU 3 H LEU 3 2.096 -4.600 -4.329 21 HA LEU 3 HA LEU 3 2.902 -3.649 -6.970 22 HB2 LEU 3 HB2 LEU 3 4.404 -4.500 -4.935 23 HB3 LEU 3 HB3 LEU 3 4.146 -6.044 -5.745 24 HG LEU 3 HG LEU 3 5.342 -3.599 -7.047 25 HD11 LEU 3 HD11 LEU 3 6.548 -5.114 -5.137 26 HD12 LEU 3 HD12 LEU 3 7.391 -4.249 -6.421 27 HD13 LEU 3 HD13 LEU 3 7.016 -5.962 -6.611 28 HD21 LEU 3 HD21 LEU 3 4.594 -6.309 -7.980 29 HD22 LEU 3 HD22 LEU 3 6.114 -5.640 -8.572 30 HD23 LEU 3 HD23 LEU 3 4.603 -4.772 -8.845 31 H CYS 4 H CYS 4 2.560 -4.745 -8.835 32 HA CYS 4 HA CYS 4 0.997 -7.236 -8.642 33 HB2 CYS 4 HB2 CYS 4 0.072 -4.959 -9.698 34 HB3 CYS 4 HB3 CYS 4 0.894 -5.593 -11.119 35 H THR 5 H THR 5 2.364 -8.871 -8.999 36 HA THR 5 HA THR 5 3.540 -9.233 -11.556 37 HB THR 5 HB THR 5 5.241 -7.704 -10.722 38 HG1 THR 5 HG1 THR 5 6.019 -9.387 -12.005 39 HG21 THR 5 HG21 THR 5 4.752 -8.406 -8.268 40 HG22 THR 5 HG22 THR 5 6.394 -7.947 -8.719 41 HG23 THR 5 HG23 THR 5 5.966 -9.650 -8.563 42 H ASN 6 H ASN 6 4.806 -11.285 -11.668 43 HA ASN 6 HA ASN 6 3.990 -13.156 -9.543 44 HB2 ASN 6 HB2 ASN 6 2.620 -13.464 -11.570 45 HB3 ASN 6 HB3 ASN 6 4.084 -13.709 -12.517 46 HD21 ASN 6 HD21 ASN 6 3.324 -15.759 -13.129 47 HD22 ASN 6 HD22 ASN 6 3.394 -17.103 -12.046 48 H CYS 7 H CYS 7 5.429 -14.775 -8.984 49 HA CYS 7 HA CYS 7 8.149 -14.213 -9.130 50 HB2 CYS 7 HB2 CYS 7 7.320 -15.630 -7.380 51 HB3 CYS 7 HB3 CYS 7 6.707 -16.801 -8.543 52 H CYS 8 H CYS 8 6.128 -16.211 -11.194 53 HA CYS 8 HA CYS 8 8.200 -17.482 -12.630 54 HB2 CYS 8 HB2 CYS 8 5.738 -18.118 -12.580 55 HB3 CYS 8 HB3 CYS 8 5.469 -16.807 -13.724 56 H ALA 9 H ALA 9 6.183 -14.672 -13.500 57 HA ALA 9 HA ALA 9 8.075 -13.991 -15.621 58 HB1 ALA 9 HB1 ALA 9 5.352 -12.892 -14.942 59 HB2 ALA 9 HB2 ALA 9 6.363 -12.306 -16.264 60 HB3 ALA 9 HB3 ALA 9 5.769 -13.966 -16.278 61 H GLY 10 H GLY 10 8.834 -13.680 -12.831 62 HA2 GLY 10 HA2 GLY 10 8.674 -10.884 -12.178 63 HA3 GLY 10 HA3 GLY 10 9.633 -12.098 -11.344 64 H ARG 11 H ARG 11 11.653 -11.354 -11.274 65 HA ARG 11 HA ARG 11 12.915 -10.590 -13.813 66 HB2 ARG 11 HB2 ARG 11 13.310 -9.143 -11.187 67 HB3 ARG 11 HB3 ARG 11 14.136 -8.786 -12.698 68 HG2 ARG 11 HG2 ARG 11 11.187 -8.741 -12.781 69 HG3 ARG 11 HG3 ARG 11 11.971 -7.465 -11.848 70 HD2 ARG 11 HD2 ARG 11 13.485 -7.251 -13.967 71 HD3 ARG 11 HD3 ARG 11 12.140 -8.062 -14.769 72 HE ARG 11 HE ARG 11 10.914 -6.135 -14.593 73 HH11 ARG 11 HH11 ARG 11 13.688 -5.928 -12.498 74 HH12 ARG 11 HH12 ARG 11 13.438 -4.257 -12.117 75 HH21 ARG 11 HH21 ARG 11 10.575 -3.934 -14.098 76 HH22 ARG 11 HH22 ARG 11 11.667 -3.124 -13.027 77 H LYS 12 H LYS 12 14.713 -11.700 -14.196 78 HA LYS 12 HA LYS 12 15.671 -13.743 -12.608 79 HB2 LYS 12 HB2 LYS 12 16.165 -13.337 -15.050 80 HB3 LYS 12 HB3 LYS 12 17.365 -12.156 -14.540 81 HG2 LYS 12 HG2 LYS 12 18.409 -14.042 -13.187 82 HG3 LYS 12 HG3 LYS 12 17.372 -15.125 -14.118 83 HD2 LYS 12 HD2 LYS 12 19.252 -15.150 -15.425 84 HD3 LYS 12 HD3 LYS 12 18.391 -13.793 -16.155 85 HE2 LYS 12 HE2 LYS 12 20.190 -13.191 -13.879 86 HE3 LYS 12 HE3 LYS 12 20.950 -13.653 -15.401 87 HZ1 LYS 12 HZ1 LYS 12 20.765 -11.418 -15.696 88 HZ2 LYS 12 HZ2 LYS 12 19.361 -11.278 -14.762 89 HZ3 LYS 12 HZ3 LYS 12 19.271 -11.890 -16.337 90 H GLY 13 H GLY 13 16.483 -13.627 -10.622 91 HA2 GLY 13 HA2 GLY 13 18.361 -13.132 -9.219 92 HA3 GLY 13 HA3 GLY 13 18.566 -11.619 -10.089 93 H CYS 14 H CYS 14 15.485 -12.814 -8.902 94 HA CYS 14 HA CYS 14 15.554 -10.912 -6.681 95 HB2 CYS 14 HB2 CYS 14 13.611 -10.864 -8.977 96 HB3 CYS 14 HB3 CYS 14 13.161 -10.235 -7.395 97 H ASN 15 H ASN 15 13.158 -11.089 -5.621 98 HA ASN 15 HA ASN 15 12.374 -13.908 -5.518 99 HB2 ASN 15 HB2 ASN 15 13.921 -13.802 -3.712 100 HB3 ASN 15 HB3 ASN 15 13.288 -12.251 -3.167 101 HD21 ASN 15 HD21 ASN 15 12.061 -15.511 -3.862 102 HD22 ASN 15 HD22 ASN 15 11.092 -15.632 -2.436 103 H TYR 16 H TYR 16 10.263 -14.276 -4.728 104 HA TYR 16 HA TYR 16 8.611 -11.903 -4.252 105 HB2 TYR 16 HB2 TYR 16 7.919 -14.078 -6.237 106 HB3 TYR 16 HB3 TYR 16 6.887 -12.722 -5.796 107 HD1 TYR 16 HD1 TYR 16 7.120 -10.627 -6.857 108 HD2 TYR 16 HD2 TYR 16 10.092 -13.617 -7.429 109 HE1 TYR 16 HE1 TYR 16 8.131 -9.272 -8.644 110 HE2 TYR 16 HE2 TYR 16 11.112 -12.270 -9.215 111 HH TYR 16 HH TYR 16 10.691 -9.172 -9.653 112 H TYR 17 H TYR 17 7.368 -12.162 -2.524 113 HA TYR 17 HA TYR 17 6.744 -14.907 -1.648 114 HB2 TYR 17 HB2 TYR 17 7.125 -14.340 0.547 115 HB3 TYR 17 HB3 TYR 17 8.284 -13.276 -0.243 116 HD1 TYR 17 HD1 TYR 17 7.029 -10.957 -1.054 117 HD2 TYR 17 HD2 TYR 17 5.995 -13.369 2.295 118 HE1 TYR 17 HE1 TYR 17 5.975 -9.009 0.016 119 HE2 TYR 17 HE2 TYR 17 4.938 -11.428 3.374 120 HH TYR 17 HH TYR 17 4.012 -9.294 2.827 121 H SER 18 H SER 18 4.710 -15.232 -0.578 122 HA SER 18 HA SER 18 2.551 -13.966 -1.898 123 HB2 SER 18 HB2 SER 18 2.587 -16.327 -0.969 124 HB3 SER 18 HB3 SER 18 2.358 -15.614 0.628 125 HG SER 18 HG SER 18 0.334 -15.983 -0.041 126 H ALA 19 H ALA 19 0.585 -13.453 -0.161 127 HA ALA 19 HA ALA 19 1.410 -10.932 0.986 128 HB1 ALA 19 HB1 ALA 19 -1.354 -12.054 1.221 129 HB2 ALA 19 HB2 ALA 19 -0.838 -10.373 1.082 130 HB3 ALA 19 HB3 ALA 19 -0.763 -11.437 -0.322 131 H ASP 20 H ASP 20 0.007 -13.976 2.154 132 HA ASP 20 HA ASP 20 -0.198 -13.246 4.860 133 HB2 ASP 20 HB2 ASP 20 0.318 -16.040 3.838 134 HB3 ASP 20 HB3 ASP 20 -0.514 -15.572 5.319 135 H GLY 21 H GLY 21 2.522 -14.012 2.925 136 HA2 GLY 21 HA2 GLY 21 4.695 -13.363 3.838 137 HA3 GLY 21 HA3 GLY 21 4.196 -14.090 5.357 138 H THR 22 H THR 22 3.386 -15.734 2.438 139 HA THR 22 HA THR 22 5.309 -17.836 3.130 140 HB THR 22 HB THR 22 2.888 -17.935 1.320 141 HG1 THR 22 HG1 THR 22 1.878 -18.365 3.120 142 HG21 THR 22 HG21 THR 22 4.762 -20.132 2.207 143 HG22 THR 22 HG22 THR 22 4.597 -19.498 0.569 144 HG23 THR 22 HG23 THR 22 3.259 -20.370 1.316 145 H PHE 23 H PHE 23 7.194 -17.648 2.105 146 HA PHE 23 HA PHE 23 7.719 -16.210 -0.204 147 HB2 PHE 23 HB2 PHE 23 9.833 -17.426 -0.317 148 HB3 PHE 23 HB3 PHE 23 9.460 -17.005 1.351 149 HD1 PHE 23 HD1 PHE 23 8.605 -18.758 2.896 150 HD2 PHE 23 HD2 PHE 23 10.072 -19.672 -0.994 151 HE1 PHE 23 HE1 PHE 23 8.858 -21.117 3.549 152 HE2 PHE 23 HE2 PHE 23 10.326 -22.032 -0.348 153 HZ PHE 23 HZ PHE 23 9.718 -22.758 1.926 154 H ILE 24 H ILE 24 7.497 -16.564 -2.328 155 HA ILE 24 HA ILE 24 6.120 -18.973 -3.179 156 HB ILE 24 HB ILE 24 6.957 -16.651 -4.910 157 HG12 ILE 24 HG12 ILE 24 5.624 -15.815 -3.028 158 HG13 ILE 24 HG13 ILE 24 4.711 -15.728 -4.530 159 HG21 ILE 24 HG21 ILE 24 5.671 -19.133 -5.421 160 HG22 ILE 24 HG22 ILE 24 4.501 -17.839 -5.678 161 HG23 ILE 24 HG23 ILE 24 6.034 -17.827 -6.549 162 HD11 ILE 24 HD11 ILE 24 4.381 -17.667 -2.267 163 HD12 ILE 24 HD12 ILE 24 3.214 -16.505 -2.900 164 HD13 ILE 24 HD13 ILE 24 3.656 -17.921 -3.854 165 H CYS 25 H CYS 25 8.884 -17.148 -4.512 166 HA CYS 25 HA CYS 25 10.696 -19.273 -4.533 167 HB2 CYS 25 HB2 CYS 25 10.655 -19.671 -7.071 168 HB3 CYS 25 HB3 CYS 25 9.417 -20.465 -6.104 169 H GLU 26 H GLU 26 12.575 -18.839 -6.042 170 HA GLU 26 HA GLU 26 12.782 -16.014 -6.795 171 HB2 GLU 26 HB2 GLU 26 15.138 -16.065 -5.788 172 HB3 GLU 26 HB3 GLU 26 13.785 -15.919 -4.676 173 HG2 GLU 26 HG2 GLU 26 15.374 -17.468 -3.781 174 HG3 GLU 26 HG3 GLU 26 13.918 -18.344 -4.247 175 H GLY 27 H GLY 27 15.026 -15.669 -7.909 176 HA2 GLY 27 HA2 GLY 27 16.315 -16.113 -9.755 177 HA3 GLY 27 HA3 GLY 27 16.383 -17.764 -9.156 178 H GLU 28 H GLU 28 14.214 -15.548 -10.904 179 HA GLU 28 HA GLU 28 13.218 -17.865 -12.422 180 HB2 GLU 28 HB2 GLU 28 11.270 -16.443 -12.974 181 HB3 GLU 28 HB3 GLU 28 11.452 -16.702 -11.245 182 HG2 GLU 28 HG2 GLU 28 12.648 -14.270 -12.475 183 HG3 GLU 28 HG3 GLU 28 10.907 -14.332 -12.201 184 H SER 29 H SER 29 12.274 -16.906 -14.664 185 HA SER 29 HA SER 29 14.566 -16.330 -16.215 186 HB2 SER 29 HB2 SER 29 11.751 -15.883 -17.182 187 HB3 SER 29 HB3 SER 29 13.154 -16.442 -18.093 188 HG SER 29 HG SER 29 13.005 -18.295 -16.474 189 H ASP 30 H ASP 30 14.718 -14.472 -17.742 190 HA ASP 30 HA ASP 30 14.493 -12.009 -16.262 191 HB2 ASP 30 HB2 ASP 30 15.928 -12.958 -18.640 192 HB3 ASP 30 HB3 ASP 30 15.360 -11.295 -18.770 193 HA PRO 31 HA PRO 31 10.825 -10.353 -18.005 194 HB2 PRO 31 HB2 PRO 31 11.467 -7.735 -18.322 195 HB3 PRO 31 HB3 PRO 31 11.191 -8.471 -16.739 196 HG2 PRO 31 HG2 PRO 31 13.776 -7.880 -18.128 197 HG3 PRO 31 HG3 PRO 31 13.338 -7.633 -16.427 198 HD2 PRO 31 HD2 PRO 31 14.810 -9.747 -17.261 199 HD3 PRO 31 HD3 PRO 31 13.692 -9.845 -15.885 200 H ASN 32 H ASN 32 13.823 -9.626 -19.714 201 HA ASN 32 HA ASN 32 12.820 -8.564 -22.067 202 HB2 ASN 32 HB2 ASN 32 15.283 -10.047 -21.315 203 HB3 ASN 32 HB3 ASN 32 14.919 -9.928 -23.034 204 HD21 ASN 32 HD21 ASN 32 15.607 -8.130 -20.121 205 HD22 ASN 32 HD22 ASN 32 16.079 -6.665 -20.906 206 H ASN 33 H ASN 33 13.552 -11.988 -21.387 207 HA ASN 33 HA ASN 33 11.362 -12.777 -23.138 208 HB2 ASN 33 HB2 ASN 33 13.426 -12.663 -24.557 209 HB3 ASN 33 HB3 ASN 33 14.145 -13.895 -23.525 210 HD21 ASN 33 HD21 ASN 33 12.690 -13.450 -26.376 211 HD22 ASN 33 HD22 ASN 33 11.963 -15.001 -26.602 212 HA PRO 34 HA PRO 34 11.743 -15.284 -19.252 213 HB2 PRO 34 HB2 PRO 34 9.110 -15.115 -18.611 214 HB3 PRO 34 HB3 PRO 34 10.296 -13.894 -18.133 215 HG2 PRO 34 HG2 PRO 34 8.357 -13.860 -20.414 216 HG3 PRO 34 HG3 PRO 34 8.782 -12.559 -19.287 217 HD2 PRO 34 HD2 PRO 34 9.807 -12.712 -21.788 218 HD3 PRO 34 HD3 PRO 34 10.718 -12.036 -20.423 219 H LYS 35 H LYS 35 11.011 -17.398 -18.886 220 HA LYS 35 HA LYS 35 10.316 -18.865 -21.229 221 HB2 LYS 35 HB2 LYS 35 10.401 -19.781 -18.348 222 HB3 LYS 35 HB3 LYS 35 10.351 -20.828 -19.760 223 HG2 LYS 35 HG2 LYS 35 12.533 -20.338 -20.363 224 HG3 LYS 35 HG3 LYS 35 12.560 -18.841 -19.429 225 HD2 LYS 35 HD2 LYS 35 13.898 -20.457 -18.277 226 HD3 LYS 35 HD3 LYS 35 12.414 -20.221 -17.352 227 HE2 LYS 35 HE2 LYS 35 12.881 -22.567 -17.434 228 HE3 LYS 35 HE3 LYS 35 11.482 -22.248 -18.459 229 HZ1 LYS 35 HZ1 LYS 35 14.177 -22.301 -19.639 230 HZ2 LYS 35 HZ2 LYS 35 12.684 -22.621 -20.368 231 HZ3 LYS 35 HZ3 LYS 35 13.375 -23.756 -19.320 232 H ALA 36 H ALA 36 8.573 -20.789 -20.545 233 HA ALA 36 HA ALA 36 6.079 -19.719 -21.027 234 HB1 ALA 36 HB1 ALA 36 5.672 -21.880 -21.309 235 HB2 ALA 36 HB2 ALA 36 7.152 -22.302 -20.447 236 HB3 ALA 36 HB3 ALA 36 5.645 -22.083 -19.557 237 H CYS 37 H CYS 37 5.151 -18.190 -19.811 238 HA CYS 37 HA CYS 37 4.584 -18.822 -17.014 239 HB2 CYS 37 HB2 CYS 37 5.964 -16.328 -17.990 240 HB3 CYS 37 HB3 CYS 37 5.079 -16.365 -16.468 241 HA PRO 38 HA PRO 38 0.579 -17.259 -17.893 242 HB2 PRO 38 HB2 PRO 38 -0.131 -16.186 -15.503 243 HB3 PRO 38 HB3 PRO 38 -0.026 -17.928 -15.780 244 HG2 PRO 38 HG2 PRO 38 1.955 -16.092 -14.489 245 HG3 PRO 38 HG3 PRO 38 1.440 -17.713 -13.987 246 HD2 PRO 38 HD2 PRO 38 3.761 -17.266 -15.309 247 HD3 PRO 38 HD3 PRO 38 2.822 -18.760 -15.507 248 H ARG 39 H ARG 39 -0.527 -15.412 -18.485 249 HA ARG 39 HA ARG 39 1.069 -12.997 -18.650 250 HB2 ARG 39 HB2 ARG 39 -1.340 -14.067 -19.997 251 HB3 ARG 39 HB3 ARG 39 -1.260 -12.318 -19.834 252 HG2 ARG 39 HG2 ARG 39 -0.349 -12.965 -21.958 253 HG3 ARG 39 HG3 ARG 39 0.950 -12.351 -20.932 254 HD2 ARG 39 HD2 ARG 39 0.583 -15.208 -20.622 255 HD3 ARG 39 HD3 ARG 39 0.907 -14.767 -22.298 256 HE ARG 39 HE ARG 39 2.698 -13.522 -20.437 257 HH11 ARG 39 HH11 ARG 39 2.064 -16.407 -22.279 258 HH12 ARG 39 HH12 ARG 39 3.723 -16.905 -22.316 259 HH21 ARG 39 HH21 ARG 39 4.886 -14.167 -20.479 260 HH22 ARG 39 HH22 ARG 39 5.327 -15.631 -21.291 261 H ASN 40 H ASN 40 -1.955 -14.077 -17.179 262 HA ASN 40 HA ASN 40 -2.972 -11.683 -16.264 263 HB2 ASN 40 HB2 ASN 40 -3.980 -13.034 -14.402 264 HB3 ASN 40 HB3 ASN 40 -4.244 -13.705 -16.009 265 HD21 ASN 40 HD21 ASN 40 -3.740 -15.755 -16.330 266 HD22 ASN 40 HD22 ASN 40 -2.779 -16.734 -15.280 267 H CYS 41 H CYS 41 -3.038 -10.958 -13.926 268 HA CYS 41 HA CYS 41 -0.301 -10.560 -13.036 269 HB2 CYS 41 HB2 CYS 41 -2.550 -8.940 -13.095 270 HB3 CYS 41 HB3 CYS 41 -2.384 -9.350 -11.390 271 H ASP 42 H ASP 42 0.382 -10.899 -10.864 272 HA ASP 42 HA ASP 42 -1.072 -13.089 -9.539 273 HB2 ASP 42 HB2 ASP 42 1.795 -12.536 -9.994 274 HB3 ASP 42 HB3 ASP 42 1.389 -13.159 -8.397 275 HA PRO 43 HA PRO 43 -1.623 -9.559 -6.661 276 HB2 PRO 43 HB2 PRO 43 -4.032 -10.414 -5.748 277 HB3 PRO 43 HB3 PRO 43 -3.848 -9.464 -7.226 278 HG2 PRO 43 HG2 PRO 43 -4.191 -12.421 -6.905 279 HG3 PRO 43 HG3 PRO 43 -4.951 -11.327 -8.076 280 HD2 PRO 43 HD2 PRO 43 -2.837 -12.897 -8.708 281 HD3 PRO 43 HD3 PRO 43 -3.097 -11.303 -9.446 282 H ASN 44 H ASN 44 -1.283 -12.926 -6.355 283 HA ASN 44 HA ASN 44 -1.685 -13.207 -3.560 284 HB2 ASN 44 HB2 ASN 44 -0.517 -15.352 -3.812 285 HB3 ASN 44 HB3 ASN 44 -1.716 -15.132 -5.082 286 HD21 ASN 44 HD21 ASN 44 1.186 -16.351 -4.576 287 HD22 ASN 44 HD22 ASN 44 1.942 -16.063 -6.103 288 H ILE 45 H ILE 45 1.018 -12.216 -5.535 289 HA ILE 45 HA ILE 45 2.899 -12.342 -3.333 290 HB ILE 45 HB ILE 45 3.166 -11.353 -6.169 291 HG12 ILE 45 HG12 ILE 45 5.016 -13.381 -5.575 292 HG13 ILE 45 HG13 ILE 45 3.502 -13.899 -4.842 293 HG21 ILE 45 HG21 ILE 45 5.609 -11.192 -5.648 294 HG22 ILE 45 HG22 ILE 45 4.606 -9.971 -4.868 295 HG23 ILE 45 HG23 ILE 45 5.192 -11.352 -3.942 296 HD11 ILE 45 HD11 ILE 45 3.188 -12.875 -7.551 297 HD12 ILE 45 HD12 ILE 45 4.230 -14.294 -7.439 298 HD13 ILE 45 HD13 ILE 45 2.582 -14.359 -6.816 299 H ALA 46 H ALA 46 3.221 -10.768 -1.914 300 HA ALA 46 HA ALA 46 1.802 -8.306 -2.051 301 HB1 ALA 46 HB1 ALA 46 3.990 -8.291 -0.156 302 HB2 ALA 46 HB2 ALA 46 2.250 -8.213 0.127 303 HB3 ALA 46 HB3 ALA 46 3.044 -9.777 -0.055 304 H TYR 47 H TYR 47 5.285 -9.062 -2.173 305 HA TYR 47 HA TYR 47 5.763 -7.025 -4.125 306 HB2 TYR 47 HB2 TYR 47 7.361 -5.725 -2.681 307 HB3 TYR 47 HB3 TYR 47 5.664 -5.528 -2.259 308 HD1 TYR 47 HD1 TYR 47 8.627 -7.611 -1.344 309 HD2 TYR 47 HD2 TYR 47 5.045 -5.724 -0.038 310 HE1 TYR 47 HE1 TYR 47 9.136 -8.263 0.972 311 HE2 TYR 47 HE2 TYR 47 5.544 -6.369 2.282 312 HH TYR 47 HH TYR 47 7.285 -7.065 3.666 313 H SER 48 H SER 48 8.149 -6.826 -4.594 314 HA SER 48 HA SER 48 9.356 -9.486 -4.366 315 HB2 SER 48 HB2 SER 48 10.356 -9.132 -6.403 316 HB3 SER 48 HB3 SER 48 8.964 -8.065 -6.591 317 HG SER 48 HG SER 48 11.481 -7.400 -6.761 318 H LEU 49 H LEU 49 11.556 -9.749 -3.811 319 HA LEU 49 HA LEU 49 12.749 -7.466 -2.384 320 HB2 LEU 49 HB2 LEU 49 12.757 -10.365 -1.559 321 HB3 LEU 49 HB3 LEU 49 13.661 -9.082 -0.756 322 HG LEU 49 HG LEU 49 11.788 -9.432 0.599 323 HD11 LEU 49 HD11 LEU 49 10.562 -7.262 -0.992 324 HD12 LEU 49 HD12 LEU 49 12.223 -7.017 -0.453 325 HD13 LEU 49 HD13 LEU 49 10.951 -7.333 0.727 326 HD21 LEU 49 HD21 LEU 49 9.644 -9.940 -0.086 327 HD22 LEU 49 HD22 LEU 49 10.616 -10.718 -1.335 328 HD23 LEU 49 HD23 LEU 49 9.847 -9.163 -1.657 329 H CYS 50 H CYS 50 14.297 -6.866 -3.804 330 HA CYS 50 HA CYS 50 16.141 -8.946 -4.776 331 HB2 CYS 50 HB2 CYS 50 15.830 -6.164 -5.906 332 HB3 CYS 50 HB3 CYS 50 16.656 -7.536 -6.635 Start of MODEL 5 1 H1 ASN 1 H ASN 1 2.152 -0.491 0.315 2 HA ASN 1 HA ASN 1 1.185 0.793 -2.143 3 HB2 ASN 1 HB2 ASN 1 4.000 0.579 -1.164 4 HB3 ASN 1 HB3 ASN 1 3.699 0.452 -2.895 5 HD21 ASN 1 HD21 ASN 1 4.748 2.366 -3.352 6 HD22 ASN 1 HD22 ASN 1 4.084 3.909 -2.949 7 H ARG 2 H ARG 2 -0.089 -1.156 -2.314 8 HA ARG 2 HA ARG 2 0.926 -3.749 -2.365 9 HB2 ARG 2 HB2 ARG 2 -1.405 -2.544 -3.863 10 HB3 ARG 2 HB3 ARG 2 -1.071 -4.269 -3.793 11 HG2 ARG 2 HG2 ARG 2 -1.145 -3.940 -1.231 12 HG3 ARG 2 HG3 ARG 2 -1.978 -2.434 -1.618 13 HD2 ARG 2 HD2 ARG 2 -3.633 -3.712 -2.918 14 HD3 ARG 2 HD3 ARG 2 -2.814 -5.206 -2.464 15 HE ARG 2 HE ARG 2 -3.403 -3.954 -0.094 16 HH11 ARG 2 HH11 ARG 2 -5.211 -5.087 -2.845 17 HH12 ARG 2 HH12 ARG 2 -6.642 -5.427 -1.929 18 HH21 ARG 2 HH21 ARG 2 -5.280 -4.397 1.123 19 HH22 ARG 2 HH22 ARG 2 -6.680 -5.033 0.328 20 H LEU 3 H LEU 3 1.929 -4.985 -3.866 21 HA LEU 3 HA LEU 3 2.714 -3.648 -6.367 22 HB2 LEU 3 HB2 LEU 3 4.366 -4.578 -4.501 23 HB3 LEU 3 HB3 LEU 3 4.128 -6.073 -5.404 24 HG LEU 3 HG LEU 3 5.103 -3.500 -6.637 25 HD11 LEU 3 HD11 LEU 3 6.519 -4.892 -4.813 26 HD12 LEU 3 HD12 LEU 3 7.240 -4.021 -6.166 27 HD13 LEU 3 HD13 LEU 3 6.958 -5.757 -6.287 28 HD21 LEU 3 HD21 LEU 3 5.971 -5.383 -8.273 29 HD22 LEU 3 HD22 LEU 3 4.346 -4.712 -8.418 30 HD23 LEU 3 HD23 LEU 3 4.592 -6.261 -7.611 31 H CYS 4 H CYS 4 2.376 -4.613 -8.312 32 HA CYS 4 HA CYS 4 0.875 -7.148 -8.272 33 HB2 CYS 4 HB2 CYS 4 -0.107 -4.842 -9.168 34 HB3 CYS 4 HB3 CYS 4 0.751 -5.326 -10.628 35 H THR 5 H THR 5 2.264 -8.739 -8.731 36 HA THR 5 HA THR 5 3.431 -8.933 -11.308 37 HB THR 5 HB THR 5 5.107 -7.421 -10.363 38 HG1 THR 5 HG1 THR 5 6.621 -8.553 -11.328 39 HG21 THR 5 HG21 THR 5 4.663 -8.406 -7.974 40 HG22 THR 5 HG22 THR 5 6.257 -7.779 -8.394 41 HG23 THR 5 HG23 THR 5 5.960 -9.517 -8.413 42 H ASN 6 H ASN 6 4.752 -10.951 -11.532 43 HA ASN 6 HA ASN 6 3.977 -12.956 -9.518 44 HB2 ASN 6 HB2 ASN 6 2.583 -13.154 -11.549 45 HB3 ASN 6 HB3 ASN 6 4.041 -13.350 -12.518 46 HD21 ASN 6 HD21 ASN 6 3.298 -15.369 -13.226 47 HD22 ASN 6 HD22 ASN 6 3.371 -16.764 -12.209 48 H CYS 7 H CYS 7 5.452 -14.568 -9.058 49 HA CYS 7 HA CYS 7 8.169 -13.949 -9.281 50 HB2 CYS 7 HB2 CYS 7 7.408 -15.372 -7.500 51 HB3 CYS 7 HB3 CYS 7 6.785 -16.557 -8.644 52 H CYS 8 H CYS 8 6.088 -15.968 -11.263 53 HA CYS 8 HA CYS 8 8.128 -17.205 -12.782 54 HB2 CYS 8 HB2 CYS 8 5.650 -17.859 -12.593 55 HB3 CYS 8 HB3 CYS 8 5.357 -16.620 -13.809 56 H ALA 9 H ALA 9 5.993 -14.458 -13.564 57 HA ALA 9 HA ALA 9 7.755 -13.740 -15.782 58 HB1 ALA 9 HB1 ALA 9 5.326 -13.824 -16.174 59 HB2 ALA 9 HB2 ALA 9 5.106 -12.540 -14.984 60 HB3 ALA 9 HB3 ALA 9 6.000 -12.221 -16.470 61 H GLY 10 H GLY 10 8.651 -13.394 -13.038 62 HA2 GLY 10 HA2 GLY 10 8.486 -10.561 -12.472 63 HA3 GLY 10 HA3 GLY 10 9.400 -11.757 -11.565 64 H ARG 11 H ARG 11 11.459 -11.155 -11.518 65 HA ARG 11 HA ARG 11 12.784 -10.543 -14.058 66 HB2 ARG 11 HB2 ARG 11 13.020 -8.886 -11.540 67 HB3 ARG 11 HB3 ARG 11 14.061 -8.716 -12.947 68 HG2 ARG 11 HG2 ARG 11 11.142 -8.538 -13.400 69 HG3 ARG 11 HG3 ARG 11 11.918 -7.199 -12.553 70 HD2 ARG 11 HD2 ARG 11 13.217 -8.218 -15.020 71 HD3 ARG 11 HD3 ARG 11 11.732 -7.286 -15.201 72 HE ARG 11 HE ARG 11 14.305 -6.277 -14.537 73 HH11 ARG 11 HH11 ARG 11 10.905 -5.813 -13.954 74 HH12 ARG 11 HH12 ARG 11 11.063 -4.124 -13.602 75 HH21 ARG 11 HH21 ARG 11 14.526 -4.055 -14.075 76 HH22 ARG 11 HH22 ARG 11 13.123 -3.125 -13.671 77 H LYS 12 H LYS 12 14.606 -11.660 -14.304 78 HA LYS 12 HA LYS 12 15.476 -13.589 -12.499 79 HB2 LYS 12 HB2 LYS 12 15.987 -13.577 -14.927 80 HB3 LYS 12 HB3 LYS 12 17.113 -12.252 -14.662 81 HG2 LYS 12 HG2 LYS 12 18.724 -13.617 -13.946 82 HG3 LYS 12 HG3 LYS 12 17.613 -14.552 -12.942 83 HD2 LYS 12 HD2 LYS 12 17.344 -16.131 -14.515 84 HD3 LYS 12 HD3 LYS 12 17.234 -14.946 -15.818 85 HE2 LYS 12 HE2 LYS 12 19.693 -14.694 -15.741 86 HE3 LYS 12 HE3 LYS 12 19.759 -15.955 -14.511 87 HZ1 LYS 12 HZ1 LYS 12 18.761 -17.489 -16.112 88 HZ2 LYS 12 HZ2 LYS 12 20.230 -16.869 -16.677 89 HZ3 LYS 12 HZ3 LYS 12 18.769 -16.277 -17.293 90 H GLY 13 H GLY 13 16.318 -13.291 -10.546 91 HA2 GLY 13 HA2 GLY 13 18.315 -12.670 -9.306 92 HA3 GLY 13 HA3 GLY 13 18.346 -11.171 -10.223 93 H CYS 14 H CYS 14 15.442 -12.569 -8.833 94 HA CYS 14 HA CYS 14 15.497 -10.686 -6.610 95 HB2 CYS 14 HB2 CYS 14 13.542 -10.581 -8.887 96 HB3 CYS 14 HB3 CYS 14 13.054 -10.065 -7.276 97 H ASN 15 H ASN 15 13.154 -10.935 -5.480 98 HA ASN 15 HA ASN 15 12.402 -13.765 -5.455 99 HB2 ASN 15 HB2 ASN 15 14.014 -13.665 -3.691 100 HB3 ASN 15 HB3 ASN 15 13.324 -12.172 -3.061 101 HD21 ASN 15 HD21 ASN 15 11.969 -15.309 -4.019 102 HD22 ASN 15 HD22 ASN 15 11.140 -15.596 -2.531 103 H TYR 16 H TYR 16 10.295 -14.177 -4.817 104 HA TYR 16 HA TYR 16 8.631 -11.856 -4.130 105 HB2 TYR 16 HB2 TYR 16 7.934 -13.923 -6.226 106 HB3 TYR 16 HB3 TYR 16 6.901 -12.597 -5.702 107 HD1 TYR 16 HD1 TYR 16 7.088 -10.465 -6.682 108 HD2 TYR 16 HD2 TYR 16 10.119 -13.368 -7.382 109 HE1 TYR 16 HE1 TYR 16 8.076 -9.011 -8.402 110 HE2 TYR 16 HE2 TYR 16 11.116 -11.921 -9.103 111 HH TYR 16 HH TYR 16 9.611 -9.502 -10.567 112 H TYR 17 H TYR 17 7.301 -12.222 -2.477 113 HA TYR 17 HA TYR 17 6.750 -15.020 -1.730 114 HB2 TYR 17 HB2 TYR 17 7.125 -14.573 0.496 115 HB3 TYR 17 HB3 TYR 17 8.284 -13.470 -0.238 116 HD1 TYR 17 HD1 TYR 17 7.042 -11.106 -0.915 117 HD2 TYR 17 HD2 TYR 17 5.986 -13.699 2.289 118 HE1 TYR 17 HE1 TYR 17 5.993 -9.217 0.259 119 HE2 TYR 17 HE2 TYR 17 4.932 -11.817 3.472 120 HH TYR 17 HH TYR 17 4.986 -9.423 3.538 121 H SER 18 H SER 18 4.722 -15.428 -0.683 122 HA SER 18 HA SER 18 2.545 -14.124 -1.921 123 HB2 SER 18 HB2 SER 18 2.620 -16.522 -1.077 124 HB3 SER 18 HB3 SER 18 2.370 -15.867 0.541 125 HG SER 18 HG SER 18 0.470 -16.531 -0.890 126 H ALA 19 H ALA 19 0.583 -13.688 -0.169 127 HA ALA 19 HA ALA 19 1.396 -11.214 1.084 128 HB1 ALA 19 HB1 ALA 19 -0.750 -11.592 -0.245 129 HB2 ALA 19 HB2 ALA 19 -1.358 -12.405 1.198 130 HB3 ALA 19 HB3 ALA 19 -0.884 -10.708 1.276 131 H ASP 20 H ASP 20 -0.015 -14.302 2.128 132 HA ASP 20 HA ASP 20 -0.207 -13.684 4.862 133 HB2 ASP 20 HB2 ASP 20 -1.148 -15.703 3.478 134 HB3 ASP 20 HB3 ASP 20 0.369 -16.475 3.934 135 H GLY 21 H GLY 21 2.505 -14.380 2.889 136 HA2 GLY 21 HA2 GLY 21 4.680 -13.768 3.836 137 HA3 GLY 21 HA3 GLY 21 4.183 -14.583 5.312 138 H THR 22 H THR 22 3.369 -16.057 2.305 139 HA THR 22 HA THR 22 5.299 -18.191 2.869 140 HB THR 22 HB THR 22 2.866 -18.193 1.072 141 HG1 THR 22 HG1 THR 22 1.846 -18.883 2.792 142 HG21 THR 22 HG21 THR 22 3.423 -20.784 1.392 143 HG22 THR 22 HG22 THR 22 5.063 -20.142 1.499 144 HG23 THR 22 HG23 THR 22 4.086 -19.833 0.064 145 H PHE 23 H PHE 23 7.189 -17.823 1.877 146 HA PHE 23 HA PHE 23 7.670 -16.299 -0.373 147 HB2 PHE 23 HB2 PHE 23 9.811 -17.482 -0.552 148 HB3 PHE 23 HB3 PHE 23 9.445 -17.093 1.125 149 HD1 PHE 23 HD1 PHE 23 8.677 -18.875 2.664 150 HD2 PHE 23 HD2 PHE 23 10.043 -19.722 -1.277 151 HE1 PHE 23 HE1 PHE 23 8.979 -21.238 3.280 152 HE2 PHE 23 HE2 PHE 23 10.345 -22.086 -0.668 153 HZ PHE 23 HZ PHE 23 9.812 -22.847 1.612 154 H ILE 24 H ILE 24 7.564 -16.594 -2.530 155 HA ILE 24 HA ILE 24 6.208 -18.986 -3.483 156 HB ILE 24 HB ILE 24 7.009 -16.591 -5.127 157 HG12 ILE 24 HG12 ILE 24 5.675 -15.846 -3.197 158 HG13 ILE 24 HG13 ILE 24 4.775 -15.683 -4.701 159 HG21 ILE 24 HG21 ILE 24 5.710 -19.067 -5.692 160 HG22 ILE 24 HG22 ILE 24 4.567 -17.748 -5.942 161 HG23 ILE 24 HG23 ILE 24 6.112 -17.749 -6.793 162 HD11 ILE 24 HD11 ILE 24 4.436 -17.780 -2.578 163 HD12 ILE 24 HD12 ILE 24 3.290 -16.530 -3.063 164 HD13 ILE 24 HD13 ILE 24 3.665 -17.858 -4.161 165 H CYS 25 H CYS 25 8.951 -17.049 -4.698 166 HA CYS 25 HA CYS 25 10.799 -19.140 -4.801 167 HB2 CYS 25 HB2 CYS 25 10.797 -19.401 -7.361 168 HB3 CYS 25 HB3 CYS 25 9.568 -20.272 -6.450 169 H GLU 26 H GLU 26 12.701 -18.596 -6.226 170 HA GLU 26 HA GLU 26 12.865 -15.748 -6.884 171 HB2 GLU 26 HB2 GLU 26 15.158 -15.727 -5.768 172 HB3 GLU 26 HB3 GLU 26 13.758 -15.703 -4.704 173 HG2 GLU 26 HG2 GLU 26 14.020 -18.025 -4.197 174 HG3 GLU 26 HG3 GLU 26 15.290 -18.193 -5.408 175 H GLY 27 H GLY 27 15.053 -15.277 -7.968 176 HA2 GLY 27 HA2 GLY 27 16.356 -15.621 -9.829 177 HA3 GLY 27 HA3 GLY 27 16.653 -17.209 -9.136 178 H GLU 28 H GLU 28 14.286 -15.404 -11.077 179 HA GLU 28 HA GLU 28 13.537 -17.931 -12.380 180 HB2 GLU 28 HB2 GLU 28 11.495 -16.815 -13.084 181 HB3 GLU 28 HB3 GLU 28 11.689 -16.676 -11.343 182 HG2 GLU 28 HG2 GLU 28 12.810 -14.457 -12.904 183 HG3 GLU 28 HG3 GLU 28 11.057 -14.627 -12.981 184 H SER 29 H SER 29 12.580 -17.224 -14.739 185 HA SER 29 HA SER 29 14.851 -16.800 -16.325 186 HB2 SER 29 HB2 SER 29 12.486 -17.841 -16.877 187 HB3 SER 29 HB3 SER 29 12.129 -16.200 -17.414 188 HG SER 29 HG SER 29 13.873 -16.339 -18.842 189 H ASP 30 H ASP 30 15.090 -15.058 -17.973 190 HA ASP 30 HA ASP 30 15.021 -12.497 -16.660 191 HB2 ASP 30 HB2 ASP 30 16.374 -13.684 -18.964 192 HB3 ASP 30 HB3 ASP 30 15.854 -12.026 -19.253 193 HA PRO 31 HA PRO 31 11.411 -10.752 -18.435 194 HB2 PRO 31 HB2 PRO 31 12.188 -8.200 -18.938 195 HB3 PRO 31 HB3 PRO 31 11.909 -8.815 -17.304 196 HG2 PRO 31 HG2 PRO 31 14.489 -8.462 -18.780 197 HG3 PRO 31 HG3 PRO 31 14.105 -8.082 -17.092 198 HD2 PRO 31 HD2 PRO 31 15.439 -10.325 -17.812 199 HD3 PRO 31 HD3 PRO 31 14.350 -10.270 -16.411 200 H ASN 32 H ASN 32 14.402 -10.326 -20.248 201 HA ASN 32 HA ASN 32 13.419 -9.351 -22.645 202 HB2 ASN 32 HB2 ASN 32 15.655 -11.361 -22.292 203 HB3 ASN 32 HB3 ASN 32 15.404 -10.325 -23.694 204 HD21 ASN 32 HD21 ASN 32 15.482 -7.989 -23.309 205 HD22 ASN 32 HD22 ASN 32 16.578 -7.388 -22.116 206 H ASN 33 H ASN 33 13.922 -12.769 -21.758 207 HA ASN 33 HA ASN 33 11.633 -13.508 -23.399 208 HB2 ASN 33 HB2 ASN 33 14.451 -14.441 -23.909 209 HB3 ASN 33 HB3 ASN 33 13.061 -15.409 -24.392 210 HD21 ASN 33 HD21 ASN 33 11.501 -14.396 -25.829 211 HD22 ASN 33 HD22 ASN 33 12.057 -13.240 -26.986 212 HA PRO 34 HA PRO 34 11.980 -15.806 -19.382 213 HB2 PRO 34 HB2 PRO 34 9.388 -15.420 -18.674 214 HB3 PRO 34 HB3 PRO 34 10.667 -14.258 -18.306 215 HG2 PRO 34 HG2 PRO 34 8.658 -14.224 -20.525 216 HG3 PRO 34 HG3 PRO 34 9.206 -12.891 -19.492 217 HD2 PRO 34 HD2 PRO 34 10.133 -13.259 -22.009 218 HD3 PRO 34 HD3 PRO 34 11.133 -12.569 -20.715 219 H LYS 35 H LYS 35 11.148 -17.848 -18.884 220 HA LYS 35 HA LYS 35 10.310 -19.416 -21.092 221 HB2 LYS 35 HB2 LYS 35 10.389 -20.062 -18.140 222 HB3 LYS 35 HB3 LYS 35 10.104 -21.242 -19.412 223 HG2 LYS 35 HG2 LYS 35 12.325 -20.698 -20.355 224 HG3 LYS 35 HG3 LYS 35 12.606 -19.623 -18.984 225 HD2 LYS 35 HD2 LYS 35 13.657 -21.649 -18.408 226 HD3 LYS 35 HD3 LYS 35 12.139 -21.642 -17.506 227 HE2 LYS 35 HE2 LYS 35 12.355 -23.813 -18.418 228 HE3 LYS 35 HE3 LYS 35 11.151 -22.984 -19.403 229 HZ1 LYS 35 HZ1 LYS 35 12.376 -23.529 -21.151 230 HZ2 LYS 35 HZ2 LYS 35 13.638 -24.107 -20.185 231 HZ3 LYS 35 HZ3 LYS 35 13.575 -22.469 -20.603 232 H ALA 36 H ALA 36 8.411 -21.126 -20.358 233 HA ALA 36 HA ALA 36 6.018 -19.882 -20.916 234 HB1 ALA 36 HB1 ALA 36 5.963 -22.316 -19.203 235 HB2 ALA 36 HB2 ALA 36 5.019 -21.923 -20.641 236 HB3 ALA 36 HB3 ALA 36 6.705 -22.417 -20.801 237 H CYS 37 H CYS 37 5.031 -18.331 -19.804 238 HA CYS 37 HA CYS 37 4.503 -18.741 -16.965 239 HB2 CYS 37 HB2 CYS 37 5.958 -16.368 -18.115 240 HB3 CYS 37 HB3 CYS 37 5.068 -16.259 -16.599 241 HA PRO 38 HA PRO 38 0.537 -17.120 -17.911 242 HB2 PRO 38 HB2 PRO 38 -0.114 -15.858 -15.598 243 HB3 PRO 38 HB3 PRO 38 -0.063 -17.618 -15.751 244 HG2 PRO 38 HG2 PRO 38 1.986 -15.756 -14.613 245 HG3 PRO 38 HG3 PRO 38 1.429 -17.321 -13.992 246 HD2 PRO 38 HD2 PRO 38 3.747 -17.039 -15.363 247 HD3 PRO 38 HD3 PRO 38 2.762 -18.514 -15.446 248 H ARG 39 H ARG 39 -0.764 -15.108 -18.020 249 HA ARG 39 HA ARG 39 0.978 -12.805 -18.569 250 HB2 ARG 39 HB2 ARG 39 -1.729 -13.577 -19.659 251 HB3 ARG 39 HB3 ARG 39 -0.989 -12.008 -19.947 252 HG2 ARG 39 HG2 ARG 39 0.141 -14.676 -20.766 253 HG3 ARG 39 HG3 ARG 39 -0.634 -13.499 -21.827 254 HD2 ARG 39 HD2 ARG 39 1.458 -12.775 -22.195 255 HD3 ARG 39 HD3 ARG 39 1.273 -11.973 -20.636 256 HE ARG 39 HE ARG 39 2.194 -14.525 -20.103 257 HH11 ARG 39 HH11 ARG 39 3.297 -11.706 -21.822 258 HH12 ARG 39 HH12 ARG 39 4.976 -12.036 -21.549 259 HH21 ARG 39 HH21 ARG 39 4.401 -14.970 -19.737 260 HH22 ARG 39 HH22 ARG 39 5.603 -13.893 -20.363 261 H ASN 40 H ASN 40 -2.109 -13.718 -17.089 262 HA ASN 40 HA ASN 40 -2.983 -11.245 -16.224 263 HB2 ASN 40 HB2 ASN 40 -3.405 -14.043 -15.374 264 HB3 ASN 40 HB3 ASN 40 -3.766 -12.823 -14.156 265 HD21 ASN 40 HD21 ASN 40 -5.759 -12.102 -14.157 266 HD22 ASN 40 HD22 ASN 40 -6.834 -12.073 -15.509 267 H CYS 41 H CYS 41 -3.097 -10.613 -13.811 268 HA CYS 41 HA CYS 41 -0.354 -10.291 -12.907 269 HB2 CYS 41 HB2 CYS 41 -2.515 -8.602 -12.938 270 HB3 CYS 41 HB3 CYS 41 -2.489 -9.127 -11.258 271 H ASP 42 H ASP 42 0.335 -10.741 -10.764 272 HA ASP 42 HA ASP 42 -1.161 -12.945 -9.513 273 HB2 ASP 42 HB2 ASP 42 1.736 -12.405 -9.896 274 HB3 ASP 42 HB3 ASP 42 1.263 -13.192 -8.393 275 HA PRO 43 HA PRO 43 -1.610 -9.523 -6.494 276 HB2 PRO 43 HB2 PRO 43 -4.026 -10.367 -5.587 277 HB3 PRO 43 HB3 PRO 43 -3.839 -9.364 -7.030 278 HG2 PRO 43 HG2 PRO 43 -4.236 -12.323 -6.819 279 HG3 PRO 43 HG3 PRO 43 -4.986 -11.171 -7.939 280 HD2 PRO 43 HD2 PRO 43 -2.910 -12.755 -8.653 281 HD3 PRO 43 HD3 PRO 43 -3.147 -11.130 -9.327 282 H ASN 44 H ASN 44 -1.281 -12.888 -6.327 283 HA ASN 44 HA ASN 44 -1.690 -13.299 -3.549 284 HB2 ASN 44 HB2 ASN 44 -0.141 -14.850 -5.627 285 HB3 ASN 44 HB3 ASN 44 -0.304 -15.385 -3.957 286 HD21 ASN 44 HD21 ASN 44 -1.395 -16.061 -6.839 287 HD22 ASN 44 HD22 ASN 44 -3.038 -16.479 -6.504 288 H ILE 45 H ILE 45 1.011 -12.197 -5.463 289 HA ILE 45 HA ILE 45 2.893 -12.426 -3.274 290 HB ILE 45 HB ILE 45 3.149 -11.257 -6.042 291 HG12 ILE 45 HG12 ILE 45 5.005 -13.298 -5.647 292 HG13 ILE 45 HG13 ILE 45 3.546 -13.882 -4.855 293 HG21 ILE 45 HG21 ILE 45 5.185 -11.409 -3.829 294 HG22 ILE 45 HG22 ILE 45 5.588 -11.115 -5.520 295 HG23 ILE 45 HG23 ILE 45 4.584 -9.963 -4.639 296 HD11 ILE 45 HD11 ILE 45 2.961 -12.737 -7.439 297 HD12 ILE 45 HD12 ILE 45 4.152 -14.034 -7.547 298 HD13 ILE 45 HD13 ILE 45 2.585 -14.336 -6.797 299 H ALA 46 H ALA 46 3.218 -10.932 -1.770 300 HA ALA 46 HA ALA 46 1.765 -8.487 -1.745 301 HB1 ALA 46 HB1 ALA 46 2.243 -8.507 0.428 302 HB2 ALA 46 HB2 ALA 46 3.042 -10.054 0.147 303 HB3 ALA 46 HB3 ALA 46 3.979 -8.560 0.121 304 H TYR 47 H TYR 47 5.251 -9.197 -1.983 305 HA TYR 47 HA TYR 47 5.682 -7.048 -3.813 306 HB2 TYR 47 HB2 TYR 47 7.264 -5.790 -2.318 307 HB3 TYR 47 HB3 TYR 47 5.567 -5.648 -1.873 308 HD1 TYR 47 HD1 TYR 47 8.575 -7.719 -1.087 309 HD2 TYR 47 HD2 TYR 47 4.973 -5.961 0.341 310 HE1 TYR 47 HE1 TYR 47 9.116 -8.474 1.190 311 HE2 TYR 47 HE2 TYR 47 5.505 -6.710 2.622 312 HH TYR 47 HH TYR 47 7.502 -7.336 3.936 313 H SER 48 H SER 48 8.049 -6.790 -4.305 314 HA SER 48 HA SER 48 9.314 -9.432 -4.199 315 HB2 SER 48 HB2 SER 48 10.295 -8.968 -6.227 316 HB3 SER 48 HB3 SER 48 8.863 -7.949 -6.363 317 HG SER 48 HG SER 48 10.567 -6.659 -6.871 318 H LEU 49 H LEU 49 11.505 -9.685 -3.646 319 HA LEU 49 HA LEU 49 12.680 -7.429 -2.160 320 HB2 LEU 49 HB2 LEU 49 12.752 -10.354 -1.436 321 HB3 LEU 49 HB3 LEU 49 13.628 -9.079 -0.593 322 HG LEU 49 HG LEU 49 11.771 -9.519 0.756 323 HD11 LEU 49 HD11 LEU 49 10.507 -7.320 -0.775 324 HD12 LEU 49 HD12 LEU 49 12.149 -7.062 -0.186 325 HD13 LEU 49 HD13 LEU 49 10.856 -7.451 0.949 326 HD21 LEU 49 HD21 LEU 49 9.821 -9.226 -1.492 327 HD22 LEU 49 HD22 LEU 49 9.629 -10.041 0.060 328 HD23 LEU 49 HD23 LEU 49 10.618 -10.773 -1.204 329 H CYS 50 H CYS 50 14.203 -6.756 -3.574 330 HA CYS 50 HA CYS 50 16.057 -8.768 -4.657 331 HB2 CYS 50 HB2 CYS 50 15.737 -5.926 -5.622 332 HB3 CYS 50 HB3 CYS 50 16.555 -7.256 -6.437 Start of MODEL 6 1 H1 ASN 1 H ASN 1 -2.183 1.144 -1.285 2 HA ASN 1 HA ASN 1 -1.433 0.175 -3.688 3 HB2 ASN 1 HB2 ASN 1 0.893 1.245 -3.133 4 HB3 ASN 1 HB3 ASN 1 -0.542 2.264 -3.213 5 HD21 ASN 1 HD21 ASN 1 -0.996 3.499 -1.528 6 HD22 ASN 1 HD22 ASN 1 -0.275 3.370 0.037 7 H ARG 2 H ARG 2 -0.872 -1.834 -4.215 8 HA ARG 2 HA ARG 2 1.303 -3.107 -2.698 9 HB2 ARG 2 HB2 ARG 2 -1.169 -4.486 -3.763 10 HB3 ARG 2 HB3 ARG 2 0.201 -5.290 -3.009 11 HG2 ARG 2 HG2 ARG 2 -0.296 -3.794 -0.982 12 HG3 ARG 2 HG3 ARG 2 -1.858 -3.518 -1.757 13 HD2 ARG 2 HD2 ARG 2 -0.808 -6.292 -1.323 14 HD3 ARG 2 HD3 ARG 2 -1.652 -5.427 -0.039 15 HE ARG 2 HE ARG 2 -2.825 -6.668 -2.310 16 HH11 ARG 2 HH11 ARG 2 -3.133 -3.938 -0.172 17 HH12 ARG 2 HH12 ARG 2 -4.842 -3.779 -0.409 18 HH21 ARG 2 HH21 ARG 2 -5.075 -6.469 -2.631 19 HH22 ARG 2 HH22 ARG 2 -5.945 -5.220 -1.808 20 H LEU 3 H LEU 3 2.717 -4.407 -3.891 21 HA LEU 3 HA LEU 3 3.103 -3.609 -6.591 22 HB2 LEU 3 HB2 LEU 3 4.752 -4.511 -4.704 23 HB3 LEU 3 HB3 LEU 3 4.456 -6.032 -5.543 24 HG LEU 3 HG LEU 3 5.517 -3.535 -6.862 25 HD11 LEU 3 HD11 LEU 3 6.892 -4.997 -5.053 26 HD12 LEU 3 HD12 LEU 3 7.629 -4.163 -6.421 27 HD13 LEU 3 HD13 LEU 3 7.256 -5.882 -6.535 28 HD21 LEU 3 HD21 LEU 3 4.611 -4.748 -8.586 29 HD22 LEU 3 HD22 LEU 3 4.873 -6.296 -7.783 30 HD23 LEU 3 HD23 LEU 3 6.232 -5.441 -8.515 31 H CYS 4 H CYS 4 2.663 -4.633 -8.478 32 HA CYS 4 HA CYS 4 1.112 -7.131 -8.293 33 HB2 CYS 4 HB2 CYS 4 0.172 -4.822 -9.260 34 HB3 CYS 4 HB3 CYS 4 0.942 -5.424 -10.725 35 H THR 5 H THR 5 2.453 -8.768 -8.735 36 HA THR 5 HA THR 5 3.548 -9.061 -11.341 37 HB THR 5 HB THR 5 5.295 -7.593 -10.459 38 HG1 THR 5 HG1 THR 5 7.032 -8.991 -10.932 39 HG21 THR 5 HG21 THR 5 4.860 -8.485 -8.042 40 HG22 THR 5 HG22 THR 5 6.479 -7.963 -8.506 41 HG23 THR 5 HG23 THR 5 6.084 -9.681 -8.469 42 H ASN 6 H ASN 6 4.789 -11.130 -11.550 43 HA ASN 6 HA ASN 6 3.973 -13.066 -9.485 44 HB2 ASN 6 HB2 ASN 6 2.557 -13.248 -11.508 45 HB3 ASN 6 HB3 ASN 6 4.001 -13.530 -12.475 46 HD21 ASN 6 HD21 ASN 6 3.028 -15.520 -13.105 47 HD22 ASN 6 HD22 ASN 6 3.102 -16.895 -12.062 48 H CYS 7 H CYS 7 5.414 -14.671 -8.961 49 HA CYS 7 HA CYS 7 8.136 -14.169 -9.211 50 HB2 CYS 7 HB2 CYS 7 7.334 -15.570 -7.433 51 HB3 CYS 7 HB3 CYS 7 6.668 -16.732 -8.576 52 H CYS 8 H CYS 8 5.998 -16.123 -11.199 53 HA CYS 8 HA CYS 8 7.987 -17.437 -12.710 54 HB2 CYS 8 HB2 CYS 8 5.484 -17.975 -12.557 55 HB3 CYS 8 HB3 CYS 8 5.256 -16.704 -13.754 56 H ALA 9 H ALA 9 6.001 -14.584 -13.506 57 HA ALA 9 HA ALA 9 7.828 -13.943 -15.695 58 HB1 ALA 9 HB1 ALA 9 5.215 -12.649 -14.925 59 HB2 ALA 9 HB2 ALA 9 6.155 -12.315 -16.380 60 HB3 ALA 9 HB3 ALA 9 5.421 -13.902 -16.149 61 H GLY 10 H GLY 10 8.699 -13.652 -12.937 62 HA2 GLY 10 HA2 GLY 10 8.638 -10.840 -12.306 63 HA3 GLY 10 HA3 GLY 10 9.559 -12.079 -11.468 64 H ARG 11 H ARG 11 11.570 -11.268 -11.402 65 HA ARG 11 HA ARG 11 12.860 -10.695 -13.979 66 HB2 ARG 11 HB2 ARG 11 13.423 -9.115 -11.471 67 HB3 ARG 11 HB3 ARG 11 14.003 -8.790 -13.099 68 HG2 ARG 11 HG2 ARG 11 11.211 -8.803 -13.281 69 HG3 ARG 11 HG3 ARG 11 11.599 -7.907 -11.811 70 HD2 ARG 11 HD2 ARG 11 13.167 -6.515 -13.108 71 HD3 ARG 11 HD3 ARG 11 12.701 -7.384 -14.569 72 HE ARG 11 HE ARG 11 10.339 -6.479 -13.656 73 HH11 ARG 11 HH11 ARG 11 13.402 -4.918 -14.203 74 HH12 ARG 11 HH12 ARG 11 12.700 -3.378 -14.571 75 HH21 ARG 11 HH21 ARG 11 9.402 -4.456 -14.139 76 HH22 ARG 11 HH22 ARG 11 10.424 -3.116 -14.533 77 H LYS 12 H LYS 12 14.640 -11.856 -14.282 78 HA LYS 12 HA LYS 12 15.565 -13.803 -12.560 79 HB2 LYS 12 HB2 LYS 12 16.080 -13.647 -14.993 80 HB3 LYS 12 HB3 LYS 12 17.216 -12.353 -14.637 81 HG2 LYS 12 HG2 LYS 12 17.545 -14.932 -13.204 82 HG3 LYS 12 HG3 LYS 12 17.998 -14.854 -14.908 83 HD2 LYS 12 HD2 LYS 12 18.966 -12.598 -13.316 84 HD3 LYS 12 HD3 LYS 12 19.609 -14.161 -12.807 85 HE2 LYS 12 HE2 LYS 12 19.687 -13.044 -15.609 86 HE3 LYS 12 HE3 LYS 12 21.042 -13.091 -14.481 87 HZ1 LYS 12 HZ1 LYS 12 20.037 -15.145 -16.185 88 HZ2 LYS 12 HZ2 LYS 12 20.127 -15.668 -14.579 89 HZ3 LYS 12 HZ3 LYS 12 21.507 -15.066 -15.351 90 H GLY 13 H GLY 13 16.585 -13.713 -10.675 91 HA2 GLY 13 HA2 GLY 13 18.457 -13.097 -9.334 92 HA3 GLY 13 HA3 GLY 13 18.566 -11.591 -10.231 93 H CYS 14 H CYS 14 15.581 -12.891 -8.920 94 HA CYS 14 HA CYS 14 15.657 -11.002 -6.696 95 HB2 CYS 14 HB2 CYS 14 13.670 -10.927 -8.956 96 HB3 CYS 14 HB3 CYS 14 13.257 -10.314 -7.358 97 H ASN 15 H ASN 15 13.274 -11.209 -5.607 98 HA ASN 15 HA ASN 15 12.473 -14.019 -5.561 99 HB2 ASN 15 HB2 ASN 15 14.092 -14.005 -3.814 100 HB3 ASN 15 HB3 ASN 15 13.499 -12.472 -3.182 101 HD21 ASN 15 HD21 ASN 15 12.001 -15.566 -4.072 102 HD22 ASN 15 HD22 ASN 15 11.165 -15.784 -2.575 103 H TYR 16 H TYR 16 10.364 -14.376 -4.885 104 HA TYR 16 HA TYR 16 8.776 -11.996 -4.209 105 HB2 TYR 16 HB2 TYR 16 7.975 -14.118 -6.211 106 HB3 TYR 16 HB3 TYR 16 6.991 -12.747 -5.712 107 HD1 TYR 16 HD1 TYR 16 7.254 -10.626 -6.725 108 HD2 TYR 16 HD2 TYR 16 10.099 -13.697 -7.488 109 HE1 TYR 16 HE1 TYR 16 8.235 -9.262 -8.522 110 HE2 TYR 16 HE2 TYR 16 11.089 -12.341 -9.285 111 HH TYR 16 HH TYR 16 11.223 -9.900 -9.890 112 H TYR 17 H TYR 17 7.428 -12.274 -2.546 113 HA TYR 17 HA TYR 17 6.852 -15.030 -1.674 114 HB2 TYR 17 HB2 TYR 17 7.286 -14.514 0.525 115 HB3 TYR 17 HB3 TYR 17 8.448 -13.459 -0.270 116 HD1 TYR 17 HD1 TYR 17 7.207 -11.103 -1.018 117 HD2 TYR 17 HD2 TYR 17 6.230 -13.549 2.324 118 HE1 TYR 17 HE1 TYR 17 6.218 -9.155 0.112 119 HE2 TYR 17 HE2 TYR 17 5.237 -11.608 3.462 120 HH TYR 17 HH TYR 17 5.147 -9.310 3.440 121 H SER 18 H SER 18 4.843 -15.338 -0.537 122 HA SER 18 HA SER 18 2.667 -14.028 -1.786 123 HB2 SER 18 HB2 SER 18 1.344 -15.615 -0.785 124 HB3 SER 18 HB3 SER 18 2.905 -16.418 -0.620 125 HG SER 18 HG SER 18 1.299 -15.905 1.306 126 H ALA 19 H ALA 19 0.754 -13.504 -0.001 127 HA ALA 19 HA ALA 19 1.647 -11.012 1.161 128 HB1 ALA 19 HB1 ALA 19 -0.522 -11.330 -0.104 129 HB2 ALA 19 HB2 ALA 19 -1.123 -12.169 1.327 130 HB3 ALA 19 HB3 ALA 19 -0.635 -10.478 1.437 131 H ASP 20 H ASP 20 0.207 -14.043 2.325 132 HA ASP 20 HA ASP 20 0.085 -13.347 5.042 133 HB2 ASP 20 HB2 ASP 20 0.436 -16.094 3.822 134 HB3 ASP 20 HB3 ASP 20 -0.102 -15.757 5.465 135 H GLY 21 H GLY 21 2.744 -14.136 3.034 136 HA2 GLY 21 HA2 GLY 21 4.948 -13.532 3.910 137 HA3 GLY 21 HA3 GLY 21 4.472 -14.284 5.425 138 H THR 22 H THR 22 3.570 -15.854 2.492 139 HA THR 22 HA THR 22 5.484 -17.993 3.091 140 HB THR 22 HB THR 22 3.001 -18.032 1.363 141 HG1 THR 22 HG1 THR 22 2.035 -18.555 3.164 142 HG21 THR 22 HG21 THR 22 5.077 -20.113 1.975 143 HG22 THR 22 HG22 THR 22 4.393 -19.655 0.415 144 HG23 THR 22 HG23 THR 22 3.422 -20.567 1.571 145 H PHE 23 H PHE 23 7.345 -17.737 2.023 146 HA PHE 23 HA PHE 23 7.799 -16.290 -0.285 147 HB2 PHE 23 HB2 PHE 23 9.902 -17.527 -0.488 148 HB3 PHE 23 HB3 PHE 23 9.592 -17.101 1.192 149 HD1 PHE 23 HD1 PHE 23 8.807 -18.840 2.776 150 HD2 PHE 23 HD2 PHE 23 10.073 -19.780 -1.177 151 HE1 PHE 23 HE1 PHE 23 9.065 -21.200 3.423 152 HE2 PHE 23 HE2 PHE 23 10.333 -22.141 -0.537 153 HZ PHE 23 HZ PHE 23 9.828 -22.854 1.766 154 H ILE 24 H ILE 24 7.624 -16.646 -2.428 155 HA ILE 24 HA ILE 24 6.173 -19.027 -3.266 156 HB ILE 24 HB ILE 24 6.974 -16.685 -4.988 157 HG12 ILE 24 HG12 ILE 24 5.683 -15.898 -3.040 158 HG13 ILE 24 HG13 ILE 24 4.766 -15.738 -4.534 159 HG21 ILE 24 HG21 ILE 24 6.003 -17.828 -6.621 160 HG22 ILE 24 HG22 ILE 24 5.681 -19.156 -5.506 161 HG23 ILE 24 HG23 ILE 24 4.496 -17.866 -5.705 162 HD11 ILE 24 HD11 ILE 24 4.108 -17.157 -2.138 163 HD12 ILE 24 HD12 ILE 24 3.110 -16.819 -3.552 164 HD13 ILE 24 HD13 ILE 24 4.125 -18.260 -3.513 165 H CYS 25 H CYS 25 8.924 -17.195 -4.618 166 HA CYS 25 HA CYS 25 10.713 -19.337 -4.724 167 HB2 CYS 25 HB2 CYS 25 10.623 -19.660 -7.276 168 HB3 CYS 25 HB3 CYS 25 9.403 -20.478 -6.304 169 H GLU 26 H GLU 26 12.583 -18.880 -6.219 170 HA GLU 26 HA GLU 26 12.800 -16.057 -6.963 171 HB2 GLU 26 HB2 GLU 26 15.132 -16.080 -5.910 172 HB3 GLU 26 HB3 GLU 26 13.758 -15.950 -4.821 173 HG2 GLU 26 HG2 GLU 26 15.337 -17.477 -3.888 174 HG3 GLU 26 HG3 GLU 26 13.914 -18.381 -4.401 175 H GLY 27 H GLY 27 15.073 -15.715 -8.029 176 HA2 GLY 27 HA2 GLY 27 16.358 -16.152 -9.881 177 HA3 GLY 27 HA3 GLY 27 16.496 -17.775 -9.222 178 H GLU 28 H GLU 28 14.190 -15.738 -11.017 179 HA GLU 28 HA GLU 28 13.356 -18.145 -12.491 180 HB2 GLU 28 HB2 GLU 28 11.288 -16.959 -13.008 181 HB3 GLU 28 HB3 GLU 28 11.548 -17.022 -11.271 182 HG2 GLU 28 HG2 GLU 28 12.539 -14.635 -12.718 183 HG3 GLU 28 HG3 GLU 28 10.797 -14.811 -12.518 184 H SER 29 H SER 29 12.382 -17.367 -14.754 185 HA SER 29 HA SER 29 14.539 -16.759 -16.388 186 HB2 SER 29 HB2 SER 29 11.704 -16.108 -17.172 187 HB3 SER 29 HB3 SER 29 13.016 -16.703 -18.188 188 HG SER 29 HG SER 29 11.183 -18.104 -16.846 189 H ASP 30 H ASP 30 14.735 -14.875 -17.878 190 HA ASP 30 HA ASP 30 14.667 -12.429 -16.322 191 HB2 ASP 30 HB2 ASP 30 16.085 -13.395 -18.727 192 HB3 ASP 30 HB3 ASP 30 15.701 -11.676 -18.715 193 HA PRO 31 HA PRO 31 11.172 -10.537 -18.175 194 HB2 PRO 31 HB2 PRO 31 11.974 -7.954 -18.411 195 HB3 PRO 31 HB3 PRO 31 11.591 -8.702 -16.856 196 HG2 PRO 31 HG2 PRO 31 14.261 -8.235 -18.126 197 HG3 PRO 31 HG3 PRO 31 13.767 -7.996 -16.440 198 HD2 PRO 31 HD2 PRO 31 15.150 -10.176 -17.257 199 HD3 PRO 31 HD3 PRO 31 13.972 -10.234 -15.930 200 H ASN 32 H ASN 32 14.275 -9.932 -19.743 201 HA ASN 32 HA ASN 32 13.389 -8.799 -22.124 202 HB2 ASN 32 HB2 ASN 32 15.504 -9.977 -23.080 203 HB3 ASN 32 HB3 ASN 32 15.701 -8.745 -21.837 204 HD21 ASN 32 HD21 ASN 32 16.987 -9.253 -20.229 205 HD22 ASN 32 HD22 ASN 32 17.379 -10.850 -19.700 206 H ASN 33 H ASN 33 13.712 -12.205 -21.216 207 HA ASN 33 HA ASN 33 11.734 -12.942 -23.184 208 HB2 ASN 33 HB2 ASN 33 13.929 -12.927 -24.431 209 HB3 ASN 33 HB3 ASN 33 14.465 -14.222 -23.364 210 HD21 ASN 33 HD21 ASN 33 14.673 -15.716 -24.991 211 HD22 ASN 33 HD22 ASN 33 13.318 -16.398 -25.818 212 HA PRO 34 HA PRO 34 11.730 -15.406 -19.254 213 HB2 PRO 34 HB2 PRO 34 9.063 -15.140 -18.823 214 HB3 PRO 34 HB3 PRO 34 10.248 -13.951 -18.271 215 HG2 PRO 34 HG2 PRO 34 8.494 -13.892 -20.696 216 HG3 PRO 34 HG3 PRO 34 8.874 -12.586 -19.557 217 HD2 PRO 34 HD2 PRO 34 10.084 -12.814 -21.969 218 HD3 PRO 34 HD3 PRO 34 10.909 -12.146 -20.546 219 H LYS 35 H LYS 35 10.748 -17.455 -18.854 220 HA LYS 35 HA LYS 35 10.173 -18.920 -21.268 221 HB2 LYS 35 HB2 LYS 35 10.185 -19.871 -18.397 222 HB3 LYS 35 HB3 LYS 35 10.177 -20.893 -19.828 223 HG2 LYS 35 HG2 LYS 35 12.378 -18.933 -19.602 224 HG3 LYS 35 HG3 LYS 35 12.395 -20.296 -18.481 225 HD2 LYS 35 HD2 LYS 35 11.977 -20.724 -21.419 226 HD3 LYS 35 HD3 LYS 35 13.601 -20.538 -20.753 227 HE2 LYS 35 HE2 LYS 35 11.647 -22.514 -19.619 228 HE3 LYS 35 HE3 LYS 35 12.665 -22.913 -21.002 229 HZ1 LYS 35 HZ1 LYS 35 13.804 -23.649 -19.097 230 HZ2 LYS 35 HZ2 LYS 35 13.529 -22.206 -18.259 231 HZ3 LYS 35 HZ3 LYS 35 14.595 -22.231 -19.572 232 H ALA 36 H ALA 36 8.390 -20.823 -20.594 233 HA ALA 36 HA ALA 36 5.921 -19.711 -21.113 234 HB1 ALA 36 HB1 ALA 36 5.481 -22.077 -19.609 235 HB2 ALA 36 HB2 ALA 36 5.428 -21.859 -21.359 236 HB3 ALA 36 HB3 ALA 36 6.942 -22.302 -20.571 237 H CYS 37 H CYS 37 5.103 -18.104 -19.896 238 HA CYS 37 HA CYS 37 4.405 -18.741 -17.130 239 HB2 CYS 37 HB2 CYS 37 6.002 -16.351 -18.023 240 HB3 CYS 37 HB3 CYS 37 5.035 -16.308 -16.552 241 HA PRO 38 HA PRO 38 0.542 -16.899 -18.097 242 HB2 PRO 38 HB2 PRO 38 -0.163 -15.801 -15.716 243 HB3 PRO 38 HB3 PRO 38 -0.167 -17.545 -16.009 244 HG2 PRO 38 HG2 PRO 38 1.896 -15.858 -14.644 245 HG3 PRO 38 HG3 PRO 38 1.259 -17.445 -14.174 246 HD2 PRO 38 HD2 PRO 38 3.641 -17.143 -15.426 247 HD3 PRO 38 HD3 PRO 38 2.610 -18.568 -15.666 248 H ARG 39 H ARG 39 -0.673 -14.846 -18.137 249 HA ARG 39 HA ARG 39 1.166 -12.565 -18.383 250 HB2 ARG 39 HB2 ARG 39 -1.419 -13.254 -19.761 251 HB3 ARG 39 HB3 ARG 39 -0.779 -11.617 -19.779 252 HG2 ARG 39 HG2 ARG 39 0.651 -14.061 -20.803 253 HG3 ARG 39 HG3 ARG 39 -0.183 -12.862 -21.795 254 HD2 ARG 39 HD2 ARG 39 2.287 -12.499 -20.117 255 HD3 ARG 39 HD3 ARG 39 2.119 -12.310 -21.862 256 HE ARG 39 HE ARG 39 0.406 -10.466 -20.815 257 HH11 ARG 39 HH11 ARG 39 3.797 -11.157 -20.442 258 HH12 ARG 39 HH12 ARG 39 4.231 -9.511 -20.120 259 HH21 ARG 39 HH21 ARG 39 0.964 -8.295 -20.393 260 HH22 ARG 39 HH22 ARG 39 2.618 -7.884 -20.092 261 H ASN 40 H ASN 40 -1.916 -13.598 -17.036 262 HA ASN 40 HA ASN 40 -2.935 -11.205 -16.120 263 HB2 ASN 40 HB2 ASN 40 -3.816 -13.686 -15.941 264 HB3 ASN 40 HB3 ASN 40 -3.085 -13.605 -14.341 265 HD21 ASN 40 HD21 ASN 40 -4.867 -13.571 -13.102 266 HD22 ASN 40 HD22 ASN 40 -6.073 -12.335 -13.156 267 H CYS 41 H CYS 41 -3.073 -10.563 -13.737 268 HA CYS 41 HA CYS 41 -0.356 -10.151 -12.796 269 HB2 CYS 41 HB2 CYS 41 -2.658 -8.583 -12.816 270 HB3 CYS 41 HB3 CYS 41 -2.450 -9.021 -11.123 271 H ASP 42 H ASP 42 0.363 -10.642 -10.700 272 HA ASP 42 HA ASP 42 -1.133 -12.825 -9.411 273 HB2 ASP 42 HB2 ASP 42 1.743 -12.351 -9.914 274 HB3 ASP 42 HB3 ASP 42 1.346 -13.034 -8.340 275 HA PRO 43 HA PRO 43 -1.483 -9.385 -6.398 276 HB2 PRO 43 HB2 PRO 43 -3.893 -10.193 -5.445 277 HB3 PRO 43 HB3 PRO 43 -3.718 -9.197 -6.895 278 HG2 PRO 43 HG2 PRO 43 -4.152 -12.150 -6.666 279 HG3 PRO 43 HG3 PRO 43 -4.906 -10.992 -7.776 280 HD2 PRO 43 HD2 PRO 43 -2.865 -12.607 -8.522 281 HD3 PRO 43 HD3 PRO 43 -3.092 -10.981 -9.197 282 H ASN 44 H ASN 44 -1.209 -12.758 -6.223 283 HA ASN 44 HA ASN 44 -1.564 -13.145 -3.434 284 HB2 ASN 44 HB2 ASN 44 -1.432 -14.872 -5.417 285 HB3 ASN 44 HB3 ASN 44 0.287 -14.866 -5.037 286 HD21 ASN 44 HD21 ASN 44 -0.903 -17.189 -4.771 287 HD22 ASN 44 HD22 ASN 44 -1.179 -17.591 -3.113 288 H ILE 45 H ILE 45 1.115 -12.112 -5.417 289 HA ILE 45 HA ILE 45 3.028 -12.351 -3.249 290 HB ILE 45 HB ILE 45 3.283 -11.275 -6.056 291 HG12 ILE 45 HG12 ILE 45 5.075 -13.361 -5.639 292 HG13 ILE 45 HG13 ILE 45 3.622 -13.876 -4.789 293 HG21 ILE 45 HG21 ILE 45 4.779 -9.989 -4.713 294 HG22 ILE 45 HG22 ILE 45 5.339 -11.427 -3.862 295 HG23 ILE 45 HG23 ILE 45 5.734 -11.202 -5.566 296 HD11 ILE 45 HD11 ILE 45 4.110 -14.247 -7.435 297 HD12 ILE 45 HD12 ILE 45 2.513 -14.254 -6.687 298 HD13 ILE 45 HD13 ILE 45 3.122 -12.787 -7.452 299 H ALA 46 H ALA 46 3.412 -10.822 -1.796 300 HA ALA 46 HA ALA 46 2.035 -8.333 -1.836 301 HB1 ALA 46 HB1 ALA 46 2.536 -8.300 0.332 302 HB2 ALA 46 HB2 ALA 46 3.288 -9.877 0.093 303 HB3 ALA 46 HB3 ALA 46 4.266 -8.412 0.009 304 H TYR 47 H TYR 47 5.492 -9.162 -2.097 305 HA TYR 47 HA TYR 47 5.968 -7.084 -3.996 306 HB2 TYR 47 HB2 TYR 47 7.612 -5.835 -2.555 307 HB3 TYR 47 HB3 TYR 47 5.924 -5.617 -2.105 308 HD1 TYR 47 HD1 TYR 47 8.862 -7.768 -1.268 309 HD2 TYR 47 HD2 TYR 47 5.335 -5.836 0.121 310 HE1 TYR 47 HE1 TYR 47 9.392 -8.466 1.030 311 HE2 TYR 47 HE2 TYR 47 5.856 -6.528 2.423 312 HH TYR 47 HH TYR 47 7.406 -7.431 3.768 313 H SER 48 H SER 48 8.347 -6.908 -4.504 314 HA SER 48 HA SER 48 9.523 -9.587 -4.345 315 HB2 SER 48 HB2 SER 48 10.430 -9.232 -6.410 316 HB3 SER 48 HB3 SER 48 9.119 -8.058 -6.526 317 HG SER 48 HG SER 48 10.643 -6.650 -6.811 318 H LEU 49 H LEU 49 11.704 -9.903 -3.793 319 HA LEU 49 HA LEU 49 12.968 -7.653 -2.373 320 HB2 LEU 49 HB2 LEU 49 12.934 -10.558 -1.569 321 HB3 LEU 49 HB3 LEU 49 13.863 -9.294 -0.765 322 HG LEU 49 HG LEU 49 11.998 -9.625 0.604 323 HD11 LEU 49 HD11 LEU 49 11.168 -7.519 0.745 324 HD12 LEU 49 HD12 LEU 49 10.807 -7.424 -0.979 325 HD13 LEU 49 HD13 LEU 49 12.464 -7.211 -0.411 326 HD21 LEU 49 HD21 LEU 49 10.054 -9.324 -1.649 327 HD22 LEU 49 HD22 LEU 49 9.830 -10.075 -0.069 328 HD23 LEU 49 HD23 LEU 49 10.787 -10.892 -1.306 329 H CYS 50 H CYS 50 14.507 -7.075 -3.813 330 HA CYS 50 HA CYS 50 16.262 -9.182 -4.878 331 HB2 CYS 50 HB2 CYS 50 16.096 -6.323 -5.835 332 HB3 CYS 50 HB3 CYS 50 16.841 -7.692 -6.653 Start of MODEL 7 1 H1 ASN 1 H ASN 1 4.195 -2.567 0.279 2 HA ASN 1 HA ASN 1 1.832 -1.206 -0.404 3 HB2 ASN 1 HB2 ASN 1 4.416 -1.783 -1.787 4 HB3 ASN 1 HB3 ASN 1 3.074 -1.162 -2.745 5 HD21 ASN 1 HD21 ASN 1 3.207 0.932 -3.024 6 HD22 ASN 1 HD22 ASN 1 3.767 2.086 -1.866 7 H ARG 2 H ARG 2 0.924 -1.493 -2.758 8 HA ARG 2 HA ARG 2 -0.047 -4.252 -2.900 9 HB2 ARG 2 HB2 ARG 2 -1.102 -1.775 -4.277 10 HB3 ARG 2 HB3 ARG 2 -1.866 -3.359 -4.256 11 HG2 ARG 2 HG2 ARG 2 -1.382 -1.632 -1.837 12 HG3 ARG 2 HG3 ARG 2 -2.916 -1.788 -2.696 13 HD2 ARG 2 HD2 ARG 2 -3.050 -4.123 -2.136 14 HD3 ARG 2 HD3 ARG 2 -1.436 -4.088 -1.429 15 HE ARG 2 HE ARG 2 -2.851 -2.224 -0.018 16 HH11 ARG 2 HH11 ARG 2 -3.240 -5.611 -0.721 17 HH12 ARG 2 HH12 ARG 2 -4.066 -5.957 0.762 18 HH21 ARG 2 HH21 ARG 2 -3.938 -2.667 1.938 19 HH22 ARG 2 HH22 ARG 2 -4.464 -4.282 2.273 20 H LEU 3 H LEU 3 2.359 -4.425 -3.793 21 HA LEU 3 HA LEU 3 2.782 -3.685 -6.506 22 HB2 LEU 3 HB2 LEU 3 4.395 -4.509 -4.515 23 HB3 LEU 3 HB3 LEU 3 4.239 -6.012 -5.422 24 HG LEU 3 HG LEU 3 5.310 -3.387 -6.453 25 HD11 LEU 3 HD11 LEU 3 6.894 -5.875 -6.500 26 HD12 LEU 3 HD12 LEU 3 6.617 -5.152 -4.916 27 HD13 LEU 3 HD13 LEU 3 7.393 -4.212 -6.190 28 HD21 LEU 3 HD21 LEU 3 5.925 -5.058 -8.397 29 HD22 LEU 3 HD22 LEU 3 4.372 -4.223 -8.363 30 HD23 LEU 3 HD23 LEU 3 4.486 -5.897 -7.819 31 H CYS 4 H CYS 4 2.357 -4.742 -8.362 32 HA CYS 4 HA CYS 4 1.014 -7.356 -8.144 33 HB2 CYS 4 HB2 CYS 4 -0.224 -5.217 -9.030 34 HB3 CYS 4 HB3 CYS 4 0.662 -5.557 -10.513 35 H THR 5 H THR 5 2.479 -8.872 -8.618 36 HA THR 5 HA THR 5 3.559 -9.034 -11.253 37 HB THR 5 HB THR 5 5.198 -7.473 -10.262 38 HG1 THR 5 HG1 THR 5 6.335 -8.575 -11.681 39 HG21 THR 5 HG21 THR 5 6.562 -8.032 -8.424 40 HG22 THR 5 HG22 THR 5 6.047 -9.719 -8.450 41 HG23 THR 5 HG23 THR 5 4.927 -8.463 -7.923 42 H ASN 6 H ASN 6 4.612 -11.061 -11.669 43 HA ASN 6 HA ASN 6 3.967 -13.097 -9.642 44 HB2 ASN 6 HB2 ASN 6 2.771 -13.117 -11.917 45 HB3 ASN 6 HB3 ASN 6 4.314 -13.641 -12.585 46 HD21 ASN 6 HD21 ASN 6 2.084 -15.200 -12.814 47 HD22 ASN 6 HD22 ASN 6 2.256 -16.613 -11.834 48 H CYS 7 H CYS 7 5.489 -14.555 -9.016 49 HA CYS 7 HA CYS 7 8.180 -13.916 -9.131 50 HB2 CYS 7 HB2 CYS 7 7.406 -15.397 -7.423 51 HB3 CYS 7 HB3 CYS 7 6.810 -16.555 -8.608 52 H CYS 8 H CYS 8 6.273 -15.956 -11.266 53 HA CYS 8 HA CYS 8 8.475 -17.031 -12.711 54 HB2 CYS 8 HB2 CYS 8 6.151 -18.007 -12.617 55 HB3 CYS 8 HB3 CYS 8 5.637 -16.714 -13.696 56 H ALA 9 H ALA 9 6.193 -14.388 -13.386 57 HA ALA 9 HA ALA 9 7.821 -13.557 -15.665 58 HB1 ALA 9 HB1 ALA 9 5.987 -12.032 -16.181 59 HB2 ALA 9 HB2 ALA 9 5.404 -13.685 -15.984 60 HB3 ALA 9 HB3 ALA 9 5.166 -12.507 -14.694 61 H GLY 10 H GLY 10 8.847 -13.264 -12.962 62 HA2 GLY 10 HA2 GLY 10 8.653 -10.429 -12.357 63 HA3 GLY 10 HA3 GLY 10 9.569 -11.629 -11.457 64 H ARG 11 H ARG 11 11.634 -11.051 -11.426 65 HA ARG 11 HA ARG 11 12.933 -10.402 -13.972 66 HB2 ARG 11 HB2 ARG 11 13.387 -8.853 -11.416 67 HB3 ARG 11 HB3 ARG 11 14.185 -8.577 -12.958 68 HG2 ARG 11 HG2 ARG 11 11.409 -8.459 -13.437 69 HG3 ARG 11 HG3 ARG 11 11.732 -7.506 -11.987 70 HD2 ARG 11 HD2 ARG 11 13.015 -7.205 -14.697 71 HD3 ARG 11 HD3 ARG 11 11.915 -6.076 -13.907 72 HE ARG 11 HE ARG 11 14.234 -6.539 -12.330 73 HH11 ARG 11 HH11 ARG 11 13.074 -4.818 -15.125 74 HH12 ARG 11 HH12 ARG 11 14.249 -3.552 -14.996 75 HH21 ARG 11 HH21 ARG 11 15.787 -4.878 -12.149 76 HH22 ARG 11 HH22 ARG 11 15.793 -3.588 -13.304 77 H LYS 12 H LYS 12 14.646 -11.651 -14.287 78 HA LYS 12 HA LYS 12 15.536 -13.609 -12.559 79 HB2 LYS 12 HB2 LYS 12 16.020 -13.491 -15.001 80 HB3 LYS 12 HB3 LYS 12 17.201 -12.230 -14.674 81 HG2 LYS 12 HG2 LYS 12 18.341 -13.912 -13.145 82 HG3 LYS 12 HG3 LYS 12 17.302 -15.125 -13.896 83 HD2 LYS 12 HD2 LYS 12 19.251 -15.218 -15.169 84 HD3 LYS 12 HD3 LYS 12 18.187 -14.187 -16.128 85 HE2 LYS 12 HE2 LYS 12 20.398 -13.221 -16.052 86 HE3 LYS 12 HE3 LYS 12 19.278 -12.203 -15.148 87 HZ1 LYS 12 HZ1 LYS 12 21.545 -12.733 -14.120 88 HZ2 LYS 12 HZ2 LYS 12 20.895 -14.257 -13.778 89 HZ3 LYS 12 HZ3 LYS 12 20.177 -12.867 -13.133 90 H GLY 13 H GLY 13 16.378 -13.380 -10.596 91 HA2 GLY 13 HA2 GLY 13 18.383 -12.856 -9.333 92 HA3 GLY 13 HA3 GLY 13 18.483 -11.346 -10.225 93 H CYS 14 H CYS 14 15.509 -12.630 -8.879 94 HA CYS 14 HA CYS 14 15.635 -10.767 -6.637 95 HB2 CYS 14 HB2 CYS 14 13.661 -10.616 -8.896 96 HB3 CYS 14 HB3 CYS 14 13.215 -10.070 -7.282 97 H ASN 15 H ASN 15 13.293 -10.956 -5.494 98 HA ASN 15 HA ASN 15 12.484 -13.773 -5.459 99 HB2 ASN 15 HB2 ASN 15 14.078 -13.691 -3.683 100 HB3 ASN 15 HB3 ASN 15 13.425 -12.171 -3.079 101 HD21 ASN 15 HD21 ASN 15 11.984 -15.281 -4.000 102 HD22 ASN 15 HD22 ASN 15 11.142 -15.523 -2.511 103 H TYR 16 H TYR 16 10.365 -14.144 -4.844 104 HA TYR 16 HA TYR 16 8.733 -11.785 -4.205 105 HB2 TYR 16 HB2 TYR 16 7.999 -13.897 -6.243 106 HB3 TYR 16 HB3 TYR 16 7.004 -12.524 -5.769 107 HD1 TYR 16 HD1 TYR 16 7.265 -10.427 -6.809 108 HD2 TYR 16 HD2 TYR 16 10.196 -13.452 -7.414 109 HE1 TYR 16 HE1 TYR 16 8.303 -9.061 -8.572 110 HE2 TYR 16 HE2 TYR 16 11.242 -12.093 -9.178 111 HH TYR 16 HH TYR 16 10.676 -8.883 -9.605 112 H TYR 17 H TYR 17 7.341 -12.091 -2.584 113 HA TYR 17 HA TYR 17 6.778 -14.861 -1.748 114 HB2 TYR 17 HB2 TYR 17 7.121 -14.344 0.468 115 HB3 TYR 17 HB3 TYR 17 8.294 -13.269 -0.283 116 HD1 TYR 17 HD1 TYR 17 7.058 -10.928 -1.064 117 HD2 TYR 17 HD2 TYR 17 5.971 -13.404 2.221 118 HE1 TYR 17 HE1 TYR 17 5.998 -8.998 0.032 119 HE2 TYR 17 HE2 TYR 17 4.906 -11.481 3.325 120 HH TYR 17 HH TYR 17 4.407 -9.326 3.193 121 H SER 18 H SER 18 4.735 -15.217 -0.694 122 HA SER 18 HA SER 18 2.580 -13.951 -2.015 123 HB2 SER 18 HB2 SER 18 2.635 -16.321 -1.092 124 HB3 SER 18 HB3 SER 18 2.361 -15.612 0.499 125 HG SER 18 HG SER 18 0.608 -16.034 -1.541 126 H ALA 19 H ALA 19 0.595 -13.454 -0.303 127 HA ALA 19 HA ALA 19 1.400 -10.943 0.881 128 HB1 ALA 19 HB1 ALA 19 -1.219 -11.146 1.501 129 HB2 ALA 19 HB2 ALA 19 -0.614 -10.540 -0.042 130 HB3 ALA 19 HB3 ALA 19 -1.136 -12.218 0.103 131 H ASP 20 H ASP 20 -0.028 -13.995 2.003 132 HA ASP 20 HA ASP 20 -0.257 -13.289 4.713 133 HB2 ASP 20 HB2 ASP 20 -1.248 -15.315 3.458 134 HB3 ASP 20 HB3 ASP 20 0.297 -16.096 3.783 135 H GLY 21 H GLY 21 2.479 -14.052 2.800 136 HA2 GLY 21 HA2 GLY 21 4.644 -13.418 3.752 137 HA3 GLY 21 HA3 GLY 21 4.125 -14.177 5.250 138 H THR 22 H THR 22 3.344 -15.756 2.288 139 HA THR 22 HA THR 22 5.259 -17.874 2.953 140 HB THR 22 HB THR 22 2.847 -17.935 1.129 141 HG1 THR 22 HG1 THR 22 3.277 -19.203 3.645 142 HG21 THR 22 HG21 THR 22 4.944 -19.973 1.788 143 HG22 THR 22 HG22 THR 22 4.253 -19.551 0.221 144 HG23 THR 22 HG23 THR 22 3.303 -20.476 1.384 145 H PHE 23 H PHE 23 7.158 -17.598 1.960 146 HA PHE 23 HA PHE 23 7.689 -16.139 -0.324 147 HB2 PHE 23 HB2 PHE 23 9.808 -17.370 -0.452 148 HB3 PHE 23 HB3 PHE 23 9.436 -16.925 1.210 149 HD1 PHE 23 HD1 PHE 23 8.639 -18.643 2.798 150 HD2 PHE 23 HD2 PHE 23 9.981 -19.637 -1.117 151 HE1 PHE 23 HE1 PHE 23 8.887 -20.993 3.483 152 HE2 PHE 23 HE2 PHE 23 10.231 -21.988 -0.439 153 HZ PHE 23 HZ PHE 23 9.683 -22.669 1.864 154 H ILE 24 H ILE 24 7.577 -16.483 -2.470 155 HA ILE 24 HA ILE 24 6.200 -18.885 -3.370 156 HB ILE 24 HB ILE 24 7.018 -16.526 -5.059 157 HG12 ILE 24 HG12 ILE 24 5.669 -15.750 -3.149 158 HG13 ILE 24 HG13 ILE 24 4.786 -15.605 -4.664 159 HG21 ILE 24 HG21 ILE 24 6.121 -17.698 -6.714 160 HG22 ILE 24 HG22 ILE 24 5.740 -19.010 -5.599 161 HG23 ILE 24 HG23 ILE 24 4.578 -17.710 -5.860 162 HD11 ILE 24 HD11 ILE 24 4.096 -17.035 -2.280 163 HD12 ILE 24 HD12 ILE 24 3.120 -16.699 -3.711 164 HD13 ILE 24 HD13 ILE 24 4.147 -18.131 -3.660 165 H CYS 25 H CYS 25 8.957 -16.994 -4.628 166 HA CYS 25 HA CYS 25 10.790 -19.102 -4.682 167 HB2 CYS 25 HB2 CYS 25 10.790 -19.420 -7.233 168 HB3 CYS 25 HB3 CYS 25 9.547 -20.256 -6.308 169 H GLU 26 H GLU 26 12.686 -18.606 -6.153 170 HA GLU 26 HA GLU 26 12.877 -15.775 -6.865 171 HB2 GLU 26 HB2 GLU 26 15.175 -15.756 -5.740 172 HB3 GLU 26 HB3 GLU 26 13.765 -15.657 -4.694 173 HG2 GLU 26 HG2 GLU 26 14.018 -17.842 -3.936 174 HG3 GLU 26 HG3 GLU 26 15.062 -18.287 -5.285 175 H GLY 27 H GLY 27 15.074 -15.347 -7.948 176 HA2 GLY 27 HA2 GLY 27 16.428 -15.758 -9.756 177 HA3 GLY 27 HA3 GLY 27 16.634 -17.361 -9.066 178 H GLU 28 H GLU 28 14.019 -15.573 -10.713 179 HA GLU 28 HA GLU 28 13.411 -18.008 -12.227 180 HB2 GLU 28 HB2 GLU 28 11.848 -15.737 -11.238 181 HB3 GLU 28 HB3 GLU 28 11.479 -16.167 -12.902 182 HG2 GLU 28 HG2 GLU 28 10.004 -17.300 -11.335 183 HG3 GLU 28 HG3 GLU 28 10.996 -18.447 -12.234 184 H SER 29 H SER 29 12.507 -17.455 -14.522 185 HA SER 29 HA SER 29 14.651 -16.615 -16.098 186 HB2 SER 29 HB2 SER 29 11.808 -16.499 -17.077 187 HB3 SER 29 HB3 SER 29 13.261 -16.968 -17.958 188 HG SER 29 HG SER 29 11.666 -18.449 -16.233 189 H ASP 30 H ASP 30 14.790 -14.794 -17.563 190 HA ASP 30 HA ASP 30 14.208 -12.322 -16.230 191 HB2 ASP 30 HB2 ASP 30 15.803 -13.194 -18.547 192 HB3 ASP 30 HB3 ASP 30 15.112 -11.581 -18.699 193 HA PRO 31 HA PRO 31 10.467 -11.115 -18.174 194 HB2 PRO 31 HB2 PRO 31 10.852 -8.455 -18.561 195 HB3 PRO 31 HB3 PRO 31 10.584 -9.165 -16.965 196 HG2 PRO 31 HG2 PRO 31 13.153 -8.355 -18.271 197 HG3 PRO 31 HG3 PRO 31 12.619 -8.100 -16.599 198 HD2 PRO 31 HD2 PRO 31 14.334 -10.076 -17.296 199 HD3 PRO 31 HD3 PRO 31 13.174 -10.245 -15.963 200 H ASN 32 H ASN 32 13.446 -10.136 -19.789 201 HA ASN 32 HA ASN 32 12.450 -9.255 -22.216 202 HB2 ASN 32 HB2 ASN 32 14.970 -10.867 -21.754 203 HB3 ASN 32 HB3 ASN 32 14.627 -9.874 -23.169 204 HD21 ASN 32 HD21 ASN 32 16.347 -9.940 -20.445 205 HD22 ASN 32 HD22 ASN 32 16.449 -8.251 -20.092 206 H ASN 33 H ASN 33 13.467 -12.572 -21.387 207 HA ASN 33 HA ASN 33 11.435 -13.619 -23.193 208 HB2 ASN 33 HB2 ASN 33 13.786 -13.303 -24.336 209 HB3 ASN 33 HB3 ASN 33 14.186 -14.772 -23.450 210 HD21 ASN 33 HD21 ASN 33 13.886 -14.223 -26.340 211 HD22 ASN 33 HD22 ASN 33 12.740 -15.385 -26.907 212 HA PRO 34 HA PRO 34 11.865 -15.962 -19.218 213 HB2 PRO 34 HB2 PRO 34 9.196 -16.071 -18.732 214 HB3 PRO 34 HB3 PRO 34 10.208 -14.710 -18.234 215 HG2 PRO 34 HG2 PRO 34 8.417 -14.966 -20.619 216 HG3 PRO 34 HG3 PRO 34 8.627 -13.590 -19.520 217 HD2 PRO 34 HD2 PRO 34 9.810 -13.705 -21.953 218 HD3 PRO 34 HD3 PRO 34 10.558 -12.888 -20.566 219 H LYS 35 H LYS 35 11.351 -18.133 -18.814 220 HA LYS 35 HA LYS 35 11.245 -19.858 -20.967 221 HB2 LYS 35 HB2 LYS 35 10.532 -20.233 -18.068 222 HB3 LYS 35 HB3 LYS 35 10.426 -21.561 -19.216 223 HG2 LYS 35 HG2 LYS 35 12.723 -21.612 -19.561 224 HG3 LYS 35 HG3 LYS 35 12.950 -19.979 -18.930 225 HD2 LYS 35 HD2 LYS 35 13.761 -21.441 -17.259 226 HD3 LYS 35 HD3 LYS 35 12.186 -20.884 -16.691 227 HE2 LYS 35 HE2 LYS 35 12.348 -23.245 -16.301 228 HE3 LYS 35 HE3 LYS 35 11.187 -22.971 -17.600 229 HZ1 LYS 35 HZ1 LYS 35 12.366 -24.392 -18.800 230 HZ2 LYS 35 HZ2 LYS 35 13.595 -24.471 -17.641 231 HZ3 LYS 35 HZ3 LYS 35 13.632 -23.271 -18.832 232 H ALA 36 H ALA 36 8.572 -19.719 -18.628 233 HA ALA 36 HA ALA 36 6.606 -19.258 -20.674 234 HB1 ALA 36 HB1 ALA 36 7.228 -21.989 -19.799 235 HB2 ALA 36 HB2 ALA 36 5.515 -21.569 -19.758 236 HB3 ALA 36 HB3 ALA 36 6.424 -21.417 -21.262 237 H CYS 37 H CYS 37 5.496 -17.748 -19.598 238 HA CYS 37 HA CYS 37 4.309 -18.492 -17.025 239 HB2 CYS 37 HB2 CYS 37 5.476 -15.750 -17.504 240 HB3 CYS 37 HB3 CYS 37 4.852 -16.407 -15.995 241 HA PRO 38 HA PRO 38 0.595 -16.871 -18.712 242 HB2 PRO 38 HB2 PRO 38 -0.659 -15.997 -16.468 243 HB3 PRO 38 HB3 PRO 38 -0.470 -17.711 -16.857 244 HG2 PRO 38 HG2 PRO 38 1.138 -16.002 -14.998 245 HG3 PRO 38 HG3 PRO 38 0.543 -17.656 -14.765 246 HD2 PRO 38 HD2 PRO 38 3.099 -17.115 -15.476 247 HD3 PRO 38 HD3 PRO 38 2.250 -18.580 -16.008 248 H ARG 39 H ARG 39 -0.768 -14.893 -18.824 249 HA ARG 39 HA ARG 39 0.942 -12.528 -18.822 250 HB2 ARG 39 HB2 ARG 39 -1.487 -13.387 -20.286 251 HB3 ARG 39 HB3 ARG 39 -1.343 -11.665 -19.958 252 HG2 ARG 39 HG2 ARG 39 -0.427 -12.101 -22.116 253 HG3 ARG 39 HG3 ARG 39 0.901 -11.710 -21.022 254 HD2 ARG 39 HD2 ARG 39 0.147 -14.566 -21.347 255 HD3 ARG 39 HD3 ARG 39 1.004 -13.780 -22.673 256 HE ARG 39 HE ARG 39 2.098 -14.588 -20.168 257 HH11 ARG 39 HH11 ARG 39 2.348 -12.203 -22.693 258 HH12 ARG 39 HH12 ARG 39 4.018 -11.862 -22.384 259 HH21 ARG 39 HH21 ARG 39 4.297 -14.147 -19.752 260 HH22 ARG 39 HH22 ARG 39 5.126 -12.968 -20.712 261 H ASN 40 H ASN 40 -2.024 -13.748 -17.389 262 HA ASN 40 HA ASN 40 -3.097 -11.456 -16.297 263 HB2 ASN 40 HB2 ASN 40 -3.929 -13.917 -16.210 264 HB3 ASN 40 HB3 ASN 40 -3.007 -14.008 -14.712 265 HD21 ASN 40 HD21 ASN 40 -5.522 -12.155 -16.353 266 HD22 ASN 40 HD22 ASN 40 -6.383 -11.717 -14.921 267 H CYS 41 H CYS 41 -3.074 -10.742 -14.009 268 HA CYS 41 HA CYS 41 -0.325 -10.419 -13.127 269 HB2 CYS 41 HB2 CYS 41 -2.358 -8.657 -13.246 270 HB3 CYS 41 HB3 CYS 41 -2.547 -9.204 -11.583 271 H ASP 42 H ASP 42 0.370 -10.814 -10.975 272 HA ASP 42 HA ASP 42 -1.141 -12.968 -9.655 273 HB2 ASP 42 HB2 ASP 42 1.295 -13.275 -10.578 274 HB3 ASP 42 HB3 ASP 42 1.755 -12.432 -9.102 275 HA PRO 43 HA PRO 43 -1.547 -9.457 -6.733 276 HB2 PRO 43 HB2 PRO 43 -3.968 -10.250 -5.796 277 HB3 PRO 43 HB3 PRO 43 -3.776 -9.290 -7.267 278 HG2 PRO 43 HG2 PRO 43 -4.202 -12.239 -6.972 279 HG3 PRO 43 HG3 PRO 43 -4.944 -11.111 -8.121 280 HD2 PRO 43 HD2 PRO 43 -2.886 -12.736 -8.797 281 HD3 PRO 43 HD3 PRO 43 -3.109 -11.128 -9.516 282 H ASN 44 H ASN 44 -1.241 -12.816 -6.474 283 HA ASN 44 HA ASN 44 -1.652 -13.152 -3.686 284 HB2 ASN 44 HB2 ASN 44 -0.023 -14.773 -5.654 285 HB3 ASN 44 HB3 ASN 44 -0.374 -15.273 -4.002 286 HD21 ASN 44 HD21 ASN 44 -1.750 -14.600 -7.143 287 HD22 ASN 44 HD22 ASN 44 -3.214 -15.485 -6.905 288 H ILE 45 H ILE 45 1.055 -12.111 -5.627 289 HA ILE 45 HA ILE 45 2.932 -12.287 -3.427 290 HB ILE 45 HB ILE 45 3.204 -11.200 -6.228 291 HG12 ILE 45 HG12 ILE 45 5.032 -13.231 -5.857 292 HG13 ILE 45 HG13 ILE 45 3.645 -13.790 -4.929 293 HG21 ILE 45 HG21 ILE 45 5.642 -11.066 -5.706 294 HG22 ILE 45 HG22 ILE 45 4.648 -9.886 -4.852 295 HG23 ILE 45 HG23 ILE 45 5.237 -11.319 -4.008 296 HD11 ILE 45 HD11 ILE 45 2.611 -12.859 -7.353 297 HD12 ILE 45 HD12 ILE 45 4.057 -13.784 -7.760 298 HD13 ILE 45 HD13 ILE 45 2.769 -14.531 -6.815 299 H ALA 46 H ALA 46 3.254 -10.750 -1.967 300 HA ALA 46 HA ALA 46 1.821 -8.291 -2.037 301 HB1 ALA 46 HB1 ALA 46 4.006 -8.327 -0.137 302 HB2 ALA 46 HB2 ALA 46 2.266 -8.252 0.144 303 HB3 ALA 46 HB3 ALA 46 3.058 -9.812 -0.079 304 H TYR 47 H TYR 47 5.291 -9.068 -2.252 305 HA TYR 47 HA TYR 47 5.780 -6.986 -4.129 306 HB2 TYR 47 HB2 TYR 47 7.343 -5.679 -2.653 307 HB3 TYR 47 HB3 TYR 47 5.637 -5.502 -2.256 308 HD1 TYR 47 HD1 TYR 47 8.615 -7.548 -1.307 309 HD2 TYR 47 HD2 TYR 47 4.980 -5.730 -0.049 310 HE1 TYR 47 HE1 TYR 47 9.095 -8.209 1.014 311 HE2 TYR 47 HE2 TYR 47 5.450 -6.385 2.275 312 HH TYR 47 HH TYR 47 7.238 -7.029 3.681 313 H SER 48 H SER 48 8.163 -6.759 -4.574 314 HA SER 48 HA SER 48 9.405 -9.403 -4.339 315 HB2 SER 48 HB2 SER 48 10.335 -9.064 -6.390 316 HB3 SER 48 HB3 SER 48 9.028 -7.890 -6.549 317 HG SER 48 HG SER 48 10.516 -6.294 -5.791 318 H LEU 49 H LEU 49 11.576 -9.653 -3.719 319 HA LEU 49 HA LEU 49 12.738 -7.347 -2.300 320 HB2 LEU 49 HB2 LEU 49 12.759 -10.240 -1.452 321 HB3 LEU 49 HB3 LEU 49 13.631 -8.940 -0.642 322 HG LEU 49 HG LEU 49 11.737 -9.303 0.678 323 HD11 LEU 49 HD11 LEU 49 12.171 -6.892 -0.346 324 HD12 LEU 49 HD12 LEU 49 10.840 -7.219 0.763 325 HD13 LEU 49 HD13 LEU 49 10.543 -7.152 -0.974 326 HD21 LEU 49 HD21 LEU 49 9.603 -9.820 -0.049 327 HD22 LEU 49 HD22 LEU 49 10.614 -10.626 -1.249 328 HD23 LEU 49 HD23 LEU 49 9.850 -9.082 -1.632 329 H CYS 50 H CYS 50 14.302 -6.750 -3.705 330 HA CYS 50 HA CYS 50 16.136 -8.822 -4.698 331 HB2 CYS 50 HB2 CYS 50 15.939 -5.972 -5.674 332 HB3 CYS 50 HB3 CYS 50 16.736 -7.329 -6.464 Start of MODEL 8 1 H1 ASN 1 H ASN 1 1.497 1.674 -1.692 2 HA ASN 1 HA ASN 1 3.421 -0.095 -0.921 3 HB2 ASN 1 HB2 ASN 1 1.283 0.870 0.316 4 HB3 ASN 1 HB3 ASN 1 0.619 -0.710 -0.091 5 HD21 ASN 1 HD21 ASN 1 1.989 -2.588 0.525 6 HD22 ASN 1 HD22 ASN 1 2.825 -2.503 2.035 7 H ARG 2 H ARG 2 0.300 -0.992 -2.392 8 HA ARG 2 HA ARG 2 0.798 -3.748 -2.533 9 HB2 ARG 2 HB2 ARG 2 -1.051 -1.886 -3.983 10 HB3 ARG 2 HB3 ARG 2 -0.918 -3.563 -4.497 11 HG2 ARG 2 HG2 ARG 2 -1.592 -2.719 -1.689 12 HG3 ARG 2 HG3 ARG 2 -2.793 -3.097 -2.926 13 HD2 ARG 2 HD2 ARG 2 -1.805 -5.349 -3.147 14 HD3 ARG 2 HD3 ARG 2 -0.678 -4.959 -1.849 15 HE ARG 2 HE ARG 2 -2.352 -5.336 -0.337 16 HH11 ARG 2 HH11 ARG 2 -3.750 -4.930 -3.500 17 HH12 ARG 2 HH12 ARG 2 -5.347 -5.371 -2.994 18 HH21 ARG 2 HH21 ARG 2 -4.450 -5.919 0.341 19 HH22 ARG 2 HH22 ARG 2 -5.744 -5.933 -0.808 20 H LEU 3 H LEU 3 1.156 -5.043 -4.483 21 HA LEU 3 HA LEU 3 2.634 -3.713 -6.621 22 HB2 LEU 3 HB2 LEU 3 4.053 -4.723 -4.591 23 HB3 LEU 3 HB3 LEU 3 3.864 -6.186 -5.555 24 HG LEU 3 HG LEU 3 5.072 -3.610 -6.559 25 HD11 LEU 3 HD11 LEU 3 6.705 -6.043 -6.180 26 HD12 LEU 3 HD12 LEU 3 6.243 -5.161 -4.725 27 HD13 LEU 3 HD13 LEU 3 7.138 -4.342 -6.004 28 HD21 LEU 3 HD21 LEU 3 4.519 -4.582 -8.515 29 HD22 LEU 3 HD22 LEU 3 4.348 -6.184 -7.796 30 HD23 LEU 3 HD23 LEU 3 5.950 -5.563 -8.197 31 H CYS 4 H CYS 4 2.410 -4.672 -8.582 32 HA CYS 4 HA CYS 4 0.823 -7.153 -8.658 33 HB2 CYS 4 HB2 CYS 4 -0.438 -5.325 -9.585 34 HB3 CYS 4 HB3 CYS 4 0.922 -4.829 -10.587 35 H THR 5 H THR 5 2.187 -8.794 -8.997 36 HA THR 5 HA THR 5 3.497 -9.126 -11.462 37 HB THR 5 HB THR 5 5.106 -7.506 -10.518 38 HG1 THR 5 HG1 THR 5 6.893 -8.731 -11.064 39 HG21 THR 5 HG21 THR 5 5.972 -9.558 -8.523 40 HG22 THR 5 HG22 THR 5 4.664 -8.446 -8.118 41 HG23 THR 5 HG23 THR 5 6.258 -7.819 -8.538 42 H ASN 6 H ASN 6 4.685 -11.167 -11.594 43 HA ASN 6 HA ASN 6 3.970 -13.017 -9.414 44 HB2 ASN 6 HB2 ASN 6 2.548 -13.334 -11.423 45 HB3 ASN 6 HB3 ASN 6 3.997 -13.638 -12.376 46 HD21 ASN 6 HD21 ASN 6 3.288 -15.699 -12.922 47 HD22 ASN 6 HD22 ASN 6 3.308 -17.005 -11.791 48 H CYS 7 H CYS 7 5.379 -14.805 -9.078 49 HA CYS 7 HA CYS 7 8.115 -14.170 -9.236 50 HB2 CYS 7 HB2 CYS 7 7.343 -15.607 -7.477 51 HB3 CYS 7 HB3 CYS 7 6.697 -16.768 -8.633 52 H CYS 8 H CYS 8 6.025 -16.132 -11.263 53 HA CYS 8 HA CYS 8 8.102 -17.327 -12.795 54 HB2 CYS 8 HB2 CYS 8 5.609 -18.026 -12.549 55 HB3 CYS 8 HB3 CYS 8 5.325 -16.868 -13.844 56 H ALA 9 H ALA 9 5.855 -14.653 -13.505 57 HA ALA 9 HA ALA 9 7.525 -13.869 -15.772 58 HB1 ALA 9 HB1 ALA 9 5.709 -12.432 -16.426 59 HB2 ALA 9 HB2 ALA 9 5.069 -14.034 -16.055 60 HB3 ALA 9 HB3 ALA 9 4.880 -12.719 -14.895 61 H GLY 10 H GLY 10 8.490 -13.510 -13.052 62 HA2 GLY 10 HA2 GLY 10 8.264 -10.674 -12.491 63 HA3 GLY 10 HA3 GLY 10 9.204 -11.848 -11.582 64 H ARG 11 H ARG 11 11.256 -11.228 -11.559 65 HA ARG 11 HA ARG 11 12.543 -10.589 -14.114 66 HB2 ARG 11 HB2 ARG 11 12.826 -8.962 -11.580 67 HB3 ARG 11 HB3 ARG 11 13.814 -8.757 -13.021 68 HG2 ARG 11 HG2 ARG 11 10.871 -8.606 -13.343 69 HG3 ARG 11 HG3 ARG 11 11.685 -7.262 -12.538 70 HD2 ARG 11 HD2 ARG 11 13.219 -7.091 -14.473 71 HD3 ARG 11 HD3 ARG 11 12.298 -8.361 -15.279 72 HE ARG 11 HE ARG 11 11.606 -5.606 -15.094 73 HH11 ARG 11 HH11 ARG 11 10.262 -8.816 -15.206 74 HH12 ARG 11 HH12 ARG 11 8.753 -8.301 -15.884 75 HH21 ARG 11 HH21 ARG 11 9.624 -4.916 -15.988 76 HH22 ARG 11 HH22 ARG 11 8.392 -6.083 -16.329 77 H LYS 12 H LYS 12 14.379 -11.676 -14.397 78 HA LYS 12 HA LYS 12 15.284 -13.660 -12.708 79 HB2 LYS 12 HB2 LYS 12 15.867 -13.342 -15.140 80 HB3 LYS 12 HB3 LYS 12 17.037 -12.131 -14.634 81 HG2 LYS 12 HG2 LYS 12 18.409 -13.701 -13.611 82 HG3 LYS 12 HG3 LYS 12 17.120 -14.903 -13.509 83 HD2 LYS 12 HD2 LYS 12 17.372 -15.557 -15.686 84 HD3 LYS 12 HD3 LYS 12 17.954 -13.975 -16.208 85 HE2 LYS 12 HE2 LYS 12 20.118 -14.407 -15.554 86 HE3 LYS 12 HE3 LYS 12 19.628 -15.594 -14.346 87 HZ1 LYS 12 HZ1 LYS 12 20.169 -15.944 -17.173 88 HZ2 LYS 12 HZ2 LYS 12 18.823 -16.786 -16.590 89 HZ3 LYS 12 HZ3 LYS 12 20.343 -17.036 -15.893 90 H GLY 13 H GLY 13 16.014 -13.470 -10.695 91 HA2 GLY 13 HA2 GLY 13 17.841 -12.924 -9.242 92 HA3 GLY 13 HA3 GLY 13 18.075 -11.441 -10.155 93 H CYS 14 H CYS 14 14.950 -12.596 -9.054 94 HA CYS 14 HA CYS 14 14.935 -10.701 -6.841 95 HB2 CYS 14 HB2 CYS 14 13.293 -10.440 -9.326 96 HB3 CYS 14 HB3 CYS 14 12.582 -9.967 -7.786 97 H ASN 15 H ASN 15 13.689 -11.352 -5.169 98 HA ASN 15 HA ASN 15 12.366 -13.937 -5.439 99 HB2 ASN 15 HB2 ASN 15 13.863 -13.795 -3.579 100 HB3 ASN 15 HB3 ASN 15 13.151 -12.277 -3.041 101 HD21 ASN 15 HD21 ASN 15 12.082 -15.571 -3.829 102 HD22 ASN 15 HD22 ASN 15 11.058 -15.749 -2.448 103 H TYR 16 H TYR 16 10.233 -14.317 -4.680 104 HA TYR 16 HA TYR 16 8.550 -11.956 -4.272 105 HB2 TYR 16 HB2 TYR 16 8.006 -14.106 -6.329 106 HB3 TYR 16 HB3 TYR 16 6.871 -12.842 -5.869 107 HD1 TYR 16 HD1 TYR 16 7.090 -10.615 -6.713 108 HD2 TYR 16 HD2 TYR 16 10.075 -13.527 -7.558 109 HE1 TYR 16 HE1 TYR 16 8.057 -9.121 -8.410 110 HE2 TYR 16 HE2 TYR 16 11.052 -12.040 -9.257 111 HH TYR 16 HH TYR 16 10.440 -8.840 -9.471 112 H TYR 17 H TYR 17 7.550 -12.275 -2.407 113 HA TYR 17 HA TYR 17 6.799 -15.016 -1.646 114 HB2 TYR 17 HB2 TYR 17 7.165 -14.484 0.557 115 HB3 TYR 17 HB3 TYR 17 8.319 -13.393 -0.201 116 HD1 TYR 17 HD1 TYR 17 6.974 -11.092 -1.015 117 HD2 TYR 17 HD2 TYR 17 6.077 -13.540 2.348 118 HE1 TYR 17 HE1 TYR 17 5.889 -9.177 0.083 119 HE2 TYR 17 HE2 TYR 17 4.988 -11.632 3.454 120 HH TYR 17 HH TYR 17 4.182 -9.539 3.144 121 H SER 18 H SER 18 4.758 -15.323 -0.544 122 HA SER 18 HA SER 18 2.614 -14.021 -1.886 123 HB2 SER 18 HB2 SER 18 2.743 -16.437 -0.921 124 HB3 SER 18 HB3 SER 18 2.237 -15.683 0.591 125 HG SER 18 HG SER 18 0.385 -16.258 -0.442 126 H ALA 19 H ALA 19 0.628 -13.590 -0.137 127 HA ALA 19 HA ALA 19 1.437 -11.110 1.110 128 HB1 ALA 19 HB1 ALA 19 -0.689 -11.438 -0.225 129 HB2 ALA 19 HB2 ALA 19 -1.314 -12.323 1.167 130 HB3 ALA 19 HB3 ALA 19 -0.862 -10.627 1.331 131 H ASP 20 H ASP 20 0.117 -14.232 2.141 132 HA ASP 20 HA ASP 20 -0.146 -13.609 4.873 133 HB2 ASP 20 HB2 ASP 20 0.161 -16.208 3.381 134 HB3 ASP 20 HB3 ASP 20 0.022 -16.161 5.137 135 H GLY 21 H GLY 21 2.609 -14.233 2.937 136 HA2 GLY 21 HA2 GLY 21 4.760 -13.573 3.886 137 HA3 GLY 21 HA3 GLY 21 4.264 -14.354 5.380 138 H THR 22 H THR 22 3.512 -15.932 2.410 139 HA THR 22 HA THR 22 5.516 -17.984 3.038 140 HB THR 22 HB THR 22 3.031 -18.160 1.323 141 HG1 THR 22 HG1 THR 22 3.651 -18.824 3.980 142 HG21 THR 22 HG21 THR 22 3.589 -20.671 1.540 143 HG22 THR 22 HG22 THR 22 5.222 -20.122 1.918 144 HG23 THR 22 HG23 THR 22 4.490 -19.711 0.367 145 H PHE 23 H PHE 23 7.352 -17.734 1.941 146 HA PHE 23 HA PHE 23 7.723 -16.251 -0.378 147 HB2 PHE 23 HB2 PHE 23 9.892 -17.354 -0.564 148 HB3 PHE 23 HB3 PHE 23 9.555 -16.957 1.117 149 HD1 PHE 23 HD1 PHE 23 8.864 -18.752 2.688 150 HD2 PHE 23 HD2 PHE 23 10.206 -19.586 -1.264 151 HE1 PHE 23 HE1 PHE 23 9.262 -21.096 3.322 152 HE2 PHE 23 HE2 PHE 23 10.606 -21.932 -0.637 153 HZ PHE 23 HZ PHE 23 10.133 -22.689 1.658 154 H ILE 24 H ILE 24 7.473 -16.626 -2.499 155 HA ILE 24 HA ILE 24 6.164 -19.086 -3.305 156 HB ILE 24 HB ILE 24 6.895 -16.768 -5.086 157 HG12 ILE 24 HG12 ILE 24 5.607 -15.943 -3.156 158 HG13 ILE 24 HG13 ILE 24 4.667 -15.857 -4.642 159 HG21 ILE 24 HG21 ILE 24 5.948 -17.996 -6.672 160 HG22 ILE 24 HG22 ILE 24 5.629 -19.279 -5.506 161 HG23 ILE 24 HG23 ILE 24 4.439 -18.003 -5.760 162 HD11 ILE 24 HD11 ILE 24 4.084 -18.352 -3.545 163 HD12 ILE 24 HD12 ILE 24 4.089 -17.224 -2.188 164 HD13 ILE 24 HD13 ILE 24 3.050 -16.924 -3.581 165 H CYS 25 H CYS 25 8.886 -17.190 -4.629 166 HA CYS 25 HA CYS 25 10.720 -19.295 -4.711 167 HB2 CYS 25 HB2 CYS 25 10.682 -19.611 -7.264 168 HB3 CYS 25 HB3 CYS 25 9.461 -20.456 -6.317 169 H GLU 26 H GLU 26 12.628 -18.786 -6.098 170 HA GLU 26 HA GLU 26 12.797 -15.939 -6.799 171 HB2 GLU 26 HB2 GLU 26 15.157 -16.015 -5.791 172 HB3 GLU 26 HB3 GLU 26 13.798 -15.902 -4.682 173 HG2 GLU 26 HG2 GLU 26 13.955 -18.227 -4.148 174 HG3 GLU 26 HG3 GLU 26 15.174 -18.478 -5.397 175 H GLY 27 H GLY 27 14.994 -15.516 -7.933 176 HA2 GLY 27 HA2 GLY 27 16.228 -15.864 -9.839 177 HA3 GLY 27 HA3 GLY 27 16.458 -17.489 -9.212 178 H GLU 28 H GLU 28 14.122 -15.495 -10.999 179 HA GLU 28 HA GLU 28 13.224 -17.929 -12.387 180 HB2 GLU 28 HB2 GLU 28 11.210 -16.661 -12.984 181 HB3 GLU 28 HB3 GLU 28 11.440 -16.721 -11.243 182 HG2 GLU 28 HG2 GLU 28 12.510 -14.389 -12.744 183 HG3 GLU 28 HG3 GLU 28 10.774 -14.495 -12.456 184 H SER 29 H SER 29 12.318 -17.264 -14.691 185 HA SER 29 HA SER 29 14.505 -16.761 -16.322 186 HB2 SER 29 HB2 SER 29 11.773 -16.051 -17.307 187 HB3 SER 29 HB3 SER 29 13.053 -16.960 -18.110 188 HG SER 29 HG SER 29 11.141 -17.819 -16.260 189 H ASP 30 H ASP 30 14.746 -14.963 -17.903 190 HA ASP 30 HA ASP 30 14.695 -12.440 -16.486 191 HB2 ASP 30 HB2 ASP 30 15.880 -11.632 -18.599 192 HB3 ASP 30 HB3 ASP 30 16.718 -12.848 -17.639 193 HA PRO 31 HA PRO 31 11.165 -10.647 -18.376 194 HB2 PRO 31 HB2 PRO 31 11.941 -8.059 -18.646 195 HB3 PRO 31 HB3 PRO 31 11.554 -8.788 -17.082 196 HG2 PRO 31 HG2 PRO 31 14.229 -8.311 -18.340 197 HG3 PRO 31 HG3 PRO 31 13.719 -8.052 -16.661 198 HD2 PRO 31 HD2 PRO 31 15.132 -10.228 -17.435 199 HD3 PRO 31 HD3 PRO 31 13.945 -10.280 -16.116 200 H ASN 32 H ASN 32 14.266 -9.910 -19.921 201 HA ASN 32 HA ASN 32 13.356 -8.879 -22.331 202 HB2 ASN 32 HB2 ASN 32 15.767 -10.667 -21.948 203 HB3 ASN 32 HB3 ASN 32 15.509 -9.523 -23.263 204 HD21 ASN 32 HD21 ASN 32 15.134 -7.232 -22.531 205 HD22 ASN 32 HD22 ASN 32 16.138 -6.653 -21.249 206 H ASN 33 H ASN 33 14.048 -12.271 -21.502 207 HA ASN 33 HA ASN 33 12.030 -13.143 -23.395 208 HB2 ASN 33 HB2 ASN 33 14.922 -13.994 -23.659 209 HB3 ASN 33 HB3 ASN 33 13.575 -14.722 -24.529 210 HD21 ASN 33 HD21 ASN 33 15.953 -12.395 -24.613 211 HD22 ASN 33 HD22 ASN 33 15.363 -11.458 -25.940 212 HA PRO 34 HA PRO 34 12.329 -15.620 -19.477 213 HB2 PRO 34 HB2 PRO 34 9.672 -15.513 -18.932 214 HB3 PRO 34 HB3 PRO 34 10.809 -14.263 -18.415 215 HG2 PRO 34 HG2 PRO 34 8.954 -14.281 -20.764 216 HG3 PRO 34 HG3 PRO 34 9.306 -12.967 -19.627 217 HD2 PRO 34 HD2 PRO 34 10.424 -13.102 -22.090 218 HD3 PRO 34 HD3 PRO 34 11.269 -12.401 -20.695 219 H LYS 35 H LYS 35 10.757 -17.524 -18.893 220 HA LYS 35 HA LYS 35 10.416 -19.089 -21.350 221 HB2 LYS 35 HB2 LYS 35 10.522 -20.040 -18.482 222 HB3 LYS 35 HB3 LYS 35 10.499 -21.059 -19.915 223 HG2 LYS 35 HG2 LYS 35 12.691 -20.786 -20.300 224 HG3 LYS 35 HG3 LYS 35 12.664 -19.080 -19.848 225 HD2 LYS 35 HD2 LYS 35 13.505 -19.569 -17.849 226 HD3 LYS 35 HD3 LYS 35 12.165 -20.672 -17.527 227 HE2 LYS 35 HE2 LYS 35 13.774 -22.239 -17.464 228 HE3 LYS 35 HE3 LYS 35 13.668 -22.162 -19.222 229 HZ1 LYS 35 HZ1 LYS 35 15.471 -20.535 -19.206 230 HZ2 LYS 35 HZ2 LYS 35 15.952 -21.996 -18.503 231 HZ3 LYS 35 HZ3 LYS 35 15.591 -20.665 -17.523 232 H ALA 36 H ALA 36 8.685 -21.022 -20.591 233 HA ALA 36 HA ALA 36 6.185 -19.963 -21.059 234 HB1 ALA 36 HB1 ALA 36 7.123 -22.453 -20.946 235 HB2 ALA 36 HB2 ALA 36 6.290 -22.409 -19.391 236 HB3 ALA 36 HB3 ALA 36 5.399 -22.085 -20.878 237 H CYS 37 H CYS 37 5.366 -18.346 -19.858 238 HA CYS 37 HA CYS 37 4.729 -18.931 -17.071 239 HB2 CYS 37 HB2 CYS 37 6.374 -16.601 -18.015 240 HB3 CYS 37 HB3 CYS 37 5.385 -16.469 -16.565 241 HA PRO 38 HA PRO 38 0.876 -17.045 -17.986 242 HB2 PRO 38 HB2 PRO 38 0.241 -15.876 -15.620 243 HB3 PRO 38 HB3 PRO 38 0.205 -17.626 -15.867 244 HG2 PRO 38 HG2 PRO 38 2.322 -15.935 -14.592 245 HG3 PRO 38 HG3 PRO 38 1.673 -17.500 -14.067 246 HD2 PRO 38 HD2 PRO 38 4.030 -17.266 -15.379 247 HD3 PRO 38 HD3 PRO 38 2.974 -18.681 -15.559 248 H ARG 39 H ARG 39 -0.356 -14.909 -17.770 249 HA ARG 39 HA ARG 39 1.518 -12.658 -18.106 250 HB2 ARG 39 HB2 ARG 39 -0.927 -13.416 -19.681 251 HB3 ARG 39 HB3 ARG 39 -0.354 -11.754 -19.647 252 HG2 ARG 39 HG2 ARG 39 1.251 -14.137 -20.551 253 HG3 ARG 39 HG3 ARG 39 0.455 -12.968 -21.607 254 HD2 ARG 39 HD2 ARG 39 2.764 -12.517 -19.734 255 HD3 ARG 39 HD3 ARG 39 2.729 -12.323 -21.486 256 HE ARG 39 HE ARG 39 0.867 -10.554 -20.573 257 HH11 ARG 39 HH11 ARG 39 4.242 -11.116 -19.931 258 HH12 ARG 39 HH12 ARG 39 4.583 -9.456 -19.569 259 HH21 ARG 39 HH21 ARG 39 1.303 -8.366 -20.099 260 HH22 ARG 39 HH22 ARG 39 2.911 -7.893 -19.665 261 H ASN 40 H ASN 40 -1.584 -13.752 -16.900 262 HA ASN 40 HA ASN 40 -2.746 -11.364 -16.130 263 HB2 ASN 40 HB2 ASN 40 -3.852 -12.723 -14.316 264 HB3 ASN 40 HB3 ASN 40 -4.000 -13.393 -15.938 265 HD21 ASN 40 HD21 ASN 40 -3.907 -15.510 -15.852 266 HD22 ASN 40 HD22 ASN 40 -2.821 -16.447 -14.889 267 H CYS 41 H CYS 41 -3.076 -10.782 -13.701 268 HA CYS 41 HA CYS 41 -0.441 -10.133 -12.667 269 HB2 CYS 41 HB2 CYS 41 -2.247 -8.416 -12.832 270 HB3 CYS 41 HB3 CYS 41 -3.153 -9.308 -11.615 271 H ASP 42 H ASP 42 0.254 -10.580 -10.549 272 HA ASP 42 HA ASP 42 -1.053 -12.927 -9.346 273 HB2 ASP 42 HB2 ASP 42 1.713 -12.291 -9.932 274 HB3 ASP 42 HB3 ASP 42 1.498 -12.676 -8.227 275 HA PRO 43 HA PRO 43 -1.863 -9.596 -6.299 276 HB2 PRO 43 HB2 PRO 43 -4.207 -10.667 -5.444 277 HB3 PRO 43 HB3 PRO 43 -4.088 -9.633 -6.873 278 HG2 PRO 43 HG2 PRO 43 -4.217 -12.619 -6.700 279 HG3 PRO 43 HG3 PRO 43 -5.050 -11.526 -7.821 280 HD2 PRO 43 HD2 PRO 43 -2.827 -12.906 -8.515 281 HD3 PRO 43 HD3 PRO 43 -3.200 -11.301 -9.176 282 H ASN 44 H ASN 44 -1.404 -12.986 -6.143 283 HA ASN 44 HA ASN 44 -1.725 -13.364 -3.349 284 HB2 ASN 44 HB2 ASN 44 0.135 -15.005 -5.049 285 HB3 ASN 44 HB3 ASN 44 -0.849 -15.518 -3.681 286 HD21 ASN 44 HD21 ASN 44 -0.569 -16.161 -6.705 287 HD22 ASN 44 HD22 ASN 44 -2.214 -16.282 -7.219 288 H ILE 45 H ILE 45 0.908 -12.263 -5.360 289 HA ILE 45 HA ILE 45 2.840 -12.414 -3.201 290 HB ILE 45 HB ILE 45 3.030 -11.387 -6.029 291 HG12 ILE 45 HG12 ILE 45 4.942 -13.382 -5.440 292 HG13 ILE 45 HG13 ILE 45 3.420 -13.937 -4.752 293 HG21 ILE 45 HG21 ILE 45 4.572 -9.994 -5.091 294 HG22 ILE 45 HG22 ILE 45 4.889 -11.075 -3.735 295 HG23 ILE 45 HG23 ILE 45 5.579 -11.423 -5.320 296 HD11 ILE 45 HD11 ILE 45 2.445 -14.201 -6.777 297 HD12 ILE 45 HD12 ILE 45 3.353 -12.880 -7.513 298 HD13 ILE 45 HD13 ILE 45 4.126 -14.444 -7.252 299 H ALA 46 H ALA 46 3.287 -10.832 -1.814 300 HA ALA 46 HA ALA 46 1.805 -8.379 -1.888 301 HB1 ALA 46 HB1 ALA 46 2.231 -8.335 0.293 302 HB2 ALA 46 HB2 ALA 46 3.043 -9.887 0.089 303 HB3 ALA 46 HB3 ALA 46 3.973 -8.389 0.022 304 H TYR 47 H TYR 47 5.284 -9.152 -2.011 305 HA TYR 47 HA TYR 47 5.775 -7.066 -3.912 306 HB2 TYR 47 HB2 TYR 47 7.407 -5.843 -2.433 307 HB3 TYR 47 HB3 TYR 47 5.714 -5.625 -2.004 308 HD1 TYR 47 HD1 TYR 47 8.625 -7.810 -1.158 309 HD2 TYR 47 HD2 TYR 47 5.100 -5.861 0.213 310 HE1 TYR 47 HE1 TYR 47 9.120 -8.543 1.137 311 HE2 TYR 47 HE2 TYR 47 5.586 -6.586 2.512 312 HH TYR 47 HH TYR 47 8.502 -7.656 3.526 313 H SER 48 H SER 48 8.233 -6.829 -4.252 314 HA SER 48 HA SER 48 9.357 -9.535 -4.249 315 HB2 SER 48 HB2 SER 48 10.250 -9.058 -6.268 316 HB3 SER 48 HB3 SER 48 9.144 -7.684 -6.271 317 HG SER 48 HG SER 48 10.792 -6.401 -6.098 318 H LEU 49 H LEU 49 11.693 -9.772 -3.893 319 HA LEU 49 HA LEU 49 12.781 -7.758 -2.045 320 HB2 LEU 49 HB2 LEU 49 12.805 -10.752 -1.710 321 HB3 LEU 49 HB3 LEU 49 13.754 -9.637 -0.730 322 HG LEU 49 HG LEU 49 11.893 -10.201 0.584 323 HD11 LEU 49 HD11 LEU 49 11.244 -8.130 1.156 324 HD12 LEU 49 HD12 LEU 49 10.664 -7.750 -0.465 325 HD13 LEU 49 HD13 LEU 49 12.383 -7.625 -0.093 326 HD21 LEU 49 HD21 LEU 49 10.647 -10.924 -1.668 327 HD22 LEU 49 HD22 LEU 49 9.834 -9.386 -1.378 328 HD23 LEU 49 HD23 LEU 49 9.797 -10.650 -0.148 329 H CYS 50 H CYS 50 14.318 -6.892 -3.336 330 HA CYS 50 HA CYS 50 16.724 -8.295 -3.759 331 HB2 CYS 50 HB2 CYS 50 16.666 -8.121 -6.313 332 HB3 CYS 50 HB3 CYS 50 15.750 -9.433 -5.580 Start of MODEL 9 1 H1 ASN 1 H ASN 1 0.710 1.071 0.473 2 HA ASN 1 HA ASN 1 2.355 0.535 -1.412 3 HB2 ASN 1 HB2 ASN 1 2.881 0.689 1.135 4 HB3 ASN 1 HB3 ASN 1 2.960 -1.069 1.054 5 HD21 ASN 1 HD21 ASN 1 4.032 1.568 -1.068 6 HD22 ASN 1 HD22 ASN 1 5.668 1.026 -1.196 7 H ARG 2 H ARG 2 0.345 -0.970 -2.347 8 HA ARG 2 HA ARG 2 1.024 -3.784 -2.092 9 HB2 ARG 2 HB2 ARG 2 -1.121 -2.335 -3.648 10 HB3 ARG 2 HB3 ARG 2 -0.888 -4.077 -3.709 11 HG2 ARG 2 HG2 ARG 2 -1.290 -2.687 -1.092 12 HG3 ARG 2 HG3 ARG 2 -2.663 -3.104 -2.119 13 HD2 ARG 2 HD2 ARG 2 -0.629 -5.197 -1.531 14 HD3 ARG 2 HD3 ARG 2 -1.776 -4.758 -0.266 15 HE ARG 2 HE ARG 2 -3.358 -5.181 -2.421 16 HH11 ARG 2 HH11 ARG 2 -0.874 -7.059 -0.865 17 HH12 ARG 2 HH12 ARG 2 -1.576 -8.584 -1.294 18 HH21 ARG 2 HH21 ARG 2 -4.292 -7.182 -2.992 19 HH22 ARG 2 HH22 ARG 2 -3.519 -8.652 -2.505 20 H LEU 3 H LEU 3 1.457 -5.118 -3.968 21 HA LEU 3 HA LEU 3 2.569 -3.694 -6.276 22 HB2 LEU 3 HB2 LEU 3 4.223 -4.543 -4.348 23 HB3 LEU 3 HB3 LEU 3 4.098 -6.027 -5.290 24 HG LEU 3 HG LEU 3 5.009 -3.357 -6.362 25 HD11 LEU 3 HD11 LEU 3 6.426 -4.938 -4.686 26 HD12 LEU 3 HD12 LEU 3 7.141 -3.918 -5.934 27 HD13 LEU 3 HD13 LEU 3 6.865 -5.632 -6.247 28 HD21 LEU 3 HD21 LEU 3 5.860 -5.080 -8.171 29 HD22 LEU 3 HD22 LEU 3 4.236 -4.398 -8.241 30 HD23 LEU 3 HD23 LEU 3 4.485 -6.016 -7.584 31 H CYS 4 H CYS 4 2.237 -4.682 -8.198 32 HA CYS 4 HA CYS 4 0.919 -7.316 -8.126 33 HB2 CYS 4 HB2 CYS 4 -0.224 -5.078 -9.025 34 HB3 CYS 4 HB3 CYS 4 0.632 -5.533 -10.495 35 H THR 5 H THR 5 2.408 -8.808 -8.599 36 HA THR 5 HA THR 5 3.591 -8.867 -11.195 37 HB THR 5 HB THR 5 5.164 -7.329 -10.006 38 HG1 THR 5 HG1 THR 5 7.023 -8.504 -10.705 39 HG21 THR 5 HG21 THR 5 4.901 -8.534 -7.785 40 HG22 THR 5 HG22 THR 5 6.546 -8.090 -8.240 41 HG23 THR 5 HG23 THR 5 5.998 -9.755 -8.428 42 H ASN 6 H ASN 6 4.505 -10.891 -11.704 43 HA ASN 6 HA ASN 6 3.927 -12.988 -9.718 44 HB2 ASN 6 HB2 ASN 6 2.636 -12.889 -11.956 45 HB3 ASN 6 HB3 ASN 6 4.132 -13.467 -12.682 46 HD21 ASN 6 HD21 ASN 6 1.983 -14.998 -12.983 47 HD22 ASN 6 HD22 ASN 6 2.068 -16.405 -11.984 48 H CYS 7 H CYS 7 5.493 -14.376 -9.123 49 HA CYS 7 HA CYS 7 8.179 -13.785 -9.476 50 HB2 CYS 7 HB2 CYS 7 7.497 -15.161 -7.635 51 HB3 CYS 7 HB3 CYS 7 6.830 -16.379 -8.718 52 H CYS 8 H CYS 8 6.113 -16.009 -11.278 53 HA CYS 8 HA CYS 8 8.095 -17.251 -12.817 54 HB2 CYS 8 HB2 CYS 8 5.592 -17.832 -12.587 55 HB3 CYS 8 HB3 CYS 8 5.339 -16.647 -13.865 56 H ALA 9 H ALA 9 6.001 -14.493 -13.671 57 HA ALA 9 HA ALA 9 7.766 -13.870 -15.916 58 HB1 ALA 9 HB1 ALA 9 5.153 -12.574 -15.158 59 HB2 ALA 9 HB2 ALA 9 6.034 -12.380 -16.673 60 HB3 ALA 9 HB3 ALA 9 5.315 -13.938 -16.265 61 H GLY 10 H GLY 10 8.672 -13.452 -13.184 62 HA2 GLY 10 HA2 GLY 10 8.566 -10.584 -12.749 63 HA3 GLY 10 HA3 GLY 10 9.405 -11.762 -11.751 64 H ARG 11 H ARG 11 11.395 -10.866 -11.624 65 HA ARG 11 HA ARG 11 12.872 -10.609 -14.154 66 HB2 ARG 11 HB2 ARG 11 13.308 -8.771 -11.804 67 HB3 ARG 11 HB3 ARG 11 13.953 -8.616 -13.433 68 HG2 ARG 11 HG2 ARG 11 11.154 -8.660 -13.687 69 HG3 ARG 11 HG3 ARG 11 11.526 -7.578 -12.343 70 HD2 ARG 11 HD2 ARG 11 12.757 -7.434 -15.093 71 HD3 ARG 11 HD3 ARG 11 11.448 -6.407 -14.510 72 HE ARG 11 HE ARG 11 13.634 -6.232 -12.747 73 HH11 ARG 11 HH11 ARG 11 12.670 -5.283 -15.955 74 HH12 ARG 11 HH12 ARG 11 13.689 -3.883 -15.988 75 HH21 ARG 11 HH21 ARG 11 14.980 -4.391 -12.778 76 HH22 ARG 11 HH22 ARG 11 15.004 -3.377 -14.181 77 H LYS 12 H LYS 12 14.518 -11.974 -14.191 78 HA LYS 12 HA LYS 12 15.343 -13.604 -12.124 79 HB2 LYS 12 HB2 LYS 12 15.871 -13.851 -14.583 80 HB3 LYS 12 HB3 LYS 12 17.143 -12.658 -14.356 81 HG2 LYS 12 HG2 LYS 12 18.458 -14.087 -13.136 82 HG3 LYS 12 HG3 LYS 12 17.089 -15.065 -12.603 83 HD2 LYS 12 HD2 LYS 12 17.050 -16.304 -14.526 84 HD3 LYS 12 HD3 LYS 12 17.714 -14.998 -15.510 85 HE2 LYS 12 HE2 LYS 12 19.912 -15.359 -14.568 86 HE3 LYS 12 HE3 LYS 12 19.273 -16.582 -13.470 87 HZ1 LYS 12 HZ1 LYS 12 19.444 -18.122 -15.038 88 HZ2 LYS 12 HZ2 LYS 12 20.296 -17.006 -15.980 89 HZ3 LYS 12 HZ3 LYS 12 18.625 -17.177 -16.176 90 H GLY 13 H GLY 13 16.142 -13.033 -10.212 91 HA2 GLY 13 HA2 GLY 13 18.395 -12.248 -9.315 92 HA3 GLY 13 HA3 GLY 13 17.982 -10.729 -10.096 93 H CYS 14 H CYS 14 15.105 -11.130 -9.355 94 HA CYS 14 HA CYS 14 15.362 -10.248 -6.559 95 HB2 CYS 14 HB2 CYS 14 13.372 -9.567 -8.718 96 HB3 CYS 14 HB3 CYS 14 13.057 -9.223 -7.020 97 H ASN 15 H ASN 15 13.622 -10.811 -5.083 98 HA ASN 15 HA ASN 15 12.495 -13.458 -5.706 99 HB2 ASN 15 HB2 ASN 15 13.954 -13.736 -3.880 100 HB3 ASN 15 HB3 ASN 15 13.443 -12.227 -3.128 101 HD21 ASN 15 HD21 ASN 15 12.046 -15.309 -4.201 102 HD22 ASN 15 HD22 ASN 15 11.033 -15.524 -2.819 103 H TYR 16 H TYR 16 10.368 -13.945 -5.033 104 HA TYR 16 HA TYR 16 8.708 -11.642 -4.276 105 HB2 TYR 16 HB2 TYR 16 7.987 -13.651 -6.419 106 HB3 TYR 16 HB3 TYR 16 6.998 -12.295 -5.888 107 HD1 TYR 16 HD1 TYR 16 7.410 -10.077 -6.682 108 HD2 TYR 16 HD2 TYR 16 10.059 -13.244 -7.709 109 HE1 TYR 16 HE1 TYR 16 8.463 -8.639 -8.377 110 HE2 TYR 16 HE2 TYR 16 11.121 -11.814 -9.405 111 HH TYR 16 HH TYR 16 10.624 -8.473 -9.565 112 H TYR 17 H TYR 17 7.447 -12.057 -2.590 113 HA TYR 17 HA TYR 17 6.867 -14.872 -1.939 114 HB2 TYR 17 HB2 TYR 17 7.244 -14.481 0.290 115 HB3 TYR 17 HB3 TYR 17 8.363 -13.309 -0.399 116 HD1 TYR 17 HD1 TYR 17 6.962 -10.992 -1.040 117 HD2 TYR 17 HD2 TYR 17 6.136 -13.693 2.142 118 HE1 TYR 17 HE1 TYR 17 5.836 -9.186 0.192 119 HE2 TYR 17 HE2 TYR 17 5.006 -11.894 3.383 120 HH TYR 17 HH TYR 17 3.775 -9.579 2.554 121 H SER 18 H SER 18 4.834 -15.304 -0.886 122 HA SER 18 HA SER 18 2.662 -13.959 -2.121 123 HB2 SER 18 HB2 SER 18 1.357 -15.666 -1.316 124 HB3 SER 18 HB3 SER 18 2.935 -16.435 -1.151 125 HG SER 18 HG SER 18 1.190 -15.996 0.746 126 H ALA 19 H ALA 19 0.674 -13.645 -0.368 127 HA ALA 19 HA ALA 19 1.452 -11.243 1.039 128 HB1 ALA 19 HB1 ALA 19 -1.304 -12.365 1.199 129 HB2 ALA 19 HB2 ALA 19 -0.773 -10.687 1.083 130 HB3 ALA 19 HB3 ALA 19 -0.725 -11.727 -0.340 131 H ASP 20 H ASP 20 0.109 -14.419 1.868 132 HA ASP 20 HA ASP 20 -0.166 -13.976 4.629 133 HB2 ASP 20 HB2 ASP 20 0.158 -16.466 2.968 134 HB3 ASP 20 HB3 ASP 20 0.039 -16.546 4.724 135 H GLY 21 H GLY 21 2.612 -14.458 2.684 136 HA2 GLY 21 HA2 GLY 21 4.751 -13.849 3.683 137 HA3 GLY 21 HA3 GLY 21 4.246 -14.707 5.131 138 H THR 22 H THR 22 3.528 -16.132 2.075 139 HA THR 22 HA THR 22 5.492 -18.235 2.635 140 HB THR 22 HB THR 22 3.104 -18.243 0.779 141 HG1 THR 22 HG1 THR 22 2.122 -18.723 2.588 142 HG21 THR 22 HG21 THR 22 4.800 -19.702 -0.114 143 HG22 THR 22 HG22 THR 22 3.550 -20.691 0.641 144 HG23 THR 22 HG23 THR 22 5.080 -20.416 1.474 145 H PHE 23 H PHE 23 7.370 -18.075 1.612 146 HA PHE 23 HA PHE 23 7.918 -16.391 -0.545 147 HB2 PHE 23 HB2 PHE 23 10.051 -17.568 -0.719 148 HB3 PHE 23 HB3 PHE 23 9.647 -17.283 0.970 149 HD1 PHE 23 HD1 PHE 23 8.869 -19.149 2.385 150 HD2 PHE 23 HD2 PHE 23 10.256 -19.764 -1.591 151 HE1 PHE 23 HE1 PHE 23 9.145 -21.548 2.856 152 HE2 PHE 23 HE2 PHE 23 10.534 -22.164 -1.127 153 HZ PHE 23 HZ PHE 23 9.977 -23.059 1.099 154 H ILE 24 H ILE 24 7.551 -16.541 -2.656 155 HA ILE 24 HA ILE 24 6.279 -18.899 -3.727 156 HB ILE 24 HB ILE 24 7.121 -16.442 -5.257 157 HG12 ILE 24 HG12 ILE 24 5.751 -15.796 -3.313 158 HG13 ILE 24 HG13 ILE 24 4.886 -15.546 -4.826 159 HG21 ILE 24 HG21 ILE 24 5.885 -18.881 -5.996 160 HG22 ILE 24 HG22 ILE 24 4.680 -17.602 -6.136 161 HG23 ILE 24 HG23 ILE 24 6.211 -17.468 -7.000 162 HD11 ILE 24 HD11 ILE 24 4.223 -18.129 -4.015 163 HD12 ILE 24 HD12 ILE 24 4.170 -17.141 -2.554 164 HD13 ILE 24 HD13 ILE 24 3.206 -16.689 -3.961 165 H CYS 25 H CYS 25 9.044 -16.962 -4.886 166 HA CYS 25 HA CYS 25 10.871 -19.067 -5.051 167 HB2 CYS 25 HB2 CYS 25 10.854 -19.259 -7.620 168 HB3 CYS 25 HB3 CYS 25 9.628 -20.149 -6.723 169 H GLU 26 H GLU 26 12.769 -18.507 -6.480 170 HA GLU 26 HA GLU 26 12.959 -15.651 -7.085 171 HB2 GLU 26 HB2 GLU 26 15.251 -15.671 -5.949 172 HB3 GLU 26 HB3 GLU 26 13.837 -15.614 -4.907 173 HG2 GLU 26 HG2 GLU 26 15.419 -17.147 -3.983 174 HG3 GLU 26 HG3 GLU 26 14.030 -18.055 -4.576 175 H GLY 27 H GLY 27 15.214 -15.200 -8.094 176 HA2 GLY 27 HA2 GLY 27 16.536 -15.528 -9.945 177 HA3 GLY 27 HA3 GLY 27 16.781 -17.139 -9.286 178 H GLU 28 H GLU 28 13.725 -15.795 -10.425 179 HA GLU 28 HA GLU 28 13.236 -18.081 -12.062 180 HB2 GLU 28 HB2 GLU 28 11.728 -15.899 -11.024 181 HB3 GLU 28 HB3 GLU 28 11.492 -15.938 -12.766 182 HG2 GLU 28 HG2 GLU 28 9.829 -17.239 -11.433 183 HG3 GLU 28 HG3 GLU 28 10.656 -18.150 -12.696 184 H SER 29 H SER 29 12.305 -17.536 -14.389 185 HA SER 29 HA SER 29 14.463 -17.031 -16.047 186 HB2 SER 29 HB2 SER 29 11.640 -16.471 -16.929 187 HB3 SER 29 HB3 SER 29 12.967 -17.170 -17.856 188 HG SER 29 HG SER 29 12.810 -19.019 -16.485 189 H ASP 30 H ASP 30 14.681 -15.279 -17.673 190 HA ASP 30 HA ASP 30 14.572 -12.713 -16.337 191 HB2 ASP 30 HB2 ASP 30 15.998 -13.863 -18.655 192 HB3 ASP 30 HB3 ASP 30 15.593 -12.154 -18.791 193 HA PRO 31 HA PRO 31 11.063 -11.004 -18.336 194 HB2 PRO 31 HB2 PRO 31 11.851 -8.449 -18.808 195 HB3 PRO 31 HB3 PRO 31 11.480 -9.056 -17.190 196 HG2 PRO 31 HG2 PRO 31 14.141 -8.694 -18.513 197 HG3 PRO 31 HG3 PRO 31 13.655 -8.306 -16.853 198 HD2 PRO 31 HD2 PRO 31 15.044 -10.544 -17.479 199 HD3 PRO 31 HD3 PRO 31 13.874 -10.488 -16.145 200 H ASN 32 H ASN 32 14.154 -10.544 -19.971 201 HA ASN 32 HA ASN 32 13.300 -9.602 -22.429 202 HB2 ASN 32 HB2 ASN 32 15.538 -11.582 -21.945 203 HB3 ASN 32 HB3 ASN 32 15.359 -10.535 -23.350 204 HD21 ASN 32 HD21 ASN 32 16.686 -10.864 -20.293 205 HD22 ASN 32 HD22 ASN 32 17.195 -9.230 -20.055 206 H ASN 33 H ASN 33 13.799 -13.006 -21.488 207 HA ASN 33 HA ASN 33 11.611 -13.797 -23.232 208 HB2 ASN 33 HB2 ASN 33 14.308 -15.121 -23.536 209 HB3 ASN 33 HB3 ASN 33 12.867 -15.373 -24.517 210 HD21 ASN 33 HD21 ASN 33 12.261 -13.799 -26.018 211 HD22 ASN 33 HD22 ASN 33 13.372 -12.599 -26.574 212 HA PRO 34 HA PRO 34 11.935 -16.114 -19.208 213 HB2 PRO 34 HB2 PRO 34 9.349 -15.706 -18.488 214 HB3 PRO 34 HB3 PRO 34 10.644 -14.564 -18.107 215 HG2 PRO 34 HG2 PRO 34 8.631 -14.475 -20.320 216 HG3 PRO 34 HG3 PRO 34 9.198 -13.163 -19.270 217 HD2 PRO 34 HD2 PRO 34 10.114 -13.508 -21.795 218 HD3 PRO 34 HD3 PRO 34 11.126 -12.848 -20.494 219 H LYS 35 H LYS 35 11.172 -18.176 -18.797 220 HA LYS 35 HA LYS 35 10.321 -19.715 -20.988 221 HB2 LYS 35 HB2 LYS 35 10.274 -20.347 -18.032 222 HB3 LYS 35 HB3 LYS 35 10.000 -21.528 -19.306 223 HG2 LYS 35 HG2 LYS 35 12.270 -21.024 -20.181 224 HG3 LYS 35 HG3 LYS 35 12.529 -19.984 -18.779 225 HD2 LYS 35 HD2 LYS 35 11.839 -22.918 -18.636 226 HD3 LYS 35 HD3 LYS 35 13.474 -22.264 -18.509 227 HE2 LYS 35 HE2 LYS 35 12.879 -21.047 -16.515 228 HE3 LYS 35 HE3 LYS 35 11.191 -21.528 -16.680 229 HZ1 LYS 35 HZ1 LYS 35 13.361 -23.516 -16.378 230 HZ2 LYS 35 HZ2 LYS 35 11.700 -23.732 -16.143 231 HZ3 LYS 35 HZ3 LYS 35 12.598 -22.817 -15.039 232 H ALA 36 H ALA 36 8.359 -21.382 -20.339 233 HA ALA 36 HA ALA 36 6.016 -20.081 -20.988 234 HB1 ALA 36 HB1 ALA 36 4.901 -22.164 -19.955 235 HB2 ALA 36 HB2 ALA 36 5.998 -22.380 -21.319 236 HB3 ALA 36 HB3 ALA 36 6.552 -22.720 -19.679 237 H CYS 37 H CYS 37 5.285 -18.375 -19.854 238 HA CYS 37 HA CYS 37 4.534 -18.846 -17.058 239 HB2 CYS 37 HB2 CYS 37 6.130 -16.532 -18.133 240 HB3 CYS 37 HB3 CYS 37 5.176 -16.381 -16.661 241 HA PRO 38 HA PRO 38 0.669 -17.065 -18.125 242 HB2 PRO 38 HB2 PRO 38 -0.012 -15.794 -15.825 243 HB3 PRO 38 HB3 PRO 38 -0.024 -17.553 -15.990 244 HG2 PRO 38 HG2 PRO 38 2.055 -15.780 -14.768 245 HG3 PRO 38 HG3 PRO 38 1.417 -17.326 -14.179 246 HD2 PRO 38 HD2 PRO 38 3.789 -17.125 -15.468 247 HD3 PRO 38 HD3 PRO 38 2.752 -18.560 -15.596 248 H ARG 39 H ARG 39 -0.594 -14.920 -17.970 249 HA ARG 39 HA ARG 39 1.265 -12.687 -18.467 250 HB2 ARG 39 HB2 ARG 39 -0.933 -13.770 -20.061 251 HB3 ARG 39 HB3 ARG 39 -1.061 -12.035 -19.803 252 HG2 ARG 39 HG2 ARG 39 0.118 -12.375 -21.834 253 HG3 ARG 39 HG3 ARG 39 1.286 -11.820 -20.633 254 HD2 ARG 39 HD2 ARG 39 1.382 -14.541 -20.336 255 HD3 ARG 39 HD3 ARG 39 1.124 -14.361 -22.071 256 HE ARG 39 HE ARG 39 3.511 -13.781 -20.628 257 HH11 ARG 39 HH11 ARG 39 1.598 -12.813 -23.371 258 HH12 ARG 39 HH12 ARG 39 2.945 -12.164 -24.246 259 HH21 ARG 39 HH21 ARG 39 5.292 -12.931 -21.770 260 HH22 ARG 39 HH22 ARG 39 5.046 -12.233 -23.335 261 H ASN 40 H ASN 40 -1.833 -13.679 -17.133 262 HA ASN 40 HA ASN 40 -2.873 -11.224 -16.378 263 HB2 ASN 40 HB2 ASN 40 -3.057 -13.837 -14.861 264 HB3 ASN 40 HB3 ASN 40 -4.129 -12.454 -14.661 265 HD21 ASN 40 HD21 ASN 40 -4.169 -15.384 -15.804 266 HD22 ASN 40 HD22 ASN 40 -5.170 -15.208 -17.201 267 H CYS 41 H CYS 41 -3.141 -10.613 -13.946 268 HA CYS 41 HA CYS 41 -0.460 -10.094 -12.954 269 HB2 CYS 41 HB2 CYS 41 -2.748 -8.573 -13.054 270 HB3 CYS 41 HB3 CYS 41 -2.709 -9.081 -11.368 271 H ASP 42 H ASP 42 0.263 -10.600 -10.874 272 HA ASP 42 HA ASP 42 -1.189 -12.823 -9.602 273 HB2 ASP 42 HB2 ASP 42 1.219 -13.093 -10.562 274 HB3 ASP 42 HB3 ASP 42 1.712 -12.229 -9.108 275 HA PRO 43 HA PRO 43 -1.625 -9.411 -6.570 276 HB2 PRO 43 HB2 PRO 43 -4.017 -10.281 -5.626 277 HB3 PRO 43 HB3 PRO 43 -3.864 -9.274 -7.070 278 HG2 PRO 43 HG2 PRO 43 -4.226 -12.238 -6.858 279 HG3 PRO 43 HG3 PRO 43 -5.007 -11.091 -7.963 280 HD2 PRO 43 HD2 PRO 43 -2.926 -12.653 -8.714 281 HD3 PRO 43 HD3 PRO 43 -3.191 -11.029 -9.381 282 H ASN 44 H ASN 44 -1.244 -12.767 -6.416 283 HA ASN 44 HA ASN 44 -1.612 -13.197 -3.636 284 HB2 ASN 44 HB2 ASN 44 -1.389 -14.897 -5.634 285 HB3 ASN 44 HB3 ASN 44 0.325 -14.824 -5.237 286 HD21 ASN 44 HD21 ASN 44 -2.792 -15.111 -3.562 287 HD22 ASN 44 HD22 ASN 44 -2.282 -16.349 -2.470 288 H ILE 45 H ILE 45 1.047 -12.037 -5.576 289 HA ILE 45 HA ILE 45 2.958 -12.241 -3.409 290 HB ILE 45 HB ILE 45 3.161 -11.048 -6.172 291 HG12 ILE 45 HG12 ILE 45 5.051 -13.059 -5.839 292 HG13 ILE 45 HG13 ILE 45 3.632 -13.676 -5.001 293 HG21 ILE 45 HG21 ILE 45 5.223 -11.187 -3.981 294 HG22 ILE 45 HG22 ILE 45 5.606 -10.879 -5.674 295 HG23 ILE 45 HG23 ILE 45 4.595 -9.745 -4.778 296 HD11 ILE 45 HD11 ILE 45 2.701 -12.629 -7.424 297 HD12 ILE 45 HD12 ILE 45 4.165 -13.537 -7.804 298 HD13 ILE 45 HD13 ILE 45 2.834 -14.323 -6.955 299 H ALA 46 H ALA 46 3.187 -10.771 -1.869 300 HA ALA 46 HA ALA 46 1.734 -8.320 -1.882 301 HB1 ALA 46 HB1 ALA 46 2.945 -9.916 0.046 302 HB2 ALA 46 HB2 ALA 46 3.844 -8.398 0.089 303 HB3 ALA 46 HB3 ALA 46 2.094 -8.394 0.311 304 H TYR 47 H TYR 47 5.211 -9.077 -2.036 305 HA TYR 47 HA TYR 47 5.732 -6.887 -3.786 306 HB2 TYR 47 HB2 TYR 47 7.290 -5.695 -2.206 307 HB3 TYR 47 HB3 TYR 47 5.580 -5.526 -1.824 308 HD1 TYR 47 HD1 TYR 47 8.542 -7.626 -0.956 309 HD2 TYR 47 HD2 TYR 47 4.865 -5.925 0.344 310 HE1 TYR 47 HE1 TYR 47 8.978 -8.441 1.323 311 HE2 TYR 47 HE2 TYR 47 5.291 -6.735 2.627 312 HH TYR 47 HH TYR 47 7.262 -7.377 4.015 313 H SER 48 H SER 48 8.121 -6.650 -4.191 314 HA SER 48 HA SER 48 9.341 -9.313 -4.116 315 HB2 SER 48 HB2 SER 48 10.199 -8.870 -6.161 316 HB3 SER 48 HB3 SER 48 9.024 -7.556 -6.199 317 HG SER 48 HG SER 48 10.592 -6.132 -5.605 318 H LEU 49 H LEU 49 11.492 -9.627 -3.474 319 HA LEU 49 HA LEU 49 12.661 -7.426 -1.902 320 HB2 LEU 49 HB2 LEU 49 12.638 -10.366 -1.237 321 HB3 LEU 49 HB3 LEU 49 13.517 -9.131 -0.338 322 HG LEU 49 HG LEU 49 11.602 -9.551 0.937 323 HD11 LEU 49 HD11 LEU 49 10.716 -7.465 1.136 324 HD12 LEU 49 HD12 LEU 49 10.475 -7.277 -0.601 325 HD13 LEU 49 HD13 LEU 49 12.086 -7.088 0.091 326 HD21 LEU 49 HD21 LEU 49 10.483 -10.734 -1.078 327 HD22 LEU 49 HD22 LEU 49 9.750 -9.158 -1.381 328 HD23 LEU 49 HD23 LEU 49 9.466 -9.983 0.152 329 H CYS 50 H CYS 50 14.250 -6.759 -3.247 330 HA CYS 50 HA CYS 50 15.992 -8.746 -4.498 331 HB2 CYS 50 HB2 CYS 50 16.105 -5.750 -4.846 332 HB3 CYS 50 HB3 CYS 50 16.791 -6.985 -5.897 Start of MODEL 10 1 H1 ASN 1 H ASN 1 -0.613 1.028 -0.160 2 HA ASN 1 HA ASN 1 1.944 0.313 -1.018 3 HB2 ASN 1 HB2 ASN 1 2.249 -0.631 1.235 4 HB3 ASN 1 HB3 ASN 1 1.454 0.939 1.297 5 HD21 ASN 1 HD21 ASN 1 1.234 -0.520 3.472 6 HD22 ASN 1 HD22 ASN 1 -0.338 -1.219 3.626 7 H ARG 2 H ARG 2 0.416 -1.024 -2.789 8 HA ARG 2 HA ARG 2 0.902 -3.838 -2.075 9 HB2 ARG 2 HB2 ARG 2 -1.388 -2.890 -3.800 10 HB3 ARG 2 HB3 ARG 2 -1.089 -4.526 -3.231 11 HG2 ARG 2 HG2 ARG 2 -1.358 -3.593 -0.882 12 HG3 ARG 2 HG3 ARG 2 -2.004 -2.144 -1.655 13 HD2 ARG 2 HD2 ARG 2 -3.079 -4.906 -2.180 14 HD3 ARG 2 HD3 ARG 2 -3.703 -3.860 -0.905 15 HE ARG 2 HE ARG 2 -3.776 -2.355 -3.207 16 HH11 ARG 2 HH11 ARG 2 -5.144 -5.363 -2.111 17 HH12 ARG 2 HH12 ARG 2 -6.566 -5.223 -3.091 18 HH21 ARG 2 HH21 ARG 2 -5.644 -2.159 -4.501 19 HH22 ARG 2 HH22 ARG 2 -6.850 -3.401 -4.450 20 H LEU 3 H LEU 3 1.951 -5.041 -3.569 21 HA LEU 3 HA LEU 3 2.700 -3.684 -6.070 22 HB2 LEU 3 HB2 LEU 3 4.368 -4.578 -4.194 23 HB3 LEU 3 HB3 LEU 3 4.184 -6.068 -5.116 24 HG LEU 3 HG LEU 3 5.115 -3.443 -6.276 25 HD11 LEU 3 HD11 LEU 3 6.947 -5.745 -5.990 26 HD12 LEU 3 HD12 LEU 3 6.556 -4.850 -4.522 27 HD13 LEU 3 HD13 LEU 3 7.271 -4.013 -5.900 28 HD21 LEU 3 HD21 LEU 3 4.638 -6.175 -7.366 29 HD22 LEU 3 HD22 LEU 3 5.964 -5.213 -8.019 30 HD23 LEU 3 HD23 LEU 3 4.312 -4.599 -8.087 31 H CYS 4 H CYS 4 2.349 -4.636 -8.011 32 HA CYS 4 HA CYS 4 0.958 -7.233 -7.976 33 HB2 CYS 4 HB2 CYS 4 -0.141 -4.968 -8.829 34 HB3 CYS 4 HB3 CYS 4 0.723 -5.385 -10.305 35 H THR 5 H THR 5 2.406 -8.759 -8.473 36 HA THR 5 HA THR 5 3.560 -8.847 -11.072 37 HB THR 5 HB THR 5 5.167 -7.305 -9.940 38 HG1 THR 5 HG1 THR 5 6.419 -8.220 -11.372 39 HG21 THR 5 HG21 THR 5 6.119 -9.673 -8.363 40 HG22 THR 5 HG22 THR 5 4.903 -8.577 -7.705 41 HG23 THR 5 HG23 THR 5 6.498 -7.965 -8.142 42 H ASN 6 H ASN 6 4.491 -10.879 -11.561 43 HA ASN 6 HA ASN 6 3.911 -12.950 -9.548 44 HB2 ASN 6 HB2 ASN 6 2.630 -12.857 -11.807 45 HB3 ASN 6 HB3 ASN 6 4.119 -13.497 -12.496 46 HD21 ASN 6 HD21 ASN 6 1.587 -14.783 -12.461 47 HD22 ASN 6 HD22 ASN 6 1.755 -16.236 -11.541 48 H CYS 7 H CYS 7 5.406 -14.536 -9.123 49 HA CYS 7 HA CYS 7 8.124 -13.899 -9.419 50 HB2 CYS 7 HB2 CYS 7 7.444 -15.276 -7.581 51 HB3 CYS 7 HB3 CYS 7 6.745 -16.477 -8.663 52 H CYS 8 H CYS 8 5.984 -15.964 -11.289 53 HA CYS 8 HA CYS 8 8.006 -17.204 -12.849 54 HB2 CYS 8 HB2 CYS 8 5.503 -17.862 -12.502 55 HB3 CYS 8 HB3 CYS 8 5.211 -16.772 -13.854 56 H ALA 9 H ALA 9 5.746 -14.547 -13.585 57 HA ALA 9 HA ALA 9 7.351 -13.847 -15.926 58 HB1 ALA 9 HB1 ALA 9 4.864 -12.393 -15.133 59 HB2 ALA 9 HB2 ALA 9 5.523 -12.698 -16.741 60 HB3 ALA 9 HB3 ALA 9 4.755 -14.005 -15.839 61 H GLY 10 H GLY 10 8.401 -13.399 -13.252 62 HA2 GLY 10 HA2 GLY 10 8.218 -10.526 -12.833 63 HA3 GLY 10 HA3 GLY 10 9.111 -11.671 -11.843 64 H ARG 11 H ARG 11 11.134 -10.907 -11.797 65 HA ARG 11 HA ARG 11 12.498 -10.558 -14.375 66 HB2 ARG 11 HB2 ARG 11 12.771 -8.732 -11.979 67 HB3 ARG 11 HB3 ARG 11 13.753 -8.646 -13.436 68 HG2 ARG 11 HG2 ARG 11 10.832 -8.533 -13.829 69 HG3 ARG 11 HG3 ARG 11 11.573 -7.147 -13.026 70 HD2 ARG 11 HD2 ARG 11 12.894 -6.629 -14.863 71 HD3 ARG 11 HD3 ARG 11 12.764 -8.253 -15.537 72 HE ARG 11 HE ARG 11 10.213 -7.267 -15.592 73 HH11 ARG 11 HH11 ARG 11 13.293 -6.252 -16.859 74 HH12 ARG 11 HH12 ARG 11 12.609 -5.450 -18.235 75 HH21 ARG 11 HH21 ARG 11 9.302 -6.215 -17.399 76 HH22 ARG 11 HH22 ARG 11 10.339 -5.429 -18.540 77 H LYS 12 H LYS 12 14.257 -11.776 -14.523 78 HA LYS 12 HA LYS 12 15.122 -13.554 -12.598 79 HB2 LYS 12 HB2 LYS 12 15.686 -13.658 -15.019 80 HB3 LYS 12 HB3 LYS 12 16.822 -12.337 -14.782 81 HG2 LYS 12 HG2 LYS 12 18.184 -13.688 -13.343 82 HG3 LYS 12 HG3 LYS 12 16.994 -14.991 -13.373 83 HD2 LYS 12 HD2 LYS 12 18.659 -15.649 -14.897 84 HD3 LYS 12 HD3 LYS 12 17.342 -15.032 -15.897 85 HE2 LYS 12 HE2 LYS 12 18.495 -13.109 -16.456 86 HE3 LYS 12 HE3 LYS 12 19.533 -13.194 -15.033 87 HZ1 LYS 12 HZ1 LYS 12 20.258 -13.937 -17.518 88 HZ2 LYS 12 HZ2 LYS 12 19.825 -15.423 -16.836 89 HZ3 LYS 12 HZ3 LYS 12 21.008 -14.466 -16.097 90 H GLY 13 H GLY 13 15.890 -13.127 -10.636 91 HA2 GLY 13 HA2 GLY 13 17.885 -12.446 -9.403 92 HA3 GLY 13 HA3 GLY 13 17.909 -10.987 -10.382 93 H CYS 14 H CYS 14 15.005 -12.366 -8.975 94 HA CYS 14 HA CYS 14 15.004 -10.485 -6.774 95 HB2 CYS 14 HB2 CYS 14 13.298 -10.153 -9.200 96 HB3 CYS 14 HB3 CYS 14 12.594 -9.780 -7.630 97 H ASN 15 H ASN 15 13.827 -11.206 -5.080 98 HA ASN 15 HA ASN 15 12.512 -13.792 -5.396 99 HB2 ASN 15 HB2 ASN 15 14.092 -13.743 -3.609 100 HB3 ASN 15 HB3 ASN 15 13.431 -12.238 -2.977 101 HD21 ASN 15 HD21 ASN 15 11.976 -15.314 -3.982 102 HD22 ASN 15 HD22 ASN 15 11.141 -15.599 -2.496 103 H TYR 16 H TYR 16 10.390 -14.193 -4.835 104 HA TYR 16 HA TYR 16 8.733 -11.869 -4.132 105 HB2 TYR 16 HB2 TYR 16 8.084 -13.915 -6.264 106 HB3 TYR 16 HB3 TYR 16 7.010 -12.630 -5.723 107 HD1 TYR 16 HD1 TYR 16 7.333 -10.355 -6.439 108 HD2 TYR 16 HD2 TYR 16 10.081 -13.391 -7.594 109 HE1 TYR 16 HE1 TYR 16 8.299 -8.835 -8.113 110 HE2 TYR 16 HE2 TYR 16 11.056 -11.878 -9.271 111 HH TYR 16 HH TYR 16 10.077 -8.508 -9.496 112 H TYR 17 H TYR 17 7.391 -12.236 -2.491 113 HA TYR 17 HA TYR 17 6.791 -15.032 -1.779 114 HB2 TYR 17 HB2 TYR 17 7.179 -14.631 0.453 115 HB3 TYR 17 HB3 TYR 17 8.359 -13.538 -0.264 116 HD1 TYR 17 HD1 TYR 17 7.157 -11.141 -0.903 117 HD2 TYR 17 HD2 TYR 17 6.066 -13.763 2.265 118 HE1 TYR 17 HE1 TYR 17 6.146 -9.251 0.305 119 HE2 TYR 17 HE2 TYR 17 5.051 -11.881 3.481 120 HH TYR 17 HH TYR 17 4.027 -9.544 2.734 121 H SER 18 H SER 18 4.756 -15.407 -0.726 122 HA SER 18 HA SER 18 2.606 -14.041 -1.945 123 HB2 SER 18 HB2 SER 18 2.694 -16.463 -1.058 124 HB3 SER 18 HB3 SER 18 2.314 -15.758 0.513 125 HG SER 18 HG SER 18 0.542 -16.476 -1.067 126 H ALA 19 H ALA 19 0.657 -13.576 -0.192 127 HA ALA 19 HA ALA 19 1.529 -11.140 1.095 128 HB1 ALA 19 HB1 ALA 19 -0.509 -10.515 0.482 129 HB2 ALA 19 HB2 ALA 19 -0.933 -12.173 0.054 130 HB3 ALA 19 HB3 ALA 19 -1.171 -11.600 1.705 131 H ASP 20 H ASP 20 0.038 -14.204 2.097 132 HA ASP 20 HA ASP 20 -0.137 -13.615 4.839 133 HB2 ASP 20 HB2 ASP 20 -1.109 -15.603 3.399 134 HB3 ASP 20 HB3 ASP 20 0.365 -16.415 3.919 135 H GLY 21 H GLY 21 2.552 -14.363 2.856 136 HA2 GLY 21 HA2 GLY 21 4.743 -13.826 3.814 137 HA3 GLY 21 HA3 GLY 21 4.224 -14.653 5.275 138 H THR 22 H THR 22 3.370 -16.049 2.242 139 HA THR 22 HA THR 22 5.237 -18.247 2.767 140 HB THR 22 HB THR 22 2.808 -18.145 0.968 141 HG1 THR 22 HG1 THR 22 2.258 -18.213 3.166 142 HG21 THR 22 HG21 THR 22 4.880 -20.246 1.464 143 HG22 THR 22 HG22 THR 22 4.125 -19.754 -0.052 144 HG23 THR 22 HG23 THR 22 3.218 -20.719 1.112 145 H PHE 23 H PHE 23 7.140 -17.902 1.789 146 HA PHE 23 HA PHE 23 7.667 -16.355 -0.433 147 HB2 PHE 23 HB2 PHE 23 9.779 -17.578 -0.623 148 HB3 PHE 23 HB3 PHE 23 9.411 -17.230 1.063 149 HD1 PHE 23 HD1 PHE 23 8.540 -19.049 2.526 150 HD2 PHE 23 HD2 PHE 23 10.019 -19.790 -1.396 151 HE1 PHE 23 HE1 PHE 23 8.784 -21.435 3.073 152 HE2 PHE 23 HE2 PHE 23 10.264 -22.178 -0.856 153 HZ PHE 23 HZ PHE 23 9.645 -23.003 1.380 154 H ILE 24 H ILE 24 7.567 -16.611 -2.596 155 HA ILE 24 HA ILE 24 6.156 -18.956 -3.593 156 HB ILE 24 HB ILE 24 6.998 -16.544 -5.192 157 HG12 ILE 24 HG12 ILE 24 5.683 -15.810 -3.245 158 HG13 ILE 24 HG13 ILE 24 4.781 -15.603 -4.743 159 HG21 ILE 24 HG21 ILE 24 6.071 -17.646 -6.879 160 HG22 ILE 24 HG22 ILE 24 5.659 -18.983 -5.806 161 HG23 ILE 24 HG23 ILE 24 4.531 -17.644 -6.019 162 HD11 ILE 24 HD11 ILE 24 4.411 -17.733 -2.658 163 HD12 ILE 24 HD12 ILE 24 3.286 -16.453 -3.115 164 HD13 ILE 24 HD13 ILE 24 3.633 -17.766 -4.240 165 H CYS 25 H CYS 25 8.930 -17.044 -4.776 166 HA CYS 25 HA CYS 25 10.742 -19.164 -4.922 167 HB2 CYS 25 HB2 CYS 25 10.729 -19.374 -7.488 168 HB3 CYS 25 HB3 CYS 25 9.494 -20.248 -6.588 169 H GLU 26 H GLU 26 12.681 -18.618 -6.233 170 HA GLU 26 HA GLU 26 12.884 -15.755 -6.849 171 HB2 GLU 26 HB2 GLU 26 15.210 -15.860 -5.780 172 HB3 GLU 26 HB3 GLU 26 13.824 -15.792 -4.700 173 HG2 GLU 26 HG2 GLU 26 13.979 -18.136 -4.248 174 HG3 GLU 26 HG3 GLU 26 15.232 -18.334 -5.472 175 H GLY 27 H GLY 27 14.996 -15.268 -8.007 176 HA2 GLY 27 HA2 GLY 27 16.236 -15.568 -9.918 177 HA3 GLY 27 HA3 GLY 27 16.588 -17.155 -9.250 178 H GLU 28 H GLU 28 14.004 -15.424 -10.987 179 HA GLU 28 HA GLU 28 13.250 -17.940 -12.281 180 HB2 GLU 28 HB2 GLU 28 11.229 -16.782 -12.988 181 HB3 GLU 28 HB3 GLU 28 11.456 -16.607 -11.253 182 HG2 GLU 28 HG2 GLU 28 12.495 -14.484 -13.060 183 HG3 GLU 28 HG3 GLU 28 10.763 -14.569 -12.740 184 H SER 29 H SER 29 12.346 -17.407 -14.649 185 HA SER 29 HA SER 29 14.551 -17.097 -16.294 186 HB2 SER 29 HB2 SER 29 11.847 -16.324 -17.321 187 HB3 SER 29 HB3 SER 29 13.093 -17.313 -18.083 188 HG SER 29 HG SER 29 12.570 -18.806 -16.211 189 H ASP 30 H ASP 30 14.878 -15.412 -17.985 190 HA ASP 30 HA ASP 30 14.978 -12.814 -16.725 191 HB2 ASP 30 HB2 ASP 30 16.152 -12.189 -18.903 192 HB3 ASP 30 HB3 ASP 30 16.946 -13.401 -17.902 193 HA PRO 31 HA PRO 31 11.497 -10.944 -18.629 194 HB2 PRO 31 HB2 PRO 31 12.396 -8.418 -19.053 195 HB3 PRO 31 HB3 PRO 31 12.011 -9.043 -17.445 196 HG2 PRO 31 HG2 PRO 31 14.675 -8.772 -18.784 197 HG3 PRO 31 HG3 PRO 31 14.220 -8.399 -17.111 198 HD2 PRO 31 HD2 PRO 31 15.502 -10.683 -17.798 199 HD3 PRO 31 HD3 PRO 31 14.346 -10.604 -16.452 200 H ASN 32 H ASN 32 14.593 -10.501 -20.279 201 HA ASN 32 HA ASN 32 13.697 -9.525 -22.718 202 HB2 ASN 32 HB2 ASN 32 16.022 -11.358 -22.101 203 HB3 ASN 32 HB3 ASN 32 15.766 -10.595 -23.668 204 HD21 ASN 32 HD21 ASN 32 18.021 -10.266 -21.967 205 HD22 ASN 32 HD22 ASN 32 18.093 -8.598 -21.521 206 H ASN 33 H ASN 33 14.239 -12.922 -21.786 207 HA ASN 33 HA ASN 33 12.073 -13.746 -23.532 208 HB2 ASN 33 HB2 ASN 33 14.947 -14.332 -24.077 209 HB3 ASN 33 HB3 ASN 33 13.770 -15.604 -24.391 210 HD21 ASN 33 HD21 ASN 33 14.848 -12.413 -25.262 211 HD22 ASN 33 HD22 ASN 33 13.993 -12.316 -26.760 212 HA PRO 34 HA PRO 34 12.444 -16.107 -19.554 213 HB2 PRO 34 HB2 PRO 34 9.820 -15.867 -18.900 214 HB3 PRO 34 HB3 PRO 34 11.031 -14.649 -18.478 215 HG2 PRO 34 HG2 PRO 34 9.074 -14.670 -20.743 216 HG3 PRO 34 HG3 PRO 34 9.530 -13.333 -19.671 217 HD2 PRO 34 HD2 PRO 34 10.531 -13.601 -22.173 218 HD3 PRO 34 HD3 PRO 34 11.465 -12.889 -20.842 219 H LYS 35 H LYS 35 10.734 -17.883 -18.829 220 HA LYS 35 HA LYS 35 10.312 -19.563 -21.193 221 HB2 LYS 35 HB2 LYS 35 10.369 -20.294 -18.259 222 HB3 LYS 35 HB3 LYS 35 10.174 -21.431 -19.587 223 HG2 LYS 35 HG2 LYS 35 12.369 -21.260 -20.239 224 HG3 LYS 35 HG3 LYS 35 12.564 -19.652 -19.538 225 HD2 LYS 35 HD2 LYS 35 13.764 -20.980 -18.069 226 HD3 LYS 35 HD3 LYS 35 12.190 -20.873 -17.276 227 HE2 LYS 35 HE2 LYS 35 11.635 -23.050 -17.790 228 HE3 LYS 35 HE3 LYS 35 12.720 -23.110 -19.179 229 HZ1 LYS 35 HZ1 LYS 35 13.445 -23.259 -16.310 230 HZ2 LYS 35 HZ2 LYS 35 14.587 -23.009 -17.532 231 HZ3 LYS 35 HZ3 LYS 35 13.680 -24.437 -17.502 232 H ALA 36 H ALA 36 8.433 -21.306 -20.454 233 HA ALA 36 HA ALA 36 6.024 -20.068 -20.975 234 HB1 ALA 36 HB1 ALA 36 5.759 -22.463 -19.314 235 HB2 ALA 36 HB2 ALA 36 5.177 -22.141 -20.949 236 HB3 ALA 36 HB3 ALA 36 6.844 -22.654 -20.691 237 H CYS 37 H CYS 37 5.260 -18.415 -19.797 238 HA CYS 37 HA CYS 37 4.599 -18.937 -16.999 239 HB2 CYS 37 HB2 CYS 37 6.303 -16.674 -18.000 240 HB3 CYS 37 HB3 CYS 37 5.323 -16.482 -16.550 241 HA PRO 38 HA PRO 38 0.792 -16.970 -17.939 242 HB2 PRO 38 HB2 PRO 38 0.197 -15.740 -15.593 243 HB3 PRO 38 HB3 PRO 38 0.115 -17.493 -15.807 244 HG2 PRO 38 HG2 PRO 38 2.280 -15.835 -14.571 245 HG3 PRO 38 HG3 PRO 38 1.592 -17.372 -14.015 246 HD2 PRO 38 HD2 PRO 38 3.950 -17.225 -15.338 247 HD3 PRO 38 HD3 PRO 38 2.856 -18.615 -15.488 248 H ARG 39 H ARG 39 -0.371 -14.824 -17.863 249 HA ARG 39 HA ARG 39 1.557 -12.623 -18.219 250 HB2 ARG 39 HB2 ARG 39 -0.935 -13.331 -19.747 251 HB3 ARG 39 HB3 ARG 39 -0.280 -11.699 -19.775 252 HG2 ARG 39 HG2 ARG 39 1.188 -14.189 -20.620 253 HG3 ARG 39 HG3 ARG 39 0.445 -13.010 -21.702 254 HD2 ARG 39 HD2 ARG 39 2.758 -12.575 -19.823 255 HD3 ARG 39 HD3 ARG 39 2.789 -12.545 -21.585 256 HE ARG 39 HE ARG 39 0.981 -10.605 -20.773 257 HH11 ARG 39 HH11 ARG 39 4.385 -11.263 -20.460 258 HH12 ARG 39 HH12 ARG 39 4.832 -9.592 -20.360 259 HH21 ARG 39 HH21 ARG 39 1.557 -8.402 -20.643 260 HH22 ARG 39 HH22 ARG 39 3.222 -7.965 -20.463 261 H ASN 40 H ASN 40 -1.605 -13.574 -17.018 262 HA ASN 40 HA ASN 40 -2.646 -11.123 -16.269 263 HB2 ASN 40 HB2 ASN 40 -3.005 -13.924 -15.391 264 HB3 ASN 40 HB3 ASN 40 -3.513 -12.695 -14.235 265 HD21 ASN 40 HD21 ASN 40 -4.126 -14.194 -17.277 266 HD22 ASN 40 HD22 ASN 40 -5.639 -13.421 -17.595 267 H CYS 41 H CYS 41 -2.968 -10.497 -13.858 268 HA CYS 41 HA CYS 41 -0.312 -10.011 -12.785 269 HB2 CYS 41 HB2 CYS 41 -2.583 -8.465 -12.954 270 HB3 CYS 41 HB3 CYS 41 -2.592 -8.966 -11.266 271 H ASP 42 H ASP 42 0.377 -10.577 -10.729 272 HA ASP 42 HA ASP 42 -1.173 -12.736 -9.463 273 HB2 ASP 42 HB2 ASP 42 1.223 -13.110 -10.411 274 HB3 ASP 42 HB3 ASP 42 1.749 -12.263 -8.959 275 HA PRO 43 HA PRO 43 -1.483 -9.308 -6.433 276 HB2 PRO 43 HB2 PRO 43 -3.910 -10.082 -5.497 277 HB3 PRO 43 HB3 PRO 43 -3.712 -9.083 -6.941 278 HG2 PRO 43 HG2 PRO 43 -4.193 -12.030 -6.728 279 HG3 PRO 43 HG3 PRO 43 -4.923 -10.854 -7.837 280 HD2 PRO 43 HD2 PRO 43 -2.903 -12.498 -8.579 281 HD3 PRO 43 HD3 PRO 43 -3.101 -10.865 -9.249 282 H ASN 44 H ASN 44 -1.240 -12.679 -6.275 283 HA ASN 44 HA ASN 44 -1.632 -13.089 -3.496 284 HB2 ASN 44 HB2 ASN 44 0.048 -14.707 -5.425 285 HB3 ASN 44 HB3 ASN 44 -0.537 -15.244 -3.853 286 HD21 ASN 44 HD21 ASN 44 -2.274 -16.458 -3.904 287 HD22 ASN 44 HD22 ASN 44 -3.490 -16.452 -5.132 288 H ILE 45 H ILE 45 1.076 -12.040 -5.429 289 HA ILE 45 HA ILE 45 2.976 -12.327 -3.264 290 HB ILE 45 HB ILE 45 3.219 -11.132 -6.022 291 HG12 ILE 45 HG12 ILE 45 5.047 -13.201 -5.688 292 HG13 ILE 45 HG13 ILE 45 3.606 -13.773 -4.855 293 HG21 ILE 45 HG21 ILE 45 5.699 -11.118 -5.477 294 HG22 ILE 45 HG22 ILE 45 4.717 -9.861 -4.727 295 HG23 ILE 45 HG23 ILE 45 5.221 -11.265 -3.786 296 HD11 ILE 45 HD11 ILE 45 4.149 -13.593 -7.671 297 HD12 ILE 45 HD12 ILE 45 2.840 -14.419 -6.826 298 HD13 ILE 45 HD13 ILE 45 2.677 -12.716 -7.253 299 H ALA 46 H ALA 46 3.334 -10.862 -1.740 300 HA ALA 46 HA ALA 46 1.935 -8.387 -1.674 301 HB1 ALA 46 HB1 ALA 46 2.427 -8.445 0.495 302 HB2 ALA 46 HB2 ALA 46 3.191 -10.005 0.189 303 HB3 ALA 46 HB3 ALA 46 4.160 -8.531 0.175 304 H TYR 47 H TYR 47 5.404 -9.166 -1.944 305 HA TYR 47 HA TYR 47 5.870 -7.007 -3.751 306 HB2 TYR 47 HB2 TYR 47 7.496 -5.810 -2.238 307 HB3 TYR 47 HB3 TYR 47 5.799 -5.611 -1.816 308 HD1 TYR 47 HD1 TYR 47 8.746 -7.750 -0.989 309 HD2 TYR 47 HD2 TYR 47 5.142 -5.951 0.380 310 HE1 TYR 47 HE1 TYR 47 9.230 -8.532 1.292 311 HE2 TYR 47 HE2 TYR 47 5.616 -6.727 2.665 312 HH TYR 47 HH TYR 47 6.897 -8.187 3.885 313 H SER 48 H SER 48 8.329 -6.725 -4.079 314 HA SER 48 HA SER 48 9.486 -9.416 -4.158 315 HB2 SER 48 HB2 SER 48 10.365 -8.867 -6.163 316 HB3 SER 48 HB3 SER 48 9.257 -7.496 -6.118 317 HG SER 48 HG SER 48 11.492 -6.939 -6.513 318 H LEU 49 H LEU 49 11.803 -9.661 -3.773 319 HA LEU 49 HA LEU 49 12.880 -7.678 -1.885 320 HB2 LEU 49 HB2 LEU 49 12.900 -10.678 -1.605 321 HB3 LEU 49 HB3 LEU 49 13.849 -9.583 -0.601 322 HG LEU 49 HG LEU 49 11.983 -10.165 0.697 323 HD11 LEU 49 HD11 LEU 49 10.766 -7.693 -0.322 324 HD12 LEU 49 HD12 LEU 49 12.480 -7.581 0.074 325 HD13 LEU 49 HD13 LEU 49 11.324 -8.104 1.299 326 HD21 LEU 49 HD21 LEU 49 10.744 -10.865 -1.557 327 HD22 LEU 49 HD22 LEU 49 9.941 -9.320 -1.276 328 HD23 LEU 49 HD23 LEU 49 9.880 -10.584 -0.046 329 H CYS 50 H CYS 50 14.421 -6.787 -3.155 330 HA CYS 50 HA CYS 50 16.815 -8.229 -3.620 331 HB2 CYS 50 HB2 CYS 50 16.772 -7.868 -6.158 332 HB3 CYS 50 HB3 CYS 50 15.828 -9.209 -5.520 Start of MODEL 11 1 H1 ASN 1 H ASN 1 2.028 -1.623 0.973 2 HA ASN 1 HA ASN 1 2.058 -0.436 -1.714 3 HB2 ASN 1 HB2 ASN 1 4.236 -0.677 -0.533 4 HB3 ASN 1 HB3 ASN 1 3.993 -2.421 -0.499 5 HD21 ASN 1 HD21 ASN 1 6.005 -2.525 -1.653 6 HD22 ASN 1 HD22 ASN 1 6.026 -2.291 -3.365 7 H ARG 2 H ARG 2 0.965 -1.411 -3.275 8 HA ARG 2 HA ARG 2 0.361 -4.282 -2.987 9 HB2 ARG 2 HB2 ARG 2 -1.601 -3.724 -4.533 10 HB3 ARG 2 HB3 ARG 2 -1.705 -3.168 -2.868 11 HG2 ARG 2 HG2 ARG 2 -0.552 -1.309 -4.869 12 HG3 ARG 2 HG3 ARG 2 -2.291 -1.605 -4.918 13 HD2 ARG 2 HD2 ARG 2 -2.052 -1.195 -2.310 14 HD3 ARG 2 HD3 ARG 2 -0.640 -0.280 -2.834 15 HE ARG 2 HE ARG 2 -2.035 1.314 -3.713 16 HH11 ARG 2 HH11 ARG 2 -3.868 -1.556 -2.990 17 HH12 ARG 2 HH12 ARG 2 -5.403 -0.806 -3.278 18 HH21 ARG 2 HH21 ARG 2 -4.050 2.313 -4.095 19 HH22 ARG 2 HH22 ARG 2 -5.505 1.394 -3.907 20 H LEU 3 H LEU 3 2.487 -4.579 -4.036 21 HA LEU 3 HA LEU 3 2.916 -3.736 -6.717 22 HB2 LEU 3 HB2 LEU 3 4.543 -4.652 -4.829 23 HB3 LEU 3 HB3 LEU 3 4.248 -6.173 -5.668 24 HG LEU 3 HG LEU 3 5.308 -3.691 -7.011 25 HD11 LEU 3 HD11 LEU 3 7.438 -4.296 -6.566 26 HD12 LEU 3 HD12 LEU 3 7.061 -6.018 -6.531 27 HD13 LEU 3 HD13 LEU 3 6.692 -5.007 -5.134 28 HD21 LEU 3 HD21 LEU 3 4.532 -4.931 -8.751 29 HD22 LEU 3 HD22 LEU 3 4.656 -6.454 -7.870 30 HD23 LEU 3 HD23 LEU 3 6.103 -5.707 -8.550 31 H CYS 4 H CYS 4 2.527 -4.742 -8.629 32 HA CYS 4 HA CYS 4 0.963 -7.236 -8.506 33 HB2 CYS 4 HB2 CYS 4 0.012 -4.937 -9.439 34 HB3 CYS 4 HB3 CYS 4 0.849 -5.457 -10.898 35 H THR 5 H THR 5 2.308 -8.869 -8.947 36 HA THR 5 HA THR 5 3.403 -9.194 -11.529 37 HB THR 5 HB THR 5 5.105 -7.618 -10.734 38 HG1 THR 5 HG1 THR 5 6.482 -8.799 -11.812 39 HG21 THR 5 HG21 THR 5 6.361 -7.887 -8.810 40 HG22 THR 5 HG22 THR 5 6.039 -9.619 -8.716 41 HG23 THR 5 HG23 THR 5 4.780 -8.462 -8.284 42 H ASN 6 H ASN 6 4.757 -11.210 -11.672 43 HA ASN 6 HA ASN 6 3.997 -13.110 -9.552 44 HB2 ASN 6 HB2 ASN 6 2.689 -13.433 -11.636 45 HB3 ASN 6 HB3 ASN 6 4.194 -13.687 -12.516 46 HD21 ASN 6 HD21 ASN 6 3.449 -15.752 -13.116 47 HD22 ASN 6 HD22 ASN 6 3.490 -17.075 -12.005 48 H CYS 7 H CYS 7 5.462 -14.765 -9.056 49 HA CYS 7 HA CYS 7 8.163 -14.090 -9.070 50 HB2 CYS 7 HB2 CYS 7 7.340 -15.628 -7.428 51 HB3 CYS 7 HB3 CYS 7 6.796 -16.753 -8.668 52 H CYS 8 H CYS 8 6.305 -16.102 -11.282 53 HA CYS 8 HA CYS 8 8.553 -17.078 -12.735 54 HB2 CYS 8 HB2 CYS 8 6.287 -18.163 -12.672 55 HB3 CYS 8 HB3 CYS 8 5.696 -16.858 -13.696 56 H ALA 9 H ALA 9 6.203 -14.480 -13.316 57 HA ALA 9 HA ALA 9 7.766 -13.563 -15.609 58 HB1 ALA 9 HB1 ALA 9 5.907 -12.162 -16.151 59 HB2 ALA 9 HB2 ALA 9 5.284 -13.765 -15.760 60 HB3 ALA 9 HB3 ALA 9 5.158 -12.458 -14.582 61 H GLY 10 H GLY 10 8.837 -13.315 -12.917 62 HA2 GLY 10 HA2 GLY 10 8.617 -10.483 -12.277 63 HA3 GLY 10 HA3 GLY 10 9.520 -11.690 -11.374 64 H ARG 11 H ARG 11 11.586 -11.118 -11.317 65 HA ARG 11 HA ARG 11 12.906 -10.432 -13.846 66 HB2 ARG 11 HB2 ARG 11 13.412 -8.971 -11.250 67 HB3 ARG 11 HB3 ARG 11 14.152 -8.637 -12.810 68 HG2 ARG 11 HG2 ARG 11 11.372 -8.498 -13.203 69 HG3 ARG 11 HG3 ARG 11 11.721 -7.622 -11.710 70 HD2 ARG 11 HD2 ARG 11 12.982 -7.173 -14.412 71 HD3 ARG 11 HD3 ARG 11 11.844 -6.108 -13.587 72 HE ARG 11 HE ARG 11 14.169 -6.576 -12.015 73 HH11 ARG 11 HH11 ARG 11 12.956 -4.754 -14.722 74 HH12 ARG 11 HH12 ARG 11 14.087 -3.457 -14.524 75 HH21 ARG 11 HH21 ARG 11 15.664 -4.874 -11.743 76 HH22 ARG 11 HH22 ARG 11 15.628 -3.527 -12.830 77 H LYS 12 H LYS 12 14.560 -11.745 -14.193 78 HA LYS 12 HA LYS 12 15.437 -13.730 -12.491 79 HB2 LYS 12 HB2 LYS 12 15.886 -13.626 -14.933 80 HB3 LYS 12 HB3 LYS 12 17.083 -12.372 -14.634 81 HG2 LYS 12 HG2 LYS 12 17.926 -14.336 -12.953 82 HG3 LYS 12 HG3 LYS 12 17.265 -15.272 -14.296 83 HD2 LYS 12 HD2 LYS 12 19.503 -14.931 -14.883 84 HD3 LYS 12 HD3 LYS 12 18.627 -13.707 -15.804 85 HE2 LYS 12 HE2 LYS 12 19.516 -12.882 -13.121 86 HE3 LYS 12 HE3 LYS 12 20.806 -13.202 -14.280 87 HZ1 LYS 12 HZ1 LYS 12 19.042 -11.727 -15.709 88 HZ2 LYS 12 HZ2 LYS 12 20.436 -11.128 -14.962 89 HZ3 LYS 12 HZ3 LYS 12 18.942 -11.020 -14.175 90 H GLY 13 H GLY 13 16.310 -13.526 -10.538 91 HA2 GLY 13 HA2 GLY 13 18.358 -13.054 -9.316 92 HA3 GLY 13 HA3 GLY 13 18.458 -11.532 -10.189 93 H CYS 14 H CYS 14 15.497 -12.799 -8.799 94 HA CYS 14 HA CYS 14 15.693 -10.986 -6.524 95 HB2 CYS 14 HB2 CYS 14 13.655 -10.751 -8.727 96 HB3 CYS 14 HB3 CYS 14 13.308 -10.180 -7.098 97 H ASN 15 H ASN 15 13.334 -11.141 -5.380 98 HA ASN 15 HA ASN 15 12.502 -13.953 -5.372 99 HB2 ASN 15 HB2 ASN 15 14.087 -13.845 -3.573 100 HB3 ASN 15 HB3 ASN 15 13.378 -12.353 -2.963 101 HD21 ASN 15 HD21 ASN 15 12.003 -15.461 -3.978 102 HD22 ASN 15 HD22 ASN 15 11.154 -15.760 -2.503 103 H TYR 16 H TYR 16 10.372 -14.317 -4.797 104 HA TYR 16 HA TYR 16 8.736 -11.940 -4.224 105 HB2 TYR 16 HB2 TYR 16 8.067 -14.129 -6.203 106 HB3 TYR 16 HB3 TYR 16 6.999 -12.806 -5.748 107 HD1 TYR 16 HD1 TYR 16 7.137 -10.721 -6.830 108 HD2 TYR 16 HD2 TYR 16 10.248 -13.573 -7.368 109 HE1 TYR 16 HE1 TYR 16 8.100 -9.326 -8.612 110 HE2 TYR 16 HE2 TYR 16 11.220 -12.186 -9.151 111 HH TYR 16 HH TYR 16 10.253 -8.973 -9.714 112 H TYR 17 H TYR 17 7.356 -12.180 -2.585 113 HA TYR 17 HA TYR 17 6.783 -14.913 -1.643 114 HB2 TYR 17 HB2 TYR 17 7.140 -14.315 0.548 115 HB3 TYR 17 HB3 TYR 17 8.302 -13.257 -0.244 116 HD1 TYR 17 HD1 TYR 17 6.999 -10.968 -1.123 117 HD2 TYR 17 HD2 TYR 17 6.034 -13.312 2.294 118 HE1 TYR 17 HE1 TYR 17 5.926 -9.010 -0.090 119 HE2 TYR 17 HE2 TYR 17 4.958 -11.361 3.336 120 HH TYR 17 HH TYR 17 3.883 -9.204 2.533 121 H SER 18 H SER 18 4.745 -15.194 -0.524 122 HA SER 18 HA SER 18 2.592 -13.961 -1.904 123 HB2 SER 18 HB2 SER 18 2.639 -16.315 -0.936 124 HB3 SER 18 HB3 SER 18 2.361 -15.573 0.640 125 HG SER 18 HG SER 18 0.492 -16.301 -0.821 126 H ALA 19 H ALA 19 0.611 -13.444 -0.176 127 HA ALA 19 HA ALA 19 1.418 -10.904 0.944 128 HB1 ALA 19 HB1 ALA 19 -0.970 -10.557 1.336 129 HB2 ALA 19 HB2 ALA 19 -0.657 -11.063 -0.324 130 HB3 ALA 19 HB3 ALA 19 -1.294 -12.220 0.845 131 H ASP 20 H ASP 20 0.039 -13.946 2.144 132 HA ASP 20 HA ASP 20 -0.173 -13.183 4.842 133 HB2 ASP 20 HB2 ASP 20 -1.136 -15.257 3.614 134 HB3 ASP 20 HB3 ASP 20 0.410 -16.008 4.000 135 H GLY 21 H GLY 21 2.550 -13.961 2.916 136 HA2 GLY 21 HA2 GLY 21 4.719 -13.287 3.829 137 HA3 GLY 21 HA3 GLY 21 4.224 -14.015 5.350 138 H THR 22 H THR 22 3.425 -15.671 2.434 139 HA THR 22 HA THR 22 5.373 -17.751 3.124 140 HB THR 22 HB THR 22 2.930 -17.890 1.347 141 HG1 THR 22 HG1 THR 22 3.480 -18.736 4.002 142 HG21 THR 22 HG21 THR 22 4.188 -19.569 0.438 143 HG22 THR 22 HG22 THR 22 3.498 -20.446 1.804 144 HG23 THR 22 HG23 THR 22 5.136 -19.801 1.906 145 H PHE 23 H PHE 23 7.252 -17.453 2.094 146 HA PHE 23 HA PHE 23 7.720 -16.058 -0.239 147 HB2 PHE 23 HB2 PHE 23 9.854 -17.257 -0.372 148 HB3 PHE 23 HB3 PHE 23 9.503 -16.783 1.287 149 HD1 PHE 23 HD1 PHE 23 8.752 -18.482 2.921 150 HD2 PHE 23 HD2 PHE 23 10.060 -19.533 -0.991 151 HE1 PHE 23 HE1 PHE 23 9.049 -20.813 3.650 152 HE2 PHE 23 HE2 PHE 23 10.359 -21.865 -0.268 153 HZ PHE 23 HZ PHE 23 9.852 -22.508 2.055 154 H ILE 24 H ILE 24 7.655 -16.486 -2.384 155 HA ILE 24 HA ILE 24 6.270 -18.922 -3.193 156 HB ILE 24 HB ILE 24 7.023 -16.591 -4.951 157 HG12 ILE 24 HG12 ILE 24 5.671 -15.814 -3.036 158 HG13 ILE 24 HG13 ILE 24 4.785 -15.701 -4.553 159 HG21 ILE 24 HG21 ILE 24 4.600 -17.860 -5.691 160 HG22 ILE 24 HG22 ILE 24 6.126 -17.808 -6.572 161 HG23 ILE 24 HG23 ILE 24 5.811 -19.115 -5.431 162 HD11 ILE 24 HD11 ILE 24 3.138 -16.831 -3.614 163 HD12 ILE 24 HD12 ILE 24 4.206 -18.229 -3.485 164 HD13 ILE 24 HD13 ILE 24 4.094 -17.079 -2.153 165 H CYS 25 H CYS 25 8.965 -17.024 -4.564 166 HA CYS 25 HA CYS 25 10.842 -19.093 -4.579 167 HB2 CYS 25 HB2 CYS 25 10.800 -19.510 -7.114 168 HB3 CYS 25 HB3 CYS 25 9.588 -20.332 -6.136 169 H GLU 26 H GLU 26 12.704 -18.611 -6.087 170 HA GLU 26 HA GLU 26 12.819 -15.796 -6.889 171 HB2 GLU 26 HB2 GLU 26 15.155 -15.722 -5.848 172 HB3 GLU 26 HB3 GLU 26 13.783 -15.623 -4.753 173 HG2 GLU 26 HG2 GLU 26 14.039 -17.927 -4.134 174 HG3 GLU 26 HG3 GLU 26 15.303 -18.152 -5.342 175 H GLY 27 H GLY 27 15.040 -15.383 -8.002 176 HA2 GLY 27 HA2 GLY 27 16.321 -15.807 -9.860 177 HA3 GLY 27 HA3 GLY 27 16.553 -17.400 -9.155 178 H GLU 28 H GLU 28 14.096 -15.549 -10.955 179 HA GLU 28 HA GLU 28 13.393 -18.038 -12.361 180 HB2 GLU 28 HB2 GLU 28 11.822 -15.746 -11.389 181 HB3 GLU 28 HB3 GLU 28 11.404 -16.283 -13.010 182 HG2 GLU 28 HG2 GLU 28 11.407 -17.953 -10.507 183 HG3 GLU 28 HG3 GLU 28 9.997 -17.377 -11.396 184 H SER 29 H SER 29 12.421 -17.484 -14.636 185 HA SER 29 HA SER 29 14.496 -16.693 -16.290 186 HB2 SER 29 HB2 SER 29 11.690 -16.297 -17.237 187 HB3 SER 29 HB3 SER 29 13.054 -17.057 -18.056 188 HG SER 29 HG SER 29 11.116 -18.208 -16.618 189 H ASP 30 H ASP 30 14.489 -14.862 -17.855 190 HA ASP 30 HA ASP 30 14.215 -12.381 -16.409 191 HB2 ASP 30 HB2 ASP 30 15.332 -13.130 -19.100 192 HB3 ASP 30 HB3 ASP 30 15.115 -11.444 -18.641 193 HA PRO 31 HA PRO 31 10.388 -10.971 -18.023 194 HB2 PRO 31 HB2 PRO 31 10.853 -8.311 -18.306 195 HB3 PRO 31 HB3 PRO 31 10.660 -9.090 -16.731 196 HG2 PRO 31 HG2 PRO 31 13.171 -8.310 -18.164 197 HG3 PRO 31 HG3 PRO 31 12.756 -8.122 -16.450 198 HD2 PRO 31 HD2 PRO 31 14.341 -10.122 -17.354 199 HD3 PRO 31 HD3 PRO 31 13.263 -10.315 -15.956 200 H ASN 32 H ASN 32 13.240 -9.747 -19.755 201 HA ASN 32 HA ASN 32 12.021 -8.883 -22.087 202 HB2 ASN 32 HB2 ASN 32 14.279 -9.590 -23.160 203 HB3 ASN 32 HB3 ASN 32 14.285 -8.347 -21.912 204 HD21 ASN 32 HD21 ASN 32 15.317 -8.713 -20.018 205 HD22 ASN 32 HD22 ASN 32 16.221 -10.145 -19.675 206 H ASN 33 H ASN 33 13.434 -12.098 -21.461 207 HA ASN 33 HA ASN 33 11.437 -13.280 -23.228 208 HB2 ASN 33 HB2 ASN 33 13.360 -14.690 -24.242 209 HB3 ASN 33 HB3 ASN 33 13.115 -13.052 -24.841 210 HD21 ASN 33 HD21 ASN 33 14.857 -11.852 -24.995 211 HD22 ASN 33 HD22 ASN 33 16.322 -12.061 -24.103 212 HA PRO 34 HA PRO 34 12.188 -15.705 -19.357 213 HB2 PRO 34 HB2 PRO 34 9.556 -16.124 -18.844 214 HB3 PRO 34 HB3 PRO 34 10.419 -14.676 -18.312 215 HG2 PRO 34 HG2 PRO 34 8.631 -15.051 -20.684 216 HG3 PRO 34 HG3 PRO 34 8.705 -13.697 -19.541 217 HD2 PRO 34 HD2 PRO 34 9.856 -13.601 -21.990 218 HD3 PRO 34 HD3 PRO 34 10.530 -12.752 -20.584 219 H LYS 35 H LYS 35 10.840 -17.853 -18.796 220 HA LYS 35 HA LYS 35 11.234 -19.572 -21.090 221 HB2 LYS 35 HB2 LYS 35 10.653 -20.049 -18.179 222 HB3 LYS 35 HB3 LYS 35 10.548 -21.358 -19.348 223 HG2 LYS 35 HG2 LYS 35 13.011 -19.669 -19.045 224 HG3 LYS 35 HG3 LYS 35 12.728 -21.123 -18.085 225 HD2 LYS 35 HD2 LYS 35 12.548 -21.182 -21.079 226 HD3 LYS 35 HD3 LYS 35 14.104 -21.327 -20.256 227 HE2 LYS 35 HE2 LYS 35 13.296 -23.266 -19.033 228 HE3 LYS 35 HE3 LYS 35 11.708 -23.100 -19.781 229 HZ1 LYS 35 HZ1 LYS 35 13.346 -23.208 -21.915 230 HZ2 LYS 35 HZ2 LYS 35 12.516 -24.533 -21.272 231 HZ3 LYS 35 HZ3 LYS 35 14.128 -24.254 -20.840 232 H ALA 36 H ALA 36 8.626 -19.656 -18.675 233 HA ALA 36 HA ALA 36 6.591 -19.314 -20.693 234 HB1 ALA 36 HB1 ALA 36 7.497 -21.920 -20.138 235 HB2 ALA 36 HB2 ALA 36 5.916 -21.760 -19.372 236 HB3 ALA 36 HB3 ALA 36 6.097 -21.438 -21.097 237 H CYS 37 H CYS 37 5.537 -17.756 -19.599 238 HA CYS 37 HA CYS 37 4.353 -18.497 -17.022 239 HB2 CYS 37 HB2 CYS 37 5.504 -15.749 -17.500 240 HB3 CYS 37 HB3 CYS 37 4.911 -16.425 -15.987 241 HA PRO 38 HA PRO 38 0.636 -16.875 -18.701 242 HB2 PRO 38 HB2 PRO 38 -0.609 -15.992 -16.456 243 HB3 PRO 38 HB3 PRO 38 -0.424 -17.707 -16.840 244 HG2 PRO 38 HG2 PRO 38 1.192 -15.995 -14.992 245 HG3 PRO 38 HG3 PRO 38 0.595 -17.647 -14.751 246 HD2 PRO 38 HD2 PRO 38 3.150 -17.112 -15.472 247 HD3 PRO 38 HD3 PRO 38 2.297 -18.578 -15.997 248 H ARG 39 H ARG 39 -0.744 -14.889 -18.771 249 HA ARG 39 HA ARG 39 0.976 -12.527 -18.793 250 HB2 ARG 39 HB2 ARG 39 -1.587 -13.273 -20.155 251 HB3 ARG 39 HB3 ARG 39 -1.143 -11.578 -20.001 252 HG2 ARG 39 HG2 ARG 39 0.640 -13.659 -21.241 253 HG3 ARG 39 HG3 ARG 39 -0.488 -12.657 -22.156 254 HD2 ARG 39 HD2 ARG 39 1.861 -11.734 -20.510 255 HD3 ARG 39 HD3 ARG 39 1.689 -11.655 -22.263 256 HE ARG 39 HE ARG 39 0.584 -9.838 -20.326 257 HH11 ARG 39 HH11 ARG 39 0.304 -11.114 -23.553 258 HH12 ARG 39 HH12 ARG 39 -0.541 -9.732 -24.167 259 HH21 ARG 39 HH21 ARG 39 -0.529 -8.012 -21.122 260 HH22 ARG 39 HH22 ARG 39 -1.014 -7.968 -22.783 261 H ASN 40 H ASN 40 -1.987 -13.747 -17.355 262 HA ASN 40 HA ASN 40 -3.063 -11.455 -16.266 263 HB2 ASN 40 HB2 ASN 40 -4.056 -13.758 -16.168 264 HB3 ASN 40 HB3 ASN 40 -2.933 -14.131 -14.863 265 HD21 ASN 40 HD21 ASN 40 -4.394 -14.415 -13.263 266 HD22 ASN 40 HD22 ASN 40 -5.415 -13.161 -12.653 267 H CYS 41 H CYS 41 -3.053 -10.783 -13.947 268 HA CYS 41 HA CYS 41 -0.303 -10.406 -13.090 269 HB2 CYS 41 HB2 CYS 41 -2.508 -8.761 -13.098 270 HB3 CYS 41 HB3 CYS 41 -2.411 -9.251 -11.410 271 H ASP 42 H ASP 42 0.386 -10.758 -10.905 272 HA ASP 42 HA ASP 42 -1.016 -13.016 -9.641 273 HB2 ASP 42 HB2 ASP 42 1.815 -12.428 -10.145 274 HB3 ASP 42 HB3 ASP 42 1.484 -12.972 -8.503 275 HA PRO 43 HA PRO 43 -1.667 -9.577 -6.676 276 HB2 PRO 43 HB2 PRO 43 -4.055 -10.518 -5.793 277 HB3 PRO 43 HB3 PRO 43 -3.892 -9.526 -7.246 278 HG2 PRO 43 HG2 PRO 43 -4.158 -12.498 -7.001 279 HG3 PRO 43 HG3 PRO 43 -4.943 -11.395 -8.147 280 HD2 PRO 43 HD2 PRO 43 -2.787 -12.892 -8.811 281 HD3 PRO 43 HD3 PRO 43 -3.087 -11.288 -9.510 282 H ASN 44 H ASN 44 -1.259 -12.947 -6.452 283 HA ASN 44 HA ASN 44 -1.649 -13.298 -3.663 284 HB2 ASN 44 HB2 ASN 44 -0.247 -14.870 -5.804 285 HB3 ASN 44 HB3 ASN 44 -0.088 -15.336 -4.113 286 HD21 ASN 44 HD21 ASN 44 -1.225 -16.982 -6.028 287 HD22 ASN 44 HD22 ASN 44 -2.905 -17.177 -5.674 288 H ILE 45 H ILE 45 1.030 -12.216 -5.620 289 HA ILE 45 HA ILE 45 2.904 -12.341 -3.406 290 HB ILE 45 HB ILE 45 3.189 -11.363 -6.244 291 HG12 ILE 45 HG12 ILE 45 5.049 -13.356 -5.716 292 HG13 ILE 45 HG13 ILE 45 3.612 -13.891 -4.852 293 HG21 ILE 45 HG21 ILE 45 4.659 -9.962 -5.108 294 HG22 ILE 45 HG22 ILE 45 5.089 -11.204 -3.934 295 HG23 ILE 45 HG23 ILE 45 5.679 -11.317 -5.591 296 HD11 ILE 45 HD11 ILE 45 4.045 -14.534 -7.366 297 HD12 ILE 45 HD12 ILE 45 2.420 -14.215 -6.759 298 HD13 ILE 45 HD13 ILE 45 3.290 -12.966 -7.650 299 H ALA 46 H ALA 46 3.335 -10.727 -2.048 300 HA ALA 46 HA ALA 46 1.862 -8.273 -2.209 301 HB1 ALA 46 HB1 ALA 46 2.254 -8.164 -0.021 302 HB2 ALA 46 HB2 ALA 46 3.039 -9.737 -0.170 303 HB3 ALA 46 HB3 ALA 46 4.000 -8.261 -0.257 304 H TYR 47 H TYR 47 5.336 -9.070 -2.270 305 HA TYR 47 HA TYR 47 5.879 -7.044 -4.211 306 HB2 TYR 47 HB2 TYR 47 7.454 -5.749 -2.735 307 HB3 TYR 47 HB3 TYR 47 5.748 -5.529 -2.364 308 HD1 TYR 47 HD1 TYR 47 8.651 -7.648 -1.346 309 HD2 TYR 47 HD2 TYR 47 5.069 -5.683 -0.159 310 HE1 TYR 47 HE1 TYR 47 9.084 -8.283 0.991 311 HE2 TYR 47 HE2 TYR 47 5.493 -6.312 2.181 312 HH TYR 47 HH TYR 47 8.113 -8.469 3.058 313 H SER 48 H SER 48 8.282 -6.860 -4.611 314 HA SER 48 HA SER 48 9.462 -9.530 -4.342 315 HB2 SER 48 HB2 SER 48 10.391 -9.234 -6.391 316 HB3 SER 48 HB3 SER 48 9.166 -7.977 -6.558 317 HG SER 48 HG SER 48 10.864 -6.769 -6.897 318 H LEU 49 H LEU 49 11.621 -9.820 -3.691 319 HA LEU 49 HA LEU 49 12.806 -7.533 -2.261 320 HB2 LEU 49 HB2 LEU 49 12.748 -10.421 -1.398 321 HB3 LEU 49 HB3 LEU 49 13.638 -9.137 -0.581 322 HG LEU 49 HG LEU 49 11.716 -9.445 0.712 323 HD11 LEU 49 HD11 LEU 49 10.882 -7.339 0.773 324 HD12 LEU 49 HD12 LEU 49 10.578 -7.287 -0.963 325 HD13 LEU 49 HD13 LEU 49 12.214 -7.052 -0.347 326 HD21 LEU 49 HD21 LEU 49 10.594 -10.760 -1.219 327 HD22 LEU 49 HD22 LEU 49 9.871 -9.205 -1.630 328 HD23 LEU 49 HD23 LEU 49 9.581 -9.921 -0.044 329 H CYS 50 H CYS 50 14.407 -6.977 -3.640 330 HA CYS 50 HA CYS 50 16.194 -9.090 -4.627 331 HB2 CYS 50 HB2 CYS 50 16.135 -6.208 -5.523 332 HB3 CYS 50 HB3 CYS 50 16.891 -7.574 -6.336
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