NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
599078 | 2n2w | 25614 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 1H GLY 1 0.633 -1.111 1.207 2 H2 GLY 1 2H GLY 1 -0.606 -0.862 0.150 3 H3 GLY 1 3H GLY 1 0.136 -2.330 0.214 4 HA2 GLY 1 1HA GLY 1 1.399 0.198 -0.664 5 HA3 GLY 1 2HA GLY 1 2.210 -1.378 -0.590 6 H ILE 2 H ILE 2 2.363 -0.293 -3.055 7 HA ILE 2 HA ILE 2 0.056 -0.594 -4.676 8 HB ILE 2 HB ILE 2 2.071 0.735 -5.316 9 HG12 ILE 2 1HG1 ILE 2 1.279 -1.396 -7.337 10 HG13 ILE 2 2HG1 ILE 2 0.366 0.064 -6.973 11 HG21 ILE 2 1HG2 ILE 2 3.428 -1.911 -6.030 12 HG22 ILE 2 2HG2 ILE 2 4.102 -0.279 -6.180 13 HG23 ILE 2 3HG2 ILE 2 3.811 -0.960 -4.574 14 HD11 ILE 2 3HD1 ILE 2 2.357 1.421 -7.789 15 HD12 ILE 2 1HD1 ILE 2 3.106 -0.112 -8.314 16 HD13 ILE 2 2HD1 ILE 2 1.575 0.423 -9.034 17 H VAL 3 H VAL 3 2.517 -3.021 -3.786 18 HA VAL 3 HA VAL 3 1.743 -4.997 -5.680 19 HB VAL 3 HB VAL 3 2.856 -5.401 -2.860 20 HG11 VAL 3 1HG1 VAL 3 2.870 -7.239 -5.302 21 HG12 VAL 3 2HG1 VAL 3 3.730 -7.548 -3.775 22 HG13 VAL 3 3HG1 VAL 3 1.957 -7.498 -3.795 23 HG21 VAL 3 3HG2 VAL 3 4.329 -3.928 -4.184 24 HG22 VAL 3 1HG2 VAL 3 5.075 -5.526 -4.002 25 HG23 VAL 3 2HG2 VAL 3 4.296 -5.085 -5.537 26 H GLU 4 H GLU 4 0.600 -4.276 -2.410 27 HA GLU 4 HA GLU 4 -1.239 -6.418 -2.115 28 HB2 GLU 4 1HB GLU 4 -0.324 -4.839 -0.382 29 HB3 GLU 4 2HB GLU 4 -1.346 -3.580 -1.063 30 HG2 GLU 4 1HG GLU 4 -3.348 -4.891 -0.462 31 HG3 GLU 4 2HG GLU 4 -2.287 -6.092 0.308 32 H GLN 5 H GLN 5 -1.580 -3.122 -3.460 33 HA GLN 5 HA GLN 5 -4.425 -3.316 -3.877 34 HB2 GLN 5 1HB GLN 5 -2.294 -1.503 -5.052 35 HB3 GLN 5 2HB GLN 5 -4.030 -1.282 -5.311 36 HG2 GLN 5 1HG GLN 5 -4.410 -0.875 -2.964 37 HG3 GLN 5 2HG GLN 5 -2.758 -1.333 -2.555 38 HE21 GLN 5 2HE2 GLN 5 -4.431 1.212 -2.293 39 HE22 GLN 5 1HE2 GLN 5 -3.360 2.451 -2.904 40 H CYS 6 H CYS 6 -1.589 -3.927 -5.983 41 HA CYS 6 HA CYS 6 -3.204 -4.336 -8.357 42 HB2 CYS 6 1HB CYS 6 -0.742 -3.716 -8.234 43 HB3 CYS 6 2HB CYS 6 -0.413 -5.380 -7.759 44 H CYS 7 H CYS 7 -2.024 -6.390 -5.717 45 HA CYS 7 HA CYS 7 -2.718 -8.909 -6.940 46 HB2 CYS 7 1HB CYS 7 -1.877 -7.900 -4.292 47 HB3 CYS 7 2HB CYS 7 -2.967 -9.283 -4.206 48 H THR 8 H THR 8 -4.319 -7.099 -4.280 49 HA THR 8 HA THR 8 -6.609 -8.872 -4.392 50 HB THR 8 HB THR 8 -6.688 -6.346 -2.771 51 HG1 THR 8 HG1 THR 8 -4.581 -6.769 -2.429 52 HG21 THR 8 1HG2 THR 8 -7.400 -7.923 -1.025 53 HG22 THR 8 2HG2 THR 8 -7.062 -9.299 -2.098 54 HG23 THR 8 3HG2 THR 8 -8.374 -8.160 -2.493 55 H SER 9 H SER 9 -6.302 -7.401 -6.855 56 HA SER 9 HA SER 9 -9.031 -6.369 -7.040 57 HB2 SER 9 1HB SER 9 -7.625 -4.404 -6.153 58 HB3 SER 9 2HB SER 9 -6.801 -4.423 -7.724 59 HG SER 9 HG SER 9 -8.595 -2.972 -7.643 60 H ILE 10 H ILE 10 -9.295 -5.387 -9.358 61 HA ILE 10 HA ILE 10 -7.916 -7.170 -11.295 62 HB ILE 10 HB ILE 10 -10.016 -4.998 -11.835 63 HG12 ILE 10 1HG1 ILE 10 -10.983 -6.693 -10.347 64 HG13 ILE 10 2HG1 ILE 10 -11.714 -6.720 -11.945 65 HG21 ILE 10 1HG2 ILE 10 -8.735 -5.548 -13.833 66 HG22 ILE 10 2HG2 ILE 10 -8.918 -7.291 -13.540 67 HG23 ILE 10 3HG2 ILE 10 -10.335 -6.305 -13.990 68 HD11 ILE 10 3HD1 ILE 10 -9.590 -8.696 -11.019 69 HD12 ILE 10 1HD1 ILE 10 -11.342 -8.989 -10.981 70 HD13 ILE 10 2HD1 ILE 10 -10.521 -8.756 -12.536 71 H CYS 11 H CYS 11 -5.830 -6.377 -11.215 72 HA CYS 11 HA CYS 11 -5.149 -3.640 -10.901 73 HB2 CYS 11 1HB CYS 11 -3.776 -5.801 -10.572 74 HB3 CYS 11 2HB CYS 11 -3.444 -5.711 -12.300 75 H SER 12 H SER 12 -5.175 -1.966 -12.291 76 HA SER 12 HA SER 12 -6.150 -2.376 -14.992 77 HB2 SER 12 1HB SER 12 -4.991 0.111 -13.682 78 HB3 SER 12 2HB SER 12 -5.905 0.063 -15.200 79 HG SER 12 HG SER 12 -6.862 -0.745 -12.641 80 H LEU 13 H LEU 13 -5.087 -1.733 -16.948 81 HA LEU 13 HA LEU 13 -2.580 -2.915 -17.300 82 HB2 LEU 13 1HB LEU 13 -4.221 -2.467 -19.091 83 HB3 LEU 13 2HB LEU 13 -3.912 -0.739 -18.949 84 HG LEU 13 HG LEU 13 -1.594 -1.078 -19.738 85 HD11 LEU 13 1HD1 LEU 13 -0.982 -3.252 -20.775 86 HD12 LEU 13 2HD1 LEU 13 -2.454 -3.970 -20.079 87 HD13 LEU 13 3HD1 LEU 13 -1.166 -3.357 -19.016 88 HD21 LEU 13 3HD2 LEU 13 -3.409 -0.540 -21.311 89 HD22 LEU 13 1HD2 LEU 13 -3.728 -2.276 -21.547 90 HD23 LEU 13 2HD2 LEU 13 -2.179 -1.569 -22.069 91 H TYR 14 H TYR 14 -3.268 0.576 -16.724 92 HA TYR 14 HA TYR 14 -0.468 1.227 -17.121 93 HB2 TYR 14 1HB TYR 14 -1.117 3.470 -16.265 94 HB3 TYR 14 2HB TYR 14 -2.064 2.912 -17.647 95 HD1 TYR 14 HD1 TYR 14 -2.159 3.682 -14.023 96 HD2 TYR 14 HD2 TYR 14 -4.451 2.392 -17.434 97 HE1 TYR 14 HE1 TYR 14 -4.281 4.112 -12.775 98 HE2 TYR 14 HE2 TYR 14 -6.561 2.810 -16.166 99 HH TYR 14 HH TYR 14 -6.569 4.075 -12.840 100 H GLN 15 H GLN 15 -2.439 0.326 -14.322 101 HA GLN 15 HA GLN 15 -0.538 1.224 -12.327 102 HB2 GLN 15 1HB GLN 15 -2.616 -1.001 -12.269 103 HB3 GLN 15 2HB GLN 15 -1.709 -0.439 -10.860 104 HG2 GLN 15 1HG GLN 15 -2.710 1.783 -11.071 105 HG3 GLN 15 2HG GLN 15 -3.597 1.268 -12.513 106 HE21 GLN 15 2HE2 GLN 15 -3.977 1.878 -9.347 107 HE22 GLN 15 1HE2 GLN 15 -5.289 0.781 -8.985 108 H LEU 16 H LEU 16 -1.049 -1.649 -14.290 109 HA LEU 16 HA LEU 16 0.998 -3.283 -13.113 110 HB2 LEU 16 1HB LEU 16 -0.988 -3.919 -14.525 111 HB3 LEU 16 2HB LEU 16 -0.154 -3.253 -15.902 112 HG LEU 16 HG LEU 16 0.559 -5.762 -14.396 113 HD11 LEU 16 1HD1 LEU 16 -0.033 -6.586 -16.788 114 HD12 LEU 16 2HD1 LEU 16 -0.707 -4.977 -17.041 115 HD13 LEU 16 3HD1 LEU 16 -1.347 -6.006 -15.748 116 HD21 LEU 16 3HD2 LEU 16 2.162 -6.159 -16.277 117 HD22 LEU 16 1HD2 LEU 16 2.660 -4.894 -15.142 118 HD23 LEU 16 2HD2 LEU 16 1.988 -4.444 -16.719 119 H GLU 17 H GLU 17 0.954 -1.248 -16.156 120 HA GLU 17 HA GLU 17 3.710 -1.852 -16.633 121 HB2 GLU 17 1HB GLU 17 3.616 -0.236 -18.413 122 HB3 GLU 17 2HB GLU 17 2.246 -1.315 -18.456 123 HG2 GLU 17 1HG GLU 17 1.009 0.414 -18.657 124 HG3 GLU 17 2HG GLU 17 1.408 0.744 -16.978 125 H ASN 18 H ASN 18 2.215 0.477 -14.536 126 HA ASN 18 HA ASN 18 4.375 2.298 -14.285 127 HB2 ASN 18 1HB ASN 18 1.985 2.002 -13.034 128 HB3 ASN 18 2HB ASN 18 3.039 1.362 -11.779 129 HD21 ASN 18 2HD2 ASN 18 5.304 3.060 -12.344 130 HD22 ASN 18 1HD2 ASN 18 4.842 4.679 -11.858 131 H TYR 19 H TYR 19 4.239 -1.116 -13.442 132 HA TYR 19 HA TYR 19 6.405 -0.966 -11.466 133 HB2 TYR 19 1HB TYR 19 5.119 -3.240 -12.998 134 HB3 TYR 19 2HB TYR 19 6.507 -3.472 -11.948 135 HD1 TYR 19 HD2 TYR 19 6.340 -3.218 -9.502 136 HD2 TYR 19 HD1 TYR 19 2.878 -2.907 -12.021 137 HE1 TYR 19 HE2 TYR 19 4.855 -3.594 -7.531 138 HE2 TYR 19 HE1 TYR 19 1.405 -3.278 -10.062 139 HH TYR 19 HH TYR 19 2.715 -3.860 -6.809 140 H CYS 20 H CYS 20 6.248 -0.993 -14.971 141 HA CYS 20 HA CYS 20 8.563 -2.595 -15.438 142 HB2 CYS 20 1HB CYS 20 7.528 -0.367 -17.201 143 HB3 CYS 20 2HB CYS 20 8.520 -1.733 -17.696 144 H ASN 21 H ASN 21 10.675 -2.182 -15.413 145 HA ASN 21 HA ASN 21 11.641 0.630 -15.018 146 HB2 ASN 21 1HB ASN 21 12.723 -2.087 -14.175 147 HB3 ASN 21 2HB ASN 21 13.792 -0.691 -14.349 148 HD21 ASN 21 2HD2 ASN 21 10.454 -0.619 -13.156 149 HD22 ASN 21 1HD2 ASN 21 10.877 -0.109 -11.541 150 H1 PHE 1 1H PHE 1 -2.603 -8.937 -23.319 151 H2 PHE 1 2H PHE 1 -3.360 -7.475 -23.255 152 H3 PHE 1 3H PHE 1 -1.729 -7.570 -23.023 153 HA PHE 1 HA PHE 1 -2.032 -8.823 -20.996 154 HB2 PHE 1 1HB PHE 1 -1.804 -6.409 -20.876 155 HB3 PHE 1 2HB PHE 1 -3.540 -6.195 -21.153 156 HD1 PHE 1 HD2 PHE 1 -1.644 -8.573 -18.940 157 HD2 PHE 1 HD1 PHE 1 -4.431 -5.295 -19.178 158 HE1 PHE 1 HE2 PHE 1 -2.109 -8.795 -16.548 159 HE2 PHE 1 HE1 PHE 1 -4.846 -5.496 -16.732 160 HZ PHE 1 HZ PHE 1 -3.682 -7.273 -15.443 161 H VAL 2 H VAL 2 -3.540 -9.587 -19.355 162 HA VAL 2 HA VAL 2 -6.102 -10.541 -20.540 163 HB VAL 2 HB VAL 2 -5.972 -12.265 -18.700 164 HG11 VAL 2 1HG1 VAL 2 -3.458 -12.156 -20.422 165 HG12 VAL 2 2HG1 VAL 2 -4.182 -13.601 -19.684 166 HG13 VAL 2 3HG1 VAL 2 -5.055 -12.729 -20.962 167 HG21 VAL 2 3HG2 VAL 2 -3.946 -12.526 -17.357 168 HG22 VAL 2 1HG2 VAL 2 -3.163 -11.154 -18.163 169 HG23 VAL 2 2HG2 VAL 2 -4.565 -10.884 -17.098 170 H ASN 3 H ASN 3 -7.377 -11.187 -18.107 171 HA ASN 3 HA ASN 3 -7.710 -8.526 -16.768 172 HB2 ASN 3 1HB ASN 3 -9.884 -10.582 -17.357 173 HB3 ASN 3 2HB ASN 3 -10.109 -9.006 -16.577 174 HD21 ASN 3 2HD2 ASN 3 -8.954 -7.186 -18.053 175 HD22 ASN 3 1HD2 ASN 3 -9.521 -7.229 -19.703 176 H GLN 4 H GLN 4 -9.668 -9.844 -14.949 177 HA GLN 4 HA GLN 4 -9.806 -11.023 -13.014 178 HB2 GLN 4 1HB GLN 4 -9.332 -12.923 -14.534 179 HB3 GLN 4 2HB GLN 4 -7.616 -12.784 -14.177 180 HG2 GLN 4 1HG GLN 4 -7.880 -13.510 -11.959 181 HG3 GLN 4 2HG GLN 4 -9.644 -13.300 -12.008 182 HE21 GLN 4 2HE2 GLN 4 -7.339 -15.583 -11.917 183 HE22 GLN 4 1HE2 GLN 4 -8.149 -16.859 -12.796 184 H HIS 5 H HIS 5 -8.534 -11.730 -10.976 185 HA HIS 5 HA HIS 5 -6.779 -9.568 -10.142 186 HB2 HIS 5 1HB HIS 5 -7.601 -12.244 -8.940 187 HB3 HIS 5 2HB HIS 5 -6.383 -11.210 -8.183 188 HD1 HIS 5 HD1 HIS 5 -9.827 -10.257 -9.625 189 HD2 HIS 5 HD2 HIS 5 -7.599 -10.045 -6.122 190 HE1 HIS 5 HE1 HIS 5 -11.207 -8.954 -7.962 191 H LEU 6 H LEU 6 -4.515 -9.727 -9.843 192 HA LEU 6 HA LEU 6 -3.325 -11.808 -11.604 193 HB2 LEU 6 1HB LEU 6 -2.134 -9.208 -10.625 194 HB3 LEU 6 2HB LEU 6 -1.455 -10.294 -11.832 195 HG LEU 6 HG LEU 6 -3.945 -8.584 -12.110 196 HD11 LEU 6 1HD1 LEU 6 -1.259 -8.570 -13.542 197 HD12 LEU 6 2HD1 LEU 6 -1.711 -7.479 -12.215 198 HD13 LEU 6 3HD1 LEU 6 -2.583 -7.407 -13.751 199 HD21 LEU 6 3HD2 LEU 6 -4.381 -10.668 -13.329 200 HD22 LEU 6 1HD2 LEU 6 -2.759 -10.607 -14.073 201 HD23 LEU 6 2HD2 LEU 6 -3.989 -9.387 -14.488 202 H CYS 7 H CYS 7 -3.705 -11.368 -8.322 203 HA CYS 7 HA CYS 7 -1.065 -11.694 -7.365 204 HB2 CYS 7 1HB CYS 7 -3.458 -11.301 -6.194 205 HB3 CYS 7 2HB CYS 7 -3.274 -13.031 -5.875 206 H GLY 8 H GLY 8 0.340 -13.265 -7.778 207 HA2 GLY 8 1HA GLY 8 0.759 -15.722 -7.350 208 HA3 GLY 8 2HA GLY 8 -0.716 -16.014 -8.294 209 H SER 9 H SER 9 0.515 -17.240 -9.842 210 HA SER 9 HA SER 9 2.824 -16.291 -11.192 211 HB2 SER 9 1HB SER 9 1.991 -18.639 -11.221 212 HB3 SER 9 2HB SER 9 0.645 -18.131 -12.264 213 HG SER 9 HG SER 9 2.058 -17.701 -13.889 214 H HIS 10 H HIS 10 -0.579 -15.556 -11.676 215 HA HIS 10 HA HIS 10 -0.517 -14.634 -14.338 216 HB2 HIS 10 1HB HIS 10 -2.129 -13.779 -11.915 217 HB3 HIS 10 2HB HIS 10 -2.362 -13.051 -13.508 218 HD1 HIS 10 HD1 HIS 10 -4.863 -14.156 -12.970 219 HD2 HIS 10 HD2 HIS 10 -1.757 -16.722 -14.065 220 HE1 HIS 10 HE1 HIS 10 -5.926 -16.307 -13.786 221 H LEU 11 H LEU 11 0.629 -13.011 -11.358 222 HA LEU 11 HA LEU 11 0.755 -10.406 -12.566 223 HB2 LEU 11 1HB LEU 11 0.873 -10.885 -10.116 224 HB3 LEU 11 2HB LEU 11 2.476 -11.552 -10.338 225 HG LEU 11 HG LEU 11 3.311 -9.347 -11.033 226 HD11 LEU 11 1HD1 LEU 11 1.349 -8.341 -12.067 227 HD12 LEU 11 2HD1 LEU 11 1.870 -7.320 -10.718 228 HD13 LEU 11 3HD1 LEU 11 0.459 -8.389 -10.524 229 HD21 LEU 11 3HD2 LEU 11 3.329 -10.002 -8.654 230 HD22 LEU 11 1HD2 LEU 11 1.723 -9.264 -8.439 231 HD23 LEU 11 2HD2 LEU 11 3.127 -8.250 -8.847 232 H VAL 12 H VAL 12 3.042 -13.134 -12.375 233 HA VAL 12 HA VAL 12 5.246 -11.611 -13.420 234 HB VAL 12 HB VAL 12 4.792 -14.642 -13.500 235 HG11 VAL 12 1HG1 VAL 12 7.280 -14.765 -13.678 236 HG12 VAL 12 2HG1 VAL 12 6.555 -13.939 -15.072 237 HG13 VAL 12 3HG1 VAL 12 7.345 -12.990 -13.794 238 HG21 VAL 12 3HG2 VAL 12 4.711 -13.847 -11.187 239 HG22 VAL 12 1HG2 VAL 12 6.253 -14.672 -11.467 240 HG23 VAL 12 2HG2 VAL 12 6.198 -12.894 -11.427 241 H GLU 13 H GLU 13 2.771 -13.778 -14.809 242 HA GLU 13 HA GLU 13 3.734 -13.627 -17.508 243 HB2 GLU 13 1HB GLU 13 0.977 -14.165 -16.353 244 HB3 GLU 13 2HB GLU 13 1.393 -14.370 -18.061 245 HG2 GLU 13 1HG GLU 13 3.004 -16.093 -17.533 246 HG3 GLU 13 2HG GLU 13 2.813 -15.813 -15.796 247 H ALA 14 H ALA 14 1.455 -11.622 -15.624 248 HA ALA 14 HA ALA 14 0.563 -9.963 -17.759 249 HB1 ALA 14 3HB ALA 14 0.992 -9.274 -14.831 250 HB2 ALA 14 1HB ALA 14 -0.031 -8.416 -15.988 251 HB3 ALA 14 2HB ALA 14 -0.451 -10.060 -15.510 252 H LEU 15 H LEU 15 3.287 -9.594 -15.419 253 HA LEU 15 HA LEU 15 4.220 -7.127 -16.524 254 HB2 LEU 15 1HB LEU 15 5.530 -9.307 -14.886 255 HB3 LEU 15 2HB LEU 15 6.399 -7.853 -15.385 256 HG LEU 15 HG LEU 15 3.786 -7.645 -13.888 257 HD11 LEU 15 1HD1 LEU 15 6.555 -7.873 -12.666 258 HD12 LEU 15 2HD1 LEU 15 5.233 -9.051 -12.509 259 HD13 LEU 15 3HD1 LEU 15 5.065 -7.428 -11.802 260 HD21 LEU 15 3HD2 LEU 15 4.758 -5.633 -15.023 261 HD22 LEU 15 1HD2 LEU 15 6.208 -5.808 -14.014 262 HD23 LEU 15 2HD2 LEU 15 4.632 -5.467 -13.264 263 H TYR 16 H TYR 16 5.033 -10.531 -17.277 264 HA TYR 16 HA TYR 16 7.115 -9.900 -19.138 265 HB2 TYR 16 1HB TYR 16 6.678 -12.135 -18.146 266 HB3 TYR 16 2HB TYR 16 5.202 -12.259 -19.114 267 HD1 TYR 16 HD2 TYR 16 8.926 -11.844 -19.422 268 HD2 TYR 16 HD1 TYR 16 5.275 -13.093 -21.330 269 HE1 TYR 16 HE2 TYR 16 10.238 -12.760 -21.343 270 HE2 TYR 16 HE1 TYR 16 6.591 -14.015 -23.236 271 HH TYR 16 HH TYR 16 8.655 -14.348 -24.131 272 H LEU 17 H LEU 17 3.564 -10.245 -19.572 273 HA LEU 17 HA LEU 17 3.765 -9.927 -22.462 274 HB2 LEU 17 1HB LEU 17 1.440 -9.797 -20.523 275 HB3 LEU 17 2HB LEU 17 1.256 -9.621 -22.269 276 HG LEU 17 HG LEU 17 2.466 -12.073 -20.970 277 HD11 LEU 17 1HD1 LEU 17 0.145 -11.770 -20.207 278 HD12 LEU 17 2HD1 LEU 17 0.279 -13.149 -21.315 279 HD13 LEU 17 3HD1 LEU 17 -0.396 -11.611 -21.900 280 HD21 LEU 17 3HD2 LEU 17 1.386 -11.564 -23.773 281 HD22 LEU 17 1HD2 LEU 17 1.918 -13.143 -23.148 282 HD23 LEU 17 2HD2 LEU 17 3.086 -11.822 -23.322 283 H VAL 18 H VAL 18 3.455 -7.671 -19.786 284 HA VAL 18 HA VAL 18 2.645 -5.534 -21.696 285 HB VAL 18 HB VAL 18 2.786 -5.545 -18.659 286 HG11 VAL 18 1HG1 VAL 18 1.478 -3.418 -18.811 287 HG12 VAL 18 2HG1 VAL 18 3.109 -3.266 -19.487 288 HG13 VAL 18 3HG1 VAL 18 1.717 -3.433 -20.576 289 HG21 VAL 18 3HG2 VAL 18 0.254 -5.501 -18.896 290 HG22 VAL 18 1HG2 VAL 18 0.463 -5.781 -20.633 291 HG23 VAL 18 2HG2 VAL 18 0.992 -6.999 -19.453 292 H CYS 19 H CYS 19 5.277 -6.150 -19.258 293 HA CYS 19 HA CYS 19 6.686 -3.742 -20.215 294 HB2 CYS 19 1HB CYS 19 7.758 -5.933 -18.405 295 HB3 CYS 19 2HB CYS 19 8.388 -4.306 -18.612 296 H GLY 20 H GLY 20 6.928 -7.309 -20.502 297 HA2 GLY 20 1HA GLY 20 7.914 -8.349 -22.437 298 HA3 GLY 20 2HA GLY 20 8.927 -6.919 -22.674 299 H GLU 21 H GLU 21 10.736 -8.287 -22.819 300 HA GLU 21 HA GLU 21 11.613 -10.052 -20.725 301 HB2 GLU 21 1HB GLU 21 12.947 -8.676 -23.073 302 HB3 GLU 21 2HB GLU 21 13.864 -9.699 -21.964 303 HG2 GLU 21 1HG GLU 21 11.379 -10.826 -23.193 304 HG3 GLU 21 2HG GLU 21 12.828 -10.648 -24.199 305 H ARG 22 H ARG 22 11.357 -6.724 -20.627 306 HA ARG 22 HA ARG 22 13.411 -6.569 -18.467 307 HB2 ARG 22 1HB ARG 22 12.878 -4.455 -20.601 308 HB3 ARG 22 2HB ARG 22 13.925 -4.245 -19.195 309 HG2 ARG 22 1HG ARG 22 15.475 -5.956 -20.052 310 HG3 ARG 22 2HG ARG 22 14.417 -6.227 -21.452 311 HD2 ARG 22 1HD ARG 22 15.740 -3.588 -20.738 312 HD3 ARG 22 2HD ARG 22 16.309 -4.714 -21.990 313 HE ARG 22 HE ARG 22 13.629 -4.201 -22.583 314 HH11 ARG 22 1HH1 ARG 22 16.529 -2.216 -22.305 315 HH12 ARG 22 2HH1 ARG 22 15.940 -1.029 -23.440 316 HH21 ARG 22 1HH2 ARG 22 12.943 -2.659 -24.016 317 HH22 ARG 22 2HH2 ARG 22 13.941 -1.281 -24.391 318 H GLY 23 H GLY 23 12.620 -5.270 -16.748 319 HA2 GLY 23 1HA GLY 23 10.879 -3.335 -16.570 320 HA3 GLY 23 2HA GLY 23 9.743 -4.593 -17.040 321 H PHE 24 H PHE 24 11.096 -6.714 -15.541 322 HA PHE 24 HA PHE 24 10.678 -5.787 -12.745 323 HB2 PHE 24 1HB PHE 24 9.192 -7.628 -12.272 324 HB3 PHE 24 2HB PHE 24 8.523 -6.711 -13.627 325 HD1 PHE 24 HD1 PHE 24 8.721 -7.637 -15.978 326 HD2 PHE 24 HD2 PHE 24 9.815 -9.946 -12.499 327 HE1 PHE 24 HE1 PHE 24 8.598 -9.718 -17.329 328 HE2 PHE 24 HE2 PHE 24 9.683 -12.034 -13.852 329 HZ PHE 24 HZ PHE 24 9.059 -11.928 -16.268 330 H PHE 25 H PHE 25 11.318 -7.645 -11.230 331 HA PHE 25 HA PHE 25 13.502 -9.264 -12.447 332 HB2 PHE 25 1HB PHE 25 14.379 -7.215 -11.274 333 HB3 PHE 25 2HB PHE 25 13.646 -7.810 -9.781 334 HD1 PHE 25 HD1 PHE 25 14.485 -9.958 -8.752 335 HD2 PHE 25 HD2 PHE 25 16.426 -8.110 -12.116 336 HE1 PHE 25 HE1 PHE 25 16.524 -11.323 -8.319 337 HE2 PHE 25 HE2 PHE 25 18.473 -9.463 -11.685 338 HZ PHE 25 HZ PHE 25 18.527 -11.074 -9.781 339 H NVA 26 H ARX 26 13.170 -11.310 -12.102 340 HA NVA 26 HA ARX 26 11.801 -12.234 -9.623 341 HB2 NVA 26 1HB ARX 26 10.317 -12.712 -11.513 342 HB3 NVA 26 2HB ARX 26 11.630 -13.422 -12.435 343 HG2 NVA 26 1HG ARX 26 10.244 -15.235 -11.581 344 HG3 NVA 26 2HG ARX 26 11.798 -15.307 -10.787 345 HD2 NVA 26 1HD ARX 26 10.576 -13.923 -8.846 346 HD3 NVA 26 2HD ARX 26 9.093 -14.494 -9.629 347 H THR 27 H THR 27 12.915 -13.362 -8.301 348 HA THR 27 HA THR 27 15.709 -14.039 -8.702 349 HB THR 27 HB THR 27 15.332 -15.218 -6.440 350 HG1 THR 27 HG1 THR 27 12.970 -15.405 -6.991 351 HG21 THR 27 1HG2 THR 27 16.119 -12.874 -6.549 352 HG22 THR 27 2HG2 THR 27 15.011 -13.123 -5.183 353 HG23 THR 27 3HG2 THR 27 14.434 -12.310 -6.652 354 HA PRO 28 HA PRO 28 14.944 -18.050 -10.328 355 HB2 PRO 28 1HB PRO 28 16.926 -19.644 -9.306 356 HB3 PRO 28 2HB PRO 28 17.232 -18.391 -10.554 357 HG2 PRO 28 1HG PRO 28 17.596 -18.209 -7.567 358 HG3 PRO 28 2HG PRO 28 18.741 -17.770 -8.872 359 HD2 PRO 28 1HD PRO 28 17.206 -15.914 -7.646 360 HD3 PRO 28 2HD PRO 28 17.562 -15.815 -9.405 361 H HIX 29 H HIX 29 13.096 -18.860 -9.638 362 HA HIX 29 HA HIX 29 12.597 -19.652 -6.864 363 HB1 HIX 29 1HB HIX 29 10.721 -19.949 -9.265 364 HB2 HIX 29 2HB HIX 29 10.285 -20.073 -7.569 365 HD2 HIX 29 HD2 HIX 29 10.320 -17.509 -10.287 366 HD1 HIX 29 HD1 HIX 29 11.050 -17.610 -6.177 367 HE1 HIX 29 HE1 HIX 29 9.364 -15.874 -7.027 368 H THR 30 H THR 30 13.480 -21.343 -6.133 369 HA THR 30 HA THR 30 12.941 -24.025 -7.212 370 HB THR 30 HB THR 30 15.618 -24.247 -6.486 371 HG1 THR 30 HG1 THR 30 15.517 -21.817 -6.716 372 HG21 THR 30 1HG2 THR 30 14.501 -23.812 -9.285 373 HG22 THR 30 2HG2 THR 30 14.551 -25.361 -8.409 374 HG23 THR 30 3HG2 THR 30 16.065 -24.562 -8.893 Start of MODEL 2 1 H1 GLY 1 1H GLY 1 2.958 1.490 -0.677 2 H2 GLY 1 2H GLY 1 1.977 2.109 -1.851 3 H3 GLY 1 3H GLY 1 1.558 0.711 -1.080 4 HA2 GLY 1 1HA GLY 1 3.893 1.060 -2.841 5 HA3 GLY 1 2HA GLY 1 3.444 -0.436 -2.007 6 H ILE 2 H ILE 2 3.491 -1.204 -4.380 7 HA ILE 2 HA ILE 2 0.848 -0.610 -5.667 8 HB ILE 2 HB ILE 2 3.393 -1.777 -6.921 9 HG12 ILE 2 1HG1 ILE 2 2.105 0.966 -7.243 10 HG13 ILE 2 2HG1 ILE 2 3.587 0.631 -6.341 11 HG21 ILE 2 1HG2 ILE 2 1.292 -2.620 -7.988 12 HG22 ILE 2 2HG2 ILE 2 0.739 -0.950 -8.233 13 HG23 ILE 2 3HG2 ILE 2 2.177 -1.565 -9.083 14 HD11 ILE 2 3HD1 ILE 2 4.589 -0.227 -8.520 15 HD12 ILE 2 1HD1 ILE 2 3.151 0.429 -9.332 16 HD13 ILE 2 2HD1 ILE 2 4.244 1.516 -8.455 17 H VAL 3 H VAL 3 3.103 -3.177 -4.666 18 HA VAL 3 HA VAL 3 1.994 -5.331 -5.885 19 HB VAL 3 HB VAL 3 2.746 -6.611 -3.684 20 HG11 VAL 3 1HG1 VAL 3 4.643 -5.124 -5.558 21 HG12 VAL 3 2HG1 VAL 3 5.059 -6.547 -4.572 22 HG13 VAL 3 3HG1 VAL 3 3.871 -6.696 -5.872 23 HG21 VAL 3 3HG2 VAL 3 2.883 -4.430 -2.349 24 HG22 VAL 3 1HG2 VAL 3 4.362 -5.403 -2.345 25 HG23 VAL 3 2HG2 VAL 3 4.266 -3.974 -3.381 26 H GLU 4 H GLU 4 0.878 -4.380 -2.584 27 HA GLU 4 HA GLU 4 -1.012 -6.506 -2.457 28 HB2 GLU 4 1HB GLU 4 -0.163 -5.237 -0.520 29 HB3 GLU 4 2HB GLU 4 -0.977 -3.788 -1.103 30 HG2 GLU 4 1HG GLU 4 -3.161 -4.949 -0.856 31 HG3 GLU 4 2HG GLU 4 -2.310 -6.333 -0.139 32 H GLN 5 H GLN 5 -1.254 -3.118 -3.492 33 HA GLN 5 HA GLN 5 -4.067 -3.029 -3.863 34 HB2 GLN 5 1HB GLN 5 -1.737 -1.466 -5.044 35 HB3 GLN 5 2HB GLN 5 -3.423 -1.075 -5.409 36 HG2 GLN 5 1HG GLN 5 -2.558 0.369 -3.601 37 HG3 GLN 5 2HG GLN 5 -3.892 -0.639 -3.039 38 HE21 GLN 5 2HE2 GLN 5 -3.609 -1.354 -1.042 39 HE22 GLN 5 1HE2 GLN 5 -2.103 -1.850 -0.325 40 H CYS 6 H CYS 6 -1.443 -3.987 -6.047 41 HA CYS 6 HA CYS 6 -3.215 -4.316 -8.345 42 HB2 CYS 6 1HB CYS 6 -0.757 -3.763 -8.414 43 HB3 CYS 6 2HB CYS 6 -0.428 -5.401 -7.842 44 H CYS 7 H CYS 7 -1.866 -6.372 -5.765 45 HA CYS 7 HA CYS 7 -2.593 -8.893 -6.873 46 HB2 CYS 7 1HB CYS 7 -1.600 -7.840 -4.369 47 HB3 CYS 7 2HB CYS 7 -2.879 -9.001 -4.037 48 H THR 8 H THR 8 -4.323 -6.807 -4.491 49 HA THR 8 HA THR 8 -6.576 -8.649 -4.385 50 HB THR 8 HB THR 8 -7.606 -6.894 -2.934 51 HG1 THR 8 HG1 THR 8 -6.765 -5.062 -3.978 52 HG21 THR 8 1HG2 THR 8 -5.972 -6.948 -1.137 53 HG22 THR 8 2HG2 THR 8 -4.661 -7.317 -2.272 54 HG23 THR 8 3HG2 THR 8 -5.947 -8.515 -1.979 55 H SER 9 H SER 9 -5.982 -7.537 -7.089 56 HA SER 9 HA SER 9 -8.723 -6.775 -7.727 57 HB2 SER 9 1HB SER 9 -8.248 -4.613 -8.702 58 HB3 SER 9 2HB SER 9 -7.698 -4.586 -7.016 59 HG SER 9 HG SER 9 -5.636 -4.591 -7.663 60 H ILE 10 H ILE 10 -8.766 -6.094 -10.147 61 HA ILE 10 HA ILE 10 -7.559 -8.207 -11.734 62 HB ILE 10 HB ILE 10 -9.085 -5.661 -12.504 63 HG12 ILE 10 1HG1 ILE 10 -10.410 -7.248 -11.136 64 HG13 ILE 10 2HG1 ILE 10 -11.036 -7.058 -12.772 65 HG21 ILE 10 1HG2 ILE 10 -7.839 -6.346 -14.438 66 HG22 ILE 10 2HG2 ILE 10 -8.257 -8.052 -14.188 67 HG23 ILE 10 3HG2 ILE 10 -9.513 -6.892 -14.680 68 HD11 ILE 10 3HD1 ILE 10 -11.094 -9.436 -11.928 69 HD12 ILE 10 1HD1 ILE 10 -10.194 -9.246 -13.439 70 HD13 ILE 10 2HD1 ILE 10 -9.321 -9.432 -11.911 71 H CYS 11 H CYS 11 -6.835 -4.942 -10.816 72 HA CYS 11 HA CYS 11 -5.076 -3.564 -11.084 73 HB2 CYS 11 1HB CYS 11 -3.888 -5.855 -10.782 74 HB3 CYS 11 2HB CYS 11 -3.499 -5.695 -12.493 75 H SER 12 H SER 12 -5.324 -1.900 -12.395 76 HA SER 12 HA SER 12 -6.174 -2.247 -15.137 77 HB2 SER 12 1HB SER 12 -5.076 0.243 -13.788 78 HB3 SER 12 2HB SER 12 -6.073 0.183 -15.256 79 HG SER 12 HG SER 12 -7.702 -0.833 -13.880 80 H LEU 13 H LEU 13 -5.045 -1.459 -17.046 81 HA LEU 13 HA LEU 13 -2.515 -2.629 -17.331 82 HB2 LEU 13 1HB LEU 13 -4.086 -2.088 -19.179 83 HB3 LEU 13 2HB LEU 13 -3.721 -0.377 -18.972 84 HG LEU 13 HG LEU 13 -1.360 -0.808 -19.605 85 HD11 LEU 13 1HD1 LEU 13 -2.356 -3.632 -20.137 86 HD12 LEU 13 2HD1 LEU 13 -1.085 -3.142 -18.987 87 HD13 LEU 13 3HD1 LEU 13 -0.815 -2.966 -20.725 88 HD21 LEU 13 3HD2 LEU 13 -1.800 -1.145 -21.989 89 HD22 LEU 13 1HD2 LEU 13 -3.029 -0.094 -21.256 90 HD23 LEU 13 2HD2 LEU 13 -3.424 -1.792 -21.614 91 H TYR 14 H TYR 14 -3.266 0.846 -16.729 92 HA TYR 14 HA TYR 14 -0.500 1.591 -16.929 93 HB2 TYR 14 1HB TYR 14 -1.337 3.683 -15.714 94 HB3 TYR 14 2HB TYR 14 -2.020 3.314 -17.301 95 HD1 TYR 14 HD1 TYR 14 -2.733 3.345 -13.641 96 HD2 TYR 14 HD2 TYR 14 -4.367 2.765 -17.583 97 HE1 TYR 14 HE1 TYR 14 -5.048 3.440 -12.705 98 HE2 TYR 14 HE2 TYR 14 -6.670 2.861 -16.633 99 HH TYR 14 HH TYR 14 -7.290 3.315 -13.157 100 H GLN 15 H GLN 15 -2.411 0.285 -14.269 101 HA GLN 15 HA GLN 15 -0.538 1.097 -12.191 102 HB2 GLN 15 1HB GLN 15 -2.603 -1.135 -12.273 103 HB3 GLN 15 2HB GLN 15 -1.699 -0.641 -10.841 104 HG2 GLN 15 1HG GLN 15 -2.722 1.588 -10.950 105 HG3 GLN 15 2HG GLN 15 -3.620 1.110 -12.396 106 HE21 GLN 15 2HE2 GLN 15 -3.986 1.627 -9.224 107 HE22 GLN 15 1HE2 GLN 15 -5.268 0.496 -8.876 108 H LEU 16 H LEU 16 -1.060 -1.664 -14.338 109 HA LEU 16 HA LEU 16 1.014 -3.336 -13.266 110 HB2 LEU 16 1HB LEU 16 -0.933 -3.922 -14.765 111 HB3 LEU 16 2HB LEU 16 -0.079 -3.164 -16.081 112 HG LEU 16 HG LEU 16 0.768 -5.685 -14.641 113 HD11 LEU 16 1HD1 LEU 16 0.106 -6.587 -16.973 114 HD12 LEU 16 2HD1 LEU 16 -0.687 -5.026 -17.221 115 HD13 LEU 16 3HD1 LEU 16 -1.200 -6.072 -15.885 116 HD21 LEU 16 3HD2 LEU 16 2.273 -5.948 -16.650 117 HD22 LEU 16 1HD2 LEU 16 2.775 -4.687 -15.517 118 HD23 LEU 16 2HD2 LEU 16 1.965 -4.240 -17.032 119 H GLU 17 H GLU 17 0.898 -0.993 -16.008 120 HA GLU 17 HA GLU 17 3.621 -1.331 -16.803 121 HB2 GLU 17 1HB GLU 17 1.678 0.978 -17.046 122 HB3 GLU 17 2HB GLU 17 3.288 1.004 -17.781 123 HG2 GLU 17 1HG GLU 17 2.765 -0.897 -19.176 124 HG3 GLU 17 2HG GLU 17 1.226 -1.152 -18.355 125 H ASN 18 H ASN 18 2.127 0.649 -14.249 126 HA ASN 18 HA ASN 18 4.411 2.238 -13.689 127 HB2 ASN 18 1HB ASN 18 2.026 2.487 -12.818 128 HB3 ASN 18 2HB ASN 18 2.430 1.247 -11.622 129 HD21 ASN 18 2HD2 ASN 18 4.643 3.752 -12.823 130 HD22 ASN 18 1HD2 ASN 18 4.746 4.619 -11.312 131 H TYR 19 H TYR 19 4.183 -1.169 -13.286 132 HA TYR 19 HA TYR 19 6.048 -1.333 -11.015 133 HB2 TYR 19 1HB TYR 19 5.093 -3.287 -13.118 134 HB3 TYR 19 2HB TYR 19 6.455 -3.666 -12.082 135 HD1 TYR 19 HD1 TYR 19 6.135 -3.708 -9.547 136 HD2 TYR 19 HD2 TYR 19 2.873 -3.666 -12.335 137 HE1 TYR 19 HE1 TYR 19 4.625 -4.687 -7.817 138 HE2 TYR 19 HE2 TYR 19 1.381 -4.635 -10.611 139 HH TYR 19 HH TYR 19 2.552 -5.527 -7.377 140 H CYS 20 H CYS 20 6.325 -0.919 -14.532 141 HA CYS 20 HA CYS 20 9.163 -1.794 -14.348 142 HB2 CYS 20 1HB CYS 20 8.964 -2.439 -16.673 143 HB3 CYS 20 2HB CYS 20 7.817 -3.271 -15.641 144 H ASN 21 H ASN 21 10.383 -1.031 -16.424 145 HA ASN 21 HA ASN 21 10.458 1.946 -16.186 146 HB2 ASN 21 1HB ASN 21 12.715 -0.018 -16.788 147 HB3 ASN 21 2HB ASN 21 12.878 1.731 -16.565 148 HD21 ASN 21 2HD2 ASN 21 12.501 -1.352 -15.035 149 HD22 ASN 21 1HD2 ASN 21 12.741 -0.799 -13.402 150 H1 PHE 1 1H PHE 1 -1.261 -7.278 -23.018 151 H2 PHE 1 2H PHE 1 -2.207 -8.495 -23.612 152 H3 PHE 1 3H PHE 1 -2.792 -6.958 -23.547 153 HA PHE 1 HA PHE 1 -2.110 -8.647 -21.224 154 HB2 PHE 1 1HB PHE 1 -1.671 -6.192 -20.971 155 HB3 PHE 1 2HB PHE 1 -3.384 -5.894 -21.284 156 HD1 PHE 1 HD1 PHE 1 -1.702 -8.577 -19.238 157 HD2 PHE 1 HD2 PHE 1 -4.259 -5.109 -19.244 158 HE1 PHE 1 HE1 PHE 1 -2.205 -8.950 -16.864 159 HE2 PHE 1 HE2 PHE 1 -4.729 -5.469 -16.824 160 HZ PHE 1 HZ PHE 1 -3.693 -7.403 -15.643 161 H VAL 2 H VAL 2 -3.951 -9.526 -20.096 162 HA VAL 2 HA VAL 2 -6.616 -9.067 -21.338 163 HB VAL 2 HB VAL 2 -5.453 -11.810 -20.599 164 HG11 VAL 2 1HG1 VAL 2 -7.619 -12.707 -21.464 165 HG12 VAL 2 2HG1 VAL 2 -7.854 -11.685 -20.034 166 HG13 VAL 2 3HG1 VAL 2 -8.218 -11.047 -21.660 167 HG21 VAL 2 3HG2 VAL 2 -6.212 -10.625 -23.314 168 HG22 VAL 2 1HG2 VAL 2 -4.589 -11.105 -22.768 169 HG23 VAL 2 2HG2 VAL 2 -5.827 -12.343 -23.033 170 H ASN 3 H ASN 3 -8.199 -8.950 -19.719 171 HA ASN 3 HA ASN 3 -7.296 -8.265 -17.104 172 HB2 ASN 3 1HB ASN 3 -9.362 -7.392 -16.964 173 HB3 ASN 3 2HB ASN 3 -9.636 -7.966 -18.607 174 HD21 ASN 3 2HD2 ASN 3 -10.946 -9.763 -18.954 175 HD22 ASN 3 1HD2 ASN 3 -11.914 -10.452 -17.678 176 H GLN 4 H GLN 4 -6.885 -9.426 -15.332 177 HA GLN 4 HA GLN 4 -8.182 -11.982 -14.746 178 HB2 GLN 4 1HB GLN 4 -6.390 -12.601 -16.414 179 HB3 GLN 4 2HB GLN 4 -5.186 -11.859 -15.358 180 HG2 GLN 4 1HG GLN 4 -5.348 -13.558 -13.767 181 HG3 GLN 4 2HG GLN 4 -6.951 -14.065 -14.324 182 HE21 GLN 4 2HE2 GLN 4 -3.511 -14.017 -15.234 183 HE22 GLN 4 1HE2 GLN 4 -3.601 -15.423 -16.261 184 H HIS 5 H HIS 5 -7.726 -12.462 -12.434 185 HA HIS 5 HA HIS 5 -6.809 -10.135 -10.900 186 HB2 HIS 5 1HB HIS 5 -8.131 -12.692 -10.340 187 HB3 HIS 5 2HB HIS 5 -6.803 -12.388 -9.221 188 HD1 HIS 5 HD1 HIS 5 -10.111 -10.867 -10.324 189 HD2 HIS 5 HD2 HIS 5 -7.238 -10.428 -7.341 190 HE1 HIS 5 HE1 HIS 5 -11.053 -9.245 -8.636 191 H LEU 6 H LEU 6 -4.693 -9.692 -10.561 192 HA LEU 6 HA LEU 6 -2.838 -11.590 -11.733 193 HB2 LEU 6 1HB LEU 6 -2.350 -8.870 -10.505 194 HB3 LEU 6 2HB LEU 6 -1.155 -9.840 -11.362 195 HG LEU 6 HG LEU 6 -3.615 -8.509 -12.519 196 HD11 LEU 6 1HD1 LEU 6 -0.639 -8.324 -13.149 197 HD12 LEU 6 2HD1 LEU 6 -1.576 -7.154 -12.196 198 HD13 LEU 6 3HD1 LEU 6 -1.939 -7.382 -13.920 199 HD21 LEU 6 3HD2 LEU 6 -2.852 -9.474 -14.726 200 HD22 LEU 6 1HD2 LEU 6 -3.545 -10.667 -13.632 201 HD23 LEU 6 2HD2 LEU 6 -1.781 -10.570 -13.826 202 H CYS 7 H CYS 7 -3.786 -11.178 -8.455 203 HA CYS 7 HA CYS 7 -1.261 -11.604 -7.241 204 HB2 CYS 7 1HB CYS 7 -3.697 -11.127 -6.277 205 HB3 CYS 7 2HB CYS 7 -3.673 -12.876 -6.021 206 H GLY 8 H GLY 8 0.115 -13.215 -7.436 207 HA2 GLY 8 1HA GLY 8 0.444 -15.671 -7.034 208 HA3 GLY 8 2HA GLY 8 -0.947 -15.928 -8.108 209 H SER 9 H SER 9 0.495 -17.200 -9.480 210 HA SER 9 HA SER 9 2.861 -16.228 -10.667 211 HB2 SER 9 1HB SER 9 0.945 -17.991 -12.170 212 HB3 SER 9 2HB SER 9 2.709 -18.114 -12.009 213 HG SER 9 HG SER 9 1.714 -19.685 -10.726 214 H HIS 10 H HIS 10 -0.478 -15.513 -11.386 215 HA HIS 10 HA HIS 10 -0.303 -14.772 -14.094 216 HB2 HIS 10 1HB HIS 10 -1.991 -13.504 -11.926 217 HB3 HIS 10 2HB HIS 10 -2.327 -13.477 -13.661 218 HD1 HIS 10 HD1 HIS 10 -4.219 -14.688 -11.356 219 HD2 HIS 10 HD2 HIS 10 -1.729 -16.845 -13.933 220 HE1 HIS 10 HE1 HIS 10 -5.121 -17.058 -11.458 221 H LEU 11 H LEU 11 0.758 -12.998 -11.209 222 HA LEU 11 HA LEU 11 0.826 -10.411 -12.454 223 HB2 LEU 11 1HB LEU 11 1.057 -10.989 -9.978 224 HB3 LEU 11 2HB LEU 11 2.724 -11.425 -10.315 225 HG LEU 11 HG LEU 11 1.992 -8.765 -11.348 226 HD11 LEU 11 1HD1 LEU 11 1.865 -9.256 -8.342 227 HD12 LEU 11 2HD1 LEU 11 0.501 -8.794 -9.393 228 HD13 LEU 11 3HD1 LEU 11 1.849 -7.671 -9.148 229 HD21 LEU 11 3HD2 LEU 11 4.313 -9.563 -11.176 230 HD22 LEU 11 1HD2 LEU 11 4.142 -9.717 -9.411 231 HD23 LEU 11 2HD2 LEU 11 4.060 -8.116 -10.186 232 H VAL 12 H VAL 12 3.131 -13.116 -12.302 233 HA VAL 12 HA VAL 12 5.319 -11.632 -13.423 234 HB VAL 12 HB VAL 12 4.845 -14.660 -13.452 235 HG11 VAL 12 1HG1 VAL 12 7.325 -14.794 -13.591 236 HG12 VAL 12 2HG1 VAL 12 6.625 -13.969 -15.001 237 HG13 VAL 12 3HG1 VAL 12 7.399 -13.019 -13.715 238 HG21 VAL 12 3HG2 VAL 12 6.241 -12.912 -11.371 239 HG22 VAL 12 1HG2 VAL 12 4.729 -13.830 -11.138 240 HG23 VAL 12 2HG2 VAL 12 6.258 -14.687 -11.395 241 H GLU 13 H GLU 13 2.770 -13.760 -14.699 242 HA GLU 13 HA GLU 13 3.642 -13.760 -17.421 243 HB2 GLU 13 1HB GLU 13 0.858 -13.980 -16.231 244 HB3 GLU 13 2HB GLU 13 1.269 -14.352 -17.913 245 HG2 GLU 13 1HG GLU 13 2.748 -16.160 -17.159 246 HG3 GLU 13 2HG GLU 13 2.374 -15.777 -15.466 247 H ALA 14 H ALA 14 1.414 -11.610 -15.603 248 HA ALA 14 HA ALA 14 0.626 -10.039 -17.832 249 HB1 ALA 14 3HB ALA 14 -0.472 -10.082 -15.611 250 HB2 ALA 14 1HB ALA 14 0.914 -9.209 -14.925 251 HB3 ALA 14 2HB ALA 14 -0.100 -8.448 -16.159 252 H LEU 15 H LEU 15 3.273 -9.575 -15.437 253 HA LEU 15 HA LEU 15 4.219 -7.115 -16.485 254 HB2 LEU 15 1HB LEU 15 5.206 -9.301 -14.754 255 HB3 LEU 15 2HB LEU 15 6.467 -8.448 -15.618 256 HG LEU 15 HG LEU 15 6.143 -7.617 -13.354 257 HD11 LEU 15 1HD1 LEU 15 6.301 -5.283 -13.903 258 HD12 LEU 15 2HD1 LEU 15 5.374 -5.502 -15.404 259 HD13 LEU 15 3HD1 LEU 15 7.012 -6.187 -15.250 260 HD21 LEU 15 3HD2 LEU 15 4.231 -6.272 -12.721 261 HD22 LEU 15 1HD2 LEU 15 3.719 -7.919 -13.129 262 HD23 LEU 15 2HD2 LEU 15 3.448 -6.594 -14.277 263 H TYR 16 H TYR 16 5.041 -10.497 -17.318 264 HA TYR 16 HA TYR 16 7.030 -9.828 -19.252 265 HB2 TYR 16 1HB TYR 16 6.708 -12.054 -18.192 266 HB3 TYR 16 2HB TYR 16 5.216 -12.254 -19.124 267 HD1 TYR 16 HD1 TYR 16 8.921 -12.055 -19.337 268 HD2 TYR 16 HD2 TYR 16 5.273 -12.810 -21.494 269 HE1 TYR 16 HE1 TYR 16 10.228 -13.019 -21.237 270 HE2 TYR 16 HE2 TYR 16 6.596 -13.750 -23.393 271 HH TYR 16 HH TYR 16 8.680 -14.256 -24.192 272 H LEU 17 H LEU 17 3.501 -10.363 -19.570 273 HA LEU 17 HA LEU 17 3.552 -10.219 -22.458 274 HB2 LEU 17 1HB LEU 17 1.335 -9.962 -20.409 275 HB3 LEU 17 2HB LEU 17 1.043 -9.880 -22.146 276 HG LEU 17 HG LEU 17 2.351 -12.260 -20.810 277 HD11 LEU 17 1HD1 LEU 17 -0.576 -11.837 -21.534 278 HD12 LEU 17 2HD1 LEU 17 0.096 -11.911 -19.880 279 HD13 LEU 17 3HD1 LEU 17 0.143 -13.345 -20.926 280 HD21 LEU 17 3HD2 LEU 17 1.068 -11.880 -23.548 281 HD22 LEU 17 1HD2 LEU 17 1.616 -13.433 -22.885 282 HD23 LEU 17 2HD2 LEU 17 2.787 -12.143 -23.207 283 H VAL 18 H VAL 18 3.402 -7.789 -19.934 284 HA VAL 18 HA VAL 18 2.552 -5.787 -21.961 285 HB VAL 18 HB VAL 18 2.767 -5.569 -18.947 286 HG11 VAL 18 1HG1 VAL 18 3.056 -3.372 -19.970 287 HG12 VAL 18 2HG1 VAL 18 1.644 -3.642 -21.018 288 HG13 VAL 18 3HG1 VAL 18 1.439 -3.490 -19.263 289 HG21 VAL 18 3HG2 VAL 18 0.965 -7.079 -19.517 290 HG22 VAL 18 1HG2 VAL 18 0.212 -5.518 -19.177 291 HG23 VAL 18 2HG2 VAL 18 0.446 -6.041 -20.858 292 H CYS 19 H CYS 19 5.203 -6.070 -19.460 293 HA CYS 19 HA CYS 19 6.521 -3.787 -20.828 294 HB2 CYS 19 1HB CYS 19 7.617 -5.333 -18.446 295 HB3 CYS 19 2HB CYS 19 8.036 -3.710 -19.003 296 H GLY 20 H GLY 20 6.458 -7.146 -21.179 297 HA2 GLY 20 1HA GLY 20 7.621 -8.274 -22.868 298 HA3 GLY 20 2HA GLY 20 8.840 -6.989 -22.900 299 H GLU 21 H GLU 21 10.439 -8.631 -22.928 300 HA GLU 21 HA GLU 21 10.759 -10.562 -20.819 301 HB2 GLU 21 1HB GLU 21 11.667 -10.422 -23.273 302 HB3 GLU 21 2HB GLU 21 12.981 -9.479 -22.562 303 HG2 GLU 21 1HG GLU 21 13.540 -11.395 -21.093 304 HG3 GLU 21 2HG GLU 21 12.203 -12.321 -21.792 305 H ARG 22 H ARG 22 10.711 -7.399 -20.345 306 HA ARG 22 HA ARG 22 12.739 -7.468 -18.197 307 HB2 ARG 22 1HB ARG 22 13.598 -5.243 -18.833 308 HB3 ARG 22 2HB ARG 22 13.962 -6.480 -20.044 309 HG2 ARG 22 1HG ARG 22 12.192 -5.655 -21.506 310 HG3 ARG 22 2HG ARG 22 11.670 -4.493 -20.276 311 HD2 ARG 22 1HD ARG 22 13.032 -3.367 -21.935 312 HD3 ARG 22 2HD ARG 22 13.875 -3.407 -20.374 313 HE ARG 22 HE ARG 22 14.654 -5.676 -21.924 314 HH11 ARG 22 1HH1 ARG 22 15.133 -2.183 -21.869 315 HH12 ARG 22 2HH1 ARG 22 16.698 -2.290 -22.626 316 HH21 ARG 22 1HH2 ARG 22 16.650 -5.744 -22.883 317 HH22 ARG 22 2HH2 ARG 22 17.545 -4.281 -23.194 318 H GLY 23 H GLY 23 12.345 -5.665 -16.688 319 HA2 GLY 23 1HA GLY 23 10.874 -3.729 -16.221 320 HA3 GLY 23 2HA GLY 23 9.528 -4.712 -16.801 321 H PHE 24 H PHE 24 11.232 -6.981 -15.274 322 HA PHE 24 HA PHE 24 10.505 -6.280 -12.499 323 HB2 PHE 24 1HB PHE 24 9.069 -8.226 -12.241 324 HB3 PHE 24 2HB PHE 24 8.426 -7.199 -13.523 325 HD1 PHE 24 HD2 PHE 24 8.784 -7.867 -15.952 326 HD2 PHE 24 HD1 PHE 24 9.721 -10.488 -12.665 327 HE1 PHE 24 HE2 PHE 24 8.784 -9.800 -17.505 328 HE2 PHE 24 HE1 PHE 24 9.716 -12.432 -14.213 329 HZ PHE 24 HZ PHE 24 9.238 -12.098 -16.644 330 H PHE 25 H PHE 25 11.135 -8.216 -11.070 331 HA PHE 25 HA PHE 25 13.193 -9.940 -12.317 332 HB2 PHE 25 1HB PHE 25 14.275 -7.877 -11.303 333 HB3 PHE 25 2HB PHE 25 13.690 -8.429 -9.734 334 HD1 PHE 25 HD2 PHE 25 14.563 -10.588 -8.769 335 HD2 PHE 25 HD1 PHE 25 16.144 -8.897 -12.396 336 HE1 PHE 25 HE2 PHE 25 16.599 -12.019 -8.552 337 HE2 PHE 25 HE1 PHE 25 18.175 -10.318 -12.181 338 HZ PHE 25 HZ PHE 25 18.404 -11.890 -10.253 339 H NVA 26 H ARX 26 12.121 -11.784 -12.068 340 HA NVA 26 HA ARX 26 11.103 -12.551 -9.370 341 HB2 NVA 26 1HB ARX 26 9.381 -12.633 -11.219 342 HB3 NVA 26 2HB ARX 26 10.388 -13.786 -12.090 343 HG2 NVA 26 1HG ARX 26 8.726 -15.099 -10.976 344 HG3 NVA 26 2HG ARX 26 10.201 -15.382 -10.097 345 HD2 NVA 26 1HD ARX 26 8.813 -13.112 -8.874 346 HD3 NVA 26 2HD ARX 26 7.652 -14.422 -9.112 347 H THR 27 H THR 27 12.400 -13.598 -8.215 348 HA THR 27 HA THR 27 14.795 -14.983 -9.137 349 HB THR 27 HB THR 27 14.817 -15.786 -6.694 350 HG1 THR 27 HG1 THR 27 12.331 -15.304 -6.756 351 HG21 THR 27 1HG2 THR 27 15.984 -13.719 -7.312 352 HG22 THR 27 2HG2 THR 27 15.215 -13.558 -5.718 353 HG23 THR 27 3HG2 THR 27 14.467 -12.798 -7.136 354 HA PRO 28 HA PRO 28 12.662 -18.838 -9.691 355 HB2 PRO 28 1HB PRO 28 14.320 -20.814 -8.829 356 HB3 PRO 28 2HB PRO 28 14.692 -19.822 -10.275 357 HG2 PRO 28 1HG PRO 28 15.696 -19.474 -7.460 358 HG3 PRO 28 2HG PRO 28 16.625 -19.535 -8.989 359 HD2 PRO 28 1HD PRO 28 15.917 -17.190 -7.805 360 HD3 PRO 28 2HD PRO 28 15.993 -17.370 -9.588 361 H HIX 29 H HIX 29 11.105 -18.086 -8.152 362 HA HIX 29 HA HIX 29 10.987 -19.589 -5.571 363 HB1 HIX 29 1HB HIX 29 9.440 -17.742 -4.760 364 HB2 HIX 29 2HB HIX 29 11.132 -17.348 -4.895 365 HD2 HIX 29 HD2 HIX 29 9.009 -16.975 -8.188 366 HD1 HIX 29 HD1 HIX 29 10.641 -14.821 -5.002 367 HE1 HIX 29 HE1 HIX 29 8.802 -13.675 -6.317 368 H THR 30 H THR 30 10.053 -21.328 -6.053 369 HA THR 30 HA THR 30 7.343 -21.350 -7.310 370 HB THR 30 HB THR 30 9.468 -23.544 -7.478 371 HG1 THR 30 HG1 THR 30 8.829 -21.378 -9.158 372 HG21 THR 30 1HG2 THR 30 7.170 -24.363 -7.713 373 HG22 THR 30 2HG2 THR 30 7.990 -24.399 -9.290 374 HG23 THR 30 3HG2 THR 30 6.817 -23.112 -8.922 Start of MODEL 3 1 H1 GLY 1 1H GLY 1 0.185 0.092 0.864 2 H2 GLY 1 2H GLY 1 -1.096 0.134 -0.151 3 H3 GLY 1 3H GLY 1 -0.206 -1.245 0.037 4 HA2 GLY 1 1HA GLY 1 0.840 1.286 -1.128 5 HA3 GLY 1 2HA GLY 1 1.763 -0.210 -0.928 6 H ILE 2 H ILE 2 1.924 0.402 -3.428 7 HA ILE 2 HA ILE 2 -0.384 -0.072 -5.041 8 HB ILE 2 HB ILE 2 1.569 1.073 -5.958 9 HG12 ILE 2 1HG1 ILE 2 1.161 -1.520 -7.455 10 HG13 ILE 2 2HG1 ILE 2 -0.031 -0.237 -7.392 11 HG21 ILE 2 1HG2 ILE 2 3.663 -0.192 -6.585 12 HG22 ILE 2 2HG2 ILE 2 3.471 -0.030 -4.824 13 HG23 ILE 2 3HG2 ILE 2 3.058 -1.568 -5.622 14 HD11 ILE 2 3HD1 ILE 2 2.791 0.192 -8.450 15 HD12 ILE 2 1HD1 ILE 2 1.368 -0.230 -9.477 16 HD13 ILE 2 2HD1 ILE 2 1.418 1.297 -8.552 17 H VAL 3 H VAL 3 1.896 -2.459 -3.709 18 HA VAL 3 HA VAL 3 1.151 -4.611 -5.380 19 HB VAL 3 HB VAL 3 2.034 -4.635 -2.465 20 HG11 VAL 3 1HG1 VAL 3 2.088 -6.880 -4.536 21 HG12 VAL 3 2HG1 VAL 3 2.799 -6.995 -2.896 22 HG13 VAL 3 3HG1 VAL 3 1.057 -6.785 -3.094 23 HG21 VAL 3 3HG2 VAL 3 3.667 -4.829 -5.047 24 HG22 VAL 3 1HG2 VAL 3 3.675 -3.483 -3.893 25 HG23 VAL 3 2HG2 VAL 3 4.342 -5.032 -3.420 26 H GLU 4 H GLU 4 -0.148 -3.705 -2.161 27 HA GLU 4 HA GLU 4 -2.216 -5.670 -2.128 28 HB2 GLU 4 1HB GLU 4 -1.829 -2.982 -0.767 29 HB3 GLU 4 2HB GLU 4 -3.279 -3.979 -0.498 30 HG2 GLU 4 1HG GLU 4 -0.510 -5.112 -0.022 31 HG3 GLU 4 2HG GLU 4 -1.333 -4.109 1.207 32 H GLN 5 H GLN 5 -2.031 -2.383 -3.375 33 HA GLN 5 HA GLN 5 -4.776 -1.940 -3.842 34 HB2 GLN 5 1HB GLN 5 -2.803 -0.302 -3.960 35 HB3 GLN 5 2HB GLN 5 -2.516 -0.943 -5.589 36 HG2 GLN 5 1HG GLN 5 -3.772 0.882 -6.085 37 HG3 GLN 5 2HG GLN 5 -5.057 -0.317 -5.915 38 HE21 GLN 5 2HE2 GLN 5 -5.075 2.637 -5.586 39 HE22 GLN 5 1HE2 GLN 5 -5.650 2.930 -3.956 40 H CYS 6 H CYS 6 -2.237 -3.381 -6.031 41 HA CYS 6 HA CYS 6 -4.398 -3.832 -8.029 42 HB2 CYS 6 1HB CYS 6 -1.432 -3.936 -8.064 43 HB3 CYS 6 2HB CYS 6 -2.286 -5.161 -9.055 44 H CYS 7 H CYS 7 -2.883 -5.637 -5.462 45 HA CYS 7 HA CYS 7 -3.510 -8.250 -6.492 46 HB2 CYS 7 1HB CYS 7 -2.026 -7.806 -4.548 47 HB3 CYS 7 2HB CYS 7 -3.402 -7.205 -3.658 48 H THR 8 H THR 8 -5.289 -6.080 -4.215 49 HA THR 8 HA THR 8 -7.586 -7.851 -4.057 50 HB THR 8 HB THR 8 -8.583 -6.008 -2.742 51 HG1 THR 8 HG1 THR 8 -6.118 -4.614 -3.218 52 HG21 THR 8 1HG2 THR 8 -7.002 -6.023 -0.903 53 HG22 THR 8 2HG2 THR 8 -5.688 -6.494 -1.979 54 HG23 THR 8 3HG2 THR 8 -6.999 -7.621 -1.655 55 H SER 9 H SER 9 -6.879 -6.683 -6.802 56 HA SER 9 HA SER 9 -9.626 -5.846 -7.501 57 HB2 SER 9 1HB SER 9 -8.975 -3.676 -8.401 58 HB3 SER 9 2HB SER 9 -8.501 -3.750 -6.684 59 HG SER 9 HG SER 9 -6.450 -3.792 -7.237 60 H ILE 10 H ILE 10 -9.550 -5.119 -9.937 61 HA ILE 10 HA ILE 10 -7.973 -7.027 -11.522 62 HB ILE 10 HB ILE 10 -9.868 -4.841 -12.526 63 HG12 ILE 10 1HG1 ILE 10 -11.093 -6.387 -11.024 64 HG13 ILE 10 2HG1 ILE 10 -11.625 -6.515 -12.704 65 HG21 ILE 10 1HG2 ILE 10 -8.673 -7.312 -13.874 66 HG22 ILE 10 2HG2 ILE 10 -9.894 -6.264 -14.630 67 HG23 ILE 10 3HG2 ILE 10 -8.291 -5.642 -14.223 68 HD11 ILE 10 3HD1 ILE 10 -9.726 -8.511 -11.403 69 HD12 ILE 10 1HD1 ILE 10 -11.491 -8.686 -11.510 70 HD13 ILE 10 2HD1 ILE 10 -10.495 -8.630 -12.990 71 H CYS 11 H CYS 11 -5.862 -6.321 -11.828 72 HA CYS 11 HA CYS 11 -5.174 -3.618 -11.261 73 HB2 CYS 11 1HB CYS 11 -3.712 -5.715 -11.006 74 HB3 CYS 11 2HB CYS 11 -3.473 -5.637 -12.744 75 H SER 12 H SER 12 -5.157 -1.865 -12.538 76 HA SER 12 HA SER 12 -6.063 -2.031 -15.272 77 HB2 SER 12 1HB SER 12 -4.582 0.323 -14.057 78 HB3 SER 12 2HB SER 12 -5.881 0.346 -15.239 79 HG SER 12 HG SER 12 -7.083 -0.749 -13.341 80 H LEU 13 H LEU 13 -4.874 -1.392 -17.174 81 HA LEU 13 HA LEU 13 -2.502 -2.799 -17.475 82 HB2 LEU 13 1HB LEU 13 -4.117 -2.075 -19.238 83 HB3 LEU 13 2HB LEU 13 -3.461 -0.467 -19.145 84 HG LEU 13 HG LEU 13 -1.275 -1.348 -19.916 85 HD11 LEU 13 1HD1 LEU 13 -2.869 -3.923 -20.249 86 HD12 LEU 13 2HD1 LEU 13 -1.503 -3.681 -19.190 87 HD13 LEU 13 3HD1 LEU 13 -1.265 -3.631 -20.960 88 HD21 LEU 13 3HD2 LEU 13 -3.634 -2.017 -21.739 89 HD22 LEU 13 1HD2 LEU 13 -1.988 -1.581 -22.293 90 HD23 LEU 13 2HD2 LEU 13 -3.017 -0.367 -21.465 91 H TYR 14 H TYR 14 -2.954 0.673 -16.829 92 HA TYR 14 HA TYR 14 -0.097 1.222 -17.012 93 HB2 TYR 14 1HB TYR 14 -0.696 3.486 -16.205 94 HB3 TYR 14 2HB TYR 14 -1.586 2.975 -17.615 95 HD1 TYR 14 HD1 TYR 14 -1.915 3.663 -14.030 96 HD2 TYR 14 HD2 TYR 14 -4.006 2.522 -17.551 97 HE1 TYR 14 HE1 TYR 14 -4.065 4.110 -12.866 98 HE2 TYR 14 HE2 TYR 14 -6.191 2.845 -16.377 99 HH TYR 14 HH TYR 14 -6.328 4.192 -13.061 100 H GLN 15 H GLN 15 -2.219 0.233 -14.403 101 HA GLN 15 HA GLN 15 -0.398 1.090 -12.319 102 HB2 GLN 15 1HB GLN 15 -2.679 -0.889 -12.289 103 HB3 GLN 15 2HB GLN 15 -1.743 -0.403 -10.841 104 HG2 GLN 15 1HG GLN 15 -3.158 1.602 -12.565 105 HG3 GLN 15 2HG GLN 15 -4.000 0.707 -11.256 106 HE21 GLN 15 2HE2 GLN 15 -3.700 1.343 -9.173 107 HE22 GLN 15 1HE2 GLN 15 -2.711 2.690 -8.679 108 H LEU 16 H LEU 16 -1.037 -1.755 -14.269 109 HA LEU 16 HA LEU 16 0.826 -3.575 -13.004 110 HB2 LEU 16 1HB LEU 16 -1.036 -4.108 -14.573 111 HB3 LEU 16 2HB LEU 16 -0.208 -3.278 -15.858 112 HG LEU 16 HG LEU 16 0.675 -5.921 -14.591 113 HD11 LEU 16 1HD1 LEU 16 -0.834 -5.065 -17.099 114 HD12 LEU 16 2HD1 LEU 16 -1.321 -6.157 -15.778 115 HD13 LEU 16 3HD1 LEU 16 -0.088 -6.690 -16.908 116 HD21 LEU 16 3HD2 LEU 16 1.787 -4.333 -16.979 117 HD22 LEU 16 1HD2 LEU 16 2.097 -6.077 -16.640 118 HD23 LEU 16 2HD2 LEU 16 2.640 -4.845 -15.506 119 H GLU 17 H GLU 17 1.129 -1.435 -15.933 120 HA GLU 17 HA GLU 17 3.875 -2.143 -16.164 121 HB2 GLU 17 1HB GLU 17 4.073 -0.591 -17.897 122 HB3 GLU 17 2HB GLU 17 2.573 -1.435 -18.075 123 HG2 GLU 17 1HG GLU 17 1.700 0.552 -18.431 124 HG3 GLU 17 2HG GLU 17 1.783 0.699 -16.706 125 H ASN 18 H ASN 18 2.323 0.233 -14.165 126 HA ASN 18 HA ASN 18 4.615 1.834 -13.549 127 HB2 ASN 18 1HB ASN 18 2.175 2.041 -12.768 128 HB3 ASN 18 2HB ASN 18 2.574 0.898 -11.499 129 HD21 ASN 18 2HD2 ASN 18 3.208 4.089 -12.859 130 HD22 ASN 18 1HD2 ASN 18 3.902 4.770 -11.400 131 H TYR 19 H TYR 19 4.204 -1.587 -12.888 132 HA TYR 19 HA TYR 19 6.137 -1.601 -10.655 133 HB2 TYR 19 1HB TYR 19 5.002 -3.804 -12.346 134 HB3 TYR 19 2HB TYR 19 6.166 -4.116 -11.090 135 HD1 TYR 19 HD2 TYR 19 5.322 -2.857 -8.721 136 HD2 TYR 19 HD1 TYR 19 2.819 -4.357 -11.840 137 HE1 TYR 19 HE2 TYR 19 3.471 -3.158 -7.092 138 HE2 TYR 19 HE1 TYR 19 0.976 -4.678 -10.204 139 HH TYR 19 HH TYR 19 1.184 -3.731 -6.810 140 H CYS 20 H CYS 20 6.387 -1.290 -14.006 141 HA CYS 20 HA CYS 20 8.892 -2.863 -14.282 142 HB2 CYS 20 1HB CYS 20 7.210 -1.219 -16.224 143 HB3 CYS 20 2HB CYS 20 8.618 -2.175 -16.678 144 H ASN 21 H ASN 21 10.785 -1.787 -15.172 145 HA ASN 21 HA ASN 21 11.451 0.625 -13.702 146 HB2 ASN 21 1HB ASN 21 12.783 -1.357 -15.392 147 HB3 ASN 21 2HB ASN 21 13.298 0.288 -15.777 148 HD21 ASN 21 2HD2 ASN 21 12.889 -2.043 -13.209 149 HD22 ASN 21 1HD2 ASN 21 14.160 -1.417 -12.203 150 H1 PHE 1 1H PHE 1 -3.270 -8.432 -23.459 151 H2 PHE 1 2H PHE 1 -1.691 -8.732 -22.982 152 H3 PHE 1 3H PHE 1 -2.792 -9.953 -23.188 153 HA PHE 1 HA PHE 1 -2.465 -9.526 -20.845 154 HB2 PHE 1 1HB PHE 1 -1.850 -7.138 -21.175 155 HB3 PHE 1 2HB PHE 1 -3.541 -6.760 -21.505 156 HD1 PHE 1 HD1 PHE 1 -1.853 -8.894 -18.918 157 HD2 PHE 1 HD2 PHE 1 -4.444 -5.549 -19.683 158 HE1 PHE 1 HE1 PHE 1 -2.271 -8.718 -16.552 159 HE2 PHE 1 HE2 PHE 1 -4.896 -5.388 -17.254 160 HZ PHE 1 HZ PHE 1 -3.785 -6.966 -15.694 161 H VAL 2 H VAL 2 -4.218 -9.729 -19.279 162 HA VAL 2 HA VAL 2 -6.888 -9.989 -20.584 163 HB VAL 2 HB VAL 2 -7.226 -12.136 -19.358 164 HG11 VAL 2 1HG1 VAL 2 -4.794 -12.180 -21.131 165 HG12 VAL 2 2HG1 VAL 2 -5.797 -13.560 -20.786 166 HG13 VAL 2 3HG1 VAL 2 -6.448 -12.180 -21.712 167 HG21 VAL 2 3HG2 VAL 2 -5.602 -11.830 -17.527 168 HG22 VAL 2 1HG2 VAL 2 -5.298 -13.315 -18.373 169 HG23 VAL 2 2HG2 VAL 2 -4.295 -11.876 -18.687 170 H ASN 3 H ASN 3 -8.548 -10.471 -18.760 171 HA ASN 3 HA ASN 3 -8.242 -8.432 -16.677 172 HB2 ASN 3 1HB ASN 3 -10.645 -8.854 -16.248 173 HB3 ASN 3 2HB ASN 3 -10.328 -8.539 -17.975 174 HD21 ASN 3 2HD2 ASN 3 -12.293 -10.322 -16.147 175 HD22 ASN 3 1HD2 ASN 3 -12.416 -11.767 -17.115 176 H GLN 4 H GLN 4 -10.035 -9.855 -14.830 177 HA GLN 4 HA GLN 4 -10.158 -11.306 -13.116 178 HB2 GLN 4 1HB GLN 4 -9.180 -12.961 -14.923 179 HB3 GLN 4 2HB GLN 4 -7.702 -12.835 -13.930 180 HG2 GLN 4 1HG GLN 4 -8.858 -14.782 -13.247 181 HG3 GLN 4 2HG GLN 4 -9.029 -13.626 -11.936 182 HE21 GLN 4 2HE2 GLN 4 -10.730 -15.262 -11.425 183 HE22 GLN 4 1HE2 GLN 4 -12.311 -15.011 -12.099 184 H HIS 5 H HIS 5 -8.878 -12.006 -11.149 185 HA HIS 5 HA HIS 5 -7.106 -9.759 -10.326 186 HB2 HIS 5 1HB HIS 5 -8.350 -12.159 -8.882 187 HB3 HIS 5 2HB HIS 5 -7.075 -11.177 -8.142 188 HD1 HIS 5 HD1 HIS 5 -10.448 -10.217 -9.817 189 HD2 HIS 5 HD2 HIS 5 -8.094 -9.414 -6.473 190 HE1 HIS 5 HE1 HIS 5 -11.684 -8.460 -8.455 191 H LEU 6 H LEU 6 -4.911 -9.929 -10.352 192 HA LEU 6 HA LEU 6 -3.829 -12.607 -11.078 193 HB2 LEU 6 1HB LEU 6 -2.756 -9.922 -11.910 194 HB3 LEU 6 2HB LEU 6 -2.195 -11.475 -12.444 195 HG LEU 6 HG LEU 6 -4.913 -10.325 -13.075 196 HD11 LEU 6 1HD1 LEU 6 -4.014 -9.977 -15.321 197 HD12 LEU 6 2HD1 LEU 6 -2.463 -10.661 -14.878 198 HD13 LEU 6 3HD1 LEU 6 -2.979 -9.159 -14.139 199 HD21 LEU 6 3HD2 LEU 6 -5.259 -12.072 -14.642 200 HD22 LEU 6 1HD2 LEU 6 -4.825 -12.842 -13.100 201 HD23 LEU 6 2HD2 LEU 6 -3.633 -12.712 -14.400 202 H CYS 7 H CYS 7 -4.079 -11.766 -8.388 203 HA CYS 7 HA CYS 7 -1.569 -10.732 -7.449 204 HB2 CYS 7 1HB CYS 7 -3.899 -10.795 -6.310 205 HB3 CYS 7 2HB CYS 7 -3.476 -12.462 -5.830 206 H GLY 8 H GLY 8 -2.209 -13.806 -8.666 207 HA2 GLY 8 1HA GLY 8 -0.200 -15.104 -6.964 208 HA3 GLY 8 2HA GLY 8 -1.181 -15.883 -8.207 209 H SER 9 H SER 9 0.812 -16.912 -8.974 210 HA SER 9 HA SER 9 3.072 -15.500 -9.948 211 HB2 SER 9 1HB SER 9 1.871 -18.034 -11.141 212 HB3 SER 9 2HB SER 9 3.552 -17.511 -11.250 213 HG SER 9 HG SER 9 3.435 -18.952 -9.584 214 H HIS 10 H HIS 10 -0.137 -15.599 -11.234 215 HA HIS 10 HA HIS 10 0.344 -15.146 -13.997 216 HB2 HIS 10 1HB HIS 10 -1.840 -14.074 -12.158 217 HB3 HIS 10 2HB HIS 10 -1.898 -14.141 -13.934 218 HD1 HIS 10 HD1 HIS 10 -3.703 -15.706 -11.627 219 HD2 HIS 10 HD2 HIS 10 -0.972 -17.265 -14.347 220 HE1 HIS 10 HE1 HIS 10 -4.263 -18.169 -11.912 221 H LEU 11 H LEU 11 0.966 -13.149 -11.212 222 HA LEU 11 HA LEU 11 0.736 -10.557 -12.496 223 HB2 LEU 11 1HB LEU 11 1.132 -11.069 -10.003 224 HB3 LEU 11 2HB LEU 11 2.807 -11.340 -10.380 225 HG LEU 11 HG LEU 11 2.714 -8.949 -11.452 226 HD11 LEU 11 1HD1 LEU 11 0.342 -8.531 -11.430 227 HD12 LEU 11 2HD1 LEU 11 1.094 -7.408 -10.253 228 HD13 LEU 11 3HD1 LEU 11 0.231 -8.852 -9.649 229 HD21 LEU 11 3HD2 LEU 11 3.993 -9.531 -9.462 230 HD22 LEU 11 1HD2 LEU 11 2.532 -9.294 -8.455 231 HD23 LEU 11 2HD2 LEU 11 3.291 -7.920 -9.316 232 H VAL 12 H VAL 12 3.349 -12.981 -12.310 233 HA VAL 12 HA VAL 12 5.405 -11.367 -13.516 234 HB VAL 12 HB VAL 12 5.036 -14.392 -13.431 235 HG11 VAL 12 1HG1 VAL 12 6.715 -13.588 -15.131 236 HG12 VAL 12 2HG1 VAL 12 7.632 -12.827 -13.794 237 HG13 VAL 12 3HG1 VAL 12 7.419 -14.596 -13.880 238 HG21 VAL 12 3HG2 VAL 12 5.082 -13.338 -11.152 239 HG22 VAL 12 1HG2 VAL 12 6.487 -14.386 -11.432 240 HG23 VAL 12 2HG2 VAL 12 6.668 -12.583 -11.519 241 H GLU 13 H GLU 13 2.952 -13.628 -14.737 242 HA GLU 13 HA GLU 13 3.851 -13.598 -17.455 243 HB2 GLU 13 1HB GLU 13 1.030 -14.030 -16.361 244 HB3 GLU 13 2HB GLU 13 1.639 -14.522 -17.943 245 HG2 GLU 13 1HG GLU 13 3.282 -16.055 -16.818 246 HG3 GLU 13 2HG GLU 13 2.585 -15.577 -15.250 247 H ALA 14 H ALA 14 1.649 -11.583 -15.526 248 HA ALA 14 HA ALA 14 0.533 -10.006 -17.656 249 HB1 ALA 14 3HB ALA 14 -0.198 -10.114 -15.241 250 HB2 ALA 14 1HB ALA 14 1.152 -9.044 -14.856 251 HB3 ALA 14 2HB ALA 14 -0.105 -8.473 -15.954 252 H LEU 15 H LEU 15 3.365 -9.437 -15.505 253 HA LEU 15 HA LEU 15 4.269 -7.049 -16.756 254 HB2 LEU 15 1HB LEU 15 5.768 -9.206 -15.258 255 HB3 LEU 15 2HB LEU 15 6.483 -7.654 -15.733 256 HG LEU 15 HG LEU 15 3.955 -7.750 -14.066 257 HD11 LEU 15 1HD1 LEU 15 6.784 -7.686 -12.972 258 HD12 LEU 15 2HD1 LEU 15 5.711 -9.099 -12.906 259 HD13 LEU 15 3HD1 LEU 15 5.301 -7.582 -12.052 260 HD21 LEU 15 3HD2 LEU 15 4.798 -5.692 -15.302 261 HD22 LEU 15 1HD2 LEU 15 6.176 -5.727 -14.192 262 HD23 LEU 15 2HD2 LEU 15 4.561 -5.534 -13.541 263 H TYR 16 H TYR 16 5.025 -10.465 -17.377 264 HA TYR 16 HA TYR 16 7.052 -10.127 -19.277 265 HB2 TYR 16 1HB TYR 16 6.173 -12.238 -18.098 266 HB3 TYR 16 2HB TYR 16 4.949 -12.307 -19.411 267 HD1 TYR 16 HD2 TYR 16 5.597 -12.685 -21.737 268 HD2 TYR 16 HD1 TYR 16 8.464 -12.933 -18.556 269 HE1 TYR 16 HE2 TYR 16 7.176 -13.943 -23.230 270 HE2 TYR 16 HE1 TYR 16 10.040 -14.185 -20.065 271 HH TYR 16 HH TYR 16 10.492 -14.788 -22.188 272 H LEU 17 H LEU 17 3.493 -10.416 -19.782 273 HA LEU 17 HA LEU 17 3.824 -10.131 -22.676 274 HB2 LEU 17 1HB LEU 17 1.342 -10.085 -20.906 275 HB3 LEU 17 2HB LEU 17 1.322 -10.095 -22.671 276 HG LEU 17 HG LEU 17 2.617 -12.272 -20.980 277 HD11 LEU 17 1HD1 LEU 17 -0.119 -12.226 -22.331 278 HD12 LEU 17 2HD1 LEU 17 0.174 -12.089 -20.545 279 HD13 LEU 17 3HD1 LEU 17 0.582 -13.574 -21.359 280 HD21 LEU 17 3HD2 LEU 17 3.463 -12.213 -23.287 281 HD22 LEU 17 1HD2 LEU 17 1.829 -12.224 -23.918 282 HD23 LEU 17 2HD2 LEU 17 2.435 -13.637 -23.029 283 H VAL 18 H VAL 18 3.197 -7.780 -20.096 284 HA VAL 18 HA VAL 18 2.279 -5.738 -22.037 285 HB VAL 18 HB VAL 18 2.644 -5.689 -19.004 286 HG11 VAL 18 1HG1 VAL 18 1.617 -3.544 -20.910 287 HG12 VAL 18 2HG1 VAL 18 1.312 -3.528 -19.154 288 HG13 VAL 18 3HG1 VAL 18 2.964 -3.423 -19.769 289 HG21 VAL 18 3HG2 VAL 18 0.096 -5.604 -19.111 290 HG22 VAL 18 1HG2 VAL 18 0.215 -5.934 -20.860 291 HG23 VAL 18 2HG2 VAL 18 0.792 -7.122 -19.645 292 H CYS 19 H CYS 19 4.985 -5.992 -19.621 293 HA CYS 19 HA CYS 19 6.247 -3.662 -20.903 294 HB2 CYS 19 1HB CYS 19 7.201 -5.425 -18.601 295 HB3 CYS 19 2HB CYS 19 7.972 -3.922 -19.143 296 H GLY 20 H GLY 20 5.978 -6.765 -21.756 297 HA2 GLY 20 1HA GLY 20 7.039 -8.019 -23.354 298 HA3 GLY 20 2HA GLY 20 8.004 -6.546 -23.696 299 H GLU 21 H GLU 21 7.889 -8.139 -20.584 300 HA GLU 21 HA GLU 21 9.483 -9.021 -19.265 301 HB2 GLU 21 1HB GLU 21 9.747 -10.584 -21.313 302 HB3 GLU 21 2HB GLU 21 11.293 -9.703 -21.545 303 HG2 GLU 21 1HG GLU 21 11.910 -10.299 -19.223 304 HG3 GLU 21 2HG GLU 21 10.433 -11.257 -19.079 305 H ARG 22 H ARG 22 10.529 -6.604 -21.510 306 HA ARG 22 HA ARG 22 13.128 -6.159 -20.589 307 HB2 ARG 22 1HB ARG 22 11.095 -4.224 -21.704 308 HB3 ARG 22 2HB ARG 22 12.810 -3.875 -21.614 309 HG2 ARG 22 1HG ARG 22 13.275 -5.739 -23.206 310 HG3 ARG 22 2HG ARG 22 11.559 -6.111 -23.256 311 HD2 ARG 22 1HD ARG 22 11.050 -3.850 -24.093 312 HD3 ARG 22 2HD ARG 22 12.782 -3.488 -24.145 313 HE ARG 22 HE ARG 22 12.294 -5.947 -25.481 314 HH11 ARG 22 1HH1 ARG 22 11.720 -2.510 -26.017 315 HH12 ARG 22 2HH1 ARG 22 11.743 -2.701 -27.732 316 HH21 ARG 22 1HH2 ARG 22 12.313 -6.089 -27.672 317 HH22 ARG 22 2HH2 ARG 22 12.117 -4.679 -28.662 318 H GLY 23 H GLY 23 10.153 -5.049 -19.116 319 HA2 GLY 23 1HA GLY 23 11.543 -2.967 -17.680 320 HA3 GLY 23 2HA GLY 23 9.854 -3.423 -17.528 321 H PHE 24 H PHE 24 11.340 -6.370 -17.010 322 HA PHE 24 HA PHE 24 12.031 -5.803 -14.224 323 HB2 PHE 24 1HB PHE 24 10.343 -7.002 -13.228 324 HB3 PHE 24 2HB PHE 24 9.495 -6.092 -14.495 325 HD1 PHE 24 HD1 PHE 24 9.025 -7.371 -16.726 326 HD2 PHE 24 HD2 PHE 24 10.182 -9.342 -13.075 327 HE1 PHE 24 HE1 PHE 24 8.109 -9.503 -17.604 328 HE2 PHE 24 HE2 PHE 24 9.311 -11.501 -13.972 329 HZ PHE 24 HZ PHE 24 8.249 -11.573 -16.249 330 H PHE 25 H PHE 25 12.640 -7.939 -13.036 331 HA PHE 25 HA PHE 25 13.358 -10.115 -14.910 332 HB2 PHE 25 1HB PHE 25 15.339 -8.687 -14.726 333 HB3 PHE 25 2HB PHE 25 15.271 -8.787 -12.946 334 HD1 PHE 25 HD2 PHE 25 15.822 -10.811 -16.047 335 HD2 PHE 25 HD1 PHE 25 16.206 -10.616 -11.772 336 HE1 PHE 25 HE2 PHE 25 17.199 -12.863 -16.075 337 HE2 PHE 25 HE1 PHE 25 17.589 -12.683 -11.813 338 HZ PHE 25 HZ PHE 25 18.065 -13.817 -13.957 339 H NVA 26 H ARX 26 12.651 -11.942 -14.178 340 HA NVA 26 HA ARX 26 12.465 -12.439 -11.228 341 HB2 NVA 26 1HB ARX 26 10.297 -12.760 -12.432 342 HB3 NVA 26 2HB ARX 26 11.019 -14.009 -13.436 343 HG2 NVA 26 1HG ARX 26 11.524 -15.276 -11.304 344 HG3 NVA 26 2HG ARX 26 10.691 -14.052 -10.389 345 HD2 NVA 26 1HD ARX 26 8.627 -14.892 -10.938 346 HD3 NVA 26 2HD ARX 26 9.080 -15.141 -12.616 347 H THR 27 H THR 27 13.657 -14.049 -10.366 348 HA THR 27 HA THR 27 16.033 -15.070 -11.655 349 HB THR 27 HB THR 27 15.967 -16.659 -9.626 350 HG1 THR 27 HG1 THR 27 13.644 -16.471 -9.351 351 HG21 THR 27 1HG2 THR 27 17.201 -14.571 -9.593 352 HG22 THR 27 2HG2 THR 27 16.493 -14.926 -8.026 353 HG23 THR 27 3HG2 THR 27 15.743 -13.692 -9.094 354 HA PRO 28 HA PRO 28 14.177 -18.357 -13.755 355 HB2 PRO 28 1HB PRO 28 15.803 -20.562 -13.405 356 HB3 PRO 28 2HB PRO 28 16.213 -19.190 -14.482 357 HG2 PRO 28 1HG PRO 28 17.116 -19.706 -11.623 358 HG3 PRO 28 2HG PRO 28 18.091 -19.268 -13.073 359 HD2 PRO 28 1HD PRO 28 17.303 -17.392 -11.286 360 HD3 PRO 28 2HD PRO 28 17.343 -17.041 -13.033 361 H HIX 29 H HIX 29 12.441 -19.461 -13.339 362 HA HIX 29 HA HIX 29 11.856 -20.549 -10.630 363 HB1 HIX 29 1HB HIX 29 10.114 -20.270 -13.146 364 HB2 HIX 29 2HB HIX 29 9.556 -20.960 -11.643 365 HD2 HIX 29 HD2 HIX 29 10.081 -17.536 -13.293 366 HD1 HIX 29 HD1 HIX 29 9.659 -19.191 -9.468 367 HE1 HIX 29 HE1 HIX 29 8.226 -17.164 -9.979 368 H THR 30 H THR 30 13.236 -22.190 -10.479 369 HA THR 30 HA THR 30 13.262 -24.435 -12.354 370 HB THR 30 HB THR 30 14.793 -25.470 -10.658 371 HG1 THR 30 HG1 THR 30 13.546 -24.159 -8.958 372 HG21 THR 30 1HG2 THR 30 16.642 -23.957 -10.879 373 HG22 THR 30 2HG2 THR 30 15.571 -22.549 -11.115 374 HG23 THR 30 3HG2 THR 30 15.697 -23.800 -12.390 Start of MODEL 4 1 H1 GLY 1 1H GLY 1 -0.341 -3.228 -0.535 2 H2 GLY 1 2H GLY 1 0.110 -1.838 0.225 3 H3 GLY 1 3H GLY 1 -0.991 -1.795 -1.027 4 HA2 GLY 1 1HA GLY 1 1.268 -1.027 -1.648 5 HA3 GLY 1 2HA GLY 1 1.812 -2.682 -1.314 6 H ILE 2 H ILE 2 2.141 -1.540 -3.848 7 HA ILE 2 HA ILE 2 -0.044 -1.790 -5.586 8 HB ILE 2 HB ILE 2 2.126 -0.571 -5.992 9 HG12 ILE 2 1HG1 ILE 2 1.280 -2.464 -8.239 10 HG13 ILE 2 2HG1 ILE 2 0.397 -1.021 -7.726 11 HG21 ILE 2 1HG2 ILE 2 3.239 -3.336 -6.754 12 HG22 ILE 2 2HG2 ILE 2 4.088 -1.788 -6.948 13 HG23 ILE 2 3HG2 ILE 2 3.705 -2.391 -5.336 14 HD11 ILE 2 3HD1 ILE 2 3.177 -1.129 -8.981 15 HD12 ILE 2 1HD1 ILE 2 1.700 -0.449 -9.683 16 HD13 ILE 2 2HD1 ILE 2 2.470 0.350 -8.288 17 H VAL 3 H VAL 3 2.100 -4.392 -4.461 18 HA VAL 3 HA VAL 3 1.315 -6.262 -6.506 19 HB VAL 3 HB VAL 3 2.337 -6.893 -3.695 20 HG11 VAL 3 1HG1 VAL 3 2.550 -8.458 -6.315 21 HG12 VAL 3 2HG1 VAL 3 3.168 -8.975 -4.727 22 HG13 VAL 3 3HG1 VAL 3 1.418 -8.828 -4.994 23 HG21 VAL 3 3HG2 VAL 3 3.901 -6.197 -6.222 24 HG22 VAL 3 1HG2 VAL 3 3.928 -5.336 -4.670 25 HG23 VAL 3 2HG2 VAL 3 4.617 -6.950 -4.784 26 H GLU 4 H GLU 4 0.313 -5.648 -3.129 27 HA GLU 4 HA GLU 4 -1.706 -7.687 -3.087 28 HB2 GLU 4 1HB GLU 4 -1.698 -5.157 -1.446 29 HB3 GLU 4 2HB GLU 4 -2.446 -6.705 -1.029 30 HG2 GLU 4 1HG GLU 4 -0.579 -6.970 0.218 31 HG3 GLU 4 2HG GLU 4 0.147 -7.466 -1.314 32 H GLN 5 H GLN 5 -1.656 -4.326 -4.168 33 HA GLN 5 HA GLN 5 -4.528 -4.134 -4.490 34 HB2 GLN 5 1HB GLN 5 -2.144 -2.529 -5.179 35 HB3 GLN 5 2HB GLN 5 -3.463 -2.380 -6.346 36 HG2 GLN 5 1HG GLN 5 -3.648 -0.621 -4.657 37 HG3 GLN 5 2HG GLN 5 -4.999 -1.748 -4.535 38 HE21 GLN 5 2HE2 GLN 5 -5.375 -2.774 -2.652 39 HE22 GLN 5 1HE2 GLN 5 -4.371 -2.610 -1.230 40 H CYS 6 H CYS 6 -1.857 -5.150 -6.612 41 HA CYS 6 HA CYS 6 -3.414 -5.471 -8.985 42 HB2 CYS 6 1HB CYS 6 -0.906 -5.492 -8.851 43 HB3 CYS 6 2HB CYS 6 -1.007 -7.069 -8.052 44 H CYS 7 H CYS 7 -2.765 -7.565 -6.205 45 HA CYS 7 HA CYS 7 -4.274 -9.829 -7.230 46 HB2 CYS 7 1HB CYS 7 -3.486 -9.040 -4.391 47 HB3 CYS 7 2HB CYS 7 -4.143 -10.617 -4.853 48 H THR 8 H THR 8 -5.076 -7.716 -4.432 49 HA THR 8 HA THR 8 -7.740 -8.805 -4.232 50 HB THR 8 HB THR 8 -8.053 -7.085 -2.456 51 HG1 THR 8 HG1 THR 8 -5.463 -6.160 -3.295 52 HG21 THR 8 1HG2 THR 8 -6.261 -7.781 -0.958 53 HG22 THR 8 2HG2 THR 8 -5.250 -8.280 -2.331 54 HG23 THR 8 3HG2 THR 8 -6.743 -9.175 -1.964 55 H SER 9 H SER 9 -6.921 -7.035 -6.737 56 HA SER 9 HA SER 9 -9.565 -5.788 -7.020 57 HB2 SER 9 1HB SER 9 -7.110 -3.972 -6.791 58 HB3 SER 9 2HB SER 9 -8.723 -3.467 -7.341 59 HG SER 9 HG SER 9 -8.727 -4.785 -4.929 60 H ILE 10 H ILE 10 -9.352 -4.274 -9.136 61 HA ILE 10 HA ILE 10 -8.330 -6.047 -11.209 62 HB ILE 10 HB ILE 10 -9.394 -3.176 -11.321 63 HG12 ILE 10 1HG1 ILE 10 -11.049 -4.869 -10.556 64 HG13 ILE 10 2HG1 ILE 10 -11.473 -4.105 -12.080 65 HG21 ILE 10 1HG2 ILE 10 -8.020 -3.507 -13.255 66 HG22 ILE 10 2HG2 ILE 10 -8.686 -5.128 -13.551 67 HG23 ILE 10 3HG2 ILE 10 -9.702 -3.674 -13.789 68 HD11 ILE 10 3HD1 ILE 10 -11.913 -6.600 -11.951 69 HD12 ILE 10 1HD1 ILE 10 -10.933 -6.097 -13.349 70 HD13 ILE 10 2HD1 ILE 10 -10.167 -6.855 -11.946 71 H CYS 11 H CYS 11 -6.253 -6.200 -11.750 72 HA CYS 11 HA CYS 11 -4.282 -4.572 -10.553 73 HB2 CYS 11 1HB CYS 11 -4.058 -6.909 -11.475 74 HB3 CYS 11 2HB CYS 11 -3.910 -6.175 -13.092 75 H SER 12 H SER 12 -5.802 -4.313 -13.705 76 HA SER 12 HA SER 12 -5.951 -2.647 -15.225 77 HB2 SER 12 1HB SER 12 -4.724 -0.791 -13.161 78 HB3 SER 12 2HB SER 12 -5.757 -0.352 -14.543 79 HG SER 12 HG SER 12 -6.425 -1.752 -12.170 80 H LEU 13 H LEU 13 -4.915 -2.119 -17.016 81 HA LEU 13 HA LEU 13 -2.335 -2.940 -17.532 82 HB2 LEU 13 1HB LEU 13 -4.041 -2.475 -19.218 83 HB3 LEU 13 2HB LEU 13 -3.939 -0.738 -18.893 84 HG LEU 13 HG LEU 13 -1.633 -0.691 -19.747 85 HD11 LEU 13 1HD1 LEU 13 -0.913 -2.993 -19.313 86 HD12 LEU 13 2HD1 LEU 13 -0.719 -2.572 -21.023 87 HD13 LEU 13 3HD1 LEU 13 -2.078 -3.587 -20.518 88 HD21 LEU 13 3HD2 LEU 13 -3.665 -1.932 -21.651 89 HD22 LEU 13 1HD2 LEU 13 -2.239 -0.952 -22.104 90 HD23 LEU 13 2HD2 LEU 13 -3.560 -0.212 -21.180 91 H TYR 14 H TYR 14 -3.203 0.477 -16.705 92 HA TYR 14 HA TYR 14 -0.471 1.302 -17.227 93 HB2 TYR 14 1HB TYR 14 -1.399 3.477 -16.095 94 HB3 TYR 14 2HB TYR 14 -1.994 2.968 -17.692 95 HD1 TYR 14 HD2 TYR 14 -2.850 3.244 -14.090 96 HD2 TYR 14 HD1 TYR 14 -4.279 2.189 -18.019 97 HE1 TYR 14 HE2 TYR 14 -5.184 3.203 -13.240 98 HE2 TYR 14 HE1 TYR 14 -6.622 2.162 -17.143 99 HH TYR 14 HH TYR 14 -7.388 2.841 -13.746 100 H GLN 15 H GLN 15 -2.317 0.383 -14.334 101 HA GLN 15 HA GLN 15 -0.277 1.345 -12.509 102 HB2 GLN 15 1HB GLN 15 -2.326 -0.821 -12.151 103 HB3 GLN 15 2HB GLN 15 -1.382 -0.094 -10.855 104 HG2 GLN 15 1HG GLN 15 -2.449 2.107 -11.365 105 HG3 GLN 15 2HG GLN 15 -3.445 1.313 -12.600 106 HE21 GLN 15 2HE2 GLN 15 -3.744 -1.163 -10.932 107 HE22 GLN 15 1HE2 GLN 15 -4.933 -0.704 -9.731 108 H LEU 16 H LEU 16 -0.905 -1.542 -14.441 109 HA LEU 16 HA LEU 16 1.170 -3.145 -13.263 110 HB2 LEU 16 1HB LEU 16 -0.816 -3.906 -14.623 111 HB3 LEU 16 2HB LEU 16 -0.008 -3.312 -16.054 112 HG LEU 16 HG LEU 16 0.938 -5.604 -14.293 113 HD11 LEU 16 1HD1 LEU 16 0.340 -6.772 -16.569 114 HD12 LEU 16 2HD1 LEU 16 -0.632 -5.331 -16.886 115 HD13 LEU 16 3HD1 LEU 16 -0.947 -6.328 -15.434 116 HD21 LEU 16 3HD2 LEU 16 2.931 -4.862 -15.218 117 HD22 LEU 16 1HD2 LEU 16 2.163 -4.318 -16.715 118 HD23 LEU 16 2HD2 LEU 16 2.380 -6.049 -16.406 119 H GLU 17 H GLU 17 1.038 -1.059 -16.261 120 HA GLU 17 HA GLU 17 3.776 -1.654 -16.858 121 HB2 GLU 17 1HB GLU 17 3.668 -0.036 -18.578 122 HB3 GLU 17 2HB GLU 17 2.176 -0.959 -18.580 123 HG2 GLU 17 1HG GLU 17 1.130 0.899 -18.664 124 HG3 GLU 17 2HG GLU 17 1.632 1.165 -17.008 125 H ASN 18 H ASN 18 2.335 0.544 -14.584 126 HA ASN 18 HA ASN 18 4.673 2.209 -14.249 127 HB2 ASN 18 1HB ASN 18 2.184 1.612 -12.737 128 HB3 ASN 18 2HB ASN 18 3.564 2.119 -11.749 129 HD21 ASN 18 2HD2 ASN 18 2.315 3.069 -14.982 130 HD22 ASN 18 1HD2 ASN 18 2.326 4.788 -14.624 131 H TYR 19 H TYR 19 4.382 -1.161 -13.696 132 HA TYR 19 HA TYR 19 6.346 -1.302 -11.494 133 HB2 TYR 19 1HB TYR 19 5.245 -3.285 -13.491 134 HB3 TYR 19 2HB TYR 19 6.630 -3.678 -12.486 135 HD1 TYR 19 HD2 TYR 19 2.993 -2.851 -12.317 136 HD2 TYR 19 HD1 TYR 19 6.424 -4.323 -10.206 137 HE1 TYR 19 HE2 TYR 19 1.515 -3.711 -10.536 138 HE2 TYR 19 HE1 TYR 19 4.923 -5.172 -8.398 139 HH TYR 19 HH TYR 19 1.370 -4.726 -8.543 140 H CYS 20 H CYS 20 6.363 -0.810 -14.961 141 HA CYS 20 HA CYS 20 9.018 -1.944 -15.374 142 HB2 CYS 20 1HB CYS 20 7.133 -0.375 -17.170 143 HB3 CYS 20 2HB CYS 20 8.687 -1.036 -17.696 144 H ASN 21 H ASN 21 10.132 -0.167 -17.189 145 HA ASN 21 HA ASN 21 10.763 2.274 -15.648 146 HB2 ASN 21 1HB ASN 21 13.152 1.885 -16.340 147 HB3 ASN 21 2HB ASN 21 12.585 0.729 -15.133 148 HD21 ASN 21 2HD2 ASN 21 11.809 -1.413 -16.002 149 HD22 ASN 21 1HD2 ASN 21 12.700 -2.098 -17.328 150 H1 PHE 1 1H PHE 1 -2.928 -7.062 -23.351 151 H2 PHE 1 2H PHE 1 -1.799 -8.167 -22.855 152 H3 PHE 1 3H PHE 1 -3.292 -8.690 -23.299 153 HA PHE 1 HA PHE 1 -3.110 -8.694 -20.894 154 HB2 PHE 1 1HB PHE 1 -1.382 -6.928 -20.893 155 HB3 PHE 1 2HB PHE 1 -2.642 -5.719 -21.165 156 HD1 PHE 1 HD2 PHE 1 -1.825 -8.647 -18.984 157 HD2 PHE 1 HD1 PHE 1 -3.555 -4.709 -19.250 158 HE1 PHE 1 HE2 PHE 1 -2.316 -8.712 -16.602 159 HE2 PHE 1 HE1 PHE 1 -4.059 -4.765 -16.809 160 HZ PHE 1 HZ PHE 1 -3.452 -6.785 -15.468 161 H VAL 2 H VAL 2 -5.117 -8.579 -19.838 162 HA VAL 2 HA VAL 2 -7.172 -6.743 -21.007 163 HB VAL 2 HB VAL 2 -8.870 -8.609 -20.770 164 HG11 VAL 2 1HG1 VAL 2 -6.614 -9.225 -22.725 165 HG12 VAL 2 2HG1 VAL 2 -8.335 -9.687 -22.867 166 HG13 VAL 2 3HG1 VAL 2 -7.864 -7.984 -22.943 167 HG21 VAL 2 3HG2 VAL 2 -6.411 -10.427 -20.522 168 HG22 VAL 2 1HG2 VAL 2 -7.546 -10.069 -19.193 169 HG23 VAL 2 2HG2 VAL 2 -8.103 -10.934 -20.630 170 H ASN 3 H ASN 3 -5.617 -6.495 -18.547 171 HA ASN 3 HA ASN 3 -5.899 -5.795 -16.403 172 HB2 ASN 3 1HB ASN 3 -8.843 -5.676 -17.073 173 HB3 ASN 3 2HB ASN 3 -8.059 -4.964 -15.669 174 HD21 ASN 3 2HD2 ASN 3 -9.457 -3.980 -18.240 175 HD22 ASN 3 1HD2 ASN 3 -8.386 -2.710 -18.772 176 H GLN 4 H GLN 4 -8.952 -7.006 -15.587 177 HA GLN 4 HA GLN 4 -9.636 -8.625 -14.103 178 HB2 GLN 4 1HB GLN 4 -7.241 -10.267 -14.950 179 HB3 GLN 4 2HB GLN 4 -8.684 -10.847 -14.120 180 HG2 GLN 4 1HG GLN 4 -10.042 -10.369 -16.116 181 HG3 GLN 4 2HG GLN 4 -8.637 -9.690 -16.931 182 HE21 GLN 4 2HE2 GLN 4 -10.472 -12.177 -17.296 183 HE22 GLN 4 1HE2 GLN 4 -9.333 -13.438 -17.579 184 H HIS 5 H HIS 5 -8.831 -10.121 -12.210 185 HA HIS 5 HA HIS 5 -7.059 -8.525 -10.404 186 HB2 HIS 5 1HB HIS 5 -8.865 -10.980 -10.026 187 HB3 HIS 5 2HB HIS 5 -7.730 -10.406 -8.801 188 HD1 HIS 5 HD1 HIS 5 -10.376 -8.450 -10.862 189 HD2 HIS 5 HD2 HIS 5 -9.216 -9.195 -6.932 190 HE1 HIS 5 HE1 HIS 5 -11.890 -7.093 -9.358 191 H LEU 6 H LEU 6 -4.901 -9.275 -10.161 192 HA LEU 6 HA LEU 6 -4.405 -12.070 -11.125 193 HB2 LEU 6 1HB LEU 6 -2.852 -9.615 -11.958 194 HB3 LEU 6 2HB LEU 6 -2.396 -11.271 -12.306 195 HG LEU 6 HG LEU 6 -4.936 -9.928 -13.299 196 HD11 LEU 6 1HD1 LEU 6 -3.827 -9.744 -15.397 197 HD12 LEU 6 2HD1 LEU 6 -2.355 -10.495 -14.745 198 HD13 LEU 6 3HD1 LEU 6 -2.892 -8.898 -14.150 199 HD21 LEU 6 3HD2 LEU 6 -3.623 -12.530 -14.210 200 HD22 LEU 6 1HD2 LEU 6 -5.092 -11.794 -14.878 201 HD23 LEU 6 2HD2 LEU 6 -5.095 -12.422 -13.225 202 H CYS 7 H CYS 7 -3.064 -13.216 -9.904 203 HA CYS 7 HA CYS 7 -1.195 -11.833 -8.076 204 HB2 CYS 7 1HB CYS 7 -3.661 -12.263 -7.143 205 HB3 CYS 7 2HB CYS 7 -3.070 -13.912 -6.953 206 H GLY 8 H GLY 8 0.208 -13.531 -6.994 207 HA2 GLY 8 1HA GLY 8 1.490 -15.460 -7.069 208 HA3 GLY 8 2HA GLY 8 0.121 -16.263 -7.865 209 H SER 9 H SER 9 1.163 -17.374 -9.495 210 HA SER 9 HA SER 9 3.366 -16.409 -10.991 211 HB2 SER 9 1HB SER 9 2.557 -18.197 -12.638 212 HB3 SER 9 2HB SER 9 2.896 -18.738 -10.979 213 HG SER 9 HG SER 9 0.803 -19.371 -12.035 214 H HIS 10 H HIS 10 -0.117 -15.891 -11.394 215 HA HIS 10 HA HIS 10 -0.069 -15.105 -14.139 216 HB2 HIS 10 1HB HIS 10 -1.878 -14.176 -11.888 217 HB3 HIS 10 2HB HIS 10 -2.141 -13.855 -13.599 218 HD1 HIS 10 HD1 HIS 10 -4.455 -15.263 -12.597 219 HD2 HIS 10 HD2 HIS 10 -0.979 -17.355 -13.571 220 HE1 HIS 10 HE1 HIS 10 -5.126 -17.675 -12.960 221 H LEU 11 H LEU 11 0.929 -13.401 -11.222 222 HA LEU 11 HA LEU 11 0.733 -10.736 -12.321 223 HB2 LEU 11 1HB LEU 11 0.938 -11.471 -9.880 224 HB3 LEU 11 2HB LEU 11 2.639 -11.698 -10.166 225 HG LEU 11 HG LEU 11 1.601 -9.049 -10.989 226 HD11 LEU 11 1HD1 LEU 11 0.197 -9.396 -9.027 227 HD12 LEU 11 2HD1 LEU 11 1.462 -8.210 -8.654 228 HD13 LEU 11 3HD1 LEU 11 1.622 -9.877 -8.079 229 HD21 LEU 11 3HD2 LEU 11 3.641 -8.300 -9.848 230 HD22 LEU 11 1HD2 LEU 11 4.015 -9.618 -10.963 231 HD23 LEU 11 2HD2 LEU 11 3.912 -9.940 -9.227 232 H VAL 12 H VAL 12 3.244 -13.258 -12.244 233 HA VAL 12 HA VAL 12 5.325 -11.602 -13.290 234 HB VAL 12 HB VAL 12 5.041 -14.647 -13.417 235 HG11 VAL 12 1HG1 VAL 12 6.718 -13.805 -15.012 236 HG12 VAL 12 2HG1 VAL 12 7.481 -12.840 -13.730 237 HG13 VAL 12 3HG1 VAL 12 7.513 -14.617 -13.662 238 HG21 VAL 12 3HG2 VAL 12 4.992 -13.845 -11.093 239 HG22 VAL 12 1HG2 VAL 12 6.551 -14.626 -11.453 240 HG23 VAL 12 2HG2 VAL 12 6.467 -12.857 -11.400 241 H GLU 13 H GLU 13 2.920 -13.807 -14.731 242 HA GLU 13 HA GLU 13 3.838 -13.489 -17.448 243 HB2 GLU 13 1HB GLU 13 1.129 -14.210 -16.280 244 HB3 GLU 13 2HB GLU 13 1.472 -14.186 -18.009 245 HG2 GLU 13 1HG GLU 13 3.545 -15.720 -16.889 246 HG3 GLU 13 2HG GLU 13 2.063 -16.229 -16.043 247 H ALA 14 H ALA 14 1.576 -11.618 -15.429 248 HA ALA 14 HA ALA 14 0.566 -9.973 -17.496 249 HB1 ALA 14 3HB ALA 14 -0.268 -8.639 -15.756 250 HB2 ALA 14 1HB ALA 14 -0.179 -10.238 -15.026 251 HB3 ALA 14 2HB ALA 14 1.073 -9.033 -14.666 252 H LEU 15 H LEU 15 3.372 -9.584 -15.266 253 HA LEU 15 HA LEU 15 4.289 -7.093 -16.278 254 HB2 LEU 15 1HB LEU 15 5.251 -9.313 -14.641 255 HB3 LEU 15 2HB LEU 15 6.518 -8.618 -15.624 256 HG LEU 15 HG LEU 15 6.513 -7.713 -13.402 257 HD11 LEU 15 1HD1 LEU 15 5.609 -5.511 -15.290 258 HD12 LEU 15 2HD1 LEU 15 7.184 -6.319 -15.432 259 HD13 LEU 15 3HD1 LEU 15 6.788 -5.415 -13.961 260 HD21 LEU 15 3HD2 LEU 15 4.123 -7.908 -12.879 261 HD22 LEU 15 1HD2 LEU 15 3.772 -6.577 -13.988 262 HD23 LEU 15 2HD2 LEU 15 4.743 -6.294 -12.534 263 H TYR 16 H TYR 16 5.030 -10.451 -17.269 264 HA TYR 16 HA TYR 16 6.986 -9.756 -19.203 265 HB2 TYR 16 1HB TYR 16 6.537 -11.985 -18.134 266 HB3 TYR 16 2HB TYR 16 5.161 -12.183 -19.211 267 HD1 TYR 16 HD1 TYR 16 8.866 -11.867 -19.054 268 HD2 TYR 16 HD2 TYR 16 5.482 -12.826 -21.529 269 HE1 TYR 16 HE1 TYR 16 10.394 -12.848 -20.776 270 HE2 TYR 16 HE2 TYR 16 7.009 -13.784 -23.259 271 HH TYR 16 HH TYR 16 10.577 -13.784 -22.831 272 H LEU 17 H LEU 17 3.439 -10.259 -19.508 273 HA LEU 17 HA LEU 17 3.436 -9.969 -22.374 274 HB2 LEU 17 1HB LEU 17 1.289 -9.673 -20.231 275 HB3 LEU 17 2HB LEU 17 0.955 -9.455 -21.958 276 HG LEU 17 HG LEU 17 2.151 -12.001 -20.838 277 HD11 LEU 17 1HD1 LEU 17 -0.096 -12.951 -20.844 278 HD12 LEU 17 2HD1 LEU 17 -0.772 -11.403 -21.400 279 HD13 LEU 17 3HD1 LEU 17 -0.034 -11.531 -19.777 280 HD21 LEU 17 3HD2 LEU 17 0.716 -11.415 -23.464 281 HD22 LEU 17 1HD2 LEU 17 1.303 -12.998 -22.924 282 HD23 LEU 17 2HD2 LEU 17 2.451 -11.708 -23.280 283 H VAL 18 H VAL 18 3.060 -7.579 -19.735 284 HA VAL 18 HA VAL 18 2.292 -5.507 -21.703 285 HB VAL 18 HB VAL 18 2.920 -5.346 -18.726 286 HG11 VAL 18 1HG1 VAL 18 1.729 -3.088 -18.861 287 HG12 VAL 18 2HG1 VAL 18 3.308 -3.123 -19.680 288 HG13 VAL 18 3HG1 VAL 18 1.820 -3.229 -20.632 289 HG21 VAL 18 3HG2 VAL 18 0.369 -5.007 -18.678 290 HG22 VAL 18 1HG2 VAL 18 0.362 -5.545 -20.361 291 HG23 VAL 18 2HG2 VAL 18 0.925 -6.642 -19.071 292 H CYS 19 H CYS 19 5.206 -6.260 -19.701 293 HA CYS 19 HA CYS 19 6.605 -3.979 -20.945 294 HB2 CYS 19 1HB CYS 19 6.878 -5.410 -18.554 295 HB3 CYS 19 2HB CYS 19 8.325 -5.794 -19.497 296 H GLY 20 H GLY 20 5.724 -6.798 -22.221 297 HA2 GLY 20 1HA GLY 20 6.347 -7.757 -24.182 298 HA3 GLY 20 2HA GLY 20 7.696 -6.609 -24.291 299 H GLU 21 H GLU 21 9.229 -7.315 -22.143 300 HA GLU 21 HA GLU 21 9.969 -10.158 -22.742 301 HB2 GLU 21 1HB GLU 21 12.330 -9.365 -22.986 302 HB3 GLU 21 2HB GLU 21 11.216 -8.874 -24.275 303 HG2 GLU 21 1HG GLU 21 10.987 -6.612 -23.142 304 HG3 GLU 21 2HG GLU 21 12.296 -7.115 -22.063 305 H ARG 22 H ARG 22 10.058 -7.486 -20.429 306 HA ARG 22 HA ARG 22 10.312 -9.370 -18.280 307 HB2 ARG 22 1HB ARG 22 12.474 -8.107 -17.344 308 HB3 ARG 22 2HB ARG 22 12.565 -9.542 -18.338 309 HG2 ARG 22 1HG ARG 22 13.116 -8.270 -20.312 310 HG3 ARG 22 2HG ARG 22 12.816 -6.737 -19.452 311 HD2 ARG 22 1HD ARG 22 14.668 -7.259 -17.919 312 HD3 ARG 22 2HD ARG 22 14.982 -8.771 -18.804 313 HE ARG 22 HE ARG 22 15.111 -6.934 -20.802 314 HH11 ARG 22 1HH1 ARG 22 16.659 -6.962 -17.627 315 HH12 ARG 22 2HH1 ARG 22 18.061 -6.061 -18.206 316 HH21 ARG 22 1HH2 ARG 22 16.870 -5.793 -21.444 317 HH22 ARG 22 2HH2 ARG 22 18.163 -5.423 -20.342 318 H GLY 23 H GLY 23 11.793 -6.184 -17.827 319 HA2 GLY 23 1HA GLY 23 10.854 -4.246 -16.931 320 HA3 GLY 23 2HA GLY 23 9.246 -4.993 -16.965 321 H PHE 24 H PHE 24 11.339 -7.170 -15.530 322 HA PHE 24 HA PHE 24 11.073 -6.017 -12.828 323 HB2 PHE 24 1HB PHE 24 10.077 -8.119 -11.972 324 HB3 PHE 24 2HB PHE 24 9.001 -7.321 -13.115 325 HD1 PHE 24 HD1 PHE 24 8.594 -8.257 -15.339 326 HD2 PHE 24 HD2 PHE 24 11.080 -10.302 -12.519 327 HE1 PHE 24 HE1 PHE 24 8.406 -10.326 -16.716 328 HE2 PHE 24 HE2 PHE 24 10.928 -12.383 -13.880 329 HZ PHE 24 HZ PHE 24 9.550 -12.386 -15.986 330 H PHE 25 H PHE 25 12.325 -7.458 -11.269 331 HA PHE 25 HA PHE 25 14.378 -9.126 -12.627 332 HB2 PHE 25 1HB PHE 25 15.118 -6.701 -12.004 333 HB3 PHE 25 2HB PHE 25 15.149 -7.302 -10.340 334 HD1 PHE 25 HD1 PHE 25 16.147 -10.219 -11.090 335 HD2 PHE 25 HD2 PHE 25 17.415 -6.275 -12.300 336 HE1 PHE 25 HE1 PHE 25 18.408 -11.108 -11.554 337 HE2 PHE 25 HE2 PHE 25 19.689 -7.155 -12.765 338 HZ PHE 25 HZ PHE 25 20.204 -9.569 -12.394 339 H NVA 26 H ARX 26 12.786 -10.626 -11.939 340 HA NVA 26 HA ARX 26 13.053 -11.458 -9.106 341 HB2 NVA 26 1HB ARX 26 10.638 -10.951 -9.805 342 HB3 NVA 26 2HB ARX 26 10.815 -12.134 -11.083 343 HG2 NVA 26 1HG ARX 26 9.614 -13.251 -9.330 344 HG3 NVA 26 2HG ARX 26 11.215 -13.920 -9.327 345 HD2 NVA 26 1HD ARX 26 11.658 -12.073 -7.438 346 HD3 NVA 26 2HD ARX 26 9.904 -12.046 -7.327 347 H THR 27 H THR 27 14.522 -12.891 -8.800 348 HA THR 27 HA THR 27 15.478 -14.664 -10.914 349 HB THR 27 HB THR 27 16.706 -15.768 -8.941 350 HG1 THR 27 HG1 THR 27 15.033 -14.855 -7.434 351 HG21 THR 27 1HG2 THR 27 17.060 -12.752 -9.239 352 HG22 THR 27 2HG2 THR 27 17.770 -13.987 -10.309 353 HG23 THR 27 3HG2 THR 27 18.268 -13.885 -8.598 354 HA PRO 28 HA PRO 28 12.241 -17.485 -10.238 355 HB2 PRO 28 1HB PRO 28 13.247 -20.026 -10.482 356 HB3 PRO 28 2HB PRO 28 13.101 -18.887 -11.868 357 HG2 PRO 28 1HG PRO 28 15.518 -19.416 -10.126 358 HG3 PRO 28 2HG PRO 28 15.399 -19.459 -11.912 359 HD2 PRO 28 1HD PRO 28 16.321 -17.289 -10.614 360 HD3 PRO 28 2HD PRO 28 15.243 -17.118 -12.047 361 H HIX 29 H HIX 29 11.414 -17.258 -8.281 362 HA HIX 29 HA HIX 29 12.527 -18.114 -5.775 363 HB1 HIX 29 1HB HIX 29 9.549 -17.636 -6.315 364 HB2 HIX 29 2HB HIX 29 10.370 -17.626 -4.760 365 HD2 HIX 29 HD2 HIX 29 9.670 -15.352 -7.758 366 HD1 HIX 29 HD1 HIX 29 12.112 -15.518 -4.384 367 HE1 HIX 29 HE1 HIX 29 10.920 -13.276 -4.856 368 H THR 30 H THR 30 13.071 -20.061 -5.404 369 HA THR 30 HA THR 30 11.268 -22.332 -6.090 370 HB THR 30 HB THR 30 14.293 -22.384 -5.657 371 HG1 THR 30 HG1 THR 30 13.620 -21.222 -7.552 372 HG21 THR 30 1HG2 THR 30 14.134 -24.612 -6.720 373 HG22 THR 30 2HG2 THR 30 12.371 -24.419 -6.852 374 HG23 THR 30 3HG2 THR 30 13.132 -24.551 -5.258 Start of MODEL 5 1 H1 GLY 1 1H GLY 1 1.210 0.739 0.659 2 H2 GLY 1 2H GLY 1 0.041 1.177 -0.426 3 H3 GLY 1 3H GLY 1 0.164 -0.402 0.039 4 HA2 GLY 1 1HA GLY 1 2.101 1.160 -1.536 5 HA3 GLY 1 2HA GLY 1 2.375 -0.524 -0.958 6 H ILE 2 H ILE 2 2.361 0.274 -3.745 7 HA ILE 2 HA ILE 2 -0.202 -0.053 -4.904 8 HB ILE 2 HB ILE 2 1.720 0.965 -6.138 9 HG12 ILE 2 1HG1 ILE 2 0.660 -1.476 -7.594 10 HG13 ILE 2 2HG1 ILE 2 -0.261 0.007 -7.304 11 HG21 ILE 2 1HG2 ILE 2 3.549 -0.499 -5.363 12 HG22 ILE 2 2HG2 ILE 2 2.842 -1.896 -6.315 13 HG23 ILE 2 3HG2 ILE 2 3.487 -0.454 -7.151 14 HD11 ILE 2 3HD1 ILE 2 2.162 -0.401 -9.087 15 HD12 ILE 2 1HD1 ILE 2 0.541 0.156 -9.537 16 HD13 ILE 2 2HD1 ILE 2 1.618 1.220 -8.585 17 H VAL 3 H VAL 3 2.196 -2.547 -3.961 18 HA VAL 3 HA VAL 3 1.222 -4.659 -5.488 19 HB VAL 3 HB VAL 3 2.367 -4.746 -2.671 20 HG11 VAL 3 1HG1 VAL 3 3.040 -7.115 -3.409 21 HG12 VAL 3 2HG1 VAL 3 1.310 -6.852 -3.067 22 HG13 VAL 3 3HG1 VAL 3 1.902 -6.943 -4.737 23 HG21 VAL 3 3HG2 VAL 3 4.510 -5.235 -3.870 24 HG22 VAL 3 1HG2 VAL 3 3.655 -5.034 -5.427 25 HG23 VAL 3 2HG2 VAL 3 3.847 -3.689 -4.314 26 H GLU 4 H GLU 4 0.097 -3.922 -2.131 27 HA GLU 4 HA GLU 4 -1.774 -6.093 -2.199 28 HB2 GLU 4 1HB GLU 4 -1.650 -3.603 -0.471 29 HB3 GLU 4 2HB GLU 4 -2.789 -4.926 -0.210 30 HG2 GLU 4 1HG GLU 4 -0.893 -6.493 0.062 31 HG3 GLU 4 2HG GLU 4 0.236 -5.144 -0.163 32 H GLN 5 H GLN 5 -1.957 -2.667 -3.019 33 HA GLN 5 HA GLN 5 -4.789 -2.489 -3.281 34 HB2 GLN 5 1HB GLN 5 -3.195 -0.559 -3.240 35 HB3 GLN 5 2HB GLN 5 -2.608 -1.008 -4.833 36 HG2 GLN 5 1HG GLN 5 -4.891 -0.625 -5.715 37 HG3 GLN 5 2HG GLN 5 -5.426 -0.102 -4.101 38 HE21 GLN 5 2HE2 GLN 5 -5.431 2.039 -3.827 39 HE22 GLN 5 1HE2 GLN 5 -4.351 3.166 -4.589 40 H CYS 6 H CYS 6 -2.166 -3.336 -5.577 41 HA CYS 6 HA CYS 6 -3.814 -3.731 -7.887 42 HB2 CYS 6 1HB CYS 6 -1.390 -3.287 -7.829 43 HB3 CYS 6 2HB CYS 6 -1.123 -4.884 -7.081 44 H CYS 7 H CYS 7 -2.719 -5.973 -5.292 45 HA CYS 7 HA CYS 7 -3.826 -8.303 -6.624 46 HB2 CYS 7 1HB CYS 7 -3.029 -7.758 -3.733 47 HB3 CYS 7 2HB CYS 7 -3.633 -9.335 -4.295 48 H THR 8 H THR 8 -5.109 -6.256 -3.935 49 HA THR 8 HA THR 8 -7.411 -8.011 -3.644 50 HB THR 8 HB THR 8 -8.254 -6.264 -2.076 51 HG1 THR 8 HG1 THR 8 -5.838 -4.856 -2.611 52 HG21 THR 8 1HG2 THR 8 -6.622 -8.009 -1.367 53 HG22 THR 8 2HG2 THR 8 -6.459 -6.505 -0.460 54 HG23 THR 8 3HG2 THR 8 -5.294 -6.876 -1.710 55 H SER 9 H SER 9 -6.988 -6.568 -6.333 56 HA SER 9 HA SER 9 -9.764 -5.811 -6.790 57 HB2 SER 9 1HB SER 9 -9.397 -3.503 -7.360 58 HB3 SER 9 2HB SER 9 -8.697 -3.726 -5.768 59 HG SER 9 HG SER 9 -6.646 -3.783 -6.679 60 H ILE 10 H ILE 10 -9.951 -4.906 -9.123 61 HA ILE 10 HA ILE 10 -8.313 -6.640 -10.885 62 HB ILE 10 HB ILE 10 -10.390 -4.432 -11.525 63 HG12 ILE 10 1HG1 ILE 10 -11.315 -6.506 -10.438 64 HG13 ILE 10 2HG1 ILE 10 -11.933 -6.179 -12.040 65 HG21 ILE 10 1HG2 ILE 10 -8.831 -6.333 -13.357 66 HG22 ILE 10 2HG2 ILE 10 -10.343 -5.450 -13.854 67 HG23 ILE 10 3HG2 ILE 10 -8.893 -4.555 -13.398 68 HD11 ILE 10 3HD1 ILE 10 -11.523 -8.558 -11.652 69 HD12 ILE 10 1HD1 ILE 10 -10.608 -7.961 -13.040 70 HD13 ILE 10 2HD1 ILE 10 -9.772 -8.215 -11.482 71 H CYS 11 H CYS 11 -6.304 -6.036 -11.165 72 HA CYS 11 HA CYS 11 -5.423 -3.301 -10.791 73 HB2 CYS 11 1HB CYS 11 -4.217 -5.590 -10.292 74 HB3 CYS 11 2HB CYS 11 -3.734 -5.486 -12.033 75 H SER 12 H SER 12 -4.922 -1.785 -12.340 76 HA SER 12 HA SER 12 -6.040 -2.309 -14.993 77 HB2 SER 12 1HB SER 12 -6.002 0.037 -15.341 78 HB3 SER 12 2HB SER 12 -6.457 -0.193 -13.630 79 HG SER 12 HG SER 12 -4.852 1.373 -13.790 80 H LEU 13 H LEU 13 -4.944 -1.375 -16.967 81 HA LEU 13 HA LEU 13 -2.412 -2.633 -17.339 82 HB2 LEU 13 1HB LEU 13 -4.002 -2.080 -19.170 83 HB3 LEU 13 2HB LEU 13 -3.731 -0.353 -18.882 84 HG LEU 13 HG LEU 13 -1.406 -0.554 -19.607 85 HD11 LEU 13 1HD1 LEU 13 -0.551 -2.610 -20.674 86 HD12 LEU 13 2HD1 LEU 13 -2.016 -3.489 -20.142 87 HD13 LEU 13 3HD1 LEU 13 -0.878 -2.867 -18.947 88 HD21 LEU 13 3HD2 LEU 13 -3.441 -1.773 -21.516 89 HD22 LEU 13 1HD2 LEU 13 -1.876 -1.060 -21.994 90 HD23 LEU 13 2HD2 LEU 13 -3.108 -0.053 -21.240 91 H TYR 14 H TYR 14 -3.212 0.811 -16.599 92 HA TYR 14 HA TYR 14 -0.452 1.561 -16.850 93 HB2 TYR 14 1HB TYR 14 -1.110 3.712 -16.028 94 HB3 TYR 14 2HB TYR 14 -2.212 3.160 -17.320 95 HD1 TYR 14 HD2 TYR 14 -1.893 3.753 -13.656 96 HD2 TYR 14 HD1 TYR 14 -4.590 2.801 -16.881 97 HE1 TYR 14 HE2 TYR 14 -3.851 4.212 -12.145 98 HE2 TYR 14 HE1 TYR 14 -6.545 3.267 -15.398 99 HH TYR 14 HH TYR 14 -6.144 4.165 -12.011 100 H GLN 15 H GLN 15 -2.398 0.256 -14.231 101 HA GLN 15 HA GLN 15 -0.569 1.063 -12.103 102 HB2 GLN 15 1HB GLN 15 -2.751 -1.071 -12.299 103 HB3 GLN 15 2HB GLN 15 -1.726 -0.895 -10.880 104 HG2 GLN 15 1HG GLN 15 -3.249 1.485 -11.874 105 HG3 GLN 15 2HG GLN 15 -4.041 0.222 -10.896 106 HE21 GLN 15 2HE2 GLN 15 -3.809 0.214 -8.732 107 HE22 GLN 15 1HE2 GLN 15 -2.710 1.256 -7.855 108 H LEU 16 H LEU 16 -0.994 -1.659 -14.351 109 HA LEU 16 HA LEU 16 1.146 -3.219 -13.250 110 HB2 LEU 16 1HB LEU 16 -0.724 -4.005 -14.731 111 HB3 LEU 16 2HB LEU 16 0.035 -3.172 -16.055 112 HG LEU 16 HG LEU 16 1.353 -5.479 -14.553 113 HD11 LEU 16 1HD1 LEU 16 -0.418 -5.402 -17.036 114 HD12 LEU 16 2HD1 LEU 16 -0.734 -6.282 -15.504 115 HD13 LEU 16 3HD1 LEU 16 0.569 -6.806 -16.554 116 HD21 LEU 16 3HD2 LEU 16 1.886 -4.185 -17.242 117 HD22 LEU 16 1HD2 LEU 16 2.641 -5.697 -16.703 118 HD23 LEU 16 2HD2 LEU 16 2.951 -4.177 -15.827 119 H GLU 17 H GLU 17 0.946 -0.846 -15.946 120 HA GLU 17 HA GLU 17 3.681 -1.095 -16.734 121 HB2 GLU 17 1HB GLU 17 1.732 1.224 -16.888 122 HB3 GLU 17 2HB GLU 17 3.348 1.332 -17.572 123 HG2 GLU 17 1HG GLU 17 1.484 -0.946 -18.319 124 HG3 GLU 17 2HG GLU 17 1.344 0.651 -19.085 125 H ASN 18 H ASN 18 2.190 0.856 -14.202 126 HA ASN 18 HA ASN 18 4.339 2.478 -13.465 127 HB2 ASN 18 1HB ASN 18 1.843 2.057 -12.610 128 HB3 ASN 18 2HB ASN 18 2.713 1.351 -11.255 129 HD21 ASN 18 2HD2 ASN 18 2.910 2.810 -9.710 130 HD22 ASN 18 1HD2 ASN 18 3.139 4.515 -9.928 131 H TYR 19 H TYR 19 4.236 -0.996 -13.150 132 HA TYR 19 HA TYR 19 6.177 -1.069 -10.924 133 HB2 TYR 19 1HB TYR 19 4.981 -3.196 -12.724 134 HB3 TYR 19 2HB TYR 19 6.276 -3.535 -11.575 135 HD1 TYR 19 HD2 TYR 19 5.896 -3.466 -9.163 136 HD2 TYR 19 HD1 TYR 19 2.675 -2.882 -11.949 137 HE1 TYR 19 HE2 TYR 19 4.208 -4.022 -7.368 138 HE2 TYR 19 HE1 TYR 19 1.034 -3.384 -10.196 139 HH TYR 19 HH TYR 19 2.034 -4.340 -6.885 140 H CYS 20 H CYS 20 6.166 -0.987 -14.399 141 HA CYS 20 HA CYS 20 8.881 -2.244 -14.551 142 HB2 CYS 20 1HB CYS 20 6.759 -1.554 -16.604 143 HB3 CYS 20 2HB CYS 20 8.405 -1.983 -17.077 144 H ASN 21 H ASN 21 10.258 -1.071 -16.339 145 HA ASN 21 HA ASN 21 10.582 1.733 -15.405 146 HB2 ASN 21 1HB ASN 21 12.566 -0.133 -16.751 147 HB3 ASN 21 2HB ASN 21 12.891 1.492 -16.079 148 HD21 ASN 21 2HD2 ASN 21 13.193 -1.749 -15.532 149 HD22 ASN 21 1HD2 ASN 21 13.365 -1.715 -13.798 150 H1 PHE 1 1H PHE 1 -1.680 -7.642 -22.867 151 H2 PHE 1 2H PHE 1 -3.138 -8.206 -23.464 152 H3 PHE 1 3H PHE 1 -2.880 -6.568 -23.262 153 HA PHE 1 HA PHE 1 -2.937 -8.556 -21.070 154 HB2 PHE 1 1HB PHE 1 -1.512 -6.524 -20.860 155 HB3 PHE 1 2HB PHE 1 -2.965 -5.538 -20.903 156 HD1 PHE 1 HD2 PHE 1 -2.061 -8.770 -19.183 157 HD2 PHE 1 HD1 PHE 1 -3.509 -4.746 -18.792 158 HE1 PHE 1 HE2 PHE 1 -2.437 -9.151 -16.751 159 HE2 PHE 1 HE1 PHE 1 -3.923 -5.114 -16.337 160 HZ PHE 1 HZ PHE 1 -3.336 -7.346 -15.332 161 H VAL 2 H VAL 2 -4.988 -8.755 -19.980 162 HA VAL 2 HA VAL 2 -7.234 -7.190 -21.063 163 HB VAL 2 HB VAL 2 -8.599 -9.345 -21.134 164 HG11 VAL 2 1HG1 VAL 2 -6.237 -9.233 -23.064 165 HG12 VAL 2 2HG1 VAL 2 -7.826 -9.973 -23.323 166 HG13 VAL 2 3HG1 VAL 2 -7.673 -8.199 -23.164 167 HG21 VAL 2 3HG2 VAL 2 -5.818 -10.687 -21.150 168 HG22 VAL 2 1HG2 VAL 2 -6.990 -10.739 -19.764 169 HG23 VAL 2 2HG2 VAL 2 -7.419 -11.454 -21.334 170 H ASN 3 H ASN 3 -5.744 -6.959 -18.615 171 HA ASN 3 HA ASN 3 -6.026 -6.630 -16.408 172 HB2 ASN 3 1HB ASN 3 -8.963 -6.666 -17.126 173 HB3 ASN 3 2HB ASN 3 -8.316 -6.179 -15.566 174 HD21 ASN 3 2HD2 ASN 3 -6.710 -4.429 -15.531 175 HD22 ASN 3 1HD2 ASN 3 -6.921 -3.138 -16.742 176 H GLN 4 H GLN 4 -8.991 -8.294 -15.871 177 HA GLN 4 HA GLN 4 -9.532 -9.996 -14.486 178 HB2 GLN 4 1HB GLN 4 -7.229 -11.178 -15.978 179 HB3 GLN 4 2HB GLN 4 -7.581 -11.908 -14.400 180 HG2 GLN 4 1HG GLN 4 -8.781 -13.097 -16.146 181 HG3 GLN 4 2HG GLN 4 -9.951 -12.245 -15.092 182 HE21 GLN 4 2HE2 GLN 4 -8.436 -12.329 -18.269 183 HE22 GLN 4 1HE2 GLN 4 -9.569 -11.247 -19.026 184 H HIS 5 H HIS 5 -8.727 -11.367 -12.513 185 HA HIS 5 HA HIS 5 -7.418 -9.423 -10.663 186 HB2 HIS 5 1HB HIS 5 -9.380 -11.637 -10.460 187 HB3 HIS 5 2HB HIS 5 -8.057 -11.745 -9.279 188 HD1 HIS 5 HD1 HIS 5 -11.260 -10.089 -9.816 189 HD2 HIS 5 HD2 HIS 5 -7.787 -9.323 -7.634 190 HE1 HIS 5 HE1 HIS 5 -11.845 -8.392 -8.072 191 H LEU 6 H LEU 6 -5.181 -9.625 -10.605 192 HA LEU 6 HA LEU 6 -3.984 -12.389 -10.597 193 HB2 LEU 6 1HB LEU 6 -2.760 -9.947 -11.958 194 HB3 LEU 6 2HB LEU 6 -2.233 -11.626 -12.059 195 HG LEU 6 HG LEU 6 -4.859 -10.536 -13.173 196 HD11 LEU 6 1HD1 LEU 6 -3.744 -10.681 -15.361 197 HD12 LEU 6 2HD1 LEU 6 -2.229 -11.040 -14.539 198 HD13 LEU 6 3HD1 LEU 6 -3.001 -9.462 -14.280 199 HD21 LEU 6 3HD2 LEU 6 -3.523 -13.097 -14.025 200 HD22 LEU 6 1HD2 LEU 6 -5.143 -12.525 -14.395 201 HD23 LEU 6 2HD2 LEU 6 -4.744 -13.077 -12.748 202 H CYS 7 H CYS 7 -2.156 -12.592 -9.262 203 HA CYS 7 HA CYS 7 -1.085 -10.279 -7.812 204 HB2 CYS 7 1HB CYS 7 -3.148 -10.875 -6.585 205 HB3 CYS 7 2HB CYS 7 -2.530 -12.509 -6.346 206 H GLY 8 H GLY 8 -1.234 -13.862 -7.867 207 HA2 GLY 8 1HA GLY 8 1.551 -13.982 -6.938 208 HA3 GLY 8 2HA GLY 8 0.447 -15.314 -7.223 209 H SER 9 H SER 9 1.347 -16.622 -8.696 210 HA SER 9 HA SER 9 3.458 -16.041 -10.406 211 HB2 SER 9 1HB SER 9 2.764 -18.175 -11.561 212 HB3 SER 9 2HB SER 9 2.914 -18.323 -9.818 213 HG SER 9 HG SER 9 0.905 -19.161 -10.954 214 H HIS 10 H HIS 10 -0.009 -15.840 -11.148 215 HA HIS 10 HA HIS 10 0.291 -15.458 -13.952 216 HB2 HIS 10 1HB HIS 10 -1.828 -14.432 -12.024 217 HB3 HIS 10 2HB HIS 10 -1.995 -14.464 -13.788 218 HD1 HIS 10 HD1 HIS 10 -2.914 -16.372 -10.918 219 HD2 HIS 10 HD2 HIS 10 -1.642 -17.272 -14.794 220 HE1 HIS 10 HE1 HIS 10 -3.611 -18.750 -11.381 221 H LEU 11 H LEU 11 0.892 -13.155 -11.349 222 HA LEU 11 HA LEU 11 0.607 -10.793 -12.934 223 HB2 LEU 11 1HB LEU 11 0.647 -10.940 -10.397 224 HB3 LEU 11 2HB LEU 11 2.407 -11.156 -10.540 225 HG LEU 11 HG LEU 11 2.371 -8.898 -11.836 226 HD11 LEU 11 1HD1 LEU 11 -0.311 -8.706 -10.391 227 HD12 LEU 11 2HD1 LEU 11 -0.115 -8.847 -12.181 228 HD13 LEU 11 3HD1 LEU 11 0.506 -7.413 -11.326 229 HD21 LEU 11 3HD2 LEU 11 3.380 -9.177 -9.634 230 HD22 LEU 11 1HD2 LEU 11 1.761 -8.940 -8.882 231 HD23 LEU 11 2HD2 LEU 11 2.505 -7.597 -9.764 232 H VAL 12 H VAL 12 3.111 -13.128 -12.317 233 HA VAL 12 HA VAL 12 5.300 -11.587 -13.324 234 HB VAL 12 HB VAL 12 4.978 -14.616 -13.261 235 HG11 VAL 12 1HG1 VAL 12 7.446 -12.859 -13.309 236 HG12 VAL 12 2HG1 VAL 12 7.440 -14.607 -13.158 237 HG13 VAL 12 3HG1 VAL 12 6.848 -13.841 -14.639 238 HG21 VAL 12 3HG2 VAL 12 6.156 -14.473 -11.003 239 HG22 VAL 12 1HG2 VAL 12 6.029 -12.733 -11.054 240 HG23 VAL 12 2HG2 VAL 12 4.549 -13.699 -10.965 241 H GLU 13 H GLU 13 2.959 -13.869 -14.790 242 HA GLU 13 HA GLU 13 4.077 -13.684 -17.449 243 HB2 GLU 13 1HB GLU 13 1.223 -14.321 -16.598 244 HB3 GLU 13 2HB GLU 13 1.966 -14.607 -18.209 245 HG2 GLU 13 1HG GLU 13 3.651 -16.082 -16.978 246 HG3 GLU 13 2HG GLU 13 2.552 -16.005 -15.582 247 H ALA 14 H ALA 14 1.616 -11.822 -15.683 248 HA ALA 14 HA ALA 14 0.595 -10.335 -17.866 249 HB1 ALA 14 3HB ALA 14 0.896 -9.482 -14.981 250 HB2 ALA 14 1HB ALA 14 -0.204 -8.817 -16.176 251 HB3 ALA 14 2HB ALA 14 -0.434 -10.480 -15.632 252 H LEU 15 H LEU 15 3.271 -9.682 -15.576 253 HA LEU 15 HA LEU 15 4.067 -7.196 -16.722 254 HB2 LEU 15 1HB LEU 15 5.541 -9.293 -15.094 255 HB3 LEU 15 2HB LEU 15 6.281 -7.793 -15.624 256 HG LEU 15 HG LEU 15 3.717 -7.692 -14.074 257 HD11 LEU 15 1HD1 LEU 15 6.498 -8.015 -12.895 258 HD12 LEU 15 2HD1 LEU 15 5.151 -9.151 -12.761 259 HD13 LEU 15 3HD1 LEU 15 5.052 -7.571 -11.973 260 HD21 LEU 15 3HD2 LEU 15 4.541 -5.506 -13.397 261 HD22 LEU 15 1HD2 LEU 15 4.785 -5.657 -15.186 262 HD23 LEU 15 2HD2 LEU 15 6.151 -5.861 -14.078 263 H TYR 16 H TYR 16 5.036 -10.581 -17.303 264 HA TYR 16 HA TYR 16 7.095 -10.071 -19.172 265 HB2 TYR 16 1HB TYR 16 6.510 -12.266 -18.106 266 HB3 TYR 16 2HB TYR 16 5.121 -12.359 -19.187 267 HD1 TYR 16 HD1 TYR 16 8.824 -12.414 -19.029 268 HD2 TYR 16 HD2 TYR 16 5.339 -13.004 -21.501 269 HE1 TYR 16 HE1 TYR 16 10.252 -13.534 -20.742 270 HE2 TYR 16 HE2 TYR 16 6.784 -14.139 -23.219 271 HH TYR 16 HH TYR 16 8.921 -14.775 -23.809 272 H LEU 17 H LEU 17 3.581 -10.512 -19.724 273 HA LEU 17 HA LEU 17 3.717 -10.239 -22.603 274 HB2 LEU 17 1HB LEU 17 1.542 -9.868 -20.570 275 HB3 LEU 17 2HB LEU 17 1.257 -9.744 -22.285 276 HG LEU 17 HG LEU 17 2.380 -12.243 -21.001 277 HD11 LEU 17 1HD1 LEU 17 -0.515 -11.567 -21.705 278 HD12 LEU 17 2HD1 LEU 17 0.133 -11.759 -20.069 279 HD13 LEU 17 3HD1 LEU 17 0.074 -13.164 -21.132 280 HD21 LEU 17 3HD2 LEU 17 1.054 -11.691 -23.701 281 HD22 LEU 17 1HD2 LEU 17 1.509 -13.315 -23.105 282 HD23 LEU 17 2HD2 LEU 17 2.789 -12.110 -23.407 283 H VAL 18 H VAL 18 3.177 -7.780 -20.033 284 HA VAL 18 HA VAL 18 2.472 -5.787 -22.052 285 HB VAL 18 HB VAL 18 2.919 -5.534 -19.049 286 HG11 VAL 18 1HG1 VAL 18 1.602 -3.403 -19.384 287 HG12 VAL 18 2HG1 VAL 18 3.261 -3.372 -20.011 288 HG13 VAL 18 3HG1 VAL 18 1.900 -3.588 -21.140 289 HG21 VAL 18 3HG2 VAL 18 0.464 -5.849 -20.813 290 HG22 VAL 18 1HG2 VAL 18 1.000 -6.947 -19.543 291 HG23 VAL 18 2HG2 VAL 18 0.389 -5.396 -19.094 292 H CYS 19 H CYS 19 5.188 -6.197 -19.678 293 HA CYS 19 HA CYS 19 6.537 -3.860 -20.757 294 HB2 CYS 19 1HB CYS 19 7.559 -5.977 -18.839 295 HB3 CYS 19 2HB CYS 19 8.201 -4.344 -19.076 296 H GLY 20 H GLY 20 6.353 -7.029 -21.857 297 HA2 GLY 20 1HA GLY 20 7.557 -8.100 -23.542 298 HA3 GLY 20 2HA GLY 20 8.384 -6.572 -23.832 299 H GLU 21 H GLU 21 8.182 -8.419 -20.848 300 HA GLU 21 HA GLU 21 9.653 -9.248 -19.370 301 HB2 GLU 21 1HB GLU 21 10.361 -10.537 -21.430 302 HB3 GLU 21 2HB GLU 21 11.720 -9.427 -21.542 303 HG2 GLU 21 1HG GLU 21 11.970 -10.138 -18.983 304 HG3 GLU 21 2HG GLU 21 11.160 -11.596 -19.566 305 H ARG 22 H ARG 22 11.033 -6.616 -21.328 306 HA ARG 22 HA ARG 22 13.268 -6.140 -19.575 307 HB2 ARG 22 1HB ARG 22 13.495 -3.973 -20.814 308 HB3 ARG 22 2HB ARG 22 13.472 -5.426 -21.818 309 HG2 ARG 22 1HG ARG 22 11.231 -4.954 -22.586 310 HG3 ARG 22 2HG ARG 22 11.021 -3.618 -21.435 311 HD2 ARG 22 1HD ARG 22 12.924 -2.425 -22.553 312 HD3 ARG 22 2HD ARG 22 13.062 -3.749 -23.724 313 HE ARG 22 HE ARG 22 10.685 -1.963 -23.430 314 HH11 ARG 22 1HH1 ARG 22 12.760 -3.917 -25.497 315 HH12 ARG 22 2HH1 ARG 22 11.892 -3.441 -26.946 316 HH21 ARG 22 1HH2 ARG 22 9.646 -1.405 -25.346 317 HH22 ARG 22 2HH2 ARG 22 10.226 -2.039 -26.847 318 H GLY 23 H GLY 23 11.767 -6.224 -17.525 319 HA2 GLY 23 1HA GLY 23 11.963 -3.511 -16.501 320 HA3 GLY 23 2HA GLY 23 10.266 -4.048 -16.647 321 H PHE 24 H PHE 24 10.434 -6.684 -15.839 322 HA PHE 24 HA PHE 24 10.998 -6.275 -12.933 323 HB2 PHE 24 1HB PHE 24 9.341 -8.008 -12.554 324 HB3 PHE 24 2HB PHE 24 8.654 -6.831 -13.663 325 HD1 PHE 24 HD1 PHE 24 8.656 -7.379 -16.165 326 HD2 PHE 24 HD2 PHE 24 9.547 -10.307 -13.108 327 HE1 PHE 24 HE1 PHE 24 8.208 -9.194 -17.781 328 HE2 PHE 24 HE2 PHE 24 9.118 -12.144 -14.759 329 HZ PHE 24 HZ PHE 24 8.438 -11.583 -17.072 330 H PHE 25 H PHE 25 11.689 -8.195 -11.706 331 HA PHE 25 HA PHE 25 13.231 -10.134 -13.366 332 HB2 PHE 25 1HB PHE 25 14.821 -8.366 -12.643 333 HB3 PHE 25 2HB PHE 25 14.331 -8.597 -10.958 334 HD1 PHE 25 HD1 PHE 25 15.625 -10.651 -13.856 335 HD2 PHE 25 HD2 PHE 25 15.596 -9.940 -9.599 336 HE1 PHE 25 HE1 PHE 25 17.374 -12.463 -13.546 337 HE2 PHE 25 HE2 PHE 25 17.325 -11.733 -9.258 338 HZ PHE 25 HZ PHE 25 18.214 -12.990 -11.213 339 H NVA 26 H ARX 26 11.946 -11.734 -13.003 340 HA NVA 26 HA ARX 26 10.567 -12.409 -10.568 341 HB2 NVA 26 1HB ARX 26 9.950 -14.548 -11.768 342 HB3 NVA 26 2HB ARX 26 9.541 -13.085 -12.642 343 HG2 NVA 26 1HG ARX 26 11.458 -13.330 -14.142 344 HG3 NVA 26 2HG ARX 26 12.172 -14.596 -13.224 345 HD2 NVA 26 1HD ARX 26 9.361 -15.033 -14.313 346 HD3 NVA 26 2HD ARX 26 10.717 -14.988 -15.448 347 H THR 27 H THR 27 13.687 -12.861 -11.287 348 HA THR 27 HA THR 27 15.543 -13.888 -10.448 349 HB THR 27 HB THR 27 15.663 -15.139 -8.410 350 HG1 THR 27 HG1 THR 27 12.844 -15.309 -8.712 351 HG21 THR 27 1HG2 THR 27 13.586 -12.912 -8.042 352 HG22 THR 27 2HG2 THR 27 15.299 -12.662 -8.277 353 HG23 THR 27 3HG2 THR 27 14.714 -13.490 -6.824 354 HA PRO 28 HA PRO 28 15.349 -17.176 -13.113 355 HB2 PRO 28 1HB PRO 28 17.430 -18.869 -12.565 356 HB3 PRO 28 2HB PRO 28 17.636 -17.197 -13.170 357 HG2 PRO 28 1HG PRO 28 17.746 -18.215 -10.390 358 HG3 PRO 28 2HG PRO 28 18.939 -17.234 -11.266 359 HD2 PRO 28 1HD PRO 28 17.122 -16.102 -9.585 360 HD3 PRO 28 2HD PRO 28 17.610 -15.282 -11.090 361 H HIX 29 H HIX 29 13.485 -18.106 -12.875 362 HA HIX 29 HA HIX 29 13.090 -20.483 -11.238 363 HB1 HIX 29 1HB HIX 29 10.791 -20.453 -12.507 364 HB2 HIX 29 2HB HIX 29 11.107 -19.260 -11.254 365 HD2 HIX 29 HD2 HIX 29 10.964 -16.702 -11.999 366 HD1 HIX 29 HD1 HIX 29 11.093 -19.539 -15.032 367 HE1 HIX 29 HE1 HIX 29 11.713 -17.165 -15.711 368 H THR 30 H THR 30 14.547 -21.872 -11.916 369 HA THR 30 HA THR 30 13.926 -23.578 -14.212 370 HB THR 30 HB THR 30 15.357 -21.952 -15.420 371 HG1 THR 30 HG1 THR 30 16.386 -24.489 -14.728 372 HG21 THR 30 1HG2 THR 30 16.581 -20.990 -13.508 373 HG22 THR 30 2HG2 THR 30 17.681 -21.595 -14.748 374 HG23 THR 30 3HG2 THR 30 17.419 -22.532 -13.256 Start of MODEL 6 1 H1 GLY 1 1H GLY 1 2.199 1.205 -0.989 2 H2 GLY 1 2H GLY 1 0.893 0.358 -0.409 3 H3 GLY 1 3H GLY 1 2.342 0.308 0.396 4 HA2 GLY 1 1HA GLY 1 3.406 -0.801 -1.460 5 HA3 GLY 1 2HA GLY 1 2.039 -1.732 -0.801 6 H ILE 2 H ILE 2 2.579 -2.524 -3.298 7 HA ILE 2 HA ILE 2 0.422 -1.210 -4.855 8 HB ILE 2 HB ILE 2 2.564 -0.270 -5.622 9 HG12 ILE 2 1HG1 ILE 2 1.345 -2.124 -7.690 10 HG13 ILE 2 2HG1 ILE 2 0.600 -0.631 -7.123 11 HG21 ILE 2 1HG2 ILE 2 4.090 -2.214 -5.108 12 HG22 ILE 2 2HG2 ILE 2 3.344 -3.106 -6.446 13 HG23 ILE 2 3HG2 ILE 2 4.264 -1.657 -6.773 14 HD11 ILE 2 3HD1 ILE 2 3.188 -0.891 -8.689 15 HD12 ILE 2 1HD1 ILE 2 1.676 -0.199 -9.248 16 HD13 ILE 2 2HD1 ILE 2 2.617 0.643 -7.993 17 H VAL 3 H VAL 3 2.408 -4.133 -4.321 18 HA VAL 3 HA VAL 3 1.029 -5.751 -6.220 19 HB VAL 3 HB VAL 3 2.374 -6.601 -3.590 20 HG11 VAL 3 1HG1 VAL 3 1.678 -8.226 -6.074 21 HG12 VAL 3 2HG1 VAL 3 2.656 -8.814 -4.714 22 HG13 VAL 3 3HG1 VAL 3 0.960 -8.386 -4.475 23 HG21 VAL 3 3HG2 VAL 3 4.363 -7.094 -5.011 24 HG22 VAL 3 1HG2 VAL 3 3.503 -6.418 -6.423 25 HG23 VAL 3 2HG2 VAL 3 3.928 -5.368 -5.051 26 H GLU 4 H GLU 4 0.386 -5.161 -2.746 27 HA GLU 4 HA GLU 4 -1.799 -6.950 -2.449 28 HB2 GLU 4 1HB GLU 4 -0.687 -5.907 -0.599 29 HB3 GLU 4 2HB GLU 4 -1.093 -4.281 -1.158 30 HG2 GLU 4 1HG GLU 4 -3.288 -6.265 -0.529 31 HG3 GLU 4 2HG GLU 4 -2.452 -5.437 0.807 32 H GLN 5 H GLN 5 -1.777 -3.496 -3.448 33 HA GLN 5 HA GLN 5 -4.578 -3.219 -3.788 34 HB2 GLN 5 1HB GLN 5 -2.814 -1.413 -3.748 35 HB3 GLN 5 2HB GLN 5 -2.321 -1.906 -5.367 36 HG2 GLN 5 1HG GLN 5 -4.521 -1.329 -6.239 37 HG3 GLN 5 2HG GLN 5 -5.046 -0.859 -4.627 38 HE21 GLN 5 2HE2 GLN 5 -5.471 1.259 -5.329 39 HE22 GLN 5 1HE2 GLN 5 -4.156 2.387 -5.630 40 H CYS 6 H CYS 6 -2.023 -4.379 -6.005 41 HA CYS 6 HA CYS 6 -3.675 -4.562 -8.351 42 HB2 CYS 6 1HB CYS 6 -1.010 -4.730 -7.800 43 HB3 CYS 6 2HB CYS 6 -1.369 -6.441 -7.985 44 H CYS 7 H CYS 7 -2.990 -6.773 -5.651 45 HA CYS 7 HA CYS 7 -4.255 -9.077 -6.917 46 HB2 CYS 7 1HB CYS 7 -3.416 -8.456 -4.068 47 HB3 CYS 7 2HB CYS 7 -4.226 -9.955 -4.551 48 H THR 8 H THR 8 -5.253 -6.815 -4.267 49 HA THR 8 HA THR 8 -7.742 -8.198 -3.856 50 HB THR 8 HB THR 8 -8.288 -6.206 -2.423 51 HG1 THR 8 HG1 THR 8 -6.099 -4.884 -2.311 52 HG21 THR 8 1HG2 THR 8 -6.868 -8.079 -1.527 53 HG22 THR 8 2HG2 THR 8 -6.475 -6.499 -0.822 54 HG23 THR 8 3HG2 THR 8 -5.418 -7.188 -2.066 55 H SER 9 H SER 9 -7.122 -6.840 -6.593 56 HA SER 9 HA SER 9 -9.870 -6.021 -7.179 57 HB2 SER 9 1HB SER 9 -9.507 -3.713 -7.623 58 HB3 SER 9 2HB SER 9 -8.833 -3.985 -6.010 59 HG SER 9 HG SER 9 -6.755 -4.020 -6.940 60 H ILE 10 H ILE 10 -9.634 -4.696 -9.454 61 HA ILE 10 HA ILE 10 -8.364 -6.532 -11.293 62 HB ILE 10 HB ILE 10 -9.542 -3.716 -11.725 63 HG12 ILE 10 1HG1 ILE 10 -11.201 -5.370 -10.925 64 HG13 ILE 10 2HG1 ILE 10 -11.530 -4.776 -12.551 65 HG21 ILE 10 1HG2 ILE 10 -9.673 -4.506 -14.161 66 HG22 ILE 10 2HG2 ILE 10 -8.087 -4.070 -13.520 67 HG23 ILE 10 3HG2 ILE 10 -8.523 -5.766 -13.706 68 HD11 ILE 10 3HD1 ILE 10 -10.216 -7.479 -11.976 69 HD12 ILE 10 1HD1 ILE 10 -11.945 -7.256 -12.326 70 HD13 ILE 10 2HD1 ILE 10 -10.748 -6.881 -13.565 71 H CYS 11 H CYS 11 -6.260 -6.508 -11.801 72 HA CYS 11 HA CYS 11 -4.458 -4.959 -10.359 73 HB2 CYS 11 1HB CYS 11 -4.337 -6.959 -12.454 74 HB3 CYS 11 2HB CYS 11 -3.177 -5.657 -12.823 75 H SER 12 H SER 12 -6.035 -4.030 -13.294 76 HA SER 12 HA SER 12 -6.095 -2.164 -14.515 77 HB2 SER 12 1HB SER 12 -4.640 -0.918 -12.163 78 HB3 SER 12 2HB SER 12 -5.408 -0.028 -13.496 79 HG SER 12 HG SER 12 -6.619 -1.688 -11.528 80 H LEU 13 H LEU 13 -5.127 -1.837 -16.366 81 HA LEU 13 HA LEU 13 -2.572 -2.730 -16.925 82 HB2 LEU 13 1HB LEU 13 -4.308 -2.389 -18.603 83 HB3 LEU 13 2HB LEU 13 -4.220 -0.646 -18.398 84 HG LEU 13 HG LEU 13 -1.930 -0.630 -19.263 85 HD11 LEU 13 1HD1 LEU 13 -2.339 -3.600 -19.781 86 HD12 LEU 13 2HD1 LEU 13 -1.139 -2.861 -18.692 87 HD13 LEU 13 3HD1 LEU 13 -1.008 -2.613 -20.435 88 HD21 LEU 13 3HD2 LEU 13 -3.934 -2.019 -21.065 89 HD22 LEU 13 1HD2 LEU 13 -2.471 -1.146 -21.617 90 HD23 LEU 13 2HD2 LEU 13 -3.756 -0.247 -20.790 91 H TYR 14 H TYR 14 -3.487 0.663 -16.160 92 HA TYR 14 HA TYR 14 -0.876 1.686 -16.747 93 HB2 TYR 14 1HB TYR 14 -1.763 3.590 -15.145 94 HB3 TYR 14 2HB TYR 14 -2.448 3.369 -16.749 95 HD1 TYR 14 HD2 TYR 14 -3.130 2.892 -13.123 96 HD2 TYR 14 HD1 TYR 14 -4.733 2.593 -17.109 97 HE1 TYR 14 HE2 TYR 14 -5.434 2.645 -12.191 98 HE2 TYR 14 HE1 TYR 14 -7.037 2.369 -16.157 99 HH TYR 14 HH TYR 14 -8.312 2.257 -14.261 100 H GLN 15 H GLN 15 -2.355 0.404 -13.739 101 HA GLN 15 HA GLN 15 -0.150 1.150 -12.023 102 HB2 GLN 15 1HB GLN 15 -2.334 -0.941 -11.851 103 HB3 GLN 15 2HB GLN 15 -1.101 -0.797 -10.622 104 HG2 GLN 15 1HG GLN 15 -1.831 1.443 -10.073 105 HG3 GLN 15 2HG GLN 15 -2.963 1.466 -11.448 106 HE21 GLN 15 2HE2 GLN 15 -2.453 -1.310 -9.287 107 HE22 GLN 15 1HE2 GLN 15 -4.051 -1.300 -8.620 108 H LEU 16 H LEU 16 -0.915 -1.607 -14.106 109 HA LEU 16 HA LEU 16 1.223 -3.318 -13.234 110 HB2 LEU 16 1HB LEU 16 -0.825 -3.975 -14.550 111 HB3 LEU 16 2HB LEU 16 -0.171 -3.131 -15.936 112 HG LEU 16 HG LEU 16 1.070 -5.611 -14.685 113 HD11 LEU 16 1HD1 LEU 16 -0.890 -5.170 -16.973 114 HD12 LEU 16 2HD1 LEU 16 -1.019 -6.282 -15.591 115 HD13 LEU 16 3HD1 LEU 16 0.132 -6.632 -16.898 116 HD21 LEU 16 3HD2 LEU 16 2.253 -5.764 -16.868 117 HD22 LEU 16 1HD2 LEU 16 2.744 -4.385 -15.888 118 HD23 LEU 16 2HD2 LEU 16 1.657 -4.130 -17.253 119 H GLU 17 H GLU 17 0.901 -0.918 -15.927 120 HA GLU 17 HA GLU 17 3.580 -1.312 -16.908 121 HB2 GLU 17 1HB GLU 17 1.626 1.004 -17.065 122 HB3 GLU 17 2HB GLU 17 3.231 1.027 -17.839 123 HG2 GLU 17 1HG GLU 17 2.621 -0.942 -19.177 124 HG3 GLU 17 2HG GLU 17 1.042 -1.035 -18.361 125 H ASN 18 H ASN 18 2.299 0.681 -14.256 126 HA ASN 18 HA ASN 18 4.671 2.218 -13.840 127 HB2 ASN 18 1HB ASN 18 2.344 2.503 -12.834 128 HB3 ASN 18 2HB ASN 18 2.783 1.241 -11.671 129 HD21 ASN 18 2HD2 ASN 18 3.382 2.038 -9.822 130 HD22 ASN 18 1HD2 ASN 18 4.295 3.529 -9.567 131 H TYR 19 H TYR 19 4.418 -1.181 -13.540 132 HA TYR 19 HA TYR 19 6.406 -1.406 -11.347 133 HB2 TYR 19 1HB TYR 19 5.165 -3.378 -13.282 134 HB3 TYR 19 2HB TYR 19 6.525 -3.800 -12.228 135 HD1 TYR 19 HD2 TYR 19 2.964 -2.652 -12.117 136 HD2 TYR 19 HD1 TYR 19 6.231 -4.457 -9.988 137 HE1 TYR 19 HE2 TYR 19 1.426 -3.305 -10.322 138 HE2 TYR 19 HE1 TYR 19 4.662 -5.127 -8.169 139 HH TYR 19 HH TYR 19 2.498 -5.170 -7.491 140 H CYS 20 H CYS 20 6.442 -0.624 -14.655 141 HA CYS 20 HA CYS 20 9.119 -1.904 -15.039 142 HB2 CYS 20 1HB CYS 20 6.749 -1.795 -16.668 143 HB3 CYS 20 2HB CYS 20 8.107 -1.104 -17.543 144 H ASN 21 H ASN 21 10.280 -0.644 -16.961 145 HA ASN 21 HA ASN 21 10.767 2.085 -15.839 146 HB2 ASN 21 1HB ASN 21 12.964 1.907 -16.936 147 HB3 ASN 21 2HB ASN 21 12.691 0.512 -15.880 148 HD21 ASN 21 2HD2 ASN 21 11.921 -1.504 -16.962 149 HD22 ASN 21 1HD2 ASN 21 12.506 -1.849 -18.573 150 H1 PHE 1 1H PHE 1 -3.524 -8.100 -23.564 151 H2 PHE 1 2H PHE 1 -3.523 -6.467 -23.337 152 H3 PHE 1 3H PHE 1 -2.154 -7.330 -23.087 153 HA PHE 1 HA PHE 1 -3.141 -8.493 -21.228 154 HB2 PHE 1 1HB PHE 1 -1.901 -6.324 -20.989 155 HB3 PHE 1 2HB PHE 1 -3.468 -5.505 -20.947 156 HD1 PHE 1 HD2 PHE 1 -2.290 -8.720 -19.401 157 HD2 PHE 1 HD1 PHE 1 -3.880 -4.767 -18.790 158 HE1 PHE 1 HE2 PHE 1 -2.577 -9.219 -17.010 159 HE2 PHE 1 HE1 PHE 1 -4.126 -5.224 -16.376 160 HZ PHE 1 HZ PHE 1 -3.504 -7.480 -15.461 161 H VAL 2 H VAL 2 -5.053 -9.084 -20.063 162 HA VAL 2 HA VAL 2 -7.574 -8.041 -21.294 163 HB VAL 2 HB VAL 2 -8.643 -10.056 -20.313 164 HG11 VAL 2 1HG1 VAL 2 -7.658 -11.656 -21.904 165 HG12 VAL 2 2HG1 VAL 2 -7.693 -10.055 -22.636 166 HG13 VAL 2 3HG1 VAL 2 -6.163 -10.721 -21.993 167 HG21 VAL 2 3HG2 VAL 2 -7.307 -11.854 -19.345 168 HG22 VAL 2 1HG2 VAL 2 -5.807 -10.897 -19.516 169 HG23 VAL 2 2HG2 VAL 2 -7.094 -10.358 -18.394 170 H ASN 3 H ASN 3 -5.742 -7.366 -18.640 171 HA ASN 3 HA ASN 3 -6.166 -6.294 -16.721 172 HB2 ASN 3 1HB ASN 3 -7.091 -4.808 -18.535 173 HB3 ASN 3 2HB ASN 3 -8.695 -5.311 -18.000 174 HD21 ASN 3 2HD2 ASN 3 -9.352 -3.376 -17.173 175 HD22 ASN 3 1HD2 ASN 3 -8.566 -2.557 -15.841 176 H GLN 4 H GLN 4 -6.512 -8.379 -15.607 177 HA GLN 4 HA GLN 4 -9.215 -8.415 -14.304 178 HB2 GLN 4 1HB GLN 4 -9.120 -10.837 -14.279 179 HB3 GLN 4 2HB GLN 4 -9.034 -10.228 -15.917 180 HG2 GLN 4 1HG GLN 4 -6.575 -10.607 -15.920 181 HG3 GLN 4 2HG GLN 4 -6.687 -11.259 -14.281 182 HE21 GLN 4 2HE2 GLN 4 -5.589 -12.964 -15.836 183 HE22 GLN 4 1HE2 GLN 4 -6.707 -14.210 -16.368 184 H HIS 5 H HIS 5 -8.881 -10.098 -12.290 185 HA HIS 5 HA HIS 5 -7.004 -8.825 -10.436 186 HB2 HIS 5 1HB HIS 5 -8.717 -11.349 -10.328 187 HB3 HIS 5 2HB HIS 5 -7.622 -10.905 -9.016 188 HD1 HIS 5 HD1 HIS 5 -10.623 -9.304 -10.849 189 HD2 HIS 5 HD2 HIS 5 -8.784 -9.431 -7.125 190 HE1 HIS 5 HE1 HIS 5 -12.036 -7.906 -9.276 191 H LEU 6 H LEU 6 -4.949 -9.492 -9.910 192 HA LEU 6 HA LEU 6 -4.033 -12.152 -10.973 193 HB2 LEU 6 1HB LEU 6 -2.561 -9.528 -11.266 194 HB3 LEU 6 2HB LEU 6 -1.932 -11.109 -11.717 195 HG LEU 6 HG LEU 6 -4.276 -9.733 -13.069 196 HD11 LEU 6 1HD1 LEU 6 -2.575 -9.289 -14.840 197 HD12 LEU 6 2HD1 LEU 6 -1.344 -9.874 -13.726 198 HD13 LEU 6 3HD1 LEU 6 -2.276 -8.442 -13.315 199 HD21 LEU 6 3HD2 LEU 6 -4.276 -12.215 -13.351 200 HD22 LEU 6 1HD2 LEU 6 -2.605 -12.086 -13.967 201 HD23 LEU 6 2HD2 LEU 6 -3.954 -11.331 -14.861 202 H CYS 7 H CYS 7 -2.935 -13.194 -9.423 203 HA CYS 7 HA CYS 7 -1.240 -11.720 -7.546 204 HB2 CYS 7 1HB CYS 7 -3.746 -11.796 -6.702 205 HB3 CYS 7 2HB CYS 7 -3.317 -13.466 -6.247 206 H GLY 8 H GLY 8 -2.894 -14.919 -7.729 207 HA2 GLY 8 1HA GLY 8 -0.572 -16.360 -6.864 208 HA3 GLY 8 2HA GLY 8 -2.070 -17.053 -7.544 209 H SER 9 H SER 9 1.143 -15.850 -8.192 210 HA SER 9 HA SER 9 2.651 -16.204 -9.842 211 HB2 SER 9 1HB SER 9 1.793 -18.561 -9.332 212 HB3 SER 9 2HB SER 9 0.940 -18.465 -10.887 213 HG SER 9 HG SER 9 2.876 -18.285 -11.928 214 H HIS 10 H HIS 10 -0.320 -15.034 -10.788 215 HA HIS 10 HA HIS 10 0.221 -15.199 -13.706 216 HB2 HIS 10 1HB HIS 10 -2.062 -13.921 -12.141 217 HB3 HIS 10 2HB HIS 10 -2.002 -14.177 -13.900 218 HD1 HIS 10 HD1 HIS 10 -4.068 -15.512 -11.681 219 HD2 HIS 10 HD2 HIS 10 -0.922 -17.341 -13.730 220 HE1 HIS 10 HE1 HIS 10 -4.518 -17.981 -11.670 221 H LEU 11 H LEU 11 0.796 -12.935 -11.135 222 HA LEU 11 HA LEU 11 0.568 -10.524 -12.730 223 HB2 LEU 11 1HB LEU 11 0.692 -10.549 -10.236 224 HB3 LEU 11 2HB LEU 11 2.364 -11.040 -10.343 225 HG LEU 11 HG LEU 11 2.942 -8.894 -11.413 226 HD11 LEU 11 1HD1 LEU 11 0.924 -8.361 -12.612 227 HD12 LEU 11 2HD1 LEU 11 1.227 -7.052 -11.467 228 HD13 LEU 11 3HD1 LEU 11 -0.022 -8.256 -11.105 229 HD21 LEU 11 3HD2 LEU 11 1.309 -8.553 -8.859 230 HD22 LEU 11 1HD2 LEU 11 2.552 -7.422 -9.468 231 HD23 LEU 11 2HD2 LEU 11 3.011 -9.074 -8.955 232 H VAL 12 H VAL 12 3.079 -12.936 -12.130 233 HA VAL 12 HA VAL 12 5.223 -11.505 -13.309 234 HB VAL 12 HB VAL 12 4.825 -14.520 -13.216 235 HG11 VAL 12 1HG1 VAL 12 7.339 -14.567 -13.227 236 HG12 VAL 12 2HG1 VAL 12 6.631 -13.938 -14.744 237 HG13 VAL 12 3HG1 VAL 12 7.323 -12.806 -13.557 238 HG21 VAL 12 3HG2 VAL 12 6.076 -12.583 -11.201 239 HG22 VAL 12 1HG2 VAL 12 4.636 -13.614 -10.972 240 HG23 VAL 12 2HG2 VAL 12 6.214 -14.366 -11.125 241 H GLU 13 H GLU 13 2.859 -13.795 -14.756 242 HA GLU 13 HA GLU 13 4.004 -13.653 -17.385 243 HB2 GLU 13 1HB GLU 13 1.224 -14.373 -16.373 244 HB3 GLU 13 2HB GLU 13 1.663 -14.341 -18.098 245 HG2 GLU 13 1HG GLU 13 3.598 -15.917 -17.418 246 HG3 GLU 13 2HG GLU 13 2.665 -16.190 -15.939 247 H ALA 14 H ALA 14 1.418 -11.769 -15.742 248 HA ALA 14 HA ALA 14 0.621 -10.253 -17.987 249 HB1 ALA 14 3HB ALA 14 -0.459 -10.314 -15.728 250 HB2 ALA 14 1HB ALA 14 0.856 -9.236 -15.152 251 HB3 ALA 14 2HB ALA 14 -0.238 -8.705 -16.452 252 H LEU 15 H LEU 15 3.245 -9.623 -15.581 253 HA LEU 15 HA LEU 15 4.098 -7.168 -16.786 254 HB2 LEU 15 1HB LEU 15 5.558 -9.179 -15.074 255 HB3 LEU 15 2HB LEU 15 6.235 -7.638 -15.536 256 HG LEU 15 HG LEU 15 3.620 -7.814 -14.031 257 HD11 LEU 15 1HD1 LEU 15 6.427 -7.614 -12.853 258 HD12 LEU 15 2HD1 LEU 15 5.327 -9.006 -12.720 259 HD13 LEU 15 3HD1 LEU 15 4.897 -7.466 -11.952 260 HD21 LEU 15 3HD2 LEU 15 4.089 -5.518 -13.479 261 HD22 LEU 15 1HD2 LEU 15 4.366 -5.691 -15.224 262 HD23 LEU 15 2HD2 LEU 15 5.735 -5.627 -14.151 263 H TYR 16 H TYR 16 5.109 -10.544 -17.302 264 HA TYR 16 HA TYR 16 7.305 -10.054 -19.018 265 HB2 TYR 16 1HB TYR 16 6.523 -12.211 -17.893 266 HB3 TYR 16 2HB TYR 16 5.312 -12.337 -19.187 267 HD1 TYR 16 HD1 TYR 16 6.229 -12.433 -21.668 268 HD2 TYR 16 HD2 TYR 16 8.660 -13.156 -18.193 269 HE1 TYR 16 HE1 TYR 16 7.866 -13.649 -23.058 270 HE2 TYR 16 HE2 TYR 16 10.311 -14.368 -19.596 271 HH TYR 16 HH TYR 16 9.849 -14.783 -23.105 272 H LEU 17 H LEU 17 3.801 -10.364 -19.695 273 HA LEU 17 HA LEU 17 4.162 -10.201 -22.569 274 HB2 LEU 17 1HB LEU 17 1.791 -10.075 -20.694 275 HB3 LEU 17 2HB LEU 17 1.603 -9.910 -22.438 276 HG LEU 17 HG LEU 17 2.929 -12.355 -21.251 277 HD11 LEU 17 1HD1 LEU 17 0.766 -13.480 -21.426 278 HD12 LEU 17 2HD1 LEU 17 -0.035 -11.960 -21.856 279 HD13 LEU 17 3HD1 LEU 17 0.692 -12.179 -20.234 280 HD21 LEU 17 3HD2 LEU 17 2.171 -13.343 -23.423 281 HD22 LEU 17 1HD2 LEU 17 3.253 -11.947 -23.697 282 HD23 LEU 17 2HD2 LEU 17 1.495 -11.751 -23.913 283 H VAL 18 H VAL 18 3.242 -7.854 -20.032 284 HA VAL 18 HA VAL 18 2.477 -5.907 -22.098 285 HB VAL 18 HB VAL 18 2.723 -5.614 -19.063 286 HG11 VAL 18 1HG1 VAL 18 1.594 -3.708 -21.166 287 HG12 VAL 18 2HG1 VAL 18 1.283 -3.557 -19.408 288 HG13 VAL 18 3HG1 VAL 18 2.935 -3.416 -20.058 289 HG21 VAL 18 3HG2 VAL 18 0.287 -5.964 -20.873 290 HG22 VAL 18 1HG2 VAL 18 0.941 -7.199 -19.768 291 HG23 VAL 18 2HG2 VAL 18 0.231 -5.722 -19.112 292 H CYS 19 H CYS 19 5.228 -6.239 -19.779 293 HA CYS 19 HA CYS 19 6.452 -3.742 -20.715 294 HB2 CYS 19 1HB CYS 19 7.732 -6.157 -19.338 295 HB3 CYS 19 2HB CYS 19 8.520 -4.600 -19.624 296 H GLY 20 H GLY 20 6.415 -7.080 -21.794 297 HA2 GLY 20 1HA GLY 20 7.036 -7.879 -23.885 298 HA3 GLY 20 2HA GLY 20 7.807 -6.317 -24.242 299 H GLU 21 H GLU 21 8.352 -9.575 -23.455 300 HA GLU 21 HA GLU 21 10.239 -10.809 -22.994 301 HB2 GLU 21 1HB GLU 21 11.522 -8.398 -24.325 302 HB3 GLU 21 2HB GLU 21 12.391 -9.883 -23.939 303 HG2 GLU 21 1HG GLU 21 11.686 -10.796 -25.851 304 HG3 GLU 21 2HG GLU 21 10.017 -10.680 -25.287 305 H ARG 22 H ARG 22 9.302 -9.010 -20.891 306 HA ARG 22 HA ARG 22 9.740 -8.749 -18.679 307 HB2 ARG 22 1HB ARG 22 12.609 -9.608 -19.134 308 HB3 ARG 22 2HB ARG 22 11.771 -9.403 -17.601 309 HG2 ARG 22 1HG ARG 22 10.274 -11.234 -18.025 310 HG3 ARG 22 2HG ARG 22 10.914 -11.447 -19.673 311 HD2 ARG 22 1HD ARG 22 12.650 -11.696 -17.177 312 HD3 ARG 22 2HD ARG 22 11.792 -13.061 -17.926 313 HE ARG 22 HE ARG 22 13.741 -11.370 -19.437 314 HH11 ARG 22 1HH1 ARG 22 12.560 -14.612 -18.591 315 HH12 ARG 22 2HH1 ARG 22 13.660 -15.369 -19.696 316 HH21 ARG 22 1HH2 ARG 22 15.112 -12.426 -20.760 317 HH22 ARG 22 2HH2 ARG 22 15.062 -14.183 -20.929 318 H GLY 23 H GLY 23 11.696 -7.541 -17.229 319 HA2 GLY 23 1HA GLY 23 13.127 -5.395 -17.938 320 HA3 GLY 23 2HA GLY 23 11.525 -4.839 -18.455 321 H PHE 24 H PHE 24 10.219 -6.372 -16.331 322 HA PHE 24 HA PHE 24 10.080 -4.325 -14.349 323 HB2 PHE 24 1HB PHE 24 8.464 -5.908 -13.329 324 HB3 PHE 24 2HB PHE 24 8.150 -5.590 -15.035 325 HD1 PHE 24 HD2 PHE 24 8.498 -7.333 -16.736 326 HD2 PHE 24 HD1 PHE 24 9.264 -8.110 -12.574 327 HE1 PHE 24 HE2 PHE 24 8.523 -9.765 -17.193 328 HE2 PHE 24 HE1 PHE 24 9.292 -10.568 -13.064 329 HZ PHE 24 HZ PHE 24 8.905 -11.392 -15.364 330 H PHE 25 H PHE 25 12.062 -7.108 -14.525 331 HA PHE 25 HA PHE 25 13.276 -8.333 -13.042 332 HB2 PHE 25 1HB PHE 25 14.483 -6.163 -13.029 333 HB3 PHE 25 2HB PHE 25 13.590 -5.713 -11.578 334 HD1 PHE 25 HD2 PHE 25 16.163 -8.055 -12.966 335 HD2 PHE 25 HD1 PHE 25 14.157 -6.641 -9.405 336 HE1 PHE 25 HE2 PHE 25 17.862 -9.219 -11.535 337 HE2 PHE 25 HE1 PHE 25 15.847 -7.784 -7.998 338 HZ PHE 25 HZ PHE 25 17.712 -9.073 -9.056 339 H NVA 26 H ARX 26 11.931 -9.878 -12.093 340 HA NVA 26 HA ARX 26 10.492 -9.236 -9.627 341 HB2 NVA 26 1HB ARX 26 9.783 -11.489 -9.429 342 HB3 NVA 26 2HB ARX 26 9.579 -11.006 -11.111 343 HG2 NVA 26 1HG ARX 26 11.648 -12.243 -11.728 344 HG3 NVA 26 2HG ARX 26 11.945 -12.686 -10.073 345 HD2 NVA 26 1HD ARX 26 9.204 -13.440 -10.987 346 HD3 NVA 26 2HD ARX 26 10.456 -14.151 -11.926 347 H THR 27 H THR 27 10.811 -9.865 -7.589 348 HA THR 27 HA THR 27 13.512 -10.004 -6.537 349 HB THR 27 HB THR 27 12.215 -10.531 -4.361 350 HG1 THR 27 HG1 THR 27 10.383 -11.493 -5.371 351 HG21 THR 27 1HG2 THR 27 11.333 -8.083 -5.950 352 HG22 THR 27 2HG2 THR 27 12.785 -8.218 -4.955 353 HG23 THR 27 3HG2 THR 27 11.189 -8.305 -4.183 354 HA PRO 28 HA PRO 28 14.062 -14.303 -6.931 355 HB2 PRO 28 1HB PRO 28 15.021 -15.241 -4.511 356 HB3 PRO 28 2HB PRO 28 15.990 -14.268 -5.668 357 HG2 PRO 28 1HG PRO 28 14.440 -13.336 -3.270 358 HG3 PRO 28 2HG PRO 28 16.160 -13.023 -3.691 359 HD2 PRO 28 1HD PRO 28 14.268 -11.199 -4.288 360 HD3 PRO 28 2HD PRO 28 15.570 -11.572 -5.481 361 H HIX 29 H HIX 29 12.829 -16.017 -6.944 362 HA HIX 29 HA HIX 29 10.830 -16.494 -4.810 363 HB1 HIX 29 1HB HIX 29 9.458 -17.529 -6.897 364 HB2 HIX 29 2HB HIX 29 9.233 -15.909 -6.313 365 HD2 HIX 29 HD2 HIX 29 9.528 -14.009 -8.208 366 HD1 HIX 29 HD1 HIX 29 11.166 -17.727 -9.140 367 HE1 HIX 29 HE1 HIX 29 12.226 -15.604 -10.174 368 H THR 30 H THR 30 11.812 -17.914 -3.723 369 HA THR 30 HA THR 30 12.285 -20.636 -4.761 370 HB THR 30 HB THR 30 14.435 -19.065 -3.197 371 HG1 THR 30 HG1 THR 30 13.894 -19.166 -5.843 372 HG21 THR 30 1HG2 THR 30 14.365 -21.504 -2.789 373 HG22 THR 30 2HG2 THR 30 15.832 -21.032 -3.669 374 HG23 THR 30 3HG2 THR 30 14.502 -21.817 -4.549 Start of MODEL 7 1 H1 GLY 1 1H GLY 1 -0.273 -2.806 -0.402 2 H2 GLY 1 2H GLY 1 0.359 -1.671 0.604 3 H3 GLY 1 3H GLY 1 -0.800 -1.262 -0.508 4 HA2 GLY 1 1HA GLY 1 1.301 -0.488 -1.325 5 HA3 GLY 1 2HA GLY 1 1.963 -2.124 -1.133 6 H ILE 2 H ILE 2 2.210 -1.028 -3.682 7 HA ILE 2 HA ILE 2 -0.141 -1.386 -5.258 8 HB ILE 2 HB ILE 2 1.832 0.035 -5.905 9 HG12 ILE 2 1HG1 ILE 2 0.962 -1.980 -7.994 10 HG13 ILE 2 2HG1 ILE 2 0.024 -0.601 -7.470 11 HG21 ILE 2 1HG2 ILE 2 3.166 -2.582 -6.785 12 HG22 ILE 2 2HG2 ILE 2 3.814 -0.939 -6.954 13 HG23 ILE 2 3HG2 ILE 2 3.647 -1.634 -5.352 14 HD11 ILE 2 3HD1 ILE 2 2.638 -0.607 -9.036 15 HD12 ILE 2 1HD1 ILE 2 1.054 0.029 -9.517 16 HD13 ILE 2 2HD1 ILE 2 1.976 0.865 -8.266 17 H VAL 3 H VAL 3 2.395 -3.742 -4.431 18 HA VAL 3 HA VAL 3 1.546 -5.711 -6.321 19 HB VAL 3 HB VAL 3 2.857 -6.156 -3.597 20 HG11 VAL 3 1HG1 VAL 3 3.767 -8.201 -4.606 21 HG12 VAL 3 2HG1 VAL 3 1.974 -8.248 -4.610 22 HG13 VAL 3 3HG1 VAL 3 2.872 -7.900 -6.114 23 HG21 VAL 3 3HG2 VAL 3 4.149 -5.708 -6.345 24 HG22 VAL 3 1HG2 VAL 3 4.201 -4.580 -4.974 25 HG23 VAL 3 2HG2 VAL 3 5.025 -6.133 -4.855 26 H GLU 4 H GLU 4 0.668 -5.057 -2.931 27 HA GLU 4 HA GLU 4 -1.106 -7.237 -2.577 28 HB2 GLU 4 1HB GLU 4 -0.065 -5.735 -0.820 29 HB3 GLU 4 2HB GLU 4 -1.205 -4.476 -1.328 30 HG2 GLU 4 1HG GLU 4 -3.084 -5.865 -0.645 31 HG3 GLU 4 2HG GLU 4 -1.985 -7.196 -0.247 32 H GLN 5 H GLN 5 -1.499 -4.032 -3.968 33 HA GLN 5 HA GLN 5 -4.378 -4.162 -4.186 34 HB2 GLN 5 1HB GLN 5 -2.745 -2.101 -4.192 35 HB3 GLN 5 2HB GLN 5 -2.593 -2.442 -5.908 36 HG2 GLN 5 1HG GLN 5 -4.332 -0.905 -5.936 37 HG3 GLN 5 2HG GLN 5 -5.243 -2.439 -5.836 38 HE21 GLN 5 2HE2 GLN 5 -5.425 0.545 -4.779 39 HE22 GLN 5 1HE2 GLN 5 -6.011 0.305 -3.158 40 H CYS 6 H CYS 6 -1.605 -5.095 -6.250 41 HA CYS 6 HA CYS 6 -3.246 -5.609 -8.558 42 HB2 CYS 6 1HB CYS 6 -0.463 -6.019 -7.807 43 HB3 CYS 6 2HB CYS 6 -1.103 -7.451 -8.611 44 H CYS 7 H CYS 7 -2.337 -7.473 -5.652 45 HA CYS 7 HA CYS 7 -3.551 -9.957 -6.507 46 HB2 CYS 7 1HB CYS 7 -2.825 -8.829 -3.786 47 HB3 CYS 7 2HB CYS 7 -3.500 -10.444 -4.017 48 H THR 8 H THR 8 -4.628 -8.007 -3.744 49 HA THR 8 HA THR 8 -7.199 -9.237 -3.812 50 HB THR 8 HB THR 8 -6.775 -6.800 -2.136 51 HG1 THR 8 HG1 THR 8 -4.760 -7.464 -1.859 52 HG21 THR 8 1HG2 THR 8 -7.625 -8.283 -0.360 53 HG22 THR 8 2HG2 THR 8 -7.510 -9.690 -1.455 54 HG23 THR 8 3HG2 THR 8 -8.690 -8.393 -1.780 55 H SER 9 H SER 9 -6.461 -7.325 -6.124 56 HA SER 9 HA SER 9 -9.085 -6.141 -6.425 57 HB2 SER 9 1HB SER 9 -6.769 -4.311 -5.740 58 HB3 SER 9 2HB SER 9 -8.138 -3.729 -6.673 59 HG SER 9 HG SER 9 -8.634 -5.098 -4.251 60 H ILE 10 H ILE 10 -8.750 -4.334 -8.337 61 HA ILE 10 HA ILE 10 -7.571 -5.907 -10.543 62 HB ILE 10 HB ILE 10 -9.277 -3.377 -10.468 63 HG12 ILE 10 1HG1 ILE 10 -10.493 -5.469 -9.868 64 HG13 ILE 10 2HG1 ILE 10 -11.097 -4.746 -11.356 65 HG21 ILE 10 1HG2 ILE 10 -7.985 -3.096 -12.432 66 HG22 ILE 10 2HG2 ILE 10 -8.049 -4.834 -12.805 67 HG23 ILE 10 3HG2 ILE 10 -9.504 -3.819 -12.999 68 HD11 ILE 10 3HD1 ILE 10 -9.931 -6.438 -12.715 69 HD12 ILE 10 1HD1 ILE 10 -9.231 -7.142 -11.229 70 HD13 ILE 10 2HD1 ILE 10 -10.974 -7.199 -11.493 71 H CYS 11 H CYS 11 -5.540 -5.613 -11.100 72 HA CYS 11 HA CYS 11 -3.753 -3.688 -10.186 73 HB2 CYS 11 1HB CYS 11 -3.826 -5.100 -12.893 74 HB3 CYS 11 2HB CYS 11 -2.445 -4.170 -12.310 75 H SER 12 H SER 12 -5.633 -3.533 -13.226 76 HA SER 12 HA SER 12 -6.148 -1.842 -14.645 77 HB2 SER 12 1HB SER 12 -4.878 0.176 -12.800 78 HB3 SER 12 2HB SER 12 -6.108 0.438 -14.040 79 HG SER 12 HG SER 12 -6.387 -1.010 -11.615 80 H LEU 13 H LEU 13 -5.218 -1.313 -16.507 81 HA LEU 13 HA LEU 13 -2.674 -2.318 -16.958 82 HB2 LEU 13 1HB LEU 13 -4.425 -2.069 -18.654 83 HB3 LEU 13 2HB LEU 13 -4.175 -0.341 -18.651 84 HG LEU 13 HG LEU 13 -1.871 -0.665 -19.515 85 HD11 LEU 13 1HD1 LEU 13 -1.500 -3.000 -18.671 86 HD12 LEU 13 2HD1 LEU 13 -1.215 -2.861 -20.431 87 HD13 LEU 13 3HD1 LEU 13 -2.732 -3.589 -19.817 88 HD21 LEU 13 3HD2 LEU 13 -3.735 -0.214 -21.036 89 HD22 LEU 13 1HD2 LEU 13 -4.041 -1.972 -21.182 90 HD23 LEU 13 2HD2 LEU 13 -2.520 -1.249 -21.789 91 H TYR 14 H TYR 14 -3.514 1.167 -16.492 92 HA TYR 14 HA TYR 14 -0.903 2.048 -17.288 93 HB2 TYR 14 1HB TYR 14 -1.779 4.082 -15.739 94 HB3 TYR 14 2HB TYR 14 -2.393 3.775 -17.374 95 HD1 TYR 14 HD2 TYR 14 -3.197 3.559 -13.773 96 HD2 TYR 14 HD1 TYR 14 -4.664 2.919 -17.765 97 HE1 TYR 14 HE2 TYR 14 -5.497 3.317 -12.892 98 HE2 TYR 14 HE1 TYR 14 -6.982 2.687 -16.851 99 HH TYR 14 HH TYR 14 -8.328 2.759 -14.967 100 H GLN 15 H GLN 15 -2.252 1.016 -14.122 101 HA GLN 15 HA GLN 15 0.159 1.807 -12.686 102 HB2 GLN 15 1HB GLN 15 -2.068 -0.090 -11.969 103 HB3 GLN 15 2HB GLN 15 -0.807 0.431 -10.857 104 HG2 GLN 15 1HG GLN 15 -1.565 2.763 -11.235 105 HG3 GLN 15 2HG GLN 15 -2.937 2.117 -12.163 106 HE21 GLN 15 2HE2 GLN 15 -4.510 0.823 -11.051 107 HE22 GLN 15 1HE2 GLN 15 -4.726 1.040 -9.325 108 H LEU 16 H LEU 16 -0.940 -1.015 -14.530 109 HA LEU 16 HA LEU 16 1.121 -2.824 -13.590 110 HB2 LEU 16 1HB LEU 16 -1.085 -2.998 -15.191 111 HB3 LEU 16 2HB LEU 16 0.168 -2.996 -16.430 112 HG LEU 16 HG LEU 16 -0.082 -4.956 -14.130 113 HD11 LEU 16 1HD1 LEU 16 -0.732 -5.120 -17.096 114 HD12 LEU 16 2HD1 LEU 16 -1.871 -5.201 -15.718 115 HD13 LEU 16 3HD1 LEU 16 -0.708 -6.518 -16.003 116 HD21 LEU 16 3HD2 LEU 16 1.805 -4.930 -16.496 117 HD22 LEU 16 1HD2 LEU 16 1.597 -6.271 -15.353 118 HD23 LEU 16 2HD2 LEU 16 2.246 -4.708 -14.797 119 H GLU 17 H GLU 17 0.803 -0.560 -16.372 120 HA GLU 17 HA GLU 17 3.406 -1.043 -17.488 121 HB2 GLU 17 1HB GLU 17 1.481 1.295 -17.609 122 HB3 GLU 17 2HB GLU 17 3.002 1.284 -18.504 123 HG2 GLU 17 1HG GLU 17 2.306 -0.720 -19.757 124 HG3 GLU 17 2HG GLU 17 0.853 -0.881 -18.776 125 H ASN 18 H ASN 18 2.246 1.042 -14.859 126 HA ASN 18 HA ASN 18 4.627 2.520 -14.505 127 HB2 ASN 18 1HB ASN 18 2.265 2.568 -13.336 128 HB3 ASN 18 2HB ASN 18 3.076 1.619 -12.080 129 HD21 ASN 18 2HD2 ASN 18 3.197 4.582 -13.992 130 HD22 ASN 18 1HD2 ASN 18 4.022 5.549 -12.765 131 H TYR 19 H TYR 19 4.234 -0.915 -13.913 132 HA TYR 19 HA TYR 19 6.403 -1.070 -11.937 133 HB2 TYR 19 1HB TYR 19 5.027 -3.124 -13.692 134 HB3 TYR 19 2HB TYR 19 6.422 -3.502 -12.702 135 HD1 TYR 19 HD1 TYR 19 2.857 -2.501 -12.530 136 HD2 TYR 19 HD2 TYR 19 6.267 -3.935 -10.367 137 HE1 TYR 19 HE1 TYR 19 1.377 -3.116 -10.612 138 HE2 TYR 19 HE2 TYR 19 4.799 -4.542 -8.459 139 HH TYR 19 HH TYR 19 1.268 -4.066 -8.542 140 H CYS 20 H CYS 20 6.104 -0.868 -15.424 141 HA CYS 20 HA CYS 20 8.551 -2.376 -15.970 142 HB2 CYS 20 1HB CYS 20 7.035 -0.455 -17.776 143 HB3 CYS 20 2HB CYS 20 8.154 -1.707 -18.283 144 H ASN 21 H ASN 21 10.476 -1.446 -17.086 145 HA ASN 21 HA ASN 21 10.967 1.406 -16.436 146 HB2 ASN 21 1HB ASN 21 12.826 -0.932 -15.831 147 HB3 ASN 21 2HB ASN 21 13.214 0.771 -15.665 148 HD21 ASN 21 2HD2 ASN 21 11.408 -1.901 -14.378 149 HD22 ASN 21 1HD2 ASN 21 11.060 -1.171 -12.826 150 H1 PHE 1 1H PHE 1 -3.813 -8.584 -23.258 151 H2 PHE 1 2H PHE 1 -4.203 -6.988 -23.033 152 H3 PHE 1 3H PHE 1 -2.624 -7.454 -23.113 153 HA PHE 1 HA PHE 1 -2.759 -8.692 -21.093 154 HB2 PHE 1 1HB PHE 1 -2.102 -6.405 -20.832 155 HB3 PHE 1 2HB PHE 1 -3.786 -5.862 -20.885 156 HD1 PHE 1 HD1 PHE 1 -2.115 -8.719 -19.110 157 HD2 PHE 1 HD2 PHE 1 -4.358 -5.070 -18.715 158 HE1 PHE 1 HE1 PHE 1 -2.344 -9.109 -16.723 159 HE2 PHE 1 HE2 PHE 1 -4.592 -5.484 -16.306 160 HZ PHE 1 HZ PHE 1 -3.551 -7.529 -15.301 161 H VAL 2 H VAL 2 -5.590 -6.586 -20.743 162 HA VAL 2 HA VAL 2 -7.713 -6.915 -19.986 163 HB VAL 2 HB VAL 2 -7.438 -9.926 -20.288 164 HG11 VAL 2 1HG1 VAL 2 -9.875 -8.118 -20.040 165 HG12 VAL 2 2HG1 VAL 2 -9.916 -9.857 -20.385 166 HG13 VAL 2 3HG1 VAL 2 -9.279 -9.274 -18.818 167 HG21 VAL 2 3HG2 VAL 2 -7.135 -8.936 -22.494 168 HG22 VAL 2 1HG2 VAL 2 -8.780 -9.525 -22.424 169 HG23 VAL 2 2HG2 VAL 2 -8.449 -7.772 -22.223 170 H ASN 3 H ASN 3 -8.118 -6.454 -17.934 171 HA ASN 3 HA ASN 3 -6.379 -7.263 -15.759 172 HB2 ASN 3 1HB ASN 3 -9.087 -5.929 -15.955 173 HB3 ASN 3 2HB ASN 3 -8.352 -6.284 -14.392 174 HD21 ASN 3 2HD2 ASN 3 -8.814 -3.941 -16.609 175 HD22 ASN 3 1HD2 ASN 3 -7.427 -2.919 -16.227 176 H GLN 4 H GLN 4 -6.572 -8.953 -14.344 177 HA GLN 4 HA GLN 4 -9.131 -10.366 -14.023 178 HB2 GLN 4 1HB GLN 4 -8.246 -12.533 -14.816 179 HB3 GLN 4 2HB GLN 4 -8.377 -11.309 -16.093 180 HG2 GLN 4 1HG GLN 4 -5.905 -10.852 -15.826 181 HG3 GLN 4 2HG GLN 4 -5.821 -12.271 -14.776 182 HE21 GLN 4 2HE2 GLN 4 -5.817 -11.092 -17.963 183 HE22 GLN 4 1HE2 GLN 4 -5.888 -12.624 -18.783 184 H HIS 5 H HIS 5 -7.520 -9.044 -12.069 185 HA HIS 5 HA HIS 5 -6.752 -9.312 -9.932 186 HB2 HIS 5 1HB HIS 5 -8.782 -11.430 -10.363 187 HB3 HIS 5 2HB HIS 5 -7.744 -11.641 -8.946 188 HD1 HIS 5 HD1 HIS 5 -10.412 -9.344 -10.334 189 HD2 HIS 5 HD2 HIS 5 -8.071 -9.805 -6.923 190 HE1 HIS 5 HE1 HIS 5 -11.362 -7.782 -8.558 191 H LEU 6 H LEU 6 -4.559 -9.507 -10.012 192 HA LEU 6 HA LEU 6 -3.482 -12.219 -10.645 193 HB2 LEU 6 1HB LEU 6 -2.304 -9.478 -11.017 194 HB3 LEU 6 2HB LEU 6 -1.516 -10.985 -11.471 195 HG LEU 6 HG LEU 6 -4.169 -10.031 -12.648 196 HD11 LEU 6 1HD1 LEU 6 -2.711 -9.415 -14.600 197 HD12 LEU 6 2HD1 LEU 6 -1.314 -9.674 -13.571 198 HD13 LEU 6 3HD1 LEU 6 -2.478 -8.417 -13.176 199 HD21 LEU 6 3HD2 LEU 6 -2.200 -12.196 -13.432 200 HD22 LEU 6 1HD2 LEU 6 -3.515 -11.642 -14.476 201 HD23 LEU 6 2HD2 LEU 6 -3.891 -12.412 -12.902 202 H CYS 7 H CYS 7 -2.988 -13.214 -8.765 203 HA CYS 7 HA CYS 7 -0.852 -11.870 -7.164 204 HB2 CYS 7 1HB CYS 7 -3.243 -12.273 -6.120 205 HB3 CYS 7 2HB CYS 7 -2.607 -13.927 -5.845 206 H GLY 8 H GLY 8 -1.798 -14.662 -8.983 207 HA2 GLY 8 1HA GLY 8 0.255 -16.380 -7.719 208 HA3 GLY 8 2HA GLY 8 -0.889 -16.831 -8.979 209 H SER 9 H SER 9 0.980 -17.819 -10.080 210 HA SER 9 HA SER 9 3.213 -16.348 -11.032 211 HB2 SER 9 1HB SER 9 3.281 -18.182 -12.785 212 HB3 SER 9 2HB SER 9 3.187 -18.748 -11.100 213 HG SER 9 HG SER 9 1.689 -19.739 -12.635 214 H HIS 10 H HIS 10 -0.093 -16.406 -12.040 215 HA HIS 10 HA HIS 10 0.138 -15.392 -14.676 216 HB2 HIS 10 1HB HIS 10 -1.967 -14.911 -12.549 217 HB3 HIS 10 2HB HIS 10 -2.149 -14.419 -14.228 218 HD1 HIS 10 HD1 HIS 10 -4.300 -16.276 -13.453 219 HD2 HIS 10 HD2 HIS 10 -0.555 -17.692 -14.662 220 HE1 HIS 10 HE1 HIS 10 -4.630 -18.673 -14.183 221 H LEU 11 H LEU 11 0.686 -13.782 -11.575 222 HA LEU 11 HA LEU 11 0.352 -11.070 -12.611 223 HB2 LEU 11 1HB LEU 11 0.400 -11.652 -10.172 224 HB3 LEU 11 2HB LEU 11 2.054 -12.156 -10.326 225 HG LEU 11 HG LEU 11 2.766 -9.890 -10.799 226 HD11 LEU 11 1HD1 LEU 11 1.281 -7.928 -10.607 227 HD12 LEU 11 2HD1 LEU 11 -0.118 -8.987 -10.365 228 HD13 LEU 11 3HD1 LEU 11 0.751 -8.973 -11.928 229 HD21 LEU 11 3HD2 LEU 11 2.606 -10.737 -8.478 230 HD22 LEU 11 1HD2 LEU 11 0.994 -10.018 -8.352 231 HD23 LEU 11 2HD2 LEU 11 2.418 -8.984 -8.582 232 H VAL 12 H VAL 12 3.052 -13.392 -12.343 233 HA VAL 12 HA VAL 12 5.033 -11.519 -13.225 234 HB VAL 12 HB VAL 12 5.058 -14.593 -13.307 235 HG11 VAL 12 1HG1 VAL 12 7.315 -12.522 -13.520 236 HG12 VAL 12 2HG1 VAL 12 7.547 -14.274 -13.297 237 HG13 VAL 12 3HG1 VAL 12 6.805 -13.659 -14.780 238 HG21 VAL 12 3HG2 VAL 12 4.702 -13.776 -11.027 239 HG22 VAL 12 1HG2 VAL 12 6.342 -14.387 -11.184 240 HG23 VAL 12 2HG2 VAL 12 6.057 -12.630 -11.183 241 H GLU 13 H GLU 13 2.965 -13.992 -14.820 242 HA GLU 13 HA GLU 13 4.120 -13.612 -17.451 243 HB2 GLU 13 1HB GLU 13 1.394 -14.595 -16.560 244 HB3 GLU 13 2HB GLU 13 1.940 -14.570 -18.241 245 HG2 GLU 13 1HG GLU 13 3.789 -16.068 -17.728 246 HG3 GLU 13 2HG GLU 13 3.345 -16.048 -16.002 247 H ALA 14 H ALA 14 1.484 -11.938 -15.732 248 HA ALA 14 HA ALA 14 0.564 -10.333 -17.918 249 HB1 ALA 14 3HB ALA 14 0.676 -9.752 -14.931 250 HB2 ALA 14 1HB ALA 14 -0.224 -8.796 -16.151 251 HB3 ALA 14 2HB ALA 14 -0.671 -10.495 -15.834 252 H LEU 15 H LEU 15 2.997 -9.781 -15.361 253 HA LEU 15 HA LEU 15 3.844 -7.231 -16.312 254 HB2 LEU 15 1HB LEU 15 5.113 -9.355 -14.590 255 HB3 LEU 15 2HB LEU 15 5.974 -7.865 -14.954 256 HG LEU 15 HG LEU 15 3.207 -7.693 -13.834 257 HD11 LEU 15 1HD1 LEU 15 4.380 -9.224 -12.302 258 HD12 LEU 15 2HD1 LEU 15 4.089 -7.634 -11.574 259 HD13 LEU 15 3HD1 LEU 15 5.705 -8.051 -12.158 260 HD21 LEU 15 3HD2 LEU 15 4.433 -5.691 -14.694 261 HD22 LEU 15 1HD2 LEU 15 5.686 -5.988 -13.443 262 HD23 LEU 15 2HD2 LEU 15 4.014 -5.623 -12.957 263 H TYR 16 H TYR 16 5.016 -10.506 -17.057 264 HA TYR 16 HA TYR 16 7.241 -9.663 -18.612 265 HB2 TYR 16 1HB TYR 16 6.999 -11.947 -17.841 266 HB3 TYR 16 2HB TYR 16 5.494 -12.142 -18.766 267 HD1 TYR 16 HD1 TYR 16 9.172 -11.552 -19.165 268 HD2 TYR 16 HD2 TYR 16 5.523 -12.863 -21.025 269 HE1 TYR 16 HE1 TYR 16 10.471 -12.375 -21.133 270 HE2 TYR 16 HE2 TYR 16 6.822 -13.677 -22.969 271 HH TYR 16 HH TYR 16 10.379 -13.343 -23.200 272 H LEU 17 H LEU 17 3.801 -10.376 -19.547 273 HA LEU 17 HA LEU 17 4.333 -9.952 -22.361 274 HB2 LEU 17 1HB LEU 17 1.780 -9.943 -20.707 275 HB3 LEU 17 2HB LEU 17 1.801 -9.669 -22.456 276 HG LEU 17 HG LEU 17 2.861 -12.176 -21.114 277 HD11 LEU 17 1HD1 LEU 17 0.811 -13.247 -21.868 278 HD12 LEU 17 2HD1 LEU 17 0.231 -11.698 -22.562 279 HD13 LEU 17 3HD1 LEU 17 0.431 -11.880 -20.782 280 HD21 LEU 17 3HD2 LEU 17 2.317 -11.476 -24.015 281 HD22 LEU 17 1HD2 LEU 17 2.669 -13.101 -23.425 282 HD23 LEU 17 2HD2 LEU 17 3.896 -11.831 -23.288 283 H VAL 18 H VAL 18 3.342 -7.753 -19.701 284 HA VAL 18 HA VAL 18 2.633 -5.642 -21.605 285 HB VAL 18 HB VAL 18 2.836 -5.684 -18.539 286 HG11 VAL 18 1HG1 VAL 18 1.777 -3.525 -20.424 287 HG12 VAL 18 2HG1 VAL 18 1.477 -3.567 -18.677 288 HG13 VAL 18 3HG1 VAL 18 3.104 -3.365 -19.265 289 HG21 VAL 18 3HG2 VAL 18 1.049 -7.117 -19.643 290 HG22 VAL 18 1HG2 VAL 18 0.402 -5.828 -18.635 291 HG23 VAL 18 2HG2 VAL 18 0.403 -5.657 -20.402 292 H CYS 19 H CYS 19 5.410 -6.329 -19.408 293 HA CYS 19 HA CYS 19 6.738 -3.821 -20.287 294 HB2 CYS 19 1HB CYS 19 7.853 -6.086 -18.626 295 HB3 CYS 19 2HB CYS 19 8.544 -4.474 -18.848 296 H GLY 20 H GLY 20 6.307 -6.832 -21.668 297 HA2 GLY 20 1HA GLY 20 7.194 -7.493 -23.713 298 HA3 GLY 20 2HA GLY 20 8.486 -6.285 -23.565 299 H GLU 21 H GLU 21 9.625 -7.058 -21.136 300 HA GLU 21 HA GLU 21 10.303 -9.912 -21.428 301 HB2 GLU 21 1HB GLU 21 11.888 -8.646 -22.918 302 HB3 GLU 21 2HB GLU 21 12.455 -7.762 -21.492 303 HG2 GLU 21 1HG GLU 21 13.091 -10.010 -20.486 304 HG3 GLU 21 2HG GLU 21 12.701 -10.750 -22.034 305 H ARG 22 H ARG 22 11.001 -6.834 -19.698 306 HA ARG 22 HA ARG 22 10.871 -8.324 -17.158 307 HB2 ARG 22 1HB ARG 22 13.103 -7.344 -16.470 308 HB3 ARG 22 2HB ARG 22 13.181 -8.660 -17.655 309 HG2 ARG 22 1HG ARG 22 13.472 -6.986 -19.484 310 HG3 ARG 22 2HG ARG 22 13.395 -5.657 -18.299 311 HD2 ARG 22 1HD ARG 22 15.384 -7.885 -18.142 312 HD3 ARG 22 2HD ARG 22 15.680 -6.384 -19.041 313 HE ARG 22 HE ARG 22 14.934 -5.398 -16.628 314 HH11 ARG 22 1HH1 ARG 22 17.277 -7.937 -17.407 315 HH12 ARG 22 2HH1 ARG 22 18.239 -7.626 -16.000 316 HH21 ARG 22 1HH2 ARG 22 16.199 -5.061 -14.838 317 HH22 ARG 22 2HH2 ARG 22 17.635 -5.982 -14.544 318 H GLY 23 H GLY 23 10.461 -7.076 -15.386 319 HA2 GLY 23 1HA GLY 23 10.676 -4.284 -15.137 320 HA3 GLY 23 2HA GLY 23 9.104 -4.623 -15.888 321 H PHE 24 H PHE 24 11.002 -6.365 -13.470 322 HA PHE 24 HA PHE 24 9.224 -5.823 -11.265 323 HB2 PHE 24 1HB PHE 24 8.322 -8.207 -11.086 324 HB3 PHE 24 2HB PHE 24 7.617 -7.222 -12.348 325 HD1 PHE 24 HD2 PHE 24 8.064 -7.617 -14.759 326 HD2 PHE 24 HD1 PHE 24 9.702 -10.187 -11.712 327 HE1 PHE 24 HE2 PHE 24 8.573 -9.360 -16.489 328 HE2 PHE 24 HE1 PHE 24 10.206 -11.903 -13.428 329 HZ PHE 24 HZ PHE 24 9.641 -11.480 -15.820 330 H PHE 25 H PHE 25 11.450 -8.164 -12.718 331 HA PHE 25 HA PHE 25 13.227 -9.298 -11.910 332 HB2 PHE 25 1HB PHE 25 13.888 -6.815 -11.773 333 HB3 PHE 25 2HB PHE 25 13.781 -7.038 -10.026 334 HD1 PHE 25 HD2 PHE 25 15.578 -7.989 -13.132 335 HD2 PHE 25 HD1 PHE 25 15.472 -8.383 -8.848 336 HE1 PHE 25 HE2 PHE 25 17.901 -8.917 -13.163 337 HE2 PHE 25 HE1 PHE 25 17.786 -9.283 -8.860 338 HZ PHE 25 HZ PHE 25 19.007 -9.565 -11.020 339 H NVA 26 H ARX 26 11.404 -10.676 -10.876 340 HA NVA 26 HA ARX 26 11.172 -10.812 -8.002 341 HB2 NVA 26 1HB ARX 26 9.901 -12.792 -8.417 342 HB3 NVA 26 2HB ARX 26 9.456 -11.623 -9.651 343 HG2 NVA 26 1HG ARX 26 10.976 -12.770 -11.291 344 HG3 NVA 26 2HG ARX 26 11.481 -13.912 -10.067 345 HD2 NVA 26 1HD ARX 26 8.641 -14.087 -10.047 346 HD3 NVA 26 2HD ARX 26 9.083 -13.955 -11.772 347 H THR 27 H THR 27 13.865 -11.257 -9.577 348 HA THR 27 HA THR 27 15.950 -12.172 -9.220 349 HB THR 27 HB THR 27 16.611 -13.275 -7.234 350 HG1 THR 27 HG1 THR 27 13.856 -13.917 -6.936 351 HG21 THR 27 1HG2 THR 27 15.866 -10.917 -6.842 352 HG22 THR 27 2HG2 THR 27 15.740 -11.950 -5.404 353 HG23 THR 27 3HG2 THR 27 14.284 -11.540 -6.336 354 HA PRO 28 HA PRO 28 15.731 -15.709 -11.654 355 HB2 PRO 28 1HB PRO 28 17.694 -17.224 -9.953 356 HB3 PRO 28 2HB PRO 28 17.743 -16.903 -11.714 357 HG2 PRO 28 1HG PRO 28 19.361 -15.564 -10.102 358 HG3 PRO 28 2HG PRO 28 18.481 -14.690 -11.381 359 HD2 PRO 28 1HD PRO 28 17.814 -14.931 -8.448 360 HD3 PRO 28 2HD PRO 28 17.853 -13.469 -9.491 361 H HIX 29 H HIX 29 14.112 -17.097 -11.756 362 HA HIX 29 HA HIX 29 12.960 -18.412 -9.444 363 HB1 HIX 29 1HB HIX 29 12.267 -18.433 -12.417 364 HB2 HIX 29 2HB HIX 29 11.467 -19.522 -11.297 365 HD2 HIX 29 HD2 HIX 29 11.501 -15.720 -12.130 366 HD1 HIX 29 HD1 HIX 29 9.894 -18.498 -9.437 367 HE1 HIX 29 HE1 HIX 29 8.283 -16.777 -10.404 368 H THR 30 H THR 30 12.509 -20.480 -9.110 369 HA THR 30 HA THR 30 14.060 -22.627 -10.437 370 HB THR 30 HB THR 30 14.279 -23.699 -8.117 371 HG1 THR 30 HG1 THR 30 12.797 -22.111 -7.179 372 HG21 THR 30 1HG2 THR 30 16.308 -22.416 -7.491 373 HG22 THR 30 2HG2 THR 30 15.826 -21.103 -8.573 374 HG23 THR 30 3HG2 THR 30 16.242 -22.690 -9.252 Start of MODEL 8 1 H1 GLY 1 1H GLY 1 4.213 2.939 -1.760 2 H2 GLY 1 2H GLY 1 3.895 3.122 -3.386 3 H3 GLY 1 3H GLY 1 2.629 3.121 -2.285 4 HA2 GLY 1 1HA GLY 1 4.435 0.859 -2.889 5 HA3 GLY 1 2HA GLY 1 3.147 0.877 -1.688 6 H ILE 2 H ILE 2 3.122 -0.998 -3.883 7 HA ILE 2 HA ILE 2 0.619 -0.135 -5.167 8 HB ILE 2 HB ILE 2 2.384 0.763 -6.635 9 HG12 ILE 2 1HG1 ILE 2 1.063 -1.612 -7.979 10 HG13 ILE 2 2HG1 ILE 2 0.198 -0.134 -7.484 11 HG21 ILE 2 1HG2 ILE 2 3.337 -2.109 -6.938 12 HG22 ILE 2 2HG2 ILE 2 3.910 -0.711 -7.856 13 HG23 ILE 2 3HG2 ILE 2 4.190 -0.785 -6.140 14 HD11 ILE 2 3HD1 ILE 2 0.716 0.016 -9.835 15 HD12 ILE 2 1HD1 ILE 2 1.731 1.189 -8.974 16 HD13 ILE 2 2HD1 ILE 2 2.415 -0.350 -9.583 17 H VAL 3 H VAL 3 2.878 -2.678 -4.290 18 HA VAL 3 HA VAL 3 1.848 -4.794 -5.695 19 HB VAL 3 HB VAL 3 3.083 -4.778 -2.914 20 HG11 VAL 3 1HG1 VAL 3 3.637 -7.185 -3.391 21 HG12 VAL 3 2HG1 VAL 3 1.903 -6.910 -3.219 22 HG13 VAL 3 3HG1 VAL 3 2.587 -7.102 -4.885 23 HG21 VAL 3 3HG2 VAL 3 5.148 -5.427 -4.270 24 HG22 VAL 3 1HG2 VAL 3 4.179 -5.173 -5.750 25 HG23 VAL 3 2HG2 VAL 3 4.520 -3.809 -4.648 26 H GLU 4 H GLU 4 0.798 -3.736 -2.394 27 HA GLU 4 HA GLU 4 -0.982 -5.938 -2.068 28 HB2 GLU 4 1HB GLU 4 -1.117 -3.119 -0.910 29 HB3 GLU 4 2HB GLU 4 -2.101 -4.486 -0.406 30 HG2 GLU 4 1HG GLU 4 -0.102 -5.738 0.303 31 HG3 GLU 4 2HG GLU 4 0.878 -4.311 -0.186 32 H GLN 5 H GLN 5 -1.572 -2.637 -3.332 33 HA GLN 5 HA GLN 5 -4.344 -2.915 -3.747 34 HB2 GLN 5 1HB GLN 5 -3.000 -0.804 -3.680 35 HB3 GLN 5 2HB GLN 5 -2.376 -1.176 -5.284 36 HG2 GLN 5 1HG GLN 5 -4.664 -1.007 -6.207 37 HG3 GLN 5 2HG GLN 5 -5.312 -0.713 -4.569 38 HE21 GLN 5 2HE2 GLN 5 -5.984 1.330 -4.794 39 HE22 GLN 5 1HE2 GLN 5 -4.974 2.698 -5.173 40 H CYS 6 H CYS 6 -1.592 -3.596 -5.948 41 HA CYS 6 HA CYS 6 -3.241 -4.226 -8.220 42 HB2 CYS 6 1HB CYS 6 -0.788 -3.673 -8.293 43 HB3 CYS 6 2HB CYS 6 -0.423 -5.194 -7.520 44 H CYS 7 H CYS 7 -1.815 -6.180 -5.561 45 HA CYS 7 HA CYS 7 -2.655 -8.727 -6.630 46 HB2 CYS 7 1HB CYS 7 -1.525 -7.691 -4.142 47 HB3 CYS 7 2HB CYS 7 -2.827 -8.853 -3.793 48 H THR 8 H THR 8 -4.203 -6.517 -4.241 49 HA THR 8 HA THR 8 -6.493 -8.290 -4.035 50 HB THR 8 HB THR 8 -7.435 -6.486 -2.551 51 HG1 THR 8 HG1 THR 8 -4.891 -5.216 -2.991 52 HG21 THR 8 1HG2 THR 8 -5.937 -8.278 -1.604 53 HG22 THR 8 2HG2 THR 8 -5.772 -6.754 -0.754 54 HG23 THR 8 3HG2 THR 8 -4.516 -7.264 -1.903 55 H SER 9 H SER 9 -6.071 -7.158 -6.793 56 HA SER 9 HA SER 9 -8.868 -6.400 -7.076 57 HB2 SER 9 1HB SER 9 -8.519 -4.272 -8.147 58 HB3 SER 9 2HB SER 9 -7.866 -4.222 -6.525 59 HG SER 9 HG SER 9 -5.815 -4.324 -7.368 60 H ILE 10 H ILE 10 -9.333 -5.695 -9.461 61 HA ILE 10 HA ILE 10 -8.037 -7.523 -11.342 62 HB ILE 10 HB ILE 10 -10.064 -5.252 -11.711 63 HG12 ILE 10 1HG1 ILE 10 -10.912 -7.211 -10.426 64 HG13 ILE 10 2HG1 ILE 10 -11.745 -6.912 -11.917 65 HG21 ILE 10 1HG2 ILE 10 -8.883 -5.532 -13.794 66 HG22 ILE 10 2HG2 ILE 10 -8.929 -7.304 -13.671 67 HG23 ILE 10 3HG2 ILE 10 -10.416 -6.372 -13.985 68 HD11 ILE 10 3HD1 ILE 10 -10.558 -8.798 -13.020 69 HD12 ILE 10 1HD1 ILE 10 -9.707 -9.139 -11.472 70 HD13 ILE 10 2HD1 ILE 10 -11.461 -9.347 -11.579 71 H CYS 11 H CYS 11 -5.885 -6.845 -11.292 72 HA CYS 11 HA CYS 11 -5.147 -4.087 -11.197 73 HB2 CYS 11 1HB CYS 11 -3.878 -6.199 -10.430 74 HB3 CYS 11 2HB CYS 11 -3.349 -6.324 -12.088 75 H SER 12 H SER 12 -4.863 -2.644 -12.682 76 HA SER 12 HA SER 12 -5.807 -3.239 -15.339 77 HB2 SER 12 1HB SER 12 -4.884 -0.633 -14.104 78 HB3 SER 12 2HB SER 12 -5.872 -0.821 -15.575 79 HG SER 12 HG SER 12 -6.585 -1.620 -12.921 80 H LEU 13 H LEU 13 -4.915 -2.388 -17.273 81 HA LEU 13 HA LEU 13 -2.358 -3.254 -17.871 82 HB2 LEU 13 1HB LEU 13 -4.097 -2.683 -19.543 83 HB3 LEU 13 2HB LEU 13 -3.901 -0.951 -19.181 84 HG LEU 13 HG LEU 13 -1.466 -1.184 -19.978 85 HD11 LEU 13 1HD1 LEU 13 -2.643 -3.820 -20.961 86 HD12 LEU 13 2HD1 LEU 13 -1.170 -3.596 -19.981 87 HD13 LEU 13 3HD1 LEU 13 -1.194 -3.050 -21.684 88 HD21 LEU 13 3HD2 LEU 13 -3.223 -0.059 -21.185 89 HD22 LEU 13 1HD2 LEU 13 -3.826 -1.614 -21.850 90 HD23 LEU 13 2HD2 LEU 13 -2.219 -0.971 -22.315 91 H TYR 14 H TYR 14 -3.301 0.104 -16.986 92 HA TYR 14 HA TYR 14 -0.604 1.106 -17.208 93 HB2 TYR 14 1HB TYR 14 -1.448 3.148 -16.300 94 HB3 TYR 14 2HB TYR 14 -2.623 2.503 -17.466 95 HD1 TYR 14 HD1 TYR 14 -1.942 3.260 -13.923 96 HD2 TYR 14 HD2 TYR 14 -4.820 1.739 -16.760 97 HE1 TYR 14 HE1 TYR 14 -3.779 3.488 -12.246 98 HE2 TYR 14 HE2 TYR 14 -6.606 1.965 -15.066 99 HH TYR 14 HH TYR 14 -7.150 2.568 -12.942 100 H GLN 15 H GLN 15 -2.405 -0.345 -14.540 101 HA GLN 15 HA GLN 15 -0.660 0.598 -12.445 102 HB2 GLN 15 1HB GLN 15 -2.498 -1.797 -12.636 103 HB3 GLN 15 2HB GLN 15 -1.575 -1.415 -11.199 104 HG2 GLN 15 1HG GLN 15 -2.637 0.787 -11.099 105 HG3 GLN 15 2HG GLN 15 -3.598 0.420 -12.555 106 HE21 GLN 15 2HE2 GLN 15 -3.445 0.195 -9.158 107 HE22 GLN 15 1HE2 GLN 15 -4.820 -0.859 -8.942 108 H LEU 16 H LEU 16 -0.784 -2.174 -14.683 109 HA LEU 16 HA LEU 16 1.586 -3.399 -13.559 110 HB2 LEU 16 1HB LEU 16 0.145 -3.679 -16.172 111 HB3 LEU 16 2HB LEU 16 1.632 -4.539 -15.848 112 HG LEU 16 HG LEU 16 -0.716 -4.787 -13.997 113 HD11 LEU 16 1HD1 LEU 16 -0.179 -6.386 -16.520 114 HD12 LEU 16 2HD1 LEU 16 -1.519 -5.304 -16.249 115 HD13 LEU 16 3HD1 LEU 16 -1.387 -6.758 -15.287 116 HD21 LEU 16 3HD2 LEU 16 0.256 -6.914 -13.421 117 HD22 LEU 16 1HD2 LEU 16 1.466 -5.664 -13.223 118 HD23 LEU 16 2HD2 LEU 16 1.526 -6.726 -14.641 119 H GLU 17 H GLU 17 1.136 -1.152 -16.412 120 HA GLU 17 HA GLU 17 3.874 -1.386 -17.075 121 HB2 GLU 17 1HB GLU 17 3.593 0.243 -18.664 122 HB3 GLU 17 2HB GLU 17 2.006 -0.519 -18.543 123 HG2 GLU 17 1HG GLU 17 1.359 1.632 -18.572 124 HG3 GLU 17 2HG GLU 17 1.577 1.402 -16.836 125 H ASN 18 H ASN 18 2.247 0.491 -14.637 126 HA ASN 18 HA ASN 18 4.283 2.360 -14.104 127 HB2 ASN 18 1HB ASN 18 1.927 2.247 -13.247 128 HB3 ASN 18 2HB ASN 18 2.482 1.061 -12.061 129 HD21 ASN 18 2HD2 ASN 18 3.265 4.307 -13.291 130 HD22 ASN 18 1HD2 ASN 18 3.654 4.971 -11.736 131 H TYR 19 H TYR 19 4.343 -1.072 -13.526 132 HA TYR 19 HA TYR 19 6.330 -0.966 -11.328 133 HB2 TYR 19 1HB TYR 19 5.258 -3.108 -13.183 134 HB3 TYR 19 2HB TYR 19 6.622 -3.408 -12.099 135 HD1 TYR 19 HD1 TYR 19 3.015 -2.636 -12.228 136 HD2 TYR 19 HD2 TYR 19 6.326 -3.792 -9.779 137 HE1 TYR 19 HE1 TYR 19 1.426 -3.277 -10.430 138 HE2 TYR 19 HE2 TYR 19 4.740 -4.464 -7.939 139 HH TYR 19 HH TYR 19 1.187 -4.101 -8.377 140 H CYS 20 H CYS 20 6.236 -0.781 -14.827 141 HA CYS 20 HA CYS 20 8.765 -2.114 -15.201 142 HB2 CYS 20 1HB CYS 20 7.464 -0.204 -17.161 143 HB3 CYS 20 2HB CYS 20 8.558 -1.579 -17.506 144 H ASN 21 H ASN 21 10.630 -0.980 -16.364 145 HA ASN 21 HA ASN 21 11.429 1.343 -14.776 146 HB2 ASN 21 1HB ASN 21 12.690 -0.490 -16.803 147 HB3 ASN 21 2HB ASN 21 13.324 1.180 -16.727 148 HD21 ASN 21 2HD2 ASN 21 12.115 -1.042 -14.231 149 HD22 ASN 21 1HD2 ASN 21 13.616 -1.070 -13.283 150 H1 PHE 1 1H PHE 1 -2.770 -8.027 -23.383 151 H2 PHE 1 2H PHE 1 -1.528 -7.141 -22.782 152 H3 PHE 1 3H PHE 1 -1.344 -8.779 -22.969 153 HA PHE 1 HA PHE 1 -2.263 -9.209 -20.986 154 HB2 PHE 1 1HB PHE 1 -0.898 -7.346 -20.355 155 HB3 PHE 1 2HB PHE 1 -2.181 -6.185 -20.826 156 HD1 PHE 1 HD2 PHE 1 -1.785 -9.276 -18.707 157 HD2 PHE 1 HD1 PHE 1 -3.420 -5.331 -19.114 158 HE1 PHE 1 HE2 PHE 1 -2.796 -9.458 -16.464 159 HE2 PHE 1 HE1 PHE 1 -4.410 -5.485 -16.860 160 HZ PHE 1 HZ PHE 1 -4.097 -7.570 -15.519 161 H VAL 2 H VAL 2 -4.229 -9.669 -20.048 162 HA VAL 2 HA VAL 2 -6.564 -8.081 -20.979 163 HB VAL 2 HB VAL 2 -7.947 -10.198 -20.741 164 HG11 VAL 2 1HG1 VAL 2 -5.731 -10.384 -22.821 165 HG12 VAL 2 2HG1 VAL 2 -7.299 -11.154 -22.904 166 HG13 VAL 2 3HG1 VAL 2 -7.215 -9.417 -22.962 167 HG21 VAL 2 3HG2 VAL 2 -6.296 -11.476 -19.336 168 HG22 VAL 2 1HG2 VAL 2 -6.878 -12.375 -20.781 169 HG23 VAL 2 2HG2 VAL 2 -5.259 -11.669 -20.790 170 H ASN 3 H ASN 3 -7.753 -7.276 -19.284 171 HA ASN 3 HA ASN 3 -6.477 -7.186 -16.727 172 HB2 ASN 3 1HB ASN 3 -9.341 -6.430 -17.491 173 HB3 ASN 3 2HB ASN 3 -8.493 -5.931 -16.022 174 HD21 ASN 3 2HD2 ASN 3 -9.514 -4.726 -18.761 175 HD22 ASN 3 1HD2 ASN 3 -8.272 -3.574 -19.111 176 H GLN 4 H GLN 4 -6.518 -8.539 -15.028 177 HA GLN 4 HA GLN 4 -8.878 -10.256 -14.449 178 HB2 GLN 4 1HB GLN 4 -6.097 -11.305 -15.043 179 HB3 GLN 4 2HB GLN 4 -7.286 -12.235 -14.085 180 HG2 GLN 4 1HG GLN 4 -8.783 -12.273 -15.995 181 HG3 GLN 4 2HG GLN 4 -7.677 -11.344 -16.967 182 HE21 GLN 4 2HE2 GLN 4 -8.753 -14.372 -16.613 183 HE22 GLN 4 1HE2 GLN 4 -7.329 -15.259 -17.114 184 H HIS 5 H HIS 5 -8.292 -11.510 -12.266 185 HA HIS 5 HA HIS 5 -6.979 -9.625 -10.400 186 HB2 HIS 5 1HB HIS 5 -8.743 -11.987 -10.198 187 HB3 HIS 5 2HB HIS 5 -7.375 -12.071 -9.085 188 HD1 HIS 5 HD1 HIS 5 -10.556 -10.120 -9.593 189 HD2 HIS 5 HD2 HIS 5 -7.244 -10.152 -7.066 190 HE1 HIS 5 HE1 HIS 5 -11.120 -8.641 -7.593 191 H LEU 6 H LEU 6 -4.836 -9.764 -9.953 192 HA LEU 6 HA LEU 6 -3.442 -12.106 -11.194 193 HB2 LEU 6 1HB LEU 6 -2.411 -9.298 -10.697 194 HB3 LEU 6 2HB LEU 6 -1.551 -10.597 -11.525 195 HG LEU 6 HG LEU 6 -4.075 -9.225 -12.517 196 HD11 LEU 6 1HD1 LEU 6 -2.096 -7.814 -12.565 197 HD12 LEU 6 2HD1 LEU 6 -2.518 -8.306 -14.219 198 HD13 LEU 6 3HD1 LEU 6 -1.175 -9.089 -13.367 199 HD21 LEU 6 3HD2 LEU 6 -3.662 -10.448 -14.632 200 HD22 LEU 6 1HD2 LEU 6 -4.056 -11.508 -13.316 201 HD23 LEU 6 2HD2 LEU 6 -2.371 -11.357 -13.873 202 H CYS 7 H CYS 7 -4.150 -11.606 -8.098 203 HA CYS 7 HA CYS 7 -1.477 -11.544 -6.967 204 HB2 CYS 7 1HB CYS 7 -3.802 -10.995 -5.862 205 HB3 CYS 7 2HB CYS 7 -3.821 -12.728 -5.497 206 H GLY 8 H GLY 8 -0.193 -13.159 -7.879 207 HA2 GLY 8 1HA GLY 8 0.204 -15.614 -6.894 208 HA3 GLY 8 2HA GLY 8 -1.189 -15.884 -7.966 209 H SER 9 H SER 9 0.321 -17.284 -9.171 210 HA SER 9 HA SER 9 2.677 -16.408 -10.421 211 HB2 SER 9 1HB SER 9 1.862 -18.759 -10.274 212 HB3 SER 9 2HB SER 9 0.666 -18.390 -11.566 213 HG SER 9 HG SER 9 2.479 -19.257 -12.540 214 H HIS 10 H HIS 10 -0.678 -15.752 -11.325 215 HA HIS 10 HA HIS 10 -0.347 -15.024 -14.055 216 HB2 HIS 10 1HB HIS 10 -2.274 -14.034 -11.911 217 HB3 HIS 10 2HB HIS 10 -2.410 -13.626 -13.620 218 HD1 HIS 10 HD1 HIS 10 -3.331 -16.256 -11.191 219 HD2 HIS 10 HD2 HIS 10 -2.944 -15.868 -15.307 220 HE1 HIS 10 HE1 HIS 10 -4.513 -18.257 -12.234 221 H LEU 11 H LEU 11 0.630 -13.197 -11.185 222 HA LEU 11 HA LEU 11 0.778 -10.630 -12.391 223 HB2 LEU 11 1HB LEU 11 1.053 -11.247 -9.924 224 HB3 LEU 11 2HB LEU 11 2.697 -11.724 -10.342 225 HG LEU 11 HG LEU 11 3.186 -9.392 -11.057 226 HD11 LEU 11 1HD1 LEU 11 0.950 -8.593 -11.710 227 HD12 LEU 11 2HD1 LEU 11 1.588 -7.558 -10.395 228 HD13 LEU 11 3HD1 LEU 11 0.325 -8.810 -10.063 229 HD21 LEU 11 3HD2 LEU 11 3.341 -8.484 -8.863 230 HD22 LEU 11 1HD2 LEU 11 3.581 -10.219 -8.745 231 HD23 LEU 11 2HD2 LEU 11 2.032 -9.514 -8.233 232 H VAL 12 H VAL 12 2.963 -13.367 -12.390 233 HA VAL 12 HA VAL 12 5.241 -11.955 -13.452 234 HB VAL 12 HB VAL 12 4.543 -14.905 -13.626 235 HG11 VAL 12 1HG1 VAL 12 7.041 -15.225 -13.870 236 HG12 VAL 12 2HG1 VAL 12 6.254 -14.421 -15.256 237 HG13 VAL 12 3HG1 VAL 12 7.163 -13.466 -14.067 238 HG21 VAL 12 3HG2 VAL 12 6.249 -13.439 -11.596 239 HG22 VAL 12 1HG2 VAL 12 4.653 -14.124 -11.256 240 HG23 VAL 12 2HG2 VAL 12 6.011 -15.185 -11.663 241 H GLU 13 H GLU 13 2.676 -13.975 -15.014 242 HA GLU 13 HA GLU 13 3.719 -13.552 -17.653 243 HB2 GLU 13 1HB GLU 13 1.151 -14.441 -16.448 244 HB3 GLU 13 2HB GLU 13 1.086 -13.853 -18.135 245 HG2 GLU 13 1HG GLU 13 3.109 -15.893 -17.250 246 HG3 GLU 13 2HG GLU 13 1.464 -16.375 -17.668 247 H ALA 14 H ALA 14 1.412 -11.763 -15.631 248 HA ALA 14 HA ALA 14 0.492 -9.964 -17.617 249 HB1 ALA 14 3HB ALA 14 0.899 -9.470 -14.680 250 HB2 ALA 14 1HB ALA 14 -0.153 -8.589 -15.793 251 HB3 ALA 14 2HB ALA 14 -0.456 -10.270 -15.402 252 H LEU 15 H LEU 15 3.311 -9.725 -15.324 253 HA LEU 15 HA LEU 15 4.040 -7.154 -16.435 254 HB2 LEU 15 1HB LEU 15 5.480 -9.101 -14.597 255 HB3 LEU 15 2HB LEU 15 6.222 -7.587 -15.205 256 HG LEU 15 HG LEU 15 3.552 -7.647 -13.758 257 HD11 LEU 15 1HD1 LEU 15 5.421 -8.568 -12.317 258 HD12 LEU 15 2HD1 LEU 15 4.632 -7.032 -11.718 259 HD13 LEU 15 3HD1 LEU 15 6.213 -6.971 -12.518 260 HD21 LEU 15 3HD2 LEU 15 5.545 -5.420 -14.353 261 HD22 LEU 15 1HD2 LEU 15 4.074 -5.239 -13.406 262 HD23 LEU 15 2HD2 LEU 15 3.973 -5.615 -15.146 263 H TYR 16 H TYR 16 4.946 -10.496 -17.208 264 HA TYR 16 HA TYR 16 7.109 -9.857 -18.895 265 HB2 TYR 16 1HB TYR 16 6.544 -12.193 -18.252 266 HB3 TYR 16 2HB TYR 16 5.059 -12.084 -19.245 267 HD1 TYR 16 HD2 TYR 16 8.805 -12.095 -19.431 268 HD2 TYR 16 HD1 TYR 16 5.085 -12.360 -21.617 269 HE1 TYR 16 HE2 TYR 16 10.023 -12.745 -21.503 270 HE2 TYR 16 HE1 TYR 16 6.346 -13.054 -23.654 271 HH TYR 16 HH TYR 16 9.953 -13.283 -23.691 272 H LEU 17 H LEU 17 3.618 -10.087 -19.570 273 HA LEU 17 HA LEU 17 3.849 -9.366 -22.337 274 HB2 LEU 17 1HB LEU 17 1.546 -9.295 -20.353 275 HB3 LEU 17 2HB LEU 17 1.349 -8.871 -22.058 276 HG LEU 17 HG LEU 17 2.284 -11.602 -21.053 277 HD11 LEU 17 1HD1 LEU 17 -0.006 -11.081 -20.370 278 HD12 LEU 17 2HD1 LEU 17 0.008 -12.355 -21.616 279 HD13 LEU 17 3HD1 LEU 17 -0.436 -10.701 -22.074 280 HD21 LEU 17 3HD2 LEU 17 3.096 -11.201 -23.329 281 HD22 LEU 17 1HD2 LEU 17 1.472 -10.744 -23.860 282 HD23 LEU 17 2HD2 LEU 17 1.812 -12.420 -23.353 283 H VAL 18 H VAL 18 3.207 -7.386 -19.444 284 HA VAL 18 HA VAL 18 2.522 -5.101 -21.150 285 HB VAL 18 HB VAL 18 2.747 -5.262 -18.101 286 HG11 VAL 18 1HG1 VAL 18 1.484 -3.076 -18.192 287 HG12 VAL 18 2HG1 VAL 18 3.149 -2.959 -18.781 288 HG13 VAL 18 3HG1 VAL 18 1.791 -3.013 -19.931 289 HG21 VAL 18 3HG2 VAL 18 0.834 -6.577 -18.843 290 HG22 VAL 18 1HG2 VAL 18 0.205 -5.022 -18.328 291 HG23 VAL 18 2HG2 VAL 18 0.378 -5.328 -20.048 292 H CYS 19 H CYS 19 5.296 -5.912 -18.951 293 HA CYS 19 HA CYS 19 6.604 -3.397 -19.684 294 HB2 CYS 19 1HB CYS 19 7.737 -5.884 -18.366 295 HB3 CYS 19 2HB CYS 19 8.577 -4.341 -18.568 296 H GLY 20 H GLY 20 6.367 -6.506 -21.144 297 HA2 GLY 20 1HA GLY 20 7.382 -7.348 -23.064 298 HA3 GLY 20 2HA GLY 20 7.944 -5.716 -23.421 299 H GLU 21 H GLU 21 8.418 -7.973 -20.757 300 HA GLU 21 HA GLU 21 10.223 -8.872 -19.691 301 HB2 GLU 21 1HB GLU 21 12.026 -7.978 -21.966 302 HB3 GLU 21 2HB GLU 21 12.301 -9.242 -20.749 303 HG2 GLU 21 1HG GLU 21 10.455 -10.554 -21.762 304 HG3 GLU 21 2HG GLU 21 10.182 -9.318 -22.936 305 H ARG 22 H ARG 22 11.135 -5.742 -21.217 306 HA ARG 22 HA ARG 22 13.139 -5.249 -19.166 307 HB2 ARG 22 1HB ARG 22 13.256 -2.983 -20.224 308 HB3 ARG 22 2HB ARG 22 13.676 -4.349 -21.247 309 HG2 ARG 22 1HG ARG 22 11.457 -4.281 -22.346 310 HG3 ARG 22 2HG ARG 22 11.000 -2.937 -21.325 311 HD2 ARG 22 1HD ARG 22 12.807 -1.535 -22.242 312 HD3 ARG 22 2HD ARG 22 13.356 -2.971 -23.192 313 HE ARG 22 HE ARG 22 11.572 -2.711 -24.656 314 HH11 ARG 22 1HH1 ARG 22 11.204 -0.390 -22.010 315 HH12 ARG 22 2HH1 ARG 22 9.975 0.528 -22.878 316 HH21 ARG 22 1HH2 ARG 22 10.057 -1.500 -25.683 317 HH22 ARG 22 2HH2 ARG 22 9.328 -0.088 -24.926 318 H GLY 23 H GLY 23 12.411 -5.122 -17.168 319 HA2 GLY 23 1HA GLY 23 11.802 -2.859 -15.934 320 HA3 GLY 23 2HA GLY 23 10.210 -3.191 -16.598 321 H PHE 24 H PHE 24 11.358 -6.215 -15.876 322 HA PHE 24 HA PHE 24 10.884 -6.016 -13.000 323 HB2 PHE 24 1HB PHE 24 8.929 -7.285 -12.888 324 HB3 PHE 24 2HB PHE 24 8.641 -6.227 -14.227 325 HD1 PHE 24 HD2 PHE 24 9.209 -7.258 -16.648 326 HD2 PHE 24 HD1 PHE 24 8.701 -9.612 -13.079 327 HE1 PHE 24 HE2 PHE 24 8.858 -9.284 -18.023 328 HE2 PHE 24 HE1 PHE 24 8.297 -11.614 -14.466 329 HZ PHE 24 HZ PHE 24 8.358 -11.470 -16.926 330 H PHE 25 H PHE 25 10.887 -8.349 -12.035 331 HA PHE 25 HA PHE 25 12.825 -10.040 -13.601 332 HB2 PHE 25 1HB PHE 25 14.206 -8.769 -12.125 333 HB3 PHE 25 2HB PHE 25 13.122 -9.005 -10.758 334 HD1 PHE 25 HD1 PHE 25 15.573 -10.674 -12.991 335 HD2 PHE 25 HD2 PHE 25 13.240 -10.989 -9.395 336 HE1 PHE 25 HE1 PHE 25 16.903 -12.652 -12.315 337 HE2 PHE 25 HE2 PHE 25 14.555 -12.960 -8.670 338 HZ PHE 25 HZ PHE 25 16.406 -13.829 -10.151 339 H NVA 26 H ARX 26 12.105 -12.046 -13.679 340 HA NVA 26 HA ARX 26 10.354 -13.164 -11.541 341 HB2 NVA 26 1HB ARX 26 9.729 -14.992 -12.912 342 HB3 NVA 26 2HB ARX 26 9.428 -13.521 -13.767 343 HG2 NVA 26 1HG ARX 26 11.437 -13.902 -15.233 344 HG3 NVA 26 2HG ARX 26 11.912 -15.294 -14.294 345 HD2 NVA 26 1HD ARX 26 9.099 -15.394 -15.406 346 HD3 NVA 26 2HD ARX 26 10.396 -15.385 -16.544 347 H THR 27 H THR 27 10.966 -14.695 -10.197 348 HA THR 27 HA THR 27 13.743 -15.443 -9.792 349 HB THR 27 HB THR 27 12.570 -17.363 -8.402 350 HG1 THR 27 HG1 THR 27 10.570 -16.720 -9.739 351 HG21 THR 27 1HG2 THR 27 11.883 -15.733 -6.603 352 HG22 THR 27 2HG2 THR 27 11.994 -14.429 -7.781 353 HG23 THR 27 3HG2 THR 27 13.460 -15.308 -7.318 354 HA PRO 28 HA PRO 28 14.050 -18.177 -13.198 355 HB2 PRO 28 1HB PRO 28 15.492 -20.065 -11.326 356 HB3 PRO 28 2HB PRO 28 15.983 -19.493 -12.963 357 HG2 PRO 28 1HG PRO 28 17.153 -18.456 -10.866 358 HG3 PRO 28 2HG PRO 28 16.564 -17.394 -12.184 359 HD2 PRO 28 1HD PRO 28 15.270 -18.029 -9.498 360 HD3 PRO 28 2HD PRO 28 15.519 -16.435 -10.276 361 H HIX 29 H HIX 29 13.049 -19.743 -14.129 362 HA HIX 29 HA HIX 29 11.457 -21.827 -12.716 363 HB1 HIX 29 1HB HIX 29 9.561 -21.153 -14.441 364 HB2 HIX 29 2HB HIX 29 9.775 -20.261 -12.944 365 HD2 HIX 29 HD2 HIX 29 9.948 -17.530 -13.285 366 HD1 HIX 29 HD1 HIX 29 10.709 -19.960 -16.632 367 HE1 HIX 29 HE1 HIX 29 11.829 -17.648 -16.602 368 H THR 30 H THR 30 12.946 -23.299 -13.326 369 HA THR 30 HA THR 30 12.701 -24.668 -15.819 370 HB THR 30 HB THR 30 14.119 -22.692 -16.649 371 HG1 THR 30 HG1 THR 30 15.612 -24.059 -17.646 372 HG21 THR 30 1HG2 THR 30 16.438 -22.559 -15.975 373 HG22 THR 30 2HG2 THR 30 16.224 -23.885 -14.826 374 HG23 THR 30 3HG2 THR 30 15.376 -22.383 -14.544 Start of MODEL 9 1 H1 GLY 1 1H GLY 1 1.863 2.882 -1.233 2 H2 GLY 1 2H GLY 1 2.426 1.965 -2.511 3 H3 GLY 1 3H GLY 1 1.415 3.252 -2.793 4 HA2 GLY 1 1HA GLY 1 0.733 0.745 -1.364 5 HA3 GLY 1 2HA GLY 1 -0.346 2.143 -1.557 6 H ILE 2 H ILE 2 1.382 -0.420 -3.321 7 HA ILE 2 HA ILE 2 -0.647 -0.161 -5.452 8 HB ILE 2 HB ILE 2 1.392 1.100 -6.163 9 HG12 ILE 2 1HG1 ILE 2 0.981 -1.494 -7.716 10 HG13 ILE 2 2HG1 ILE 2 -0.081 -0.095 -7.794 11 HG21 ILE 2 1HG2 ILE 2 2.915 -1.524 -6.105 12 HG22 ILE 2 2HG2 ILE 2 3.541 0.081 -6.439 13 HG23 ILE 2 3HG2 ILE 2 3.015 -0.320 -4.797 14 HD11 ILE 2 3HD1 ILE 2 2.765 -0.269 -8.773 15 HD12 ILE 2 1HD1 ILE 2 1.297 0.006 -9.688 16 HD13 ILE 2 2HD1 ILE 2 1.876 1.259 -8.592 17 H VAL 3 H VAL 3 1.735 -2.202 -3.717 18 HA VAL 3 HA VAL 3 1.393 -4.457 -5.345 19 HB VAL 3 HB VAL 3 1.960 -4.491 -2.357 20 HG11 VAL 3 1HG1 VAL 3 3.159 -6.560 -2.849 21 HG12 VAL 3 2HG1 VAL 3 1.431 -6.700 -3.225 22 HG13 VAL 3 3HG1 VAL 3 2.613 -6.472 -4.531 23 HG21 VAL 3 3HG2 VAL 3 4.352 -4.563 -3.163 24 HG22 VAL 3 1HG2 VAL 3 3.731 -4.152 -4.775 25 HG23 VAL 3 2HG2 VAL 3 3.508 -2.995 -3.388 26 H GLU 4 H GLU 4 -0.275 -3.940 -2.191 27 HA GLU 4 HA GLU 4 -1.985 -6.190 -2.589 28 HB2 GLU 4 1HB GLU 4 -2.275 -3.742 -0.804 29 HB3 GLU 4 2HB GLU 4 -3.362 -5.115 -0.727 30 HG2 GLU 4 1HG GLU 4 -1.731 -5.336 1.059 31 HG3 GLU 4 2HG GLU 4 -1.402 -6.568 -0.141 32 H GLN 5 H GLN 5 -2.168 -2.835 -3.658 33 HA GLN 5 HA GLN 5 -5.014 -2.836 -4.146 34 HB2 GLN 5 1HB GLN 5 -2.737 -1.250 -5.332 35 HB3 GLN 5 2HB GLN 5 -4.402 -1.031 -5.833 36 HG2 GLN 5 1HG GLN 5 -3.335 -0.639 -3.030 37 HG3 GLN 5 2HG GLN 5 -3.735 0.634 -4.164 38 HE21 GLN 5 2HE2 GLN 5 -4.837 -1.059 -1.561 39 HE22 GLN 5 1HE2 GLN 5 -6.555 -0.712 -1.720 40 H CYS 6 H CYS 6 -2.158 -3.835 -6.045 41 HA CYS 6 HA CYS 6 -3.765 -4.484 -8.369 42 HB2 CYS 6 1HB CYS 6 -1.076 -4.164 -7.799 43 HB3 CYS 6 2HB CYS 6 -1.208 -5.893 -8.087 44 H CYS 7 H CYS 7 -2.403 -6.391 -5.625 45 HA CYS 7 HA CYS 7 -3.140 -8.911 -6.740 46 HB2 CYS 7 1HB CYS 7 -2.139 -7.877 -4.197 47 HB3 CYS 7 2HB CYS 7 -3.272 -9.180 -3.927 48 H THR 8 H THR 8 -4.811 -6.935 -4.218 49 HA THR 8 HA THR 8 -7.024 -8.799 -4.123 50 HB THR 8 HB THR 8 -7.314 -6.092 -2.864 51 HG1 THR 8 HG1 THR 8 -5.135 -6.306 -2.569 52 HG21 THR 8 1HG2 THR 8 -7.835 -7.468 -0.883 53 HG22 THR 8 2HG2 THR 8 -7.368 -8.947 -1.764 54 HG23 THR 8 3HG2 THR 8 -8.810 -8.020 -2.271 55 H SER 9 H SER 9 -6.557 -7.375 -6.715 56 HA SER 9 HA SER 9 -9.331 -6.636 -7.236 57 HB2 SER 9 1HB SER 9 -7.178 -4.498 -7.514 58 HB3 SER 9 2HB SER 9 -8.840 -4.364 -8.067 59 HG SER 9 HG SER 9 -8.698 -5.149 -5.459 60 H ILE 10 H ILE 10 -9.343 -5.558 -9.568 61 HA ILE 10 HA ILE 10 -7.817 -7.367 -11.355 62 HB ILE 10 HB ILE 10 -9.681 -5.017 -11.975 63 HG12 ILE 10 1HG1 ILE 10 -10.850 -6.912 -10.886 64 HG13 ILE 10 2HG1 ILE 10 -11.392 -6.593 -12.516 65 HG21 ILE 10 1HG2 ILE 10 -8.362 -7.049 -13.829 66 HG22 ILE 10 2HG2 ILE 10 -9.733 -5.988 -14.295 67 HG23 ILE 10 3HG2 ILE 10 -8.152 -5.266 -13.811 68 HD11 ILE 10 3HD1 ILE 10 -11.235 -9.017 -12.024 69 HD12 ILE 10 1HD1 ILE 10 -10.191 -8.522 -13.376 70 HD13 ILE 10 2HD1 ILE 10 -9.464 -8.808 -11.791 71 H CYS 11 H CYS 11 -5.777 -6.739 -12.050 72 HA CYS 11 HA CYS 11 -4.735 -4.179 -11.201 73 HB2 CYS 11 1HB CYS 11 -3.712 -6.325 -13.040 74 HB3 CYS 11 2HB CYS 11 -2.846 -4.833 -12.813 75 H SER 12 H SER 12 -5.121 -2.250 -12.107 76 HA SER 12 HA SER 12 -6.189 -1.935 -14.798 77 HB2 SER 12 1HB SER 12 -4.706 0.055 -13.012 78 HB3 SER 12 2HB SER 12 -5.752 0.458 -14.434 79 HG SER 12 HG SER 12 -7.490 0.029 -13.248 80 H LEU 13 H LEU 13 -5.057 -1.414 -16.695 81 HA LEU 13 HA LEU 13 -2.556 -2.530 -17.058 82 HB2 LEU 13 1HB LEU 13 -4.124 -2.040 -18.854 83 HB3 LEU 13 2HB LEU 13 -3.911 -0.313 -18.607 84 HG LEU 13 HG LEU 13 -1.544 -0.510 -19.322 85 HD11 LEU 13 1HD1 LEU 13 -2.194 -3.353 -20.030 86 HD12 LEU 13 2HD1 LEU 13 -1.053 -2.874 -18.786 87 HD13 LEU 13 3HD1 LEU 13 -0.736 -2.505 -20.480 88 HD21 LEU 13 3HD2 LEU 13 -3.610 -1.616 -21.246 89 HD22 LEU 13 1HD2 LEU 13 -2.035 -0.929 -21.736 90 HD23 LEU 13 2HD2 LEU 13 -3.238 0.103 -20.952 91 H TYR 14 H TYR 14 -3.339 0.919 -16.357 92 HA TYR 14 HA TYR 14 -0.641 1.850 -16.675 93 HB2 TYR 14 1HB TYR 14 -1.528 3.818 -15.298 94 HB3 TYR 14 2HB TYR 14 -2.249 3.491 -16.886 95 HD1 TYR 14 HD1 TYR 14 -2.861 3.361 -13.237 96 HD2 TYR 14 HD2 TYR 14 -4.563 2.844 -17.135 97 HE1 TYR 14 HE1 TYR 14 -5.146 3.331 -12.262 98 HE2 TYR 14 HE2 TYR 14 -6.820 2.826 -16.144 99 HH TYR 14 HH TYR 14 -7.382 3.233 -12.672 100 H GLN 15 H GLN 15 -2.353 0.490 -13.855 101 HA GLN 15 HA GLN 15 -0.148 1.209 -12.051 102 HB2 GLN 15 1HB GLN 15 -2.476 -0.688 -11.725 103 HB3 GLN 15 2HB GLN 15 -1.243 -0.426 -10.500 104 HG2 GLN 15 1HG GLN 15 -1.777 2.020 -10.618 105 HG3 GLN 15 2HG GLN 15 -3.184 1.594 -11.583 106 HE21 GLN 15 2HE2 GLN 15 -5.028 1.105 -10.490 107 HE22 GLN 15 1HE2 GLN 15 -5.084 0.738 -8.782 108 H LEU 16 H LEU 16 -0.990 -1.523 -14.146 109 HA LEU 16 HA LEU 16 1.099 -3.261 -13.193 110 HB2 LEU 16 1HB LEU 16 -0.849 -3.915 -14.689 111 HB3 LEU 16 2HB LEU 16 -0.061 -3.062 -16.000 112 HG LEU 16 HG LEU 16 1.135 -5.448 -14.532 113 HD11 LEU 16 1HD1 LEU 16 -0.802 -6.203 -15.580 114 HD12 LEU 16 2HD1 LEU 16 0.488 -6.599 -16.760 115 HD13 LEU 16 3HD1 LEU 16 -0.581 -5.172 -17.019 116 HD21 LEU 16 3HD2 LEU 16 2.914 -4.348 -15.621 117 HD22 LEU 16 1HD2 LEU 16 1.955 -3.975 -17.057 118 HD23 LEU 16 2HD2 LEU 16 2.518 -5.654 -16.686 119 H GLU 17 H GLU 17 0.885 -0.870 -15.939 120 HA GLU 17 HA GLU 17 3.599 -1.211 -16.750 121 HB2 GLU 17 1HB GLU 17 1.549 0.945 -17.114 122 HB3 GLU 17 2HB GLU 17 3.196 1.233 -17.586 123 HG2 GLU 17 1HG GLU 17 3.161 -0.803 -18.973 124 HG3 GLU 17 2HG GLU 17 1.426 -1.002 -18.582 125 H ASN 18 H ASN 18 2.212 0.642 -14.079 126 HA ASN 18 HA ASN 18 4.483 2.312 -13.610 127 HB2 ASN 18 1HB ASN 18 2.141 2.418 -12.548 128 HB3 ASN 18 2HB ASN 18 2.744 1.183 -11.417 129 HD21 ASN 18 2HD2 ASN 18 3.393 4.356 -12.764 130 HD22 ASN 18 1HD2 ASN 18 4.073 5.040 -11.334 131 H TYR 19 H TYR 19 4.162 -1.101 -13.158 132 HA TYR 19 HA TYR 19 6.364 -1.306 -11.202 133 HB2 TYR 19 1HB TYR 19 4.936 -3.438 -12.864 134 HB3 TYR 19 2HB TYR 19 6.188 -3.755 -11.676 135 HD1 TYR 19 HD2 TYR 19 5.468 -2.530 -9.202 136 HD2 TYR 19 HD1 TYR 19 2.860 -4.066 -12.243 137 HE1 TYR 19 HE2 TYR 19 3.707 -3.033 -7.488 138 HE2 TYR 19 HE1 TYR 19 1.153 -4.581 -10.535 139 HH TYR 19 HH TYR 19 1.630 -3.839 -7.105 140 H CYS 20 H CYS 20 5.857 -1.067 -14.634 141 HA CYS 20 HA CYS 20 8.296 -2.572 -15.309 142 HB2 CYS 20 1HB CYS 20 6.029 -2.557 -16.600 143 HB3 CYS 20 2HB CYS 20 6.548 -1.000 -17.216 144 H ASN 21 H ASN 21 9.635 -1.259 -17.066 145 HA ASN 21 HA ASN 21 10.256 1.481 -15.949 146 HB2 ASN 21 1HB ASN 21 11.997 -0.482 -17.485 147 HB3 ASN 21 2HB ASN 21 12.493 1.150 -16.977 148 HD21 ASN 21 2HD2 ASN 21 12.876 -1.978 -16.292 149 HD22 ASN 21 1HD2 ASN 21 13.180 -1.868 -14.603 150 H1 PHE 1 1H PHE 1 -2.765 -8.329 -23.189 151 H2 PHE 1 2H PHE 1 -1.241 -8.853 -22.790 152 H3 PHE 1 3H PHE 1 -2.480 -9.926 -22.907 153 HA PHE 1 HA PHE 1 -1.934 -9.460 -20.612 154 HB2 PHE 1 1HB PHE 1 -1.140 -7.171 -20.885 155 HB3 PHE 1 2HB PHE 1 -2.706 -6.612 -21.361 156 HD1 PHE 1 HD1 PHE 1 -1.677 -8.960 -18.633 157 HD2 PHE 1 HD2 PHE 1 -3.420 -5.155 -19.620 158 HE1 PHE 1 HE1 PHE 1 -2.320 -8.701 -16.318 159 HE2 PHE 1 HE2 PHE 1 -4.035 -4.831 -17.272 160 HZ PHE 1 HZ PHE 1 -3.484 -6.648 -15.588 161 H VAL 2 H VAL 2 -4.587 -7.275 -21.630 162 HA VAL 2 HA VAL 2 -6.795 -7.345 -21.303 163 HB VAL 2 HB VAL 2 -6.886 -10.355 -21.463 164 HG11 VAL 2 1HG1 VAL 2 -8.903 -9.903 -22.785 165 HG12 VAL 2 2HG1 VAL 2 -9.028 -9.034 -21.232 166 HG13 VAL 2 3HG1 VAL 2 -8.624 -8.154 -22.740 167 HG21 VAL 2 3HG2 VAL 2 -6.770 -10.089 -23.954 168 HG22 VAL 2 1HG2 VAL 2 -6.189 -8.444 -23.766 169 HG23 VAL 2 2HG2 VAL 2 -5.240 -9.816 -23.175 170 H ASN 3 H ASN 3 -5.619 -6.927 -18.991 171 HA ASN 3 HA ASN 3 -6.090 -6.705 -16.779 172 HB2 ASN 3 1HB ASN 3 -8.833 -7.587 -17.814 173 HB3 ASN 3 2HB ASN 3 -8.537 -6.855 -16.224 174 HD21 ASN 3 2HD2 ASN 3 -9.667 -6.172 -19.167 175 HD22 ASN 3 1HD2 ASN 3 -9.276 -4.475 -19.256 176 H GLN 4 H GLN 4 -8.538 -8.615 -15.879 177 HA GLN 4 HA GLN 4 -8.850 -10.518 -14.662 178 HB2 GLN 4 1HB GLN 4 -5.988 -11.351 -15.238 179 HB3 GLN 4 2HB GLN 4 -7.280 -12.352 -14.569 180 HG2 GLN 4 1HG GLN 4 -8.460 -12.424 -16.688 181 HG3 GLN 4 2HG GLN 4 -7.465 -11.085 -17.347 182 HE21 GLN 4 2HE2 GLN 4 -5.655 -11.506 -18.418 183 HE22 GLN 4 1HE2 GLN 4 -4.947 -13.088 -18.586 184 H HIS 5 H HIS 5 -8.098 -11.537 -12.543 185 HA HIS 5 HA HIS 5 -6.803 -9.536 -10.733 186 HB2 HIS 5 1HB HIS 5 -8.196 -12.210 -10.468 187 HB3 HIS 5 2HB HIS 5 -6.929 -11.788 -9.277 188 HD1 HIS 5 HD1 HIS 5 -10.306 -10.525 -10.433 189 HD2 HIS 5 HD2 HIS 5 -7.590 -10.038 -7.362 190 HE1 HIS 5 HE1 HIS 5 -11.468 -9.121 -8.668 191 H LEU 6 H LEU 6 -4.632 -9.963 -10.005 192 HA LEU 6 HA LEU 6 -3.276 -12.126 -11.584 193 HB2 LEU 6 1HB LEU 6 -2.214 -9.385 -10.884 194 HB3 LEU 6 2HB LEU 6 -1.353 -10.640 -11.793 195 HG LEU 6 HG LEU 6 -3.843 -9.178 -12.709 196 HD11 LEU 6 1HD1 LEU 6 -1.741 -7.864 -12.564 197 HD12 LEU 6 2HD1 LEU 6 -2.283 -8.094 -14.253 198 HD13 LEU 6 3HD1 LEU 6 -0.963 -9.052 -13.562 199 HD21 LEU 6 3HD2 LEU 6 -3.826 -11.399 -13.777 200 HD22 LEU 6 1HD2 LEU 6 -2.124 -11.199 -14.229 201 HD23 LEU 6 2HD2 LEU 6 -3.382 -10.165 -14.966 202 H CYS 7 H CYS 7 -3.975 -11.617 -8.412 203 HA CYS 7 HA CYS 7 -1.381 -11.641 -7.251 204 HB2 CYS 7 1HB CYS 7 -3.805 -11.349 -6.246 205 HB3 CYS 7 2HB CYS 7 -3.651 -13.092 -5.922 206 H GLY 8 H GLY 8 0.159 -13.160 -7.122 207 HA2 GLY 8 1HA GLY 8 0.782 -15.521 -6.678 208 HA3 GLY 8 2HA GLY 8 -0.555 -16.008 -7.733 209 H SER 9 H SER 9 0.995 -17.085 -9.104 210 HA SER 9 HA SER 9 3.234 -15.748 -10.301 211 HB2 SER 9 1HB SER 9 1.843 -17.998 -11.728 212 HB3 SER 9 2HB SER 9 3.560 -17.780 -11.344 213 HG SER 9 HG SER 9 2.979 -19.242 -9.877 214 H HIS 10 H HIS 10 -0.148 -15.404 -10.960 215 HA HIS 10 HA HIS 10 -0.092 -15.109 -13.763 216 HB2 HIS 10 1HB HIS 10 -1.789 -13.465 -11.946 217 HB3 HIS 10 2HB HIS 10 -2.216 -14.104 -13.532 218 HD1 HIS 10 HD1 HIS 10 -2.760 -14.692 -9.961 219 HD2 HIS 10 HD2 HIS 10 -2.437 -17.080 -13.391 220 HE1 HIS 10 HE1 HIS 10 -3.776 -16.903 -9.405 221 H LEU 11 H LEU 11 0.868 -12.913 -11.148 222 HA LEU 11 HA LEU 11 0.864 -10.475 -12.680 223 HB2 LEU 11 1HB LEU 11 1.052 -10.814 -10.136 224 HB3 LEU 11 2HB LEU 11 2.761 -11.092 -10.400 225 HG LEU 11 HG LEU 11 2.252 -8.733 -11.793 226 HD11 LEU 11 1HD1 LEU 11 1.028 -7.280 -10.243 227 HD12 LEU 11 2HD1 LEU 11 0.727 -8.659 -9.201 228 HD13 LEU 11 3HD1 LEU 11 0.006 -8.578 -10.815 229 HD21 LEU 11 3HD2 LEU 11 3.201 -9.075 -8.937 230 HD22 LEU 11 1HD2 LEU 11 3.473 -7.645 -9.935 231 HD23 LEU 11 2HD2 LEU 11 4.211 -9.212 -10.363 232 H VAL 12 H VAL 12 3.148 -13.127 -12.330 233 HA VAL 12 HA VAL 12 5.387 -11.730 -13.432 234 HB VAL 12 HB VAL 12 4.881 -14.740 -13.427 235 HG11 VAL 12 1HG1 VAL 12 7.493 -13.159 -13.727 236 HG12 VAL 12 2HG1 VAL 12 7.339 -14.922 -13.672 237 HG13 VAL 12 3HG1 VAL 12 6.666 -14.031 -15.032 238 HG21 VAL 12 3HG2 VAL 12 6.400 -13.000 -11.411 239 HG22 VAL 12 1HG2 VAL 12 4.805 -13.739 -11.153 240 HG23 VAL 12 2HG2 VAL 12 6.249 -14.782 -11.384 241 H GLU 13 H GLU 13 2.841 -13.856 -14.815 242 HA GLU 13 HA GLU 13 3.826 -13.751 -17.496 243 HB2 GLU 13 1HB GLU 13 1.031 -14.162 -16.428 244 HB3 GLU 13 2HB GLU 13 1.524 -14.403 -18.145 245 HG2 GLU 13 1HG GLU 13 3.060 -16.136 -17.450 246 HG3 GLU 13 2HG GLU 13 2.567 -15.942 -15.767 247 H ALA 14 H ALA 14 1.395 -11.814 -15.728 248 HA ALA 14 HA ALA 14 0.515 -10.094 -17.756 249 HB1 ALA 14 3HB ALA 14 -0.398 -10.266 -15.537 250 HB2 ALA 14 1HB ALA 14 1.068 -9.526 -14.857 251 HB3 ALA 14 2HB ALA 14 -0.005 -8.592 -15.973 252 H LEU 15 H LEU 15 3.296 -9.595 -15.481 253 HA LEU 15 HA LEU 15 4.151 -7.147 -16.564 254 HB2 LEU 15 1HB LEU 15 5.231 -9.236 -14.773 255 HB3 LEU 15 2HB LEU 15 6.448 -8.328 -15.621 256 HG LEU 15 HG LEU 15 6.063 -7.419 -13.434 257 HD11 LEU 15 1HD1 LEU 15 5.970 -5.110 -14.011 258 HD12 LEU 15 2HD1 LEU 15 5.059 -5.440 -15.486 259 HD13 LEU 15 3HD1 LEU 15 6.753 -5.956 -15.366 260 HD21 LEU 15 3HD2 LEU 15 4.030 -6.174 -12.869 261 HD22 LEU 15 1HD2 LEU 15 3.742 -7.894 -13.085 262 HD23 LEU 15 2HD2 LEU 15 3.251 -6.785 -14.359 263 H TYR 16 H TYR 16 5.072 -10.530 -17.353 264 HA TYR 16 HA TYR 16 7.155 -9.864 -19.150 265 HB2 TYR 16 1HB TYR 16 6.822 -12.157 -18.227 266 HB3 TYR 16 2HB TYR 16 5.303 -12.257 -19.089 267 HD1 TYR 16 HD2 TYR 16 8.986 -11.970 -19.542 268 HD2 TYR 16 HD1 TYR 16 5.227 -13.006 -21.372 269 HE1 TYR 16 HE2 TYR 16 10.222 -12.897 -21.527 270 HE2 TYR 16 HE1 TYR 16 6.499 -13.941 -23.359 271 HH TYR 16 HH TYR 16 8.501 -14.324 -24.319 272 H LEU 17 H LEU 17 3.663 -10.395 -19.655 273 HA LEU 17 HA LEU 17 3.698 -10.139 -22.469 274 HB2 LEU 17 1HB LEU 17 1.508 -9.704 -20.437 275 HB3 LEU 17 2HB LEU 17 1.235 -9.522 -22.164 276 HG LEU 17 HG LEU 17 2.225 -12.090 -20.887 277 HD11 LEU 17 1HD1 LEU 17 -0.038 -12.884 -21.068 278 HD12 LEU 17 2HD1 LEU 17 -0.595 -11.350 -21.726 279 HD13 LEU 17 3HD1 LEU 17 -0.003 -11.459 -20.058 280 HD21 LEU 17 3HD2 LEU 17 1.156 -11.451 -23.692 281 HD22 LEU 17 1HD2 LEU 17 1.408 -13.075 -23.040 282 HD23 LEU 17 2HD2 LEU 17 2.803 -12.016 -23.246 283 H VAL 18 H VAL 18 3.307 -7.679 -19.899 284 HA VAL 18 HA VAL 18 2.588 -5.668 -21.939 285 HB VAL 18 HB VAL 18 3.026 -5.448 -18.964 286 HG11 VAL 18 1HG1 VAL 18 3.376 -3.256 -19.943 287 HG12 VAL 18 2HG1 VAL 18 1.952 -3.439 -21.005 288 HG13 VAL 18 3HG1 VAL 18 1.704 -3.287 -19.239 289 HG21 VAL 18 3HG2 VAL 18 0.494 -5.255 -18.954 290 HG22 VAL 18 1HG2 VAL 18 0.503 -5.641 -20.673 291 HG23 VAL 18 2HG2 VAL 18 1.075 -6.833 -19.489 292 H CYS 19 H CYS 19 5.428 -6.368 -19.847 293 HA CYS 19 HA CYS 19 6.938 -4.138 -21.013 294 HB2 CYS 19 1HB CYS 19 7.916 -6.596 -19.486 295 HB3 CYS 19 2HB CYS 19 8.867 -5.130 -19.833 296 H GLY 20 H GLY 20 5.819 -6.982 -22.311 297 HA2 GLY 20 1HA GLY 20 6.191 -7.890 -24.384 298 HA3 GLY 20 2HA GLY 20 7.560 -6.790 -24.590 299 H GLU 21 H GLU 21 9.391 -7.431 -22.817 300 HA GLU 21 HA GLU 21 9.899 -10.365 -23.258 301 HB2 GLU 21 1HB GLU 21 11.856 -8.085 -23.656 302 HB3 GLU 21 2HB GLU 21 12.272 -9.787 -23.795 303 HG2 GLU 21 1HG GLU 21 10.624 -10.007 -25.623 304 HG3 GLU 21 2HG GLU 21 10.350 -8.259 -25.571 305 H ARG 22 H ARG 22 10.887 -7.440 -21.463 306 HA ARG 22 HA ARG 22 11.403 -8.969 -19.002 307 HB2 ARG 22 1HB ARG 22 13.775 -8.450 -18.857 308 HB3 ARG 22 2HB ARG 22 13.471 -9.359 -20.336 309 HG2 ARG 22 1HG ARG 22 13.396 -7.136 -21.591 310 HG3 ARG 22 2HG ARG 22 14.091 -6.425 -20.095 311 HD2 ARG 22 1HD ARG 22 15.284 -8.709 -21.706 312 HD3 ARG 22 2HD ARG 22 15.815 -7.044 -21.803 313 HE ARG 22 HE ARG 22 16.295 -7.345 -19.270 314 HH11 ARG 22 1HH1 ARG 22 16.612 -9.883 -21.683 315 HH12 ARG 22 2HH1 ARG 22 17.807 -10.761 -20.772 316 HH21 ARG 22 1HH2 ARG 22 17.832 -8.485 -18.124 317 HH22 ARG 22 2HH2 ARG 22 18.510 -9.954 -18.796 318 H GLY 23 H GLY 23 12.231 -7.420 -17.254 319 HA2 GLY 23 1HA GLY 23 12.592 -4.841 -17.092 320 HA3 GLY 23 2HA GLY 23 10.925 -4.755 -17.736 321 H PHE 24 H PHE 24 11.569 -7.418 -15.586 322 HA PHE 24 HA PHE 24 10.396 -5.950 -13.317 323 HB2 PHE 24 1HB PHE 24 8.812 -7.848 -12.978 324 HB3 PHE 24 2HB PHE 24 8.475 -6.850 -14.407 325 HD1 PHE 24 HD1 PHE 24 8.971 -7.740 -16.687 326 HD2 PHE 24 HD2 PHE 24 9.455 -10.207 -13.176 327 HE1 PHE 24 HE1 PHE 24 8.952 -9.741 -18.135 328 HE2 PHE 24 HE2 PHE 24 9.397 -12.251 -14.596 329 HZ PHE 24 HZ PHE 24 9.182 -12.011 -17.111 330 H PHE 25 H PHE 25 11.941 -8.934 -14.392 331 HA PHE 25 HA PHE 25 13.302 -10.460 -13.437 332 HB2 PHE 25 1HB PHE 25 14.673 -8.430 -12.950 333 HB3 PHE 25 2HB PHE 25 13.982 -8.405 -11.336 334 HD1 PHE 25 HD1 PHE 25 16.088 -10.380 -13.668 335 HD2 PHE 25 HD2 PHE 25 14.691 -9.945 -9.629 336 HE1 PHE 25 HE1 PHE 25 17.774 -12.013 -12.947 337 HE2 PHE 25 HE2 PHE 25 16.391 -11.571 -8.872 338 HZ PHE 25 HZ PHE 25 17.929 -12.634 -10.509 339 H NVA 26 H ARX 26 11.892 -11.953 -12.910 340 HA NVA 26 HA ARX 26 10.730 -12.160 -10.259 341 HB2 NVA 26 1HB ARX 26 9.435 -12.921 -12.296 342 HB3 NVA 26 2HB ARX 26 10.669 -14.096 -12.643 343 HG2 NVA 26 1HG ARX 26 9.975 -14.638 -9.902 344 HG3 NVA 26 2HG ARX 26 8.450 -14.161 -10.664 345 HD2 NVA 26 1HD ARX 26 8.514 -15.962 -12.295 346 HD3 NVA 26 2HD ARX 26 10.222 -16.338 -11.887 347 H THR 27 H THR 27 11.871 -12.640 -8.638 348 HA THR 27 HA THR 27 14.435 -13.969 -8.593 349 HB THR 27 HB THR 27 13.801 -14.010 -6.019 350 HG1 THR 27 HG1 THR 27 11.911 -13.057 -5.527 351 HG21 THR 27 1HG2 THR 27 13.701 -11.298 -7.513 352 HG22 THR 27 2HG2 THR 27 15.201 -12.143 -7.047 353 HG23 THR 27 3HG2 THR 27 14.109 -11.567 -5.775 354 HA PRO 28 HA PRO 28 12.944 -18.004 -8.833 355 HB2 PRO 28 1HB PRO 28 14.069 -19.564 -6.865 356 HB3 PRO 28 2HB PRO 28 14.975 -18.943 -8.277 357 HG2 PRO 28 1HG PRO 28 14.751 -17.788 -5.502 358 HG3 PRO 28 2HG PRO 28 16.254 -18.131 -6.435 359 HD2 PRO 28 1HD PRO 28 15.238 -15.671 -6.377 360 HD3 PRO 28 2HD PRO 28 15.844 -16.332 -7.946 361 H HIX 29 H HIX 29 11.311 -19.337 -8.425 362 HA HIX 29 HA HIX 29 9.936 -19.541 -5.858 363 HB1 HIX 29 1HB HIX 29 7.720 -18.943 -6.805 364 HB2 HIX 29 2HB HIX 29 8.783 -17.585 -6.495 365 HD2 HIX 29 HD2 HIX 29 10.153 -16.735 -8.829 366 HD1 HIX 29 HD1 HIX 29 6.647 -18.910 -9.209 367 HE1 HIX 29 HE1 HIX 29 8.118 -18.630 -11.303 368 H THR 30 H THR 30 10.323 -21.623 -5.730 369 HA THR 30 HA THR 30 8.808 -23.457 -7.492 370 HB THR 30 HB THR 30 11.707 -23.982 -6.614 371 HG1 THR 30 HG1 THR 30 11.886 -23.770 -9.073 372 HG21 THR 30 1HG2 THR 30 10.257 -25.941 -7.008 373 HG22 THR 30 2HG2 THR 30 11.554 -25.798 -8.183 374 HG23 THR 30 3HG2 THR 30 9.929 -25.364 -8.645 Start of MODEL 10 1 H1 GLY 1 1H GLY 1 -0.535 -1.134 -0.037 2 H2 GLY 1 2H GLY 1 0.712 -2.170 0.048 3 H3 GLY 1 3H GLY 1 0.785 -0.773 0.847 4 HA2 GLY 1 1HA GLY 1 0.994 0.530 -1.171 5 HA3 GLY 1 2HA GLY 1 2.227 -0.740 -1.158 6 H ILE 2 H ILE 2 2.092 -0.171 -3.638 7 HA ILE 2 HA ILE 2 -0.221 -0.796 -5.115 8 HB ILE 2 HB ILE 2 1.825 0.484 -5.903 9 HG12 ILE 2 1HG1 ILE 2 0.783 -1.759 -7.696 10 HG13 ILE 2 2HG1 ILE 2 -0.086 -0.307 -7.246 11 HG21 ILE 2 1HG2 ILE 2 3.725 -0.696 -6.892 12 HG22 ILE 2 2HG2 ILE 2 3.594 -1.177 -5.173 13 HG23 ILE 2 3HG2 ILE 2 3.034 -2.290 -6.456 14 HD11 ILE 2 3HD1 ILE 2 1.743 1.039 -8.316 15 HD12 ILE 2 1HD1 ILE 2 2.450 -0.529 -8.884 16 HD13 ILE 2 2HD1 ILE 2 0.817 -0.006 -9.440 17 H VAL 3 H VAL 3 2.340 -2.983 -4.003 18 HA VAL 3 HA VAL 3 1.654 -5.239 -5.561 19 HB VAL 3 HB VAL 3 2.634 -5.132 -2.713 20 HG11 VAL 3 1HG1 VAL 3 1.828 -7.437 -3.243 21 HG12 VAL 3 2HG1 VAL 3 2.717 -7.415 -4.756 22 HG13 VAL 3 3HG1 VAL 3 3.576 -7.451 -3.231 23 HG21 VAL 3 3HG2 VAL 3 4.185 -3.932 -4.312 24 HG22 VAL 3 1HG2 VAL 3 4.926 -5.394 -3.714 25 HG23 VAL 3 2HG2 VAL 3 4.191 -5.370 -5.336 26 H GLU 4 H GLU 4 0.393 -4.378 -2.216 27 HA GLU 4 HA GLU 4 -1.349 -6.642 -2.217 28 HB2 GLU 4 1HB GLU 4 -1.558 -4.011 -0.801 29 HB3 GLU 4 2HB GLU 4 -2.629 -5.381 -0.491 30 HG2 GLU 4 1HG GLU 4 -0.620 -6.704 0.232 31 HG3 GLU 4 2HG GLU 4 0.418 -5.293 -0.183 32 H GLN 5 H GLN 5 -1.775 -3.309 -3.417 33 HA GLN 5 HA GLN 5 -4.580 -3.521 -3.767 34 HB2 GLN 5 1HB GLN 5 -2.462 -1.749 -4.981 35 HB3 GLN 5 2HB GLN 5 -4.144 -1.579 -5.421 36 HG2 GLN 5 1HG GLN 5 -4.816 -1.150 -3.119 37 HG3 GLN 5 2HG GLN 5 -3.094 -1.286 -2.602 38 HE21 GLN 5 2HE2 GLN 5 -5.334 0.989 -2.884 39 HE22 GLN 5 1HE2 GLN 5 -4.350 2.321 -3.534 40 H CYS 6 H CYS 6 -1.857 -4.151 -6.055 41 HA CYS 6 HA CYS 6 -3.681 -4.729 -8.274 42 HB2 CYS 6 1HB CYS 6 -1.218 -3.904 -8.146 43 HB3 CYS 6 2HB CYS 6 -0.755 -5.602 -7.976 44 H CYS 7 H CYS 7 -2.140 -6.604 -5.634 45 HA CYS 7 HA CYS 7 -2.722 -9.181 -6.670 46 HB2 CYS 7 1HB CYS 7 -1.304 -9.190 -4.758 47 HB3 CYS 7 2HB CYS 7 -2.320 -8.038 -3.920 48 H THR 8 H THR 8 -4.558 -7.112 -4.346 49 HA THR 8 HA THR 8 -6.772 -9.052 -4.451 50 HB THR 8 HB THR 8 -7.085 -6.345 -3.206 51 HG1 THR 8 HG1 THR 8 -4.911 -6.997 -2.691 52 HG21 THR 8 1HG2 THR 8 -8.040 -7.700 -1.388 53 HG22 THR 8 2HG2 THR 8 -7.600 -9.186 -2.267 54 HG23 THR 8 3HG2 THR 8 -8.829 -8.082 -2.932 55 H SER 9 H SER 9 -6.213 -7.921 -7.031 56 HA SER 9 HA SER 9 -8.859 -6.858 -7.768 57 HB2 SER 9 1HB SER 9 -7.472 -4.943 -6.940 58 HB3 SER 9 2HB SER 9 -6.354 -5.223 -8.230 59 HG SER 9 HG SER 9 -8.201 -3.606 -8.432 60 H ILE 10 H ILE 10 -9.242 -6.647 -10.000 61 HA ILE 10 HA ILE 10 -7.814 -8.266 -11.944 62 HB ILE 10 HB ILE 10 -9.729 -5.874 -12.362 63 HG12 ILE 10 1HG1 ILE 10 -10.791 -7.728 -11.147 64 HG13 ILE 10 2HG1 ILE 10 -11.493 -7.478 -12.732 65 HG21 ILE 10 1HG2 ILE 10 -8.358 -6.309 -14.371 66 HG22 ILE 10 2HG2 ILE 10 -8.904 -7.994 -14.373 67 HG23 ILE 10 3HG2 ILE 10 -10.081 -6.677 -14.653 68 HD11 ILE 10 3HD1 ILE 10 -11.044 -9.916 -11.803 69 HD12 ILE 10 1HD1 ILE 10 -10.806 -9.529 -13.536 70 HD13 ILE 10 2HD1 ILE 10 -9.402 -9.641 -12.437 71 H CYS 11 H CYS 11 -7.408 -5.094 -10.437 72 HA CYS 11 HA CYS 11 -5.756 -3.468 -10.600 73 HB2 CYS 11 1HB CYS 11 -4.359 -5.769 -10.774 74 HB3 CYS 11 2HB CYS 11 -4.120 -5.259 -12.448 75 H SER 12 H SER 12 -4.214 -2.546 -12.671 76 HA SER 12 HA SER 12 -6.064 -2.376 -15.071 77 HB2 SER 12 1HB SER 12 -5.087 -0.036 -13.444 78 HB3 SER 12 2HB SER 12 -5.788 0.096 -15.015 79 HG SER 12 HG SER 12 -7.320 -1.487 -13.409 80 H LEU 13 H LEU 13 -5.072 -1.476 -17.066 81 HA LEU 13 HA LEU 13 -2.381 -2.484 -17.407 82 HB2 LEU 13 1HB LEU 13 -4.098 -1.957 -19.200 83 HB3 LEU 13 2HB LEU 13 -3.648 -0.252 -19.027 84 HG LEU 13 HG LEU 13 -1.318 -0.719 -19.657 85 HD11 LEU 13 1HD1 LEU 13 -2.236 -3.611 -20.010 86 HD12 LEU 13 2HD1 LEU 13 -0.874 -2.952 -19.050 87 HD13 LEU 13 3HD1 LEU 13 -0.837 -2.914 -20.851 88 HD21 LEU 13 3HD2 LEU 13 -3.025 -0.054 -21.256 89 HD22 LEU 13 1HD2 LEU 13 -3.366 -1.777 -21.624 90 HD23 LEU 13 2HD2 LEU 13 -1.783 -1.063 -21.990 91 H TYR 14 H TYR 14 -3.412 0.948 -16.781 92 HA TYR 14 HA TYR 14 -0.726 1.939 -17.064 93 HB2 TYR 14 1HB TYR 14 -1.692 3.788 -15.542 94 HB3 TYR 14 2HB TYR 14 -2.325 3.570 -17.197 95 HD1 TYR 14 HD1 TYR 14 -3.077 3.216 -13.619 96 HD2 TYR 14 HD2 TYR 14 -4.678 2.798 -17.588 97 HE1 TYR 14 HE1 TYR 14 -5.438 3.136 -12.683 98 HE2 TYR 14 HE2 TYR 14 -7.034 2.763 -16.557 99 HH TYR 14 HH TYR 14 -7.631 2.708 -13.083 100 H GLN 15 H GLN 15 -2.546 0.526 -14.292 101 HA GLN 15 HA GLN 15 -0.571 1.311 -12.280 102 HB2 GLN 15 1HB GLN 15 -2.470 -1.074 -12.283 103 HB3 GLN 15 2HB GLN 15 -1.594 -0.461 -10.887 104 HG2 GLN 15 1HG GLN 15 -2.860 1.667 -10.984 105 HG3 GLN 15 2HG GLN 15 -3.820 1.031 -12.327 106 HE21 GLN 15 2HE2 GLN 15 -3.690 1.487 -9.002 107 HE22 GLN 15 1HE2 GLN 15 -4.857 0.269 -8.486 108 H LEU 16 H LEU 16 -0.985 -1.490 -14.418 109 HA LEU 16 HA LEU 16 1.161 -3.041 -13.310 110 HB2 LEU 16 1HB LEU 16 -0.777 -3.780 -14.664 111 HB3 LEU 16 2HB LEU 16 -0.026 -3.061 -16.090 112 HG LEU 16 HG LEU 16 0.958 -5.487 -14.558 113 HD11 LEU 16 1HD1 LEU 16 -0.556 -4.871 -17.085 114 HD12 LEU 16 2HD1 LEU 16 -0.918 -6.022 -15.742 115 HD13 LEU 16 3HD1 LEU 16 0.381 -6.381 -16.924 116 HD21 LEU 16 3HD2 LEU 16 2.219 -3.915 -16.807 117 HD22 LEU 16 1HD2 LEU 16 2.440 -5.667 -16.675 118 HD23 LEU 16 2HD2 LEU 16 2.950 -4.613 -15.336 119 H GLU 17 H GLU 17 0.966 -0.642 -15.965 120 HA GLU 17 HA GLU 17 3.702 -0.988 -16.786 121 HB2 GLU 17 1HB GLU 17 1.643 1.249 -17.103 122 HB3 GLU 17 2HB GLU 17 3.340 1.502 -17.574 123 HG2 GLU 17 1HG GLU 17 3.236 -0.487 -18.939 124 HG3 GLU 17 2HG GLU 17 1.549 -0.681 -18.590 125 H ASN 18 H ASN 18 2.180 0.800 -14.163 126 HA ASN 18 HA ASN 18 4.369 2.518 -13.604 127 HB2 ASN 18 1HB ASN 18 1.819 1.875 -12.483 128 HB3 ASN 18 2HB ASN 18 3.026 1.791 -11.202 129 HD21 ASN 18 2HD2 ASN 18 0.853 3.751 -12.689 130 HD22 ASN 18 1HD2 ASN 18 1.639 5.305 -12.428 131 H TYR 19 H TYR 19 4.173 -0.954 -13.192 132 HA TYR 19 HA TYR 19 6.129 -1.029 -11.036 133 HB2 TYR 19 1HB TYR 19 4.996 -3.116 -12.929 134 HB3 TYR 19 2HB TYR 19 6.344 -3.506 -11.836 135 HD1 TYR 19 HD2 TYR 19 2.778 -2.541 -11.982 136 HD2 TYR 19 HD1 TYR 19 5.999 -3.899 -9.460 137 HE1 TYR 19 HE2 TYR 19 1.109 -3.175 -10.256 138 HE2 TYR 19 HE1 TYR 19 4.285 -4.456 -7.717 139 HH TYR 19 HH TYR 19 1.989 -4.550 -7.194 140 H CYS 20 H CYS 20 6.107 -0.855 -14.546 141 HA CYS 20 HA CYS 20 8.788 -2.034 -14.785 142 HB2 CYS 20 1HB CYS 20 6.977 -0.764 -16.923 143 HB3 CYS 20 2HB CYS 20 8.439 -1.712 -17.204 144 H ASN 21 H ASN 21 10.637 -0.999 -15.374 145 HA ASN 21 HA ASN 21 10.909 1.743 -14.442 146 HB2 ASN 21 1HB ASN 21 12.875 -0.299 -15.541 147 HB3 ASN 21 2HB ASN 21 13.340 1.354 -15.055 148 HD21 ASN 21 2HD2 ASN 21 14.181 -1.158 -13.991 149 HD22 ASN 21 1HD2 ASN 21 13.733 -1.109 -12.315 150 H1 PHE 1 1H PHE 1 -1.058 -8.313 -23.088 151 H2 PHE 1 2H PHE 1 -1.573 -9.836 -23.085 152 H3 PHE 1 3H PHE 1 -2.674 -8.622 -23.327 153 HA PHE 1 HA PHE 1 -1.182 -9.247 -20.881 154 HB2 PHE 1 1HB PHE 1 -1.340 -6.835 -21.125 155 HB3 PHE 1 2HB PHE 1 -3.045 -6.906 -21.549 156 HD1 PHE 1 HD2 PHE 1 -1.256 -8.661 -18.827 157 HD2 PHE 1 HD1 PHE 1 -4.111 -5.697 -19.900 158 HE1 PHE 1 HE2 PHE 1 -1.946 -8.531 -16.485 159 HE2 PHE 1 HE1 PHE 1 -4.778 -5.428 -17.483 160 HZ PHE 1 HZ PHE 1 -3.721 -6.913 -15.797 161 H VAL 2 H VAL 2 -4.619 -8.417 -21.746 162 HA VAL 2 HA VAL 2 -6.594 -9.491 -21.320 163 HB VAL 2 HB VAL 2 -5.058 -12.068 -20.695 164 HG11 VAL 2 1HG1 VAL 2 -7.204 -13.219 -21.018 165 HG12 VAL 2 2HG1 VAL 2 -7.425 -12.000 -19.750 166 HG13 VAL 2 3HG1 VAL 2 -8.043 -11.694 -21.396 167 HG21 VAL 2 3HG2 VAL 2 -6.325 -11.053 -23.318 168 HG22 VAL 2 1HG2 VAL 2 -4.621 -11.453 -23.034 169 HG23 VAL 2 2HG2 VAL 2 -5.826 -12.737 -23.030 170 H ASN 3 H ASN 3 -7.162 -8.173 -19.721 171 HA ASN 3 HA ASN 3 -5.952 -8.076 -17.166 172 HB2 ASN 3 1HB ASN 3 -7.889 -6.752 -16.609 173 HB3 ASN 3 2HB ASN 3 -7.492 -6.434 -18.299 174 HD21 ASN 3 2HD2 ASN 3 -8.994 -7.094 -19.947 175 HD22 ASN 3 1HD2 ASN 3 -10.610 -7.671 -19.526 176 H GLN 4 H GLN 4 -6.239 -9.217 -15.235 177 HA GLN 4 HA GLN 4 -8.435 -10.975 -14.714 178 HB2 GLN 4 1HB GLN 4 -7.148 -13.091 -14.590 179 HB3 GLN 4 2HB GLN 4 -7.207 -12.484 -16.252 180 HG2 GLN 4 1HG GLN 4 -4.899 -11.479 -15.895 181 HG3 GLN 4 2HG GLN 4 -4.808 -12.315 -14.347 182 HE21 GLN 4 2HE2 GLN 4 -3.170 -12.462 -16.746 183 HE22 GLN 4 1HE2 GLN 4 -3.183 -14.175 -17.157 184 H HIS 5 H HIS 5 -7.774 -12.067 -12.440 185 HA HIS 5 HA HIS 5 -6.658 -9.931 -10.788 186 HB2 HIS 5 1HB HIS 5 -7.775 -12.673 -10.274 187 HB3 HIS 5 2HB HIS 5 -6.512 -12.118 -9.151 188 HD1 HIS 5 HD1 HIS 5 -9.889 -10.806 -10.444 189 HD2 HIS 5 HD2 HIS 5 -7.312 -10.525 -7.190 190 HE1 HIS 5 HE1 HIS 5 -11.069 -9.415 -8.703 191 H LEU 6 H LEU 6 -4.611 -9.684 -9.928 192 HA LEU 6 HA LEU 6 -2.655 -11.528 -11.230 193 HB2 LEU 6 1HB LEU 6 -2.392 -8.655 -10.399 194 HB3 LEU 6 2HB LEU 6 -1.141 -9.623 -11.208 195 HG LEU 6 HG LEU 6 -3.778 -8.654 -12.336 196 HD11 LEU 6 1HD1 LEU 6 -2.076 -6.993 -12.105 197 HD12 LEU 6 2HD1 LEU 6 -2.216 -7.435 -13.829 198 HD13 LEU 6 3HD1 LEU 6 -0.847 -8.039 -12.818 199 HD21 LEU 6 3HD2 LEU 6 -2.871 -9.544 -14.548 200 HD22 LEU 6 1HD2 LEU 6 -3.350 -10.817 -13.380 201 HD23 LEU 6 2HD2 LEU 6 -1.626 -10.435 -13.605 202 H CYS 7 H CYS 7 -3.796 -11.855 -8.426 203 HA CYS 7 HA CYS 7 -1.590 -11.110 -6.718 204 HB2 CYS 7 1HB CYS 7 -4.015 -11.522 -6.017 205 HB3 CYS 7 2HB CYS 7 -3.507 -13.230 -5.968 206 H GLY 8 H GLY 8 -2.398 -14.167 -8.368 207 HA2 GLY 8 1HA GLY 8 -0.246 -15.607 -7.053 208 HA3 GLY 8 2HA GLY 8 -1.358 -16.240 -8.300 209 H SER 9 H SER 9 0.350 -17.249 -9.504 210 HA SER 9 HA SER 9 2.729 -15.838 -10.249 211 HB2 SER 9 1HB SER 9 2.392 -18.353 -10.267 212 HB3 SER 9 2HB SER 9 1.336 -18.119 -11.720 213 HG SER 9 HG SER 9 3.986 -18.408 -11.659 214 H HIS 10 H HIS 10 -0.440 -15.309 -11.166 215 HA HIS 10 HA HIS 10 -0.310 -14.640 -13.951 216 HB2 HIS 10 1HB HIS 10 -2.087 -13.481 -11.768 217 HB3 HIS 10 2HB HIS 10 -2.259 -13.187 -13.497 218 HD1 HIS 10 HD1 HIS 10 -4.599 -14.395 -12.114 219 HD2 HIS 10 HD2 HIS 10 -1.589 -16.721 -13.795 220 HE1 HIS 10 HE1 HIS 10 -5.649 -16.677 -12.608 221 H LEU 11 H LEU 11 0.762 -12.875 -11.025 222 HA LEU 11 HA LEU 11 1.058 -10.305 -12.332 223 HB2 LEU 11 1HB LEU 11 1.225 -10.774 -9.849 224 HB3 LEU 11 2HB LEU 11 2.777 -11.492 -10.144 225 HG LEU 11 HG LEU 11 3.671 -9.291 -10.878 226 HD11 LEU 11 1HD1 LEU 11 0.947 -8.106 -10.121 227 HD12 LEU 11 2HD1 LEU 11 1.551 -8.314 -11.775 228 HD13 LEU 11 3HD1 LEU 11 2.409 -7.239 -10.674 229 HD21 LEU 11 3HD2 LEU 11 3.679 -9.995 -8.448 230 HD22 LEU 11 1HD2 LEU 11 2.219 -9.044 -8.203 231 HD23 LEU 11 2HD2 LEU 11 3.721 -8.246 -8.699 232 H VAL 12 H VAL 12 3.227 -13.191 -12.195 233 HA VAL 12 HA VAL 12 5.388 -11.879 -13.385 234 HB VAL 12 HB VAL 12 4.732 -14.897 -13.440 235 HG11 VAL 12 1HG1 VAL 12 7.415 -13.504 -13.745 236 HG12 VAL 12 2HG1 VAL 12 7.052 -15.265 -13.884 237 HG13 VAL 12 3HG1 VAL 12 6.435 -14.132 -15.120 238 HG21 VAL 12 3HG2 VAL 12 4.834 -14.126 -11.154 239 HG22 VAL 12 1HG2 VAL 12 6.390 -14.904 -11.480 240 HG23 VAL 12 2HG2 VAL 12 6.266 -13.127 -11.492 241 H GLU 13 H GLU 13 2.763 -13.877 -14.737 242 HA GLU 13 HA GLU 13 3.469 -13.735 -17.444 243 HB2 GLU 13 1HB GLU 13 0.693 -13.837 -16.147 244 HB3 GLU 13 2HB GLU 13 1.103 -14.317 -17.827 245 HG2 GLU 13 1HG GLU 13 2.781 -15.710 -15.881 246 HG3 GLU 13 2HG GLU 13 1.026 -16.000 -15.610 247 H ALA 14 H ALA 14 1.427 -11.473 -15.456 248 HA ALA 14 HA ALA 14 0.547 -9.921 -17.654 249 HB1 ALA 14 3HB ALA 14 -0.353 -9.877 -15.388 250 HB2 ALA 14 1HB ALA 14 1.133 -9.111 -14.773 251 HB3 ALA 14 2HB ALA 14 0.045 -8.259 -15.912 252 H LEU 15 H LEU 15 3.418 -9.579 -15.532 253 HA LEU 15 HA LEU 15 4.338 -7.154 -16.781 254 HB2 LEU 15 1HB LEU 15 5.762 -9.290 -15.079 255 HB3 LEU 15 2HB LEU 15 6.542 -7.773 -15.594 256 HG LEU 15 HG LEU 15 3.944 -7.654 -14.030 257 HD11 LEU 15 1HD1 LEU 15 5.265 -8.992 -12.620 258 HD12 LEU 15 2HD1 LEU 15 5.401 -7.330 -12.012 259 HD13 LEU 15 3HD1 LEU 15 6.741 -8.059 -12.961 260 HD21 LEU 15 3HD2 LEU 15 6.384 -5.782 -14.113 261 HD22 LEU 15 1HD2 LEU 15 4.801 -5.473 -13.351 262 HD23 LEU 15 2HD2 LEU 15 4.906 -5.568 -15.103 263 H TYR 16 H TYR 16 4.875 -10.615 -17.377 264 HA TYR 16 HA TYR 16 7.059 -10.369 -19.213 265 HB2 TYR 16 1HB TYR 16 6.351 -12.499 -18.140 266 HB3 TYR 16 2HB TYR 16 4.847 -12.449 -19.074 267 HD1 TYR 16 HD1 TYR 16 8.563 -12.438 -19.546 268 HD2 TYR 16 HD2 TYR 16 4.738 -13.457 -21.236 269 HE1 TYR 16 HE1 TYR 16 9.729 -13.504 -21.510 270 HE2 TYR 16 HE2 TYR 16 5.950 -14.608 -23.141 271 HH TYR 16 HH TYR 16 9.451 -15.010 -23.286 272 H LEU 17 H LEU 17 3.521 -10.473 -19.674 273 HA LEU 17 HA LEU 17 3.800 -10.257 -22.509 274 HB2 LEU 17 1HB LEU 17 1.463 -9.824 -20.670 275 HB3 LEU 17 2HB LEU 17 1.284 -9.750 -22.423 276 HG LEU 17 HG LEU 17 2.413 -12.171 -21.055 277 HD11 LEU 17 1HD1 LEU 17 0.180 -13.187 -21.045 278 HD12 LEU 17 2HD1 LEU 17 -0.534 -11.636 -21.596 279 HD13 LEU 17 3HD1 LEU 17 0.244 -11.737 -19.993 280 HD21 LEU 17 3HD2 LEU 17 0.991 -11.827 -23.695 281 HD22 LEU 17 1HD2 LEU 17 1.601 -13.352 -23.029 282 HD23 LEU 17 2HD2 LEU 17 2.747 -12.030 -23.456 283 H VAL 18 H VAL 18 3.186 -7.719 -19.989 284 HA VAL 18 HA VAL 18 2.570 -5.760 -22.069 285 HB VAL 18 HB VAL 18 2.934 -5.487 -19.043 286 HG11 VAL 18 1HG1 VAL 18 1.807 -3.279 -19.253 287 HG12 VAL 18 2HG1 VAL 18 3.410 -3.309 -19.995 288 HG13 VAL 18 3HG1 VAL 18 1.973 -3.387 -21.019 289 HG21 VAL 18 3HG2 VAL 18 0.462 -5.467 -20.742 290 HG22 VAL 18 1HG2 VAL 18 1.052 -6.847 -19.801 291 HG23 VAL 18 2HG2 VAL 18 0.536 -5.371 -18.979 292 H CYS 19 H CYS 19 5.319 -6.452 -19.896 293 HA CYS 19 HA CYS 19 6.809 -4.192 -21.183 294 HB2 CYS 19 1HB CYS 19 7.177 -5.498 -18.407 295 HB3 CYS 19 2HB CYS 19 8.182 -4.219 -19.151 296 H GLY 20 H GLY 20 6.501 -7.394 -21.754 297 HA2 GLY 20 1HA GLY 20 7.860 -8.665 -23.000 298 HA3 GLY 20 2HA GLY 20 8.895 -7.228 -23.191 299 H GLU 21 H GLU 21 8.388 -8.532 -20.012 300 HA GLU 21 HA GLU 21 9.719 -9.475 -18.466 301 HB2 GLU 21 1HB GLU 21 10.205 -11.099 -20.582 302 HB3 GLU 21 2HB GLU 21 11.832 -10.412 -20.336 303 HG2 GLU 21 1HG GLU 21 11.822 -11.125 -17.994 304 HG3 GLU 21 2HG GLU 21 10.194 -11.774 -18.214 305 H ARG 22 H ARG 22 10.551 -6.878 -20.308 306 HA ARG 22 HA ARG 22 13.257 -6.500 -19.094 307 HB2 ARG 22 1HB ARG 22 11.612 -4.782 -20.944 308 HB3 ARG 22 2HB ARG 22 13.222 -4.422 -20.352 309 HG2 ARG 22 1HG ARG 22 14.074 -6.453 -21.439 310 HG3 ARG 22 2HG ARG 22 12.423 -6.899 -21.877 311 HD2 ARG 22 1HD ARG 22 12.240 -4.772 -23.187 312 HD3 ARG 22 2HD ARG 22 13.945 -4.458 -22.803 313 HE ARG 22 HE ARG 22 13.749 -7.083 -23.845 314 HH11 ARG 22 1HH1 ARG 22 13.453 -3.795 -25.024 315 HH12 ARG 22 2HH1 ARG 22 13.851 -4.175 -26.667 316 HH21 ARG 22 1HH2 ARG 22 14.277 -7.593 -25.927 317 HH22 ARG 22 2HH2 ARG 22 14.334 -6.320 -27.129 318 H GLY 23 H GLY 23 10.139 -6.168 -18.110 319 HA2 GLY 23 1HA GLY 23 10.622 -3.663 -16.586 320 HA3 GLY 23 2HA GLY 23 9.072 -4.483 -16.825 321 H PHE 24 H PHE 24 11.161 -6.975 -16.117 322 HA PHE 24 HA PHE 24 11.453 -6.484 -13.275 323 HB2 PHE 24 1HB PHE 24 9.906 -8.056 -12.418 324 HB3 PHE 24 2HB PHE 24 8.973 -7.081 -13.583 325 HD1 PHE 24 HD2 PHE 24 8.785 -8.070 -15.980 326 HD2 PHE 24 HD1 PHE 24 9.854 -10.368 -12.522 327 HE1 PHE 24 HE2 PHE 24 8.096 -10.190 -17.184 328 HE2 PHE 24 HE1 PHE 24 9.285 -12.467 -13.769 329 HZ PHE 24 HZ PHE 24 8.416 -12.343 -16.096 330 H PHE 25 H PHE 25 12.326 -8.465 -12.170 331 HA PHE 25 HA PHE 25 13.504 -10.455 -13.959 332 HB2 PHE 25 1HB PHE 25 15.115 -8.560 -13.741 333 HB3 PHE 25 2HB PHE 25 15.086 -8.759 -11.995 334 HD1 PHE 25 HD2 PHE 25 15.621 -10.977 -14.980 335 HD2 PHE 25 HD1 PHE 25 16.864 -9.809 -11.060 336 HE1 PHE 25 HE2 PHE 25 17.472 -12.650 -15.063 337 HE2 PHE 25 HE1 PHE 25 18.637 -11.545 -11.068 338 HZ PHE 25 HZ PHE 25 18.983 -12.930 -13.077 339 H NVA 26 H ARX 26 12.411 -12.266 -13.047 340 HA NVA 26 HA ARX 26 12.554 -12.653 -10.114 341 HB2 NVA 26 1HB ARX 26 10.799 -14.188 -10.173 342 HB3 NVA 26 2HB ARX 26 10.243 -12.872 -11.165 343 HG2 NVA 26 1HG ARX 26 10.645 -14.369 -13.252 344 HG3 NVA 26 2HG ARX 26 11.557 -15.517 -12.309 345 HD2 NVA 26 1HD ARX 26 9.343 -15.695 -10.810 346 HD3 NVA 26 2HD ARX 26 8.543 -15.394 -12.366 347 H THR 27 H THR 27 14.514 -13.322 -12.451 348 HA THR 27 HA THR 27 16.352 -14.612 -12.871 349 HB THR 27 HB THR 27 17.308 -16.232 -11.355 350 HG1 THR 27 HG1 THR 27 14.690 -16.398 -10.322 351 HG21 THR 27 1HG2 THR 27 17.301 -15.105 -9.173 352 HG22 THR 27 2HG2 THR 27 15.982 -14.047 -9.736 353 HG23 THR 27 3HG2 THR 27 17.586 -13.976 -10.524 354 HA PRO 28 HA PRO 28 14.310 -17.465 -15.365 355 HB2 PRO 28 1HB PRO 28 16.091 -19.440 -16.043 356 HB3 PRO 28 2HB PRO 28 16.231 -17.725 -16.596 357 HG2 PRO 28 1HG PRO 28 17.512 -19.098 -14.258 358 HG3 PRO 28 2HG PRO 28 18.326 -18.244 -15.564 359 HD2 PRO 28 1HD PRO 28 17.810 -16.994 -13.224 360 HD3 PRO 28 2HD PRO 28 17.468 -16.125 -14.758 361 H HIX 29 H HIX 29 12.947 -19.057 -15.383 362 HA HIX 29 HA HIX 29 12.605 -20.665 -12.919 363 HB1 HIX 29 1HB HIX 29 10.618 -19.939 -15.050 364 HB2 HIX 29 2HB HIX 29 10.225 -21.148 -13.836 365 HD2 HIX 29 HD2 HIX 29 10.152 -17.358 -14.210 366 HD1 HIX 29 HD1 HIX 29 10.163 -20.163 -11.198 367 HE1 HIX 29 HE1 HIX 29 8.469 -18.267 -10.979 368 H THR 30 H THR 30 13.337 -22.549 -12.846 369 HA THR 30 HA THR 30 13.694 -24.203 -15.280 370 HB THR 30 HB THR 30 15.558 -25.308 -13.852 371 HG1 THR 30 HG1 THR 30 16.236 -23.700 -12.088 372 HG21 THR 30 1HG2 THR 30 16.073 -23.496 -15.536 373 HG22 THR 30 2HG2 THR 30 17.197 -23.509 -14.188 374 HG23 THR 30 3HG2 THR 30 15.914 -22.291 -14.269 Start of MODEL 11 1 H1 GLY 1 1H GLY 1 -0.587 0.805 -0.714 2 H2 GLY 1 2H GLY 1 0.602 1.453 0.173 3 H3 GLY 1 3H GLY 1 -0.029 2.253 -1.112 4 HA2 GLY 1 1HA GLY 1 2.021 1.411 -1.829 5 HA3 GLY 1 2HA GLY 1 1.662 -0.158 -1.091 6 H ILE 2 H ILE 2 1.939 -1.317 -3.203 7 HA ILE 2 HA ILE 2 -0.398 -0.693 -4.962 8 HB ILE 2 HB ILE 2 1.757 0.299 -5.824 9 HG12 ILE 2 1HG1 ILE 2 0.811 -2.018 -7.578 10 HG13 ILE 2 2HG1 ILE 2 -0.060 -0.500 -7.414 11 HG21 ILE 2 1HG2 ILE 2 3.589 -1.113 -6.600 12 HG22 ILE 2 2HG2 ILE 2 3.297 -1.433 -4.859 13 HG23 ILE 2 3HG2 ILE 2 2.717 -2.590 -6.110 14 HD11 ILE 2 3HD1 ILE 2 2.302 0.542 -8.273 15 HD12 ILE 2 1HD1 ILE 2 2.620 -1.116 -8.854 16 HD13 ILE 2 2HD1 ILE 2 1.194 -0.202 -9.462 17 H VAL 3 H VAL 3 1.709 -3.167 -3.577 18 HA VAL 3 HA VAL 3 0.928 -5.221 -5.326 19 HB VAL 3 HB VAL 3 1.810 -5.390 -2.385 20 HG11 VAL 3 1HG1 VAL 3 1.750 -7.598 -4.516 21 HG12 VAL 3 2HG1 VAL 3 2.459 -7.727 -2.880 22 HG13 VAL 3 3HG1 VAL 3 0.721 -7.509 -3.038 23 HG21 VAL 3 3HG2 VAL 3 4.054 -5.853 -3.363 24 HG22 VAL 3 1HG2 VAL 3 3.392 -5.671 -5.017 25 HG23 VAL 3 2HG2 VAL 3 3.475 -4.280 -3.901 26 H GLU 4 H GLU 4 -0.461 -4.365 -2.069 27 HA GLU 4 HA GLU 4 -2.288 -6.580 -2.273 28 HB2 GLU 4 1HB GLU 4 -1.591 -5.302 -0.166 29 HB3 GLU 4 2HB GLU 4 -2.717 -4.034 -0.621 30 HG2 GLU 4 1HG GLU 4 -4.626 -5.714 -0.567 31 HG3 GLU 4 2HG GLU 4 -3.503 -6.963 -0.023 32 H GLN 5 H GLN 5 -2.481 -3.277 -3.419 33 HA GLN 5 HA GLN 5 -5.323 -3.253 -3.939 34 HB2 GLN 5 1HB GLN 5 -3.072 -1.530 -4.963 35 HB3 GLN 5 2HB GLN 5 -4.809 -1.255 -5.220 36 HG2 GLN 5 1HG GLN 5 -5.145 -0.989 -2.813 37 HG3 GLN 5 2HG GLN 5 -3.415 -1.247 -2.484 38 HE21 GLN 5 2HE2 GLN 5 -3.690 0.855 -1.446 39 HE22 GLN 5 1HE2 GLN 5 -3.479 2.255 -2.461 40 H CYS 6 H CYS 6 -2.359 -4.084 -5.734 41 HA CYS 6 HA CYS 6 -3.753 -4.399 -8.279 42 HB2 CYS 6 1HB CYS 6 -1.328 -4.040 -8.009 43 HB3 CYS 6 2HB CYS 6 -1.152 -5.641 -7.299 44 H CYS 7 H CYS 7 -3.072 -6.427 -5.451 45 HA CYS 7 HA CYS 7 -3.693 -8.913 -6.807 46 HB2 CYS 7 1HB CYS 7 -3.096 -7.910 -4.051 47 HB3 CYS 7 2HB CYS 7 -3.841 -9.509 -4.138 48 H THR 8 H THR 8 -5.396 -7.025 -4.258 49 HA THR 8 HA THR 8 -7.581 -8.899 -4.133 50 HB THR 8 HB THR 8 -7.565 -6.157 -2.842 51 HG1 THR 8 HG1 THR 8 -5.553 -6.740 -2.519 52 HG21 THR 8 1HG2 THR 8 -8.232 -9.005 -2.003 53 HG22 THR 8 2HG2 THR 8 -9.404 -7.738 -2.394 54 HG23 THR 8 3HG2 THR 8 -8.366 -7.591 -0.989 55 H SER 9 H SER 9 -7.081 -7.217 -6.686 56 HA SER 9 HA SER 9 -9.903 -6.662 -7.191 57 HB2 SER 9 1HB SER 9 -8.835 -4.523 -6.076 58 HB3 SER 9 2HB SER 9 -8.009 -4.347 -7.658 59 HG SER 9 HG SER 9 -10.118 -3.298 -7.449 60 H ILE 10 H ILE 10 -9.991 -5.615 -9.522 61 HA ILE 10 HA ILE 10 -8.284 -7.079 -11.342 62 HB ILE 10 HB ILE 10 -10.163 -4.643 -11.804 63 HG12 ILE 10 1HG1 ILE 10 -11.381 -6.751 -11.099 64 HG13 ILE 10 2HG1 ILE 10 -11.809 -6.185 -12.705 65 HG21 ILE 10 1HG2 ILE 10 -8.586 -6.310 -13.767 66 HG22 ILE 10 2HG2 ILE 10 -10.054 -5.409 -14.188 67 HG23 ILE 10 3HG2 ILE 10 -8.652 -4.513 -13.565 68 HD11 ILE 10 3HD1 ILE 10 -11.483 -8.744 -12.438 69 HD12 ILE 10 1HD1 ILE 10 -10.641 -7.947 -13.809 70 HD13 ILE 10 2HD1 ILE 10 -9.748 -8.403 -12.314 71 H CYS 11 H CYS 11 -6.332 -6.438 -11.957 72 HA CYS 11 HA CYS 11 -5.267 -3.843 -10.982 73 HB2 CYS 11 1HB CYS 11 -4.200 -6.183 -10.616 74 HB3 CYS 11 2HB CYS 11 -3.747 -6.060 -12.311 75 H SER 12 H SER 12 -5.111 -2.157 -12.279 76 HA SER 12 HA SER 12 -6.122 -2.378 -14.992 77 HB2 SER 12 1HB SER 12 -4.935 0.073 -13.562 78 HB3 SER 12 2HB SER 12 -5.952 0.040 -15.019 79 HG SER 12 HG SER 12 -6.779 -0.903 -12.467 80 H LEU 13 H LEU 13 -4.939 -1.462 -16.879 81 HA LEU 13 HA LEU 13 -2.373 -2.571 -17.256 82 HB2 LEU 13 1HB LEU 13 -3.993 -2.014 -19.057 83 HB3 LEU 13 2HB LEU 13 -3.670 -0.310 -18.812 84 HG LEU 13 HG LEU 13 -1.300 -0.726 -19.578 85 HD11 LEU 13 1HD1 LEU 13 -0.877 -2.819 -20.813 86 HD12 LEU 13 2HD1 LEU 13 -2.383 -3.482 -20.156 87 HD13 LEU 13 3HD1 LEU 13 -1.079 -2.997 -19.070 88 HD21 LEU 13 3HD2 LEU 13 -3.280 -1.641 -21.741 89 HD22 LEU 13 1HD2 LEU 13 -1.792 -0.697 -21.917 90 HD23 LEU 13 2HD2 LEU 13 -3.184 0.027 -21.169 91 H TYR 14 H TYR 14 -3.240 0.680 -16.318 92 HA TYR 14 HA TYR 14 -0.498 1.608 -16.628 93 HB2 TYR 14 1HB TYR 14 -1.340 3.512 -15.273 94 HB3 TYR 14 2HB TYR 14 -2.121 3.266 -16.828 95 HD1 TYR 14 HD1 TYR 14 -2.600 3.136 -13.160 96 HD2 TYR 14 HD2 TYR 14 -4.532 2.582 -16.940 97 HE1 TYR 14 HE1 TYR 14 -4.849 3.059 -12.050 98 HE2 TYR 14 HE2 TYR 14 -6.737 2.557 -15.792 99 HH TYR 14 HH TYR 14 -7.079 2.841 -12.291 100 H GLN 15 H GLN 15 -2.366 0.127 -13.973 101 HA GLN 15 HA GLN 15 -0.418 0.755 -11.882 102 HB2 GLN 15 1HB GLN 15 -2.471 -1.491 -12.189 103 HB3 GLN 15 2HB GLN 15 -1.497 -1.239 -10.763 104 HG2 GLN 15 1HG GLN 15 -2.484 0.941 -10.339 105 HG3 GLN 15 2HG GLN 15 -3.391 0.851 -11.858 106 HE21 GLN 15 2HE2 GLN 15 -3.489 0.261 -8.525 107 HE22 GLN 15 1HE2 GLN 15 -4.946 -0.691 -8.484 108 H LEU 16 H LEU 16 -0.991 -1.850 -14.172 109 HA LEU 16 HA LEU 16 1.052 -3.642 -13.312 110 HB2 LEU 16 1HB LEU 16 -1.013 -3.954 -14.788 111 HB3 LEU 16 2HB LEU 16 -0.065 -3.233 -16.066 112 HG LEU 16 HG LEU 16 0.435 -5.883 -14.702 113 HD11 LEU 16 1HD1 LEU 16 -0.140 -6.588 -17.142 114 HD12 LEU 16 2HD1 LEU 16 -0.714 -4.915 -17.358 115 HD13 LEU 16 3HD1 LEU 16 -1.435 -5.983 -16.118 116 HD21 LEU 16 3HD2 LEU 16 2.551 -4.996 -15.302 117 HD22 LEU 16 1HD2 LEU 16 1.969 -4.570 -16.963 118 HD23 LEU 16 2HD2 LEU 16 2.100 -6.292 -16.480 119 H GLU 17 H GLU 17 1.071 -1.102 -15.850 120 HA GLU 17 HA GLU 17 3.782 -1.451 -16.647 121 HB2 GLU 17 1HB GLU 17 1.807 0.835 -16.776 122 HB3 GLU 17 2HB GLU 17 3.441 0.940 -17.473 123 HG2 GLU 17 1HG GLU 17 1.802 -1.430 -18.234 124 HG3 GLU 17 2HG GLU 17 1.342 0.133 -18.930 125 H ASN 18 H ASN 18 2.295 0.310 -14.017 126 HA ASN 18 HA ASN 18 4.508 1.979 -13.373 127 HB2 ASN 18 1HB ASN 18 1.967 1.364 -12.389 128 HB3 ASN 18 2HB ASN 18 3.067 0.989 -11.074 129 HD21 ASN 18 2HD2 ASN 18 4.869 2.740 -11.053 130 HD22 ASN 18 1HD2 ASN 18 4.302 4.359 -11.002 131 H TYR 19 H TYR 19 4.146 -1.480 -13.055 132 HA TYR 19 HA TYR 19 6.132 -1.779 -10.789 133 HB2 TYR 19 1HB TYR 19 4.818 -3.715 -12.738 134 HB3 TYR 19 2HB TYR 19 6.143 -4.173 -11.676 135 HD1 TYR 19 HD1 TYR 19 5.788 -4.405 -9.192 136 HD2 TYR 19 HD2 TYR 19 2.555 -3.211 -11.809 137 HE1 TYR 19 HE1 TYR 19 4.109 -4.834 -7.422 138 HE2 TYR 19 HE2 TYR 19 0.945 -3.720 -9.978 139 HH TYR 19 HH TYR 19 1.808 -5.106 -6.918 140 H CYS 20 H CYS 20 6.131 -1.450 -14.282 141 HA CYS 20 HA CYS 20 8.898 -2.451 -14.555 142 HB2 CYS 20 1HB CYS 20 6.645 -1.816 -16.455 143 HB3 CYS 20 2HB CYS 20 8.284 -1.432 -16.977 144 H ASN 21 H ASN 21 10.326 -0.829 -15.837 145 HA ASN 21 HA ASN 21 10.433 1.626 -14.243 146 HB2 ASN 21 1HB ASN 21 12.035 0.529 -16.576 147 HB3 ASN 21 2HB ASN 21 12.287 2.159 -15.907 148 HD21 ASN 21 2HD2 ASN 21 13.671 -0.721 -15.918 149 HD22 ASN 21 1HD2 ASN 21 14.153 -0.822 -14.227 150 H1 PHE 1 1H PHE 1 -3.926 -6.467 -23.544 151 H2 PHE 1 2H PHE 1 -2.546 -7.336 -23.349 152 H3 PHE 1 3H PHE 1 -3.980 -8.060 -23.721 153 HA PHE 1 HA PHE 1 -3.386 -8.476 -21.463 154 HB2 PHE 1 1HB PHE 1 -2.000 -6.425 -21.187 155 HB3 PHE 1 2HB PHE 1 -3.507 -5.447 -21.125 156 HD1 PHE 1 HD1 PHE 1 -1.998 -8.438 -19.520 157 HD2 PHE 1 HD2 PHE 1 -4.483 -4.999 -18.956 158 HE1 PHE 1 HE1 PHE 1 -2.305 -9.075 -17.113 159 HE2 PHE 1 HE2 PHE 1 -4.725 -5.545 -16.540 160 HZ PHE 1 HZ PHE 1 -3.687 -7.637 -15.618 161 H VAL 2 H VAL 2 -5.464 -5.697 -22.348 162 HA VAL 2 HA VAL 2 -7.669 -5.290 -21.926 163 HB VAL 2 HB VAL 2 -8.094 -8.255 -21.352 164 HG11 VAL 2 1HG1 VAL 2 -9.885 -6.432 -20.886 165 HG12 VAL 2 2HG1 VAL 2 -10.002 -6.290 -22.647 166 HG13 VAL 2 3HG1 VAL 2 -10.353 -7.850 -21.847 167 HG21 VAL 2 3HG2 VAL 2 -6.960 -8.220 -23.459 168 HG22 VAL 2 1HG2 VAL 2 -8.734 -8.400 -23.790 169 HG23 VAL 2 2HG2 VAL 2 -7.957 -6.824 -24.058 170 H ASN 3 H ASN 3 -7.936 -7.834 -19.397 171 HA ASN 3 HA ASN 3 -6.909 -6.048 -17.282 172 HB2 ASN 3 1HB ASN 3 -9.040 -5.843 -16.102 173 HB3 ASN 3 2HB ASN 3 -9.231 -5.168 -17.747 174 HD21 ASN 3 2HD2 ASN 3 -10.871 -5.774 -18.935 175 HD22 ASN 3 1HD2 ASN 3 -11.904 -7.188 -18.554 176 H GLN 4 H GLN 4 -6.820 -7.269 -15.205 177 HA GLN 4 HA GLN 4 -7.960 -9.970 -15.091 178 HB2 GLN 4 1HB GLN 4 -5.463 -9.812 -16.363 179 HB3 GLN 4 2HB GLN 4 -5.013 -10.180 -14.708 180 HG2 GLN 4 1HG GLN 4 -7.249 -11.864 -15.835 181 HG3 GLN 4 2HG GLN 4 -5.684 -12.053 -16.661 182 HE21 GLN 4 2HE2 GLN 4 -7.637 -13.087 -14.088 183 HE22 GLN 4 1HE2 GLN 4 -6.347 -13.872 -13.140 184 H HIS 5 H HIS 5 -7.451 -11.035 -12.947 185 HA HIS 5 HA HIS 5 -6.949 -9.085 -10.774 186 HB2 HIS 5 1HB HIS 5 -8.072 -11.829 -11.026 187 HB3 HIS 5 2HB HIS 5 -6.923 -11.651 -9.660 188 HD1 HIS 5 HD1 HIS 5 -10.321 -10.385 -10.878 189 HD2 HIS 5 HD2 HIS 5 -7.820 -10.167 -7.531 190 HE1 HIS 5 HE1 HIS 5 -11.622 -9.321 -8.996 191 H LEU 6 H LEU 6 -4.708 -8.743 -10.176 192 HA LEU 6 HA LEU 6 -2.890 -10.953 -11.106 193 HB2 LEU 6 1HB LEU 6 -2.293 -7.953 -10.891 194 HB3 LEU 6 2HB LEU 6 -1.128 -9.185 -11.360 195 HG LEU 6 HG LEU 6 -3.551 -8.324 -12.944 196 HD11 LEU 6 1HD1 LEU 6 -0.586 -8.064 -13.499 197 HD12 LEU 6 2HD1 LEU 6 -1.645 -6.742 -13.061 198 HD13 LEU 6 3HD1 LEU 6 -1.901 -7.585 -14.607 199 HD21 LEU 6 3HD2 LEU 6 -1.512 -10.534 -13.434 200 HD22 LEU 6 1HD2 LEU 6 -2.582 -9.908 -14.701 201 HD23 LEU 6 2HD2 LEU 6 -3.249 -10.695 -13.228 202 H CYS 7 H CYS 7 -2.697 -12.178 -9.365 203 HA CYS 7 HA CYS 7 -0.941 -10.926 -7.240 204 HB2 CYS 7 1HB CYS 7 -3.489 -11.281 -6.615 205 HB3 CYS 7 2HB CYS 7 -3.004 -12.985 -6.430 206 H GLY 8 H GLY 8 0.620 -12.494 -6.459 207 HA2 GLY 8 1HA GLY 8 1.916 -14.341 -6.478 208 HA3 GLY 8 2HA GLY 8 0.553 -15.259 -7.161 209 H SER 9 H SER 9 1.781 -16.467 -8.700 210 HA SER 9 HA SER 9 3.652 -15.209 -10.454 211 HB2 SER 9 1HB SER 9 1.954 -17.639 -11.074 212 HB3 SER 9 2HB SER 9 3.583 -17.235 -11.676 213 HG SER 9 HG SER 9 3.936 -18.612 -10.000 214 H HIS 10 H HIS 10 0.215 -14.868 -10.605 215 HA HIS 10 HA HIS 10 -0.168 -14.655 -13.422 216 HB2 HIS 10 1HB HIS 10 -1.769 -13.241 -11.211 217 HB3 HIS 10 2HB HIS 10 -2.195 -13.371 -12.916 218 HD1 HIS 10 HD1 HIS 10 -2.132 -15.160 -9.628 219 HD2 HIS 10 HD2 HIS 10 -3.106 -16.036 -13.572 220 HE1 HIS 10 HE1 HIS 10 -3.327 -17.385 -9.619 221 H LEU 11 H LEU 11 0.978 -12.357 -10.929 222 HA LEU 11 HA LEU 11 0.928 -10.060 -12.598 223 HB2 LEU 11 1HB LEU 11 1.142 -9.977 -10.159 224 HB3 LEU 11 2HB LEU 11 2.679 -10.780 -10.231 225 HG LEU 11 HG LEU 11 3.625 -8.729 -11.284 226 HD11 LEU 11 1HD1 LEU 11 0.845 -7.573 -10.778 227 HD12 LEU 11 2HD1 LEU 11 1.712 -7.637 -12.313 228 HD13 LEU 11 3HD1 LEU 11 2.292 -6.554 -11.015 229 HD21 LEU 11 3HD2 LEU 11 3.875 -9.035 -8.908 230 HD22 LEU 11 1HD2 LEU 11 2.202 -8.512 -8.610 231 HD23 LEU 11 2HD2 LEU 11 3.406 -7.343 -9.144 232 H VAL 12 H VAL 12 3.201 -12.733 -12.129 233 HA VAL 12 HA VAL 12 5.454 -11.437 -13.438 234 HB VAL 12 HB VAL 12 4.876 -14.459 -13.222 235 HG11 VAL 12 1HG1 VAL 12 7.467 -14.504 -13.286 236 HG12 VAL 12 2HG1 VAL 12 6.619 -14.141 -14.834 237 HG13 VAL 12 3HG1 VAL 12 7.380 -12.811 -13.901 238 HG21 VAL 12 3HG2 VAL 12 4.882 -13.531 -11.017 239 HG22 VAL 12 1HG2 VAL 12 6.374 -14.401 -11.288 240 HG23 VAL 12 2HG2 VAL 12 6.380 -12.616 -11.326 241 H GLU 13 H GLU 13 2.911 -13.701 -14.571 242 HA GLU 13 HA GLU 13 3.801 -13.808 -17.262 243 HB2 GLU 13 1HB GLU 13 1.224 -14.355 -15.810 244 HB3 GLU 13 2HB GLU 13 1.319 -14.458 -17.622 245 HG2 GLU 13 1HG GLU 13 3.269 -15.885 -15.853 246 HG3 GLU 13 2HG GLU 13 1.756 -16.649 -16.392 247 H ALA 14 H ALA 14 1.504 -11.675 -15.587 248 HA ALA 14 HA ALA 14 0.528 -10.238 -17.848 249 HB1 ALA 14 3HB ALA 14 0.075 -8.477 -16.142 250 HB2 ALA 14 1HB ALA 14 -0.407 -10.111 -15.617 251 HB3 ALA 14 2HB ALA 14 1.057 -9.367 -15.001 252 H LEU 15 H LEU 15 3.380 -9.595 -15.699 253 HA LEU 15 HA LEU 15 4.135 -7.178 -17.039 254 HB2 LEU 15 1HB LEU 15 5.544 -9.166 -15.230 255 HB3 LEU 15 2HB LEU 15 6.414 -7.800 -15.924 256 HG LEU 15 HG LEU 15 3.821 -7.443 -14.380 257 HD11 LEU 15 1HD1 LEU 15 6.545 -7.305 -13.081 258 HD12 LEU 15 2HD1 LEU 15 5.392 -8.605 -12.822 259 HD13 LEU 15 3HD1 LEU 15 4.980 -6.950 -12.322 260 HD21 LEU 15 3HD2 LEU 15 6.225 -5.593 -14.666 261 HD22 LEU 15 1HD2 LEU 15 4.586 -5.156 -14.157 262 HD23 LEU 15 2HD2 LEU 15 4.895 -5.589 -15.837 263 H TYR 16 H TYR 16 5.067 -10.664 -17.414 264 HA TYR 16 HA TYR 16 7.166 -10.217 -19.317 265 HB2 TYR 16 1HB TYR 16 6.542 -12.341 -18.144 266 HB3 TYR 16 2HB TYR 16 5.211 -12.558 -19.299 267 HD1 TYR 16 HD2 TYR 16 8.921 -12.378 -18.904 268 HD2 TYR 16 HD1 TYR 16 5.667 -13.446 -21.430 269 HE1 TYR 16 HE2 TYR 16 10.525 -13.516 -20.460 270 HE2 TYR 16 HE1 TYR 16 7.260 -14.571 -23.036 271 HH TYR 16 HH TYR 16 9.615 -14.461 -23.672 272 H LEU 17 H LEU 17 3.605 -10.537 -19.762 273 HA LEU 17 HA LEU 17 3.847 -10.348 -22.645 274 HB2 LEU 17 1HB LEU 17 1.607 -9.912 -20.692 275 HB3 LEU 17 2HB LEU 17 1.373 -9.728 -22.403 276 HG LEU 17 HG LEU 17 2.379 -12.308 -21.122 277 HD11 LEU 17 1HD1 LEU 17 -0.450 -11.658 -21.877 278 HD12 LEU 17 2HD1 LEU 17 0.178 -11.698 -20.227 279 HD13 LEU 17 3HD1 LEU 17 0.149 -13.162 -21.198 280 HD21 LEU 17 3HD2 LEU 17 2.911 -12.122 -23.541 281 HD22 LEU 17 1HD2 LEU 17 1.202 -11.744 -23.908 282 HD23 LEU 17 2HD2 LEU 17 1.653 -13.367 -23.288 283 H VAL 18 H VAL 18 3.183 -7.907 -20.144 284 HA VAL 18 HA VAL 18 2.464 -5.928 -22.147 285 HB VAL 18 HB VAL 18 2.749 -5.826 -19.110 286 HG11 VAL 18 1HG1 VAL 18 1.415 -3.699 -19.320 287 HG12 VAL 18 2HG1 VAL 18 3.079 -3.574 -19.832 288 HG13 VAL 18 3HG1 VAL 18 1.792 -3.684 -21.066 289 HG21 VAL 18 3HG2 VAL 18 0.860 -7.247 -19.895 290 HG22 VAL 18 1HG2 VAL 18 0.227 -5.787 -19.210 291 HG23 VAL 18 2HG2 VAL 18 0.279 -5.988 -20.922 292 H CYS 19 H CYS 19 5.331 -6.397 -19.963 293 HA CYS 19 HA CYS 19 6.413 -3.789 -20.827 294 HB2 CYS 19 1HB CYS 19 7.607 -6.135 -19.347 295 HB3 CYS 19 2HB CYS 19 8.400 -4.573 -19.547 296 H GLY 20 H GLY 20 6.075 -6.832 -22.330 297 HA2 GLY 20 1HA GLY 20 6.757 -6.778 -24.701 298 HA3 GLY 20 2HA GLY 20 8.347 -6.207 -24.161 299 H GLU 21 H GLU 21 9.374 -7.509 -22.472 300 HA GLU 21 HA GLU 21 8.835 -10.378 -22.463 301 HB2 GLU 21 1HB GLU 21 10.079 -9.812 -24.701 302 HB3 GLU 21 2HB GLU 21 11.504 -9.534 -23.665 303 HG2 GLU 21 1HG GLU 21 11.818 -11.712 -24.293 304 HG3 GLU 21 2HG GLU 21 11.037 -11.952 -22.747 305 H ARG 22 H ARG 22 10.802 -7.568 -21.800 306 HA ARG 22 HA ARG 22 11.757 -8.774 -19.217 307 HB2 ARG 22 1HB ARG 22 13.424 -7.047 -21.140 308 HB3 ARG 22 2HB ARG 22 13.977 -7.758 -19.613 309 HG2 ARG 22 1HG ARG 22 13.497 -9.999 -20.658 310 HG3 ARG 22 2HG ARG 22 13.407 -9.131 -22.185 311 HD2 ARG 22 1HD ARG 22 15.775 -9.172 -20.222 312 HD3 ARG 22 2HD ARG 22 15.653 -10.029 -21.774 313 HE ARG 22 HE ARG 22 15.241 -7.423 -22.551 314 HH11 ARG 22 1HH1 ARG 22 17.822 -9.082 -20.840 315 HH12 ARG 22 2HH1 ARG 22 19.023 -7.869 -21.155 316 HH21 ARG 22 1HH2 ARG 22 16.896 -5.831 -22.919 317 HH22 ARG 22 2HH2 ARG 22 18.502 -6.132 -22.335 318 H GLY 23 H GLY 23 12.806 -6.839 -17.842 319 HA2 GLY 23 1HA GLY 23 13.006 -4.345 -17.652 320 HA3 GLY 23 2HA GLY 23 11.355 -4.295 -18.274 321 H PHE 24 H PHE 24 11.376 -6.966 -16.209 322 HA PHE 24 HA PHE 24 10.683 -5.217 -13.905 323 HB2 PHE 24 1HB PHE 24 8.752 -6.642 -13.484 324 HB3 PHE 24 2HB PHE 24 8.644 -5.928 -15.097 325 HD1 PHE 24 HD2 PHE 24 9.108 -7.435 -17.101 326 HD2 PHE 24 HD1 PHE 24 8.764 -9.002 -13.100 327 HE1 PHE 24 HE2 PHE 24 8.820 -9.720 -18.011 328 HE2 PHE 24 HE1 PHE 24 8.474 -11.277 -14.012 329 HZ PHE 24 HZ PHE 24 8.495 -11.667 -16.430 330 H PHE 25 H PHE 25 10.507 -6.512 -11.867 331 HA PHE 25 HA PHE 25 12.894 -8.226 -11.710 332 HB2 PHE 25 1HB PHE 25 12.116 -6.320 -10.141 333 HB3 PHE 25 2HB PHE 25 11.098 -7.545 -9.386 334 HD1 PHE 25 HD1 PHE 25 14.634 -6.423 -9.931 335 HD2 PHE 25 HD2 PHE 25 12.025 -9.372 -8.071 336 HE1 PHE 25 HE1 PHE 25 16.551 -7.161 -8.556 337 HE2 PHE 25 HE2 PHE 25 13.953 -10.086 -6.699 338 HZ PHE 25 HZ PHE 25 16.265 -9.010 -6.968 339 H NVA 26 H ARX 26 12.404 -10.127 -12.747 340 HA NVA 26 HA ARX 26 10.115 -11.800 -12.335 341 HB2 NVA 26 1HB ARX 26 11.867 -11.711 -14.288 342 HB3 NVA 26 2HB ARX 26 12.784 -12.757 -13.258 343 HG2 NVA 26 1HG ARX 26 10.456 -14.262 -13.211 344 HG3 NVA 26 2HG ARX 26 10.217 -13.400 -14.705 345 HD2 NVA 26 1HD ARX 26 11.480 -14.782 -15.830 346 HD3 NVA 26 2HD ARX 26 12.951 -14.309 -14.873 347 H THR 27 H THR 27 13.296 -11.885 -10.996 348 HA THR 27 HA THR 27 14.382 -12.735 -9.156 349 HB THR 27 HB THR 27 13.405 -14.107 -7.387 350 HG1 THR 27 HG1 THR 27 11.244 -14.451 -9.206 351 HG21 THR 27 1HG2 THR 27 11.234 -12.842 -6.811 352 HG22 THR 27 2HG2 THR 27 11.302 -12.092 -8.392 353 HG23 THR 27 3HG2 THR 27 12.601 -11.761 -7.223 354 HA PRO 28 HA PRO 28 15.693 -16.148 -11.310 355 HB2 PRO 28 1HB PRO 28 17.372 -17.598 -9.806 356 HB3 PRO 28 2HB PRO 28 17.785 -15.966 -10.208 357 HG2 PRO 28 1HG PRO 28 16.554 -16.924 -7.645 358 HG3 PRO 28 2HG PRO 28 17.902 -15.788 -7.919 359 HD2 PRO 28 1HD PRO 28 15.315 -14.980 -7.364 360 HD3 PRO 28 2HD PRO 28 16.434 -13.984 -8.335 361 H HIX 29 H HIX 29 13.391 -16.935 -11.358 362 HA HIX 29 HA HIX 29 12.475 -19.320 -9.950 363 HB1 HIX 29 1HB HIX 29 11.086 -19.604 -11.972 364 HB2 HIX 29 2HB HIX 29 10.737 -18.172 -11.021 365 HD2 HIX 29 HD2 HIX 29 11.477 -15.659 -12.141 366 HD1 HIX 29 HD1 HIX 29 11.967 -19.183 -14.430 367 HE1 HIX 29 HE1 HIX 29 13.367 -17.092 -15.094 368 H THR 30 H THR 30 13.882 -20.865 -9.699 369 HA THR 30 HA THR 30 14.809 -22.583 -11.900 370 HB THR 30 HB THR 30 17.053 -22.810 -10.710 371 HG1 THR 30 HG1 THR 30 15.878 -20.694 -9.265 372 HG21 THR 30 1HG2 THR 30 18.078 -20.891 -11.767 373 HG22 THR 30 2HG2 THR 30 16.556 -19.986 -11.728 374 HG23 THR 30 3HG2 THR 30 16.737 -21.380 -12.801 Start of MODEL 12 1 H1 GLY 1 1H GLY 1 0.959 0.849 -0.929 2 H2 GLY 1 2H GLY 1 0.333 -0.497 -0.255 3 H3 GLY 1 3H GLY 1 1.703 0.150 0.360 4 HA2 GLY 1 1HA GLY 1 2.936 -0.346 -1.595 5 HA3 GLY 1 2HA GLY 1 2.192 -1.810 -0.905 6 H ILE 2 H ILE 2 2.980 -1.267 -3.779 7 HA ILE 2 HA ILE 2 0.549 -0.705 -5.219 8 HB ILE 2 HB ILE 2 2.884 -0.220 -6.029 9 HG12 ILE 2 1HG1 ILE 2 1.307 -2.061 -7.891 10 HG13 ILE 2 2HG1 ILE 2 0.836 -0.414 -7.507 11 HG21 ILE 2 1HG2 ILE 2 4.325 -2.012 -6.907 12 HG22 ILE 2 2HG2 ILE 2 3.933 -2.369 -5.245 13 HG23 ILE 2 3HG2 ILE 2 3.082 -3.232 -6.575 14 HD11 ILE 2 3HD1 ILE 2 3.381 -1.310 -8.946 15 HD12 ILE 2 1HD1 ILE 2 2.012 -0.389 -9.621 16 HD13 ILE 2 2HD1 ILE 2 3.061 0.349 -8.435 17 H VAL 3 H VAL 3 2.086 -3.703 -4.098 18 HA VAL 3 HA VAL 3 0.702 -5.513 -5.783 19 HB VAL 3 HB VAL 3 1.559 -5.990 -2.886 20 HG11 VAL 3 1HG1 VAL 3 0.124 -7.810 -3.838 21 HG12 VAL 3 2HG1 VAL 3 1.244 -7.939 -5.243 22 HG13 VAL 3 3HG1 VAL 3 1.817 -8.337 -3.604 23 HG21 VAL 3 3HG2 VAL 3 3.493 -5.127 -4.068 24 HG22 VAL 3 1HG2 VAL 3 3.662 -6.885 -3.989 25 HG23 VAL 3 2HG2 VAL 3 3.118 -6.136 -5.519 26 H GLU 4 H GLU 4 -0.206 -4.175 -2.561 27 HA GLU 4 HA GLU 4 -2.678 -5.618 -2.349 28 HB2 GLU 4 1HB GLU 4 -1.757 -2.927 -1.271 29 HB3 GLU 4 2HB GLU 4 -3.249 -3.745 -0.754 30 HG2 GLU 4 1HG GLU 4 -2.021 -5.500 0.247 31 HG3 GLU 4 2HG GLU 4 -0.503 -4.953 -0.490 32 H GLN 5 H GLN 5 -1.769 -2.440 -3.767 33 HA GLN 5 HA GLN 5 -4.435 -1.614 -4.298 34 HB2 GLN 5 1HB GLN 5 -2.223 -0.323 -4.251 35 HB3 GLN 5 2HB GLN 5 -2.036 -0.872 -5.929 36 HG2 GLN 5 1HG GLN 5 -4.217 0.234 -6.478 37 HG3 GLN 5 2HG GLN 5 -4.321 0.812 -4.778 38 HE21 GLN 5 2HE2 GLN 5 -4.412 2.984 -5.546 39 HE22 GLN 5 1HE2 GLN 5 -2.925 3.772 -6.050 40 H CYS 6 H CYS 6 -2.230 -3.809 -6.051 41 HA CYS 6 HA CYS 6 -3.961 -3.838 -8.435 42 HB2 CYS 6 1HB CYS 6 -1.374 -4.439 -8.065 43 HB3 CYS 6 2HB CYS 6 -2.037 -6.046 -7.888 44 H CYS 7 H CYS 7 -3.359 -5.918 -5.567 45 HA CYS 7 HA CYS 7 -5.170 -7.984 -6.504 46 HB2 CYS 7 1HB CYS 7 -4.108 -7.319 -3.720 47 HB3 CYS 7 2HB CYS 7 -5.012 -8.801 -4.124 48 H THR 8 H THR 8 -5.754 -4.954 -4.826 49 HA THR 8 HA THR 8 -8.332 -5.785 -3.760 50 HB THR 8 HB THR 8 -8.654 -3.186 -3.617 51 HG1 THR 8 HG1 THR 8 -5.843 -3.380 -3.835 52 HG21 THR 8 1HG2 THR 8 -6.422 -4.575 -2.019 53 HG22 THR 8 2HG2 THR 8 -8.180 -4.708 -1.647 54 HG23 THR 8 3HG2 THR 8 -7.385 -3.123 -1.552 55 H SER 9 H SER 9 -9.124 -6.760 -5.573 56 HA SER 9 HA SER 9 -10.834 -6.881 -7.092 57 HB2 SER 9 1HB SER 9 -10.795 -3.930 -7.622 58 HB3 SER 9 2HB SER 9 -12.094 -5.103 -7.929 59 HG SER 9 HG SER 9 -11.162 -4.191 -5.413 60 H ILE 10 H ILE 10 -10.990 -5.360 -9.548 61 HA ILE 10 HA ILE 10 -8.947 -6.907 -10.918 62 HB ILE 10 HB ILE 10 -11.050 -4.865 -11.862 63 HG12 ILE 10 1HG1 ILE 10 -11.814 -7.051 -10.937 64 HG13 ILE 10 2HG1 ILE 10 -12.341 -6.718 -12.581 65 HG21 ILE 10 1HG2 ILE 10 -10.570 -5.869 -14.184 66 HG22 ILE 10 2HG2 ILE 10 -9.424 -4.682 -13.542 67 HG23 ILE 10 3HG2 ILE 10 -9.012 -6.416 -13.502 68 HD11 ILE 10 3HD1 ILE 10 -10.808 -8.337 -13.498 69 HD12 ILE 10 1HD1 ILE 10 -9.981 -8.530 -11.932 70 HD13 ILE 10 2HD1 ILE 10 -11.657 -9.121 -12.175 71 H CYS 11 H CYS 11 -6.945 -6.318 -11.546 72 HA CYS 11 HA CYS 11 -5.757 -3.799 -10.875 73 HB2 CYS 11 1HB CYS 11 -4.908 -5.995 -12.805 74 HB3 CYS 11 2HB CYS 11 -3.932 -4.620 -12.390 75 H SER 12 H SER 12 -4.846 -2.257 -12.360 76 HA SER 12 HA SER 12 -6.297 -2.137 -14.964 77 HB2 SER 12 1HB SER 12 -5.121 0.071 -13.233 78 HB3 SER 12 2HB SER 12 -5.814 0.354 -14.846 79 HG SER 12 HG SER 12 -7.075 -0.328 -12.432 80 H LEU 13 H LEU 13 -5.111 -1.305 -16.783 81 HA LEU 13 HA LEU 13 -2.560 -2.516 -17.153 82 HB2 LEU 13 1HB LEU 13 -4.127 -1.885 -19.023 83 HB3 LEU 13 2HB LEU 13 -3.780 -0.194 -18.657 84 HG LEU 13 HG LEU 13 -1.413 -0.496 -19.239 85 HD11 LEU 13 1HD1 LEU 13 -2.258 -3.301 -20.144 86 HD12 LEU 13 2HD1 LEU 13 -1.134 -2.926 -18.846 87 HD13 LEU 13 3HD1 LEU 13 -0.690 -2.533 -20.506 88 HD21 LEU 13 3HD2 LEU 13 -3.071 0.325 -20.860 89 HD22 LEU 13 1HD2 LEU 13 -3.357 -1.328 -21.429 90 HD23 LEU 13 2HD2 LEU 13 -1.764 -0.547 -21.647 91 H TYR 14 H TYR 14 -3.348 0.900 -16.314 92 HA TYR 14 HA TYR 14 -0.601 1.693 -16.614 93 HB2 TYR 14 1HB TYR 14 -1.208 3.785 -15.648 94 HB3 TYR 14 2HB TYR 14 -2.468 3.251 -16.757 95 HD1 TYR 14 HD2 TYR 14 -4.734 2.592 -15.893 96 HD2 TYR 14 HD1 TYR 14 -1.598 3.899 -13.247 97 HE1 TYR 14 HE2 TYR 14 -6.388 2.908 -14.057 98 HE2 TYR 14 HE1 TYR 14 -3.272 4.242 -11.425 99 HH TYR 14 HH TYR 14 -5.502 4.003 -10.795 100 H GLN 15 H GLN 15 -2.420 0.249 -13.948 101 HA GLN 15 HA GLN 15 -0.363 0.851 -11.956 102 HB2 GLN 15 1HB GLN 15 -2.558 -1.229 -12.100 103 HB3 GLN 15 2HB GLN 15 -1.455 -1.090 -10.738 104 HG2 GLN 15 1HG GLN 15 -2.277 1.109 -10.239 105 HG3 GLN 15 2HG GLN 15 -3.228 1.153 -11.732 106 HE21 GLN 15 2HE2 GLN 15 -2.834 -0.643 -8.659 107 HE22 GLN 15 1HE2 GLN 15 -4.534 -1.064 -8.494 108 H LEU 16 H LEU 16 -1.076 -1.745 -14.277 109 HA LEU 16 HA LEU 16 0.983 -3.557 -13.404 110 HB2 LEU 16 1HB LEU 16 -0.959 -4.022 -14.977 111 HB3 LEU 16 2HB LEU 16 -0.035 -3.201 -16.223 112 HG LEU 16 HG LEU 16 0.886 -5.694 -14.781 113 HD11 LEU 16 1HD1 LEU 16 0.179 -6.767 -17.005 114 HD12 LEU 16 2HD1 LEU 16 -0.747 -5.281 -17.308 115 HD13 LEU 16 3HD1 LEU 16 -1.095 -6.295 -15.889 116 HD21 LEU 16 3HD2 LEU 16 2.815 -4.684 -15.804 117 HD22 LEU 16 1HD2 LEU 16 1.930 -4.246 -17.263 118 HD23 LEU 16 2HD2 LEU 16 2.279 -5.968 -16.917 119 H GLU 17 H GLU 17 0.922 -0.994 -15.939 120 HA GLU 17 HA GLU 17 3.697 -1.399 -16.622 121 HB2 GLU 17 1HB GLU 17 1.813 0.895 -16.981 122 HB3 GLU 17 2HB GLU 17 3.500 0.981 -17.537 123 HG2 GLU 17 1HG GLU 17 3.100 -1.133 -18.868 124 HG3 GLU 17 2HG GLU 17 1.397 -1.079 -18.397 125 H ASN 18 H ASN 18 2.174 0.484 -14.060 126 HA ASN 18 HA ASN 18 4.581 1.872 -13.262 127 HB2 ASN 18 1HB ASN 18 1.893 1.351 -12.147 128 HB3 ASN 18 2HB ASN 18 3.142 1.560 -10.953 129 HD21 ASN 18 2HD2 ASN 18 1.503 3.044 -13.669 130 HD22 ASN 18 1HD2 ASN 18 1.942 4.670 -13.248 131 H TYR 19 H TYR 19 4.032 -1.478 -13.174 132 HA TYR 19 HA TYR 19 5.784 -1.934 -10.774 133 HB2 TYR 19 1HB TYR 19 4.582 -3.774 -12.873 134 HB3 TYR 19 2HB TYR 19 5.856 -4.281 -11.753 135 HD1 TYR 19 HD1 TYR 19 2.363 -3.177 -11.949 136 HD2 TYR 19 HD2 TYR 19 5.446 -4.833 -9.496 137 HE1 TYR 19 HE1 TYR 19 0.646 -3.855 -10.320 138 HE2 TYR 19 HE2 TYR 19 3.717 -5.525 -7.826 139 HH TYR 19 HH TYR 19 0.251 -4.950 -8.321 140 H CYS 20 H CYS 20 6.071 -1.350 -14.261 141 HA CYS 20 HA CYS 20 8.574 -2.816 -14.521 142 HB2 CYS 20 1HB CYS 20 7.134 -0.964 -16.448 143 HB3 CYS 20 2HB CYS 20 8.602 -1.859 -16.810 144 H ASN 21 H ASN 21 10.561 -1.816 -15.001 145 HA ASN 21 HA ASN 21 11.051 0.576 -13.376 146 HB2 ASN 21 1HB ASN 21 12.956 -0.937 -15.217 147 HB3 ASN 21 2HB ASN 21 13.412 0.236 -13.981 148 HD21 ASN 21 2HD2 ASN 21 13.139 -2.953 -14.642 149 HD22 ASN 21 1HD2 ASN 21 13.123 -3.584 -12.990 150 H1 PHE 1 1H PHE 1 -2.681 -6.595 -23.477 151 H2 PHE 1 2H PHE 1 -1.796 -7.957 -23.137 152 H3 PHE 1 3H PHE 1 -3.312 -8.078 -23.762 153 HA PHE 1 HA PHE 1 -3.272 -8.572 -21.360 154 HB2 PHE 1 1HB PHE 1 -1.384 -7.025 -21.007 155 HB3 PHE 1 2HB PHE 1 -2.490 -5.661 -21.177 156 HD1 PHE 1 HD1 PHE 1 -1.786 -8.761 -19.190 157 HD2 PHE 1 HD2 PHE 1 -3.807 -4.952 -19.317 158 HE1 PHE 1 HE1 PHE 1 -2.359 -8.989 -16.816 159 HE2 PHE 1 HE2 PHE 1 -4.346 -5.177 -16.902 160 HZ PHE 1 HZ PHE 1 -3.609 -7.185 -15.665 161 H VAL 2 H VAL 2 -5.236 -8.007 -20.076 162 HA VAL 2 HA VAL 2 -6.906 -5.966 -21.390 163 HB VAL 2 HB VAL 2 -8.027 -8.626 -20.416 164 HG11 VAL 2 1HG1 VAL 2 -9.621 -6.768 -20.211 165 HG12 VAL 2 2HG1 VAL 2 -9.277 -6.250 -21.862 166 HG13 VAL 2 3HG1 VAL 2 -10.135 -7.751 -21.578 167 HG21 VAL 2 3HG2 VAL 2 -6.777 -9.069 -22.425 168 HG22 VAL 2 1HG2 VAL 2 -8.502 -9.050 -22.846 169 HG23 VAL 2 2HG2 VAL 2 -7.457 -7.657 -23.245 170 H ASN 3 H ASN 3 -7.395 -8.203 -18.593 171 HA ASN 3 HA ASN 3 -7.102 -5.959 -16.680 172 HB2 ASN 3 1HB ASN 3 -9.717 -7.316 -17.376 173 HB3 ASN 3 2HB ASN 3 -9.409 -6.637 -15.776 174 HD21 ASN 3 2HD2 ASN 3 -11.036 -5.941 -18.371 175 HD22 ASN 3 1HD2 ASN 3 -10.824 -4.197 -18.426 176 H GLN 4 H GLN 4 -9.087 -8.347 -15.438 177 HA GLN 4 HA GLN 4 -8.895 -10.180 -14.154 178 HB2 GLN 4 1HB GLN 4 -5.998 -10.486 -14.945 179 HB3 GLN 4 2HB GLN 4 -6.963 -11.674 -14.123 180 HG2 GLN 4 1HG GLN 4 -8.411 -11.836 -16.166 181 HG3 GLN 4 2HG GLN 4 -7.325 -10.702 -16.987 182 HE21 GLN 4 2HE2 GLN 4 -5.240 -11.364 -17.527 183 HE22 GLN 4 1HE2 GLN 4 -4.799 -13.064 -17.559 184 H HIS 5 H HIS 5 -7.675 -11.076 -12.182 185 HA HIS 5 HA HIS 5 -6.663 -8.817 -10.485 186 HB2 HIS 5 1HB HIS 5 -7.510 -11.726 -9.986 187 HB3 HIS 5 2HB HIS 5 -6.663 -10.728 -8.780 188 HD1 HIS 5 HD1 HIS 5 -10.009 -10.705 -10.621 189 HD2 HIS 5 HD2 HIS 5 -8.177 -9.119 -7.259 190 HE1 HIS 5 HE1 HIS 5 -11.814 -9.565 -9.229 191 H LEU 6 H LEU 6 -4.471 -8.745 -10.100 192 HA LEU 6 HA LEU 6 -2.841 -11.191 -10.755 193 HB2 LEU 6 1HB LEU 6 -2.222 -8.323 -11.491 194 HB3 LEU 6 2HB LEU 6 -1.034 -9.601 -11.475 195 HG LEU 6 HG LEU 6 -1.543 -9.153 -13.695 196 HD11 LEU 6 1HD1 LEU 6 -3.114 -11.633 -13.017 197 HD12 LEU 6 2HD1 LEU 6 -1.369 -11.511 -13.021 198 HD13 LEU 6 3HD1 LEU 6 -2.239 -11.247 -14.519 199 HD21 LEU 6 3HD2 LEU 6 -3.718 -9.280 -14.756 200 HD22 LEU 6 1HD2 LEU 6 -3.729 -8.041 -13.483 201 HD23 LEU 6 2HD2 LEU 6 -4.502 -9.640 -13.185 202 H CYS 7 H CYS 7 -1.540 -11.755 -9.073 203 HA CYS 7 HA CYS 7 -0.946 -9.667 -7.031 204 HB2 CYS 7 1HB CYS 7 -2.098 -12.439 -6.602 205 HB3 CYS 7 2HB CYS 7 -1.321 -11.486 -5.321 206 H GLY 8 H GLY 8 -0.042 -12.888 -8.322 207 HA2 GLY 8 1HA GLY 8 2.708 -12.313 -7.483 208 HA3 GLY 8 2HA GLY 8 1.958 -13.684 -6.670 209 H SER 9 H SER 9 1.097 -15.450 -8.176 210 HA SER 9 HA SER 9 3.222 -16.267 -9.867 211 HB2 SER 9 1HB SER 9 0.382 -17.300 -9.987 212 HB3 SER 9 2HB SER 9 1.904 -18.175 -10.319 213 HG SER 9 HG SER 9 2.196 -18.435 -8.239 214 H HIS 10 H HIS 10 -0.150 -15.529 -10.921 215 HA HIS 10 HA HIS 10 0.544 -15.307 -13.647 216 HB2 HIS 10 1HB HIS 10 -1.775 -14.093 -12.105 217 HB3 HIS 10 2HB HIS 10 -1.695 -14.142 -13.837 218 HD1 HIS 10 HD1 HIS 10 -4.041 -15.510 -12.361 219 HD2 HIS 10 HD2 HIS 10 -0.542 -17.476 -13.441 220 HE1 HIS 10 HE1 HIS 10 -4.584 -17.967 -12.451 221 H LEU 11 H LEU 11 1.226 -13.116 -11.149 222 HA LEU 11 HA LEU 11 0.993 -10.636 -12.586 223 HB2 LEU 11 1HB LEU 11 1.240 -10.908 -10.091 224 HB3 LEU 11 2HB LEU 11 2.903 -11.401 -10.357 225 HG LEU 11 HG LEU 11 3.411 -9.193 -11.299 226 HD11 LEU 11 1HD1 LEU 11 0.600 -8.459 -10.325 227 HD12 LEU 11 2HD1 LEU 11 1.166 -8.459 -12.009 228 HD13 LEU 11 3HD1 LEU 11 1.847 -7.295 -10.898 229 HD21 LEU 11 3HD2 LEU 11 2.253 -9.217 -8.489 230 HD22 LEU 11 1HD2 LEU 11 3.462 -8.061 -9.142 231 HD23 LEU 11 2HD2 LEU 11 3.859 -9.771 -8.963 232 H VAL 12 H VAL 12 3.426 -13.244 -12.377 233 HA VAL 12 HA VAL 12 5.512 -11.703 -13.623 234 HB VAL 12 HB VAL 12 5.073 -14.709 -13.554 235 HG11 VAL 12 1HG1 VAL 12 7.476 -14.927 -14.034 236 HG12 VAL 12 2HG1 VAL 12 6.648 -14.084 -15.386 237 HG13 VAL 12 3HG1 VAL 12 7.624 -13.151 -14.164 238 HG21 VAL 12 3HG2 VAL 12 6.676 -14.701 -11.701 239 HG22 VAL 12 1HG2 VAL 12 6.744 -12.924 -11.766 240 HG23 VAL 12 2HG2 VAL 12 5.221 -13.729 -11.309 241 H GLU 13 H GLU 13 3.066 -13.927 -14.848 242 HA GLU 13 HA GLU 13 3.786 -13.744 -17.595 243 HB2 GLU 13 1HB GLU 13 1.110 -14.356 -16.303 244 HB3 GLU 13 2HB GLU 13 1.373 -14.358 -18.045 245 HG2 GLU 13 1HG GLU 13 1.613 -16.586 -17.515 246 HG3 GLU 13 2HG GLU 13 3.288 -16.065 -17.546 247 H ALA 14 H ALA 14 1.602 -11.734 -15.579 248 HA ALA 14 HA ALA 14 0.572 -10.163 -17.722 249 HB1 ALA 14 3HB ALA 14 1.136 -9.161 -14.908 250 HB2 ALA 14 1HB ALA 14 -0.158 -8.659 -16.002 251 HB3 ALA 14 2HB ALA 14 -0.197 -10.288 -15.319 252 H LEU 15 H LEU 15 3.412 -9.655 -15.536 253 HA LEU 15 HA LEU 15 4.214 -7.167 -16.666 254 HB2 LEU 15 1HB LEU 15 5.462 -9.290 -14.968 255 HB3 LEU 15 2HB LEU 15 6.548 -8.210 -15.785 256 HG LEU 15 HG LEU 15 6.122 -7.591 -13.430 257 HD11 LEU 15 1HD1 LEU 15 5.134 -5.496 -15.393 258 HD12 LEU 15 2HD1 LEU 15 6.832 -6.010 -15.222 259 HD13 LEU 15 3HD1 LEU 15 6.000 -5.250 -13.858 260 HD21 LEU 15 3HD2 LEU 15 3.342 -6.731 -14.323 261 HD22 LEU 15 1HD2 LEU 15 4.067 -6.480 -12.734 262 HD23 LEU 15 2HD2 LEU 15 3.712 -8.125 -13.300 263 H TYR 16 H TYR 16 5.130 -10.522 -17.355 264 HA TYR 16 HA TYR 16 7.123 -9.965 -19.317 265 HB2 TYR 16 1HB TYR 16 6.658 -12.165 -18.170 266 HB3 TYR 16 2HB TYR 16 5.220 -12.344 -19.184 267 HD1 TYR 16 HD1 TYR 16 8.950 -11.981 -19.374 268 HD2 TYR 16 HD2 TYR 16 5.363 -13.364 -21.294 269 HE1 TYR 16 HE1 TYR 16 10.308 -13.055 -21.182 270 HE2 TYR 16 HE2 TYR 16 6.735 -14.428 -23.095 271 HH TYR 16 HH TYR 16 8.879 -14.854 -23.907 272 H LEU 17 H LEU 17 3.557 -10.475 -19.681 273 HA LEU 17 HA LEU 17 3.653 -10.384 -22.560 274 HB2 LEU 17 1HB LEU 17 1.404 -9.962 -20.577 275 HB3 LEU 17 2HB LEU 17 1.166 -9.865 -22.333 276 HG LEU 17 HG LEU 17 2.313 -12.349 -20.969 277 HD11 LEU 17 1HD1 LEU 17 0.102 -11.970 -20.058 278 HD12 LEU 17 2HD1 LEU 17 0.011 -13.311 -21.231 279 HD13 LEU 17 3HD1 LEU 17 -0.544 -11.687 -21.666 280 HD21 LEU 17 3HD2 LEU 17 1.100 -11.878 -23.694 281 HD22 LEU 17 1HD2 LEU 17 1.608 -13.481 -23.050 282 HD23 LEU 17 2HD2 LEU 17 2.824 -12.226 -23.327 283 H VAL 18 H VAL 18 3.234 -7.860 -20.082 284 HA VAL 18 HA VAL 18 2.465 -5.923 -22.180 285 HB VAL 18 HB VAL 18 2.976 -5.552 -19.185 286 HG11 VAL 18 1HG1 VAL 18 1.790 -3.625 -21.238 287 HG12 VAL 18 2HG1 VAL 18 1.689 -3.393 -19.478 288 HG13 VAL 18 3HG1 VAL 18 3.261 -3.384 -20.278 289 HG21 VAL 18 3HG2 VAL 18 0.452 -5.930 -20.882 290 HG22 VAL 18 1HG2 VAL 18 1.036 -6.976 -19.565 291 HG23 VAL 18 2HG2 VAL 18 0.383 -5.365 -19.200 292 H CYS 19 H CYS 19 5.273 -6.140 -19.870 293 HA CYS 19 HA CYS 19 6.512 -3.930 -21.375 294 HB2 CYS 19 1HB CYS 19 7.313 -5.397 -18.883 295 HB3 CYS 19 2HB CYS 19 8.279 -4.148 -19.653 296 H GLY 20 H GLY 20 6.499 -7.332 -21.536 297 HA2 GLY 20 1HA GLY 20 7.642 -8.733 -23.001 298 HA3 GLY 20 2HA GLY 20 8.108 -7.287 -23.878 299 H GLU 21 H GLU 21 8.912 -8.432 -20.609 300 HA GLU 21 HA GLU 21 10.880 -8.911 -19.545 301 HB2 GLU 21 1HB GLU 21 11.371 -10.250 -21.584 302 HB3 GLU 21 2HB GLU 21 12.301 -8.874 -22.188 303 HG2 GLU 21 1HG GLU 21 13.654 -9.023 -20.018 304 HG3 GLU 21 2HG GLU 21 12.868 -10.615 -19.753 305 H ARG 22 H ARG 22 10.996 -6.347 -21.938 306 HA ARG 22 HA ARG 22 13.336 -4.986 -20.971 307 HB2 ARG 22 1HB ARG 22 10.988 -3.893 -22.518 308 HB3 ARG 22 2HB ARG 22 12.603 -3.135 -22.421 309 HG2 ARG 22 1HG ARG 22 13.600 -4.905 -23.658 310 HG3 ARG 22 2HG ARG 22 12.111 -5.883 -23.647 311 HD2 ARG 22 1HD ARG 22 12.472 -3.176 -25.022 312 HD3 ARG 22 2HD ARG 22 12.355 -4.770 -25.802 313 HE ARG 22 HE ARG 22 10.160 -3.223 -24.583 314 HH11 ARG 22 1HH1 ARG 22 11.122 -6.334 -25.886 315 HH12 ARG 22 2HH1 ARG 22 9.497 -6.820 -26.190 316 HH21 ARG 22 1HH2 ARG 22 8.064 -3.931 -24.944 317 HH22 ARG 22 2HH2 ARG 22 7.783 -5.479 -25.660 318 H GLY 23 H GLY 23 11.595 -5.446 -18.696 319 HA2 GLY 23 1HA GLY 23 11.782 -2.778 -17.600 320 HA3 GLY 23 2HA GLY 23 10.087 -3.199 -17.958 321 H PHE 24 H PHE 24 11.601 -6.110 -16.976 322 HA PHE 24 HA PHE 24 11.328 -5.416 -14.126 323 HB2 PHE 24 1HB PHE 24 9.572 -6.917 -13.598 324 HB3 PHE 24 2HB PHE 24 9.032 -6.025 -15.046 325 HD1 PHE 24 HD2 PHE 24 9.156 -7.142 -17.321 326 HD2 PHE 24 HD1 PHE 24 9.770 -9.270 -13.609 327 HE1 PHE 24 HE2 PHE 24 8.778 -9.317 -18.494 328 HE2 PHE 24 HE1 PHE 24 9.379 -11.430 -14.802 329 HZ PHE 24 HZ PHE 24 8.861 -11.447 -17.241 330 H PHE 25 H PHE 25 11.949 -7.176 -12.707 331 HA PHE 25 HA PHE 25 13.574 -9.303 -14.013 332 HB2 PHE 25 1HB PHE 25 15.125 -7.481 -13.402 333 HB3 PHE 25 2HB PHE 25 14.510 -7.529 -11.755 334 HD1 PHE 25 HD2 PHE 25 15.050 -9.371 -10.234 335 HD2 PHE 25 HD1 PHE 25 16.604 -9.273 -14.249 336 HE1 PHE 25 HE2 PHE 25 16.712 -11.110 -9.637 337 HE2 PHE 25 HE1 PHE 25 18.264 -10.998 -13.650 338 HZ PHE 25 HZ PHE 25 18.337 -11.949 -11.344 339 H NVA 26 H ARX 26 12.808 -11.127 -13.302 340 HA NVA 26 HA ARX 26 11.511 -11.332 -10.628 341 HB2 NVA 26 1HB ARX 26 10.061 -12.042 -12.499 342 HB3 NVA 26 2HB ARX 26 11.375 -13.083 -13.098 343 HG2 NVA 26 1HG ARX 26 9.695 -14.493 -11.993 344 HG3 NVA 26 2HG ARX 26 11.164 -14.550 -11.109 345 HD2 NVA 26 1HD ARX 26 10.045 -12.701 -9.608 346 HD3 NVA 26 2HD ARX 26 8.539 -13.209 -10.354 347 H THR 27 H THR 27 12.244 -12.314 -9.004 348 HA THR 27 HA THR 27 14.999 -13.230 -8.901 349 HB THR 27 HB THR 27 14.379 -13.932 -6.566 350 HG1 THR 27 HG1 THR 27 12.002 -14.142 -7.456 351 HG21 THR 27 1HG2 THR 27 14.104 -11.695 -5.704 352 HG22 THR 27 2HG2 THR 27 13.335 -11.131 -7.218 353 HG23 THR 27 3HG2 THR 27 15.068 -11.572 -7.231 354 HA PRO 28 HA PRO 28 14.007 -17.375 -9.989 355 HB2 PRO 28 1HB PRO 28 15.853 -18.941 -8.730 356 HB3 PRO 28 2HB PRO 28 16.314 -17.794 -10.036 357 HG2 PRO 28 1HG PRO 28 16.448 -17.426 -7.061 358 HG3 PRO 28 2HG PRO 28 17.698 -17.132 -8.305 359 HD2 PRO 28 1HD PRO 28 16.181 -15.144 -7.324 360 HD3 PRO 28 2HD PRO 28 16.732 -15.129 -9.036 361 H HIX 29 H HIX 29 11.953 -17.348 -9.034 362 HA HIX 29 HA HIX 29 11.343 -18.142 -6.371 363 HB1 HIX 29 1HB HIX 29 9.491 -18.660 -8.749 364 HB2 HIX 29 2HB HIX 29 9.040 -18.333 -7.035 365 HD2 HIX 29 HD2 HIX 29 9.442 -16.442 -10.283 366 HD1 HIX 29 HD1 HIX 29 9.853 -15.733 -6.211 367 HE1 HIX 29 HE1 HIX 29 8.424 -14.086 -7.527 368 H THR 30 H THR 30 11.896 -19.931 -5.428 369 HA THR 30 HA THR 30 11.822 -22.553 -6.836 370 HB THR 30 HB THR 30 13.650 -21.833 -4.534 371 HG1 THR 30 HG1 THR 30 14.017 -20.534 -6.495 372 HG21 THR 30 1HG2 THR 30 13.686 -24.020 -6.605 373 HG22 THR 30 2HG2 THR 30 13.376 -24.229 -4.884 374 HG23 THR 30 3HG2 THR 30 14.986 -23.732 -5.435 Start of MODEL 13 1 H1 GLY 1 1H GLY 1 0.752 -0.948 0.221 2 H2 GLY 1 2H GLY 1 1.216 -2.554 0.097 3 H3 GLY 1 3H GLY 1 2.102 -1.498 0.989 4 HA2 GLY 1 1HA GLY 1 2.565 -0.224 -1.056 5 HA3 GLY 1 2HA GLY 1 3.277 -1.821 -1.084 6 H ILE 2 H ILE 2 2.832 -0.760 -3.586 7 HA ILE 2 HA ILE 2 0.276 -0.914 -4.690 8 HB ILE 2 HB ILE 2 2.295 0.099 -5.752 9 HG12 ILE 2 1HG1 ILE 2 1.085 -1.987 -7.505 10 HG13 ILE 2 2HG1 ILE 2 0.268 -0.497 -7.065 11 HG21 ILE 2 1HG2 ILE 2 3.982 -1.683 -5.213 12 HG22 ILE 2 2HG2 ILE 2 3.237 -2.743 -6.420 13 HG23 ILE 2 3HG2 ILE 2 4.045 -1.245 -6.918 14 HD11 ILE 2 3HD1 ILE 2 2.868 -0.767 -8.658 15 HD12 ILE 2 1HD1 ILE 2 1.299 -0.450 -9.326 16 HD13 ILE 2 2HD1 ILE 2 2.036 0.768 -8.302 17 H VAL 3 H VAL 3 2.504 -3.729 -4.153 18 HA VAL 3 HA VAL 3 1.097 -5.469 -5.869 19 HB VAL 3 HB VAL 3 1.994 -7.220 -4.069 20 HG11 VAL 3 1HG1 VAL 3 3.990 -7.382 -5.282 21 HG12 VAL 3 2HG1 VAL 3 2.745 -6.852 -6.421 22 HG13 VAL 3 3HG1 VAL 3 3.960 -5.698 -5.783 23 HG21 VAL 3 3HG2 VAL 3 2.533 -5.270 -2.438 24 HG22 VAL 3 1HG2 VAL 3 3.776 -6.492 -2.712 25 HG23 VAL 3 2HG2 VAL 3 3.889 -4.931 -3.494 26 H GLU 4 H GLU 4 0.425 -4.564 -2.471 27 HA GLU 4 HA GLU 4 -1.596 -6.580 -2.022 28 HB2 GLU 4 1HB GLU 4 -1.059 -3.780 -0.882 29 HB3 GLU 4 2HB GLU 4 -2.301 -4.865 -0.257 30 HG2 GLU 4 1HG GLU 4 0.388 -6.031 -0.511 31 HG3 GLU 4 2HG GLU 4 0.277 -4.682 0.609 32 H GLN 5 H GLN 5 -1.672 -3.200 -3.316 33 HA GLN 5 HA GLN 5 -4.550 -3.009 -3.330 34 HB2 GLN 5 1HB GLN 5 -2.914 -1.096 -3.447 35 HB3 GLN 5 2HB GLN 5 -2.521 -1.556 -5.110 36 HG2 GLN 5 1HG GLN 5 -4.784 -1.068 -5.818 37 HG3 GLN 5 2HG GLN 5 -5.296 -0.779 -4.158 38 HE21 GLN 5 2HE2 GLN 5 -6.023 1.335 -4.856 39 HE22 GLN 5 1HE2 GLN 5 -4.833 2.597 -5.098 40 H CYS 6 H CYS 6 -2.072 -3.931 -5.771 41 HA CYS 6 HA CYS 6 -3.968 -4.362 -7.889 42 HB2 CYS 6 1HB CYS 6 -1.158 -4.343 -7.696 43 HB3 CYS 6 2HB CYS 6 -1.554 -6.022 -8.035 44 H CYS 7 H CYS 7 -2.720 -6.436 -5.281 45 HA CYS 7 HA CYS 7 -3.449 -8.958 -6.452 46 HB2 CYS 7 1HB CYS 7 -1.818 -8.811 -4.572 47 HB3 CYS 7 2HB CYS 7 -3.001 -7.982 -3.587 48 H THR 8 H THR 8 -4.910 -6.836 -3.979 49 HA THR 8 HA THR 8 -7.227 -8.524 -3.770 50 HB THR 8 HB THR 8 -8.037 -6.631 -2.179 51 HG1 THR 8 HG1 THR 8 -5.439 -5.503 -2.612 52 HG21 THR 8 1HG2 THR 8 -6.583 -8.541 -1.381 53 HG22 THR 8 2HG2 THR 8 -6.326 -7.016 -0.508 54 HG23 THR 8 3HG2 THR 8 -5.141 -7.512 -1.713 55 H SER 9 H SER 9 -6.602 -7.182 -6.420 56 HA SER 9 HA SER 9 -9.369 -6.140 -6.848 57 HB2 SER 9 1HB SER 9 -7.918 -4.231 -5.814 58 HB3 SER 9 2HB SER 9 -7.086 -4.208 -7.383 59 HG SER 9 HG SER 9 -8.832 -2.708 -7.122 60 H ILE 10 H ILE 10 -9.221 -4.821 -9.046 61 HA ILE 10 HA ILE 10 -8.117 -6.719 -11.065 62 HB ILE 10 HB ILE 10 -10.048 -4.318 -11.254 63 HG12 ILE 10 1HG1 ILE 10 -11.174 -6.230 -10.187 64 HG13 ILE 10 2HG1 ILE 10 -11.755 -6.063 -11.856 65 HG21 ILE 10 1HG2 ILE 10 -10.465 -5.023 -13.596 66 HG22 ILE 10 2HG2 ILE 10 -8.732 -4.617 -13.362 67 HG23 ILE 10 3HG2 ILE 10 -9.229 -6.305 -13.411 68 HD11 ILE 10 3HD1 ILE 10 -10.356 -7.997 -12.572 69 HD12 ILE 10 1HD1 ILE 10 -9.715 -8.150 -10.915 70 HD13 ILE 10 2HD1 ILE 10 -11.471 -8.424 -11.212 71 H CYS 11 H CYS 11 -5.991 -6.252 -11.511 72 HA CYS 11 HA CYS 11 -4.772 -3.693 -11.298 73 HB2 CYS 11 1HB CYS 11 -4.008 -6.140 -12.949 74 HB3 CYS 11 2HB CYS 11 -2.977 -4.709 -12.664 75 H SER 12 H SER 12 -5.091 -2.007 -12.541 76 HA SER 12 HA SER 12 -6.238 -2.182 -15.178 77 HB2 SER 12 1HB SER 12 -4.941 0.139 -13.697 78 HB3 SER 12 2HB SER 12 -5.932 0.260 -15.163 79 HG SER 12 HG SER 12 -7.234 0.622 -13.275 80 H LEU 13 H LEU 13 -5.051 -1.345 -17.105 81 HA LEU 13 HA LEU 13 -2.511 -2.509 -17.443 82 HB2 LEU 13 1HB LEU 13 -4.068 -1.947 -19.291 83 HB3 LEU 13 2HB LEU 13 -3.722 -0.252 -19.022 84 HG LEU 13 HG LEU 13 -1.418 -0.513 -19.777 85 HD11 LEU 13 1HD1 LEU 13 -0.995 -2.857 -19.135 86 HD12 LEU 13 2HD1 LEU 13 -0.660 -2.576 -20.830 87 HD13 LEU 13 3HD1 LEU 13 -2.123 -3.423 -20.384 88 HD21 LEU 13 3HD2 LEU 13 -3.229 -0.032 -21.426 89 HD22 LEU 13 1HD2 LEU 13 -3.471 -1.739 -21.699 90 HD23 LEU 13 2HD2 LEU 13 -1.947 -0.964 -22.132 91 H TYR 14 H TYR 14 -3.315 0.869 -16.646 92 HA TYR 14 HA TYR 14 -0.556 1.705 -16.889 93 HB2 TYR 14 1HB TYR 14 -1.399 3.784 -15.689 94 HB3 TYR 14 2HB TYR 14 -2.195 3.341 -17.190 95 HD1 TYR 14 HD1 TYR 14 -2.617 3.380 -13.439 96 HD2 TYR 14 HD2 TYR 14 -4.623 2.781 -17.233 97 HE1 TYR 14 HE1 TYR 14 -4.813 3.478 -12.324 98 HE2 TYR 14 HE2 TYR 14 -6.866 2.801 -16.041 99 HH TYR 14 HH TYR 14 -7.928 3.305 -14.006 100 H GLN 15 H GLN 15 -2.478 0.304 -14.277 101 HA GLN 15 HA GLN 15 -0.521 0.992 -12.207 102 HB2 GLN 15 1HB GLN 15 -2.581 -1.184 -12.343 103 HB3 GLN 15 2HB GLN 15 -1.631 -0.764 -10.891 104 HG2 GLN 15 1HG GLN 15 -2.657 1.455 -10.796 105 HG3 GLN 15 2HG GLN 15 -3.520 1.184 -12.316 106 HE21 GLN 15 2HE2 GLN 15 -4.443 1.795 -9.577 107 HE22 GLN 15 1HE2 GLN 15 -5.613 0.538 -9.201 108 H LEU 16 H LEU 16 -1.026 -1.673 -14.537 109 HA LEU 16 HA LEU 16 1.099 -3.312 -13.461 110 HB2 LEU 16 1HB LEU 16 -0.605 -4.051 -15.067 111 HB3 LEU 16 2HB LEU 16 0.108 -3.027 -16.305 112 HG LEU 16 HG LEU 16 1.505 -5.409 -15.019 113 HD11 LEU 16 1HD1 LEU 16 0.885 -6.471 -17.109 114 HD12 LEU 16 2HD1 LEU 16 -0.066 -5.020 -17.557 115 HD13 LEU 16 3HD1 LEU 16 -0.527 -5.983 -16.111 116 HD21 LEU 16 3HD2 LEU 16 3.130 -3.835 -16.097 117 HD22 LEU 16 1HD2 LEU 16 2.171 -3.908 -17.596 118 HD23 LEU 16 2HD2 LEU 16 2.964 -5.384 -16.950 119 H GLU 17 H GLU 17 0.965 -0.805 -15.970 120 HA GLU 17 HA GLU 17 3.722 -0.946 -16.695 121 HB2 GLU 17 1HB GLU 17 1.503 1.063 -16.973 122 HB3 GLU 17 2HB GLU 17 3.197 1.582 -17.281 123 HG2 GLU 17 1HG GLU 17 3.313 -0.488 -18.828 124 HG3 GLU 17 2HG GLU 17 1.558 -0.603 -18.694 125 H ASN 18 H ASN 18 2.138 0.636 -13.985 126 HA ASN 18 HA ASN 18 4.209 2.536 -13.351 127 HB2 ASN 18 1HB ASN 18 1.819 2.305 -12.441 128 HB3 ASN 18 2HB ASN 18 2.464 1.035 -11.391 129 HD21 ASN 18 2HD2 ASN 18 1.778 4.291 -11.691 130 HD22 ASN 18 1HD2 ASN 18 2.735 4.890 -10.350 131 H TYR 19 H TYR 19 3.934 -0.988 -12.883 132 HA TYR 19 HA TYR 19 6.154 -1.220 -11.004 133 HB2 TYR 19 1HB TYR 19 4.913 -3.195 -12.969 134 HB3 TYR 19 2HB TYR 19 6.227 -3.571 -11.867 135 HD1 TYR 19 HD1 TYR 19 2.648 -2.770 -11.982 136 HD2 TYR 19 HD2 TYR 19 5.852 -4.096 -9.564 137 HE1 TYR 19 HE1 TYR 19 1.011 -3.430 -10.255 138 HE2 TYR 19 HE2 TYR 19 4.190 -4.843 -7.825 139 HH TYR 19 HH TYR 19 1.965 -5.007 -7.278 140 H CYS 20 H CYS 20 5.970 -0.783 -14.527 141 HA CYS 20 HA CYS 20 8.663 -1.963 -14.897 142 HB2 CYS 20 1HB CYS 20 6.794 -0.639 -16.905 143 HB3 CYS 20 2HB CYS 20 8.239 -1.601 -17.267 144 H ASN 21 H ASN 21 10.454 -0.811 -14.795 145 HA ASN 21 HA ASN 21 10.240 2.011 -14.063 146 HB2 ASN 21 1HB ASN 21 12.743 0.326 -14.612 147 HB3 ASN 21 2HB ASN 21 12.728 1.926 -13.933 148 HD21 ASN 21 2HD2 ASN 21 12.766 -1.321 -13.235 149 HD22 ASN 21 1HD2 ASN 21 12.288 -1.246 -11.555 150 H1 PHE 1 1H PHE 1 -2.157 -7.621 -23.279 151 H2 PHE 1 2H PHE 1 -3.494 -8.446 -23.446 152 H3 PHE 1 3H PHE 1 -3.510 -6.748 -23.292 153 HA PHE 1 HA PHE 1 -2.609 -8.591 -21.186 154 HB2 PHE 1 1HB PHE 1 -1.729 -6.329 -21.077 155 HB3 PHE 1 2HB PHE 1 -3.353 -5.661 -21.244 156 HD1 PHE 1 HD1 PHE 1 -1.731 -8.373 -19.137 157 HD2 PHE 1 HD2 PHE 1 -4.089 -4.699 -19.176 158 HE1 PHE 1 HE1 PHE 1 -2.002 -8.422 -16.680 159 HE2 PHE 1 HE2 PHE 1 -4.244 -4.825 -16.770 160 HZ PHE 1 HZ PHE 1 -3.165 -6.675 -15.485 161 H VAL 2 H VAL 2 -4.199 -9.339 -19.660 162 HA VAL 2 HA VAL 2 -7.050 -8.490 -20.232 163 HB VAL 2 HB VAL 2 -7.871 -10.791 -19.698 164 HG11 VAL 2 1HG1 VAL 2 -5.843 -10.764 -22.000 165 HG12 VAL 2 2HG1 VAL 2 -7.178 -11.929 -21.838 166 HG13 VAL 2 3HG1 VAL 2 -7.493 -10.202 -22.126 167 HG21 VAL 2 3HG2 VAL 2 -6.296 -12.762 -19.609 168 HG22 VAL 2 1HG2 VAL 2 -4.906 -11.660 -19.785 169 HG23 VAL 2 2HG2 VAL 2 -5.874 -11.625 -18.326 170 H ASN 3 H ASN 3 -8.472 -8.684 -18.346 171 HA ASN 3 HA ASN 3 -6.950 -7.979 -15.907 172 HB2 ASN 3 1HB ASN 3 -9.056 -6.491 -15.476 173 HB3 ASN 3 2HB ASN 3 -7.983 -5.973 -16.763 174 HD21 ASN 3 2HD2 ASN 3 -11.138 -6.567 -15.927 175 HD22 ASN 3 1HD2 ASN 3 -11.830 -6.615 -17.557 176 H GLN 4 H GLN 4 -6.934 -9.725 -14.581 177 HA GLN 4 HA GLN 4 -9.561 -10.583 -13.611 178 HB2 GLN 4 1HB GLN 4 -9.096 -11.800 -15.727 179 HB3 GLN 4 2HB GLN 4 -7.716 -12.595 -14.936 180 HG2 GLN 4 1HG GLN 4 -9.105 -13.667 -13.392 181 HG3 GLN 4 2HG GLN 4 -10.478 -12.649 -13.817 182 HE21 GLN 4 2HE2 GLN 4 -8.182 -14.723 -15.616 183 HE22 GLN 4 1HE2 GLN 4 -9.415 -15.546 -16.508 184 H HIS 5 H HIS 5 -8.630 -9.704 -11.675 185 HA HIS 5 HA HIS 5 -7.230 -9.622 -9.815 186 HB2 HIS 5 1HB HIS 5 -9.035 -11.999 -9.782 187 HB3 HIS 5 2HB HIS 5 -7.797 -11.883 -8.515 188 HD1 HIS 5 HD1 HIS 5 -10.900 -10.083 -9.779 189 HD2 HIS 5 HD2 HIS 5 -8.110 -9.844 -6.645 190 HE1 HIS 5 HE1 HIS 5 -11.785 -8.439 -8.047 191 H LEU 6 H LEU 6 -5.199 -9.738 -11.074 192 HA LEU 6 HA LEU 6 -3.908 -12.356 -11.404 193 HB2 LEU 6 1HB LEU 6 -2.724 -9.551 -11.769 194 HB3 LEU 6 2HB LEU 6 -2.144 -11.057 -12.504 195 HG LEU 6 HG LEU 6 -4.856 -9.806 -13.090 196 HD11 LEU 6 1HD1 LEU 6 -2.960 -8.302 -13.732 197 HD12 LEU 6 2HD1 LEU 6 -3.785 -8.991 -15.139 198 HD13 LEU 6 3HD1 LEU 6 -2.223 -9.645 -14.607 199 HD21 LEU 6 3HD2 LEU 6 -4.836 -11.334 -15.049 200 HD22 LEU 6 1HD2 LEU 6 -4.555 -12.341 -13.632 201 HD23 LEU 6 2HD2 LEU 6 -3.180 -11.877 -14.669 202 H CYS 7 H CYS 7 -4.267 -12.084 -8.665 203 HA CYS 7 HA CYS 7 -1.893 -10.903 -7.424 204 HB2 CYS 7 1HB CYS 7 -4.120 -11.192 -6.291 205 HB3 CYS 7 2HB CYS 7 -3.907 -12.942 -6.267 206 H GLY 8 H GLY 8 0.084 -11.533 -7.536 207 HA2 GLY 8 1HA GLY 8 1.760 -13.070 -6.792 208 HA3 GLY 8 2HA GLY 8 0.583 -14.368 -6.757 209 H SER 9 H SER 9 0.746 -15.883 -8.429 210 HA SER 9 HA SER 9 2.997 -15.737 -10.141 211 HB2 SER 9 1HB SER 9 1.771 -17.789 -11.273 212 HB3 SER 9 2HB SER 9 2.401 -17.921 -9.628 213 HG SER 9 HG SER 9 0.123 -18.614 -10.224 214 H HIS 10 H HIS 10 -0.519 -15.197 -10.876 215 HA HIS 10 HA HIS 10 -0.020 -15.040 -13.689 216 HB2 HIS 10 1HB HIS 10 -2.216 -13.952 -11.891 217 HB3 HIS 10 2HB HIS 10 -2.193 -13.760 -13.713 218 HD1 HIS 10 HD1 HIS 10 -4.522 -15.341 -12.341 219 HD2 HIS 10 HD2 HIS 10 -0.964 -17.097 -13.715 220 HE1 HIS 10 HE1 HIS 10 -4.977 -17.792 -12.844 221 H LEU 11 H LEU 11 0.744 -12.742 -11.119 222 HA LEU 11 HA LEU 11 0.614 -10.445 -12.856 223 HB2 LEU 11 1HB LEU 11 0.741 -10.489 -10.331 224 HB3 LEU 11 2HB LEU 11 2.435 -10.831 -10.481 225 HG LEU 11 HG LEU 11 2.732 -8.681 -11.685 226 HD11 LEU 11 1HD1 LEU 11 -0.083 -7.942 -10.791 227 HD12 LEU 11 2HD1 LEU 11 0.380 -8.311 -12.460 228 HD13 LEU 11 3HD1 LEU 11 1.099 -6.919 -11.648 229 HD21 LEU 11 3HD2 LEU 11 2.956 -9.028 -9.099 230 HD22 LEU 11 1HD2 LEU 11 1.427 -8.196 -8.960 231 HD23 LEU 11 2HD2 LEU 11 2.794 -7.371 -9.682 232 H VAL 12 H VAL 12 3.076 -12.958 -12.178 233 HA VAL 12 HA VAL 12 5.262 -11.544 -13.359 234 HB VAL 12 HB VAL 12 4.790 -14.594 -13.307 235 HG11 VAL 12 1HG1 VAL 12 7.314 -14.620 -13.173 236 HG12 VAL 12 2HG1 VAL 12 6.642 -14.084 -14.707 237 HG13 VAL 12 3HG1 VAL 12 7.313 -12.906 -13.558 238 HG21 VAL 12 3HG2 VAL 12 5.995 -14.585 -11.127 239 HG22 VAL 12 1HG2 VAL 12 5.999 -12.828 -11.098 240 HG23 VAL 12 2HG2 VAL 12 4.472 -13.709 -11.027 241 H GLU 13 H GLU 13 2.866 -13.771 -14.736 242 HA GLU 13 HA GLU 13 3.943 -13.714 -17.383 243 HB2 GLU 13 1HB GLU 13 1.061 -14.181 -16.515 244 HB3 GLU 13 2HB GLU 13 1.766 -14.543 -18.111 245 HG2 GLU 13 1HG GLU 13 3.302 -16.197 -17.022 246 HG3 GLU 13 2HG GLU 13 2.579 -15.794 -15.458 247 H ALA 14 H ALA 14 1.621 -11.638 -15.570 248 HA ALA 14 HA ALA 14 0.631 -10.178 -17.791 249 HB1 ALA 14 3HB ALA 14 1.009 -9.434 -14.918 250 HB2 ALA 14 1HB ALA 14 0.149 -8.416 -16.078 251 HB3 ALA 14 2HB ALA 14 -0.460 -10.043 -15.726 252 H LEU 15 H LEU 15 3.436 -9.595 -15.607 253 HA LEU 15 HA LEU 15 4.317 -7.135 -16.880 254 HB2 LEU 15 1HB LEU 15 5.828 -9.241 -15.240 255 HB3 LEU 15 2HB LEU 15 6.491 -7.685 -15.737 256 HG LEU 15 HG LEU 15 3.934 -7.825 -14.129 257 HD11 LEU 15 1HD1 LEU 15 5.679 -9.143 -12.860 258 HD12 LEU 15 2HD1 LEU 15 5.103 -7.684 -12.022 259 HD13 LEU 15 3HD1 LEU 15 6.674 -7.665 -12.841 260 HD21 LEU 15 3HD2 LEU 15 4.643 -5.632 -13.376 261 HD22 LEU 15 1HD2 LEU 15 4.501 -5.708 -15.139 262 HD23 LEU 15 2HD2 LEU 15 6.112 -5.791 -14.377 263 H TYR 16 H TYR 16 5.058 -10.594 -17.408 264 HA TYR 16 HA TYR 16 7.118 -10.279 -19.344 265 HB2 TYR 16 1HB TYR 16 6.361 -12.358 -18.071 266 HB3 TYR 16 2HB TYR 16 5.083 -12.507 -19.289 267 HD1 TYR 16 HD2 TYR 16 8.776 -11.835 -19.359 268 HD2 TYR 16 HD1 TYR 16 5.470 -14.131 -20.924 269 HE1 TYR 16 HE2 TYR 16 10.353 -12.976 -20.925 270 HE2 TYR 16 HE1 TYR 16 7.056 -15.303 -22.465 271 HH TYR 16 HH TYR 16 9.257 -15.583 -23.144 272 H LEU 17 H LEU 17 3.606 -10.505 -19.732 273 HA LEU 17 HA LEU 17 3.664 -10.445 -22.652 274 HB2 LEU 17 1HB LEU 17 1.521 -9.867 -20.589 275 HB3 LEU 17 2HB LEU 17 1.252 -9.790 -22.321 276 HG LEU 17 HG LEU 17 2.308 -12.245 -20.966 277 HD11 LEU 17 1HD1 LEU 17 0.105 -11.705 -20.056 278 HD12 LEU 17 2HD1 LEU 17 -0.057 -13.064 -21.173 279 HD13 LEU 17 3HD1 LEU 17 -0.517 -11.429 -21.641 280 HD21 LEU 17 3HD2 LEU 17 0.987 -11.875 -23.687 281 HD22 LEU 17 1HD2 LEU 17 1.567 -13.412 -22.984 282 HD23 LEU 17 2HD2 LEU 17 2.730 -12.140 -23.443 283 H VAL 18 H VAL 18 3.354 -7.924 -20.113 284 HA VAL 18 HA VAL 18 2.765 -5.956 -22.254 285 HB VAL 18 HB VAL 18 2.876 -5.698 -19.248 286 HG11 VAL 18 1HG1 VAL 18 3.367 -3.477 -20.215 287 HG12 VAL 18 2HG1 VAL 18 2.081 -3.662 -21.425 288 HG13 VAL 18 3HG1 VAL 18 1.683 -3.434 -19.699 289 HG21 VAL 18 3HG2 VAL 18 0.953 -7.008 -19.947 290 HG22 VAL 18 1HG2 VAL 18 0.336 -5.383 -19.600 291 HG23 VAL 18 2HG2 VAL 18 0.573 -5.870 -21.259 292 H CYS 19 H CYS 19 5.306 -6.212 -19.617 293 HA CYS 19 HA CYS 19 6.787 -4.094 -21.143 294 HB2 CYS 19 1HB CYS 19 7.168 -5.209 -18.312 295 HB3 CYS 19 2HB CYS 19 8.026 -3.853 -18.974 296 H GLY 20 H GLY 20 6.769 -7.430 -20.677 297 HA2 GLY 20 1HA GLY 20 8.203 -9.101 -21.097 298 HA3 GLY 20 2HA GLY 20 9.188 -7.928 -21.985 299 H GLU 21 H GLU 21 11.102 -8.990 -21.207 300 HA GLU 21 HA GLU 21 11.708 -9.269 -18.476 301 HB2 GLU 21 1HB GLU 21 12.717 -10.321 -20.573 302 HB3 GLU 21 2HB GLU 21 13.669 -8.850 -20.746 303 HG2 GLU 21 1HG GLU 21 14.863 -9.387 -18.575 304 HG3 GLU 21 2HG GLU 21 13.635 -10.608 -18.209 305 H ARG 22 H ARG 22 11.438 -6.405 -20.331 306 HA ARG 22 HA ARG 22 13.612 -4.990 -18.818 307 HB2 ARG 22 1HB ARG 22 11.424 -3.966 -20.728 308 HB3 ARG 22 2HB ARG 22 12.710 -2.979 -19.994 309 HG2 ARG 22 1HG ARG 22 14.350 -4.490 -21.213 310 HG3 ARG 22 2HG ARG 22 12.982 -5.219 -22.078 311 HD2 ARG 22 1HD ARG 22 13.869 -2.248 -22.124 312 HD3 ARG 22 2HD ARG 22 14.136 -3.467 -23.433 313 HE ARG 22 HE ARG 22 11.379 -3.293 -22.869 314 HH11 ARG 22 1HH1 ARG 22 13.955 -1.560 -24.609 315 HH12 ARG 22 2HH1 ARG 22 12.867 -0.882 -25.755 316 HH21 ARG 22 1HH2 ARG 22 10.061 -2.337 -24.424 317 HH22 ARG 22 2HH2 ARG 22 10.706 -1.314 -25.650 318 H GLY 23 H GLY 23 10.502 -5.931 -18.000 319 HA2 GLY 23 1HA GLY 23 10.073 -3.541 -16.291 320 HA3 GLY 23 2HA GLY 23 8.853 -4.699 -16.723 321 H PHE 24 H PHE 24 11.116 -6.891 -16.011 322 HA PHE 24 HA PHE 24 11.132 -6.622 -13.072 323 HB2 PHE 24 1HB PHE 24 9.722 -8.432 -12.497 324 HB3 PHE 24 2HB PHE 24 8.817 -7.389 -13.587 325 HD1 PHE 24 HD2 PHE 24 8.598 -8.026 -16.027 326 HD2 PHE 24 HD1 PHE 24 10.134 -10.735 -13.067 327 HE1 PHE 24 HE2 PHE 24 8.188 -9.952 -17.588 328 HE2 PHE 24 HE1 PHE 24 9.728 -12.611 -14.601 329 HZ PHE 24 HZ PHE 24 8.737 -12.251 -16.866 330 H PHE 25 H PHE 25 12.184 -8.590 -11.934 331 HA PHE 25 HA PHE 25 13.952 -10.103 -13.791 332 HB2 PHE 25 1HB PHE 25 15.041 -8.184 -12.414 333 HB3 PHE 25 2HB PHE 25 14.783 -9.184 -11.002 334 HD1 PHE 25 HD2 PHE 25 15.573 -11.860 -11.634 335 HD2 PHE 25 HD1 PHE 25 17.138 -8.137 -13.156 336 HE1 PHE 25 HE2 PHE 25 17.683 -13.024 -12.286 337 HE2 PHE 25 HE1 PHE 25 19.219 -9.278 -13.747 338 HZ PHE 25 HZ PHE 25 19.582 -11.698 -13.338 339 H NVA 26 H ARX 26 13.124 -12.157 -13.711 340 HA NVA 26 HA ARX 26 12.751 -13.497 -11.149 341 HB2 NVA 26 1HB ARX 26 10.489 -13.067 -12.052 342 HB3 NVA 26 2HB ARX 26 10.965 -13.917 -13.533 343 HG2 NVA 26 1HG ARX 26 9.604 -15.526 -12.247 344 HG3 NVA 26 2HG ARX 26 11.289 -16.062 -12.340 345 HD2 NVA 26 1HD ARX 26 11.401 -14.820 -9.908 346 HD3 NVA 26 2HD ARX 26 9.622 -15.056 -9.968 347 H THR 27 H THR 27 14.156 -14.924 -10.836 348 HA THR 27 HA THR 27 15.852 -16.107 -12.887 349 HB THR 27 HB THR 27 16.530 -17.631 -11.001 350 HG1 THR 27 HG1 THR 27 14.222 -17.306 -10.144 351 HG21 THR 27 1HG2 THR 27 17.683 -15.534 -11.173 352 HG22 THR 27 2HG2 THR 27 17.319 -15.853 -9.449 353 HG23 THR 27 3HG2 THR 27 16.344 -14.647 -10.357 354 HA PRO 28 HA PRO 28 13.189 -19.447 -13.854 355 HB2 PRO 28 1HB PRO 28 14.801 -21.638 -14.245 356 HB3 PRO 28 2HB PRO 28 14.766 -20.252 -15.376 357 HG2 PRO 28 1HG PRO 28 16.740 -20.806 -13.182 358 HG3 PRO 28 2HG PRO 28 17.020 -20.320 -14.879 359 HD2 PRO 28 1HD PRO 28 17.045 -18.515 -12.833 360 HD3 PRO 28 2HD PRO 28 16.492 -18.096 -14.463 361 H HIX 29 H HIX 29 11.920 -19.877 -12.207 362 HA HIX 29 HA HIX 29 12.706 -21.212 -9.748 363 HB1 HIX 29 1HB HIX 29 9.835 -20.611 -10.803 364 HB2 HIX 29 2HB HIX 29 10.265 -21.058 -9.180 365 HD2 HIX 29 HD2 HIX 29 9.947 -18.005 -11.526 366 HD1 HIX 29 HD1 HIX 29 11.881 -18.997 -7.973 367 HE1 HIX 29 HE1 HIX 29 10.398 -16.920 -7.920 368 H THR 30 H THR 30 13.230 -23.102 -9.572 369 HA THR 30 HA THR 30 11.700 -25.307 -10.875 370 HB THR 30 HB THR 30 13.896 -26.445 -10.975 371 HG1 THR 30 HG1 THR 30 15.751 -25.282 -10.554 372 HG21 THR 30 1HG2 THR 30 14.043 -23.774 -12.421 373 HG22 THR 30 2HG2 THR 30 12.905 -25.082 -12.895 374 HG23 THR 30 3HG2 THR 30 14.671 -25.406 -12.936 Start of MODEL 14 1 H1 GLY 1 1H GLY 1 -0.012 0.003 0.768 2 H2 GLY 1 2H GLY 1 -0.993 0.642 -0.370 3 H3 GLY 1 3H GLY 1 -1.036 -0.988 -0.084 4 HA2 GLY 1 1HA GLY 1 1.129 0.531 -1.262 5 HA3 GLY 1 2HA GLY 1 1.319 -1.165 -0.798 6 H ILE 2 H ILE 2 1.679 -0.172 -3.493 7 HA ILE 2 HA ILE 2 -0.717 -0.486 -5.030 8 HB ILE 2 HB ILE 2 1.351 0.787 -5.692 9 HG12 ILE 2 1HG1 ILE 2 0.504 -1.420 -7.682 10 HG13 ILE 2 2HG1 ILE 2 -0.275 0.125 -7.428 11 HG21 ILE 2 1HG2 ILE 2 3.161 -0.614 -4.844 12 HG22 ILE 2 2HG2 ILE 2 2.624 -2.008 -5.822 13 HG23 ILE 2 3HG2 ILE 2 3.334 -0.596 -6.560 14 HD11 ILE 2 3HD1 ILE 2 1.740 1.314 -8.296 15 HD12 ILE 2 1HD1 ILE 2 2.511 -0.270 -8.632 16 HD13 ILE 2 2HD1 ILE 2 0.993 0.179 -9.474 17 H VAL 3 H VAL 3 1.492 -2.818 -3.695 18 HA VAL 3 HA VAL 3 1.042 -4.910 -5.506 19 HB VAL 3 HB VAL 3 1.762 -5.234 -2.530 20 HG11 VAL 3 1HG1 VAL 3 1.113 -7.362 -3.619 21 HG12 VAL 3 2HG1 VAL 3 2.110 -7.013 -5.002 22 HG13 VAL 3 3HG1 VAL 3 2.901 -7.327 -3.449 23 HG21 VAL 3 3HG2 VAL 3 4.144 -5.286 -3.442 24 HG22 VAL 3 1HG2 VAL 3 3.494 -4.765 -5.013 25 HG23 VAL 3 2HG2 VAL 3 3.389 -3.731 -3.620 26 H GLU 4 H GLU 4 -0.562 -4.101 -2.348 27 HA GLU 4 HA GLU 4 -2.406 -6.359 -2.611 28 HB2 GLU 4 1HB GLU 4 -2.471 -3.819 -0.937 29 HB3 GLU 4 2HB GLU 4 -3.770 -5.002 -0.947 30 HG2 GLU 4 1HG GLU 4 -2.177 -6.716 -0.204 31 HG3 GLU 4 2HG GLU 4 -0.837 -5.521 -0.207 32 H GLN 5 H GLN 5 -2.431 -3.022 -3.879 33 HA GLN 5 HA GLN 5 -5.219 -2.977 -4.560 34 HB2 GLN 5 1HB GLN 5 -2.831 -1.417 -5.602 35 HB3 GLN 5 2HB GLN 5 -4.402 -1.285 -6.374 36 HG2 GLN 5 1HG GLN 5 -4.077 -0.645 -3.425 37 HG3 GLN 5 2HG GLN 5 -3.662 0.556 -4.651 38 HE21 GLN 5 2HE2 GLN 5 -5.272 1.923 -5.330 39 HE22 GLN 5 1HE2 GLN 5 -6.965 1.647 -5.036 40 H CYS 6 H CYS 6 -2.237 -4.110 -6.244 41 HA CYS 6 HA CYS 6 -3.620 -4.670 -8.769 42 HB2 CYS 6 1HB CYS 6 -1.189 -4.047 -8.299 43 HB3 CYS 6 2HB CYS 6 -0.938 -5.684 -7.697 44 H CYS 7 H CYS 7 -2.897 -6.305 -5.787 45 HA CYS 7 HA CYS 7 -3.566 -8.992 -6.691 46 HB2 CYS 7 1HB CYS 7 -2.159 -8.605 -4.701 47 HB3 CYS 7 2HB CYS 7 -3.493 -7.695 -3.994 48 H THR 8 H THR 8 -5.409 -6.819 -4.499 49 HA THR 8 HA THR 8 -7.592 -8.720 -4.638 50 HB THR 8 HB THR 8 -7.891 -6.143 -3.026 51 HG1 THR 8 HG1 THR 8 -6.042 -6.358 -2.120 52 HG21 THR 8 1HG2 THR 8 -7.985 -8.980 -1.989 53 HG22 THR 8 2HG2 THR 8 -9.340 -8.348 -2.958 54 HG23 THR 8 3HG2 THR 8 -8.878 -7.530 -1.451 55 H SER 9 H SER 9 -7.084 -7.082 -7.034 56 HA SER 9 HA SER 9 -9.825 -6.310 -7.598 57 HB2 SER 9 1HB SER 9 -8.784 -4.227 -6.397 58 HB3 SER 9 2HB SER 9 -7.650 -4.169 -7.762 59 HG SER 9 HG SER 9 -9.226 -2.819 -8.381 60 H ILE 10 H ILE 10 -9.861 -5.607 -9.883 61 HA ILE 10 HA ILE 10 -8.072 -7.069 -11.656 62 HB ILE 10 HB ILE 10 -9.917 -4.697 -12.141 63 HG12 ILE 10 1HG1 ILE 10 -11.014 -6.781 -11.307 64 HG13 ILE 10 2HG1 ILE 10 -11.609 -6.185 -12.861 65 HG21 ILE 10 1HG2 ILE 10 -9.778 -5.266 -14.567 66 HG22 ILE 10 2HG2 ILE 10 -8.214 -4.702 -13.900 67 HG23 ILE 10 3HG2 ILE 10 -8.489 -6.456 -14.213 68 HD11 ILE 10 3HD1 ILE 10 -11.512 -8.620 -12.962 69 HD12 ILE 10 1HD1 ILE 10 -10.242 -7.955 -14.067 70 HD13 ILE 10 2HD1 ILE 10 -9.786 -8.618 -12.465 71 H CYS 11 H CYS 11 -6.029 -6.452 -11.910 72 HA CYS 11 HA CYS 11 -5.086 -3.947 -10.886 73 HB2 CYS 11 1HB CYS 11 -3.869 -6.218 -11.013 74 HB3 CYS 11 2HB CYS 11 -3.572 -5.886 -12.725 75 H SER 12 H SER 12 -5.378 -2.054 -12.012 76 HA SER 12 HA SER 12 -6.281 -1.911 -14.696 77 HB2 SER 12 1HB SER 12 -4.938 0.503 -13.949 78 HB3 SER 12 2HB SER 12 -6.687 0.176 -14.018 79 HG SER 12 HG SER 12 -6.666 0.151 -11.892 80 H LEU 13 H LEU 13 -5.150 -1.546 -16.643 81 HA LEU 13 HA LEU 13 -2.655 -2.677 -16.922 82 HB2 LEU 13 1HB LEU 13 -4.264 -2.314 -18.768 83 HB3 LEU 13 2HB LEU 13 -4.016 -0.566 -18.683 84 HG LEU 13 HG LEU 13 -1.702 -0.859 -19.467 85 HD11 LEU 13 1HD1 LEU 13 -2.476 -3.775 -19.730 86 HD12 LEU 13 2HD1 LEU 13 -1.200 -3.100 -18.706 87 HD13 LEU 13 3HD1 LEU 13 -1.039 -3.044 -20.468 88 HD21 LEU 13 3HD2 LEU 13 -2.254 -1.526 -21.751 89 HD22 LEU 13 1HD2 LEU 13 -3.306 -0.290 -21.043 90 HD23 LEU 13 2HD2 LEU 13 -3.900 -1.975 -21.171 91 H TYR 14 H TYR 14 -3.399 0.840 -16.319 92 HA TYR 14 HA TYR 14 -0.659 1.698 -16.779 93 HB2 TYR 14 1HB TYR 14 -1.366 3.740 -15.619 94 HB3 TYR 14 2HB TYR 14 -2.424 3.349 -16.936 95 HD1 TYR 14 HD1 TYR 14 -2.191 3.682 -13.239 96 HD2 TYR 14 HD2 TYR 14 -4.778 2.660 -16.584 97 HE1 TYR 14 HE1 TYR 14 -4.318 3.939 -11.776 98 HE2 TYR 14 HE2 TYR 14 -6.785 2.867 -15.057 99 HH TYR 14 HH TYR 14 -7.519 3.487 -12.926 100 H GLN 15 H GLN 15 -2.299 0.274 -14.018 101 HA GLN 15 HA GLN 15 -0.248 1.308 -12.222 102 HB2 GLN 15 1HB GLN 15 -2.483 -0.670 -11.801 103 HB3 GLN 15 2HB GLN 15 -1.233 -0.405 -10.580 104 HG2 GLN 15 1HG GLN 15 -1.910 2.064 -10.754 105 HG3 GLN 15 2HG GLN 15 -3.358 1.486 -11.574 106 HE21 GLN 15 2HE2 GLN 15 -5.012 0.574 -10.496 107 HE22 GLN 15 1HE2 GLN 15 -5.016 0.468 -8.747 108 H LEU 16 H LEU 16 -1.105 -1.551 -14.116 109 HA LEU 16 HA LEU 16 0.980 -3.294 -13.241 110 HB2 LEU 16 1HB LEU 16 -0.961 -3.630 -14.849 111 HB3 LEU 16 2HB LEU 16 0.101 -3.043 -16.080 112 HG LEU 16 HG LEU 16 0.640 -5.501 -14.484 113 HD11 LEU 16 1HD1 LEU 16 -0.855 -4.856 -17.028 114 HD12 LEU 16 2HD1 LEU 16 -1.335 -5.830 -15.633 115 HD13 LEU 16 3HD1 LEU 16 -0.134 -6.467 -16.777 116 HD21 LEU 16 3HD2 LEU 16 2.099 -6.141 -16.387 117 HD22 LEU 16 1HD2 LEU 16 2.708 -4.849 -15.340 118 HD23 LEU 16 2HD2 LEU 16 1.991 -4.435 -16.912 119 H GLU 17 H GLU 17 0.868 -0.819 -15.888 120 HA GLU 17 HA GLU 17 3.554 -1.165 -16.701 121 HB2 GLU 17 1HB GLU 17 1.573 1.141 -16.982 122 HB3 GLU 17 2HB GLU 17 3.245 1.298 -17.536 123 HG2 GLU 17 1HG GLU 17 2.752 -0.827 -18.915 124 HG3 GLU 17 2HG GLU 17 1.042 -0.503 -18.541 125 H ASN 18 H ASN 18 2.087 0.676 -14.062 126 HA ASN 18 HA ASN 18 4.309 2.377 -13.514 127 HB2 ASN 18 1HB ASN 18 1.999 2.420 -12.446 128 HB3 ASN 18 2HB ASN 18 2.594 1.191 -11.346 129 HD21 ASN 18 2HD2 ASN 18 3.246 1.891 -9.517 130 HD22 ASN 18 1HD2 ASN 18 3.974 3.474 -9.183 131 H TYR 19 H TYR 19 4.028 -1.108 -13.046 132 HA TYR 19 HA TYR 19 6.240 -1.309 -11.166 133 HB2 TYR 19 1HB TYR 19 4.861 -3.293 -12.969 134 HB3 TYR 19 2HB TYR 19 6.210 -3.703 -11.932 135 HD1 TYR 19 HD1 TYR 19 6.085 -3.559 -9.443 136 HD2 TYR 19 HD2 TYR 19 2.571 -3.025 -11.935 137 HE1 TYR 19 HE1 TYR 19 4.624 -3.984 -7.468 138 HE2 TYR 19 HE2 TYR 19 1.130 -3.344 -9.913 139 HH TYR 19 HH TYR 19 2.528 -4.054 -6.728 140 H CYS 20 H CYS 20 5.890 -0.925 -14.578 141 HA CYS 20 HA CYS 20 8.232 -2.517 -15.317 142 HB2 CYS 20 1HB CYS 20 5.936 -1.959 -16.591 143 HB3 CYS 20 2HB CYS 20 6.795 -0.533 -17.192 144 H ASN 21 H ASN 21 10.026 -1.733 -16.609 145 HA ASN 21 HA ASN 21 11.033 0.887 -15.620 146 HB2 ASN 21 1HB ASN 21 12.205 -1.697 -16.548 147 HB3 ASN 21 2HB ASN 21 12.861 -0.268 -17.400 148 HD21 ASN 21 2HD2 ASN 21 13.076 -2.236 -14.736 149 HD22 ASN 21 1HD2 ASN 21 14.083 -1.222 -13.745 150 H1 PHE 1 1H PHE 1 -2.031 -7.156 -23.393 151 H2 PHE 1 2H PHE 1 -2.633 -8.624 -23.633 152 H3 PHE 1 3H PHE 1 -3.694 -7.399 -23.548 153 HA PHE 1 HA PHE 1 -2.073 -8.538 -21.403 154 HB2 PHE 1 1HB PHE 1 -1.837 -6.204 -21.137 155 HB3 PHE 1 2HB PHE 1 -3.560 -5.866 -21.437 156 HD1 PHE 1 HD1 PHE 1 -1.734 -8.391 -19.241 157 HD2 PHE 1 HD2 PHE 1 -4.577 -5.078 -19.356 158 HE1 PHE 1 HE1 PHE 1 -2.179 -8.670 -16.887 159 HE2 PHE 1 HE2 PHE 1 -4.963 -5.356 -17.013 160 HZ PHE 1 HZ PHE 1 -3.826 -7.154 -15.714 161 H VAL 2 H VAL 2 -5.338 -7.000 -21.864 162 HA VAL 2 HA VAL 2 -7.453 -7.755 -21.426 163 HB VAL 2 HB VAL 2 -6.506 -10.635 -21.089 164 HG11 VAL 2 1HG1 VAL 2 -8.827 -10.024 -20.236 165 HG12 VAL 2 2HG1 VAL 2 -9.250 -9.536 -21.908 166 HG13 VAL 2 3HG1 VAL 2 -8.821 -11.241 -21.554 167 HG21 VAL 2 3HG2 VAL 2 -7.354 -9.094 -23.626 168 HG22 VAL 2 1HG2 VAL 2 -5.830 -10.006 -23.346 169 HG23 VAL 2 2HG2 VAL 2 -7.380 -10.898 -23.483 170 H ASN 3 H ASN 3 -8.658 -7.463 -19.694 171 HA ASN 3 HA ASN 3 -7.285 -6.843 -17.282 172 HB2 ASN 3 1HB ASN 3 -10.162 -7.228 -18.028 173 HB3 ASN 3 2HB ASN 3 -9.733 -6.950 -16.354 174 HD21 ASN 3 2HD2 ASN 3 -11.062 -5.323 -18.643 175 HD22 ASN 3 1HD2 ASN 3 -10.304 -3.750 -18.429 176 H GLN 4 H GLN 4 -6.835 -7.946 -15.387 177 HA GLN 4 HA GLN 4 -8.449 -10.258 -14.608 178 HB2 GLN 4 1HB GLN 4 -5.962 -10.534 -15.976 179 HB3 GLN 4 2HB GLN 4 -5.694 -10.963 -14.286 180 HG2 GLN 4 1HG GLN 4 -8.059 -12.189 -15.764 181 HG3 GLN 4 2HG GLN 4 -6.422 -12.812 -16.017 182 HE21 GLN 4 2HE2 GLN 4 -5.721 -14.411 -14.693 183 HE22 GLN 4 1HE2 GLN 4 -6.426 -14.749 -13.118 184 H HIS 5 H HIS 5 -7.670 -11.073 -12.438 185 HA HIS 5 HA HIS 5 -6.622 -8.892 -10.672 186 HB2 HIS 5 1HB HIS 5 -7.693 -11.732 -10.238 187 HB3 HIS 5 2HB HIS 5 -6.716 -10.896 -9.006 188 HD1 HIS 5 HD1 HIS 5 -9.934 -10.225 -10.969 189 HD2 HIS 5 HD2 HIS 5 -8.143 -9.532 -7.221 190 HE1 HIS 5 HE1 HIS 5 -11.655 -8.971 -9.481 191 H LEU 6 H LEU 6 -4.554 -8.892 -9.899 192 HA LEU 6 HA LEU 6 -2.831 -11.183 -10.876 193 HB2 LEU 6 1HB LEU 6 -2.490 -8.193 -11.222 194 HB3 LEU 6 2HB LEU 6 -1.091 -9.231 -11.194 195 HG LEU 6 HG LEU 6 -1.376 -8.851 -13.432 196 HD11 LEU 6 1HD1 LEU 6 -2.000 -10.940 -14.434 197 HD12 LEU 6 2HD1 LEU 6 -3.131 -11.317 -13.115 198 HD13 LEU 6 3HD1 LEU 6 -1.382 -11.312 -12.814 199 HD21 LEU 6 3HD2 LEU 6 -3.535 -7.751 -13.273 200 HD22 LEU 6 1HD2 LEU 6 -4.327 -9.351 -13.154 201 HD23 LEU 6 2HD2 LEU 6 -3.458 -8.917 -14.650 202 H CYS 7 H CYS 7 -3.169 -11.943 -8.709 203 HA CYS 7 HA CYS 7 -1.544 -10.478 -6.696 204 HB2 CYS 7 1HB CYS 7 -3.969 -11.183 -6.355 205 HB3 CYS 7 2HB CYS 7 -3.390 -12.861 -6.260 206 H GLY 8 H GLY 8 -1.914 -13.867 -7.796 207 HA2 GLY 8 1HA GLY 8 0.649 -14.610 -6.568 208 HA3 GLY 8 2HA GLY 8 -0.468 -15.687 -7.379 209 H SER 9 H SER 9 1.177 -16.685 -8.519 210 HA SER 9 HA SER 9 3.187 -15.427 -9.957 211 HB2 SER 9 1HB SER 9 2.635 -18.034 -9.460 212 HB3 SER 9 2HB SER 9 2.099 -17.935 -11.141 213 HG SER 9 HG SER 9 4.636 -17.320 -10.050 214 H HIS 10 H HIS 10 -0.159 -15.395 -10.814 215 HA HIS 10 HA HIS 10 -0.127 -15.135 -13.622 216 HB2 HIS 10 1HB HIS 10 -1.745 -13.525 -11.610 217 HB3 HIS 10 2HB HIS 10 -2.183 -13.861 -13.311 218 HD1 HIS 10 HD1 HIS 10 -3.333 -14.995 -10.174 219 HD2 HIS 10 HD2 HIS 10 -2.018 -16.885 -13.644 220 HE1 HIS 10 HE1 HIS 10 -4.271 -17.344 -10.165 221 H LEU 11 H LEU 11 0.887 -12.928 -11.015 222 HA LEU 11 HA LEU 11 0.948 -10.484 -12.587 223 HB2 LEU 11 1HB LEU 11 1.059 -10.640 -10.068 224 HB3 LEU 11 2HB LEU 11 2.662 -11.319 -10.174 225 HG LEU 11 HG LEU 11 3.573 -9.312 -11.145 226 HD11 LEU 11 1HD1 LEU 11 1.674 -8.348 -12.320 227 HD12 LEU 11 2HD1 LEU 11 2.302 -7.195 -11.140 228 HD13 LEU 11 3HD1 LEU 11 0.828 -8.120 -10.763 229 HD21 LEU 11 3HD2 LEU 11 3.670 -9.554 -8.707 230 HD22 LEU 11 1HD2 LEU 11 2.044 -8.839 -8.569 231 HD23 LEU 11 2HD2 LEU 11 3.422 -7.856 -9.141 232 H VAL 12 H VAL 12 3.315 -13.153 -12.230 233 HA VAL 12 HA VAL 12 5.437 -11.738 -13.436 234 HB VAL 12 HB VAL 12 4.837 -14.749 -13.412 235 HG11 VAL 12 1HG1 VAL 12 6.393 -14.209 -15.208 236 HG12 VAL 12 2HG1 VAL 12 7.444 -13.314 -14.088 237 HG13 VAL 12 3HG1 VAL 12 7.221 -15.072 -13.897 238 HG21 VAL 12 3HG2 VAL 12 6.622 -13.030 -11.662 239 HG22 VAL 12 1HG2 VAL 12 5.045 -13.782 -11.198 240 HG23 VAL 12 2HG2 VAL 12 6.412 -14.819 -11.561 241 H GLU 13 H GLU 13 2.734 -13.750 -14.703 242 HA GLU 13 HA GLU 13 3.702 -13.737 -17.370 243 HB2 GLU 13 1HB GLU 13 1.056 -14.198 -16.068 244 HB3 GLU 13 2HB GLU 13 1.150 -14.200 -17.826 245 HG2 GLU 13 1HG GLU 13 3.070 -15.977 -16.329 246 HG3 GLU 13 2HG GLU 13 1.376 -16.461 -16.399 247 H ALA 14 H ALA 14 1.437 -11.648 -15.552 248 HA ALA 14 HA ALA 14 0.568 -10.072 -17.695 249 HB1 ALA 14 3HB ALA 14 -0.159 -10.066 -15.262 250 HB2 ALA 14 1HB ALA 14 1.155 -8.931 -14.965 251 HB3 ALA 14 2HB ALA 14 -0.126 -8.486 -16.124 252 H LEU 15 H LEU 15 3.459 -9.640 -15.566 253 HA LEU 15 HA LEU 15 4.342 -7.283 -16.811 254 HB2 LEU 15 1HB LEU 15 5.653 -9.387 -15.064 255 HB3 LEU 15 2HB LEU 15 6.518 -8.017 -15.694 256 HG LEU 15 HG LEU 15 4.030 -7.668 -14.002 257 HD11 LEU 15 1HD1 LEU 15 6.824 -7.924 -12.936 258 HD12 LEU 15 2HD1 LEU 15 5.524 -9.072 -12.728 259 HD13 LEU 15 3HD1 LEU 15 5.396 -7.471 -12.002 260 HD21 LEU 15 3HD2 LEU 15 6.455 -5.868 -14.339 261 HD22 LEU 15 1HD2 LEU 15 4.927 -5.465 -13.485 262 HD23 LEU 15 2HD2 LEU 15 4.959 -5.687 -15.257 263 H TYR 16 H TYR 16 5.127 -10.762 -17.402 264 HA TYR 16 HA TYR 16 7.145 -10.311 -19.254 265 HB2 TYR 16 1HB TYR 16 6.626 -12.452 -18.216 266 HB3 TYR 16 2HB TYR 16 5.113 -12.561 -19.109 267 HD1 TYR 16 HD1 TYR 16 8.839 -12.679 -19.424 268 HD2 TYR 16 HD2 TYR 16 5.075 -13.193 -21.446 269 HE1 TYR 16 HE1 TYR 16 10.019 -13.746 -21.376 270 HE2 TYR 16 HE2 TYR 16 6.255 -14.249 -23.377 271 HH TYR 16 HH TYR 16 8.102 -14.979 -24.159 272 H LEU 17 H LEU 17 3.620 -10.419 -19.661 273 HA LEU 17 HA LEU 17 3.713 -10.192 -22.573 274 HB2 LEU 17 1HB LEU 17 1.522 -9.543 -20.556 275 HB3 LEU 17 2HB LEU 17 1.339 -9.595 -22.291 276 HG LEU 17 HG LEU 17 2.190 -11.984 -20.692 277 HD11 LEU 17 1HD1 LEU 17 -0.088 -11.292 -20.018 278 HD12 LEU 17 2HD1 LEU 17 -0.168 -12.806 -20.964 279 HD13 LEU 17 3HD1 LEU 17 -0.571 -11.231 -21.727 280 HD21 LEU 17 3HD2 LEU 17 2.796 -12.055 -23.111 281 HD22 LEU 17 1HD2 LEU 17 1.100 -11.801 -23.529 282 HD23 LEU 17 2HD2 LEU 17 1.580 -13.292 -22.688 283 H VAL 18 H VAL 18 3.324 -7.726 -19.970 284 HA VAL 18 HA VAL 18 2.650 -5.708 -21.994 285 HB VAL 18 HB VAL 18 2.989 -5.474 -18.956 286 HG11 VAL 18 1HG1 VAL 18 1.833 -3.497 -21.038 287 HG12 VAL 18 2HG1 VAL 18 1.685 -3.285 -19.310 288 HG13 VAL 18 3HG1 VAL 18 3.270 -3.246 -20.026 289 HG21 VAL 18 3HG2 VAL 18 0.463 -5.642 -20.576 290 HG22 VAL 18 1HG2 VAL 18 1.180 -6.974 -19.670 291 HG23 VAL 18 2HG2 VAL 18 0.618 -5.571 -18.808 292 H CYS 19 H CYS 19 5.375 -6.446 -19.833 293 HA CYS 19 HA CYS 19 6.807 -3.981 -20.675 294 HB2 CYS 19 1HB CYS 19 7.665 -6.399 -19.084 295 HB3 CYS 19 2HB CYS 19 8.708 -5.034 -19.473 296 H GLY 20 H GLY 20 6.163 -7.050 -22.049 297 HA2 GLY 20 1HA GLY 20 7.168 -8.049 -23.894 298 HA3 GLY 20 2HA GLY 20 8.063 -6.550 -24.147 299 H GLU 21 H GLU 21 7.867 -8.722 -21.434 300 HA GLU 21 HA GLU 21 9.396 -9.976 -20.267 301 HB2 GLU 21 1HB GLU 21 10.289 -10.604 -22.618 302 HB3 GLU 21 2HB GLU 21 11.586 -9.434 -22.275 303 HG2 GLU 21 1HG GLU 21 12.037 -10.803 -20.109 304 HG3 GLU 21 2HG GLU 21 11.032 -12.071 -20.779 305 H ARG 22 H ARG 22 10.982 -7.076 -21.624 306 HA ARG 22 HA ARG 22 12.807 -7.001 -19.318 307 HB2 ARG 22 1HB ARG 22 13.669 -4.861 -20.396 308 HB3 ARG 22 2HB ARG 22 13.759 -6.329 -21.392 309 HG2 ARG 22 1HG ARG 22 11.785 -5.564 -22.706 310 HG3 ARG 22 2HG ARG 22 11.658 -4.163 -21.668 311 HD2 ARG 22 1HD ARG 22 13.811 -3.329 -22.436 312 HD3 ARG 22 2HD ARG 22 14.086 -4.790 -23.372 313 HE ARG 22 HE ARG 22 12.637 -4.093 -24.975 314 HH11 ARG 22 1HH1 ARG 22 12.393 -1.879 -22.266 315 HH12 ARG 22 2HH1 ARG 22 11.364 -0.747 -23.106 316 HH21 ARG 22 1HH2 ARG 22 11.336 -2.727 -26.079 317 HH22 ARG 22 2HH2 ARG 22 10.814 -1.223 -25.291 318 H GLY 23 H GLY 23 12.091 -6.491 -17.395 319 HA2 GLY 23 1HA GLY 23 11.815 -3.872 -16.631 320 HA3 GLY 23 2HA GLY 23 10.168 -4.332 -17.051 321 H PHE 24 H PHE 24 11.256 -7.196 -15.854 322 HA PHE 24 HA PHE 24 10.895 -6.344 -12.990 323 HB2 PHE 24 1HB PHE 24 9.269 -7.998 -12.679 324 HB3 PHE 24 2HB PHE 24 8.779 -7.018 -14.030 325 HD1 PHE 24 HD2 PHE 24 8.975 -7.897 -16.372 326 HD2 PHE 24 HD1 PHE 24 9.677 -10.372 -12.915 327 HE1 PHE 24 HE2 PHE 24 8.730 -9.962 -17.748 328 HE2 PHE 24 HE1 PHE 24 9.466 -12.402 -14.283 329 HZ PHE 24 HZ PHE 24 8.989 -12.252 -16.687 330 H PHE 25 H PHE 25 12.330 -8.586 -15.235 331 HA PHE 25 HA PHE 25 13.370 -10.644 -14.828 332 HB2 PHE 25 1HB PHE 25 14.869 -8.662 -15.103 333 HB3 PHE 25 2HB PHE 25 15.219 -8.739 -13.394 334 HD1 PHE 25 HD1 PHE 25 15.445 -10.616 -16.617 335 HD2 PHE 25 HD2 PHE 25 16.768 -10.384 -12.556 336 HE1 PHE 25 HE1 PHE 25 17.194 -12.276 -17.164 337 HE2 PHE 25 HE2 PHE 25 18.594 -12.047 -13.071 338 HZ PHE 25 HZ PHE 25 18.820 -12.930 -15.348 339 H NVA 26 H ARX 26 11.940 -11.827 -13.406 340 HA NVA 26 HA ARX 26 12.694 -12.012 -10.632 341 HB2 NVA 26 1HB ARX 26 11.142 -13.789 -10.302 342 HB3 NVA 26 2HB ARX 26 10.389 -12.741 -11.510 343 HG2 NVA 26 1HG ARX 26 11.027 -14.215 -13.311 344 HG3 NVA 26 2HG ARX 26 12.039 -15.209 -12.230 345 HD2 NVA 26 1HD ARX 26 9.885 -15.881 -11.042 346 HD3 NVA 26 2HD ARX 26 8.905 -14.995 -12.262 347 H THR 27 H THR 27 13.545 -13.584 -13.503 348 HA THR 27 HA THR 27 16.188 -13.909 -13.723 349 HB THR 27 HB THR 27 16.495 -16.471 -13.065 350 HG1 THR 27 HG1 THR 27 14.781 -15.504 -11.052 351 HG21 THR 27 1HG2 THR 27 17.577 -15.716 -10.914 352 HG22 THR 27 2HG2 THR 27 16.876 -14.108 -11.169 353 HG23 THR 27 3HG2 THR 27 18.034 -14.769 -12.336 354 HA PRO 28 HA PRO 28 14.066 -15.780 -17.043 355 HB2 PRO 28 1HB PRO 28 15.695 -17.581 -18.304 356 HB3 PRO 28 2HB PRO 28 15.998 -15.804 -18.413 357 HG2 PRO 28 1HG PRO 28 17.337 -17.797 -16.610 358 HG3 PRO 28 2HG PRO 28 18.055 -16.531 -17.593 359 HD2 PRO 28 1HD PRO 28 17.565 -16.222 -14.930 360 HD3 PRO 28 2HD PRO 28 17.404 -14.829 -16.113 361 H HIX 29 H HIX 29 12.392 -17.134 -16.886 362 HA HIX 29 HA HIX 29 12.438 -19.493 -15.128 363 HB1 HIX 29 1HB HIX 29 10.362 -17.982 -16.764 364 HB2 HIX 29 2HB HIX 29 9.944 -19.558 -16.106 365 HD2 HIX 29 HD2 HIX 29 10.095 -15.983 -14.897 366 HD1 HIX 29 HD1 HIX 29 10.510 -19.786 -13.409 367 HE1 HIX 29 HE1 HIX 29 8.950 -18.211 -12.157 368 H THR 30 H THR 30 13.467 -21.232 -15.793 369 HA THR 30 HA THR 30 13.027 -22.263 -18.543 370 HB THR 30 HB THR 30 15.744 -22.299 -17.162 371 HG1 THR 30 HG1 THR 30 15.119 -20.154 -17.278 372 HG21 THR 30 1HG2 THR 30 16.608 -22.469 -19.395 373 HG22 THR 30 2HG2 THR 30 15.020 -22.164 -20.130 374 HG23 THR 30 3HG2 THR 30 15.331 -23.694 -19.253 Start of MODEL 15 1 H1 GLY 1 1H GLY 1 0.041 -3.285 0.285 2 H2 GLY 1 2H GLY 1 0.651 -2.177 1.338 3 H3 GLY 1 3H GLY 1 -0.624 -1.780 0.369 4 HA2 GLY 1 1HA GLY 1 1.410 -0.772 -0.428 5 HA3 GLY 1 2HA GLY 1 2.122 -2.397 -0.540 6 H ILE 2 H ILE 2 2.305 -1.406 -2.910 7 HA ILE 2 HA ILE 2 -0.042 -1.226 -4.505 8 HB ILE 2 HB ILE 2 2.173 -0.240 -5.094 9 HG12 ILE 2 1HG1 ILE 2 0.995 -2.107 -7.143 10 HG13 ILE 2 2HG1 ILE 2 0.343 -0.524 -6.777 11 HG21 ILE 2 1HG2 ILE 2 3.014 -3.082 -5.947 12 HG22 ILE 2 2HG2 ILE 2 3.966 -1.600 -6.046 13 HG23 ILE 2 3HG2 ILE 2 3.539 -2.291 -4.424 14 HD11 ILE 2 3HD1 ILE 2 2.969 -1.069 -8.226 15 HD12 ILE 2 1HD1 ILE 2 1.515 -0.217 -8.823 16 HD13 ILE 2 2HD1 ILE 2 2.550 0.530 -7.586 17 H VAL 3 H VAL 3 1.972 -4.034 -3.612 18 HA VAL 3 HA VAL 3 0.921 -5.813 -5.530 19 HB VAL 3 HB VAL 3 1.814 -6.535 -2.698 20 HG11 VAL 3 1HG1 VAL 3 1.774 -8.127 -5.247 21 HG12 VAL 3 2HG1 VAL 3 2.496 -8.674 -3.724 22 HG13 VAL 3 3HG1 VAL 3 0.719 -8.353 -3.858 23 HG21 VAL 3 3HG2 VAL 3 4.044 -6.973 -3.808 24 HG22 VAL 3 1HG2 VAL 3 3.398 -6.160 -5.245 25 HG23 VAL 3 2HG2 VAL 3 3.620 -5.255 -3.746 26 H GLU 4 H GLU 4 -0.206 -5.063 -2.261 27 HA GLU 4 HA GLU 4 -2.408 -6.900 -2.249 28 HB2 GLU 4 1HB GLU 4 -1.435 -4.743 -0.559 29 HB3 GLU 4 2HB GLU 4 -3.229 -4.823 -0.704 30 HG2 GLU 4 1HG GLU 4 -3.049 -7.266 -0.051 31 HG3 GLU 4 2HG GLU 4 -1.328 -7.041 0.229 32 H GLN 5 H GLN 5 -2.152 -3.407 -3.026 33 HA GLN 5 HA GLN 5 -4.833 -2.942 -3.632 34 HB2 GLN 5 1HB GLN 5 -2.265 -1.688 -4.089 35 HB3 GLN 5 2HB GLN 5 -3.409 -1.302 -5.381 36 HG2 GLN 5 1HG GLN 5 -3.827 0.441 -3.891 37 HG3 GLN 5 2HG GLN 5 -5.119 -0.755 -3.538 38 HE21 GLN 5 2HE2 GLN 5 -2.234 0.896 -2.464 39 HE22 GLN 5 1HE2 GLN 5 -2.234 0.287 -0.849 40 H CYS 6 H CYS 6 -2.295 -4.478 -5.616 41 HA CYS 6 HA CYS 6 -3.875 -4.447 -8.082 42 HB2 CYS 6 1HB CYS 6 -1.244 -4.753 -7.606 43 HB3 CYS 6 2HB CYS 6 -1.669 -6.435 -7.613 44 H CYS 7 H CYS 7 -3.137 -6.842 -5.479 45 HA CYS 7 HA CYS 7 -4.371 -9.055 -6.750 46 HB2 CYS 7 1HB CYS 7 -3.331 -8.348 -4.061 47 HB3 CYS 7 2HB CYS 7 -4.619 -9.554 -4.056 48 H THR 8 H THR 8 -5.513 -7.116 -4.004 49 HA THR 8 HA THR 8 -8.046 -8.475 -3.924 50 HB THR 8 HB THR 8 -7.672 -5.807 -2.583 51 HG1 THR 8 HG1 THR 8 -5.645 -6.408 -2.197 52 HG21 THR 8 1HG2 THR 8 -8.229 -7.303 -0.617 53 HG22 THR 8 2HG2 THR 8 -8.465 -8.646 -1.749 54 HG23 THR 8 3HG2 THR 8 -9.484 -7.189 -1.892 55 H SER 9 H SER 9 -7.426 -6.806 -6.462 56 HA SER 9 HA SER 9 -10.056 -5.715 -6.886 57 HB2 SER 9 1HB SER 9 -8.901 -3.878 -5.515 58 HB3 SER 9 2HB SER 9 -7.756 -3.750 -6.820 59 HG SER 9 HG SER 9 -9.685 -2.291 -6.765 60 H ILE 10 H ILE 10 -9.563 -4.062 -8.965 61 HA ILE 10 HA ILE 10 -8.528 -5.949 -10.991 62 HB ILE 10 HB ILE 10 -9.541 -3.085 -11.231 63 HG12 ILE 10 1HG1 ILE 10 -11.238 -4.697 -10.375 64 HG13 ILE 10 2HG1 ILE 10 -11.624 -3.977 -11.908 65 HG21 ILE 10 1HG2 ILE 10 -8.051 -3.570 -13.110 66 HG22 ILE 10 2HG2 ILE 10 -8.872 -5.121 -13.394 67 HG23 ILE 10 3HG2 ILE 10 -9.723 -3.582 -13.661 68 HD11 ILE 10 3HD1 ILE 10 -12.194 -6.429 -11.772 69 HD12 ILE 10 1HD1 ILE 10 -11.162 -5.998 -13.141 70 HD13 ILE 10 2HD1 ILE 10 -10.464 -6.747 -11.705 71 H CYS 11 H CYS 11 -6.397 -6.102 -11.333 72 HA CYS 11 HA CYS 11 -4.584 -3.880 -10.985 73 HB2 CYS 11 1HB CYS 11 -4.367 -6.398 -12.658 74 HB3 CYS 11 2HB CYS 11 -3.029 -5.278 -12.445 75 H SER 12 H SER 12 -5.008 -2.037 -12.170 76 HA SER 12 HA SER 12 -6.168 -2.299 -14.867 77 HB2 SER 12 1HB SER 12 -6.655 -0.344 -13.337 78 HB3 SER 12 2HB SER 12 -4.977 0.171 -13.467 79 HG SER 12 HG SER 12 -6.081 1.232 -15.021 80 H LEU 13 H LEU 13 -5.047 -1.505 -16.768 81 HA LEU 13 HA LEU 13 -2.525 -2.715 -17.145 82 HB2 LEU 13 1HB LEU 13 -4.186 -2.235 -18.961 83 HB3 LEU 13 2HB LEU 13 -3.907 -0.528 -18.738 84 HG LEU 13 HG LEU 13 -1.602 -0.739 -19.479 85 HD11 LEU 13 1HD1 LEU 13 -0.961 -2.924 -20.648 86 HD12 LEU 13 2HD1 LEU 13 -2.369 -3.633 -19.766 87 HD13 LEU 13 3HD1 LEU 13 -1.036 -2.933 -18.857 88 HD21 LEU 13 3HD2 LEU 13 -3.375 -0.224 -21.116 89 HD22 LEU 13 1HD2 LEU 13 -3.674 -1.961 -21.378 90 HD23 LEU 13 2HD2 LEU 13 -2.122 -1.174 -21.891 91 H TYR 14 H TYR 14 -3.226 0.775 -16.581 92 HA TYR 14 HA TYR 14 -0.507 1.508 -16.891 93 HB2 TYR 14 1HB TYR 14 -1.076 3.653 -16.140 94 HB3 TYR 14 2HB TYR 14 -2.433 3.047 -17.062 95 HD1 TYR 14 HD2 TYR 14 -4.533 2.282 -15.952 96 HD2 TYR 14 HD1 TYR 14 -1.361 4.229 -13.830 97 HE1 TYR 14 HE2 TYR 14 -6.128 2.770 -14.072 98 HE2 TYR 14 HE1 TYR 14 -3.009 4.742 -11.889 99 HH TYR 14 HH TYR 14 -5.274 4.698 -11.214 100 H GLN 15 H GLN 15 -2.238 0.105 -14.169 101 HA GLN 15 HA GLN 15 -0.265 1.113 -12.217 102 HB2 GLN 15 1HB GLN 15 -2.396 -1.061 -11.988 103 HB3 GLN 15 2HB GLN 15 -1.502 -0.452 -10.648 104 HG2 GLN 15 1HG GLN 15 -2.403 1.795 -10.933 105 HG3 GLN 15 2HG GLN 15 -3.301 1.204 -12.355 106 HE21 GLN 15 2HE2 GLN 15 -3.699 1.993 -9.319 107 HE22 GLN 15 1HE2 GLN 15 -4.964 0.907 -8.842 108 H LEU 16 H LEU 16 -0.875 -1.654 -14.286 109 HA LEU 16 HA LEU 16 1.157 -3.439 -13.174 110 HB2 LEU 16 1HB LEU 16 -0.701 -4.120 -14.697 111 HB3 LEU 16 2HB LEU 16 0.071 -3.229 -16.018 112 HG LEU 16 HG LEU 16 1.214 -5.676 -14.701 113 HD11 LEU 16 1HD1 LEU 16 -0.341 -5.211 -17.318 114 HD12 LEU 16 2HD1 LEU 16 -0.858 -6.194 -15.912 115 HD13 LEU 16 3HD1 LEU 16 0.498 -6.698 -16.928 116 HD21 LEU 16 3HD2 LEU 16 2.194 -4.018 -17.050 117 HD22 LEU 16 1HD2 LEU 16 2.567 -5.738 -16.894 118 HD23 LEU 16 2HD2 LEU 16 3.085 -4.615 -15.629 119 H GLU 17 H GLU 17 1.029 -1.055 -15.920 120 HA GLU 17 HA GLU 17 3.768 -1.304 -16.623 121 HB2 GLU 17 1HB GLU 17 1.646 0.805 -17.125 122 HB3 GLU 17 2HB GLU 17 3.332 1.057 -17.641 123 HG2 GLU 17 1HG GLU 17 3.166 -1.133 -18.938 124 HG3 GLU 17 2HG GLU 17 1.455 -1.152 -18.550 125 H ASN 18 H ASN 18 2.205 0.656 -14.155 126 HA ASN 18 HA ASN 18 4.445 2.277 -13.441 127 HB2 ASN 18 1HB ASN 18 2.142 2.565 -12.619 128 HB3 ASN 18 2HB ASN 18 2.285 1.132 -11.642 129 HD21 ASN 18 2HD2 ASN 18 3.657 1.056 -9.823 130 HD22 ASN 18 1HD2 ASN 18 4.204 2.535 -9.108 131 H TYR 19 H TYR 19 4.152 -1.222 -13.046 132 HA TYR 19 HA TYR 19 6.216 -1.317 -10.967 133 HB2 TYR 19 1HB TYR 19 5.015 -3.415 -12.792 134 HB3 TYR 19 2HB TYR 19 6.383 -3.763 -11.704 135 HD1 TYR 19 HD2 TYR 19 2.744 -2.963 -11.892 136 HD2 TYR 19 HD1 TYR 19 6.013 -4.009 -9.319 137 HE1 TYR 19 HE2 TYR 19 1.098 -3.576 -10.023 138 HE2 TYR 19 HE1 TYR 19 4.401 -4.652 -7.503 139 HH TYR 19 HH TYR 19 2.216 -4.835 -6.918 140 H CYS 20 H CYS 20 5.937 -1.197 -14.434 141 HA CYS 20 HA CYS 20 8.743 -1.991 -14.919 142 HB2 CYS 20 1HB CYS 20 6.661 -0.926 -16.839 143 HB3 CYS 20 2HB CYS 20 8.135 -1.760 -17.297 144 H ASN 21 H ASN 21 9.719 -0.449 -16.822 145 HA ASN 21 HA ASN 21 9.699 2.356 -15.751 146 HB2 ASN 21 1HB ASN 21 12.127 0.554 -16.352 147 HB3 ASN 21 2HB ASN 21 12.207 2.262 -16.259 148 HD21 ASN 21 2HD2 ASN 21 11.853 -0.650 -14.486 149 HD22 ASN 21 1HD2 ASN 21 12.081 0.047 -12.935 150 H1 PHE 1 1H PHE 1 -2.499 -7.433 -23.296 151 H2 PHE 1 2H PHE 1 -3.700 -8.540 -23.431 152 H3 PHE 1 3H PHE 1 -4.068 -6.970 -23.116 153 HA PHE 1 HA PHE 1 -2.515 -8.690 -21.323 154 HB2 PHE 1 1HB PHE 1 -1.921 -6.418 -20.997 155 HB3 PHE 1 2HB PHE 1 -3.575 -5.887 -21.110 156 HD1 PHE 1 HD2 PHE 1 -1.976 -8.701 -19.148 157 HD2 PHE 1 HD1 PHE 1 -4.263 -5.066 -18.995 158 HE1 PHE 1 HE2 PHE 1 -2.223 -9.029 -16.763 159 HE2 PHE 1 HE1 PHE 1 -4.580 -5.404 -16.579 160 HZ PHE 1 HZ PHE 1 -3.558 -7.363 -15.429 161 H VAL 2 H VAL 2 -5.564 -6.760 -21.254 162 HA VAL 2 HA VAL 2 -7.674 -7.226 -20.667 163 HB VAL 2 HB VAL 2 -7.041 -10.200 -20.594 164 HG11 VAL 2 1HG1 VAL 2 -9.698 -8.698 -20.872 165 HG12 VAL 2 2HG1 VAL 2 -9.440 -10.496 -20.918 166 HG13 VAL 2 3HG1 VAL 2 -9.123 -9.651 -19.429 167 HG21 VAL 2 3HG2 VAL 2 -7.814 -8.409 -22.941 168 HG22 VAL 2 1HG2 VAL 2 -6.519 -9.598 -22.829 169 HG23 VAL 2 2HG2 VAL 2 -8.151 -10.098 -22.919 170 H ASN 3 H ASN 3 -8.082 -6.469 -18.647 171 HA ASN 3 HA ASN 3 -6.501 -7.305 -16.358 172 HB2 ASN 3 1HB ASN 3 -7.792 -5.689 -15.076 173 HB3 ASN 3 2HB ASN 3 -7.351 -4.950 -16.621 174 HD21 ASN 3 2HD2 ASN 3 -9.131 -4.257 -17.874 175 HD22 ASN 3 1HD2 ASN 3 -10.796 -4.472 -17.393 176 H GLN 4 H GLN 4 -7.145 -8.562 -14.625 177 HA GLN 4 HA GLN 4 -9.704 -9.902 -14.555 178 HB2 GLN 4 1HB GLN 4 -8.856 -12.115 -15.199 179 HB3 GLN 4 2HB GLN 4 -8.817 -10.981 -16.525 180 HG2 GLN 4 1HG GLN 4 -6.391 -10.577 -16.159 181 HG3 GLN 4 2HG GLN 4 -6.404 -11.939 -15.033 182 HE21 GLN 4 2HE2 GLN 4 -6.039 -11.053 -18.229 183 HE22 GLN 4 1HE2 GLN 4 -6.157 -12.671 -18.911 184 H HIS 5 H HIS 5 -8.239 -8.581 -12.465 185 HA HIS 5 HA HIS 5 -7.458 -8.856 -10.313 186 HB2 HIS 5 1HB HIS 5 -9.481 -11.043 -10.740 187 HB3 HIS 5 2HB HIS 5 -8.481 -11.090 -9.256 188 HD1 HIS 5 HD1 HIS 5 -11.082 -8.978 -10.862 189 HD2 HIS 5 HD2 HIS 5 -9.064 -9.262 -7.272 190 HE1 HIS 5 HE1 HIS 5 -12.211 -7.335 -9.235 191 H LEU 6 H LEU 6 -5.237 -9.180 -11.147 192 HA LEU 6 HA LEU 6 -4.174 -11.911 -11.390 193 HB2 LEU 6 1HB LEU 6 -2.663 -9.333 -11.068 194 HB3 LEU 6 2HB LEU 6 -2.020 -10.833 -11.738 195 HG LEU 6 HG LEU 6 -4.107 -9.030 -13.100 196 HD11 LEU 6 1HD1 LEU 6 -2.099 -8.330 -14.449 197 HD12 LEU 6 2HD1 LEU 6 -1.069 -9.385 -13.462 198 HD13 LEU 6 3HD1 LEU 6 -1.901 -7.980 -12.741 199 HD21 LEU 6 3HD2 LEU 6 -2.460 -11.351 -14.202 200 HD22 LEU 6 1HD2 LEU 6 -3.528 -10.245 -15.126 201 HD23 LEU 6 2HD2 LEU 6 -4.215 -11.336 -13.906 202 H CYS 7 H CYS 7 -2.244 -12.486 -9.968 203 HA CYS 7 HA CYS 7 -1.777 -10.877 -7.601 204 HB2 CYS 7 1HB CYS 7 -3.207 -13.552 -7.496 205 HB3 CYS 7 2HB CYS 7 -1.840 -13.347 -6.421 206 H GLY 8 H GLY 8 0.176 -12.152 -6.436 207 HA2 GLY 8 1HA GLY 8 2.392 -11.956 -7.717 208 HA3 GLY 8 2HA GLY 8 2.193 -13.413 -6.739 209 H SER 9 H SER 9 0.894 -15.221 -8.255 210 HA SER 9 HA SER 9 2.983 -15.939 -10.059 211 HB2 SER 9 1HB SER 9 1.460 -17.476 -8.760 212 HB3 SER 9 2HB SER 9 0.223 -17.200 -10.009 213 HG SER 9 HG SER 9 2.793 -17.885 -10.812 214 H HIS 10 H HIS 10 -0.353 -14.850 -10.805 215 HA HIS 10 HA HIS 10 0.174 -14.862 -13.702 216 HB2 HIS 10 1HB HIS 10 -2.035 -13.642 -12.055 217 HB3 HIS 10 2HB HIS 10 -1.948 -13.554 -13.808 218 HD1 HIS 10 HD1 HIS 10 -4.436 -14.975 -13.054 219 HD2 HIS 10 HD2 HIS 10 -0.767 -16.963 -13.011 220 HE1 HIS 10 HE1 HIS 10 -4.969 -17.406 -13.220 221 H LEU 11 H LEU 11 0.738 -12.654 -11.136 222 HA LEU 11 HA LEU 11 0.796 -10.218 -12.711 223 HB2 LEU 11 1HB LEU 11 0.818 -10.335 -10.176 224 HB3 LEU 11 2HB LEU 11 2.457 -10.875 -10.302 225 HG LEU 11 HG LEU 11 3.150 -8.740 -11.342 226 HD11 LEU 11 1HD1 LEU 11 1.563 -6.811 -11.268 227 HD12 LEU 11 2HD1 LEU 11 0.249 -7.932 -10.996 228 HD13 LEU 11 3HD1 LEU 11 1.145 -8.005 -12.484 229 HD21 LEU 11 3HD2 LEU 11 2.951 -7.402 -9.348 230 HD22 LEU 11 1HD2 LEU 11 3.167 -9.089 -8.873 231 HD23 LEU 11 2HD2 LEU 11 1.568 -8.369 -8.769 232 H VAL 12 H VAL 12 3.174 -12.843 -12.156 233 HA VAL 12 HA VAL 12 5.366 -11.462 -13.453 234 HB VAL 12 HB VAL 12 4.707 -14.443 -13.107 235 HG11 VAL 12 1HG1 VAL 12 7.196 -14.829 -13.603 236 HG12 VAL 12 2HG1 VAL 12 6.229 -14.300 -14.988 237 HG13 VAL 12 3HG1 VAL 12 7.259 -13.091 -14.148 238 HG21 VAL 12 3HG2 VAL 12 6.421 -14.441 -11.325 239 HG22 VAL 12 1HG2 VAL 12 6.641 -12.660 -11.530 240 HG23 VAL 12 2HG2 VAL 12 5.061 -13.273 -10.991 241 H GLU 13 H GLU 13 2.796 -13.647 -14.629 242 HA GLU 13 HA GLU 13 3.930 -13.755 -17.307 243 HB2 GLU 13 1HB GLU 13 1.089 -14.262 -16.253 244 HB3 GLU 13 2HB GLU 13 1.672 -14.660 -17.924 245 HG2 GLU 13 1HG GLU 13 3.453 -16.119 -16.907 246 HG3 GLU 13 2HG GLU 13 2.776 -15.749 -15.311 247 H ALA 14 H ALA 14 1.539 -11.686 -15.643 248 HA ALA 14 HA ALA 14 0.683 -10.180 -17.877 249 HB1 ALA 14 3HB ALA 14 -0.039 -8.613 -16.233 250 HB2 ALA 14 1HB ALA 14 -0.352 -10.217 -15.601 251 HB3 ALA 14 2HB ALA 14 1.023 -9.270 -15.042 252 H LEU 15 H LEU 15 3.397 -9.702 -15.608 253 HA LEU 15 HA LEU 15 4.316 -7.297 -16.804 254 HB2 LEU 15 1HB LEU 15 5.807 -9.434 -15.222 255 HB3 LEU 15 2HB LEU 15 6.543 -7.941 -15.806 256 HG LEU 15 HG LEU 15 4.077 -7.751 -14.128 257 HD11 LEU 15 1HD1 LEU 15 6.913 -8.177 -13.108 258 HD12 LEU 15 2HD1 LEU 15 5.446 -9.125 -12.745 259 HD13 LEU 15 3HD1 LEU 15 5.632 -7.453 -12.146 260 HD21 LEU 15 3HD2 LEU 15 4.934 -5.806 -15.349 261 HD22 LEU 15 1HD2 LEU 15 6.487 -5.949 -14.376 262 HD23 LEU 15 2HD2 LEU 15 4.922 -5.609 -13.554 263 H TYR 16 H TYR 16 5.078 -10.769 -17.521 264 HA TYR 16 HA TYR 16 7.149 -10.179 -19.435 265 HB2 TYR 16 1HB TYR 16 6.514 -12.382 -18.204 266 HB3 TYR 16 2HB TYR 16 5.288 -12.614 -19.412 267 HD1 TYR 16 HD2 TYR 16 8.985 -12.328 -18.971 268 HD2 TYR 16 HD1 TYR 16 5.796 -13.320 -21.694 269 HE1 TYR 16 HE2 TYR 16 10.656 -13.178 -20.597 270 HE2 TYR 16 HE1 TYR 16 7.485 -14.208 -23.288 271 HH TYR 16 HH TYR 16 9.676 -14.402 -23.791 272 H LEU 17 H LEU 17 3.597 -10.535 -19.807 273 HA LEU 17 HA LEU 17 3.717 -10.385 -22.699 274 HB2 LEU 17 1HB LEU 17 1.544 -9.823 -20.645 275 HB3 LEU 17 2HB LEU 17 1.267 -9.775 -22.371 276 HG LEU 17 HG LEU 17 2.320 -12.294 -21.099 277 HD11 LEU 17 1HD1 LEU 17 -0.527 -11.366 -21.330 278 HD12 LEU 17 2HD1 LEU 17 0.383 -11.558 -19.780 279 HD13 LEU 17 3HD1 LEU 17 0.014 -12.994 -20.784 280 HD21 LEU 17 3HD2 LEU 17 1.269 -13.318 -23.019 281 HD22 LEU 17 1HD2 LEU 17 2.300 -12.011 -23.576 282 HD23 LEU 17 2HD2 LEU 17 0.528 -11.739 -23.449 283 H VAL 18 H VAL 18 3.374 -7.947 -20.145 284 HA VAL 18 HA VAL 18 2.598 -5.956 -22.151 285 HB VAL 18 HB VAL 18 2.817 -5.849 -19.090 286 HG11 VAL 18 1HG1 VAL 18 1.429 -3.710 -19.399 287 HG12 VAL 18 2HG1 VAL 18 3.079 -3.559 -19.916 288 HG13 VAL 18 3HG1 VAL 18 1.783 -3.784 -21.127 289 HG21 VAL 18 3HG2 VAL 18 1.002 -7.309 -19.811 290 HG22 VAL 18 1HG2 VAL 18 0.270 -5.732 -19.397 291 HG23 VAL 18 2HG2 VAL 18 0.534 -6.227 -21.089 292 H CYS 19 H CYS 19 5.253 -6.401 -19.751 293 HA CYS 19 HA CYS 19 6.705 -4.191 -21.107 294 HB2 CYS 19 1HB CYS 19 7.404 -5.413 -18.438 295 HB3 CYS 19 2HB CYS 19 7.985 -3.929 -19.229 296 H GLY 20 H GLY 20 7.028 -7.582 -20.211 297 HA2 GLY 20 1HA GLY 20 8.578 -9.121 -20.951 298 HA3 GLY 20 2HA GLY 20 9.167 -7.946 -22.097 299 H GLU 21 H GLU 21 11.273 -8.730 -21.719 300 HA GLU 21 HA GLU 21 12.543 -8.469 -19.080 301 HB2 GLU 21 1HB GLU 21 14.620 -8.849 -20.301 302 HB3 GLU 21 2HB GLU 21 13.356 -9.965 -20.839 303 HG2 GLU 21 1HG GLU 21 13.712 -7.505 -22.518 304 HG3 GLU 21 2HG GLU 21 14.981 -8.710 -22.550 305 H ARG 22 H ARG 22 11.386 -6.178 -21.254 306 HA ARG 22 HA ARG 22 13.507 -4.174 -20.695 307 HB2 ARG 22 1HB ARG 22 11.013 -4.129 -22.429 308 HB3 ARG 22 2HB ARG 22 12.097 -2.764 -22.179 309 HG2 ARG 22 1HG ARG 22 13.956 -4.001 -23.104 310 HG3 ARG 22 2HG ARG 22 12.933 -5.431 -23.307 311 HD2 ARG 22 1HD ARG 22 11.564 -4.128 -24.945 312 HD3 ARG 22 2HD ARG 22 12.529 -2.690 -24.612 313 HE ARG 22 HE ARG 22 14.289 -3.603 -25.845 314 HH11 ARG 22 1HH1 ARG 22 11.793 -6.038 -25.517 315 HH12 ARG 22 2HH1 ARG 22 12.573 -7.150 -26.614 316 HH21 ARG 22 1HH2 ARG 22 15.271 -5.081 -27.228 317 HH22 ARG 22 2HH2 ARG 22 14.477 -6.592 -27.565 318 H GLY 23 H GLY 23 11.183 -5.396 -18.885 319 HA2 GLY 23 1HA GLY 23 10.764 -2.749 -17.605 320 HA3 GLY 23 2HA GLY 23 9.390 -3.761 -17.958 321 H PHE 24 H PHE 24 10.875 -6.351 -17.128 322 HA PHE 24 HA PHE 24 11.124 -5.646 -14.202 323 HB2 PHE 24 1HB PHE 24 9.430 -7.051 -13.497 324 HB3 PHE 24 2HB PHE 24 8.709 -6.352 -14.916 325 HD1 PHE 24 HD2 PHE 24 8.971 -7.618 -17.173 326 HD2 PHE 24 HD1 PHE 24 9.390 -9.389 -13.271 327 HE1 PHE 24 HE2 PHE 24 8.593 -9.923 -18.145 328 HE2 PHE 24 HE1 PHE 24 8.941 -11.654 -14.207 329 HZ PHE 24 HZ PHE 24 8.538 -11.939 -16.652 330 H PHE 25 H PHE 25 11.966 -7.362 -12.889 331 HA PHE 25 HA PHE 25 13.416 -9.436 -14.386 332 HB2 PHE 25 1HB PHE 25 14.747 -7.246 -14.200 333 HB3 PHE 25 2HB PHE 25 14.810 -7.479 -12.458 334 HD1 PHE 25 HD2 PHE 25 15.039 -10.612 -14.363 335 HD2 PHE 25 HD1 PHE 25 17.324 -7.207 -13.005 336 HE1 PHE 25 HE2 PHE 25 17.174 -11.913 -14.681 337 HE2 PHE 25 HE1 PHE 25 19.415 -8.507 -13.304 338 HZ PHE 25 HZ PHE 25 19.345 -10.859 -14.113 339 H NVA 26 H ARX 26 11.778 -10.683 -13.246 340 HA NVA 26 HA ARX 26 11.745 -11.097 -10.387 341 HB2 NVA 26 1HB ARX 26 9.853 -11.797 -11.957 342 HB3 NVA 26 2HB ARX 26 10.858 -12.936 -12.723 343 HG2 NVA 26 1HG ARX 26 10.976 -13.832 -10.117 344 HG3 NVA 26 2HG ARX 26 9.392 -13.112 -10.107 345 HD2 NVA 26 1HD ARX 26 8.493 -14.633 -11.620 346 HD3 NVA 26 2HD ARX 26 10.042 -14.927 -12.410 347 H THR 27 H THR 27 13.605 -12.651 -12.892 348 HA THR 27 HA THR 27 15.407 -14.078 -13.031 349 HB THR 27 HB THR 27 16.941 -14.406 -11.251 350 HG1 THR 27 HG1 THR 27 14.800 -13.730 -9.520 351 HG21 THR 27 1HG2 THR 27 15.635 -11.710 -10.535 352 HG22 THR 27 2HG2 THR 27 16.675 -11.973 -11.946 353 HG23 THR 27 3HG2 THR 27 17.291 -12.190 -10.288 354 HA PRO 28 HA PRO 28 13.420 -17.941 -12.634 355 HB2 PRO 28 1HB PRO 28 15.986 -19.275 -11.755 356 HB3 PRO 28 2HB PRO 28 14.884 -19.744 -13.083 357 HG2 PRO 28 1HG PRO 28 17.182 -18.602 -13.643 358 HG3 PRO 28 2HG PRO 28 15.722 -18.068 -14.483 359 HD2 PRO 28 1HD PRO 28 17.113 -16.715 -12.174 360 HD3 PRO 28 2HD PRO 28 16.419 -16.004 -13.696 361 H HIX 29 H HIX 29 12.267 -18.963 -11.192 362 HA HIX 29 HA HIX 29 13.138 -19.612 -8.474 363 HB1 HIX 29 1HB HIX 29 10.686 -19.028 -7.731 364 HB2 HIX 29 2HB HIX 29 11.946 -17.808 -7.788 365 HD2 HIX 29 HD2 HIX 29 11.614 -15.841 -9.744 366 HD1 HIX 29 HD1 HIX 29 8.779 -18.878 -9.627 367 HE1 HIX 29 HE1 HIX 29 8.784 -17.481 -11.716 368 H THR 30 H THR 30 13.604 -21.546 -9.205 369 HA THR 30 HA THR 30 11.576 -23.294 -10.488 370 HB THR 30 HB THR 30 14.481 -23.994 -9.826 371 HG1 THR 30 HG1 THR 30 13.450 -22.724 -12.159 372 HG21 THR 30 1HG2 THR 30 14.221 -25.697 -11.507 373 HG22 THR 30 2HG2 THR 30 12.717 -25.010 -12.107 374 HG23 THR 30 3HG2 THR 30 12.792 -25.788 -10.501 Start of MODEL 16 1 H1 GLY 1 1H GLY 1 4.698 -0.396 -1.122 2 H2 GLY 1 2H GLY 1 4.491 -0.087 -2.713 3 H3 GLY 1 3H GLY 1 3.253 0.049 -1.698 4 HA2 GLY 1 1HA GLY 1 4.582 -2.482 -2.316 5 HA3 GLY 1 2HA GLY 1 3.225 -2.315 -1.190 6 H ILE 2 H ILE 2 4.195 -1.542 -4.592 7 HA ILE 2 HA ILE 2 1.495 -1.215 -5.474 8 HB ILE 2 HB ILE 2 3.633 -0.331 -6.582 9 HG12 ILE 2 1HG1 ILE 2 1.788 -1.768 -8.527 10 HG13 ILE 2 2HG1 ILE 2 1.303 -0.375 -7.535 11 HG21 ILE 2 1HG2 ILE 2 3.788 -3.139 -7.795 12 HG22 ILE 2 2HG2 ILE 2 4.766 -1.708 -8.300 13 HG23 ILE 2 3HG2 ILE 2 4.941 -2.425 -6.636 14 HD11 ILE 2 3HD1 ILE 2 3.494 -0.497 -9.688 15 HD12 ILE 2 1HD1 ILE 2 1.992 0.382 -9.808 16 HD13 ILE 2 2HD1 ILE 2 3.240 0.935 -8.689 17 H VAL 3 H VAL 3 3.498 -4.156 -5.155 18 HA VAL 3 HA VAL 3 1.931 -5.850 -6.760 19 HB VAL 3 HB VAL 3 3.390 -6.543 -4.148 20 HG11 VAL 3 1HG1 VAL 3 1.702 -8.247 -4.806 21 HG12 VAL 3 2HG1 VAL 3 2.553 -8.384 -6.354 22 HG13 VAL 3 3HG1 VAL 3 3.382 -8.831 -4.884 23 HG21 VAL 3 3HG2 VAL 3 5.108 -7.505 -5.912 24 HG22 VAL 3 1HG2 VAL 3 4.301 -6.432 -7.037 25 HG23 VAL 3 2HG2 VAL 3 5.124 -5.751 -5.593 26 H GLU 4 H GLU 4 1.530 -5.173 -3.209 27 HA GLU 4 HA GLU 4 -0.896 -6.636 -2.944 28 HB2 GLU 4 1HB GLU 4 0.317 -4.267 -1.413 29 HB3 GLU 4 2HB GLU 4 -1.225 -5.019 -0.956 30 HG2 GLU 4 1HG GLU 4 1.240 -6.786 -1.210 31 HG3 GLU 4 2HG GLU 4 0.999 -5.764 0.205 32 H GLN 5 H GLN 5 -0.216 -3.227 -3.837 33 HA GLN 5 HA GLN 5 -2.915 -2.295 -3.829 34 HB2 GLN 5 1HB GLN 5 -0.538 -1.175 -4.483 35 HB3 GLN 5 2HB GLN 5 -1.139 -1.486 -6.082 36 HG2 GLN 5 1HG GLN 5 -1.874 0.524 -5.796 37 HG3 GLN 5 2HG GLN 5 -3.275 -0.435 -5.287 38 HE21 GLN 5 2HE2 GLN 5 -3.079 2.186 -4.452 39 HE22 GLN 5 1HE2 GLN 5 -2.613 2.282 -2.772 40 H CYS 6 H CYS 6 -1.182 -4.305 -6.200 41 HA CYS 6 HA CYS 6 -3.499 -4.126 -8.110 42 HB2 CYS 6 1HB CYS 6 -0.724 -5.116 -8.182 43 HB3 CYS 6 2HB CYS 6 -1.879 -5.832 -9.306 44 H CYS 7 H CYS 7 -2.265 -6.256 -5.629 45 HA CYS 7 HA CYS 7 -3.851 -8.516 -6.656 46 HB2 CYS 7 1HB CYS 7 -2.232 -8.140 -4.118 47 HB3 CYS 7 2HB CYS 7 -3.131 -9.610 -4.455 48 H THR 8 H THR 8 -4.360 -5.769 -4.605 49 HA THR 8 HA THR 8 -6.615 -7.046 -3.219 50 HB THR 8 HB THR 8 -6.969 -4.579 -2.451 51 HG1 THR 8 HG1 THR 8 -4.317 -4.377 -3.449 52 HG21 THR 8 1HG2 THR 8 -4.419 -6.055 -1.707 53 HG22 THR 8 2HG2 THR 8 -6.033 -6.322 -0.976 54 HG23 THR 8 3HG2 THR 8 -5.185 -4.763 -0.735 55 H SER 9 H SER 9 -7.267 -7.724 -5.360 56 HA SER 9 HA SER 9 -9.006 -7.731 -6.894 57 HB2 SER 9 1HB SER 9 -10.306 -6.365 -5.285 58 HB3 SER 9 2HB SER 9 -9.697 -4.910 -6.131 59 HG SER 9 HG SER 9 -11.426 -5.264 -7.255 60 H ILE 10 H ILE 10 -9.398 -6.970 -8.997 61 HA ILE 10 HA ILE 10 -6.975 -6.592 -10.357 62 HB ILE 10 HB ILE 10 -9.727 -5.753 -11.449 63 HG12 ILE 10 1HG1 ILE 10 -8.511 -8.474 -11.091 64 HG13 ILE 10 2HG1 ILE 10 -9.965 -7.895 -10.316 65 HG21 ILE 10 1HG2 ILE 10 -7.249 -6.913 -12.822 66 HG22 ILE 10 2HG2 ILE 10 -8.762 -6.579 -13.602 67 HG23 ILE 10 3HG2 ILE 10 -7.818 -5.232 -12.955 68 HD11 ILE 10 3HD1 ILE 10 -10.969 -7.755 -12.619 69 HD12 ILE 10 1HD1 ILE 10 -9.589 -8.739 -13.174 70 HD13 ILE 10 2HD1 ILE 10 -10.700 -9.368 -11.920 71 H CYS 11 H CYS 11 -5.608 -5.077 -10.619 72 HA CYS 11 HA CYS 11 -6.388 -2.260 -10.571 73 HB2 CYS 11 1HB CYS 11 -4.085 -1.737 -10.524 74 HB3 CYS 11 2HB CYS 11 -4.414 -3.025 -9.381 75 H SER 12 H SER 12 -5.563 -0.801 -12.245 76 HA SER 12 HA SER 12 -6.405 -1.723 -14.846 77 HB2 SER 12 1HB SER 12 -5.293 0.890 -14.966 78 HB3 SER 12 2HB SER 12 -7.040 0.448 -14.925 79 HG SER 12 HG SER 12 -7.142 1.213 -13.059 80 H LEU 13 H LEU 13 -5.256 -1.115 -16.896 81 HA LEU 13 HA LEU 13 -2.748 -2.429 -16.996 82 HB2 LEU 13 1HB LEU 13 -4.236 -2.150 -18.954 83 HB3 LEU 13 2HB LEU 13 -4.098 -0.413 -18.859 84 HG LEU 13 HG LEU 13 -1.719 -0.491 -19.463 85 HD11 LEU 13 1HD1 LEU 13 -0.870 -2.472 -18.608 86 HD12 LEU 13 2HD1 LEU 13 -0.873 -2.735 -20.347 87 HD13 LEU 13 3HD1 LEU 13 -2.142 -3.471 -19.317 88 HD21 LEU 13 3HD2 LEU 13 -2.012 -1.388 -21.771 89 HD22 LEU 13 1HD2 LEU 13 -3.232 -0.252 -21.269 90 HD23 LEU 13 2HD2 LEU 13 -3.621 -1.971 -21.301 91 H TYR 14 H TYR 14 -3.542 1.072 -16.649 92 HA TYR 14 HA TYR 14 -0.825 1.869 -17.121 93 HB2 TYR 14 1HB TYR 14 -1.620 4.080 -15.890 94 HB3 TYR 14 2HB TYR 14 -2.252 3.627 -17.461 95 HD1 TYR 14 HD1 TYR 14 -4.615 2.891 -17.731 96 HD2 TYR 14 HD2 TYR 14 -3.058 4.035 -13.891 97 HE1 TYR 14 HE1 TYR 14 -6.874 3.110 -16.849 98 HE2 TYR 14 HE2 TYR 14 -5.402 4.068 -12.989 99 HH TYR 14 HH TYR 14 -8.258 3.461 -15.068 100 H GLN 15 H GLN 15 -2.491 0.681 -14.257 101 HA GLN 15 HA GLN 15 -0.502 1.630 -12.371 102 HB2 GLN 15 1HB GLN 15 -2.768 -0.407 -12.202 103 HB3 GLN 15 2HB GLN 15 -1.655 -0.019 -10.864 104 HG2 GLN 15 1HG GLN 15 -2.369 2.365 -11.140 105 HG3 GLN 15 2HG GLN 15 -3.678 1.802 -12.153 106 HE21 GLN 15 2HE2 GLN 15 -5.477 1.271 -11.150 107 HE22 GLN 15 1HE2 GLN 15 -5.671 0.846 -9.488 108 H LEU 16 H LEU 16 -1.260 -1.277 -14.249 109 HA LEU 16 HA LEU 16 0.857 -2.949 -13.230 110 HB2 LEU 16 1HB LEU 16 -1.256 -3.459 -14.707 111 HB3 LEU 16 2HB LEU 16 -0.268 -2.904 -16.061 112 HG LEU 16 HG LEU 16 0.459 -5.239 -14.234 113 HD11 LEU 16 1HD1 LEU 16 -1.010 -5.008 -16.966 114 HD12 LEU 16 2HD1 LEU 16 -1.664 -5.623 -15.433 115 HD13 LEU 16 3HD1 LEU 16 -0.435 -6.550 -16.299 116 HD21 LEU 16 3HD2 LEU 16 2.487 -4.581 -15.412 117 HD22 LEU 16 1HD2 LEU 16 1.632 -4.476 -16.966 118 HD23 LEU 16 2HD2 LEU 16 1.837 -6.039 -16.165 119 H GLU 17 H GLU 17 0.662 -0.616 -15.967 120 HA GLU 17 HA GLU 17 3.335 -0.994 -16.925 121 HB2 GLU 17 1HB GLU 17 1.411 1.293 -17.219 122 HB3 GLU 17 2HB GLU 17 2.999 1.255 -17.962 123 HG2 GLU 17 1HG GLU 17 2.427 -0.818 -19.146 124 HG3 GLU 17 2HG GLU 17 0.827 -0.804 -18.440 125 H ASN 18 H ASN 18 2.005 0.827 -14.267 126 HA ASN 18 HA ASN 18 4.265 2.604 -13.906 127 HB2 ASN 18 1HB ASN 18 1.774 2.006 -12.478 128 HB3 ASN 18 2HB ASN 18 3.136 2.008 -11.361 129 HD21 ASN 18 2HD2 ASN 18 1.311 3.810 -13.716 130 HD22 ASN 18 1HD2 ASN 18 1.894 5.389 -13.185 131 H TYR 19 H TYR 19 3.915 -0.881 -13.423 132 HA TYR 19 HA TYR 19 5.942 -1.125 -11.318 133 HB2 TYR 19 1HB TYR 19 5.057 -2.929 -13.576 134 HB3 TYR 19 2HB TYR 19 6.443 -3.321 -12.517 135 HD1 TYR 19 HD1 TYR 19 2.898 -2.112 -12.072 136 HD2 TYR 19 HD2 TYR 19 5.929 -4.915 -10.862 137 HE1 TYR 19 HE1 TYR 19 1.271 -3.124 -10.486 138 HE2 TYR 19 HE2 TYR 19 4.248 -5.978 -9.239 139 HH TYR 19 HH TYR 19 0.977 -4.599 -8.894 140 H CYS 20 H CYS 20 5.911 -0.666 -14.849 141 HA CYS 20 HA CYS 20 8.697 -1.407 -15.231 142 HB2 CYS 20 1HB CYS 20 6.434 -0.691 -16.865 143 HB3 CYS 20 2HB CYS 20 7.788 0.350 -17.271 144 H ASN 21 H ASN 21 10.185 0.283 -16.301 145 HA ASN 21 HA ASN 21 9.994 2.742 -14.551 146 HB2 ASN 21 1HB ASN 21 12.441 1.208 -15.518 147 HB3 ASN 21 2HB ASN 21 12.458 2.778 -14.637 148 HD21 ASN 21 2HD2 ASN 21 13.378 -0.086 -14.189 149 HD22 ASN 21 1HD2 ASN 21 12.818 -0.362 -12.557 150 H1 PHE 1 1H PHE 1 -2.571 -6.953 -23.843 151 H2 PHE 1 2H PHE 1 -3.268 -5.472 -23.293 152 H3 PHE 1 3H PHE 1 -1.629 -5.886 -23.137 153 HA PHE 1 HA PHE 1 -2.253 -7.739 -21.647 154 HB2 PHE 1 1HB PHE 1 -1.584 -5.563 -20.790 155 HB3 PHE 1 2HB PHE 1 -3.217 -4.953 -21.001 156 HD1 PHE 1 HD2 PHE 1 -1.562 -8.015 -19.426 157 HD2 PHE 1 HD1 PHE 1 -4.455 -4.858 -18.977 158 HE1 PHE 1 HE2 PHE 1 -2.121 -8.834 -17.186 159 HE2 PHE 1 HE1 PHE 1 -4.988 -5.713 -16.651 160 HZ PHE 1 HZ PHE 1 -3.797 -7.669 -15.825 161 H VAL 2 H VAL 2 -3.959 -8.962 -20.734 162 HA VAL 2 HA VAL 2 -6.708 -7.979 -21.399 163 HB VAL 2 HB VAL 2 -5.764 -10.906 -21.282 164 HG11 VAL 2 1HG1 VAL 2 -8.058 -10.763 -20.376 165 HG12 VAL 2 2HG1 VAL 2 -8.575 -9.775 -21.781 166 HG13 VAL 2 3HG1 VAL 2 -8.111 -11.467 -21.993 167 HG21 VAL 2 3HG2 VAL 2 -6.231 -11.071 -23.647 168 HG22 VAL 2 1HG2 VAL 2 -7.021 -9.478 -23.691 169 HG23 VAL 2 2HG2 VAL 2 -5.252 -9.609 -23.450 170 H ASN 3 H ASN 3 -8.012 -7.886 -19.461 171 HA ASN 3 HA ASN 3 -6.578 -7.701 -17.042 172 HB2 ASN 3 1HB ASN 3 -8.480 -6.890 -16.035 173 HB3 ASN 3 2HB ASN 3 -8.781 -6.475 -17.701 174 HD21 ASN 3 2HD2 ASN 3 -10.316 -7.785 -18.918 175 HD22 ASN 3 1HD2 ASN 3 -11.542 -8.697 -18.051 176 H GLN 4 H GLN 4 -6.412 -8.889 -15.304 177 HA GLN 4 HA GLN 4 -7.642 -11.581 -15.132 178 HB2 GLN 4 1HB GLN 4 -4.666 -10.859 -15.178 179 HB3 GLN 4 2HB GLN 4 -5.218 -12.382 -14.481 180 HG2 GLN 4 1HG GLN 4 -5.562 -11.576 -17.413 181 HG3 GLN 4 2HG GLN 4 -4.460 -12.818 -16.779 182 HE21 GLN 4 2HE2 GLN 4 -7.099 -12.553 -18.466 183 HE22 GLN 4 1HE2 GLN 4 -8.031 -13.878 -17.905 184 H HIS 5 H HIS 5 -7.184 -12.322 -12.667 185 HA HIS 5 HA HIS 5 -7.393 -9.867 -11.012 186 HB2 HIS 5 1HB HIS 5 -8.488 -12.379 -10.870 187 HB3 HIS 5 2HB HIS 5 -7.200 -12.473 -9.694 188 HD1 HIS 5 HD1 HIS 5 -10.558 -10.866 -10.242 189 HD2 HIS 5 HD2 HIS 5 -7.494 -10.855 -7.412 190 HE1 HIS 5 HE1 HIS 5 -11.456 -9.691 -8.166 191 H LEU 6 H LEU 6 -4.878 -11.601 -12.291 192 HA LEU 6 HA LEU 6 -2.735 -11.730 -11.955 193 HB2 LEU 6 1HB LEU 6 -2.985 -9.243 -10.210 194 HB3 LEU 6 2HB LEU 6 -1.500 -9.784 -11.047 195 HG LEU 6 HG LEU 6 -4.050 -8.841 -12.406 196 HD11 LEU 6 1HD1 LEU 6 -2.954 -6.775 -12.876 197 HD12 LEU 6 2HD1 LEU 6 -1.430 -7.381 -12.215 198 HD13 LEU 6 3HD1 LEU 6 -2.784 -7.063 -11.126 199 HD21 LEU 6 3HD2 LEU 6 -2.358 -8.716 -14.376 200 HD22 LEU 6 1HD2 LEU 6 -2.940 -10.334 -13.863 201 HD23 LEU 6 2HD2 LEU 6 -1.337 -9.766 -13.332 202 H CYS 7 H CYS 7 -1.204 -10.796 -9.638 203 HA CYS 7 HA CYS 7 -0.097 -11.700 -7.898 204 HB2 CYS 7 1HB CYS 7 -2.787 -11.790 -7.150 205 HB3 CYS 7 2HB CYS 7 -2.029 -13.280 -6.594 206 H GLY 8 H GLY 8 0.870 -13.714 -7.062 207 HA2 GLY 8 1HA GLY 8 1.825 -15.840 -7.451 208 HA3 GLY 8 2HA GLY 8 0.199 -16.241 -8.089 209 H SER 9 H SER 9 1.074 -17.552 -9.817 210 HA SER 9 HA SER 9 3.076 -16.638 -11.546 211 HB2 SER 9 1HB SER 9 0.787 -18.361 -12.460 212 HB3 SER 9 2HB SER 9 2.503 -18.385 -12.994 213 HG SER 9 HG SER 9 1.939 -20.042 -11.457 214 H HIS 10 H HIS 10 -0.330 -15.771 -11.634 215 HA HIS 10 HA HIS 10 -0.504 -14.981 -14.313 216 HB2 HIS 10 1HB HIS 10 -2.090 -14.117 -11.915 217 HB3 HIS 10 2HB HIS 10 -2.509 -13.663 -13.525 218 HD1 HIS 10 HD1 HIS 10 -4.569 -15.375 -11.995 219 HD2 HIS 10 HD2 HIS 10 -1.591 -17.010 -14.411 220 HE1 HIS 10 HE1 HIS 10 -5.287 -17.731 -12.614 221 H LEU 11 H LEU 11 0.775 -13.400 -11.469 222 HA LEU 11 HA LEU 11 0.806 -10.702 -12.588 223 HB2 LEU 11 1HB LEU 11 0.897 -11.438 -10.094 224 HB3 LEU 11 2HB LEU 11 2.550 -11.978 -10.412 225 HG LEU 11 HG LEU 11 3.193 -9.626 -10.986 226 HD11 LEU 11 1HD1 LEU 11 1.764 -7.766 -10.527 227 HD12 LEU 11 2HD1 LEU 11 0.478 -8.790 -9.855 228 HD13 LEU 11 3HD1 LEU 11 0.838 -8.864 -11.586 229 HD21 LEU 11 3HD2 LEU 11 1.917 -10.116 -8.257 230 HD22 LEU 11 1HD2 LEU 11 3.039 -8.768 -8.650 231 HD23 LEU 11 2HD2 LEU 11 3.601 -10.481 -8.764 232 H VAL 12 H VAL 12 3.089 -13.410 -12.288 233 HA VAL 12 HA VAL 12 5.332 -12.003 -13.351 234 HB VAL 12 HB VAL 12 4.681 -14.957 -13.378 235 HG11 VAL 12 1HG1 VAL 12 7.111 -15.261 -13.572 236 HG12 VAL 12 2HG1 VAL 12 6.456 -14.372 -14.979 237 HG13 VAL 12 3HG1 VAL 12 7.318 -13.508 -13.699 238 HG21 VAL 12 3HG2 VAL 12 6.152 -13.199 -11.376 239 HG22 VAL 12 1HG2 VAL 12 4.660 -14.128 -11.088 240 HG23 VAL 12 2HG2 VAL 12 6.206 -14.980 -11.367 241 H GLU 13 H GLU 13 2.848 -14.215 -14.824 242 HA GLU 13 HA GLU 13 3.725 -13.936 -17.511 243 HB2 GLU 13 1HB GLU 13 1.075 -14.484 -16.165 244 HB3 GLU 13 2HB GLU 13 1.156 -14.300 -17.921 245 HG2 GLU 13 1HG GLU 13 2.928 -16.339 -16.479 246 HG3 GLU 13 2HG GLU 13 1.229 -16.686 -16.841 247 H ALA 14 H ALA 14 1.482 -11.808 -15.584 248 HA ALA 14 HA ALA 14 0.679 -10.247 -17.846 249 HB1 ALA 14 3HB ALA 14 -0.597 -10.229 -15.740 250 HB2 ALA 14 1HB ALA 14 0.797 -9.568 -14.859 251 HB3 ALA 14 2HB ALA 14 -0.030 -8.578 -16.122 252 H LEU 15 H LEU 15 3.281 -9.783 -15.465 253 HA LEU 15 HA LEU 15 4.192 -7.331 -16.546 254 HB2 LEU 15 1HB LEU 15 5.263 -9.416 -14.764 255 HB3 LEU 15 2HB LEU 15 6.446 -8.417 -15.586 256 HG LEU 15 HG LEU 15 5.923 -7.651 -13.304 257 HD11 LEU 15 1HD1 LEU 15 5.840 -5.317 -13.902 258 HD12 LEU 15 2HD1 LEU 15 4.978 -5.608 -15.413 259 HD13 LEU 15 3HD1 LEU 15 6.659 -6.133 -15.222 260 HD21 LEU 15 3HD2 LEU 15 3.770 -6.437 -12.893 261 HD22 LEU 15 1HD2 LEU 15 3.548 -8.177 -13.118 262 HD23 LEU 15 2HD2 LEU 15 3.122 -7.068 -14.452 263 H TYR 16 H TYR 16 5.099 -10.675 -17.283 264 HA TYR 16 HA TYR 16 7.258 -10.034 -19.056 265 HB2 TYR 16 1HB TYR 16 6.754 -12.273 -18.073 266 HB3 TYR 16 2HB TYR 16 5.302 -12.407 -19.070 267 HD1 TYR 16 HD1 TYR 16 9.105 -12.275 -19.118 268 HD2 TYR 16 HD2 TYR 16 5.508 -13.145 -21.417 269 HE1 TYR 16 HE1 TYR 16 10.461 -13.349 -20.919 270 HE2 TYR 16 HE2 TYR 16 6.937 -14.130 -23.204 271 HH TYR 16 HH TYR 16 9.149 -14.697 -23.861 272 H LEU 17 H LEU 17 3.770 -10.427 -19.599 273 HA LEU 17 HA LEU 17 3.994 -10.130 -22.454 274 HB2 LEU 17 1HB LEU 17 1.715 -9.905 -20.546 275 HB3 LEU 17 2HB LEU 17 1.513 -9.558 -22.236 276 HG LEU 17 HG LEU 17 2.470 -12.220 -21.132 277 HD11 LEU 17 1HD1 LEU 17 0.189 -13.006 -21.546 278 HD12 LEU 17 2HD1 LEU 17 -0.303 -11.361 -22.006 279 HD13 LEU 17 3HD1 LEU 17 0.220 -11.688 -20.327 280 HD21 LEU 17 3HD2 LEU 17 1.456 -11.405 -23.911 281 HD22 LEU 17 1HD2 LEU 17 1.678 -13.071 -23.413 282 HD23 LEU 17 2HD2 LEU 17 3.092 -11.956 -23.510 283 H VAL 18 H VAL 18 3.395 -7.766 -19.827 284 HA VAL 18 HA VAL 18 2.732 -5.734 -21.809 285 HB VAL 18 HB VAL 18 2.917 -5.650 -18.822 286 HG11 VAL 18 1HG1 VAL 18 1.838 -3.478 -20.760 287 HG12 VAL 18 2HG1 VAL 18 1.960 -3.378 -18.971 288 HG13 VAL 18 3HG1 VAL 18 3.416 -3.331 -19.957 289 HG21 VAL 18 3HG2 VAL 18 0.396 -5.364 -19.124 290 HG22 VAL 18 1HG2 VAL 18 0.619 -5.760 -20.865 291 HG23 VAL 18 2HG2 VAL 18 0.980 -6.972 -19.600 292 H CYS 19 H CYS 19 5.367 -6.156 -19.370 293 HA CYS 19 HA CYS 19 6.714 -3.756 -20.493 294 HB2 CYS 19 1HB CYS 19 7.460 -5.692 -18.312 295 HB3 CYS 19 2HB CYS 19 8.587 -4.556 -19.003 296 H GLY 20 H GLY 20 6.833 -7.317 -20.907 297 HA2 GLY 20 1HA GLY 20 7.872 -8.235 -22.881 298 HA3 GLY 20 2HA GLY 20 9.013 -6.905 -22.870 299 H GLU 21 H GLU 21 10.730 -8.649 -22.835 300 HA GLU 21 HA GLU 21 10.837 -10.589 -20.694 301 HB2 GLU 21 1HB GLU 21 11.991 -10.454 -23.105 302 HB3 GLU 21 2HB GLU 21 13.364 -9.756 -22.216 303 HG2 GLU 21 1HG GLU 21 13.289 -11.706 -20.648 304 HG3 GLU 21 2HG GLU 21 12.091 -12.422 -21.723 305 H ARG 22 H ARG 22 11.533 -7.216 -20.672 306 HA ARG 22 HA ARG 22 13.115 -7.572 -18.127 307 HB2 ARG 22 1HB ARG 22 13.661 -5.583 -20.353 308 HB3 ARG 22 2HB ARG 22 14.372 -5.536 -18.712 309 HG2 ARG 22 1HG ARG 22 15.245 -7.849 -19.204 310 HG3 ARG 22 2HG ARG 22 14.792 -7.531 -20.932 311 HD2 ARG 22 1HD ARG 22 16.293 -5.495 -20.875 312 HD3 ARG 22 2HD ARG 22 16.636 -5.841 -19.152 313 HE ARG 22 HE ARG 22 17.101 -8.148 -20.774 314 HH11 ARG 22 1HH1 ARG 22 18.600 -5.126 -19.870 315 HH12 ARG 22 2HH1 ARG 22 20.232 -5.771 -20.062 316 HH21 ARG 22 1HH2 ARG 22 19.169 -8.904 -21.062 317 HH22 ARG 22 2HH2 ARG 22 20.494 -7.844 -20.719 318 H GLY 23 H GLY 23 12.595 -5.904 -16.613 319 HA2 GLY 23 1HA GLY 23 11.225 -3.614 -16.635 320 HA3 GLY 23 2HA GLY 23 9.959 -4.652 -17.280 321 H PHE 24 H PHE 24 11.487 -6.736 -15.264 322 HA PHE 24 HA PHE 24 10.628 -5.560 -12.728 323 HB2 PHE 24 1HB PHE 24 8.963 -7.173 -12.141 324 HB3 PHE 24 2HB PHE 24 8.521 -6.574 -13.766 325 HD1 PHE 24 HD1 PHE 24 9.003 -7.996 -15.811 326 HD2 PHE 24 HD2 PHE 24 9.424 -9.483 -11.746 327 HE1 PHE 24 HE1 PHE 24 8.929 -10.312 -16.636 328 HE2 PHE 24 HE2 PHE 24 9.278 -11.811 -12.640 329 HZ PHE 24 HZ PHE 24 9.115 -12.275 -15.118 330 H PHE 25 H PHE 25 11.225 -6.950 -10.874 331 HA PHE 25 HA PHE 25 12.944 -9.260 -11.601 332 HB2 PHE 25 1HB PHE 25 14.562 -7.427 -11.274 333 HB3 PHE 25 2HB PHE 25 13.881 -7.093 -9.676 334 HD1 PHE 25 HD1 PHE 25 14.503 -10.532 -11.063 335 HD2 PHE 25 HD2 PHE 25 15.723 -7.514 -8.258 336 HE1 PHE 25 HE1 PHE 25 16.004 -12.188 -10.029 337 HE2 PHE 25 HE2 PHE 25 17.301 -9.265 -7.151 338 HZ PHE 25 HZ PHE 25 17.418 -11.572 -8.082 339 H NVA 26 H ARX 26 11.812 -10.793 -10.883 340 HA NVA 26 HA ARX 26 11.081 -10.771 -7.986 341 HB2 NVA 26 1HB ARX 26 9.009 -10.875 -9.524 342 HB3 NVA 26 2HB ARX 26 9.617 -12.439 -10.089 343 HG2 NVA 26 1HG ARX 26 9.713 -13.106 -7.515 344 HG3 NVA 26 2HG ARX 26 8.688 -11.625 -7.230 345 HD2 NVA 26 1HD ARX 26 6.823 -12.603 -8.237 346 HD3 NVA 26 2HD ARX 26 7.739 -13.647 -9.320 347 H THR 27 H THR 27 12.252 -11.970 -6.730 348 HA THR 27 HA THR 27 14.271 -13.791 -7.729 349 HB THR 27 HB THR 27 14.439 -14.415 -5.280 350 HG1 THR 27 HG1 THR 27 13.096 -13.413 -3.894 351 HG21 THR 27 1HG2 THR 27 15.292 -12.269 -4.527 352 HG22 THR 27 2HG2 THR 27 14.364 -11.410 -5.771 353 HG23 THR 27 3HG2 THR 27 15.709 -12.501 -6.214 354 HA PRO 28 HA PRO 28 11.723 -17.292 -8.089 355 HB2 PRO 28 1HB PRO 28 13.560 -18.861 -6.357 356 HB3 PRO 28 2HB PRO 28 12.999 -19.277 -8.020 357 HG2 PRO 28 1HG PRO 28 15.541 -18.415 -7.641 358 HG3 PRO 28 2HG PRO 28 14.520 -17.813 -9.028 359 HD2 PRO 28 1HD PRO 28 15.148 -16.535 -6.349 360 HD3 PRO 28 2HD PRO 28 15.196 -15.820 -7.965 361 H HIX 29 H HIX 29 10.009 -17.925 -7.220 362 HA HIX 29 HA HIX 29 9.275 -17.281 -4.458 363 HB1 HIX 29 1HB HIX 29 7.679 -18.437 -6.814 364 HB2 HIX 29 2HB HIX 29 7.045 -17.989 -5.271 365 HD2 HIX 29 HD2 HIX 29 8.203 -16.079 -8.374 366 HD1 HIX 29 HD1 HIX 29 7.144 -15.473 -4.448 367 HE1 HIX 29 HE1 HIX 29 6.040 -13.900 -6.133 368 H THR 30 H THR 30 10.449 -18.663 -3.223 369 HA THR 30 HA THR 30 10.446 -21.589 -3.781 370 HB THR 30 HB THR 30 12.195 -21.562 -1.959 371 HG1 THR 30 HG1 THR 30 13.086 -19.421 -1.713 372 HG21 THR 30 1HG2 THR 30 12.613 -21.598 -4.490 373 HG22 THR 30 2HG2 THR 30 13.922 -20.939 -3.493 374 HG23 THR 30 3HG2 THR 30 12.833 -19.829 -4.373 Start of MODEL 17 1 H1 GLY 1 1H GLY 1 -1.098 0.888 0.376 2 H2 GLY 1 2H GLY 1 -1.863 1.042 -1.079 3 H3 GLY 1 3H GLY 1 -1.864 -0.348 -0.345 4 HA2 GLY 1 1HA GLY 1 0.509 1.007 -1.355 5 HA3 GLY 1 2HA GLY 1 0.500 -0.606 -0.566 6 H ILE 2 H ILE 2 1.279 0.188 -3.380 7 HA ILE 2 HA ILE 2 -0.782 -0.431 -5.204 8 HB ILE 2 HB ILE 2 1.348 0.809 -5.758 9 HG12 ILE 2 1HG1 ILE 2 0.760 -1.588 -7.531 10 HG13 ILE 2 2HG1 ILE 2 -0.250 -0.139 -7.458 11 HG21 ILE 2 1HG2 ILE 2 2.623 -1.988 -5.946 12 HG22 ILE 2 2HG2 ILE 2 3.414 -0.420 -6.356 13 HG23 ILE 2 3HG2 ILE 2 3.020 -0.804 -4.650 14 HD11 ILE 2 3HD1 ILE 2 2.590 -0.327 -8.534 15 HD12 ILE 2 1HD1 ILE 2 1.116 -0.083 -9.450 16 HD13 ILE 2 2HD1 ILE 2 1.677 1.181 -8.337 17 H VAL 3 H VAL 3 1.460 -2.758 -3.682 18 HA VAL 3 HA VAL 3 0.739 -4.855 -5.475 19 HB VAL 3 HB VAL 3 1.797 -5.057 -2.617 20 HG11 VAL 3 1HG1 VAL 3 0.795 -7.197 -3.491 21 HG12 VAL 3 2HG1 VAL 3 1.924 -7.114 -4.872 22 HG13 VAL 3 3HG1 VAL 3 2.597 -7.297 -3.236 23 HG21 VAL 3 3HG2 VAL 3 3.988 -5.467 -3.869 24 HG22 VAL 3 1HG2 VAL 3 3.159 -4.804 -5.287 25 HG23 VAL 3 2HG2 VAL 3 3.374 -3.789 -3.815 26 H GLU 4 H GLU 4 -0.500 -3.784 -2.280 27 HA GLU 4 HA GLU 4 -2.205 -6.076 -2.062 28 HB2 GLU 4 1HB GLU 4 -1.329 -4.444 -0.314 29 HB3 GLU 4 2HB GLU 4 -2.678 -3.394 -0.799 30 HG2 GLU 4 1HG GLU 4 -3.212 -6.281 -0.133 31 HG3 GLU 4 2HG GLU 4 -2.860 -5.179 1.190 32 H GLN 5 H GLN 5 -2.491 -2.916 -3.569 33 HA GLN 5 HA GLN 5 -5.302 -2.995 -4.011 34 HB2 GLN 5 1HB GLN 5 -3.761 -1.019 -3.964 35 HB3 GLN 5 2HB GLN 5 -3.132 -1.509 -5.542 36 HG2 GLN 5 1HG GLN 5 -5.365 -1.193 -6.523 37 HG3 GLN 5 2HG GLN 5 -6.026 -0.814 -4.906 38 HE21 GLN 5 2HE2 GLN 5 -6.766 1.109 -6.306 39 HE22 GLN 5 1HE2 GLN 5 -5.638 2.504 -6.223 40 H CYS 6 H CYS 6 -2.456 -3.848 -5.947 41 HA CYS 6 HA CYS 6 -3.811 -4.431 -8.328 42 HB2 CYS 6 1HB CYS 6 -1.382 -4.017 -8.010 43 HB3 CYS 6 2HB CYS 6 -1.281 -5.613 -7.250 44 H CYS 7 H CYS 7 -3.231 -6.268 -5.385 45 HA CYS 7 HA CYS 7 -4.030 -8.827 -6.509 46 HB2 CYS 7 1HB CYS 7 -2.677 -8.793 -4.527 47 HB3 CYS 7 2HB CYS 7 -3.799 -7.749 -3.671 48 H THR 8 H THR 8 -5.618 -6.472 -4.191 49 HA THR 8 HA THR 8 -7.934 -8.138 -4.125 50 HB THR 8 HB THR 8 -8.809 -6.303 -2.665 51 HG1 THR 8 HG1 THR 8 -6.289 -5.049 -3.002 52 HG21 THR 8 1HG2 THR 8 -5.904 -7.188 -2.128 53 HG22 THR 8 2HG2 THR 8 -7.337 -8.142 -1.767 54 HG23 THR 8 3HG2 THR 8 -7.035 -6.647 -0.917 55 H SER 9 H SER 9 -7.225 -6.563 -6.706 56 HA SER 9 HA SER 9 -9.999 -6.036 -7.417 57 HB2 SER 9 1HB SER 9 -7.868 -3.928 -7.507 58 HB3 SER 9 2HB SER 9 -9.393 -3.744 -8.378 59 HG SER 9 HG SER 9 -9.094 -4.144 -5.509 60 H ILE 10 H ILE 10 -10.055 -5.251 -9.803 61 HA ILE 10 HA ILE 10 -8.361 -6.910 -11.498 62 HB ILE 10 HB ILE 10 -10.237 -4.534 -12.129 63 HG12 ILE 10 1HG1 ILE 10 -11.398 -6.560 -11.344 64 HG13 ILE 10 2HG1 ILE 10 -11.813 -6.146 -13.028 65 HG21 ILE 10 1HG2 ILE 10 -8.545 -6.215 -14.024 66 HG22 ILE 10 2HG2 ILE 10 -10.048 -5.421 -14.561 67 HG23 ILE 10 3HG2 ILE 10 -8.710 -4.454 -13.920 68 HD11 ILE 10 3HD1 ILE 10 -9.800 -8.334 -12.297 69 HD12 ILE 10 1HD1 ILE 10 -11.515 -8.602 -12.727 70 HD13 ILE 10 2HD1 ILE 10 -10.375 -7.919 -13.911 71 H CYS 11 H CYS 11 -6.300 -6.435 -11.840 72 HA CYS 11 HA CYS 11 -5.249 -3.896 -10.838 73 HB2 CYS 11 1HB CYS 11 -4.129 -6.233 -10.787 74 HB3 CYS 11 2HB CYS 11 -3.659 -5.898 -12.471 75 H SER 12 H SER 12 -5.086 -2.038 -11.964 76 HA SER 12 HA SER 12 -6.032 -2.072 -14.689 77 HB2 SER 12 1HB SER 12 -4.728 0.277 -13.289 78 HB3 SER 12 2HB SER 12 -6.018 0.325 -14.496 79 HG SER 12 HG SER 12 -7.412 -0.752 -12.879 80 H LEU 13 H LEU 13 -4.973 -1.320 -16.541 81 HA LEU 13 HA LEU 13 -2.448 -2.490 -16.911 82 HB2 LEU 13 1HB LEU 13 -4.145 -1.905 -18.597 83 HB3 LEU 13 2HB LEU 13 -3.657 -0.220 -18.486 84 HG LEU 13 HG LEU 13 -1.449 -0.725 -19.328 85 HD11 LEU 13 1HD1 LEU 13 -1.107 -2.916 -18.586 86 HD12 LEU 13 2HD1 LEU 13 -1.022 -2.920 -20.344 87 HD13 LEU 13 3HD1 LEU 13 -2.484 -3.525 -19.515 88 HD21 LEU 13 3HD2 LEU 13 -2.050 -1.039 -21.583 89 HD22 LEU 13 1HD2 LEU 13 -3.311 -0.082 -20.774 90 HD23 LEU 13 2HD2 LEU 13 -3.579 -1.831 -21.121 91 H TYR 14 H TYR 14 -3.207 0.956 -16.177 92 HA TYR 14 HA TYR 14 -0.453 1.773 -16.579 93 HB2 TYR 14 1HB TYR 14 -1.163 3.807 -15.304 94 HB3 TYR 14 2HB TYR 14 -2.091 3.498 -16.779 95 HD1 TYR 14 HD1 TYR 14 -4.428 2.797 -16.714 96 HD2 TYR 14 HD2 TYR 14 -2.282 3.611 -13.096 97 HE1 TYR 14 HE1 TYR 14 -6.602 3.004 -15.463 98 HE2 TYR 14 HE2 TYR 14 -4.502 3.774 -11.868 99 HH TYR 14 HH TYR 14 -6.769 3.533 -11.964 100 H GLN 15 H GLN 15 -2.256 0.342 -13.909 101 HA GLN 15 HA GLN 15 -0.255 1.017 -11.847 102 HB2 GLN 15 1HB GLN 15 -2.389 -1.174 -11.989 103 HB3 GLN 15 2HB GLN 15 -1.369 -0.841 -10.566 104 HG2 GLN 15 1HG GLN 15 -2.332 1.446 -10.484 105 HG3 GLN 15 2HG GLN 15 -3.328 1.012 -11.873 106 HE21 GLN 15 2HE2 GLN 15 -3.840 1.686 -8.891 107 HE22 GLN 15 1HE2 GLN 15 -5.082 0.471 -8.435 108 H LEU 16 H LEU 16 -1.013 -1.699 -14.041 109 HA LEU 16 HA LEU 16 1.022 -3.472 -13.240 110 HB2 LEU 16 1HB LEU 16 -0.996 -3.866 -14.673 111 HB3 LEU 16 2HB LEU 16 -0.146 -3.033 -15.974 112 HG LEU 16 HG LEU 16 0.594 -5.680 -14.721 113 HD11 LEU 16 1HD1 LEU 16 -0.852 -4.746 -17.213 114 HD12 LEU 16 2HD1 LEU 16 -1.419 -5.847 -15.937 115 HD13 LEU 16 3HD1 LEU 16 -0.159 -6.386 -17.103 116 HD21 LEU 16 3HD2 LEU 16 2.064 -6.036 -16.707 117 HD22 LEU 16 1HD2 LEU 16 2.684 -4.805 -15.602 118 HD23 LEU 16 2HD2 LEU 16 1.865 -4.318 -17.104 119 H GLU 17 H GLU 17 0.888 -1.022 -15.859 120 HA GLU 17 HA GLU 17 3.627 -1.257 -16.646 121 HB2 GLU 17 1HB GLU 17 1.679 1.010 -16.721 122 HB3 GLU 17 2HB GLU 17 3.317 1.162 -17.330 123 HG2 GLU 17 1HG GLU 17 2.865 -0.729 -18.884 124 HG3 GLU 17 2HG GLU 17 1.199 -0.737 -18.321 125 H ASN 18 H ASN 18 2.270 0.466 -13.795 126 HA ASN 18 HA ASN 18 4.641 2.108 -13.437 127 HB2 ASN 18 1HB ASN 18 2.157 1.953 -12.262 128 HB3 ASN 18 2HB ASN 18 3.095 1.137 -11.030 129 HD21 ASN 18 2HD2 ASN 18 1.773 3.725 -10.817 130 HD22 ASN 18 1HD2 ASN 18 3.041 4.893 -10.483 131 H TYR 19 H TYR 19 4.083 -1.319 -12.937 132 HA TYR 19 HA TYR 19 6.302 -1.677 -10.976 133 HB2 TYR 19 1HB TYR 19 4.876 -3.630 -12.754 134 HB3 TYR 19 2HB TYR 19 6.108 -4.076 -11.592 135 HD1 TYR 19 HD2 TYR 19 5.517 -2.896 -9.116 136 HD2 TYR 19 HD1 TYR 19 2.723 -4.242 -12.088 137 HE1 TYR 19 HE2 TYR 19 3.815 -3.129 -7.372 138 HE2 TYR 19 HE1 TYR 19 0.971 -4.458 -10.371 139 HH TYR 19 HH TYR 19 1.677 -3.771 -6.871 140 H CYS 20 H CYS 20 5.851 -1.095 -14.281 141 HA CYS 20 HA CYS 20 8.313 -2.480 -15.073 142 HB2 CYS 20 1HB CYS 20 6.227 -2.780 -16.389 143 HB3 CYS 20 2HB CYS 20 6.156 -1.034 -16.662 144 H ASN 21 H ASN 21 7.622 0.251 -13.620 145 HA ASN 21 HA ASN 21 8.523 2.277 -13.230 146 HB2 ASN 21 1HB ASN 21 10.925 2.248 -13.108 147 HB3 ASN 21 2HB ASN 21 10.349 0.612 -12.672 148 HD21 ASN 21 2HD2 ASN 21 10.946 -1.072 -13.820 149 HD22 ASN 21 1HD2 ASN 21 12.084 -0.982 -15.117 150 H1 PHE 1 1H PHE 1 -3.137 -8.268 -23.250 151 H2 PHE 1 2H PHE 1 -1.428 -8.504 -23.206 152 H3 PHE 1 3H PHE 1 -2.441 -9.799 -23.215 153 HA PHE 1 HA PHE 1 -1.524 -9.443 -21.080 154 HB2 PHE 1 1HB PHE 1 -1.436 -7.029 -21.028 155 HB3 PHE 1 2HB PHE 1 -3.125 -6.861 -21.431 156 HD1 PHE 1 HD1 PHE 1 -1.475 -9.037 -18.855 157 HD2 PHE 1 HD2 PHE 1 -4.062 -5.635 -19.650 158 HE1 PHE 1 HE1 PHE 1 -2.153 -8.973 -16.527 159 HE2 PHE 1 HE2 PHE 1 -4.670 -5.516 -17.330 160 HZ PHE 1 HZ PHE 1 -3.786 -7.205 -15.690 161 H VAL 2 H VAL 2 -4.894 -8.288 -21.699 162 HA VAL 2 HA VAL 2 -6.937 -9.238 -21.290 163 HB VAL 2 HB VAL 2 -5.560 -11.827 -20.304 164 HG11 VAL 2 1HG1 VAL 2 -7.754 -11.538 -19.335 165 HG12 VAL 2 2HG1 VAL 2 -8.466 -11.231 -20.937 166 HG13 VAL 2 3HG1 VAL 2 -7.796 -12.821 -20.546 167 HG21 VAL 2 3HG2 VAL 2 -6.193 -12.807 -22.447 168 HG22 VAL 2 1HG2 VAL 2 -6.870 -11.234 -22.981 169 HG23 VAL 2 2HG2 VAL 2 -5.133 -11.412 -22.694 170 H ASN 3 H ASN 3 -8.057 -8.445 -19.660 171 HA ASN 3 HA ASN 3 -6.573 -7.588 -17.331 172 HB2 ASN 3 1HB ASN 3 -8.473 -6.307 -16.806 173 HB3 ASN 3 2HB ASN 3 -8.524 -6.370 -18.584 174 HD21 ASN 3 2HD2 ASN 3 -10.142 -7.629 -19.591 175 HD22 ASN 3 1HD2 ASN 3 -11.555 -8.161 -18.693 176 H GLN 4 H GLN 4 -6.726 -8.258 -15.196 177 HA GLN 4 HA GLN 4 -8.616 -10.324 -14.428 178 HB2 GLN 4 1HB GLN 4 -6.394 -11.214 -15.695 179 HB3 GLN 4 2HB GLN 4 -5.718 -11.051 -14.075 180 HG2 GLN 4 1HG GLN 4 -6.440 -13.328 -14.224 181 HG3 GLN 4 2HG GLN 4 -7.726 -12.568 -13.301 182 HE21 GLN 4 2HE2 GLN 4 -9.790 -12.660 -14.061 183 HE22 GLN 4 1HE2 GLN 4 -10.228 -13.359 -15.608 184 H HIS 5 H HIS 5 -7.918 -10.888 -11.991 185 HA HIS 5 HA HIS 5 -6.838 -8.580 -10.523 186 HB2 HIS 5 1HB HIS 5 -7.767 -11.403 -9.657 187 HB3 HIS 5 2HB HIS 5 -6.874 -10.296 -8.596 188 HD1 HIS 5 HD1 HIS 5 -9.976 -9.578 -10.846 189 HD2 HIS 5 HD2 HIS 5 -8.727 -9.336 -6.905 190 HE1 HIS 5 HE1 HIS 5 -11.850 -8.443 -9.539 191 H LEU 6 H LEU 6 -4.678 -8.651 -9.769 192 HA LEU 6 HA LEU 6 -3.174 -11.015 -10.737 193 HB2 LEU 6 1HB LEU 6 -2.215 -8.144 -10.507 194 HB3 LEU 6 2HB LEU 6 -1.180 -9.502 -11.021 195 HG LEU 6 HG LEU 6 -3.623 -8.441 -12.478 196 HD11 LEU 6 1HD1 LEU 6 -0.653 -8.353 -13.024 197 HD12 LEU 6 2HD1 LEU 6 -1.732 -6.989 -12.689 198 HD13 LEU 6 3HD1 LEU 6 -1.879 -7.898 -14.207 199 HD21 LEU 6 3HD2 LEU 6 -3.507 -10.856 -12.780 200 HD22 LEU 6 1HD2 LEU 6 -1.767 -10.748 -13.185 201 HD23 LEU 6 2HD2 LEU 6 -2.998 -10.071 -14.269 202 H CYS 7 H CYS 7 -3.498 -12.121 -8.828 203 HA CYS 7 HA CYS 7 -1.713 -11.092 -6.645 204 HB2 CYS 7 1HB CYS 7 -4.311 -10.994 -6.304 205 HB3 CYS 7 2HB CYS 7 -4.204 -12.731 -6.083 206 H GLY 8 H GLY 8 -0.246 -12.568 -8.214 207 HA2 GLY 8 1HA GLY 8 0.625 -14.746 -6.698 208 HA3 GLY 8 2HA GLY 8 -0.609 -15.443 -7.765 209 H SER 9 H SER 9 1.152 -16.696 -8.967 210 HA SER 9 HA SER 9 3.311 -15.435 -10.317 211 HB2 SER 9 1HB SER 9 2.936 -17.930 -10.029 212 HB3 SER 9 2HB SER 9 1.801 -17.875 -11.344 213 HG SER 9 HG SER 9 3.446 -17.009 -12.677 214 H HIS 10 H HIS 10 -0.017 -15.107 -10.979 215 HA HIS 10 HA HIS 10 -0.016 -14.815 -13.798 216 HB2 HIS 10 1HB HIS 10 -1.724 -13.599 -11.574 217 HB3 HIS 10 2HB HIS 10 -2.112 -13.437 -13.307 218 HD1 HIS 10 HD1 HIS 10 -3.552 -15.194 -10.798 219 HD2 HIS 10 HD2 HIS 10 -1.768 -16.427 -14.301 220 HE1 HIS 10 HE1 HIS 10 -4.454 -17.540 -11.277 221 H LEU 11 H LEU 11 0.982 -12.780 -11.122 222 HA LEU 11 HA LEU 11 1.024 -10.272 -12.538 223 HB2 LEU 11 1HB LEU 11 1.235 -10.493 -10.111 224 HB3 LEU 11 2HB LEU 11 2.798 -11.290 -10.311 225 HG LEU 11 HG LEU 11 3.764 -9.248 -11.204 226 HD11 LEU 11 1HD1 LEU 11 1.795 -8.256 -12.346 227 HD12 LEU 11 2HD1 LEU 11 2.593 -7.122 -11.241 228 HD13 LEU 11 3HD1 LEU 11 1.052 -7.911 -10.748 229 HD21 LEU 11 3HD2 LEU 11 3.712 -8.057 -9.145 230 HD22 LEU 11 1HD2 LEU 11 3.614 -9.798 -8.808 231 HD23 LEU 11 2HD2 LEU 11 2.144 -8.759 -8.690 232 H VAL 12 H VAL 12 3.420 -12.942 -12.279 233 HA VAL 12 HA VAL 12 5.521 -11.473 -13.521 234 HB VAL 12 HB VAL 12 5.100 -14.467 -13.363 235 HG11 VAL 12 1HG1 VAL 12 6.778 -13.850 -15.037 236 HG12 VAL 12 2HG1 VAL 12 7.632 -12.811 -13.853 237 HG13 VAL 12 3HG1 VAL 12 7.569 -14.576 -13.616 238 HG21 VAL 12 3HG2 VAL 12 5.074 -13.713 -11.116 239 HG22 VAL 12 1HG2 VAL 12 6.693 -14.354 -11.422 240 HG23 VAL 12 2HG2 VAL 12 6.450 -12.580 -11.405 241 H GLU 13 H GLU 13 2.963 -13.713 -14.660 242 HA GLU 13 HA GLU 13 3.758 -13.759 -17.424 243 HB2 GLU 13 1HB GLU 13 1.047 -14.130 -15.955 244 HB3 GLU 13 2HB GLU 13 1.211 -14.358 -17.711 245 HG2 GLU 13 1HG GLU 13 2.978 -16.092 -17.324 246 HG3 GLU 13 2HG GLU 13 2.721 -15.928 -15.586 247 H ALA 14 H ALA 14 1.590 -11.574 -15.565 248 HA ALA 14 HA ALA 14 0.581 -10.113 -17.749 249 HB1 ALA 14 3HB ALA 14 0.045 -8.379 -16.107 250 HB2 ALA 14 1HB ALA 14 -0.217 -9.991 -15.410 251 HB3 ALA 14 2HB ALA 14 1.236 -9.096 -14.991 252 H LEU 15 H LEU 15 3.479 -9.574 -15.693 253 HA LEU 15 HA LEU 15 4.222 -7.192 -17.099 254 HB2 LEU 15 1HB LEU 15 5.505 -8.982 -15.122 255 HB3 LEU 15 2HB LEU 15 6.478 -7.786 -15.951 256 HG LEU 15 HG LEU 15 3.892 -6.995 -14.592 257 HD11 LEU 15 1HD1 LEU 15 4.905 -6.655 -12.483 258 HD12 LEU 15 2HD1 LEU 15 6.553 -7.013 -13.076 259 HD13 LEU 15 3HD1 LEU 15 5.344 -8.293 -12.930 260 HD21 LEU 15 3HD2 LEU 15 5.069 -4.859 -14.443 261 HD22 LEU 15 1HD2 LEU 15 5.073 -5.454 -16.095 262 HD23 LEU 15 2HD2 LEU 15 6.552 -5.588 -15.132 263 H TYR 16 H TYR 16 4.951 -10.618 -17.514 264 HA TYR 16 HA TYR 16 7.018 -10.373 -19.456 265 HB2 TYR 16 1HB TYR 16 6.471 -12.424 -18.241 266 HB3 TYR 16 2HB TYR 16 4.923 -12.547 -19.104 267 HD1 TYR 16 HD1 TYR 16 4.975 -12.985 -21.593 268 HD2 TYR 16 HD2 TYR 16 8.519 -13.067 -19.207 269 HE1 TYR 16 HE1 TYR 16 6.187 -14.285 -23.407 270 HE2 TYR 16 HE2 TYR 16 9.739 -14.329 -20.988 271 HH TYR 16 HH TYR 16 8.233 -15.187 -24.060 272 H LEU 17 H LEU 17 3.421 -10.508 -19.772 273 HA LEU 17 HA LEU 17 3.687 -10.391 -22.618 274 HB2 LEU 17 1HB LEU 17 1.315 -9.880 -20.815 275 HB3 LEU 17 2HB LEU 17 1.220 -9.910 -22.593 276 HG LEU 17 HG LEU 17 2.119 -12.268 -20.863 277 HD11 LEU 17 1HD1 LEU 17 -0.214 -13.102 -21.660 278 HD12 LEU 17 2HD1 LEU 17 -0.550 -11.395 -21.924 279 HD13 LEU 17 3HD1 LEU 17 -0.122 -11.979 -20.303 280 HD21 LEU 17 3HD2 LEU 17 1.215 -12.284 -23.766 281 HD22 LEU 17 1HD2 LEU 17 1.943 -13.624 -22.860 282 HD23 LEU 17 2HD2 LEU 17 2.905 -12.213 -23.285 283 H VAL 18 H VAL 18 3.189 -7.904 -20.114 284 HA VAL 18 HA VAL 18 2.343 -5.979 -22.154 285 HB VAL 18 HB VAL 18 2.957 -5.708 -19.154 286 HG11 VAL 18 1HG1 VAL 18 3.208 -3.458 -20.445 287 HG12 VAL 18 2HG1 VAL 18 1.495 -3.633 -20.940 288 HG13 VAL 18 3HG1 VAL 18 1.937 -3.470 -19.217 289 HG21 VAL 18 3HG2 VAL 18 0.416 -5.432 -19.187 290 HG22 VAL 18 1HG2 VAL 18 0.484 -5.962 -20.894 291 HG23 VAL 18 2HG2 VAL 18 1.007 -7.047 -19.592 292 H CYS 19 H CYS 19 5.306 -6.554 -20.252 293 HA CYS 19 HA CYS 19 6.599 -4.306 -21.721 294 HB2 CYS 19 1HB CYS 19 6.873 -5.334 -18.921 295 HB3 CYS 19 2HB CYS 19 8.265 -4.537 -19.672 296 H GLY 20 H GLY 20 6.623 -7.702 -21.955 297 HA2 GLY 20 1HA GLY 20 8.078 -9.162 -22.981 298 HA3 GLY 20 2HA GLY 20 8.762 -7.754 -23.754 299 H GLU 21 H GLU 21 8.723 -8.615 -20.350 300 HA GLU 21 HA GLU 21 10.308 -9.213 -18.850 301 HB2 GLU 21 1HB GLU 21 12.268 -9.673 -21.132 302 HB3 GLU 21 2HB GLU 21 12.477 -10.197 -19.469 303 HG2 GLU 21 1HG GLU 21 10.640 -11.721 -19.553 304 HG3 GLU 21 2HG GLU 21 10.153 -11.153 -21.174 305 H ARG 22 H ARG 22 10.467 -6.455 -20.521 306 HA ARG 22 HA ARG 22 13.037 -5.483 -19.513 307 HB2 ARG 22 1HB ARG 22 10.764 -3.930 -20.770 308 HB3 ARG 22 2HB ARG 22 12.360 -3.360 -20.503 309 HG2 ARG 22 1HG ARG 22 13.339 -4.975 -22.038 310 HG3 ARG 22 2HG ARG 22 11.784 -5.757 -22.301 311 HD2 ARG 22 1HD ARG 22 10.944 -3.696 -23.300 312 HD3 ARG 22 2HD ARG 22 12.518 -2.913 -23.041 313 HE ARG 22 HE ARG 22 12.951 -5.337 -24.508 314 HH11 ARG 22 1HH1 ARG 22 11.225 -2.331 -24.998 315 HH12 ARG 22 2HH1 ARG 22 11.369 -2.283 -26.750 316 HH21 ARG 22 1HH2 ARG 22 13.220 -5.291 -26.795 317 HH22 ARG 22 2HH2 ARG 22 12.550 -4.002 -27.731 318 H GLY 23 H GLY 23 10.036 -6.069 -18.100 319 HA2 GLY 23 1HA GLY 23 10.112 -3.657 -16.403 320 HA3 GLY 23 2HA GLY 23 8.699 -4.621 -16.815 321 H PHE 24 H PHE 24 11.081 -6.854 -16.109 322 HA PHE 24 HA PHE 24 10.854 -6.673 -13.168 323 HB2 PHE 24 1HB PHE 24 9.695 -8.696 -12.833 324 HB3 PHE 24 2HB PHE 24 8.676 -7.661 -13.902 325 HD1 PHE 24 HD2 PHE 24 8.505 -8.226 -16.314 326 HD2 PHE 24 HD1 PHE 24 10.555 -10.788 -13.631 327 HE1 PHE 24 HE2 PHE 24 8.324 -10.119 -17.978 328 HE2 PHE 24 HE1 PHE 24 10.451 -12.684 -15.203 329 HZ PHE 24 HZ PHE 24 9.305 -12.305 -17.419 330 H PHE 25 H PHE 25 12.048 -8.445 -12.194 331 HA PHE 25 HA PHE 25 14.321 -9.122 -13.964 332 HB2 PHE 25 1HB PHE 25 14.947 -7.964 -11.948 333 HB3 PHE 25 2HB PHE 25 14.049 -9.136 -10.974 334 HD1 PHE 25 HD1 PHE 25 16.944 -8.801 -13.257 335 HD2 PHE 25 HD2 PHE 25 15.065 -11.126 -10.090 336 HE1 PHE 25 HE1 PHE 25 18.965 -10.288 -13.193 337 HE2 PHE 25 HE2 PHE 25 17.046 -12.622 -10.045 338 HZ PHE 25 HZ PHE 25 18.964 -12.246 -11.636 339 H NVA 26 H ARX 26 12.494 -10.506 -11.169 340 HA NVA 26 HA ARX 26 11.857 -12.482 -10.409 341 HB2 NVA 26 1HB ARX 26 10.240 -12.476 -12.239 342 HB3 NVA 26 2HB ARX 26 11.383 -13.253 -13.337 343 HG2 NVA 26 1HG ARX 26 9.957 -15.072 -12.547 344 HG3 NVA 26 2HG ARX 26 11.519 -15.236 -11.796 345 HD2 NVA 26 1HD ARX 26 10.542 -13.947 -9.678 346 HD3 NVA 26 2HD ARX 26 8.888 -14.195 -10.441 347 H THR 27 H THR 27 12.878 -13.792 -9.255 348 HA THR 27 HA THR 27 15.545 -14.758 -9.846 349 HB THR 27 HB THR 27 14.875 -16.175 -7.755 350 HG1 THR 27 HG1 THR 27 12.583 -15.871 -8.079 351 HG21 THR 27 1HG2 THR 27 16.198 -14.099 -7.681 352 HG22 THR 27 2HG2 THR 27 15.188 -14.382 -6.259 353 HG23 THR 27 3HG2 THR 27 14.702 -13.169 -7.467 354 HA PRO 28 HA PRO 28 14.224 -18.494 -11.768 355 HB2 PRO 28 1HB PRO 28 15.871 -20.490 -10.818 356 HB3 PRO 28 2HB PRO 28 16.438 -19.236 -11.974 357 HG2 PRO 28 1HG PRO 28 16.723 -19.355 -9.015 358 HG3 PRO 28 2HG PRO 28 17.988 -19.010 -10.226 359 HD2 PRO 28 1HD PRO 28 16.742 -17.023 -8.825 360 HD3 PRO 28 2HD PRO 28 17.245 -16.846 -10.533 361 H HIX 29 H HIX 29 12.366 -19.159 -11.205 362 HA HIX 29 HA HIX 29 11.759 -19.997 -8.471 363 HB1 HIX 29 1HB HIX 29 9.926 -19.893 -10.830 364 HB2 HIX 29 2HB HIX 29 9.367 -20.141 -9.159 365 HD2 HIX 29 HD2 HIX 29 9.858 -17.208 -11.495 366 HD1 HIX 29 HD1 HIX 29 10.471 -17.938 -7.539 367 HE1 HIX 29 HE1 HIX 29 8.937 -15.978 -8.177 368 H THR 30 H THR 30 13.044 -21.711 -8.133 369 HA THR 30 HA THR 30 11.856 -24.333 -8.963 370 HB THR 30 HB THR 30 13.768 -23.902 -10.507 371 HG1 THR 30 HG1 THR 30 13.621 -25.892 -8.557 372 HG21 THR 30 1HG2 THR 30 15.441 -23.787 -7.950 373 HG22 THR 30 2HG2 THR 30 15.144 -22.408 -9.047 374 HG23 THR 30 3HG2 THR 30 16.062 -23.804 -9.628 Start of MODEL 18 1 H1 GLY 1 1H GLY 1 -0.533 -0.013 -1.467 2 H2 GLY 1 2H GLY 1 0.388 1.310 -1.252 3 H3 GLY 1 3H GLY 1 -0.689 1.326 -2.513 4 HA2 GLY 1 1HA GLY 1 1.595 0.952 -3.243 5 HA3 GLY 1 2HA GLY 1 1.578 -0.479 -2.182 6 H ILE 2 H ILE 2 1.920 -0.388 -5.141 7 HA ILE 2 HA ILE 2 -0.480 -0.818 -6.479 8 HB ILE 2 HB ILE 2 2.332 -1.704 -7.243 9 HG12 ILE 2 1HG1 ILE 2 0.961 0.896 -8.030 10 HG13 ILE 2 2HG1 ILE 2 2.118 0.815 -6.703 11 HG21 ILE 2 1HG2 ILE 2 0.794 -2.791 -8.740 12 HG22 ILE 2 2HG2 ILE 2 -0.236 -1.322 -8.884 13 HG23 ILE 2 3HG2 ILE 2 1.381 -1.380 -9.633 14 HD11 ILE 2 3HD1 ILE 2 2.664 0.453 -9.701 15 HD12 ILE 2 1HD1 ILE 2 3.445 1.583 -8.571 16 HD13 ILE 2 2HD1 ILE 2 3.813 -0.153 -8.531 17 H VAL 3 H VAL 3 1.661 -3.058 -4.780 18 HA VAL 3 HA VAL 3 0.839 -5.386 -6.190 19 HB VAL 3 HB VAL 3 1.657 -5.489 -3.264 20 HG11 VAL 3 1HG1 VAL 3 2.838 -7.473 -3.931 21 HG12 VAL 3 2HG1 VAL 3 1.157 -7.566 -4.523 22 HG13 VAL 3 3HG1 VAL 3 2.487 -7.146 -5.669 23 HG21 VAL 3 3HG2 VAL 3 3.478 -4.792 -5.617 24 HG22 VAL 3 1HG2 VAL 3 3.193 -3.817 -4.134 25 HG23 VAL 3 2HG2 VAL 3 4.072 -5.328 -4.030 26 H GLU 4 H GLU 4 -0.384 -3.816 -3.236 27 HA GLU 4 HA GLU 4 -2.377 -5.755 -2.581 28 HB2 GLU 4 1HB GLU 4 -1.576 -3.708 -1.172 29 HB3 GLU 4 2HB GLU 4 -2.622 -2.732 -2.210 30 HG2 GLU 4 1HG GLU 4 -3.975 -3.189 -0.346 31 HG3 GLU 4 2HG GLU 4 -4.503 -4.418 -1.530 32 H GLN 5 H GLN 5 -2.393 -2.830 -4.614 33 HA GLN 5 HA GLN 5 -5.160 -2.949 -5.366 34 HB2 GLN 5 1HB GLN 5 -2.724 -1.669 -6.699 35 HB3 GLN 5 2HB GLN 5 -4.354 -1.460 -7.295 36 HG2 GLN 5 1HG GLN 5 -5.010 -0.655 -5.022 37 HG3 GLN 5 2HG GLN 5 -3.302 -0.638 -4.538 38 HE21 GLN 5 2HE2 GLN 5 -5.850 1.081 -6.021 39 HE22 GLN 5 1HE2 GLN 5 -4.896 2.393 -6.637 40 H CYS 6 H CYS 6 -2.281 -4.556 -6.683 41 HA CYS 6 HA CYS 6 -3.717 -5.477 -9.070 42 HB2 CYS 6 1HB CYS 6 -1.221 -5.040 -8.844 43 HB3 CYS 6 2HB CYS 6 -1.137 -6.523 -7.870 44 H CYS 7 H CYS 7 -3.060 -6.653 -5.842 45 HA CYS 7 HA CYS 7 -3.856 -9.404 -6.435 46 HB2 CYS 7 1HB CYS 7 -2.957 -7.853 -3.976 47 HB3 CYS 7 2HB CYS 7 -3.801 -9.402 -3.741 48 H THR 8 H THR 8 -4.972 -7.204 -3.916 49 HA THR 8 HA THR 8 -7.527 -8.649 -3.707 50 HB THR 8 HB THR 8 -6.973 -6.084 -2.259 51 HG1 THR 8 HG1 THR 8 -5.146 -6.901 -1.293 52 HG21 THR 8 1HG2 THR 8 -7.537 -7.506 -0.270 53 HG22 THR 8 2HG2 THR 8 -7.642 -8.912 -1.318 54 HG23 THR 8 3HG2 THR 8 -8.808 -7.585 -1.536 55 H SER 9 H SER 9 -6.940 -6.940 -6.190 56 HA SER 9 HA SER 9 -9.689 -5.934 -6.432 57 HB2 SER 9 1HB SER 9 -8.300 -4.054 -5.224 58 HB3 SER 9 2HB SER 9 -7.472 -3.820 -6.785 59 HG SER 9 HG SER 9 -10.175 -3.388 -6.005 60 H ILE 10 H ILE 10 -9.415 -4.277 -8.603 61 HA ILE 10 HA ILE 10 -8.591 -6.138 -10.682 62 HB ILE 10 HB ILE 10 -9.716 -3.336 -10.869 63 HG12 ILE 10 1HG1 ILE 10 -11.170 -4.932 -9.734 64 HG13 ILE 10 2HG1 ILE 10 -11.884 -4.409 -11.278 65 HG21 ILE 10 1HG2 ILE 10 -8.559 -3.926 -12.935 66 HG22 ILE 10 2HG2 ILE 10 -9.290 -5.529 -12.949 67 HG23 ILE 10 3HG2 ILE 10 -10.297 -4.109 -13.233 68 HD11 ILE 10 3HD1 ILE 10 -10.493 -7.115 -10.866 69 HD12 ILE 10 1HD1 ILE 10 -12.238 -6.836 -10.792 70 HD13 ILE 10 2HD1 ILE 10 -11.359 -6.594 -12.316 71 H CYS 11 H CYS 11 -6.478 -6.362 -10.850 72 HA CYS 11 HA CYS 11 -4.555 -4.291 -10.809 73 HB2 CYS 11 1HB CYS 11 -4.226 -6.891 -10.739 74 HB3 CYS 11 2HB CYS 11 -4.349 -6.807 -12.498 75 H SER 12 H SER 12 -4.675 -2.606 -12.163 76 HA SER 12 HA SER 12 -5.948 -2.916 -14.829 77 HB2 SER 12 1HB SER 12 -5.045 -0.482 -13.283 78 HB3 SER 12 2HB SER 12 -6.054 -0.460 -14.764 79 HG SER 12 HG SER 12 -6.864 -1.911 -12.454 80 H LEU 13 H LEU 13 -4.963 -1.863 -16.736 81 HA LEU 13 HA LEU 13 -2.338 -2.740 -17.212 82 HB2 LEU 13 1HB LEU 13 -3.916 -2.323 -18.987 83 HB3 LEU 13 2HB LEU 13 -3.963 -0.620 -18.596 84 HG LEU 13 HG LEU 13 -1.505 -0.478 -19.277 85 HD11 LEU 13 1HD1 LEU 13 -2.034 -3.170 -20.545 86 HD12 LEU 13 2HD1 LEU 13 -1.029 -2.914 -19.123 87 HD13 LEU 13 3HD1 LEU 13 -0.588 -2.181 -20.654 88 HD21 LEU 13 3HD2 LEU 13 -2.068 -0.584 -21.744 89 HD22 LEU 13 1HD2 LEU 13 -3.011 0.496 -20.730 90 HD23 LEU 13 2HD2 LEU 13 -3.704 -1.086 -21.259 91 H TYR 14 H TYR 14 -3.372 0.588 -16.362 92 HA TYR 14 HA TYR 14 -0.741 1.710 -16.825 93 HB2 TYR 14 1HB TYR 14 -1.828 3.519 -15.311 94 HB3 TYR 14 2HB TYR 14 -2.421 3.317 -16.968 95 HD1 TYR 14 HD2 TYR 14 -3.317 2.838 -13.393 96 HD2 TYR 14 HD1 TYR 14 -4.599 2.363 -17.495 97 HE1 TYR 14 HE2 TYR 14 -5.703 2.485 -12.664 98 HE2 TYR 14 HE1 TYR 14 -7.032 1.981 -16.693 99 HH TYR 14 HH TYR 14 -7.833 2.240 -13.255 100 H GLN 15 H GLN 15 -2.393 0.230 -14.054 101 HA GLN 15 HA GLN 15 -0.531 1.125 -12.047 102 HB2 GLN 15 1HB GLN 15 -2.345 -1.353 -12.217 103 HB3 GLN 15 2HB GLN 15 -1.502 -0.836 -10.763 104 HG2 GLN 15 1HG GLN 15 -2.796 1.311 -10.791 105 HG3 GLN 15 2HG GLN 15 -3.631 0.774 -12.239 106 HE21 GLN 15 2HE2 GLN 15 -4.450 1.214 -9.340 107 HE22 GLN 15 1HE2 GLN 15 -5.406 -0.191 -8.997 108 H LEU 16 H LEU 16 -0.816 -1.730 -14.173 109 HA LEU 16 HA LEU 16 1.439 -3.193 -13.151 110 HB2 LEU 16 1HB LEU 16 -0.481 -3.988 -14.579 111 HB3 LEU 16 2HB LEU 16 0.280 -3.197 -15.949 112 HG LEU 16 HG LEU 16 1.533 -5.522 -14.406 113 HD11 LEU 16 1HD1 LEU 16 -0.458 -6.242 -15.449 114 HD12 LEU 16 2HD1 LEU 16 0.825 -6.673 -16.583 115 HD13 LEU 16 3HD1 LEU 16 -0.195 -5.274 -16.910 116 HD21 LEU 16 3HD2 LEU 16 2.837 -5.740 -16.546 117 HD22 LEU 16 1HD2 LEU 16 3.289 -4.396 -15.486 118 HD23 LEU 16 2HD2 LEU 16 2.326 -4.092 -16.956 119 H GLU 17 H GLU 17 0.988 -0.964 -15.909 120 HA GLU 17 HA GLU 17 3.611 -1.063 -16.918 121 HB2 GLU 17 1HB GLU 17 1.387 0.949 -17.057 122 HB3 GLU 17 2HB GLU 17 2.957 1.350 -17.686 123 HG2 GLU 17 1HG GLU 17 2.858 -0.762 -19.129 124 HG3 GLU 17 2HG GLU 17 1.168 -0.972 -18.638 125 H ASN 18 H ASN 18 2.262 0.779 -14.214 126 HA ASN 18 HA ASN 18 4.384 2.649 -13.984 127 HB2 ASN 18 1HB ASN 18 2.132 2.646 -12.826 128 HB3 ASN 18 2HB ASN 18 2.782 1.539 -11.654 129 HD21 ASN 18 2HD2 ASN 18 2.788 4.778 -12.863 130 HD22 ASN 18 1HD2 ASN 18 3.615 5.440 -11.497 131 H TYR 19 H TYR 19 4.428 -0.787 -13.195 132 HA TYR 19 HA TYR 19 6.834 -0.708 -11.488 133 HB2 TYR 19 1HB TYR 19 5.587 -2.851 -13.251 134 HB3 TYR 19 2HB TYR 19 7.019 -3.135 -12.268 135 HD1 TYR 19 HD2 TYR 19 6.581 -2.320 -9.643 136 HD2 TYR 19 HD1 TYR 19 3.580 -3.738 -12.396 137 HE1 TYR 19 HE2 TYR 19 5.205 -3.009 -7.729 138 HE2 TYR 19 HE1 TYR 19 2.172 -4.457 -10.426 139 HH TYR 19 HH TYR 19 3.430 -4.092 -7.076 140 H CYS 20 H CYS 20 6.146 -0.806 -14.964 141 HA CYS 20 HA CYS 20 8.783 -1.745 -15.691 142 HB2 CYS 20 1HB CYS 20 6.312 -1.864 -16.863 143 HB3 CYS 20 2HB CYS 20 7.063 -0.568 -17.766 144 H ASN 21 H ASN 21 10.353 -0.616 -16.834 145 HA ASN 21 HA ASN 21 10.458 2.280 -16.223 146 HB2 ASN 21 1HB ASN 21 12.865 2.118 -16.457 147 HB3 ASN 21 2HB ASN 21 12.353 0.824 -15.371 148 HD21 ASN 21 2HD2 ASN 21 12.877 -1.227 -15.869 149 HD22 ASN 21 1HD2 ASN 21 13.738 -1.724 -17.318 150 H1 PHE 1 1H PHE 1 -2.546 -6.826 -22.795 151 H2 PHE 1 2H PHE 1 -3.834 -7.845 -22.933 152 H3 PHE 1 3H PHE 1 -4.073 -6.271 -22.656 153 HA PHE 1 HA PHE 1 -2.885 -8.181 -20.820 154 HB2 PHE 1 1HB PHE 1 -1.895 -5.930 -20.550 155 HB3 PHE 1 2HB PHE 1 -3.488 -5.207 -20.474 156 HD1 PHE 1 HD2 PHE 1 -1.798 -8.067 -18.747 157 HD2 PHE 1 HD1 PHE 1 -4.123 -4.492 -18.518 158 HE1 PHE 1 HE2 PHE 1 -2.015 -8.435 -16.368 159 HE2 PHE 1 HE1 PHE 1 -4.328 -4.811 -15.964 160 HZ PHE 1 HZ PHE 1 -3.213 -6.795 -14.944 161 H VAL 2 H VAL 2 -4.424 -9.279 -19.588 162 HA VAL 2 HA VAL 2 -7.238 -8.149 -19.648 163 HB VAL 2 HB VAL 2 -7.854 -10.449 -18.756 164 HG11 VAL 2 1HG1 VAL 2 -8.171 -9.667 -21.129 165 HG12 VAL 2 2HG1 VAL 2 -6.631 -10.450 -21.549 166 HG13 VAL 2 3HG1 VAL 2 -7.994 -11.426 -20.951 167 HG21 VAL 2 3HG2 VAL 2 -6.227 -12.351 -19.312 168 HG22 VAL 2 1HG2 VAL 2 -4.990 -11.152 -19.613 169 HG23 VAL 2 2HG2 VAL 2 -5.665 -11.336 -18.016 170 H ASN 3 H ASN 3 -8.194 -7.440 -17.894 171 HA ASN 3 HA ASN 3 -6.325 -7.235 -15.568 172 HB2 ASN 3 1HB ASN 3 -8.000 -5.450 -14.891 173 HB3 ASN 3 2HB ASN 3 -7.211 -5.111 -16.438 174 HD21 ASN 3 2HD2 ASN 3 -10.169 -5.005 -14.870 175 HD22 ASN 3 1HD2 ASN 3 -11.175 -5.040 -16.341 176 H GLN 4 H GLN 4 -6.642 -9.292 -14.558 177 HA GLN 4 HA GLN 4 -9.413 -9.739 -13.477 178 HB2 GLN 4 1HB GLN 4 -7.579 -11.842 -14.708 179 HB3 GLN 4 2HB GLN 4 -9.159 -12.159 -13.971 180 HG2 GLN 4 1HG GLN 4 -10.295 -10.816 -15.706 181 HG3 GLN 4 2HG GLN 4 -8.719 -10.458 -16.382 182 HE21 GLN 4 2HE2 GLN 4 -10.195 -11.381 -18.241 183 HE22 GLN 4 1HE2 GLN 4 -9.930 -13.087 -18.565 184 H HIS 5 H HIS 5 -7.677 -8.667 -11.565 185 HA HIS 5 HA HIS 5 -6.753 -9.050 -9.477 186 HB2 HIS 5 1HB HIS 5 -8.604 -11.493 -9.639 187 HB3 HIS 5 2HB HIS 5 -7.587 -11.138 -8.232 188 HD1 HIS 5 HD1 HIS 5 -10.440 -9.455 -10.229 189 HD2 HIS 5 HD2 HIS 5 -8.684 -9.417 -6.485 190 HE1 HIS 5 HE1 HIS 5 -11.826 -7.927 -8.714 191 H LEU 6 H LEU 6 -4.739 -9.502 -10.958 192 HA LEU 6 HA LEU 6 -4.080 -12.364 -11.098 193 HB2 LEU 6 1HB LEU 6 -2.623 -9.912 -12.149 194 HB3 LEU 6 2HB LEU 6 -2.146 -11.557 -12.506 195 HG LEU 6 HG LEU 6 -4.647 -10.087 -13.328 196 HD11 LEU 6 1HD1 LEU 6 -2.405 -11.172 -14.999 197 HD12 LEU 6 2HD1 LEU 6 -2.602 -9.468 -14.517 198 HD13 LEU 6 3HD1 LEU 6 -3.803 -10.218 -15.574 199 HD21 LEU 6 3HD2 LEU 6 -5.219 -11.955 -14.763 200 HD22 LEU 6 1HD2 LEU 6 -5.310 -12.375 -13.028 201 HD23 LEU 6 2HD2 LEU 6 -3.951 -12.904 -13.987 202 H CYS 7 H CYS 7 -4.061 -12.296 -8.581 203 HA CYS 7 HA CYS 7 -1.729 -10.909 -7.375 204 HB2 CYS 7 1HB CYS 7 -3.940 -11.539 -6.207 205 HB3 CYS 7 2HB CYS 7 -3.266 -13.184 -6.088 206 H GLY 8 H GLY 8 -2.402 -14.141 -8.486 207 HA2 GLY 8 1HA GLY 8 -0.155 -15.307 -7.138 208 HA3 GLY 8 2HA GLY 8 -1.197 -16.119 -8.300 209 H SER 9 H SER 9 0.296 -17.251 -9.448 210 HA SER 9 HA SER 9 2.807 -16.091 -10.330 211 HB2 SER 9 1HB SER 9 2.179 -18.642 -10.142 212 HB3 SER 9 2HB SER 9 1.315 -18.464 -11.642 213 HG SER 9 HG SER 9 3.494 -19.202 -11.900 214 H HIS 10 H HIS 10 -0.370 -15.650 -11.403 215 HA HIS 10 HA HIS 10 0.148 -15.242 -14.192 216 HB2 HIS 10 1HB HIS 10 -2.082 -14.029 -12.406 217 HB3 HIS 10 2HB HIS 10 -2.054 -14.148 -14.198 218 HD1 HIS 10 HD1 HIS 10 -3.750 -15.645 -11.588 219 HD2 HIS 10 HD2 HIS 10 -1.591 -17.218 -14.757 220 HE1 HIS 10 HE1 HIS 10 -4.524 -18.013 -11.922 221 H LEU 11 H LEU 11 0.894 -13.418 -11.393 222 HA LEU 11 HA LEU 11 0.801 -10.781 -12.480 223 HB2 LEU 11 1HB LEU 11 0.862 -11.353 -10.062 224 HB3 LEU 11 2HB LEU 11 2.503 -11.940 -10.246 225 HG LEU 11 HG LEU 11 2.244 -9.209 -11.274 226 HD11 LEU 11 1HD1 LEU 11 1.779 -9.689 -8.263 227 HD12 LEU 11 2HD1 LEU 11 0.491 -9.242 -9.405 228 HD13 LEU 11 3HD1 LEU 11 1.809 -8.136 -9.101 229 HD21 LEU 11 3HD2 LEU 11 4.310 -10.558 -10.681 230 HD22 LEU 11 1HD2 LEU 11 3.913 -10.248 -8.968 231 HD23 LEU 11 2HD2 LEU 11 4.257 -8.898 -10.090 232 H VAL 12 H VAL 12 3.159 -13.384 -12.331 233 HA VAL 12 HA VAL 12 5.383 -11.922 -13.418 234 HB VAL 12 HB VAL 12 4.770 -14.902 -13.766 235 HG11 VAL 12 1HG1 VAL 12 7.249 -15.127 -13.821 236 HG12 VAL 12 2HG1 VAL 12 6.717 -13.951 -15.051 237 HG13 VAL 12 3HG1 VAL 12 7.428 -13.349 -13.500 238 HG21 VAL 12 3HG2 VAL 12 5.688 -13.404 -11.365 239 HG22 VAL 12 1HG2 VAL 12 4.434 -14.647 -11.531 240 HG23 VAL 12 2HG2 VAL 12 6.113 -15.088 -11.624 241 H GLU 13 H GLU 13 2.750 -13.887 -14.905 242 HA GLU 13 HA GLU 13 3.677 -13.725 -17.554 243 HB2 GLU 13 1HB GLU 13 0.837 -14.042 -16.561 244 HB3 GLU 13 2HB GLU 13 1.366 -14.311 -18.232 245 HG2 GLU 13 1HG GLU 13 2.874 -16.190 -17.400 246 HG3 GLU 13 2HG GLU 13 2.160 -15.945 -15.799 247 H ALA 14 H ALA 14 1.410 -11.744 -15.637 248 HA ALA 14 HA ALA 14 0.553 -10.008 -17.656 249 HB1 ALA 14 3HB ALA 14 1.060 -9.321 -14.735 250 HB2 ALA 14 1HB ALA 14 -0.057 -8.505 -15.822 251 HB3 ALA 14 2HB ALA 14 -0.367 -10.168 -15.335 252 H LEU 15 H LEU 15 3.267 -9.512 -15.340 253 HA LEU 15 HA LEU 15 4.254 -7.103 -16.568 254 HB2 LEU 15 1HB LEU 15 5.597 -9.227 -14.870 255 HB3 LEU 15 2HB LEU 15 6.416 -7.808 -15.496 256 HG LEU 15 HG LEU 15 3.912 -7.460 -13.945 257 HD11 LEU 15 1HD1 LEU 15 6.620 -7.716 -12.668 258 HD12 LEU 15 2HD1 LEU 15 5.331 -8.939 -12.585 259 HD13 LEU 15 3HD1 LEU 15 5.092 -7.313 -11.862 260 HD21 LEU 15 3HD2 LEU 15 6.412 -5.787 -14.112 261 HD22 LEU 15 1HD2 LEU 15 4.885 -5.325 -13.351 262 HD23 LEU 15 2HD2 LEU 15 4.984 -5.548 -15.119 263 H TYR 16 H TYR 16 5.083 -10.545 -17.252 264 HA TYR 16 HA TYR 16 7.271 -10.072 -19.016 265 HB2 TYR 16 1HB TYR 16 6.668 -12.298 -18.074 266 HB3 TYR 16 2HB TYR 16 5.225 -12.330 -19.081 267 HD1 TYR 16 HD2 TYR 16 8.914 -12.565 -19.176 268 HD2 TYR 16 HD1 TYR 16 5.269 -12.688 -21.447 269 HE1 TYR 16 HE2 TYR 16 10.128 -13.560 -21.105 270 HE2 TYR 16 HE1 TYR 16 6.514 -13.722 -23.353 271 HH TYR 16 HH TYR 16 9.952 -14.450 -23.176 272 H LEU 17 H LEU 17 3.782 -10.197 -19.624 273 HA LEU 17 HA LEU 17 4.042 -10.052 -22.496 274 HB2 LEU 17 1HB LEU 17 1.720 -9.824 -20.588 275 HB3 LEU 17 2HB LEU 17 1.560 -9.619 -22.335 276 HG LEU 17 HG LEU 17 2.613 -12.133 -21.091 277 HD11 LEU 17 1HD1 LEU 17 0.250 -11.785 -20.405 278 HD12 LEU 17 2HD1 LEU 17 0.428 -13.160 -21.513 279 HD13 LEU 17 3HD1 LEU 17 -0.223 -11.615 -22.094 280 HD21 LEU 17 3HD2 LEU 17 3.392 -11.905 -23.329 281 HD22 LEU 17 1HD2 LEU 17 1.784 -11.460 -23.893 282 HD23 LEU 17 2HD2 LEU 17 2.116 -13.115 -23.325 283 H VAL 18 H VAL 18 3.044 -7.691 -20.003 284 HA VAL 18 HA VAL 18 2.442 -5.662 -21.938 285 HB VAL 18 HB VAL 18 2.844 -5.580 -18.954 286 HG11 VAL 18 1HG1 VAL 18 3.282 -3.347 -19.773 287 HG12 VAL 18 2HG1 VAL 18 1.821 -3.377 -20.792 288 HG13 VAL 18 3HG1 VAL 18 1.666 -3.346 -19.017 289 HG21 VAL 18 3HG2 VAL 18 0.212 -5.197 -19.104 290 HG22 VAL 18 1HG2 VAL 18 0.409 -5.888 -20.724 291 HG23 VAL 18 2HG2 VAL 18 0.859 -6.829 -19.286 292 H CYS 19 H CYS 19 5.211 -6.308 -19.664 293 HA CYS 19 HA CYS 19 6.603 -3.978 -20.649 294 HB2 CYS 19 1HB CYS 19 7.547 -6.422 -19.207 295 HB3 CYS 19 2HB CYS 19 8.677 -5.182 -19.642 296 H GLY 20 H GLY 20 7.002 -7.536 -21.344 297 HA2 GLY 20 1HA GLY 20 7.865 -8.520 -23.271 298 HA3 GLY 20 2HA GLY 20 7.537 -6.977 -24.081 299 H GLU 21 H GLU 21 9.565 -6.744 -21.355 300 HA GLU 21 HA GLU 21 12.086 -6.954 -22.939 301 HB2 GLU 21 1HB GLU 21 12.731 -4.645 -22.382 302 HB3 GLU 21 2HB GLU 21 11.237 -4.654 -23.361 303 HG2 GLU 21 1HG GLU 21 9.836 -4.359 -21.369 304 HG3 GLU 21 2HG GLU 21 11.250 -4.464 -20.345 305 H ARG 22 H ARG 22 10.891 -8.294 -20.564 306 HA ARG 22 HA ARG 22 11.493 -8.959 -18.430 307 HB2 ARG 22 1HB ARG 22 14.314 -8.158 -19.183 308 HB3 ARG 22 2HB ARG 22 13.804 -9.311 -17.950 309 HG2 ARG 22 1HG ARG 22 13.057 -10.878 -19.695 310 HG3 ARG 22 2HG ARG 22 13.511 -9.668 -20.932 311 HD2 ARG 22 1HD ARG 22 15.854 -9.789 -20.214 312 HD3 ARG 22 2HD ARG 22 15.412 -10.938 -18.926 313 HE ARG 22 HE ARG 22 14.513 -12.125 -21.327 314 HH11 ARG 22 1HH1 ARG 22 17.704 -10.866 -20.285 315 HH12 ARG 22 2HH1 ARG 22 18.559 -12.114 -21.144 316 HH21 ARG 22 1HH2 ARG 22 15.771 -13.683 -22.356 317 HH22 ARG 22 2HH2 ARG 22 17.481 -13.631 -22.283 318 H GLY 23 H GLY 23 10.532 -6.246 -18.541 319 HA2 GLY 23 1HA GLY 23 12.419 -4.629 -17.000 320 HA3 GLY 23 2HA GLY 23 10.808 -4.127 -17.536 321 H PHE 24 H PHE 24 11.793 -6.957 -15.481 322 HA PHE 24 HA PHE 24 10.721 -5.660 -13.062 323 HB2 PHE 24 1HB PHE 24 8.970 -7.350 -12.708 324 HB3 PHE 24 2HB PHE 24 8.656 -6.434 -14.135 325 HD1 PHE 24 HD1 PHE 24 8.866 -7.408 -16.352 326 HD2 PHE 24 HD2 PHE 24 9.524 -9.750 -12.800 327 HE1 PHE 24 HE1 PHE 24 8.753 -9.515 -17.743 328 HE2 PHE 24 HE2 PHE 24 9.334 -11.809 -14.130 329 HZ PHE 24 HZ PHE 24 8.985 -11.722 -16.627 330 H PHE 25 H PHE 25 11.056 -7.188 -11.148 331 HA PHE 25 HA PHE 25 13.209 -9.145 -11.885 332 HB2 PHE 25 1HB PHE 25 13.833 -6.885 -10.724 333 HB3 PHE 25 2HB PHE 25 13.244 -7.666 -9.257 334 HD1 PHE 25 HD1 PHE 25 14.100 -10.415 -9.396 335 HD2 PHE 25 HD2 PHE 25 16.093 -6.878 -10.781 336 HE1 PHE 25 HE1 PHE 25 16.248 -11.607 -9.212 337 HE2 PHE 25 HE2 PHE 25 18.331 -7.998 -10.572 338 HZ PHE 25 HZ PHE 25 18.407 -10.396 -9.846 339 H NVA 26 H ARX 26 12.264 -10.954 -11.729 340 HA NVA 26 HA ARX 26 10.926 -11.782 -9.247 341 HB2 NVA 26 1HB ARX 26 10.074 -12.350 -12.012 342 HB3 NVA 26 2HB ARX 26 10.193 -13.775 -11.049 343 HG2 NVA 26 1HG ARX 26 8.506 -11.305 -10.181 344 HG3 NVA 26 2HG ARX 26 7.952 -12.735 -11.032 345 HD2 NVA 26 1HD ARX 26 9.157 -12.891 -8.263 346 HD3 NVA 26 2HD ARX 26 7.461 -12.761 -8.526 347 H THR 27 H THR 27 11.635 -13.585 -8.325 348 HA THR 27 HA THR 27 14.253 -14.812 -9.111 349 HB THR 27 HB THR 27 13.261 -16.517 -7.287 350 HG1 THR 27 HG1 THR 27 11.635 -15.694 -6.058 351 HG21 THR 27 1HG2 THR 27 13.927 -13.673 -6.458 352 HG22 THR 27 2HG2 THR 27 15.128 -14.934 -6.879 353 HG23 THR 27 3HG2 THR 27 14.038 -15.129 -5.472 354 HA PRO 28 HA PRO 28 12.282 -17.424 -12.023 355 HB2 PRO 28 1HB PRO 28 13.466 -19.945 -11.718 356 HB3 PRO 28 2HB PRO 28 14.359 -18.493 -12.357 357 HG2 PRO 28 1HG PRO 28 14.272 -19.594 -9.569 358 HG3 PRO 28 2HG PRO 28 15.698 -19.188 -10.564 359 HD2 PRO 28 1HD PRO 28 14.880 -17.433 -8.771 360 HD3 PRO 28 2HD PRO 28 15.434 -16.931 -10.413 361 H HIX 29 H HIX 29 10.245 -17.650 -11.646 362 HA HIX 29 HA HIX 29 9.220 -19.103 -9.332 363 HB1 HIX 29 1HB HIX 29 7.935 -17.601 -11.709 364 HB2 HIX 29 2HB HIX 29 6.973 -18.312 -10.413 365 HD2 HIX 29 HD2 HIX 29 8.097 -15.028 -11.104 366 HD1 HIX 29 HD1 HIX 29 8.490 -17.452 -7.853 367 HE1 HIX 29 HE1 HIX 29 7.325 -15.190 -7.453 368 H THR 30 H THR 30 10.439 -21.069 -10.324 369 HA THR 30 HA THR 30 8.432 -22.822 -11.500 370 HB THR 30 HB THR 30 9.669 -21.954 -13.482 371 HG1 THR 30 HG1 THR 30 9.771 -24.613 -12.667 372 HG21 THR 30 1HG2 THR 30 11.829 -21.593 -12.239 373 HG22 THR 30 2HG2 THR 30 11.970 -22.288 -13.831 374 HG23 THR 30 3HG2 THR 30 12.126 -23.311 -12.436 Start of MODEL 19 1 H1 GLY 1 1H GLY 1 -1.365 -0.163 -0.066 2 H2 GLY 1 2H GLY 1 -0.498 1.259 0.237 3 H3 GLY 1 3H GLY 1 -1.431 1.144 -1.120 4 HA2 GLY 1 1HA GLY 1 1.103 0.840 -1.377 5 HA3 GLY 1 2HA GLY 1 0.852 -0.754 -0.615 6 H ILE 2 H ILE 2 1.488 0.592 -3.507 7 HA ILE 2 HA ILE 2 -0.635 -0.229 -5.245 8 HB ILE 2 HB ILE 2 1.242 1.360 -5.798 9 HG12 ILE 2 1HG1 ILE 2 0.786 -0.968 -7.662 10 HG13 ILE 2 2HG1 ILE 2 -0.155 0.519 -7.525 11 HG21 ILE 2 1HG2 ILE 2 3.049 -1.084 -5.865 12 HG22 ILE 2 2HG2 ILE 2 3.445 0.508 -6.593 13 HG23 ILE 2 3HG2 ILE 2 3.207 0.353 -4.866 14 HD11 ILE 2 3HD1 ILE 2 1.856 1.785 -8.404 15 HD12 ILE 2 1HD1 ILE 2 2.649 0.233 -8.636 16 HD13 ILE 2 2HD1 ILE 2 1.146 0.598 -9.530 17 H VAL 3 H VAL 3 2.041 -2.100 -3.806 18 HA VAL 3 HA VAL 3 1.683 -4.338 -5.584 19 HB VAL 3 HB VAL 3 2.758 -4.442 -2.741 20 HG11 VAL 3 1HG1 VAL 3 3.135 -6.225 -5.175 21 HG12 VAL 3 2HG1 VAL 3 4.095 -6.326 -3.699 22 HG13 VAL 3 3HG1 VAL 3 2.340 -6.670 -3.652 23 HG21 VAL 3 3HG2 VAL 3 3.948 -2.692 -3.950 24 HG22 VAL 3 1HG2 VAL 3 4.999 -4.119 -3.884 25 HG23 VAL 3 2HG2 VAL 3 4.144 -3.738 -5.374 26 H GLU 4 H GLU 4 0.413 -3.813 -2.210 27 HA GLU 4 HA GLU 4 -0.978 -6.271 -2.282 28 HB2 GLU 4 1HB GLU 4 -0.500 -4.820 -0.211 29 HB3 GLU 4 2HB GLU 4 -1.792 -3.747 -0.746 30 HG2 GLU 4 1HG GLU 4 -3.436 -5.367 -0.397 31 HG3 GLU 4 2HG GLU 4 -2.259 -6.686 -0.445 32 H GLN 5 H GLN 5 -1.943 -2.946 -3.334 33 HA GLN 5 HA GLN 5 -4.636 -3.553 -3.983 34 HB2 GLN 5 1HB GLN 5 -3.400 -1.374 -3.760 35 HB3 GLN 5 2HB GLN 5 -2.861 -1.596 -5.425 36 HG2 GLN 5 1HG GLN 5 -5.296 -1.795 -6.041 37 HG3 GLN 5 2HG GLN 5 -5.673 -1.219 -4.414 38 HE21 GLN 5 2HE2 GLN 5 -6.623 0.261 -6.340 39 HE22 GLN 5 1HE2 GLN 5 -5.700 1.780 -6.475 40 H CYS 6 H CYS 6 -1.651 -3.924 -5.914 41 HA CYS 6 HA CYS 6 -3.165 -4.575 -8.328 42 HB2 CYS 6 1HB CYS 6 -0.821 -3.688 -8.253 43 HB3 CYS 6 2HB CYS 6 -0.259 -5.238 -7.641 44 H CYS 7 H CYS 7 -1.959 -6.341 -5.539 45 HA CYS 7 HA CYS 7 -2.257 -8.955 -6.715 46 HB2 CYS 7 1HB CYS 7 -1.470 -7.735 -4.155 47 HB3 CYS 7 2HB CYS 7 -2.491 -9.142 -3.943 48 H THR 8 H THR 8 -4.121 -7.293 -4.162 49 HA THR 8 HA THR 8 -6.131 -9.323 -4.145 50 HB THR 8 HB THR 8 -7.098 -8.012 -2.298 51 HG1 THR 8 HG1 THR 8 -5.127 -6.080 -2.992 52 HG21 THR 8 1HG2 THR 8 -5.033 -9.435 -1.887 53 HG22 THR 8 2HG2 THR 8 -5.328 -8.090 -0.721 54 HG23 THR 8 3HG2 THR 8 -4.094 -7.912 -1.990 55 H SER 9 H SER 9 -5.853 -7.452 -6.639 56 HA SER 9 HA SER 9 -8.772 -7.079 -6.948 57 HB2 SER 9 1HB SER 9 -7.671 -4.916 -5.881 58 HB3 SER 9 2HB SER 9 -7.062 -4.689 -7.549 59 HG SER 9 HG SER 9 -8.998 -3.723 -7.642 60 H ILE 10 H ILE 10 -9.254 -6.387 -9.262 61 HA ILE 10 HA ILE 10 -7.517 -7.702 -11.189 62 HB ILE 10 HB ILE 10 -9.739 -5.662 -11.556 63 HG12 ILE 10 1HG1 ILE 10 -10.536 -7.727 -10.452 64 HG13 ILE 10 2HG1 ILE 10 -11.321 -7.357 -11.975 65 HG21 ILE 10 1HG2 ILE 10 -9.771 -6.520 -13.931 66 HG22 ILE 10 2HG2 ILE 10 -8.326 -5.622 -13.526 67 HG23 ILE 10 3HG2 ILE 10 -8.283 -7.389 -13.621 68 HD11 ILE 10 3HD1 ILE 10 -10.108 -9.178 -13.110 69 HD12 ILE 10 1HD1 ILE 10 -9.071 -9.408 -11.667 70 HD13 ILE 10 2HD1 ILE 10 -10.805 -9.796 -11.604 71 H CYS 11 H CYS 11 -5.571 -6.882 -11.733 72 HA CYS 11 HA CYS 11 -4.992 -4.038 -11.136 73 HB2 CYS 11 1HB CYS 11 -3.583 -6.171 -10.625 74 HB3 CYS 11 2HB CYS 11 -3.130 -6.104 -12.358 75 H SER 12 H SER 12 -5.048 -2.467 -12.561 76 HA SER 12 HA SER 12 -5.820 -3.005 -15.323 77 HB2 SER 12 1HB SER 12 -4.956 -0.413 -13.945 78 HB3 SER 12 2HB SER 12 -5.822 -0.559 -15.485 79 HG SER 12 HG SER 12 -7.516 -1.695 -14.323 80 H LEU 13 H LEU 13 -4.903 -2.106 -17.198 81 HA LEU 13 HA LEU 13 -2.269 -2.962 -17.714 82 HB2 LEU 13 1HB LEU 13 -4.002 -2.420 -19.368 83 HB3 LEU 13 2HB LEU 13 -3.923 -0.741 -18.952 84 HG LEU 13 HG LEU 13 -1.497 -0.693 -19.768 85 HD11 LEU 13 1HD1 LEU 13 -0.789 -2.581 -21.183 86 HD12 LEU 13 2HD1 LEU 13 -2.264 -3.483 -20.776 87 HD13 LEU 13 3HD1 LEU 13 -1.013 -3.104 -19.531 88 HD21 LEU 13 3HD2 LEU 13 -3.698 -1.517 -21.734 89 HD22 LEU 13 1HD2 LEU 13 -2.162 -0.739 -22.154 90 HD23 LEU 13 2HD2 LEU 13 -3.324 0.113 -21.095 91 H TYR 14 H TYR 14 -3.291 0.450 -16.915 92 HA TYR 14 HA TYR 14 -0.619 1.471 -17.228 93 HB2 TYR 14 1HB TYR 14 -1.545 3.516 -16.184 94 HB3 TYR 14 2HB TYR 14 -2.557 2.960 -17.491 95 HD1 TYR 14 HD1 TYR 14 -2.318 3.362 -13.837 96 HD2 TYR 14 HD2 TYR 14 -4.861 2.296 -17.090 97 HE1 TYR 14 HE1 TYR 14 -4.271 3.258 -12.259 98 HE2 TYR 14 HE2 TYR 14 -6.861 2.281 -15.509 99 HH TYR 14 HH TYR 14 -6.444 2.956 -12.021 100 H GLN 15 H GLN 15 -2.316 0.008 -14.498 101 HA GLN 15 HA GLN 15 -0.414 0.918 -12.591 102 HB2 GLN 15 1HB GLN 15 -2.233 -1.478 -12.464 103 HB3 GLN 15 2HB GLN 15 -1.243 -0.919 -11.130 104 HG2 GLN 15 1HG GLN 15 -2.524 1.211 -11.124 105 HG3 GLN 15 2HG GLN 15 -3.484 0.623 -12.489 106 HE21 GLN 15 2HE2 GLN 15 -3.500 0.916 -9.182 107 HE22 GLN 15 1HE2 GLN 15 -4.704 -0.348 -8.858 108 H LEU 16 H LEU 16 -0.682 -1.895 -14.687 109 HA LEU 16 HA LEU 16 1.699 -3.108 -13.653 110 HB2 LEU 16 1HB LEU 16 0.301 -3.437 -16.311 111 HB3 LEU 16 2HB LEU 16 1.702 -4.394 -15.824 112 HG LEU 16 HG LEU 16 -0.815 -4.278 -14.103 113 HD11 LEU 16 1HD1 LEU 16 -0.379 -6.175 -16.433 114 HD12 LEU 16 2HD1 LEU 16 -1.662 -4.960 -16.271 115 HD13 LEU 16 3HD1 LEU 16 -1.624 -6.341 -15.183 116 HD21 LEU 16 3HD2 LEU 16 0.024 -6.559 -13.446 117 HD22 LEU 16 1HD2 LEU 16 1.204 -5.269 -13.114 118 HD23 LEU 16 2HD2 LEU 16 1.403 -6.346 -14.533 119 H GLU 17 H GLU 17 1.121 -0.798 -16.327 120 HA GLU 17 HA GLU 17 3.832 -0.817 -17.249 121 HB2 GLU 17 1HB GLU 17 1.728 1.360 -17.386 122 HB3 GLU 17 2HB GLU 17 3.324 1.477 -18.123 123 HG2 GLU 17 1HG GLU 17 2.586 -0.879 -19.027 124 HG3 GLU 17 2HG GLU 17 0.998 -0.112 -18.865 125 H ASN 18 H ASN 18 2.313 0.920 -14.574 126 HA ASN 18 HA ASN 18 4.534 2.681 -14.073 127 HB2 ASN 18 1HB ASN 18 2.235 2.808 -13.078 128 HB3 ASN 18 2HB ASN 18 2.713 1.482 -11.969 129 HD21 ASN 18 2HD2 ASN 18 3.058 2.302 -10.089 130 HD22 ASN 18 1HD2 ASN 18 3.864 3.844 -9.764 131 H TYR 19 H TYR 19 4.337 -0.831 -13.544 132 HA TYR 19 HA TYR 19 6.569 -0.734 -11.568 133 HB2 TYR 19 1HB TYR 19 5.194 -3.015 -13.026 134 HB3 TYR 19 2HB TYR 19 6.576 -3.208 -11.968 135 HD1 TYR 19 HD1 TYR 19 6.312 -2.770 -9.482 136 HD2 TYR 19 HD2 TYR 19 3.038 -2.781 -12.160 137 HE1 TYR 19 HE1 TYR 19 4.828 -2.902 -7.555 138 HE2 TYR 19 HE2 TYR 19 1.482 -2.989 -10.196 139 HH TYR 19 HH TYR 19 2.693 -3.253 -6.817 140 H CYS 20 H CYS 20 6.081 -0.793 -15.077 141 HA CYS 20 HA CYS 20 8.378 -2.486 -15.618 142 HB2 CYS 20 1HB CYS 20 6.968 -0.441 -17.428 143 HB3 CYS 20 2HB CYS 20 8.121 -1.675 -17.991 144 H ASN 21 H ASN 21 10.458 -1.997 -15.580 145 HA ASN 21 HA ASN 21 11.264 0.858 -15.250 146 HB2 ASN 21 1HB ASN 21 13.544 -0.028 -15.052 147 HB3 ASN 21 2HB ASN 21 12.454 -0.811 -13.909 148 HD21 ASN 21 2HD2 ASN 21 13.102 -2.799 -13.628 149 HD22 ASN 21 1HD2 ASN 21 13.553 -3.919 -14.903 150 H1 PHE 1 1H PHE 1 -1.070 -7.921 -22.487 151 H2 PHE 1 2H PHE 1 -2.335 -8.693 -23.193 152 H3 PHE 1 3H PHE 1 -2.446 -7.058 -22.923 153 HA PHE 1 HA PHE 1 -2.315 -9.146 -20.770 154 HB2 PHE 1 1HB PHE 1 -1.215 -7.062 -20.244 155 HB3 PHE 1 2HB PHE 1 -2.655 -6.143 -20.746 156 HD1 PHE 1 HD2 PHE 1 -1.808 -9.134 -18.587 157 HD2 PHE 1 HD1 PHE 1 -3.804 -5.352 -18.887 158 HE1 PHE 1 HE2 PHE 1 -2.554 -9.332 -16.235 159 HE2 PHE 1 HE1 PHE 1 -4.646 -5.588 -16.516 160 HZ PHE 1 HZ PHE 1 -3.987 -7.567 -15.221 161 H VAL 2 H VAL 2 -4.326 -9.657 -19.733 162 HA VAL 2 HA VAL 2 -6.698 -8.603 -21.196 163 HB VAL 2 HB VAL 2 -7.781 -10.832 -21.096 164 HG11 VAL 2 1HG1 VAL 2 -6.344 -11.819 -22.900 165 HG12 VAL 2 2HG1 VAL 2 -6.464 -10.074 -23.084 166 HG13 VAL 2 3HG1 VAL 2 -5.001 -10.800 -22.393 167 HG21 VAL 2 3HG2 VAL 2 -6.497 -12.863 -20.483 168 HG22 VAL 2 1HG2 VAL 2 -5.020 -11.907 -20.178 169 HG23 VAL 2 2HG2 VAL 2 -6.414 -11.752 -19.090 170 H ASN 3 H ASN 3 -5.744 -7.691 -18.636 171 HA ASN 3 HA ASN 3 -6.733 -6.850 -16.755 172 HB2 ASN 3 1HB ASN 3 -8.469 -6.417 -18.617 173 HB3 ASN 3 2HB ASN 3 -9.433 -7.685 -17.864 174 HD21 ASN 3 2HD2 ASN 3 -10.993 -6.593 -16.828 175 HD22 ASN 3 1HD2 ASN 3 -10.763 -5.208 -15.797 176 H GLN 4 H GLN 4 -5.743 -9.328 -16.385 177 HA GLN 4 HA GLN 4 -7.739 -11.039 -15.175 178 HB2 GLN 4 1HB GLN 4 -5.496 -11.649 -16.506 179 HB3 GLN 4 2HB GLN 4 -4.721 -11.490 -14.955 180 HG2 GLN 4 1HG GLN 4 -5.101 -13.775 -15.036 181 HG3 GLN 4 2HG GLN 4 -6.545 -13.284 -14.162 182 HE21 GLN 4 2HE2 GLN 4 -5.615 -15.383 -16.433 183 HE22 GLN 4 1HE2 GLN 4 -7.090 -15.425 -17.413 184 H HIS 5 H HIS 5 -7.492 -12.009 -12.962 185 HA HIS 5 HA HIS 5 -6.506 -10.083 -10.907 186 HB2 HIS 5 1HB HIS 5 -8.412 -12.297 -10.993 187 HB3 HIS 5 2HB HIS 5 -7.076 -12.819 -9.948 188 HD1 HIS 5 HD1 HIS 5 -10.233 -11.016 -9.848 189 HD2 HIS 5 HD2 HIS 5 -6.644 -10.600 -7.885 190 HE1 HIS 5 HE1 HIS 5 -10.701 -9.512 -7.876 191 H LEU 6 H LEU 6 -4.615 -10.224 -9.761 192 HA LEU 6 HA LEU 6 -2.729 -12.136 -11.059 193 HB2 LEU 6 1HB LEU 6 -2.093 -9.601 -9.610 194 HB3 LEU 6 2HB LEU 6 -1.017 -10.620 -10.608 195 HG LEU 6 HG LEU 6 -3.275 -8.919 -11.653 196 HD11 LEU 6 1HD1 LEU 6 -1.509 -7.807 -12.843 197 HD12 LEU 6 2HD1 LEU 6 -0.300 -8.958 -12.251 198 HD13 LEU 6 3HD1 LEU 6 -1.080 -7.869 -11.081 199 HD21 LEU 6 3HD2 LEU 6 -1.494 -10.873 -13.233 200 HD22 LEU 6 1HD2 LEU 6 -2.666 -9.722 -13.929 201 HD23 LEU 6 2HD2 LEU 6 -3.241 -11.060 -12.956 202 H CYS 7 H CYS 7 -0.888 -11.136 -8.714 203 HA CYS 7 HA CYS 7 -0.136 -12.022 -6.750 204 HB2 CYS 7 1HB CYS 7 -2.626 -11.226 -6.254 205 HB3 CYS 7 2HB CYS 7 -2.720 -12.920 -5.686 206 H GLY 8 H GLY 8 0.639 -13.614 -8.439 207 HA2 GLY 8 1HA GLY 8 1.247 -16.019 -7.443 208 HA3 GLY 8 2HA GLY 8 -0.357 -16.322 -8.229 209 H SER 9 H SER 9 0.447 -17.592 -9.906 210 HA SER 9 HA SER 9 2.755 -16.979 -11.407 211 HB2 SER 9 1HB SER 9 1.733 -18.726 -12.974 212 HB3 SER 9 2HB SER 9 1.944 -19.208 -11.289 213 HG SER 9 HG SER 9 -0.187 -19.555 -12.339 214 H HIS 10 H HIS 10 -0.623 -15.991 -11.796 215 HA HIS 10 HA HIS 10 -0.347 -14.955 -14.499 216 HB2 HIS 10 1HB HIS 10 -2.271 -14.450 -12.161 217 HB3 HIS 10 2HB HIS 10 -2.281 -13.487 -13.639 218 HD1 HIS 10 HD1 HIS 10 -4.091 -16.279 -12.375 219 HD2 HIS 10 HD2 HIS 10 -2.254 -15.413 -16.076 220 HE1 HIS 10 HE1 HIS 10 -5.129 -17.787 -14.083 221 H LEU 11 H LEU 11 0.784 -13.684 -11.416 222 HA LEU 11 HA LEU 11 0.804 -10.928 -12.250 223 HB2 LEU 11 1HB LEU 11 1.066 -11.869 -9.918 224 HB3 LEU 11 2HB LEU 11 2.704 -12.385 -10.342 225 HG LEU 11 HG LEU 11 2.180 -9.554 -11.052 226 HD11 LEU 11 1HD1 LEU 11 2.303 -8.821 -8.538 227 HD12 LEU 11 2HD1 LEU 11 1.885 -10.457 -8.122 228 HD13 LEU 11 3HD1 LEU 11 0.739 -9.471 -9.010 229 HD21 LEU 11 3HD2 LEU 11 4.209 -10.945 -9.215 230 HD22 LEU 11 1HD2 LEU 11 4.392 -9.346 -9.964 231 HD23 LEU 11 2HD2 LEU 11 4.410 -10.804 -10.991 232 H VAL 12 H VAL 12 3.073 -13.615 -12.457 233 HA VAL 12 HA VAL 12 5.261 -12.168 -13.506 234 HB VAL 12 HB VAL 12 4.495 -15.083 -13.933 235 HG11 VAL 12 1HG1 VAL 12 7.159 -13.574 -14.213 236 HG12 VAL 12 2HG1 VAL 12 7.068 -15.368 -14.111 237 HG13 VAL 12 3HG1 VAL 12 6.299 -14.512 -15.470 238 HG21 VAL 12 3HG2 VAL 12 4.560 -14.551 -11.530 239 HG22 VAL 12 1HG2 VAL 12 5.935 -15.553 -11.969 240 HG23 VAL 12 2HG2 VAL 12 6.187 -13.815 -11.738 241 H GLU 13 H GLU 13 2.599 -14.010 -15.049 242 HA GLU 13 HA GLU 13 3.422 -13.588 -17.748 243 HB2 GLU 13 1HB GLU 13 0.650 -13.948 -16.567 244 HB3 GLU 13 2HB GLU 13 1.004 -13.851 -18.312 245 HG2 GLU 13 1HG GLU 13 2.548 -15.804 -17.961 246 HG3 GLU 13 2HG GLU 13 1.832 -16.004 -16.370 247 H ALA 14 H ALA 14 1.429 -11.663 -15.449 248 HA ALA 14 HA ALA 14 0.596 -9.815 -17.493 249 HB1 ALA 14 3HB ALA 14 -0.540 -9.989 -15.395 250 HB2 ALA 14 1HB ALA 14 0.885 -9.371 -14.455 251 HB3 ALA 14 2HB ALA 14 -0.006 -8.326 -15.634 252 H LEU 15 H LEU 15 3.340 -9.740 -15.202 253 HA LEU 15 HA LEU 15 4.227 -7.160 -16.053 254 HB2 LEU 15 1HB LEU 15 5.431 -9.461 -14.594 255 HB3 LEU 15 2HB LEU 15 6.528 -8.275 -15.259 256 HG LEU 15 HG LEU 15 6.195 -7.847 -12.923 257 HD11 LEU 15 1HD1 LEU 15 5.808 -5.496 -13.026 258 HD12 LEU 15 2HD1 LEU 15 4.756 -5.627 -14.436 259 HD13 LEU 15 3HD1 LEU 15 6.485 -5.933 -14.615 260 HD21 LEU 15 3HD2 LEU 15 4.088 -7.102 -12.050 261 HD22 LEU 15 1HD2 LEU 15 3.948 -8.722 -12.674 262 HD23 LEU 15 2HD2 LEU 15 3.307 -7.362 -13.592 263 H TYR 16 H TYR 16 5.000 -10.501 -17.125 264 HA TYR 16 HA TYR 16 7.088 -9.784 -18.975 265 HB2 TYR 16 1HB TYR 16 6.572 -12.115 -18.299 266 HB3 TYR 16 2HB TYR 16 4.940 -11.952 -18.994 267 HD1 TYR 16 HD1 TYR 16 8.453 -11.352 -20.236 268 HD2 TYR 16 HD2 TYR 16 4.608 -13.111 -21.026 269 HE1 TYR 16 HE1 TYR 16 9.324 -12.247 -22.391 270 HE2 TYR 16 HE2 TYR 16 5.496 -13.868 -23.264 271 HH TYR 16 HH TYR 16 7.374 -14.140 -24.612 272 H LEU 17 H LEU 17 3.530 -10.112 -19.562 273 HA LEU 17 HA LEU 17 3.726 -9.512 -22.352 274 HB2 LEU 17 1HB LEU 17 1.430 -9.498 -20.330 275 HB3 LEU 17 2HB LEU 17 1.213 -9.199 -22.060 276 HG LEU 17 HG LEU 17 2.407 -11.776 -21.013 277 HD11 LEU 17 1HD1 LEU 17 0.097 -11.494 -20.142 278 HD12 LEU 17 2HD1 LEU 17 0.159 -12.786 -21.373 279 HD13 LEU 17 3HD1 LEU 17 -0.493 -11.190 -21.803 280 HD21 LEU 17 3HD2 LEU 17 1.089 -11.314 -23.683 281 HD22 LEU 17 1HD2 LEU 17 2.018 -12.741 -23.130 282 HD23 LEU 17 2HD2 LEU 17 2.830 -11.204 -23.445 283 H VAL 18 H VAL 18 3.086 -7.440 -19.415 284 HA VAL 18 HA VAL 18 2.290 -5.250 -21.220 285 HB VAL 18 HB VAL 18 2.706 -5.309 -18.208 286 HG11 VAL 18 1HG1 VAL 18 1.341 -3.143 -18.335 287 HG12 VAL 18 2HG1 VAL 18 3.025 -3.047 -18.844 288 HG13 VAL 18 3HG1 VAL 18 1.732 -3.101 -20.044 289 HG21 VAL 18 3HG2 VAL 18 0.216 -5.330 -19.952 290 HG22 VAL 18 1HG2 VAL 18 0.783 -6.639 -18.910 291 HG23 VAL 18 2HG2 VAL 18 0.207 -5.145 -18.176 292 H CYS 19 H CYS 19 5.200 -6.015 -19.195 293 HA CYS 19 HA CYS 19 6.508 -3.572 -20.109 294 HB2 CYS 19 1HB CYS 19 7.698 -5.999 -18.788 295 HB3 CYS 19 2HB CYS 19 8.384 -4.363 -18.827 296 H GLY 20 H GLY 20 6.837 -7.077 -20.872 297 HA2 GLY 20 1HA GLY 20 7.476 -7.478 -23.285 298 HA3 GLY 20 2HA GLY 20 8.780 -6.273 -22.962 299 H GLU 21 H GLU 21 10.233 -8.137 -23.540 300 HA GLU 21 HA GLU 21 10.517 -10.400 -21.782 301 HB2 GLU 21 1HB GLU 21 12.392 -9.068 -23.713 302 HB3 GLU 21 2HB GLU 21 12.814 -10.517 -22.831 303 HG2 GLU 21 1HG GLU 21 11.406 -11.859 -24.037 304 HG3 GLU 21 2HG GLU 21 10.272 -10.528 -24.405 305 H ARG 22 H ARG 22 11.092 -7.122 -21.324 306 HA ARG 22 HA ARG 22 12.799 -7.685 -18.939 307 HB2 ARG 22 1HB ARG 22 14.244 -5.790 -19.388 308 HB3 ARG 22 2HB ARG 22 14.384 -6.952 -20.711 309 HG2 ARG 22 1HG ARG 22 13.354 -5.676 -22.232 310 HG3 ARG 22 2HG ARG 22 12.458 -4.740 -21.008 311 HD2 ARG 22 1HD ARG 22 15.479 -4.534 -21.226 312 HD3 ARG 22 2HD ARG 22 14.432 -3.604 -22.286 313 HE ARG 22 HE ARG 22 13.532 -3.290 -19.608 314 HH11 ARG 22 1HH1 ARG 22 16.027 -2.083 -21.778 315 HH12 ARG 22 2HH1 ARG 22 16.168 -0.569 -20.883 316 HH21 ARG 22 1HH2 ARG 22 13.727 -1.452 -18.511 317 HH22 ARG 22 2HH2 ARG 22 14.843 -0.232 -19.049 318 H GLY 23 H GLY 23 12.664 -5.668 -17.469 319 HA2 GLY 23 1HA GLY 23 11.268 -3.505 -17.419 320 HA3 GLY 23 2HA GLY 23 9.933 -4.560 -17.845 321 H PHE 24 H PHE 24 11.313 -6.704 -16.023 322 HA PHE 24 HA PHE 24 10.629 -5.596 -13.407 323 HB2 PHE 24 1HB PHE 24 8.790 -7.035 -13.077 324 HB3 PHE 24 2HB PHE 24 8.545 -6.452 -14.741 325 HD1 PHE 24 HD1 PHE 24 9.170 -7.860 -16.672 326 HD2 PHE 24 HD2 PHE 24 9.067 -9.355 -12.627 327 HE1 PHE 24 HE1 PHE 24 9.060 -10.208 -17.545 328 HE2 PHE 24 HE2 PHE 24 8.983 -11.732 -13.533 329 HZ PHE 24 HZ PHE 24 8.920 -12.156 -15.920 330 H PHE 25 H PHE 25 11.037 -7.211 -11.616 331 HA PHE 25 HA PHE 25 12.890 -9.404 -12.451 332 HB2 PHE 25 1HB PHE 25 14.311 -7.502 -11.777 333 HB3 PHE 25 2HB PHE 25 13.434 -7.366 -10.257 334 HD1 PHE 25 HD1 PHE 25 15.857 -9.547 -12.115 335 HD2 PHE 25 HD2 PHE 25 13.882 -8.791 -8.342 336 HE1 PHE 25 HE1 PHE 25 17.475 -11.050 -10.997 337 HE2 PHE 25 HE2 PHE 25 15.465 -10.311 -7.249 338 HZ PHE 25 HZ PHE 25 17.265 -11.491 -8.586 339 H NVA 26 H ARX 26 11.931 -11.196 -11.778 340 HA NVA 26 HA ARX 26 10.278 -11.292 -9.279 341 HB2 NVA 26 1HB ARX 26 9.288 -12.281 -11.472 342 HB3 NVA 26 2HB ARX 26 10.679 -13.342 -11.532 343 HG2 NVA 26 1HG ARX 26 8.543 -14.463 -10.790 344 HG3 NVA 26 2HG ARX 26 9.881 -14.570 -9.573 345 HD2 NVA 26 1HD ARX 26 8.600 -12.334 -8.601 346 HD3 NVA 26 2HD ARX 26 7.228 -13.197 -9.301 347 H THR 27 H THR 27 11.024 -11.909 -7.496 348 HA THR 27 HA THR 27 13.667 -12.970 -6.980 349 HB THR 27 HB THR 27 12.632 -13.316 -4.627 350 HG1 THR 27 HG1 THR 27 10.431 -13.386 -5.355 351 HG21 THR 27 1HG2 THR 27 13.818 -11.128 -5.553 352 HG22 THR 27 2HG2 THR 27 12.930 -11.024 -4.023 353 HG23 THR 27 3HG2 THR 27 12.211 -10.427 -5.534 354 HA PRO 28 HA PRO 28 12.688 -17.130 -7.434 355 HB2 PRO 28 1HB PRO 28 14.287 -18.531 -5.697 356 HB3 PRO 28 2HB PRO 28 14.946 -17.593 -7.120 357 HG2 PRO 28 1HG PRO 28 14.735 -16.776 -4.204 358 HG3 PRO 28 2HG PRO 28 16.108 -16.621 -5.340 359 HD2 PRO 28 1HD PRO 28 14.358 -14.496 -4.823 360 HD3 PRO 28 2HD PRO 28 15.225 -14.740 -6.412 361 H HIX 29 H HIX 29 10.528 -16.831 -6.651 362 HA HIX 29 HA HIX 29 9.487 -16.897 -4.023 363 HB1 HIX 29 1HB HIX 29 8.005 -18.019 -6.420 364 HB2 HIX 29 2HB HIX 29 7.309 -17.328 -4.990 365 HD2 HIX 29 HD2 HIX 29 8.052 -16.275 -8.444 366 HD1 HIX 29 HD1 HIX 29 8.398 -14.627 -4.666 367 HE1 HIX 29 HE1 HIX 29 7.099 -13.265 -6.329 368 H THR 30 H THR 30 9.895 -18.264 -2.542 369 HA THR 30 HA THR 30 9.840 -20.131 -1.203 370 HB THR 30 HB THR 30 8.589 -21.641 -3.526 371 HG1 THR 30 HG1 THR 30 6.942 -20.542 -3.110 372 HG21 THR 30 1HG2 THR 30 7.586 -22.921 -1.578 373 HG22 THR 30 2HG2 THR 30 8.858 -22.156 -0.559 374 HG23 THR 30 3HG2 THR 30 9.290 -23.225 -1.897 Start of MODEL 20 1 H1 GLY 1 1H GLY 1 -0.134 1.933 0.155 2 H2 GLY 1 2H GLY 1 -0.197 2.889 -1.190 3 H3 GLY 1 3H GLY 1 -1.353 1.665 -0.968 4 HA2 GLY 1 1HA GLY 1 1.545 1.535 -1.605 5 HA3 GLY 1 2HA GLY 1 0.611 0.102 -1.099 6 H ILE 2 H ILE 2 1.576 -0.441 -3.368 7 HA ILE 2 HA ILE 2 -0.601 0.258 -5.329 8 HB ILE 2 HB ILE 2 1.520 1.341 -6.054 9 HG12 ILE 2 1HG1 ILE 2 0.845 -1.115 -7.696 10 HG13 ILE 2 2HG1 ILE 2 -0.066 0.377 -7.742 11 HG21 ILE 2 1HG2 ILE 2 2.876 -1.391 -6.151 12 HG22 ILE 2 2HG2 ILE 2 3.616 0.183 -6.502 13 HG23 ILE 2 3HG2 ILE 2 3.103 -0.197 -4.849 14 HD11 ILE 2 3HD1 ILE 2 1.535 0.015 -9.699 15 HD12 ILE 2 1HD1 ILE 2 1.895 1.504 -8.814 16 HD13 ILE 2 2HD1 ILE 2 2.893 0.074 -8.570 17 H VAL 3 H VAL 3 1.773 -2.232 -4.205 18 HA VAL 3 HA VAL 3 0.899 -4.220 -5.963 19 HB VAL 3 HB VAL 3 2.148 -4.718 -3.185 20 HG11 VAL 3 1HG1 VAL 3 2.896 -6.862 -4.255 21 HG12 VAL 3 2HG1 VAL 3 1.139 -6.735 -4.021 22 HG13 VAL 3 3HG1 VAL 3 1.849 -6.498 -5.645 23 HG21 VAL 3 3HG2 VAL 3 4.288 -4.958 -4.454 24 HG22 VAL 3 1HG2 VAL 3 3.457 -4.397 -5.929 25 HG23 VAL 3 2HG2 VAL 3 3.605 -3.315 -4.535 26 H GLU 4 H GLU 4 -0.093 -3.779 -2.443 27 HA GLU 4 HA GLU 4 -2.087 -5.771 -2.625 28 HB2 GLU 4 1HB GLU 4 -2.110 -3.350 -0.810 29 HB3 GLU 4 2HB GLU 4 -3.036 -4.808 -0.599 30 HG2 GLU 4 1HG GLU 4 -0.936 -6.110 -0.371 31 HG3 GLU 4 2HG GLU 4 0.015 -4.654 -0.665 32 H GLN 5 H GLN 5 -2.187 -2.288 -3.334 33 HA GLN 5 HA GLN 5 -5.003 -2.146 -3.399 34 HB2 GLN 5 1HB GLN 5 -3.483 -0.260 -3.174 35 HB3 GLN 5 2HB GLN 5 -3.027 -0.399 -4.871 36 HG2 GLN 5 1HG GLN 5 -5.126 0.297 -5.667 37 HG3 GLN 5 2HG GLN 5 -5.926 0.095 -4.086 38 HE21 GLN 5 2HE2 GLN 5 -6.279 1.991 -3.076 39 HE22 GLN 5 1HE2 GLN 5 -5.187 3.337 -3.112 40 H CYS 6 H CYS 6 -2.559 -2.788 -5.925 41 HA CYS 6 HA CYS 6 -4.438 -2.953 -8.074 42 HB2 CYS 6 1HB CYS 6 -1.867 -2.747 -8.035 43 HB3 CYS 6 2HB CYS 6 -1.826 -4.516 -7.906 44 H CYS 7 H CYS 7 -2.901 -5.379 -5.916 45 HA CYS 7 HA CYS 7 -3.831 -7.675 -7.283 46 HB2 CYS 7 1HB CYS 7 -2.534 -6.977 -4.728 47 HB3 CYS 7 2HB CYS 7 -3.447 -8.469 -4.693 48 H THR 8 H THR 8 -5.277 -6.197 -4.325 49 HA THR 8 HA THR 8 -7.281 -8.340 -4.242 50 HB THR 8 HB THR 8 -7.603 -5.894 -2.541 51 HG1 THR 8 HG1 THR 8 -5.781 -6.716 -1.220 52 HG21 THR 8 1HG2 THR 8 -7.925 -7.598 -0.799 53 HG22 THR 8 2HG2 THR 8 -7.397 -8.876 -1.914 54 HG23 THR 8 3HG2 THR 8 -8.908 -8.012 -2.204 55 H SER 9 H SER 9 -7.207 -6.606 -6.564 56 HA SER 9 HA SER 9 -9.996 -6.045 -6.794 57 HB2 SER 9 1HB SER 9 -8.813 -3.979 -5.691 58 HB3 SER 9 2HB SER 9 -8.159 -3.753 -7.318 59 HG SER 9 HG SER 9 -9.940 -2.619 -7.347 60 H ILE 10 H ILE 10 -10.072 -4.601 -9.064 61 HA ILE 10 HA ILE 10 -8.897 -6.309 -11.068 62 HB ILE 10 HB ILE 10 -10.304 -3.617 -11.360 63 HG12 ILE 10 1HG1 ILE 10 -11.791 -5.311 -10.460 64 HG13 ILE 10 2HG1 ILE 10 -12.237 -4.869 -12.100 65 HG21 ILE 10 1HG2 ILE 10 -10.569 -4.265 -13.740 66 HG22 ILE 10 2HG2 ILE 10 -8.889 -3.965 -13.302 67 HG23 ILE 10 3HG2 ILE 10 -9.467 -5.638 -13.479 68 HD11 ILE 10 3HD1 ILE 10 -10.588 -7.396 -11.433 69 HD12 ILE 10 1HD1 ILE 10 -12.364 -7.400 -11.541 70 HD13 ILE 10 2HD1 ILE 10 -11.397 -7.024 -12.963 71 H CYS 11 H CYS 11 -6.848 -6.194 -11.635 72 HA CYS 11 HA CYS 11 -5.203 -3.977 -10.792 73 HB2 CYS 11 1HB CYS 11 -4.827 -6.624 -11.814 74 HB3 CYS 11 2HB CYS 11 -3.767 -5.565 -12.708 75 H SER 12 H SER 12 -5.110 -2.109 -11.699 76 HA SER 12 HA SER 12 -6.234 -1.584 -14.316 77 HB2 SER 12 1HB SER 12 -4.441 0.163 -12.698 78 HB3 SER 12 2HB SER 12 -5.538 0.698 -13.975 79 HG SER 12 HG SER 12 -6.193 -0.387 -11.415 80 H LEU 13 H LEU 13 -5.238 -1.076 -16.254 81 HA LEU 13 HA LEU 13 -2.800 -2.388 -16.868 82 HB2 LEU 13 1HB LEU 13 -4.433 -1.802 -18.622 83 HB3 LEU 13 2HB LEU 13 -4.168 -0.094 -18.344 84 HG LEU 13 HG LEU 13 -1.755 -0.469 -19.112 85 HD11 LEU 13 1HD1 LEU 13 -1.258 -2.579 -20.340 86 HD12 LEU 13 2HD1 LEU 13 -2.893 -3.196 -19.944 87 HD13 LEU 13 3HD1 LEU 13 -1.709 -2.928 -18.661 88 HD21 LEU 13 3HD2 LEU 13 -3.944 -1.016 -21.092 89 HD22 LEU 13 1HD2 LEU 13 -2.267 -0.692 -21.512 90 HD23 LEU 13 2HD2 LEU 13 -3.188 0.551 -20.657 91 H TYR 14 H TYR 14 -3.441 1.087 -16.029 92 HA TYR 14 HA TYR 14 -0.663 1.711 -16.617 93 HB2 TYR 14 1HB TYR 14 -1.214 3.862 -15.466 94 HB3 TYR 14 2HB TYR 14 -2.301 3.423 -16.842 95 HD1 TYR 14 HD1 TYR 14 -1.991 3.690 -13.079 96 HD2 TYR 14 HD2 TYR 14 -4.683 3.081 -16.436 97 HE1 TYR 14 HE1 TYR 14 -3.977 3.893 -11.550 98 HE2 TYR 14 HE2 TYR 14 -6.649 3.393 -14.886 99 HH TYR 14 HH TYR 14 -6.268 4.067 -11.370 100 H GLN 15 H GLN 15 -2.261 0.298 -13.942 101 HA GLN 15 HA GLN 15 -0.330 1.118 -11.904 102 HB2 GLN 15 1HB GLN 15 -2.479 -1.065 -12.009 103 HB3 GLN 15 2HB GLN 15 -1.270 -0.991 -10.754 104 HG2 GLN 15 1HG GLN 15 -2.014 1.230 -10.042 105 HG3 GLN 15 2HG GLN 15 -3.129 1.278 -11.440 106 HE21 GLN 15 2HE2 GLN 15 -2.942 0.936 -8.204 107 HE22 GLN 15 1HE2 GLN 15 -4.350 -0.064 -7.960 108 H LEU 16 H LEU 16 -0.981 -1.627 -14.094 109 HA LEU 16 HA LEU 16 1.238 -3.228 -13.170 110 HB2 LEU 16 1HB LEU 16 -0.793 -3.935 -14.539 111 HB3 LEU 16 2HB LEU 16 -0.102 -3.166 -15.931 112 HG LEU 16 HG LEU 16 1.135 -5.517 -14.459 113 HD11 LEU 16 1HD1 LEU 16 0.492 -6.649 -16.578 114 HD12 LEU 16 2HD1 LEU 16 -0.547 -5.259 -16.933 115 HD13 LEU 16 3HD1 LEU 16 -0.842 -6.195 -15.483 116 HD21 LEU 16 3HD2 LEU 16 1.964 -4.196 -17.084 117 HD22 LEU 16 1HD2 LEU 16 2.579 -5.785 -16.438 118 HD23 LEU 16 2HD2 LEU 16 2.924 -4.305 -15.595 119 H GLU 17 H GLU 17 0.825 -0.970 -15.975 120 HA GLU 17 HA GLU 17 3.479 -1.155 -16.857 121 HB2 GLU 17 1HB GLU 17 1.340 0.945 -17.299 122 HB3 GLU 17 2HB GLU 17 2.955 0.980 -18.000 123 HG2 GLU 17 1HG GLU 17 2.540 -1.330 -18.839 124 HG3 GLU 17 2HG GLU 17 0.818 -1.083 -18.476 125 H ASN 18 H ASN 18 2.112 0.760 -14.161 126 HA ASN 18 HA ASN 18 4.273 2.571 -14.016 127 HB2 ASN 18 1HB ASN 18 2.054 1.855 -12.430 128 HB3 ASN 18 2HB ASN 18 3.505 1.529 -11.409 129 HD21 ASN 18 2HD2 ASN 18 1.464 3.826 -12.991 130 HD22 ASN 18 1HD2 ASN 18 2.183 5.286 -12.288 131 H TYR 19 H TYR 19 4.295 -0.942 -13.418 132 HA TYR 19 HA TYR 19 6.661 -0.851 -11.652 133 HB2 TYR 19 1HB TYR 19 5.312 -3.112 -13.160 134 HB3 TYR 19 2HB TYR 19 6.638 -3.317 -12.025 135 HD1 TYR 19 HD2 TYR 19 6.173 -2.064 -9.590 136 HD2 TYR 19 HD1 TYR 19 3.209 -3.636 -12.324 137 HE1 TYR 19 HE2 TYR 19 4.508 -2.284 -7.712 138 HE2 TYR 19 HE1 TYR 19 1.656 -3.933 -10.432 139 HH TYR 19 HH TYR 19 1.245 -3.762 -8.394 140 H CYS 20 H CYS 20 6.032 -0.862 -15.070 141 HA CYS 20 HA CYS 20 8.545 -2.198 -15.880 142 HB2 CYS 20 1HB CYS 20 6.761 -0.357 -17.581 143 HB3 CYS 20 2HB CYS 20 7.898 -1.595 -18.099 144 H ASN 21 H ASN 21 10.411 -1.027 -16.358 145 HA ASN 21 HA ASN 21 10.434 1.753 -15.421 146 HB2 ASN 21 1HB ASN 21 12.623 -0.243 -16.098 147 HB3 ASN 21 2HB ASN 21 12.949 1.411 -15.634 148 HD21 ASN 21 2HD2 ASN 21 13.236 -1.482 -14.380 149 HD22 ASN 21 1HD2 ASN 21 12.833 -1.139 -12.714 150 H1 PHE 1 1H PHE 1 -4.178 -5.994 -22.660 151 H2 PHE 1 2H PHE 1 -2.756 -6.867 -22.908 152 H3 PHE 1 3H PHE 1 -4.239 -7.610 -23.119 153 HA PHE 1 HA PHE 1 -3.110 -8.222 -21.018 154 HB2 PHE 1 1HB PHE 1 -2.169 -5.959 -20.571 155 HB3 PHE 1 2HB PHE 1 -3.799 -5.287 -20.471 156 HD1 PHE 1 HD1 PHE 1 -2.047 -8.272 -19.041 157 HD2 PHE 1 HD2 PHE 1 -4.369 -4.720 -18.342 158 HE1 PHE 1 HE1 PHE 1 -2.156 -8.807 -16.753 159 HE2 PHE 1 HE2 PHE 1 -4.530 -5.342 -15.903 160 HZ PHE 1 HZ PHE 1 -3.383 -7.370 -15.087 161 H VAL 2 H VAL 2 -4.566 -9.255 -19.531 162 HA VAL 2 HA VAL 2 -7.413 -8.386 -19.771 163 HB VAL 2 HB VAL 2 -6.304 -11.214 -19.176 164 HG11 VAL 2 1HG1 VAL 2 -9.155 -10.171 -19.513 165 HG12 VAL 2 2HG1 VAL 2 -8.682 -11.873 -19.309 166 HG13 VAL 2 3HG1 VAL 2 -8.399 -10.738 -17.998 167 HG21 VAL 2 3HG2 VAL 2 -6.033 -10.581 -21.517 168 HG22 VAL 2 1HG2 VAL 2 -7.232 -11.834 -21.355 169 HG23 VAL 2 2HG2 VAL 2 -7.738 -10.121 -21.604 170 H ASN 3 H ASN 3 -7.982 -7.433 -17.845 171 HA ASN 3 HA ASN 3 -6.062 -7.295 -15.665 172 HB2 ASN 3 1HB ASN 3 -7.520 -5.615 -14.836 173 HB3 ASN 3 2HB ASN 3 -7.201 -5.421 -16.569 174 HD21 ASN 3 2HD2 ASN 3 -9.172 -4.111 -16.648 175 HD22 ASN 3 1HD2 ASN 3 -10.711 -4.906 -16.802 176 H GLN 4 H GLN 4 -7.194 -9.931 -15.824 177 HA GLN 4 HA GLN 4 -9.341 -10.160 -13.916 178 HB2 GLN 4 1HB GLN 4 -8.872 -11.595 -15.976 179 HB3 GLN 4 2HB GLN 4 -7.688 -12.429 -14.955 180 HG2 GLN 4 1HG GLN 4 -9.434 -13.011 -13.339 181 HG3 GLN 4 2HG GLN 4 -10.638 -12.212 -14.367 182 HE21 GLN 4 2HE2 GLN 4 -9.726 -15.151 -13.559 183 HE22 GLN 4 1HE2 GLN 4 -9.884 -15.977 -15.085 184 H HIS 5 H HIS 5 -7.665 -8.976 -12.347 185 HA HIS 5 HA HIS 5 -6.710 -8.846 -10.298 186 HB2 HIS 5 1HB HIS 5 -7.938 -11.642 -10.207 187 HB3 HIS 5 2HB HIS 5 -6.812 -11.087 -8.932 188 HD1 HIS 5 HD1 HIS 5 -10.050 -9.727 -10.554 189 HD2 HIS 5 HD2 HIS 5 -7.948 -9.882 -6.902 190 HE1 HIS 5 HE1 HIS 5 -11.486 -8.598 -8.768 191 H LEU 6 H LEU 6 -5.874 -12.178 -11.259 192 HA LEU 6 HA LEU 6 -3.880 -13.215 -11.585 193 HB2 LEU 6 1HB LEU 6 -2.711 -10.557 -12.397 194 HB3 LEU 6 2HB LEU 6 -2.263 -12.153 -12.966 195 HG LEU 6 HG LEU 6 -4.839 -10.670 -13.628 196 HD11 LEU 6 1HD1 LEU 6 -2.981 -9.633 -14.640 197 HD12 LEU 6 2HD1 LEU 6 -3.735 -10.624 -15.901 198 HD13 LEU 6 3HD1 LEU 6 -2.243 -11.181 -15.077 199 HD21 LEU 6 3HD2 LEU 6 -3.737 -13.304 -14.747 200 HD22 LEU 6 1HD2 LEU 6 -5.139 -12.457 -15.342 201 HD23 LEU 6 2HD2 LEU 6 -5.189 -13.130 -13.763 202 H CYS 7 H CYS 7 -4.003 -11.833 -8.788 203 HA CYS 7 HA CYS 7 -1.434 -10.873 -8.219 204 HB2 CYS 7 1HB CYS 7 -3.637 -10.633 -6.917 205 HB3 CYS 7 2HB CYS 7 -3.217 -12.175 -6.157 206 H GLY 8 H GLY 8 -2.210 -13.978 -9.009 207 HA2 GLY 8 1HA GLY 8 -0.375 -15.372 -7.167 208 HA3 GLY 8 2HA GLY 8 -1.359 -16.095 -8.424 209 H SER 9 H SER 9 0.515 -17.257 -9.155 210 HA SER 9 HA SER 9 2.865 -15.939 -10.124 211 HB2 SER 9 1HB SER 9 1.695 -18.581 -11.114 212 HB3 SER 9 2HB SER 9 3.326 -17.945 -11.461 213 HG SER 9 HG SER 9 3.295 -19.358 -9.676 214 H HIS 10 H HIS 10 -0.358 -15.961 -11.432 215 HA HIS 10 HA HIS 10 0.289 -15.461 -14.173 216 HB2 HIS 10 1HB HIS 10 -1.971 -14.444 -12.430 217 HB3 HIS 10 2HB HIS 10 -1.873 -14.197 -14.171 218 HD1 HIS 10 HD1 HIS 10 -4.183 -15.829 -12.790 219 HD2 HIS 10 HD2 HIS 10 -0.852 -17.488 -14.620 220 HE1 HIS 10 HE1 HIS 10 -4.802 -18.173 -13.503 221 H LEU 11 H LEU 11 0.864 -13.475 -11.311 222 HA LEU 11 HA LEU 11 0.782 -10.863 -12.502 223 HB2 LEU 11 1HB LEU 11 1.106 -11.654 -10.012 224 HB3 LEU 11 2HB LEU 11 2.800 -11.693 -10.426 225 HG LEU 11 HG LEU 11 1.914 -9.177 -11.338 226 HD11 LEU 11 1HD1 LEU 11 -0.207 -9.395 -10.140 227 HD12 LEU 11 2HD1 LEU 11 0.804 -8.181 -9.316 228 HD13 LEU 11 3HD1 LEU 11 0.647 -9.828 -8.604 229 HD21 LEU 11 3HD2 LEU 11 3.285 -8.302 -9.472 230 HD22 LEU 11 1HD2 LEU 11 4.075 -9.654 -10.275 231 HD23 LEU 11 2HD2 LEU 11 3.319 -9.896 -8.698 232 H VAL 12 H VAL 12 3.242 -13.387 -12.442 233 HA VAL 12 HA VAL 12 5.445 -11.897 -13.428 234 HB VAL 12 HB VAL 12 4.818 -14.907 -13.636 235 HG11 VAL 12 1HG1 VAL 12 7.319 -13.267 -14.159 236 HG12 VAL 12 2HG1 VAL 12 7.387 -14.995 -13.773 237 HG13 VAL 12 3HG1 VAL 12 6.519 -14.443 -15.225 238 HG21 VAL 12 3HG2 VAL 12 6.403 -15.040 -11.635 239 HG22 VAL 12 1HG2 VAL 12 6.359 -13.245 -11.558 240 HG23 VAL 12 2HG2 VAL 12 4.849 -14.197 -11.301 241 H GLU 13 H GLU 13 3.016 -14.000 -15.000 242 HA GLU 13 HA GLU 13 3.989 -13.642 -17.697 243 HB2 GLU 13 1HB GLU 13 1.258 -14.490 -16.689 244 HB3 GLU 13 2HB GLU 13 1.829 -14.549 -18.352 245 HG2 GLU 13 1HG GLU 13 3.604 -16.114 -17.621 246 HG3 GLU 13 2HG GLU 13 2.945 -16.098 -15.978 247 H ALA 14 H ALA 14 1.599 -11.898 -15.737 248 HA ALA 14 HA ALA 14 0.648 -10.193 -17.840 249 HB1 ALA 14 3HB ALA 14 1.045 -9.367 -14.914 250 HB2 ALA 14 1HB ALA 14 -0.170 -8.794 -16.089 251 HB3 ALA 14 2HB ALA 14 -0.266 -10.471 -15.447 252 H LEU 15 H LEU 15 3.288 -9.837 -15.469 253 HA LEU 15 HA LEU 15 4.233 -7.311 -16.407 254 HB2 LEU 15 1HB LEU 15 5.520 -9.607 -14.892 255 HB3 LEU 15 2HB LEU 15 6.444 -8.168 -15.254 256 HG LEU 15 HG LEU 15 3.808 -8.060 -13.760 257 HD11 LEU 15 1HD1 LEU 15 5.499 -9.344 -12.485 258 HD12 LEU 15 2HD1 LEU 15 5.157 -7.789 -11.753 259 HD13 LEU 15 3HD1 LEU 15 6.623 -7.995 -12.677 260 HD21 LEU 15 3HD2 LEU 15 6.024 -5.994 -13.890 261 HD22 LEU 15 1HD2 LEU 15 4.371 -5.805 -13.222 262 HD23 LEU 15 2HD2 LEU 15 4.606 -5.947 -14.956 263 H TYR 16 H TYR 16 5.157 -10.641 -17.265 264 HA TYR 16 HA TYR 16 7.289 -10.012 -19.056 265 HB2 TYR 16 1HB TYR 16 6.829 -12.264 -18.144 266 HB3 TYR 16 2HB TYR 16 5.355 -12.343 -19.106 267 HD1 TYR 16 HD2 TYR 16 9.031 -11.708 -19.636 268 HD2 TYR 16 HD1 TYR 16 5.419 -13.468 -21.151 269 HE1 TYR 16 HE2 TYR 16 10.328 -12.754 -21.499 270 HE2 TYR 16 HE1 TYR 16 6.715 -14.458 -23.116 271 HH TYR 16 HH TYR 16 8.760 -14.692 -24.116 272 H LEU 17 H LEU 17 3.762 -10.499 -19.785 273 HA LEU 17 HA LEU 17 4.146 -10.106 -22.655 274 HB2 LEU 17 1HB LEU 17 1.679 -10.086 -20.871 275 HB3 LEU 17 2HB LEU 17 1.639 -9.959 -22.622 276 HG LEU 17 HG LEU 17 2.803 -12.307 -21.141 277 HD11 LEU 17 1HD1 LEU 17 0.799 -13.547 -21.861 278 HD12 LEU 17 2HD1 LEU 17 0.109 -12.052 -22.537 279 HD13 LEU 17 3HD1 LEU 17 0.392 -12.175 -20.781 280 HD21 LEU 17 3HD2 LEU 17 2.208 -12.000 -24.081 281 HD22 LEU 17 1HD2 LEU 17 2.814 -13.467 -23.244 282 HD23 LEU 17 2HD2 LEU 17 3.826 -12.011 -23.331 283 H VAL 18 H VAL 18 3.170 -7.961 -19.959 284 HA VAL 18 HA VAL 18 2.504 -5.900 -21.875 285 HB VAL 18 HB VAL 18 2.492 -5.738 -18.811 286 HG11 VAL 18 1HG1 VAL 18 0.946 -3.810 -19.176 287 HG12 VAL 18 2HG1 VAL 18 2.649 -3.550 -19.732 288 HG13 VAL 18 3HG1 VAL 18 1.367 -3.836 -20.945 289 HG21 VAL 18 3HG2 VAL 18 0.176 -6.227 -18.913 290 HG22 VAL 18 1HG2 VAL 18 0.078 -6.105 -20.675 291 HG23 VAL 18 2HG2 VAL 18 0.953 -7.446 -19.925 292 H CYS 19 H CYS 19 5.012 -6.085 -19.210 293 HA CYS 19 HA CYS 19 6.152 -3.571 -20.054 294 HB2 CYS 19 1HB CYS 19 7.574 -5.902 -18.719 295 HB3 CYS 19 2HB CYS 19 8.191 -4.255 -18.864 296 H GLY 20 H GLY 20 6.656 -6.965 -20.995 297 HA2 GLY 20 1HA GLY 20 7.508 -7.814 -22.956 298 HA3 GLY 20 2HA GLY 20 7.813 -6.161 -23.564 299 H GLU 21 H GLU 21 9.618 -5.083 -22.180 300 HA GLU 21 HA GLU 21 12.029 -6.528 -22.847 301 HB2 GLU 21 1HB GLU 21 11.690 -3.790 -21.633 302 HB3 GLU 21 2HB GLU 21 13.112 -4.375 -22.455 303 HG2 GLU 21 1HG GLU 21 11.844 -4.542 -24.606 304 HG3 GLU 21 2HG GLU 21 10.421 -3.873 -23.780 305 H ARG 22 H ARG 22 10.717 -7.768 -20.732 306 HA ARG 22 HA ARG 22 11.208 -8.752 -18.667 307 HB2 ARG 22 1HB ARG 22 14.054 -7.885 -19.247 308 HB3 ARG 22 2HB ARG 22 13.511 -9.305 -18.340 309 HG2 ARG 22 1HG ARG 22 12.515 -10.230 -20.344 310 HG3 ARG 22 2HG ARG 22 13.194 -8.883 -21.295 311 HD2 ARG 22 1HD ARG 22 14.603 -10.699 -21.567 312 HD3 ARG 22 2HD ARG 22 15.474 -9.538 -20.505 313 HE ARG 22 HE ARG 22 13.936 -11.377 -18.911 314 HH11 ARG 22 1HH1 ARG 22 16.941 -11.362 -20.862 315 HH12 ARG 22 2HH1 ARG 22 17.658 -12.700 -19.971 316 HH21 ARG 22 1HH2 ARG 22 14.878 -13.015 -17.785 317 HH22 ARG 22 2HH2 ARG 22 16.441 -13.669 -18.217 318 H GLY 23 H GLY 23 10.763 -5.746 -18.472 319 HA2 GLY 23 1HA GLY 23 12.543 -4.878 -16.410 320 HA3 GLY 23 2HA GLY 23 11.125 -4.026 -16.938 321 H PHE 24 H PHE 24 11.823 -7.160 -15.263 322 HA PHE 24 HA PHE 24 10.516 -6.138 -12.826 323 HB2 PHE 24 1HB PHE 24 8.797 -7.970 -12.808 324 HB3 PHE 24 2HB PHE 24 8.534 -6.804 -14.101 325 HD1 PHE 24 HD2 PHE 24 9.010 -7.456 -16.502 326 HD2 PHE 24 HD1 PHE 24 9.333 -10.209 -13.181 327 HE1 PHE 24 HE2 PHE 24 9.054 -9.293 -18.063 328 HE2 PHE 24 HE1 PHE 24 9.423 -12.128 -14.770 329 HZ PHE 24 HZ PHE 24 9.320 -11.642 -17.196 330 H PHE 25 H PHE 25 11.927 -8.832 -14.705 331 HA PHE 25 HA PHE 25 13.252 -10.591 -14.162 332 HB2 PHE 25 1HB PHE 25 14.732 -8.598 -13.418 333 HB3 PHE 25 2HB PHE 25 14.248 -9.006 -11.757 334 HD1 PHE 25 HD1 PHE 25 16.053 -10.119 -14.850 335 HD2 PHE 25 HD2 PHE 25 15.195 -11.109 -10.750 336 HE1 PHE 25 HE1 PHE 25 17.724 -11.939 -14.956 337 HE2 PHE 25 HE2 PHE 25 16.922 -12.957 -10.866 338 HZ PHE 25 HZ PHE 25 18.209 -13.307 -12.918 339 H NVA 26 H ARX 26 11.925 -12.204 -13.644 340 HA NVA 26 HA ARX 26 11.062 -12.688 -10.856 341 HB2 NVA 26 1HB ARX 26 9.679 -13.437 -12.858 342 HB3 NVA 26 2HB ARX 26 10.915 -14.549 -13.242 343 HG2 NVA 26 1HG ARX 26 10.232 -15.070 -10.550 344 HG3 NVA 26 2HG ARX 26 8.742 -14.665 -11.294 345 HD2 NVA 26 1HD ARX 26 8.754 -16.453 -12.900 346 HD3 NVA 26 2HD ARX 26 10.523 -16.810 -12.639 347 H THR 27 H THR 27 12.502 -13.225 -9.371 348 HA THR 27 HA THR 27 14.954 -14.646 -9.799 349 HB THR 27 HB THR 27 14.865 -14.862 -7.296 350 HG1 THR 27 HG1 THR 27 12.693 -14.977 -6.952 351 HG21 THR 27 1HG2 THR 27 15.767 -12.860 -8.494 352 HG22 THR 27 2HG2 THR 27 15.200 -12.536 -6.868 353 HG23 THR 27 3HG2 THR 27 14.228 -12.050 -8.242 354 HA PRO 28 HA PRO 28 13.358 -18.614 -10.406 355 HB2 PRO 28 1HB PRO 28 15.000 -20.328 -9.011 356 HB3 PRO 28 2HB PRO 28 15.509 -19.439 -10.472 357 HG2 PRO 28 1HG PRO 28 16.010 -18.702 -7.610 358 HG3 PRO 28 2HG PRO 28 17.136 -18.816 -8.980 359 HD2 PRO 28 1HD PRO 28 16.166 -16.483 -8.369 360 HD3 PRO 28 2HD PRO 28 16.277 -16.909 -10.099 361 H HIX 29 H HIX 29 11.809 -19.829 -9.902 362 HA HIX 29 HA HIX 29 11.088 -20.534 -7.119 363 HB1 HIX 29 1HB HIX 29 8.661 -19.940 -7.609 364 HB2 HIX 29 2HB HIX 29 9.752 -18.599 -7.298 365 HD2 HIX 29 HD2 HIX 29 10.883 -17.585 -9.920 366 HD1 HIX 29 HD1 HIX 29 7.056 -19.089 -9.514 367 HE1 HIX 29 HE1 HIX 29 8.085 -18.883 -11.845 368 H THR 30 H THR 30 11.608 -22.601 -7.245 369 HA THR 30 HA THR 30 10.512 -24.287 -9.453 370 HB THR 30 HB THR 30 12.544 -24.997 -7.274 371 HG1 THR 30 HG1 THR 30 12.746 -23.999 -9.955 372 HG21 THR 30 1HG2 THR 30 11.492 -26.988 -8.216 373 HG22 THR 30 2HG2 THR 30 13.127 -26.809 -8.913 374 HG23 THR 30 3HG2 THR 30 11.672 -26.339 -9.853 Start of MODEL 21 1 H1 GLY 1 1H GLY 1 1.023 3.126 -2.492 2 H2 GLY 1 2H GLY 1 1.706 2.715 -1.112 3 H3 GLY 1 3H GLY 1 2.269 2.107 -2.522 4 HA2 GLY 1 1HA GLY 1 1.011 0.395 -1.460 5 HA3 GLY 1 2HA GLY 1 -0.354 1.539 -1.391 6 H ILE 2 H ILE 2 0.966 -0.970 -3.232 7 HA ILE 2 HA ILE 2 -0.905 -0.319 -5.379 8 HB ILE 2 HB ILE 2 1.228 0.627 -6.098 9 HG12 ILE 2 1HG1 ILE 2 0.496 -1.882 -7.657 10 HG13 ILE 2 2HG1 ILE 2 -0.336 -0.368 -7.793 11 HG21 ILE 2 1HG2 ILE 2 2.744 -0.893 -4.783 12 HG22 ILE 2 2HG2 ILE 2 2.422 -2.185 -5.938 13 HG23 ILE 2 3HG2 ILE 2 3.250 -0.710 -6.475 14 HD11 ILE 2 3HD1 ILE 2 1.938 0.685 -8.467 15 HD12 ILE 2 1HD1 ILE 2 2.487 -0.996 -8.718 16 HD13 ILE 2 2HD1 ILE 2 1.136 -0.386 -9.637 17 H VAL 3 H VAL 3 1.187 -2.868 -3.936 18 HA VAL 3 HA VAL 3 0.247 -4.904 -5.596 19 HB VAL 3 HB VAL 3 1.376 -5.152 -2.741 20 HG11 VAL 3 1HG1 VAL 3 2.060 -7.506 -3.536 21 HG12 VAL 3 2HG1 VAL 3 0.296 -7.260 -3.301 22 HG13 VAL 3 3HG1 VAL 3 0.971 -7.257 -4.946 23 HG21 VAL 3 3HG2 VAL 3 2.866 -5.536 -5.385 24 HG22 VAL 3 1HG2 VAL 3 2.849 -4.013 -4.498 25 HG23 VAL 3 2HG2 VAL 3 3.528 -5.466 -3.757 26 H GLU 4 H GLU 4 -0.906 -3.720 -2.403 27 HA GLU 4 HA GLU 4 -2.817 -5.717 -1.884 28 HB2 GLU 4 1HB GLU 4 -2.284 -2.972 -1.102 29 HB3 GLU 4 2HB GLU 4 -3.983 -3.383 -1.036 30 HG2 GLU 4 1HG GLU 4 -2.045 -5.274 0.148 31 HG3 GLU 4 2HG GLU 4 -2.229 -3.708 0.958 32 H GLN 5 H GLN 5 -3.116 -2.895 -4.015 33 HA GLN 5 HA GLN 5 -5.945 -3.373 -4.616 34 HB2 GLN 5 1HB GLN 5 -4.634 -1.231 -4.684 35 HB3 GLN 5 2HB GLN 5 -3.981 -1.693 -6.248 36 HG2 GLN 5 1HG GLN 5 -6.295 -1.873 -7.118 37 HG3 GLN 5 2HG GLN 5 -6.946 -1.428 -5.527 38 HE21 GLN 5 2HE2 GLN 5 -7.475 0.069 -7.838 39 HE22 GLN 5 1HE2 GLN 5 -6.703 1.597 -7.713 40 H CYS 6 H CYS 6 -2.846 -4.000 -6.297 41 HA CYS 6 HA CYS 6 -4.025 -5.050 -8.642 42 HB2 CYS 6 1HB CYS 6 -1.627 -4.319 -8.186 43 HB3 CYS 6 2HB CYS 6 -1.394 -5.921 -7.463 44 H CYS 7 H CYS 7 -3.543 -6.338 -5.456 45 HA CYS 7 HA CYS 7 -4.050 -9.137 -6.192 46 HB2 CYS 7 1HB CYS 7 -3.584 -7.611 -3.652 47 HB3 CYS 7 2HB CYS 7 -4.507 -9.104 -3.519 48 H THR 8 H THR 8 -5.815 -7.001 -3.917 49 HA THR 8 HA THR 8 -8.188 -8.636 -4.019 50 HB THR 8 HB THR 8 -8.409 -5.825 -2.998 51 HG1 THR 8 HG1 THR 8 -6.411 -6.023 -2.335 52 HG21 THR 8 1HG2 THR 8 -8.690 -8.548 -1.644 53 HG22 THR 8 2HG2 THR 8 -10.017 -7.757 -2.425 54 HG23 THR 8 3HG2 THR 8 -9.292 -7.032 -1.043 55 H SER 9 H SER 9 -7.362 -6.961 -6.593 56 HA SER 9 HA SER 9 -10.157 -6.743 -7.374 57 HB2 SER 9 1HB SER 9 -10.250 -4.362 -7.868 58 HB3 SER 9 2HB SER 9 -9.764 -4.573 -6.168 59 HG SER 9 HG SER 9 -7.487 -4.335 -7.067 60 H ILE 10 H ILE 10 -10.183 -5.526 -9.684 61 HA ILE 10 HA ILE 10 -8.468 -7.135 -11.405 62 HB ILE 10 HB ILE 10 -10.325 -4.771 -11.979 63 HG12 ILE 10 1HG1 ILE 10 -11.485 -6.856 -11.250 64 HG13 ILE 10 2HG1 ILE 10 -11.803 -6.424 -12.945 65 HG21 ILE 10 1HG2 ILE 10 -8.700 -4.678 -13.723 66 HG22 ILE 10 2HG2 ILE 10 -8.543 -6.435 -13.827 67 HG23 ILE 10 3HG2 ILE 10 -9.999 -5.641 -14.421 68 HD11 ILE 10 3HD1 ILE 10 -10.359 -8.177 -13.798 69 HD12 ILE 10 1HD1 ILE 10 -9.834 -8.581 -12.149 70 HD13 ILE 10 2HD1 ILE 10 -11.530 -8.879 -12.630 71 H CYS 11 H CYS 11 -6.350 -6.567 -11.824 72 HA CYS 11 HA CYS 11 -5.345 -4.172 -10.702 73 HB2 CYS 11 1HB CYS 11 -4.251 -6.394 -10.858 74 HB3 CYS 11 2HB CYS 11 -3.891 -6.024 -12.550 75 H SER 12 H SER 12 -5.286 -2.166 -11.548 76 HA SER 12 HA SER 12 -6.236 -1.578 -14.193 77 HB2 SER 12 1HB SER 12 -4.486 0.142 -12.443 78 HB3 SER 12 2HB SER 12 -5.583 0.684 -13.686 79 HG SER 12 HG SER 12 -6.199 -0.302 -11.146 80 H LEU 13 H LEU 13 -5.228 -0.897 -16.090 81 HA LEU 13 HA LEU 13 -2.738 -2.259 -16.721 82 HB2 LEU 13 1HB LEU 13 -4.321 -1.750 -18.475 83 HB3 LEU 13 2HB LEU 13 -4.307 -0.029 -18.091 84 HG LEU 13 HG LEU 13 -1.867 0.061 -18.877 85 HD11 LEU 13 1HD1 LEU 13 -0.888 -1.724 -20.073 86 HD12 LEU 13 2HD1 LEU 13 -2.405 -2.642 -20.074 87 HD13 LEU 13 3HD1 LEU 13 -1.509 -2.443 -18.560 88 HD21 LEU 13 3HD2 LEU 13 -3.757 -0.879 -21.097 89 HD22 LEU 13 1HD2 LEU 13 -2.237 0.033 -21.302 90 HD23 LEU 13 2HD2 LEU 13 -3.637 0.783 -20.493 91 H TYR 14 H TYR 14 -3.330 1.178 -15.760 92 HA TYR 14 HA TYR 14 -0.607 1.857 -16.349 93 HB2 TYR 14 1HB TYR 14 -1.165 3.977 -14.937 94 HB3 TYR 14 2HB TYR 14 -2.148 3.697 -16.367 95 HD1 TYR 14 HD2 TYR 14 -4.504 3.128 -16.203 96 HD2 TYR 14 HD1 TYR 14 -2.152 3.883 -12.674 97 HE1 TYR 14 HE2 TYR 14 -6.558 3.224 -14.831 98 HE2 TYR 14 HE1 TYR 14 -4.232 3.944 -11.299 99 HH TYR 14 HH TYR 14 -7.474 3.354 -12.854 100 H GLN 15 H GLN 15 -2.328 0.640 -13.482 101 HA GLN 15 HA GLN 15 -0.030 0.891 -11.740 102 HB2 GLN 15 1HB GLN 15 -2.442 -0.910 -11.625 103 HB3 GLN 15 2HB GLN 15 -1.205 -0.849 -10.379 104 HG2 GLN 15 1HG GLN 15 -1.672 1.568 -10.066 105 HG3 GLN 15 2HG GLN 15 -2.877 1.483 -11.361 106 HE21 GLN 15 2HE2 GLN 15 -2.486 1.559 -8.104 107 HE22 GLN 15 1HE2 GLN 15 -4.009 0.760 -7.650 108 H LEU 16 H LEU 16 -1.208 -1.678 -14.052 109 HA LEU 16 HA LEU 16 0.814 -3.474 -13.108 110 HB2 LEU 16 1HB LEU 16 -1.337 -3.904 -14.445 111 HB3 LEU 16 2HB LEU 16 -0.482 -3.389 -15.871 112 HG LEU 16 HG LEU 16 -0.777 -5.920 -15.127 113 HD11 LEU 16 1HD1 LEU 16 1.123 -6.424 -16.703 114 HD12 LEU 16 2HD1 LEU 16 1.626 -4.714 -16.556 115 HD13 LEU 16 3HD1 LEU 16 0.047 -5.122 -17.245 116 HD21 LEU 16 3HD2 LEU 16 1.901 -5.332 -13.887 117 HD22 LEU 16 1HD2 LEU 16 1.300 -6.952 -14.289 118 HD23 LEU 16 2HD2 LEU 16 0.494 -5.980 -13.051 119 H GLU 17 H GLU 17 0.774 -1.070 -15.749 120 HA GLU 17 HA GLU 17 3.411 -1.572 -16.776 121 HB2 GLU 17 1HB GLU 17 1.712 0.961 -16.650 122 HB3 GLU 17 2HB GLU 17 3.265 0.898 -17.452 123 HG2 GLU 17 1HG GLU 17 1.381 -1.289 -18.185 124 HG3 GLU 17 2HG GLU 17 0.885 0.353 -18.599 125 H ASN 18 H ASN 18 2.298 0.277 -13.920 126 HA ASN 18 HA ASN 18 4.859 1.646 -13.561 127 HB2 ASN 18 1HB ASN 18 2.457 1.897 -12.475 128 HB3 ASN 18 2HB ASN 18 3.129 0.801 -11.279 129 HD21 ASN 18 2HD2 ASN 18 4.321 1.729 -9.683 130 HD22 ASN 18 1HD2 ASN 18 4.866 3.384 -9.678 131 H TYR 19 H TYR 19 4.093 -1.639 -13.185 132 HA TYR 19 HA TYR 19 6.197 -2.086 -11.209 133 HB2 TYR 19 1HB TYR 19 4.540 -4.064 -12.794 134 HB3 TYR 19 2HB TYR 19 5.907 -4.511 -11.783 135 HD1 TYR 19 HD1 TYR 19 5.663 -3.671 -9.253 136 HD2 TYR 19 HD2 TYR 19 2.434 -4.179 -12.035 137 HE1 TYR 19 HE1 TYR 19 4.000 -3.889 -7.349 138 HE2 TYR 19 HE2 TYR 19 0.770 -4.288 -10.172 139 HH TYR 19 HH TYR 19 1.904 -4.277 -6.819 140 H CYS 20 H CYS 20 5.986 -1.503 -14.609 141 HA CYS 20 HA CYS 20 8.495 -3.100 -15.161 142 HB2 CYS 20 1HB CYS 20 6.294 -3.172 -16.570 143 HB3 CYS 20 2HB CYS 20 6.733 -1.551 -17.118 144 H ASN 21 H ASN 21 10.128 -1.833 -16.441 145 HA ASN 21 HA ASN 21 10.672 0.706 -15.156 146 HB2 ASN 21 1HB ASN 21 12.776 0.771 -16.466 147 HB3 ASN 21 2HB ASN 21 12.528 -0.842 -15.792 148 HD21 ASN 21 2HD2 ASN 21 13.774 -1.906 -17.242 149 HD22 ASN 21 1HD2 ASN 21 13.356 -2.028 -18.955 150 H1 PHE 1 1H PHE 1 -3.625 -5.285 -23.038 151 H2 PHE 1 2H PHE 1 -2.009 -5.847 -23.174 152 H3 PHE 1 3H PHE 1 -3.225 -6.797 -23.596 153 HA PHE 1 HA PHE 1 -2.420 -7.420 -21.455 154 HB2 PHE 1 1HB PHE 1 -1.605 -5.248 -20.770 155 HB3 PHE 1 2HB PHE 1 -3.230 -4.578 -20.794 156 HD1 PHE 1 HD1 PHE 1 -1.698 -7.675 -19.307 157 HD2 PHE 1 HD2 PHE 1 -3.840 -4.026 -18.564 158 HE1 PHE 1 HE1 PHE 1 -2.024 -8.364 -16.987 159 HE2 PHE 1 HE2 PHE 1 -4.138 -4.677 -16.255 160 HZ PHE 1 HZ PHE 1 -3.206 -6.836 -15.378 161 H VAL 2 H VAL 2 -3.864 -8.813 -20.592 162 HA VAL 2 HA VAL 2 -6.745 -8.139 -20.767 163 HB VAL 2 HB VAL 2 -5.335 -10.705 -19.982 164 HG11 VAL 2 1HG1 VAL 2 -7.620 -10.432 -18.955 165 HG12 VAL 2 2HG1 VAL 2 -8.300 -10.153 -20.563 166 HG13 VAL 2 3HG1 VAL 2 -7.588 -11.711 -20.120 167 HG21 VAL 2 3HG2 VAL 2 -4.951 -10.433 -22.355 168 HG22 VAL 2 1HG2 VAL 2 -6.330 -11.510 -22.201 169 HG23 VAL 2 2HG2 VAL 2 -6.594 -9.800 -22.604 170 H ASN 3 H ASN 3 -7.300 -6.936 -19.142 171 HA ASN 3 HA ASN 3 -5.920 -6.861 -16.646 172 HB2 ASN 3 1HB ASN 3 -8.703 -5.960 -17.422 173 HB3 ASN 3 2HB ASN 3 -7.880 -5.500 -15.925 174 HD21 ASN 3 2HD2 ASN 3 -6.718 -3.786 -15.854 175 HD22 ASN 3 1HD2 ASN 3 -6.251 -2.837 -17.249 176 H GLN 4 H GLN 4 -5.974 -7.915 -14.919 177 HA GLN 4 HA GLN 4 -8.267 -9.765 -14.311 178 HB2 GLN 4 1HB GLN 4 -5.776 -10.474 -15.519 179 HB3 GLN 4 2HB GLN 4 -5.747 -11.074 -13.841 180 HG2 GLN 4 1HG GLN 4 -7.573 -12.500 -14.250 181 HG3 GLN 4 2HG GLN 4 -8.094 -11.554 -15.657 182 HE21 GLN 4 2HE2 GLN 4 -5.924 -14.051 -14.506 183 HE22 GLN 4 1HE2 GLN 4 -5.316 -14.529 -16.099 184 H HIS 5 H HIS 5 -7.892 -10.712 -12.111 185 HA HIS 5 HA HIS 5 -6.665 -8.995 -10.083 186 HB2 HIS 5 1HB HIS 5 -7.871 -11.796 -10.088 187 HB3 HIS 5 2HB HIS 5 -7.117 -11.029 -8.695 188 HD1 HIS 5 HD1 HIS 5 -10.039 -10.227 -11.045 189 HD2 HIS 5 HD2 HIS 5 -8.780 -9.757 -7.108 190 HE1 HIS 5 HE1 HIS 5 -11.900 -9.025 -9.806 191 H LEU 6 H LEU 6 -4.420 -9.160 -9.591 192 HA LEU 6 HA LEU 6 -3.031 -11.545 -10.774 193 HB2 LEU 6 1HB LEU 6 -1.882 -8.755 -10.437 194 HB3 LEU 6 2HB LEU 6 -1.038 -10.151 -11.104 195 HG LEU 6 HG LEU 6 -3.509 -8.923 -12.346 196 HD11 LEU 6 1HD1 LEU 6 -1.890 -7.966 -13.955 197 HD12 LEU 6 2HD1 LEU 6 -0.515 -8.644 -12.994 198 HD13 LEU 6 3HD1 LEU 6 -1.611 -7.390 -12.289 199 HD21 LEU 6 3HD2 LEU 6 -1.498 -10.844 -13.593 200 HD22 LEU 6 1HD2 LEU 6 -2.981 -10.191 -14.322 201 HD23 LEU 6 2HD2 LEU 6 -3.104 -11.326 -12.955 202 H CYS 7 H CYS 7 -4.005 -11.677 -8.110 203 HA CYS 7 HA CYS 7 -1.761 -11.140 -6.340 204 HB2 CYS 7 1HB CYS 7 -4.346 -11.203 -5.866 205 HB3 CYS 7 2HB CYS 7 -4.040 -12.921 -5.541 206 H GLY 8 H GLY 8 -0.157 -12.447 -7.597 207 HA2 GLY 8 1HA GLY 8 0.796 -14.711 -6.466 208 HA3 GLY 8 2HA GLY 8 -0.473 -15.354 -7.531 209 H SER 9 H SER 9 1.284 -16.493 -8.684 210 HA SER 9 HA SER 9 3.326 -15.064 -10.062 211 HB2 SER 9 1HB SER 9 2.098 -17.613 -11.094 212 HB3 SER 9 2HB SER 9 3.822 -17.173 -11.024 213 HG SER 9 HG SER 9 3.797 -18.336 -9.243 214 H HIS 10 H HIS 10 -0.040 -15.050 -10.876 215 HA HIS 10 HA HIS 10 0.310 -14.912 -13.735 216 HB2 HIS 10 1HB HIS 10 -1.882 -13.794 -11.993 217 HB3 HIS 10 2HB HIS 10 -1.910 -13.795 -13.739 218 HD1 HIS 10 HD1 HIS 10 -4.014 -15.418 -11.881 219 HD2 HIS 10 HD2 HIS 10 -0.669 -17.015 -13.803 220 HE1 HIS 10 HE1 HIS 10 -4.505 -17.868 -12.258 221 H LEU 11 H LEU 11 0.972 -12.712 -11.043 222 HA LEU 11 HA LEU 11 0.846 -10.297 -12.569 223 HB2 LEU 11 1HB LEU 11 0.908 -10.550 -10.087 224 HB3 LEU 11 2HB LEU 11 2.604 -10.968 -10.121 225 HG LEU 11 HG LEU 11 1.846 -8.413 -11.366 226 HD11 LEU 11 1HD1 LEU 11 1.927 -8.706 -8.345 227 HD12 LEU 11 2HD1 LEU 11 0.520 -8.238 -9.294 228 HD13 LEU 11 3HD1 LEU 11 1.923 -7.153 -9.224 229 HD21 LEU 11 3HD2 LEU 11 4.180 -9.178 -11.263 230 HD22 LEU 11 1HD2 LEU 11 4.092 -9.263 -9.490 231 HD23 LEU 11 2HD2 LEU 11 3.996 -7.693 -10.312 232 H VAL 12 H VAL 12 3.346 -12.788 -12.144 233 HA VAL 12 HA VAL 12 5.446 -11.272 -13.370 234 HB VAL 12 HB VAL 12 5.041 -14.320 -13.341 235 HG11 VAL 12 1HG1 VAL 12 7.549 -12.610 -13.661 236 HG12 VAL 12 2HG1 VAL 12 7.522 -14.371 -13.587 237 HG13 VAL 12 3HG1 VAL 12 6.777 -13.526 -14.943 238 HG21 VAL 12 3HG2 VAL 12 6.500 -14.293 -11.367 239 HG22 VAL 12 1HG2 VAL 12 6.485 -12.540 -11.375 240 HG23 VAL 12 2HG2 VAL 12 4.989 -13.425 -11.038 241 H GLU 13 H GLU 13 3.057 -13.589 -14.660 242 HA GLU 13 HA GLU 13 3.975 -13.669 -17.346 243 HB2 GLU 13 1HB GLU 13 1.426 -14.377 -15.889 244 HB3 GLU 13 2HB GLU 13 1.452 -14.492 -17.646 245 HG2 GLU 13 1HG GLU 13 3.610 -15.854 -16.018 246 HG3 GLU 13 2HG GLU 13 2.029 -16.622 -16.205 247 H ALA 14 H ALA 14 1.672 -11.638 -15.646 248 HA ALA 14 HA ALA 14 0.591 -10.275 -17.918 249 HB1 ALA 14 3HB ALA 14 0.900 -9.541 -14.962 250 HB2 ALA 14 1HB ALA 14 0.157 -8.472 -16.147 251 HB3 ALA 14 2HB ALA 14 -0.532 -10.087 -15.860 252 H LEU 15 H LEU 15 3.327 -9.418 -15.674 253 HA LEU 15 HA LEU 15 4.191 -7.133 -17.172 254 HB2 LEU 15 1HB LEU 15 5.462 -8.958 -15.210 255 HB3 LEU 15 2HB LEU 15 6.455 -7.922 -16.156 256 HG LEU 15 HG LEU 15 6.262 -6.779 -14.153 257 HD11 LEU 15 1HD1 LEU 15 3.929 -5.614 -15.732 258 HD12 LEU 15 2HD1 LEU 15 5.643 -5.429 -16.174 259 HD13 LEU 15 3HD1 LEU 15 5.056 -4.790 -14.647 260 HD21 LEU 15 3HD2 LEU 15 4.133 -6.330 -13.002 261 HD22 LEU 15 1HD2 LEU 15 4.749 -7.982 -12.971 262 HD23 LEU 15 2HD2 LEU 15 3.392 -7.540 -14.043 263 H TYR 16 H TYR 16 5.085 -10.645 -17.423 264 HA TYR 16 HA TYR 16 7.135 -10.281 -19.289 265 HB2 TYR 16 1HB TYR 16 6.425 -12.390 -18.183 266 HB3 TYR 16 2HB TYR 16 5.068 -12.479 -19.320 267 HD1 TYR 16 HD1 TYR 16 8.820 -12.577 -19.139 268 HD2 TYR 16 HD2 TYR 16 5.336 -13.207 -21.602 269 HE1 TYR 16 HE1 TYR 16 10.174 -13.757 -20.877 270 HE2 TYR 16 HE2 TYR 16 6.638 -14.418 -23.275 271 HH TYR 16 HH TYR 16 8.802 -14.985 -23.911 272 H LEU 17 H LEU 17 3.612 -10.528 -19.875 273 HA LEU 17 HA LEU 17 3.834 -10.435 -22.706 274 HB2 LEU 17 1HB LEU 17 1.545 -9.798 -20.817 275 HB3 LEU 17 2HB LEU 17 1.404 -9.780 -22.572 276 HG LEU 17 HG LEU 17 2.233 -12.268 -21.076 277 HD11 LEU 17 1HD1 LEU 17 0.031 -11.671 -20.206 278 HD12 LEU 17 2HD1 LEU 17 -0.086 -13.075 -21.298 279 HD13 LEU 17 3HD1 LEU 17 -0.596 -11.442 -21.861 280 HD21 LEU 17 3HD2 LEU 17 2.765 -12.185 -23.502 281 HD22 LEU 17 1HD2 LEU 17 1.064 -11.837 -23.858 282 HD23 LEU 17 2HD2 LEU 17 1.516 -13.391 -23.155 283 H VAL 18 H VAL 18 3.222 -7.912 -20.192 284 HA VAL 18 HA VAL 18 2.784 -5.850 -22.271 285 HB VAL 18 HB VAL 18 3.103 -5.644 -19.182 286 HG11 VAL 18 1HG1 VAL 18 2.055 -3.470 -21.059 287 HG12 VAL 18 2HG1 VAL 18 2.337 -3.397 -19.268 288 HG13 VAL 18 3HG1 VAL 18 3.735 -3.520 -20.369 289 HG21 VAL 18 3HG2 VAL 18 0.531 -5.101 -19.445 290 HG22 VAL 18 1HG2 VAL 18 0.655 -5.798 -21.104 291 HG23 VAL 18 2HG2 VAL 18 1.013 -6.792 -19.635 292 H CYS 19 H CYS 19 5.578 -6.562 -20.085 293 HA CYS 19 HA CYS 19 7.137 -4.415 -21.282 294 HB2 CYS 19 1HB CYS 19 8.177 -6.821 -19.755 295 HB3 CYS 19 2HB CYS 19 8.960 -5.275 -20.023 296 H GLY 20 H GLY 20 6.062 -7.377 -22.545 297 HA2 GLY 20 1HA GLY 20 6.687 -8.163 -24.697 298 HA3 GLY 20 2HA GLY 20 8.208 -7.293 -24.597 299 H GLU 21 H GLU 21 9.493 -8.130 -22.450 300 HA GLU 21 HA GLU 21 9.007 -10.945 -21.768 301 HB2 GLU 21 1HB GLU 21 11.247 -11.779 -22.497 302 HB3 GLU 21 2HB GLU 21 10.083 -11.525 -23.801 303 HG2 GLU 21 1HG GLU 21 11.197 -9.335 -24.314 304 HG3 GLU 21 2HG GLU 21 12.348 -9.646 -23.026 305 H ARG 22 H ARG 22 11.039 -8.053 -21.698 306 HA ARG 22 HA ARG 22 11.927 -8.836 -18.936 307 HB2 ARG 22 1HB ARG 22 13.684 -7.822 -21.253 308 HB3 ARG 22 2HB ARG 22 14.216 -7.809 -19.541 309 HG2 ARG 22 1HG ARG 22 13.808 -10.252 -19.434 310 HG3 ARG 22 2HG ARG 22 13.485 -10.269 -21.231 311 HD2 ARG 22 1HD ARG 22 15.762 -9.409 -21.612 312 HD3 ARG 22 2HD ARG 22 15.985 -9.284 -19.845 313 HE ARG 22 HE ARG 22 15.179 -11.921 -20.525 314 HH11 ARG 22 1HH1 ARG 22 18.025 -9.842 -20.750 315 HH12 ARG 22 2HH1 ARG 22 19.102 -11.209 -20.714 316 HH21 ARG 22 1HH2 ARG 22 16.633 -13.563 -20.508 317 HH22 ARG 22 2HH2 ARG 22 18.343 -13.261 -20.555 318 H GLY 23 H GLY 23 12.593 -6.898 -17.575 319 HA2 GLY 23 1HA GLY 23 12.725 -4.293 -17.847 320 HA3 GLY 23 2HA GLY 23 11.090 -4.498 -18.455 321 H PHE 24 H PHE 24 11.222 -6.843 -16.265 322 HA PHE 24 HA PHE 24 10.286 -5.011 -14.099 323 HB2 PHE 24 1HB PHE 24 8.670 -6.794 -13.531 324 HB3 PHE 24 2HB PHE 24 8.412 -6.071 -15.137 325 HD1 PHE 24 HD1 PHE 24 9.449 -9.175 -13.376 326 HD2 PHE 24 HD2 PHE 24 8.788 -7.314 -17.178 327 HE1 PHE 24 HE1 PHE 24 9.482 -11.394 -14.496 328 HE2 PHE 24 HE2 PHE 24 8.793 -9.508 -18.311 329 HZ PHE 24 HZ PHE 24 9.192 -11.570 -17.029 330 H PHE 25 H PHE 25 12.318 -7.780 -14.839 331 HA PHE 25 HA PHE 25 13.558 -9.165 -13.622 332 HB2 PHE 25 1HB PHE 25 14.389 -6.739 -13.156 333 HB3 PHE 25 2HB PHE 25 13.910 -7.057 -11.489 334 HD1 PHE 25 HD2 PHE 25 14.903 -9.155 -10.365 335 HD2 PHE 25 HD1 PHE 25 16.407 -7.476 -14.012 336 HE1 PHE 25 HE2 PHE 25 17.088 -10.328 -9.978 337 HE2 PHE 25 HE1 PHE 25 18.624 -8.559 -13.586 338 HZ PHE 25 HZ PHE 25 18.972 -9.989 -11.614 339 H NVA 26 H ARX 26 12.287 -10.802 -13.017 340 HA NVA 26 HA ARX 26 11.202 -10.978 -10.270 341 HB2 NVA 26 1HB ARX 26 9.827 -11.809 -12.260 342 HB3 NVA 26 2HB ARX 26 11.141 -13.002 -12.625 343 HG2 NVA 26 1HG ARX 26 10.527 -13.484 -9.895 344 HG3 NVA 26 2HG ARX 26 9.010 -12.997 -10.467 345 HD2 NVA 26 1HD ARX 26 8.827 -14.827 -11.971 346 HD3 NVA 26 2HD ARX 26 10.568 -15.169 -11.862 347 H THR 27 H THR 27 12.095 -11.975 -8.615 348 HA THR 27 HA THR 27 14.941 -12.908 -8.744 349 HB THR 27 HB THR 27 14.580 -13.313 -6.317 350 HG1 THR 27 HG1 THR 27 12.570 -13.042 -5.463 351 HG21 THR 27 1HG2 THR 27 15.100 -10.991 -7.228 352 HG22 THR 27 2HG2 THR 27 14.391 -11.051 -5.593 353 HG23 THR 27 3HG2 THR 27 13.363 -10.613 -7.004 354 HA PRO 28 HA PRO 28 13.717 -17.127 -9.271 355 HB2 PRO 28 1HB PRO 28 15.182 -18.682 -7.605 356 HB3 PRO 28 2HB PRO 28 15.954 -17.757 -8.964 357 HG2 PRO 28 1HG PRO 28 15.709 -16.988 -6.056 358 HG3 PRO 28 2HG PRO 28 17.184 -17.033 -7.165 359 HD2 PRO 28 1HD PRO 28 15.900 -14.777 -6.695 360 HD3 PRO 28 2HD PRO 28 16.604 -15.170 -8.331 361 H HIX 29 H HIX 29 12.118 -18.437 -8.681 362 HA HIX 29 HA HIX 29 11.218 -18.759 -5.908 363 HB1 HIX 29 1HB HIX 29 8.849 -18.277 -6.678 364 HB2 HIX 29 2HB HIX 29 9.825 -16.885 -6.401 365 HD2 HIX 29 HD2 HIX 29 10.373 -15.226 -8.486 366 HD1 HIX 29 HD1 HIX 29 8.314 -18.719 -9.344 367 HE1 HIX 29 HE1 HIX 29 9.405 -17.499 -11.292 368 H THR 30 H THR 30 11.772 -20.761 -5.939 369 HA THR 30 HA THR 30 10.122 -22.751 -7.337 370 HB THR 30 HB THR 30 12.274 -22.435 -8.642 371 HG1 THR 30 HG1 THR 30 11.479 -24.863 -7.324 372 HG21 THR 30 1HG2 THR 30 13.594 -23.516 -6.122 373 HG22 THR 30 2HG2 THR 30 13.875 -21.939 -6.856 374 HG23 THR 30 3HG2 THR 30 14.344 -23.410 -7.709 Start of MODEL 22 1 H1 GLY 1 1H GLY 1 1.797 -3.552 0.514 2 H2 GLY 1 2H GLY 1 2.508 -2.558 1.572 3 H3 GLY 1 3H GLY 1 1.101 -2.142 0.956 4 HA2 GLY 1 1HA GLY 1 2.832 -0.833 -0.062 5 HA3 GLY 1 2HA GLY 1 3.616 -2.339 -0.595 6 H ILE 2 H ILE 2 3.365 -2.584 -2.748 7 HA ILE 2 HA ILE 2 0.798 -1.743 -3.965 8 HB ILE 2 HB ILE 2 2.823 -0.522 -4.587 9 HG12 ILE 2 1HG1 ILE 2 1.585 -2.084 -6.832 10 HG13 ILE 2 2HG1 ILE 2 0.895 -0.659 -6.015 11 HG21 ILE 2 1HG2 ILE 2 4.613 -1.561 -5.978 12 HG22 ILE 2 2HG2 ILE 2 4.503 -2.324 -4.340 13 HG23 ILE 2 3HG2 ILE 2 3.859 -3.177 -5.783 14 HD11 ILE 2 3HD1 ILE 2 3.276 -0.755 -7.911 15 HD12 ILE 2 1HD1 ILE 2 1.780 0.245 -7.980 16 HD13 ILE 2 2HD1 ILE 2 3.048 0.595 -6.738 17 H VAL 3 H VAL 3 3.141 -4.360 -3.689 18 HA VAL 3 HA VAL 3 2.045 -5.851 -5.816 19 HB VAL 3 HB VAL 3 3.715 -6.948 -3.537 20 HG11 VAL 3 1HG1 VAL 3 2.982 -8.108 -6.226 21 HG12 VAL 3 2HG1 VAL 3 4.214 -8.759 -5.148 22 HG13 VAL 3 3HG1 VAL 3 2.554 -8.755 -4.610 23 HG21 VAL 3 3HG2 VAL 3 5.611 -6.769 -5.098 24 HG22 VAL 3 1HG2 VAL 3 4.533 -6.007 -6.293 25 HG23 VAL 3 2HG2 VAL 3 4.900 -5.184 -4.751 26 H GLU 4 H GLU 4 1.508 -6.386 -2.252 27 HA GLU 4 HA GLU 4 -0.389 -8.442 -2.583 28 HB2 GLU 4 1HB GLU 4 -1.108 -7.926 -0.391 29 HB3 GLU 4 2HB GLU 4 0.625 -7.818 -0.441 30 HG2 GLU 4 1HG GLU 4 0.386 -5.289 -0.647 31 HG3 GLU 4 2HG GLU 4 -1.341 -5.500 -0.233 32 H GLN 5 H GLN 5 -0.762 -4.927 -2.876 33 HA GLN 5 HA GLN 5 -3.627 -5.041 -2.799 34 HB2 GLN 5 1HB GLN 5 -1.673 -2.866 -3.731 35 HB3 GLN 5 2HB GLN 5 -3.408 -2.722 -3.830 36 HG2 GLN 5 1HG GLN 5 -3.336 -3.405 -1.285 37 HG3 GLN 5 2HG GLN 5 -1.638 -2.965 -1.351 38 HE21 GLN 5 2HE2 GLN 5 -1.197 -0.760 -1.148 39 HE22 GLN 5 1HE2 GLN 5 -2.441 0.474 -1.229 40 H CYS 6 H CYS 6 -1.356 -4.942 -5.493 41 HA CYS 6 HA CYS 6 -3.511 -5.103 -7.465 42 HB2 CYS 6 1HB CYS 6 -0.769 -4.517 -7.512 43 HB3 CYS 6 2HB CYS 6 -0.961 -5.941 -8.519 44 H CYS 7 H CYS 7 -1.709 -7.482 -5.653 45 HA CYS 7 HA CYS 7 -2.533 -9.730 -7.266 46 HB2 CYS 7 1HB CYS 7 -1.423 -9.303 -4.547 47 HB3 CYS 7 2HB CYS 7 -2.548 -10.641 -4.682 48 H THR 8 H THR 8 -4.011 -7.801 -4.568 49 HA THR 8 HA THR 8 -6.406 -9.488 -4.632 50 HB THR 8 HB THR 8 -6.195 -6.811 -3.173 51 HG1 THR 8 HG1 THR 8 -4.323 -7.916 -2.602 52 HG21 THR 8 1HG2 THR 8 -7.428 -9.517 -2.454 53 HG22 THR 8 2HG2 THR 8 -8.338 -8.132 -3.060 54 HG23 THR 8 3HG2 THR 8 -7.512 -8.002 -1.501 55 H SER 9 H SER 9 -5.673 -8.206 -7.197 56 HA SER 9 HA SER 9 -8.144 -6.711 -7.706 57 HB2 SER 9 1HB SER 9 -6.285 -5.156 -6.709 58 HB3 SER 9 2HB SER 9 -5.535 -5.309 -8.297 59 HG SER 9 HG SER 9 -7.112 -3.553 -7.709 60 H ILE 10 H ILE 10 -8.297 -5.691 -9.893 61 HA ILE 10 HA ILE 10 -7.618 -7.682 -11.961 62 HB ILE 10 HB ILE 10 -9.025 -4.959 -12.058 63 HG12 ILE 10 1HG1 ILE 10 -10.254 -6.757 -10.859 64 HG13 ILE 10 2HG1 ILE 10 -11.067 -6.208 -12.314 65 HG21 ILE 10 1HG2 ILE 10 -8.056 -5.353 -14.329 66 HG22 ILE 10 2HG2 ILE 10 -8.617 -7.049 -14.308 67 HG23 ILE 10 3HG2 ILE 10 -9.784 -5.723 -14.412 68 HD11 ILE 10 3HD1 ILE 10 -9.469 -8.809 -12.172 69 HD12 ILE 10 1HD1 ILE 10 -11.228 -8.703 -12.028 70 HD13 ILE 10 2HD1 ILE 10 -10.449 -8.264 -13.547 71 H CYS 11 H CYS 11 -6.709 -4.510 -10.883 72 HA CYS 11 HA CYS 11 -5.192 -2.966 -11.412 73 HB2 CYS 11 1HB CYS 11 -3.642 -5.183 -12.714 74 HB3 CYS 11 2HB CYS 11 -3.044 -3.626 -12.115 75 H SER 12 H SER 12 -4.943 -1.302 -12.817 76 HA SER 12 HA SER 12 -6.102 -1.624 -15.467 77 HB2 SER 12 1HB SER 12 -4.645 0.790 -14.323 78 HB3 SER 12 2HB SER 12 -5.856 0.714 -15.638 79 HG SER 12 HG SER 12 -7.053 1.293 -14.000 80 H LEU 13 H LEU 13 -4.899 -1.216 -17.397 81 HA LEU 13 HA LEU 13 -2.397 -2.466 -17.596 82 HB2 LEU 13 1HB LEU 13 -4.101 -2.130 -19.443 83 HB3 LEU 13 2HB LEU 13 -3.635 -0.435 -19.443 84 HG LEU 13 HG LEU 13 -1.332 -1.040 -20.207 85 HD11 LEU 13 1HD1 LEU 13 -2.482 -3.846 -20.491 86 HD12 LEU 13 2HD1 LEU 13 -1.157 -3.334 -19.427 87 HD13 LEU 13 3HD1 LEU 13 -0.968 -3.288 -21.185 88 HD21 LEU 13 3HD2 LEU 13 -3.743 -1.956 -21.833 89 HD22 LEU 13 1HD2 LEU 13 -2.105 -1.713 -22.509 90 HD23 LEU 13 2HD2 LEU 13 -2.999 -0.321 -21.757 91 H TYR 14 H TYR 14 -3.016 1.074 -17.479 92 HA TYR 14 HA TYR 14 -0.219 1.663 -17.801 93 HB2 TYR 14 1HB TYR 14 -0.960 3.950 -16.789 94 HB3 TYR 14 2HB TYR 14 -1.618 3.470 -18.369 95 HD1 TYR 14 HD2 TYR 14 -2.368 3.744 -14.744 96 HD2 TYR 14 HD1 TYR 14 -3.939 3.042 -18.727 97 HE1 TYR 14 HE2 TYR 14 -4.735 4.001 -13.916 98 HE2 TYR 14 HE1 TYR 14 -6.290 3.262 -17.851 99 HH TYR 14 HH TYR 14 -7.544 3.966 -15.922 100 H GLN 15 H GLN 15 -2.122 0.599 -15.056 101 HA GLN 15 HA GLN 15 -0.223 1.631 -13.037 102 HB2 GLN 15 1HB GLN 15 -2.487 -0.357 -12.865 103 HB3 GLN 15 2HB GLN 15 -1.452 0.079 -11.535 104 HG2 GLN 15 1HG GLN 15 -2.076 2.393 -11.592 105 HG3 GLN 15 2HG GLN 15 -3.113 2.172 -13.032 106 HE21 GLN 15 2HE2 GLN 15 -3.792 3.093 -10.337 107 HE22 GLN 15 1HE2 GLN 15 -5.037 2.064 -9.798 108 H LEU 16 H LEU 16 -0.835 -1.335 -14.852 109 HA LEU 16 HA LEU 16 1.224 -2.972 -13.641 110 HB2 LEU 16 1HB LEU 16 -0.620 -3.164 -15.819 111 HB3 LEU 16 2HB LEU 16 0.996 -3.525 -16.433 112 HG LEU 16 HG LEU 16 0.005 -4.870 -13.943 113 HD11 LEU 16 1HD1 LEU 16 -0.587 -5.919 -16.711 114 HD12 LEU 16 2HD1 LEU 16 -1.745 -5.080 -15.648 115 HD13 LEU 16 3HD1 LEU 16 -1.025 -6.581 -15.136 116 HD21 LEU 16 3HD2 LEU 16 1.525 -6.596 -14.551 117 HD22 LEU 16 1HD2 LEU 16 2.373 -5.071 -14.763 118 HD23 LEU 16 2HD2 LEU 16 1.745 -5.912 -16.209 119 H GLU 17 H GLU 17 1.216 -0.675 -16.457 120 HA GLU 17 HA GLU 17 3.970 -1.010 -16.926 121 HB2 GLU 17 1HB GLU 17 2.043 1.196 -17.622 122 HB3 GLU 17 2HB GLU 17 3.760 1.207 -18.100 123 HG2 GLU 17 1HG GLU 17 3.307 -1.142 -19.081 124 HG3 GLU 17 2HG GLU 17 1.595 -0.734 -18.972 125 H ASN 18 H ASN 18 2.300 1.041 -14.640 126 HA ASN 18 HA ASN 18 4.523 2.670 -14.051 127 HB2 ASN 18 1HB ASN 18 2.059 2.961 -13.437 128 HB3 ASN 18 2HB ASN 18 2.322 1.847 -12.080 129 HD21 ASN 18 2HD2 ASN 18 2.365 3.047 -10.236 130 HD22 ASN 18 1HD2 ASN 18 3.303 4.556 -10.129 131 H TYR 19 H TYR 19 4.061 -0.686 -13.343 132 HA TYR 19 HA TYR 19 5.822 -0.697 -10.968 133 HB2 TYR 19 1HB TYR 19 4.789 -2.800 -12.867 134 HB3 TYR 19 2HB TYR 19 6.152 -3.117 -11.829 135 HD1 TYR 19 HD1 TYR 19 2.548 -2.259 -11.880 136 HD2 TYR 19 HD2 TYR 19 5.850 -3.797 -9.554 137 HE1 TYR 19 HE1 TYR 19 0.986 -2.964 -10.089 138 HE2 TYR 19 HE2 TYR 19 4.259 -4.476 -7.768 139 HH TYR 19 HH TYR 19 2.014 -4.391 -7.085 140 H CYS 20 H CYS 20 6.031 -0.782 -14.504 141 HA CYS 20 HA CYS 20 8.721 -1.876 -14.566 142 HB2 CYS 20 1HB CYS 20 7.003 -0.536 -16.746 143 HB3 CYS 20 2HB CYS 20 8.455 -1.484 -16.999 144 H ASN 21 H ASN 21 10.603 -0.814 -14.663 145 HA ASN 21 HA ASN 21 10.659 2.064 -14.333 146 HB2 ASN 21 1HB ASN 21 13.031 1.820 -14.034 147 HB3 ASN 21 2HB ASN 21 12.248 0.522 -13.130 148 HD21 ASN 21 2HD2 ASN 21 12.345 -1.601 -13.996 149 HD22 ASN 21 1HD2 ASN 21 13.617 -2.085 -15.076 150 H1 PHE 1 1H PHE 1 -1.022 -8.366 -22.810 151 H2 PHE 1 2H PHE 1 -1.649 -9.940 -22.872 152 H3 PHE 1 3H PHE 1 -2.592 -8.641 -23.241 153 HA PHE 1 HA PHE 1 -1.398 -9.281 -20.656 154 HB2 PHE 1 1HB PHE 1 -1.431 -6.868 -20.947 155 HB3 PHE 1 2HB PHE 1 -3.150 -6.832 -21.381 156 HD1 PHE 1 HD1 PHE 1 -1.507 -8.852 -18.692 157 HD2 PHE 1 HD2 PHE 1 -4.186 -5.615 -19.713 158 HE1 PHE 1 HE1 PHE 1 -2.206 -8.701 -16.362 159 HE2 PHE 1 HE2 PHE 1 -4.995 -5.537 -17.325 160 HZ PHE 1 HZ PHE 1 -4.020 -7.172 -15.666 161 H VAL 2 H VAL 2 -4.783 -8.189 -21.503 162 HA VAL 2 HA VAL 2 -6.765 -9.182 -21.074 163 HB VAL 2 HB VAL 2 -5.376 -11.852 -20.640 164 HG11 VAL 2 1HG1 VAL 2 -7.590 -12.791 -21.288 165 HG12 VAL 2 2HG1 VAL 2 -7.734 -11.795 -19.797 166 HG13 VAL 2 3HG1 VAL 2 -8.278 -11.159 -21.392 167 HG21 VAL 2 3HG2 VAL 2 -6.522 -10.638 -23.214 168 HG22 VAL 2 1HG2 VAL 2 -4.847 -11.062 -22.960 169 HG23 VAL 2 2HG2 VAL 2 -6.041 -12.324 -23.029 170 H ASN 3 H ASN 3 -7.980 -8.926 -19.369 171 HA ASN 3 HA ASN 3 -6.758 -8.641 -16.757 172 HB2 ASN 3 1HB ASN 3 -9.667 -8.669 -17.564 173 HB3 ASN 3 2HB ASN 3 -9.052 -8.115 -16.035 174 HD21 ASN 3 2HD2 ASN 3 -7.150 -6.431 -16.305 175 HD22 ASN 3 1HD2 ASN 3 -7.523 -5.117 -17.395 176 H GLN 4 H GLN 4 -6.430 -10.218 -15.216 177 HA GLN 4 HA GLN 4 -8.459 -12.421 -15.193 178 HB2 GLN 4 1HB GLN 4 -6.873 -14.178 -15.288 179 HB3 GLN 4 2HB GLN 4 -6.645 -13.178 -16.720 180 HG2 GLN 4 1HG GLN 4 -4.754 -12.032 -15.678 181 HG3 GLN 4 2HG GLN 4 -4.848 -13.168 -14.327 182 HE21 GLN 4 2HE2 GLN 4 -4.973 -15.595 -15.232 183 HE22 GLN 4 1HE2 GLN 4 -3.776 -15.971 -16.454 184 H HIS 5 H HIS 5 -7.660 -10.160 -13.361 185 HA HIS 5 HA HIS 5 -7.423 -9.729 -11.150 186 HB2 HIS 5 1HB HIS 5 -9.134 -11.881 -11.275 187 HB3 HIS 5 2HB HIS 5 -7.923 -12.395 -10.078 188 HD1 HIS 5 HD1 HIS 5 -10.815 -10.127 -10.481 189 HD2 HIS 5 HD2 HIS 5 -7.672 -10.610 -7.808 190 HE1 HIS 5 HE1 HIS 5 -11.193 -8.584 -8.558 191 H LEU 6 H LEU 6 -5.240 -11.645 -12.606 192 HA LEU 6 HA LEU 6 -3.155 -12.186 -12.191 193 HB2 LEU 6 1HB LEU 6 -3.298 -9.909 -10.175 194 HB3 LEU 6 2HB LEU 6 -1.875 -10.486 -11.020 195 HG LEU 6 HG LEU 6 -4.192 -8.979 -12.215 196 HD11 LEU 6 1HD1 LEU 6 -2.331 -7.856 -10.915 197 HD12 LEU 6 2HD1 LEU 6 -2.579 -7.307 -12.533 198 HD13 LEU 6 3HD1 LEU 6 -1.216 -8.373 -12.200 199 HD21 LEU 6 3HD2 LEU 6 -1.861 -10.385 -13.586 200 HD22 LEU 6 1HD2 LEU 6 -2.851 -9.132 -14.347 201 HD23 LEU 6 2HD2 LEU 6 -3.610 -10.627 -13.867 202 H CYS 7 H CYS 7 -1.497 -11.724 -9.914 203 HA CYS 7 HA CYS 7 -0.497 -12.965 -8.260 204 HB2 CYS 7 1HB CYS 7 -3.018 -12.190 -7.310 205 HB3 CYS 7 2HB CYS 7 -3.048 -13.953 -7.088 206 H GLY 8 H GLY 8 -0.588 -15.406 -7.083 207 HA2 GLY 8 1HA GLY 8 -0.573 -17.704 -7.576 208 HA3 GLY 8 2HA GLY 8 -1.865 -17.372 -8.770 209 H SER 9 H SER 9 1.310 -15.834 -8.818 210 HA SER 9 HA SER 9 3.013 -15.872 -10.324 211 HB2 SER 9 1HB SER 9 3.727 -17.784 -11.423 212 HB3 SER 9 2HB SER 9 2.733 -18.434 -10.127 213 HG SER 9 HG SER 9 0.942 -18.429 -11.705 214 H HIS 10 H HIS 10 -0.255 -15.675 -11.287 215 HA HIS 10 HA HIS 10 0.243 -15.026 -14.072 216 HB2 HIS 10 1HB HIS 10 -1.889 -14.144 -12.118 217 HB3 HIS 10 2HB HIS 10 -1.953 -13.881 -13.851 218 HD1 HIS 10 HD1 HIS 10 -3.650 -15.976 -11.722 219 HD2 HIS 10 HD2 HIS 10 -1.361 -16.700 -15.126 220 HE1 HIS 10 HE1 HIS 10 -4.367 -18.220 -12.637 221 H LEU 11 H LEU 11 1.027 -13.261 -11.157 222 HA LEU 11 HA LEU 11 0.754 -10.585 -12.251 223 HB2 LEU 11 1HB LEU 11 1.009 -11.164 -9.807 224 HB3 LEU 11 2HB LEU 11 2.721 -11.591 -10.082 225 HG LEU 11 HG LEU 11 2.605 -9.071 -11.190 226 HD11 LEU 11 1HD1 LEU 11 1.154 -7.641 -9.799 227 HD12 LEU 11 2HD1 LEU 11 0.556 -9.053 -8.908 228 HD13 LEU 11 3HD1 LEU 11 0.183 -8.855 -10.640 229 HD21 LEU 11 3HD2 LEU 11 3.343 -8.183 -8.902 230 HD22 LEU 11 1HD2 LEU 11 4.290 -9.537 -9.534 231 HD23 LEU 11 2HD2 LEU 11 3.086 -9.809 -8.257 232 H VAL 12 H VAL 12 3.249 -13.096 -12.137 233 HA VAL 12 HA VAL 12 5.385 -11.624 -13.344 234 HB VAL 12 HB VAL 12 4.840 -14.659 -13.510 235 HG11 VAL 12 1HG1 VAL 12 7.534 -13.165 -13.514 236 HG12 VAL 12 2HG1 VAL 12 7.217 -14.904 -13.868 237 HG13 VAL 12 3HG1 VAL 12 6.672 -13.670 -15.007 238 HG21 VAL 12 3HG2 VAL 12 6.221 -13.076 -11.265 239 HG22 VAL 12 1HG2 VAL 12 4.807 -14.173 -11.139 240 HG23 VAL 12 2HG2 VAL 12 6.384 -14.818 -11.513 241 H GLU 13 H GLU 13 2.822 -13.772 -14.630 242 HA GLU 13 HA GLU 13 3.547 -13.709 -17.337 243 HB2 GLU 13 1HB GLU 13 1.976 -15.359 -16.443 244 HB3 GLU 13 2HB GLU 13 0.835 -14.113 -15.951 245 HG2 GLU 13 1HG GLU 13 0.408 -13.563 -18.171 246 HG3 GLU 13 2HG GLU 13 1.731 -14.608 -18.736 247 H ALA 14 H ALA 14 1.219 -11.684 -15.517 248 HA ALA 14 HA ALA 14 0.393 -10.017 -17.636 249 HB1 ALA 14 3HB ALA 14 -0.581 -9.999 -15.381 250 HB2 ALA 14 1HB ALA 14 0.908 -9.359 -14.675 251 HB3 ALA 14 2HB ALA 14 -0.091 -8.359 -15.768 252 H LEU 15 H LEU 15 3.138 -9.674 -15.408 253 HA LEU 15 HA LEU 15 4.045 -7.147 -16.490 254 HB2 LEU 15 1HB LEU 15 5.413 -9.352 -14.824 255 HB3 LEU 15 2HB LEU 15 6.283 -7.914 -15.382 256 HG LEU 15 HG LEU 15 3.725 -7.588 -13.932 257 HD11 LEU 15 1HD1 LEU 15 6.401 -8.001 -12.602 258 HD12 LEU 15 2HD1 LEU 15 5.039 -9.123 -12.553 259 HD13 LEU 15 3HD1 LEU 15 4.911 -7.502 -11.775 260 HD21 LEU 15 3HD2 LEU 15 4.585 -5.580 -14.874 261 HD22 LEU 15 1HD2 LEU 15 6.227 -5.936 -14.324 262 HD23 LEU 15 2HD2 LEU 15 4.962 -5.519 -13.155 263 H TYR 16 H TYR 16 4.944 -10.549 -17.193 264 HA TYR 16 HA TYR 16 6.936 -9.907 -19.066 265 HB2 TYR 16 1HB TYR 16 6.602 -12.102 -18.016 266 HB3 TYR 16 2HB TYR 16 5.154 -12.372 -18.979 267 HD1 TYR 16 HD1 TYR 16 8.853 -11.740 -19.193 268 HD2 TYR 16 HD2 TYR 16 5.332 -13.234 -21.135 269 HE1 TYR 16 HE1 TYR 16 10.279 -12.721 -21.012 270 HE2 TYR 16 HE2 TYR 16 6.779 -14.232 -23.035 271 HH TYR 16 HH TYR 16 10.405 -14.059 -22.838 272 H LEU 17 H LEU 17 3.360 -10.316 -19.453 273 HA LEU 17 HA LEU 17 3.514 -10.152 -22.316 274 HB2 LEU 17 1HB LEU 17 1.306 -9.912 -20.288 275 HB3 LEU 17 2HB LEU 17 1.022 -9.667 -22.029 276 HG LEU 17 HG LEU 17 2.262 -12.198 -20.930 277 HD11 LEU 17 1HD1 LEU 17 0.126 -11.909 -19.795 278 HD12 LEU 17 2HD1 LEU 17 0.052 -13.222 -20.963 279 HD13 LEU 17 3HD1 LEU 17 -0.665 -11.661 -21.370 280 HD21 LEU 17 3HD2 LEU 17 0.878 -11.488 -23.554 281 HD22 LEU 17 1HD2 LEU 17 1.186 -13.162 -23.061 282 HD23 LEU 17 2HD2 LEU 17 2.534 -12.030 -23.327 283 H VAL 18 H VAL 18 3.153 -7.741 -19.760 284 HA VAL 18 HA VAL 18 2.291 -5.657 -21.692 285 HB VAL 18 HB VAL 18 2.808 -5.561 -18.704 286 HG11 VAL 18 1HG1 VAL 18 3.154 -3.344 -19.636 287 HG12 VAL 18 2HG1 VAL 18 1.686 -3.489 -20.606 288 HG13 VAL 18 3HG1 VAL 18 1.579 -3.374 -18.796 289 HG21 VAL 18 3HG2 VAL 18 0.804 -6.932 -19.465 290 HG22 VAL 18 1HG2 VAL 18 0.340 -5.475 -18.556 291 HG23 VAL 18 2HG2 VAL 18 0.217 -5.460 -20.312 292 H CYS 19 H CYS 19 5.083 -6.148 -19.422 293 HA CYS 19 HA CYS 19 6.484 -3.954 -20.943 294 HB2 CYS 19 1HB CYS 19 6.945 -5.137 -18.201 295 HB3 CYS 19 2HB CYS 19 7.962 -3.868 -18.950 296 H GLY 20 H GLY 20 6.595 -7.374 -20.448 297 HA2 GLY 20 1HA GLY 20 8.127 -8.914 -21.170 298 HA3 GLY 20 2HA GLY 20 8.998 -7.678 -22.015 299 H GLU 21 H GLU 21 10.908 -8.882 -21.238 300 HA GLU 21 HA GLU 21 11.441 -9.024 -18.397 301 HB2 GLU 21 1HB GLU 21 13.417 -9.155 -20.649 302 HB3 GLU 21 2HB GLU 21 13.643 -9.742 -18.992 303 HG2 GLU 21 1HG GLU 21 11.745 -11.338 -19.380 304 HG3 GLU 21 2HG GLU 21 11.723 -10.870 -21.101 305 H ARG 22 H ARG 22 11.278 -6.326 -20.368 306 HA ARG 22 HA ARG 22 13.496 -4.728 -19.255 307 HB2 ARG 22 1HB ARG 22 10.885 -4.070 -20.609 308 HB3 ARG 22 2HB ARG 22 12.042 -2.853 -20.011 309 HG2 ARG 22 1HG ARG 22 12.573 -5.004 -22.139 310 HG3 ARG 22 2HG ARG 22 12.198 -3.304 -22.484 311 HD2 ARG 22 1HD ARG 22 14.265 -2.654 -21.072 312 HD3 ARG 22 2HD ARG 22 14.634 -4.384 -21.004 313 HE ARG 22 HE ARG 22 14.356 -3.805 -23.685 314 HH11 ARG 22 1HH1 ARG 22 16.573 -2.840 -21.081 315 HH12 ARG 22 2HH1 ARG 22 17.921 -2.573 -22.179 316 HH21 ARG 22 1HH2 ARG 22 16.097 -3.442 -25.041 317 HH22 ARG 22 2HH2 ARG 22 17.641 -2.904 -24.419 318 H GLY 23 H GLY 23 10.314 -5.682 -18.179 319 HA2 GLY 23 1HA GLY 23 10.141 -3.432 -16.290 320 HA3 GLY 23 2HA GLY 23 8.962 -4.718 -16.469 321 H PHE 24 H PHE 24 9.528 -6.851 -15.643 322 HA PHE 24 HA PHE 24 10.396 -6.482 -12.868 323 HB2 PHE 24 1HB PHE 24 9.192 -8.476 -12.423 324 HB3 PHE 24 2HB PHE 24 8.211 -7.504 -13.498 325 HD1 PHE 24 HD2 PHE 24 8.325 -8.104 -16.084 326 HD2 PHE 24 HD1 PHE 24 9.783 -10.619 -12.846 327 HE1 PHE 24 HE2 PHE 24 8.377 -10.009 -17.628 328 HE2 PHE 24 HE1 PHE 24 9.731 -12.592 -14.438 329 HZ PHE 24 HZ PHE 24 9.067 -12.288 -16.808 330 H PHE 25 H PHE 25 11.799 -7.980 -11.776 331 HA PHE 25 HA PHE 25 13.129 -9.953 -13.529 332 HB2 PHE 25 1HB PHE 25 14.777 -8.169 -13.059 333 HB3 PHE 25 2HB PHE 25 14.554 -8.406 -11.310 334 HD1 PHE 25 HD1 PHE 25 15.494 -10.049 -14.530 335 HD2 PHE 25 HD2 PHE 25 15.778 -10.112 -10.234 336 HE1 PHE 25 HE1 PHE 25 17.171 -11.941 -14.638 337 HE2 PHE 25 HE2 PHE 25 17.451 -11.968 -10.360 338 HZ PHE 25 HZ PHE 25 18.108 -12.877 -12.569 339 H NVA 26 H ARX 26 12.366 -11.659 -12.988 340 HA NVA 26 HA ARX 26 11.875 -12.678 -10.176 341 HB2 NVA 26 1HB ARX 26 9.880 -12.745 -11.856 342 HB3 NVA 26 2HB ARX 26 10.926 -13.723 -12.978 343 HG2 NVA 26 1HG ARX 26 11.067 -15.240 -10.686 344 HG3 NVA 26 2HG ARX 26 9.406 -14.694 -10.583 345 HD2 NVA 26 1HD ARX 26 8.782 -15.592 -12.749 346 HD3 NVA 26 2HD ARX 26 10.474 -15.727 -13.211 347 H THR 27 H THR 27 13.466 -14.008 -9.380 348 HA THR 27 HA THR 27 15.756 -14.943 -10.782 349 HB THR 27 HB THR 27 16.005 -16.533 -8.774 350 HG1 THR 27 HG1 THR 27 13.987 -16.788 -7.918 351 HG21 THR 27 1HG2 THR 27 16.622 -14.801 -7.190 352 HG22 THR 27 2HG2 THR 27 15.613 -13.592 -8.049 353 HG23 THR 27 3HG2 THR 27 17.060 -14.266 -8.827 354 HA PRO 28 HA PRO 28 14.008 -18.292 -12.964 355 HB2 PRO 28 1HB PRO 28 16.063 -20.117 -13.311 356 HB3 PRO 28 2HB PRO 28 16.062 -18.520 -14.056 357 HG2 PRO 28 1HG PRO 28 17.268 -19.383 -11.457 358 HG3 PRO 28 2HG PRO 28 18.048 -18.558 -12.870 359 HD2 PRO 28 1HD PRO 28 17.220 -17.108 -10.740 360 HD3 PRO 28 2HD PRO 28 16.933 -16.465 -12.387 361 H HIX 29 H HIX 29 12.357 -18.971 -11.711 362 HA HIX 29 HA HIX 29 12.613 -21.143 -9.710 363 HB1 HIX 29 1HB HIX 29 9.930 -21.094 -10.113 364 HB2 HIX 29 2HB HIX 29 10.718 -19.857 -9.173 365 HD2 HIX 29 HD2 HIX 29 10.966 -17.327 -10.235 366 HD1 HIX 29 HD1 HIX 29 9.012 -20.215 -12.540 367 HE1 HIX 29 HE1 HIX 29 9.560 -18.151 -13.734 368 H THR 30 H THR 30 13.268 -22.979 -10.398 369 HA THR 30 HA THR 30 11.950 -24.327 -12.667 370 HB THR 30 HB THR 30 14.911 -24.902 -12.104 371 HG1 THR 30 HG1 THR 30 14.396 -22.511 -12.501 372 HG21 THR 30 1HG2 THR 30 14.891 -25.367 -14.487 373 HG22 THR 30 2HG2 THR 30 13.169 -24.945 -14.540 374 HG23 THR 30 3HG2 THR 30 13.720 -26.374 -13.586 Start of MODEL 23 1 H1 GLY 1 1H GLY 1 1.403 2.977 -1.969 2 H2 GLY 1 2H GLY 1 0.256 2.326 -0.988 3 H3 GLY 1 3H GLY 1 1.722 2.577 -0.375 4 HA2 GLY 1 1HA GLY 1 2.707 0.893 -1.652 5 HA3 GLY 1 2HA GLY 1 1.210 0.293 -0.888 6 H ILE 2 H ILE 2 2.230 -1.029 -3.090 7 HA ILE 2 HA ILE 2 -0.037 -0.574 -4.900 8 HB ILE 2 HB ILE 2 1.929 0.635 -5.813 9 HG12 ILE 2 1HG1 ILE 2 0.910 -1.592 -7.581 10 HG13 ILE 2 2HG1 ILE 2 0.000 -0.140 -7.136 11 HG21 ILE 2 1HG2 ILE 2 3.125 -2.100 -6.321 12 HG22 ILE 2 2HG2 ILE 2 3.808 -0.529 -6.768 13 HG23 ILE 2 3HG2 ILE 2 3.672 -0.986 -5.044 14 HD11 ILE 2 3HD1 ILE 2 2.119 1.136 -8.284 15 HD12 ILE 2 1HD1 ILE 2 2.290 -0.433 -9.114 16 HD13 ILE 2 2HD1 ILE 2 0.769 0.447 -9.278 17 H VAL 3 H VAL 3 2.403 -2.828 -3.698 18 HA VAL 3 HA VAL 3 1.716 -5.009 -5.288 19 HB VAL 3 HB VAL 3 2.616 -4.962 -2.338 20 HG11 VAL 3 1HG1 VAL 3 3.587 -7.150 -2.688 21 HG12 VAL 3 2HG1 VAL 3 1.816 -7.179 -2.851 22 HG13 VAL 3 3HG1 VAL 3 2.833 -7.208 -4.349 23 HG21 VAL 3 3HG2 VAL 3 4.269 -5.054 -4.931 24 HG22 VAL 3 1HG2 VAL 3 4.166 -3.698 -3.819 25 HG23 VAL 3 2HG2 VAL 3 4.925 -5.209 -3.282 26 H GLU 4 H GLU 4 0.475 -4.781 -1.945 27 HA GLU 4 HA GLU 4 -1.507 -6.701 -2.265 28 HB2 GLU 4 1HB GLU 4 -1.389 -4.393 -0.314 29 HB3 GLU 4 2HB GLU 4 -2.645 -5.643 -0.362 30 HG2 GLU 4 1HG GLU 4 -0.299 -7.100 -0.421 31 HG3 GLU 4 2HG GLU 4 0.094 -5.783 0.666 32 H GLN 5 H GLN 5 -1.648 -3.152 -2.679 33 HA GLN 5 HA GLN 5 -4.430 -2.934 -2.969 34 HB2 GLN 5 1HB GLN 5 -2.106 -1.347 -3.470 35 HB3 GLN 5 2HB GLN 5 -3.257 -1.106 -4.792 36 HG2 GLN 5 1HG GLN 5 -4.757 -0.144 -3.399 37 HG3 GLN 5 2HG GLN 5 -4.221 -1.093 -1.990 38 HE21 GLN 5 2HE2 GLN 5 -4.115 1.952 -3.456 39 HE22 GLN 5 1HE2 GLN 5 -2.835 2.687 -2.489 40 H CYS 6 H CYS 6 -2.055 -3.505 -5.591 41 HA CYS 6 HA CYS 6 -4.018 -3.929 -7.627 42 HB2 CYS 6 1HB CYS 6 -1.352 -3.554 -7.605 43 HB3 CYS 6 2HB CYS 6 -1.386 -5.333 -7.710 44 H CYS 7 H CYS 7 -2.263 -6.230 -5.441 45 HA CYS 7 HA CYS 7 -3.136 -8.604 -6.681 46 HB2 CYS 7 1HB CYS 7 -1.980 -7.753 -4.073 47 HB3 CYS 7 2HB CYS 7 -3.096 -9.122 -3.914 48 H THR 8 H THR 8 -4.776 -6.678 -4.073 49 HA THR 8 HA THR 8 -6.877 -8.630 -3.759 50 HB THR 8 HB THR 8 -7.293 -5.866 -2.580 51 HG1 THR 8 HG1 THR 8 -5.012 -6.079 -2.256 52 HG21 THR 8 1HG2 THR 8 -8.002 -7.126 -0.680 53 HG22 THR 8 2HG2 THR 8 -7.178 -8.574 -1.236 54 HG23 THR 8 3HG2 THR 8 -8.599 -8.012 -2.093 55 H SER 9 H SER 9 -6.474 -7.332 -6.431 56 HA SER 9 HA SER 9 -9.298 -6.800 -7.003 57 HB2 SER 9 1HB SER 9 -9.025 -4.375 -7.601 58 HB3 SER 9 2HB SER 9 -8.441 -4.599 -5.948 59 HG SER 9 HG SER 9 -6.327 -4.668 -6.847 60 H ILE 10 H ILE 10 -9.496 -5.848 -9.278 61 HA ILE 10 HA ILE 10 -7.986 -7.531 -11.156 62 HB ILE 10 HB ILE 10 -10.265 -5.456 -11.474 63 HG12 ILE 10 1HG1 ILE 10 -10.822 -7.620 -10.344 64 HG13 ILE 10 2HG1 ILE 10 -11.782 -7.240 -11.779 65 HG21 ILE 10 1HG2 ILE 10 -8.838 -5.427 -13.470 66 HG22 ILE 10 2HG2 ILE 10 -9.021 -7.181 -13.640 67 HG23 ILE 10 3HG2 ILE 10 -10.436 -6.131 -13.829 68 HD11 ILE 10 3HD1 ILE 10 -11.251 -9.653 -11.712 69 HD12 ILE 10 1HD1 ILE 10 -10.570 -8.855 -13.145 70 HD13 ILE 10 2HD1 ILE 10 -9.509 -9.302 -11.771 71 H CYS 11 H CYS 11 -6.019 -6.774 -11.711 72 HA CYS 11 HA CYS 11 -5.255 -4.082 -11.146 73 HB2 CYS 11 1HB CYS 11 -3.993 -6.381 -12.539 74 HB3 CYS 11 2HB CYS 11 -3.202 -4.787 -12.474 75 H SER 12 H SER 12 -5.389 -2.276 -12.279 76 HA SER 12 HA SER 12 -6.385 -2.379 -15.011 77 HB2 SER 12 1HB SER 12 -5.330 -0.039 -13.347 78 HB3 SER 12 2HB SER 12 -6.263 0.096 -14.860 79 HG SER 12 HG SER 12 -7.562 -1.564 -13.206 80 H LEU 13 H LEU 13 -5.298 -1.475 -16.844 81 HA LEU 13 HA LEU 13 -2.736 -2.482 -17.319 82 HB2 LEU 13 1HB LEU 13 -4.357 -1.914 -19.092 83 HB3 LEU 13 2HB LEU 13 -4.170 -0.228 -18.693 84 HG LEU 13 HG LEU 13 -1.879 -0.231 -19.469 85 HD11 LEU 13 1HD1 LEU 13 -0.932 -2.128 -20.675 86 HD12 LEU 13 2HD1 LEU 13 -2.430 -3.076 -20.339 87 HD13 LEU 13 3HD1 LEU 13 -1.334 -2.568 -18.999 88 HD21 LEU 13 3HD2 LEU 13 -2.226 -0.422 -21.861 89 HD22 LEU 13 1HD2 LEU 13 -3.583 0.378 -21.057 90 HD23 LEU 13 2HD2 LEU 13 -3.720 -1.303 -21.597 91 H TYR 14 H TYR 14 -3.601 0.992 -16.665 92 HA TYR 14 HA TYR 14 -0.948 1.908 -16.856 93 HB2 TYR 14 1HB TYR 14 -1.702 3.942 -15.905 94 HB3 TYR 14 2HB TYR 14 -2.968 3.340 -16.971 95 HD1 TYR 14 HD1 TYR 14 -5.120 2.387 -16.043 96 HD2 TYR 14 HD2 TYR 14 -2.094 4.202 -13.550 97 HE1 TYR 14 HE1 TYR 14 -6.747 2.609 -14.215 98 HE2 TYR 14 HE2 TYR 14 -3.747 4.454 -11.728 99 HH TYR 14 HH TYR 14 -7.131 3.581 -12.102 100 H GLN 15 H GLN 15 -2.691 0.651 -14.137 101 HA GLN 15 HA GLN 15 -0.737 1.258 -12.144 102 HB2 GLN 15 1HB GLN 15 -2.782 -0.992 -12.286 103 HB3 GLN 15 2HB GLN 15 -1.884 -0.514 -10.827 104 HG2 GLN 15 1HG GLN 15 -2.818 1.712 -10.915 105 HG3 GLN 15 2HG GLN 15 -3.843 1.236 -12.306 106 HE21 GLN 15 2HE2 GLN 15 -3.952 1.877 -9.160 107 HE22 GLN 15 1HE2 GLN 15 -5.143 0.661 -8.672 108 H LEU 16 H LEU 16 -1.237 -1.564 -14.258 109 HA LEU 16 HA LEU 16 0.903 -3.094 -13.107 110 HB2 LEU 16 1HB LEU 16 -1.065 -3.953 -14.379 111 HB3 LEU 16 2HB LEU 16 -0.318 -3.371 -15.843 112 HG LEU 16 HG LEU 16 -0.201 -5.871 -15.148 113 HD11 LEU 16 1HD1 LEU 16 2.164 -4.389 -16.328 114 HD12 LEU 16 2HD1 LEU 16 0.754 -5.026 -17.202 115 HD13 LEU 16 3HD1 LEU 16 1.932 -6.129 -16.428 116 HD21 LEU 16 3HD2 LEU 16 0.970 -5.244 -12.913 117 HD22 LEU 16 1HD2 LEU 16 2.418 -5.168 -13.957 118 HD23 LEU 16 2HD2 LEU 16 1.464 -6.682 -13.887 119 H GLU 17 H GLU 17 0.751 -0.824 -15.915 120 HA GLU 17 HA GLU 17 3.473 -1.133 -16.862 121 HB2 GLU 17 1HB GLU 17 1.577 1.249 -16.993 122 HB3 GLU 17 2HB GLU 17 3.204 1.229 -17.643 123 HG2 GLU 17 1HG GLU 17 2.611 -0.695 -19.092 124 HG3 GLU 17 2HG GLU 17 0.929 -0.618 -18.473 125 H ASN 18 H ASN 18 2.076 0.825 -14.234 126 HA ASN 18 HA ASN 18 4.409 2.334 -13.665 127 HB2 ASN 18 1HB ASN 18 2.093 1.382 -11.885 128 HB3 ASN 18 2HB ASN 18 3.441 2.370 -11.272 129 HD21 ASN 18 2HD2 ASN 18 0.540 2.996 -11.445 130 HD22 ASN 18 1HD2 ASN 18 0.497 4.464 -12.415 131 H TYR 19 H TYR 19 3.866 -1.164 -13.245 132 HA TYR 19 HA TYR 19 5.939 -1.385 -11.192 133 HB2 TYR 19 1HB TYR 19 4.551 -3.466 -12.923 134 HB3 TYR 19 2HB TYR 19 5.883 -3.836 -11.866 135 HD1 TYR 19 HD1 TYR 19 2.330 -2.546 -11.785 136 HD2 TYR 19 HD2 TYR 19 5.637 -4.280 -9.659 137 HE1 TYR 19 HE1 TYR 19 0.886 -3.073 -9.791 138 HE2 TYR 19 HE2 TYR 19 4.205 -4.660 -7.627 139 HH TYR 19 HH TYR 19 0.698 -3.825 -7.773 140 H CYS 20 H CYS 20 5.785 -0.931 -14.608 141 HA CYS 20 HA CYS 20 8.202 -2.502 -15.195 142 HB2 CYS 20 1HB CYS 20 6.638 -0.602 -16.923 143 HB3 CYS 20 2HB CYS 20 7.901 -1.698 -17.522 144 H ASN 21 H ASN 21 10.120 -1.623 -16.162 145 HA ASN 21 HA ASN 21 11.111 0.879 -14.984 146 HB2 ASN 21 1HB ASN 21 12.198 -0.997 -17.150 147 HB3 ASN 21 2HB ASN 21 13.029 0.428 -16.517 148 HD21 ASN 21 2HD2 ASN 21 13.173 -2.705 -16.265 149 HD22 ASN 21 1HD2 ASN 21 13.672 -2.852 -14.600 150 H1 PHE 1 1H PHE 1 -2.496 -8.268 -22.803 151 H2 PHE 1 2H PHE 1 -3.028 -6.733 -22.695 152 H3 PHE 1 3H PHE 1 -1.376 -7.083 -22.577 153 HA PHE 1 HA PHE 1 -1.649 -8.170 -20.540 154 HB2 PHE 1 1HB PHE 1 -1.402 -5.800 -20.496 155 HB3 PHE 1 2HB PHE 1 -3.102 -5.529 -20.636 156 HD1 PHE 1 HD1 PHE 1 -1.659 -8.221 -18.492 157 HD2 PHE 1 HD2 PHE 1 -3.360 -4.254 -18.561 158 HE1 PHE 1 HE1 PHE 1 -1.994 -8.294 -16.079 159 HE2 PHE 1 HE2 PHE 1 -3.599 -4.346 -16.097 160 HZ PHE 1 HZ PHE 1 -2.906 -6.433 -14.901 161 H VAL 2 H VAL 2 -4.776 -6.519 -20.977 162 HA VAL 2 HA VAL 2 -6.962 -7.191 -20.798 163 HB VAL 2 HB VAL 2 -6.072 -10.104 -20.457 164 HG11 VAL 2 1HG1 VAL 2 -8.807 -8.856 -21.209 165 HG12 VAL 2 2HG1 VAL 2 -8.419 -10.562 -21.210 166 HG13 VAL 2 3HG1 VAL 2 -8.403 -9.683 -19.693 167 HG21 VAL 2 3HG2 VAL 2 -5.236 -9.351 -22.637 168 HG22 VAL 2 1HG2 VAL 2 -6.720 -10.261 -22.895 169 HG23 VAL 2 2HG2 VAL 2 -6.771 -8.499 -22.996 170 H ASN 3 H ASN 3 -8.372 -7.280 -19.125 171 HA ASN 3 HA ASN 3 -7.108 -6.661 -16.578 172 HB2 ASN 3 1HB ASN 3 -9.877 -6.727 -17.773 173 HB3 ASN 3 2HB ASN 3 -9.744 -6.872 -16.024 174 HD21 ASN 3 2HD2 ASN 3 -10.368 -4.649 -18.302 175 HD22 ASN 3 1HD2 ASN 3 -9.621 -3.236 -17.593 176 H GLN 4 H GLN 4 -6.661 -8.023 -14.937 177 HA GLN 4 HA GLN 4 -8.229 -10.489 -14.428 178 HB2 GLN 4 1HB GLN 4 -5.719 -10.487 -15.851 179 HB3 GLN 4 2HB GLN 4 -5.502 -11.199 -14.255 180 HG2 GLN 4 1HG GLN 4 -5.928 -12.978 -15.590 181 HG3 GLN 4 2HG GLN 4 -7.434 -12.698 -14.724 182 HE21 GLN 4 2HE2 GLN 4 -9.210 -12.867 -15.982 183 HE22 GLN 4 1HE2 GLN 4 -9.267 -12.614 -17.707 184 H HIS 5 H HIS 5 -7.709 -11.442 -12.266 185 HA HIS 5 HA HIS 5 -6.463 -9.509 -10.310 186 HB2 HIS 5 1HB HIS 5 -7.624 -12.351 -10.049 187 HB3 HIS 5 2HB HIS 5 -6.432 -11.780 -8.886 188 HD1 HIS 5 HD1 HIS 5 -10.018 -11.050 -10.022 189 HD2 HIS 5 HD2 HIS 5 -7.319 -10.083 -6.962 190 HE1 HIS 5 HE1 HIS 5 -11.247 -9.758 -8.226 191 H LEU 6 H LEU 6 -4.272 -9.774 -9.721 192 HA LEU 6 HA LEU 6 -2.894 -11.660 -11.445 193 HB2 LEU 6 1HB LEU 6 -1.931 -9.130 -10.229 194 HB3 LEU 6 2HB LEU 6 -0.973 -10.217 -11.218 195 HG LEU 6 HG LEU 6 -3.363 -8.650 -12.151 196 HD11 LEU 6 1HD1 LEU 6 -1.687 -7.437 -13.452 197 HD12 LEU 6 2HD1 LEU 6 -0.419 -8.549 -12.901 198 HD13 LEU 6 3HD1 LEU 6 -1.199 -7.460 -11.744 199 HD21 LEU 6 3HD2 LEU 6 -3.305 -10.861 -13.337 200 HD22 LEU 6 1HD2 LEU 6 -1.628 -10.545 -13.822 201 HD23 LEU 6 2HD2 LEU 6 -2.960 -9.536 -14.402 202 H CYS 7 H CYS 7 -3.536 -11.368 -8.196 203 HA CYS 7 HA CYS 7 -0.958 -11.880 -7.147 204 HB2 CYS 7 1HB CYS 7 -3.488 -11.383 -6.128 205 HB3 CYS 7 2HB CYS 7 -3.171 -13.061 -5.609 206 H GLY 8 H GLY 8 -3.149 -14.081 -8.697 207 HA2 GLY 8 1HA GLY 8 -2.119 -16.522 -7.506 208 HA3 GLY 8 2HA GLY 8 -3.212 -16.388 -8.905 209 H SER 9 H SER 9 0.078 -15.055 -8.403 210 HA SER 9 HA SER 9 2.041 -15.353 -9.457 211 HB2 SER 9 1HB SER 9 1.515 -17.844 -9.090 212 HB3 SER 9 2HB SER 9 1.097 -17.894 -10.828 213 HG SER 9 HG SER 9 3.087 -18.128 -11.203 214 H HIS 10 H HIS 10 -0.777 -14.861 -10.982 215 HA HIS 10 HA HIS 10 0.038 -14.742 -13.702 216 HB2 HIS 10 1HB HIS 10 -2.099 -13.138 -12.336 217 HB3 HIS 10 2HB HIS 10 -1.955 -13.353 -14.043 218 HD1 HIS 10 HD1 HIS 10 -4.388 -14.268 -12.128 219 HD2 HIS 10 HD2 HIS 10 -1.423 -16.669 -13.767 220 HE1 HIS 10 HE1 HIS 10 -5.287 -16.666 -12.185 221 H LEU 11 H LEU 11 0.852 -12.740 -11.085 222 HA LEU 11 HA LEU 11 1.120 -10.233 -12.483 223 HB2 LEU 11 1HB LEU 11 1.355 -10.580 -9.963 224 HB3 LEU 11 2HB LEU 11 2.920 -11.312 -10.240 225 HG LEU 11 HG LEU 11 3.453 -8.996 -11.450 226 HD11 LEU 11 1HD1 LEU 11 1.030 -8.277 -9.817 227 HD12 LEU 11 2HD1 LEU 11 1.330 -7.990 -11.540 228 HD13 LEU 11 3HD1 LEU 11 2.236 -7.097 -10.293 229 HD21 LEU 11 3HD2 LEU 11 3.215 -9.097 -8.403 230 HD22 LEU 11 1HD2 LEU 11 4.253 -7.965 -9.362 231 HD23 LEU 11 2HD2 LEU 11 4.602 -9.716 -9.378 232 H VAL 12 H VAL 12 3.116 -13.152 -12.363 233 HA VAL 12 HA VAL 12 5.408 -11.881 -13.490 234 HB VAL 12 HB VAL 12 4.701 -14.876 -13.369 235 HG11 VAL 12 1HG1 VAL 12 6.527 -14.656 -15.036 236 HG12 VAL 12 2HG1 VAL 12 7.429 -13.525 -13.942 237 HG13 VAL 12 3HG1 VAL 12 7.285 -15.224 -13.496 238 HG21 VAL 12 3HG2 VAL 12 4.796 -14.002 -11.125 239 HG22 VAL 12 1HG2 VAL 12 6.321 -14.870 -11.412 240 HG23 VAL 12 2HG2 VAL 12 6.301 -13.111 -11.461 241 H GLU 13 H GLU 13 2.649 -13.807 -14.691 242 HA GLU 13 HA GLU 13 3.486 -13.905 -17.392 243 HB2 GLU 13 1HB GLU 13 0.549 -13.803 -16.461 244 HB3 GLU 13 2HB GLU 13 1.205 -14.512 -17.959 245 HG2 GLU 13 1HG GLU 13 2.581 -16.033 -16.384 246 HG3 GLU 13 2HG GLU 13 1.503 -15.452 -15.130 247 H ALA 14 H ALA 14 1.404 -11.591 -15.666 248 HA ALA 14 HA ALA 14 0.605 -9.921 -17.810 249 HB1 ALA 14 3HB ALA 14 0.197 -8.247 -16.060 250 HB2 ALA 14 1HB ALA 14 -0.278 -9.840 -15.466 251 HB3 ALA 14 2HB ALA 14 1.208 -9.138 -14.919 252 H LEU 15 H LEU 15 3.409 -9.526 -15.575 253 HA LEU 15 HA LEU 15 4.371 -7.199 -16.932 254 HB2 LEU 15 1HB LEU 15 5.630 -9.206 -15.028 255 HB3 LEU 15 2HB LEU 15 6.556 -7.837 -15.680 256 HG LEU 15 HG LEU 15 3.902 -7.382 -14.331 257 HD11 LEU 15 1HD1 LEU 15 6.680 -7.431 -13.028 258 HD12 LEU 15 2HD1 LEU 15 5.371 -8.648 -12.723 259 HD13 LEU 15 3HD1 LEU 15 5.137 -6.961 -12.200 260 HD21 LEU 15 3HD2 LEU 15 4.636 -5.466 -15.527 261 HD22 LEU 15 1HD2 LEU 15 6.343 -5.758 -15.126 262 HD23 LEU 15 2HD2 LEU 15 5.191 -5.169 -13.853 263 H TYR 16 H TYR 16 5.100 -10.691 -17.347 264 HA TYR 16 HA TYR 16 7.309 -10.321 -19.082 265 HB2 TYR 16 1HB TYR 16 6.495 -12.490 -18.028 266 HB3 TYR 16 2HB TYR 16 5.204 -12.543 -19.247 267 HD1 TYR 16 HD2 TYR 16 9.012 -12.532 -18.835 268 HD2 TYR 16 HD1 TYR 16 5.624 -13.429 -21.369 269 HE1 TYR 16 HE2 TYR 16 10.495 -13.627 -20.449 270 HE2 TYR 16 HE1 TYR 16 7.148 -14.600 -23.025 271 HH TYR 16 HH TYR 16 9.228 -15.110 -23.562 272 H LEU 17 H LEU 17 3.727 -10.485 -19.722 273 HA LEU 17 HA LEU 17 3.999 -10.303 -22.594 274 HB2 LEU 17 1HB LEU 17 1.800 -9.678 -20.603 275 HB3 LEU 17 2HB LEU 17 1.612 -9.531 -22.335 276 HG LEU 17 HG LEU 17 2.303 -12.142 -20.936 277 HD11 LEU 17 1HD1 LEU 17 0.075 -11.234 -20.296 278 HD12 LEU 17 2HD1 LEU 17 -0.043 -12.750 -21.258 279 HD13 LEU 17 3HD1 LEU 17 -0.370 -11.165 -22.028 280 HD21 LEU 17 3HD2 LEU 17 2.940 -12.246 -23.337 281 HD22 LEU 17 1HD2 LEU 17 1.359 -11.649 -23.811 282 HD23 LEU 17 2HD2 LEU 17 1.501 -13.253 -23.060 283 H VAL 18 H VAL 18 3.351 -7.788 -20.116 284 HA VAL 18 HA VAL 18 2.957 -5.771 -22.133 285 HB VAL 18 HB VAL 18 3.126 -5.561 -19.069 286 HG11 VAL 18 1HG1 VAL 18 3.398 -3.251 -19.817 287 HG12 VAL 18 2HG1 VAL 18 2.360 -3.494 -21.211 288 HG13 VAL 18 3HG1 VAL 18 1.638 -3.413 -19.614 289 HG21 VAL 18 3HG2 VAL 18 0.611 -5.385 -19.299 290 HG22 VAL 18 1HG2 VAL 18 0.805 -5.781 -21.073 291 HG23 VAL 18 2HG2 VAL 18 1.226 -6.965 -19.799 292 H CYS 19 H CYS 19 5.700 -6.598 -19.907 293 HA CYS 19 HA CYS 19 7.443 -4.903 -21.576 294 HB2 CYS 19 1HB CYS 19 8.203 -3.580 -19.680 295 HB3 CYS 19 2HB CYS 19 6.470 -3.318 -19.922 296 H GLY 20 H GLY 20 7.379 -7.767 -21.174 297 HA2 GLY 20 1HA GLY 20 9.217 -8.529 -19.154 298 HA3 GLY 20 2HA GLY 20 8.780 -9.476 -20.613 299 H GLU 21 H GLU 21 9.560 -7.061 -22.345 300 HA GLU 21 HA GLU 21 12.347 -7.869 -22.753 301 HB2 GLU 21 1HB GLU 21 12.402 -5.945 -24.339 302 HB3 GLU 21 2HB GLU 21 11.033 -7.038 -24.602 303 HG2 GLU 21 1HG GLU 21 9.537 -5.421 -23.368 304 HG3 GLU 21 2HG GLU 21 10.898 -4.260 -23.251 305 H ARG 22 H ARG 22 10.816 -5.270 -20.955 306 HA ARG 22 HA ARG 22 13.342 -4.694 -19.556 307 HB2 ARG 22 1HB ARG 22 11.967 -2.708 -21.450 308 HB3 ARG 22 2HB ARG 22 13.029 -2.181 -20.111 309 HG2 ARG 22 1HG ARG 22 14.834 -3.587 -21.112 310 HG3 ARG 22 2HG ARG 22 13.788 -3.778 -22.537 311 HD2 ARG 22 1HD ARG 22 13.610 -1.467 -22.857 312 HD3 ARG 22 2HD ARG 22 14.596 -1.112 -21.388 313 HE ARG 22 HE ARG 22 15.987 -2.787 -23.325 314 HH11 ARG 22 1HH1 ARG 22 15.203 0.611 -22.495 315 HH12 ARG 22 2HH1 ARG 22 16.581 1.195 -23.359 316 HH21 ARG 22 1HH2 ARG 22 17.762 -1.886 -24.425 317 HH22 ARG 22 2HH2 ARG 22 18.036 -0.143 -24.432 318 H GLY 23 H GLY 23 11.959 -5.290 -17.626 319 HA2 GLY 23 1HA GLY 23 10.531 -2.992 -16.651 320 HA3 GLY 23 2HA GLY 23 9.448 -4.264 -17.190 321 H PHE 24 H PHE 24 11.001 -6.541 -16.247 322 HA PHE 24 HA PHE 24 11.268 -5.954 -13.331 323 HB2 PHE 24 1HB PHE 24 9.569 -7.341 -12.612 324 HB3 PHE 24 2HB PHE 24 8.818 -6.433 -13.961 325 HD1 PHE 24 HD2 PHE 24 8.995 -7.693 -16.370 326 HD2 PHE 24 HD1 PHE 24 9.273 -9.724 -12.538 327 HE1 PHE 24 HE2 PHE 24 8.418 -9.858 -17.452 328 HE2 PHE 24 HE1 PHE 24 8.591 -11.804 -13.563 329 HZ PHE 24 HZ PHE 24 8.104 -11.923 -15.995 330 H PHE 25 H PHE 25 11.956 -8.038 -12.096 331 HA PHE 25 HA PHE 25 13.592 -9.694 -13.963 332 HB2 PHE 25 1HB PHE 25 14.765 -8.495 -12.116 333 HB3 PHE 25 2HB PHE 25 13.777 -9.416 -10.951 334 HD1 PHE 25 HD2 PHE 25 16.426 -9.711 -13.644 335 HD2 PHE 25 HD1 PHE 25 14.330 -11.722 -10.400 336 HE1 PHE 25 HE2 PHE 25 18.138 -11.526 -13.573 337 HE2 PHE 25 HE1 PHE 25 16.021 -13.543 -10.484 338 HZ PHE 25 HZ PHE 25 17.954 -13.435 -12.068 339 H NVA 26 H ARX 26 12.887 -11.542 -14.503 340 HA NVA 26 HA ARX 26 11.069 -13.148 -12.829 341 HB2 NVA 26 1HB ARX 26 10.577 -12.861 -15.210 342 HB3 NVA 26 2HB ARX 26 12.088 -13.617 -15.720 343 HG2 NVA 26 1HG ARX 26 10.873 -15.486 -13.841 344 HG3 NVA 26 2HG ARX 26 9.546 -14.879 -14.825 345 HD2 NVA 26 1HD ARX 26 10.448 -15.714 -16.856 346 HD3 NVA 26 2HD ARX 26 12.051 -15.951 -16.165 347 H THR 27 H THR 27 11.809 -14.296 -11.293 348 HA THR 27 HA THR 27 14.693 -15.130 -11.110 349 HB THR 27 HB THR 27 13.785 -16.504 -9.128 350 HG1 THR 27 HG1 THR 27 11.597 -16.752 -10.001 351 HG21 THR 27 1HG2 THR 27 12.881 -13.619 -9.066 352 HG22 THR 27 2HG2 THR 27 14.548 -14.146 -8.787 353 HG23 THR 27 3HG2 THR 27 13.254 -14.633 -7.651 354 HA PRO 28 HA PRO 28 14.245 -18.449 -13.708 355 HB2 PRO 28 1HB PRO 28 15.568 -20.589 -12.558 356 HB3 PRO 28 2HB PRO 28 16.414 -19.193 -13.342 357 HG2 PRO 28 1HG PRO 28 15.704 -19.625 -10.395 358 HG3 PRO 28 2HG PRO 28 17.295 -19.215 -11.136 359 HD2 PRO 28 1HD PRO 28 15.674 -17.362 -10.053 360 HD3 PRO 28 2HD PRO 28 16.456 -16.957 -11.580 361 H HIX 29 H HIX 29 12.765 -19.999 -14.259 362 HA HIX 29 HA HIX 29 11.244 -21.573 -12.236 363 HB1 HIX 29 1HB HIX 29 9.214 -20.973 -13.857 364 HB2 HIX 29 2HB HIX 29 9.712 -19.849 -12.617 365 HD2 HIX 29 HD2 HIX 29 10.534 -17.421 -13.519 366 HD1 HIX 29 HD1 HIX 29 10.076 -20.401 -16.368 367 HE1 HIX 29 HE1 HIX 29 11.302 -18.376 -17.183 368 H THR 30 H THR 30 13.053 -23.089 -13.247 369 HA THR 30 HA THR 30 11.780 -24.827 -15.300 370 HB THR 30 HB THR 30 14.605 -23.694 -15.772 371 HG1 THR 30 HG1 THR 30 12.050 -22.772 -16.400 372 HG21 THR 30 1HG2 THR 30 14.172 -24.730 -18.054 373 HG22 THR 30 2HG2 THR 30 12.689 -25.480 -17.442 374 HG23 THR 30 3HG2 THR 30 14.275 -25.930 -16.786 Start of MODEL 24 1 H1 GLY 1 1H GLY 1 3.645 2.553 -1.591 2 H2 GLY 1 2H GLY 1 3.249 2.708 -3.139 3 H3 GLY 1 3H GLY 1 2.094 2.764 -2.109 4 HA2 GLY 1 1HA GLY 1 3.813 0.394 -2.357 5 HA3 GLY 1 2HA GLY 1 2.163 0.462 -1.631 6 H ILE 2 H ILE 2 2.689 -1.513 -3.704 7 HA ILE 2 HA ILE 2 0.627 -0.540 -5.548 8 HB ILE 2 HB ILE 2 2.683 0.342 -6.556 9 HG12 ILE 2 1HG1 ILE 2 1.365 -1.830 -8.210 10 HG13 ILE 2 2HG1 ILE 2 0.641 -0.321 -7.809 11 HG21 ILE 2 1HG2 ILE 2 3.654 -2.504 -7.014 12 HG22 ILE 2 2HG2 ILE 2 4.448 -0.969 -7.502 13 HG23 ILE 2 3HG2 ILE 2 4.309 -1.423 -5.791 14 HD11 ILE 2 3HD1 ILE 2 2.738 0.771 -8.957 15 HD12 ILE 2 1HD1 ILE 2 2.918 -0.840 -9.665 16 HD13 ILE 2 2HD1 ILE 2 1.410 0.080 -9.936 17 H VAL 3 H VAL 3 2.458 -3.223 -4.198 18 HA VAL 3 HA VAL 3 1.421 -5.194 -6.013 19 HB VAL 3 HB VAL 3 2.460 -5.488 -3.159 20 HG11 VAL 3 1HG1 VAL 3 1.126 -7.403 -3.885 21 HG12 VAL 3 2HG1 VAL 3 2.140 -7.590 -5.304 22 HG13 VAL 3 3HG1 VAL 3 2.845 -7.785 -3.662 23 HG21 VAL 3 3HG2 VAL 3 4.111 -4.442 -4.574 24 HG22 VAL 3 1HG2 VAL 3 4.583 -6.168 -4.352 25 HG23 VAL 3 2HG2 VAL 3 3.831 -5.635 -5.910 26 H GLU 4 H GLU 4 0.373 -4.227 -2.788 27 HA GLU 4 HA GLU 4 -1.852 -5.872 -2.536 28 HB2 GLU 4 1HB GLU 4 -0.748 -4.507 -0.795 29 HB3 GLU 4 2HB GLU 4 -1.554 -3.071 -1.456 30 HG2 GLU 4 1HG GLU 4 -3.719 -4.098 -1.060 31 HG3 GLU 4 2HG GLU 4 -2.919 -5.536 -0.410 32 H GLN 5 H GLN 5 -1.523 -2.569 -3.786 33 HA GLN 5 HA GLN 5 -4.239 -2.156 -4.426 34 HB2 GLN 5 1HB GLN 5 -1.634 -1.079 -5.616 35 HB3 GLN 5 2HB GLN 5 -3.242 -0.423 -6.008 36 HG2 GLN 5 1HG GLN 5 -2.264 1.052 -4.295 37 HG3 GLN 5 2HG GLN 5 -3.659 0.177 -3.635 38 HE21 GLN 5 2HE2 GLN 5 -3.211 0.303 -1.548 39 HE22 GLN 5 1HE2 GLN 5 -1.801 -0.393 -0.802 40 H CYS 6 H CYS 6 -1.665 -3.743 -6.250 41 HA CYS 6 HA CYS 6 -3.268 -4.003 -8.655 42 HB2 CYS 6 1HB CYS 6 -0.693 -4.209 -8.100 43 HB3 CYS 6 2HB CYS 6 -1.111 -5.909 -8.000 44 H CYS 7 H CYS 7 -2.635 -6.030 -5.740 45 HA CYS 7 HA CYS 7 -4.138 -8.304 -6.707 46 HB2 CYS 7 1HB CYS 7 -2.751 -7.548 -4.271 47 HB3 CYS 7 2HB CYS 7 -4.297 -8.296 -3.919 48 H THR 8 H THR 8 -5.182 -5.269 -5.193 49 HA THR 8 HA THR 8 -7.722 -6.404 -4.320 50 HB THR 8 HB THR 8 -8.419 -4.016 -4.018 51 HG1 THR 8 HG1 THR 8 -6.693 -3.306 -5.601 52 HG21 THR 8 1HG2 THR 8 -5.941 -5.008 -2.627 53 HG22 THR 8 2HG2 THR 8 -7.611 -5.330 -2.115 54 HG23 THR 8 3HG2 THR 8 -6.968 -3.678 -2.083 55 H SER 9 H SER 9 -8.473 -7.415 -6.157 56 HA SER 9 HA SER 9 -10.158 -7.536 -7.667 57 HB2 SER 9 1HB SER 9 -11.091 -5.335 -6.823 58 HB3 SER 9 2HB SER 9 -10.139 -4.517 -8.046 59 HG SER 9 HG SER 9 -12.210 -4.801 -8.664 60 H ILE 10 H ILE 10 -10.015 -5.445 -9.926 61 HA ILE 10 HA ILE 10 -8.301 -6.998 -11.642 62 HB ILE 10 HB ILE 10 -9.487 -4.182 -12.042 63 HG12 ILE 10 1HG1 ILE 10 -11.267 -5.796 -11.612 64 HG13 ILE 10 2HG1 ILE 10 -11.277 -5.301 -13.304 65 HG21 ILE 10 1HG2 ILE 10 -7.946 -6.078 -13.771 66 HG22 ILE 10 2HG2 ILE 10 -9.266 -5.161 -14.529 67 HG23 ILE 10 3HG2 ILE 10 -7.947 -4.291 -13.745 68 HD11 ILE 10 3HD1 ILE 10 -10.000 -7.925 -12.397 69 HD12 ILE 10 1HD1 ILE 10 -11.739 -7.782 -12.855 70 HD13 ILE 10 2HD1 ILE 10 -10.464 -7.440 -14.038 71 H CYS 11 H CYS 11 -6.134 -6.823 -11.964 72 HA CYS 11 HA CYS 11 -4.534 -5.128 -10.371 73 HB2 CYS 11 1HB CYS 11 -4.069 -7.237 -12.264 74 HB3 CYS 11 2HB CYS 11 -3.045 -5.857 -12.676 75 H SER 12 H SER 12 -5.827 -4.641 -13.548 76 HA SER 12 HA SER 12 -5.875 -2.813 -14.927 77 HB2 SER 12 1HB SER 12 -4.735 -1.246 -12.641 78 HB3 SER 12 2HB SER 12 -5.597 -0.636 -14.078 79 HG SER 12 HG SER 12 -6.632 -1.954 -11.849 80 H LEU 13 H LEU 13 -4.910 -2.052 -16.627 81 HA LEU 13 HA LEU 13 -2.305 -2.966 -17.227 82 HB2 LEU 13 1HB LEU 13 -4.051 -2.522 -18.843 83 HB3 LEU 13 2HB LEU 13 -3.968 -0.822 -18.512 84 HG LEU 13 HG LEU 13 -1.731 -0.683 -19.529 85 HD11 LEU 13 1HD1 LEU 13 -0.913 -2.655 -20.865 86 HD12 LEU 13 2HD1 LEU 13 -2.180 -3.652 -20.136 87 HD13 LEU 13 3HD1 LEU 13 -0.911 -2.943 -19.106 88 HD21 LEU 13 3HD2 LEU 13 -3.710 -0.301 -20.927 89 HD22 LEU 13 1HD2 LEU 13 -3.919 -2.058 -21.202 90 HD23 LEU 13 2HD2 LEU 13 -2.517 -1.188 -21.886 91 H TYR 14 H TYR 14 -3.319 0.330 -16.133 92 HA TYR 14 HA TYR 14 -0.742 1.467 -16.753 93 HB2 TYR 14 1HB TYR 14 -1.646 3.365 -15.271 94 HB3 TYR 14 2HB TYR 14 -2.407 2.989 -16.812 95 HD1 TYR 14 HD2 TYR 14 -2.808 2.760 -13.100 96 HD2 TYR 14 HD1 TYR 14 -4.729 2.153 -16.919 97 HE1 TYR 14 HE2 TYR 14 -4.987 2.459 -11.953 98 HE2 TYR 14 HE1 TYR 14 -6.933 1.912 -15.726 99 HH TYR 14 HH TYR 14 -7.203 2.009 -12.205 100 H GLN 15 H GLN 15 -2.138 -0.076 -13.862 101 HA GLN 15 HA GLN 15 0.035 0.706 -12.163 102 HB2 GLN 15 1HB GLN 15 -1.800 -1.662 -11.936 103 HB3 GLN 15 2HB GLN 15 -0.719 -1.020 -10.703 104 HG2 GLN 15 1HG GLN 15 -2.016 1.162 -10.946 105 HG3 GLN 15 2HG GLN 15 -3.253 0.185 -11.779 106 HE21 GLN 15 2HE2 GLN 15 -3.593 -2.025 -10.462 107 HE22 GLN 15 1HE2 GLN 15 -3.885 -1.729 -8.738 108 H LEU 16 H LEU 16 -0.599 -2.163 -14.299 109 HA LEU 16 HA LEU 16 1.791 -3.494 -13.532 110 HB2 LEU 16 1HB LEU 16 0.080 -3.522 -16.010 111 HB3 LEU 16 2HB LEU 16 1.501 -4.596 -15.797 112 HG LEU 16 HG LEU 16 -0.920 -4.598 -13.962 113 HD11 LEU 16 1HD1 LEU 16 -1.460 -6.714 -15.159 114 HD12 LEU 16 2HD1 LEU 16 -0.217 -6.302 -16.331 115 HD13 LEU 16 3HD1 LEU 16 -1.663 -5.241 -16.146 116 HD21 LEU 16 3HD2 LEU 16 1.150 -6.729 -14.293 117 HD22 LEU 16 1HD2 LEU 16 -0.198 -6.673 -13.149 118 HD23 LEU 16 2HD2 LEU 16 1.183 -5.548 -13.003 119 H GLU 17 H GLU 17 1.123 -1.051 -16.101 120 HA GLU 17 HA GLU 17 3.755 -1.087 -17.227 121 HB2 GLU 17 1HB GLU 17 1.640 1.044 -17.042 122 HB3 GLU 17 2HB GLU 17 3.206 1.331 -17.776 123 HG2 GLU 17 1HG GLU 17 2.738 -0.603 -19.282 124 HG3 GLU 17 2HG GLU 17 1.102 -0.635 -18.634 125 H ASN 18 H ASN 18 2.434 0.453 -14.312 126 HA ASN 18 HA ASN 18 4.580 2.304 -13.890 127 HB2 ASN 18 1HB ASN 18 2.295 2.153 -12.712 128 HB3 ASN 18 2HB ASN 18 3.003 0.893 -11.702 129 HD21 ASN 18 2HD2 ASN 18 2.609 4.206 -12.196 130 HD22 ASN 18 1HD2 ASN 18 3.619 4.740 -10.886 131 H TYR 19 H TYR 19 4.476 -1.252 -13.548 132 HA TYR 19 HA TYR 19 6.697 -1.255 -11.590 133 HB2 TYR 19 1HB TYR 19 5.426 -3.440 -13.372 134 HB3 TYR 19 2HB TYR 19 6.818 -3.767 -12.317 135 HD1 TYR 19 HD2 TYR 19 3.221 -2.872 -12.408 136 HD2 TYR 19 HD1 TYR 19 6.464 -4.141 -9.895 137 HE1 TYR 19 HE2 TYR 19 1.616 -3.466 -10.619 138 HE2 TYR 19 HE1 TYR 19 4.818 -4.699 -8.145 139 HH TYR 19 HH TYR 19 1.292 -4.251 -8.538 140 H CYS 20 H CYS 20 6.359 -0.970 -15.113 141 HA CYS 20 HA CYS 20 8.846 -2.309 -15.726 142 HB2 CYS 20 1HB CYS 20 7.462 -0.284 -17.430 143 HB3 CYS 20 2HB CYS 20 8.446 -1.668 -17.971 144 H ASN 21 H ASN 21 10.655 -1.116 -16.731 145 HA ASN 21 HA ASN 21 11.316 1.249 -15.063 146 HB2 ASN 21 1HB ASN 21 13.021 -0.516 -16.903 147 HB3 ASN 21 2HB ASN 21 13.662 0.880 -16.059 148 HD21 ASN 21 2HD2 ASN 21 13.586 -2.321 -15.940 149 HD22 ASN 21 1HD2 ASN 21 13.657 -2.580 -14.187 150 H1 PHE 1 1H PHE 1 -3.852 -6.370 -22.868 151 H2 PHE 1 2H PHE 1 -2.316 -6.996 -22.960 152 H3 PHE 1 3H PHE 1 -3.617 -8.001 -23.324 153 HA PHE 1 HA PHE 1 -2.687 -8.419 -21.085 154 HB2 PHE 1 1HB PHE 1 -2.067 -6.181 -20.502 155 HB3 PHE 1 2HB PHE 1 -3.764 -5.634 -20.693 156 HD1 PHE 1 HD1 PHE 1 -2.020 -8.379 -18.971 157 HD2 PHE 1 HD2 PHE 1 -4.888 -5.225 -18.602 158 HE1 PHE 1 HE1 PHE 1 -2.404 -9.022 -16.533 159 HE2 PHE 1 HE2 PHE 1 -5.218 -5.795 -16.299 160 HZ PHE 1 HZ PHE 1 -4.017 -7.719 -15.189 161 H VAL 2 H VAL 2 -5.562 -6.362 -21.447 162 HA VAL 2 HA VAL 2 -7.759 -6.830 -21.433 163 HB VAL 2 HB VAL 2 -7.182 -9.838 -21.304 164 HG11 VAL 2 1HG1 VAL 2 -9.511 -10.080 -22.072 165 HG12 VAL 2 2HG1 VAL 2 -9.445 -9.324 -20.475 166 HG13 VAL 2 3HG1 VAL 2 -9.774 -8.324 -21.917 167 HG21 VAL 2 3HG2 VAL 2 -7.906 -8.069 -23.691 168 HG22 VAL 2 1HG2 VAL 2 -6.362 -8.881 -23.419 169 HG23 VAL 2 2HG2 VAL 2 -7.768 -9.844 -23.697 170 H ASN 3 H ASN 3 -9.116 -6.622 -19.661 171 HA ASN 3 HA ASN 3 -7.812 -6.511 -17.095 172 HB2 ASN 3 1HB ASN 3 -9.774 -5.518 -16.431 173 HB3 ASN 3 2HB ASN 3 -9.863 -5.229 -18.145 174 HD21 ASN 3 2HD2 ASN 3 -11.180 -6.930 -19.390 175 HD22 ASN 3 1HD2 ASN 3 -12.605 -7.579 -18.582 176 H GLN 4 H GLN 4 -7.683 -7.830 -15.416 177 HA GLN 4 HA GLN 4 -9.392 -10.153 -14.964 178 HB2 GLN 4 1HB GLN 4 -6.891 -10.279 -16.548 179 HB3 GLN 4 2HB GLN 4 -6.841 -11.313 -15.100 180 HG2 GLN 4 1HG GLN 4 -8.432 -12.697 -15.949 181 HG3 GLN 4 2HG GLN 4 -9.328 -11.410 -16.748 182 HE21 GLN 4 2HE2 GLN 4 -9.419 -11.915 -18.790 183 HE22 GLN 4 1HE2 GLN 4 -8.049 -12.400 -19.757 184 H HIS 5 H HIS 5 -8.655 -11.386 -13.026 185 HA HIS 5 HA HIS 5 -7.373 -9.541 -11.046 186 HB2 HIS 5 1HB HIS 5 -8.753 -12.250 -11.046 187 HB3 HIS 5 2HB HIS 5 -7.778 -11.728 -9.646 188 HD1 HIS 5 HD1 HIS 5 -10.557 -10.075 -11.798 189 HD2 HIS 5 HD2 HIS 5 -9.391 -10.605 -7.828 190 HE1 HIS 5 HE1 HIS 5 -12.273 -8.895 -10.324 191 H LEU 6 H LEU 6 -5.328 -9.685 -10.377 192 HA LEU 6 HA LEU 6 -3.753 -12.133 -11.151 193 HB2 LEU 6 1HB LEU 6 -3.182 -9.203 -11.522 194 HB3 LEU 6 2HB LEU 6 -1.871 -10.332 -11.318 195 HG LEU 6 HG LEU 6 -2.124 -9.815 -13.669 196 HD11 LEU 6 1HD1 LEU 6 -2.247 -12.071 -14.561 197 HD12 LEU 6 2HD1 LEU 6 -3.113 -12.638 -13.149 198 HD13 LEU 6 3HD1 LEU 6 -1.423 -12.048 -13.001 199 HD21 LEU 6 3HD2 LEU 6 -4.079 -10.259 -14.926 200 HD22 LEU 6 1HD2 LEU 6 -4.544 -9.313 -13.525 201 HD23 LEU 6 2HD2 LEU 6 -4.905 -11.024 -13.574 202 H CYS 7 H CYS 7 -3.587 -13.052 -9.171 203 HA CYS 7 HA CYS 7 -2.029 -11.402 -7.248 204 HB2 CYS 7 1HB CYS 7 -4.347 -13.230 -6.581 205 HB3 CYS 7 2HB CYS 7 -3.025 -13.040 -5.432 206 H GLY 8 H GLY 8 -2.333 -14.391 -8.897 207 HA2 GLY 8 1HA GLY 8 -0.393 -15.672 -7.062 208 HA3 GLY 8 2HA GLY 8 -1.101 -16.418 -8.514 209 H SER 9 H SER 9 1.119 -17.133 -8.866 210 HA SER 9 HA SER 9 3.078 -15.277 -9.681 211 HB2 SER 9 1HB SER 9 3.468 -17.750 -9.264 212 HB3 SER 9 2HB SER 9 2.721 -18.038 -10.880 213 HG SER 9 HG SER 9 4.419 -16.849 -11.787 214 H HIS 10 H HIS 10 0.088 -15.935 -11.177 215 HA HIS 10 HA HIS 10 0.716 -15.691 -13.963 216 HB2 HIS 10 1HB HIS 10 -1.672 -14.854 -12.340 217 HB3 HIS 10 2HB HIS 10 -1.677 -14.880 -14.087 218 HD1 HIS 10 HD1 HIS 10 -2.979 -16.808 -11.449 219 HD2 HIS 10 HD2 HIS 10 -0.822 -17.759 -14.891 220 HE1 HIS 10 HE1 HIS 10 -3.371 -19.248 -11.928 221 H LEU 11 H LEU 11 0.904 -13.479 -11.234 222 HA LEU 11 HA LEU 11 0.534 -11.032 -12.678 223 HB2 LEU 11 1HB LEU 11 0.475 -11.267 -10.238 224 HB3 LEU 11 2HB LEU 11 2.174 -11.711 -10.196 225 HG LEU 11 HG LEU 11 2.863 -9.511 -10.966 226 HD11 LEU 11 1HD1 LEU 11 -0.020 -8.848 -10.857 227 HD12 LEU 11 2HD1 LEU 11 0.984 -8.888 -12.316 228 HD13 LEU 11 3HD1 LEU 11 1.283 -7.685 -11.025 229 HD21 LEU 11 3HD2 LEU 11 0.913 -9.543 -8.564 230 HD22 LEU 11 1HD2 LEU 11 2.114 -8.246 -8.822 231 HD23 LEU 11 2HD2 LEU 11 2.638 -9.908 -8.491 232 H VAL 12 H VAL 12 3.281 -13.307 -12.322 233 HA VAL 12 HA VAL 12 5.246 -11.496 -13.333 234 HB VAL 12 HB VAL 12 5.341 -14.577 -13.470 235 HG11 VAL 12 1HG1 VAL 12 7.485 -12.404 -13.474 236 HG12 VAL 12 2HG1 VAL 12 7.847 -14.146 -13.275 237 HG13 VAL 12 3HG1 VAL 12 7.112 -13.539 -14.785 238 HG21 VAL 12 3HG2 VAL 12 4.833 -13.711 -11.138 239 HG22 VAL 12 1HG2 VAL 12 6.365 -14.611 -11.307 240 HG23 VAL 12 2HG2 VAL 12 6.408 -12.828 -11.216 241 H GLU 13 H GLU 13 3.004 -13.876 -14.855 242 HA GLU 13 HA GLU 13 4.067 -13.514 -17.502 243 HB2 GLU 13 1HB GLU 13 1.286 -14.352 -16.614 244 HB3 GLU 13 2HB GLU 13 1.974 -14.524 -18.268 245 HG2 GLU 13 1HG GLU 13 3.895 -15.737 -16.846 246 HG3 GLU 13 2HG GLU 13 2.457 -16.137 -15.855 247 H ALA 14 H ALA 14 1.608 -11.864 -15.579 248 HA ALA 14 HA ALA 14 0.453 -10.340 -17.685 249 HB1 ALA 14 3HB ALA 14 0.750 -9.894 -14.684 250 HB2 ALA 14 1HB ALA 14 -0.057 -8.684 -15.719 251 HB3 ALA 14 2HB ALA 14 -0.647 -10.353 -15.599 252 H LEU 15 H LEU 15 3.156 -9.689 -15.523 253 HA LEU 15 HA LEU 15 3.710 -7.088 -16.673 254 HB2 LEU 15 1HB LEU 15 5.287 -8.921 -14.878 255 HB3 LEU 15 2HB LEU 15 5.927 -7.385 -15.473 256 HG LEU 15 HG LEU 15 3.359 -7.630 -13.923 257 HD11 LEU 15 1HD1 LEU 15 4.452 -7.053 -11.966 258 HD12 LEU 15 2HD1 LEU 15 6.007 -6.829 -12.830 259 HD13 LEU 15 3HD1 LEU 15 5.301 -8.454 -12.655 260 HD21 LEU 15 3HD2 LEU 15 3.520 -5.614 -15.223 261 HD22 LEU 15 1HD2 LEU 15 5.125 -5.261 -14.563 262 HD23 LEU 15 2HD2 LEU 15 3.709 -5.229 -13.521 263 H TYR 16 H TYR 16 4.829 -10.377 -17.284 264 HA TYR 16 HA TYR 16 7.056 -9.723 -19.017 265 HB2 TYR 16 1HB TYR 16 6.441 -12.006 -18.120 266 HB3 TYR 16 2HB TYR 16 5.056 -12.057 -19.184 267 HD1 TYR 16 HD1 TYR 16 8.731 -12.142 -19.103 268 HD2 TYR 16 HD2 TYR 16 5.185 -12.656 -21.513 269 HE1 TYR 16 HE1 TYR 16 10.125 -13.204 -20.862 270 HE2 TYR 16 HE2 TYR 16 6.616 -13.699 -23.313 271 HH TYR 16 HH TYR 16 8.766 -14.456 -23.890 272 H LEU 17 H LEU 17 3.561 -9.981 -19.587 273 HA LEU 17 HA LEU 17 3.965 -9.468 -22.428 274 HB2 LEU 17 1HB LEU 17 1.434 -9.767 -20.759 275 HB3 LEU 17 2HB LEU 17 1.498 -9.480 -22.485 276 HG LEU 17 HG LEU 17 2.821 -11.897 -21.218 277 HD11 LEU 17 1HD1 LEU 17 0.442 -12.060 -20.772 278 HD12 LEU 17 2HD1 LEU 17 0.868 -13.214 -22.047 279 HD13 LEU 17 3HD1 LEU 17 0.082 -11.695 -22.468 280 HD21 LEU 17 3HD2 LEU 17 3.705 -11.292 -23.448 281 HD22 LEU 17 1HD2 LEU 17 2.059 -11.226 -24.112 282 HD23 LEU 17 2HD2 LEU 17 2.790 -12.773 -23.586 283 H VAL 18 H VAL 18 3.022 -7.569 -19.611 284 HA VAL 18 HA VAL 18 2.090 -5.386 -21.250 285 HB VAL 18 HB VAL 18 2.579 -5.514 -18.258 286 HG11 VAL 18 1HG1 VAL 18 1.110 -3.409 -18.323 287 HG12 VAL 18 2HG1 VAL 18 2.854 -3.263 -18.697 288 HG13 VAL 18 3HG1 VAL 18 1.687 -3.221 -20.004 289 HG21 VAL 18 3HG2 VAL 18 0.070 -5.436 -18.223 290 HG22 VAL 18 1HG2 VAL 18 0.021 -5.465 -19.997 291 HG23 VAL 18 2HG2 VAL 18 0.630 -6.870 -19.122 292 H CYS 19 H CYS 19 5.125 -5.913 -19.307 293 HA CYS 19 HA CYS 19 6.127 -3.381 -20.283 294 HB2 CYS 19 1HB CYS 19 7.720 -5.742 -19.205 295 HB3 CYS 19 2HB CYS 19 8.283 -4.039 -19.325 296 H GLY 20 H GLY 20 5.945 -6.631 -21.560 297 HA2 GLY 20 1HA GLY 20 6.370 -7.259 -23.759 298 HA3 GLY 20 2HA GLY 20 7.107 -5.670 -24.037 299 H GLU 21 H GLU 21 9.253 -5.305 -23.139 300 HA GLU 21 HA GLU 21 10.997 -7.755 -23.405 301 HB2 GLU 21 1HB GLU 21 12.808 -6.019 -23.602 302 HB3 GLU 21 2HB GLU 21 11.493 -5.863 -24.804 303 HG2 GLU 21 1HG GLU 21 10.451 -4.158 -23.235 304 HG3 GLU 21 2HG GLU 21 12.066 -4.023 -22.530 305 H ARG 22 H ARG 22 9.353 -7.486 -21.118 306 HA ARG 22 HA ARG 22 9.354 -7.999 -18.930 307 HB2 ARG 22 1HB ARG 22 12.333 -7.975 -19.093 308 HB3 ARG 22 2HB ARG 22 11.355 -8.745 -17.837 309 HG2 ARG 22 1HG ARG 22 10.455 -10.311 -19.473 310 HG3 ARG 22 2HG ARG 22 11.498 -9.631 -20.719 311 HD2 ARG 22 1HD ARG 22 13.543 -10.176 -19.471 312 HD3 ARG 22 2HD ARG 22 12.557 -10.814 -18.125 313 HE ARG 22 HE ARG 22 12.205 -12.713 -19.331 314 HH11 ARG 22 1HH1 ARG 22 13.547 -10.381 -21.504 315 HH12 ARG 22 2HH1 ARG 22 13.835 -11.521 -22.759 316 HH21 ARG 22 1HH2 ARG 22 12.652 -14.174 -21.034 317 HH22 ARG 22 2HH2 ARG 22 13.334 -13.628 -22.479 318 H GLY 23 H GLY 23 10.385 -7.290 -16.651 319 HA2 GLY 23 1HA GLY 23 11.414 -4.710 -16.327 320 HA3 GLY 23 2HA GLY 23 9.729 -4.428 -16.707 321 H PHE 24 H PHE 24 11.383 -7.066 -14.896 322 HA PHE 24 HA PHE 24 10.116 -6.275 -12.344 323 HB2 PHE 24 1HB PHE 24 8.918 -8.430 -12.134 324 HB3 PHE 24 2HB PHE 24 8.245 -7.349 -13.389 325 HD1 PHE 24 HD2 PHE 24 10.268 -10.461 -12.898 326 HD2 PHE 24 HD1 PHE 24 8.176 -8.023 -15.760 327 HE1 PHE 24 HE2 PHE 24 10.369 -12.313 -14.558 328 HE2 PHE 24 HE1 PHE 24 8.360 -9.793 -17.446 329 HZ PHE 24 HZ PHE 24 9.382 -11.928 -16.851 330 H PHE 25 H PHE 25 10.782 -7.835 -10.660 331 HA PHE 25 HA PHE 25 13.547 -8.805 -11.157 332 HB2 PHE 25 1HB PHE 25 13.138 -7.587 -9.073 333 HB3 PHE 25 2HB PHE 25 11.837 -8.672 -8.633 334 HD1 PHE 25 HD2 PHE 25 15.418 -9.096 -9.839 335 HD2 PHE 25 HD1 PHE 25 12.504 -10.064 -6.809 336 HE1 PHE 25 HE2 PHE 25 17.041 -10.527 -8.666 337 HE2 PHE 25 HE1 PHE 25 14.132 -11.570 -5.680 338 HZ PHE 25 HZ PHE 25 16.417 -11.845 -6.651 339 H NVA 26 H ARX 26 10.551 -10.176 -9.644 340 HA NVA 26 HA ARX 26 9.721 -12.241 -9.454 341 HB2 NVA 26 1HB ARX 26 10.126 -12.747 -11.814 342 HB3 NVA 26 2HB ARX 26 11.680 -13.395 -11.458 343 HG2 NVA 26 1HG ARX 26 10.133 -14.827 -9.668 344 HG3 NVA 26 2HG ARX 26 9.039 -14.658 -10.997 345 HD2 NVA 26 1HD ARX 26 10.476 -15.936 -12.493 346 HD3 NVA 26 2HD ARX 26 11.899 -15.696 -11.485 347 H THR 27 H THR 27 10.007 -12.584 -7.342 348 HA THR 27 HA THR 27 12.592 -13.003 -6.131 349 HB THR 27 HB THR 27 11.243 -13.904 -4.206 350 HG1 THR 27 HG1 THR 27 9.397 -14.702 -5.153 351 HG21 THR 27 1HG2 THR 27 10.330 -11.785 -3.609 352 HG22 THR 27 2HG2 THR 27 10.046 -11.366 -5.301 353 HG23 THR 27 3HG2 THR 27 11.691 -11.369 -4.672 354 HA PRO 28 HA PRO 28 13.512 -16.776 -7.583 355 HB2 PRO 28 1HB PRO 28 14.624 -18.330 -5.601 356 HB3 PRO 28 2HB PRO 28 15.458 -16.906 -6.294 357 HG2 PRO 28 1HG PRO 28 13.800 -16.954 -3.789 358 HG3 PRO 28 2HG PRO 28 15.472 -16.328 -4.057 359 HD2 PRO 28 1HD PRO 28 13.462 -14.618 -4.114 360 HD3 PRO 28 2HD PRO 28 14.736 -14.500 -5.364 361 H HIX 29 H HIX 29 12.522 -18.608 -8.122 362 HA HIX 29 HA HIX 29 10.555 -19.881 -6.152 363 HB1 HIX 29 1HB HIX 29 9.164 -20.352 -8.404 364 HB2 HIX 29 2HB HIX 29 9.084 -18.816 -7.558 365 HD2 HIX 29 HD2 HIX 29 10.182 -16.672 -8.780 366 HD1 HIX 29 HD1 HIX 29 10.094 -20.267 -10.953 367 HE1 HIX 29 HE1 HIX 29 11.563 -18.504 -11.894 368 H THR 30 H THR 30 10.975 -21.711 -5.659 369 HA THR 30 HA THR 30 11.864 -23.810 -7.545 370 HB THR 30 HB THR 30 13.346 -24.186 -5.147 371 HG1 THR 30 HG1 THR 30 13.438 -21.611 -6.264 372 HG21 THR 30 1HG2 THR 30 15.184 -24.418 -6.554 373 HG22 THR 30 2HG2 THR 30 14.469 -23.358 -7.815 374 HG23 THR 30 3HG2 THR 30 13.806 -25.002 -7.496 Start of MODEL 25 1 H1 GLY 1 1H GLY 1 -1.481 1.924 -1.865 2 H2 GLY 1 2H GLY 1 -2.291 0.594 -1.342 3 H3 GLY 1 3H GLY 1 -1.246 1.341 -0.313 4 HA2 GLY 1 1HA GLY 1 0.662 0.664 -1.574 5 HA3 GLY 1 2HA GLY 1 -0.337 -0.757 -1.277 6 H ILE 2 H ILE 2 0.875 -1.637 -3.202 7 HA ILE 2 HA ILE 2 -0.681 -0.914 -5.656 8 HB ILE 2 HB ILE 2 1.543 0.287 -5.680 9 HG12 ILE 2 1HG1 ILE 2 1.214 -1.958 -7.778 10 HG13 ILE 2 2HG1 ILE 2 0.344 -0.392 -7.741 11 HG21 ILE 2 1HG2 ILE 2 3.667 -0.842 -5.915 12 HG22 ILE 2 2HG2 ILE 2 2.902 -1.540 -4.442 13 HG23 ILE 2 3HG2 ILE 2 2.907 -2.444 -5.977 14 HD11 ILE 2 3HD1 ILE 2 2.225 -0.360 -9.389 15 HD12 ILE 2 1HD1 ILE 2 2.423 0.847 -8.087 16 HD13 ILE 2 2HD1 ILE 2 3.416 -0.631 -8.063 17 H VAL 3 H VAL 3 1.465 -3.353 -4.023 18 HA VAL 3 HA VAL 3 0.832 -5.299 -6.028 19 HB VAL 3 HB VAL 3 1.873 -5.672 -3.242 20 HG11 VAL 3 1HG1 VAL 3 1.810 -7.598 -5.582 21 HG12 VAL 3 2HG1 VAL 3 2.742 -7.886 -4.044 22 HG13 VAL 3 3HG1 VAL 3 0.986 -7.810 -3.984 23 HG21 VAL 3 3HG2 VAL 3 4.098 -5.998 -4.465 24 HG22 VAL 3 1HG2 VAL 3 3.252 -5.323 -5.917 25 HG23 VAL 3 2HG2 VAL 3 3.442 -4.345 -4.453 26 H GLU 4 H GLU 4 -0.456 -4.794 -2.737 27 HA GLU 4 HA GLU 4 -2.407 -6.929 -2.789 28 HB2 GLU 4 1HB GLU 4 -1.574 -5.630 -0.790 29 HB3 GLU 4 2HB GLU 4 -2.523 -4.273 -1.328 30 HG2 GLU 4 1HG GLU 4 -4.593 -5.706 -1.100 31 HG3 GLU 4 2HG GLU 4 -3.596 -7.023 -0.467 32 H GLN 5 H GLN 5 -2.337 -3.511 -3.938 33 HA GLN 5 HA GLN 5 -5.062 -3.121 -4.436 34 HB2 GLN 5 1HB GLN 5 -3.154 -1.433 -4.425 35 HB3 GLN 5 2HB GLN 5 -2.717 -1.995 -6.034 36 HG2 GLN 5 1HG GLN 5 -4.874 -1.363 -6.987 37 HG3 GLN 5 2HG GLN 5 -5.405 -0.827 -5.361 38 HE21 GLN 5 2HE2 GLN 5 -5.536 1.367 -5.365 39 HE22 GLN 5 1HE2 GLN 5 -4.273 2.407 -5.994 40 H CYS 6 H CYS 6 -2.473 -4.512 -6.437 41 HA CYS 6 HA CYS 6 -4.318 -5.028 -8.696 42 HB2 CYS 6 1HB CYS 6 -1.327 -5.181 -8.218 43 HB3 CYS 6 2HB CYS 6 -2.049 -6.034 -9.589 44 H CYS 7 H CYS 7 -3.241 -6.850 -5.894 45 HA CYS 7 HA CYS 7 -3.832 -9.405 -7.097 46 HB2 CYS 7 1HB CYS 7 -3.213 -8.532 -4.287 47 HB3 CYS 7 2HB CYS 7 -3.902 -10.129 -4.632 48 H THR 8 H THR 8 -5.444 -7.325 -4.638 49 HA THR 8 HA THR 8 -7.653 -9.096 -4.408 50 HB THR 8 HB THR 8 -8.541 -7.441 -2.879 51 HG1 THR 8 HG1 THR 8 -6.331 -5.747 -3.425 52 HG21 THR 8 1HG2 THR 8 -6.771 -8.880 -2.063 53 HG22 THR 8 2HG2 THR 8 -6.697 -7.345 -1.302 54 HG23 THR 8 3HG2 THR 8 -5.536 -7.719 -2.559 55 H SER 9 H SER 9 -6.955 -7.293 -6.998 56 HA SER 9 HA SER 9 -9.747 -7.008 -7.753 57 HB2 SER 9 1HB SER 9 -7.897 -4.620 -7.205 58 HB3 SER 9 2HB SER 9 -9.295 -4.484 -8.285 59 HG SER 9 HG SER 9 -9.636 -5.547 -5.726 60 H ILE 10 H ILE 10 -9.737 -5.884 -10.006 61 HA ILE 10 HA ILE 10 -7.801 -7.201 -11.657 62 HB ILE 10 HB ILE 10 -9.792 -4.943 -12.226 63 HG12 ILE 10 1HG1 ILE 10 -10.772 -7.057 -11.392 64 HG13 ILE 10 2HG1 ILE 10 -11.339 -6.605 -13.013 65 HG21 ILE 10 1HG2 ILE 10 -8.196 -6.707 -14.154 66 HG22 ILE 10 2HG2 ILE 10 -9.527 -5.603 -14.616 67 HG23 ILE 10 3HG2 ILE 10 -8.071 -4.963 -13.972 68 HD11 ILE 10 3HD1 ILE 10 -10.758 -9.113 -12.650 69 HD12 ILE 10 1HD1 ILE 10 -10.032 -8.367 -14.130 70 HD13 ILE 10 2HD1 ILE 10 -9.062 -8.581 -12.669 71 H CYS 11 H CYS 11 -5.850 -6.496 -12.212 72 HA CYS 11 HA CYS 11 -4.924 -3.937 -11.232 73 HB2 CYS 11 1HB CYS 11 -3.539 -6.181 -11.264 74 HB3 CYS 11 2HB CYS 11 -3.369 -5.814 -12.996 75 H SER 12 H SER 12 -5.250 -2.132 -12.286 76 HA SER 12 HA SER 12 -6.100 -1.957 -15.068 77 HB2 SER 12 1HB SER 12 -4.959 0.505 -14.133 78 HB3 SER 12 2HB SER 12 -6.720 0.019 -14.199 79 HG SER 12 HG SER 12 -6.265 0.509 -12.076 80 H LEU 13 H LEU 13 -4.980 -1.383 -16.898 81 HA LEU 13 HA LEU 13 -2.378 -2.321 -17.008 82 HB2 LEU 13 1HB LEU 13 -3.989 -2.258 -18.867 83 HB3 LEU 13 2HB LEU 13 -3.893 -0.479 -18.874 84 HG LEU 13 HG LEU 13 -1.576 -0.654 -19.636 85 HD11 LEU 13 1HD1 LEU 13 -2.280 -3.619 -19.710 86 HD12 LEU 13 2HD1 LEU 13 -0.985 -2.910 -18.752 87 HD13 LEU 13 3HD1 LEU 13 -0.781 -2.903 -20.522 88 HD21 LEU 13 3HD2 LEU 13 -2.237 -1.235 -21.918 89 HD22 LEU 13 1HD2 LEU 13 -3.593 -0.448 -21.199 90 HD23 LEU 13 2HD2 LEU 13 -3.583 -2.231 -21.311 91 H TYR 14 H TYR 14 -3.352 0.982 -16.422 92 HA TYR 14 HA TYR 14 -0.720 2.040 -17.026 93 HB2 TYR 14 1HB TYR 14 -1.605 3.985 -15.557 94 HB3 TYR 14 2HB TYR 14 -2.278 3.703 -17.170 95 HD1 TYR 14 HD1 TYR 14 -4.531 2.698 -17.455 96 HD2 TYR 14 HD2 TYR 14 -3.019 3.724 -13.596 97 HE1 TYR 14 HE1 TYR 14 -6.787 2.659 -16.624 98 HE2 TYR 14 HE2 TYR 14 -5.352 3.601 -12.670 99 HH TYR 14 HH TYR 14 -8.126 2.802 -14.862 100 H GLN 15 H GLN 15 -2.380 0.712 -14.093 101 HA GLN 15 HA GLN 15 -0.215 1.547 -12.313 102 HB2 GLN 15 1HB GLN 15 -2.397 -0.552 -11.863 103 HB3 GLN 15 2HB GLN 15 -1.279 0.157 -10.679 104 HG2 GLN 15 1HG GLN 15 -2.334 2.435 -11.512 105 HG3 GLN 15 2HG GLN 15 -3.595 1.380 -12.158 106 HE21 GLN 15 2HE2 GLN 15 -4.614 -0.203 -10.423 107 HE22 GLN 15 1HE2 GLN 15 -4.938 0.623 -8.897 108 H LEU 16 H LEU 16 -0.935 -1.165 -14.416 109 HA LEU 16 HA LEU 16 0.913 -3.096 -13.337 110 HB2 LEU 16 1HB LEU 16 -1.079 -3.279 -14.993 111 HB3 LEU 16 2HB LEU 16 0.113 -2.843 -16.183 112 HG LEU 16 HG LEU 16 0.129 -5.311 -14.440 113 HD11 LEU 16 1HD1 LEU 16 -0.515 -6.372 -16.610 114 HD12 LEU 16 2HD1 LEU 16 -0.486 -4.763 -17.416 115 HD13 LEU 16 3HD1 LEU 16 -1.680 -5.079 -16.145 116 HD21 LEU 16 3HD2 LEU 16 1.832 -6.233 -15.871 117 HD22 LEU 16 1HD2 LEU 16 2.417 -4.709 -15.122 118 HD23 LEU 16 2HD2 LEU 16 1.925 -4.669 -16.833 119 H GLU 17 H GLU 17 1.042 -0.736 -16.043 120 HA GLU 17 HA GLU 17 3.814 -1.092 -16.784 121 HB2 GLU 17 1HB GLU 17 1.564 0.879 -17.128 122 HB3 GLU 17 2HB GLU 17 3.161 1.533 -17.306 123 HG2 GLU 17 1HG GLU 17 2.112 -0.809 -18.989 124 HG3 GLU 17 2HG GLU 17 2.167 0.885 -19.465 125 H ASN 18 H ASN 18 2.115 0.902 -14.222 126 HA ASN 18 HA ASN 18 4.427 2.358 -13.426 127 HB2 ASN 18 1HB ASN 18 2.077 2.611 -12.616 128 HB3 ASN 18 2HB ASN 18 2.383 1.308 -11.466 129 HD21 ASN 18 2HD2 ASN 18 1.923 2.934 -9.843 130 HD22 ASN 18 1HD2 ASN 18 3.101 4.155 -9.453 131 H TYR 19 H TYR 19 4.115 -1.128 -13.273 132 HA TYR 19 HA TYR 19 6.022 -1.292 -10.978 133 HB2 TYR 19 1HB TYR 19 5.025 -3.330 -13.012 134 HB3 TYR 19 2HB TYR 19 6.322 -3.739 -11.901 135 HD1 TYR 19 HD2 TYR 19 5.744 -3.402 -9.343 136 HD2 TYR 19 HD1 TYR 19 2.896 -3.690 -12.483 137 HE1 TYR 19 HE2 TYR 19 3.989 -4.032 -7.667 138 HE2 TYR 19 HE1 TYR 19 1.083 -4.294 -10.793 139 HH TYR 19 HH TYR 19 0.616 -4.500 -8.616 140 H CYS 20 H CYS 20 6.255 -0.952 -14.606 141 HA CYS 20 HA CYS 20 8.994 -2.040 -14.579 142 HB2 CYS 20 1HB CYS 20 6.978 -1.225 -16.696 143 HB3 CYS 20 2HB CYS 20 8.697 -1.454 -17.126 144 H ASN 21 H ASN 21 10.712 -0.892 -15.491 145 HA ASN 21 HA ASN 21 10.790 1.764 -14.347 146 HB2 ASN 21 1HB ASN 21 12.687 -0.052 -15.776 147 HB3 ASN 21 2HB ASN 21 13.020 1.643 -15.978 148 HD21 ASN 21 2HD2 ASN 21 13.240 -1.054 -13.946 149 HD22 ASN 21 1HD2 ASN 21 13.973 -0.215 -12.607 150 H1 PHE 1 1H PHE 1 -1.911 -7.144 -23.219 151 H2 PHE 1 2H PHE 1 -3.046 -8.245 -23.688 152 H3 PHE 1 3H PHE 1 -3.451 -6.632 -23.424 153 HA PHE 1 HA PHE 1 -2.555 -8.561 -21.408 154 HB2 PHE 1 1HB PHE 1 -1.653 -6.308 -20.924 155 HB3 PHE 1 2HB PHE 1 -3.284 -5.617 -21.194 156 HD1 PHE 1 HD2 PHE 1 -1.520 -8.357 -19.166 157 HD2 PHE 1 HD1 PHE 1 -4.558 -5.280 -19.254 158 HE1 PHE 1 HE2 PHE 1 -2.036 -8.760 -16.789 159 HE2 PHE 1 HE1 PHE 1 -5.041 -5.678 -16.924 160 HZ PHE 1 HZ PHE 1 -3.876 -7.461 -15.586 161 H VAL 2 H VAL 2 -4.219 -9.636 -20.351 162 HA VAL 2 HA VAL 2 -7.045 -8.792 -21.140 163 HB VAL 2 HB VAL 2 -5.939 -11.365 -19.987 164 HG11 VAL 2 1HG1 VAL 2 -8.721 -10.592 -20.916 165 HG12 VAL 2 2HG1 VAL 2 -8.194 -12.233 -20.442 166 HG13 VAL 2 3HG1 VAL 2 -8.230 -10.933 -19.236 167 HG21 VAL 2 3HG2 VAL 2 -7.023 -10.805 -22.816 168 HG22 VAL 2 1HG2 VAL 2 -5.271 -11.003 -22.427 169 HG23 VAL 2 2HG2 VAL 2 -6.381 -12.365 -22.197 170 H ASN 3 H ASN 3 -8.369 -8.079 -19.511 171 HA ASN 3 HA ASN 3 -7.147 -7.075 -17.150 172 HB2 ASN 3 1HB ASN 3 -9.958 -7.495 -18.110 173 HB3 ASN 3 2HB ASN 3 -9.681 -6.876 -16.493 174 HD21 ASN 3 2HD2 ASN 3 -10.704 -5.006 -16.992 175 HD22 ASN 3 1HD2 ASN 3 -9.968 -3.787 -18.017 176 H GLN 4 H GLN 4 -6.453 -8.384 -15.380 177 HA GLN 4 HA GLN 4 -8.377 -10.348 -14.319 178 HB2 GLN 4 1HB GLN 4 -6.875 -12.263 -14.573 179 HB3 GLN 4 2HB GLN 4 -7.134 -11.491 -16.144 180 HG2 GLN 4 1HG GLN 4 -4.944 -10.322 -15.919 181 HG3 GLN 4 2HG GLN 4 -4.692 -11.240 -14.441 182 HE21 GLN 4 2HE2 GLN 4 -3.192 -12.761 -14.865 183 HE22 GLN 4 1HE2 GLN 4 -3.201 -13.846 -16.245 184 H HIS 5 H HIS 5 -7.571 -11.322 -12.211 185 HA HIS 5 HA HIS 5 -6.387 -9.181 -10.649 186 HB2 HIS 5 1HB HIS 5 -7.082 -12.049 -9.998 187 HB3 HIS 5 2HB HIS 5 -6.306 -10.992 -8.841 188 HD1 HIS 5 HD1 HIS 5 -9.333 -10.377 -11.162 189 HD2 HIS 5 HD2 HIS 5 -8.254 -10.234 -7.123 190 HE1 HIS 5 HE1 HIS 5 -11.294 -9.481 -9.914 191 H LEU 6 H LEU 6 -4.272 -9.180 -9.776 192 HA LEU 6 HA LEU 6 -2.547 -11.178 -11.197 193 HB2 LEU 6 1HB LEU 6 -1.886 -8.367 -10.384 194 HB3 LEU 6 2HB LEU 6 -0.731 -9.503 -11.070 195 HG LEU 6 HG LEU 6 -3.121 -8.225 -12.383 196 HD11 LEU 6 1HD1 LEU 6 -0.141 -8.156 -13.005 197 HD12 LEU 6 2HD1 LEU 6 -1.072 -6.860 -12.183 198 HD13 LEU 6 3HD1 LEU 6 -1.419 -7.301 -13.887 199 HD21 LEU 6 3HD2 LEU 6 -2.508 -9.384 -14.415 200 HD22 LEU 6 1HD2 LEU 6 -3.050 -10.521 -13.156 201 HD23 LEU 6 2HD2 LEU 6 -1.319 -10.333 -13.516 202 H CYS 7 H CYS 7 -2.827 -12.644 -9.251 203 HA CYS 7 HA CYS 7 -0.637 -11.904 -7.415 204 HB2 CYS 7 1HB CYS 7 -3.309 -12.411 -6.650 205 HB3 CYS 7 2HB CYS 7 -2.439 -13.888 -6.196 206 H GLY 8 H GLY 8 0.639 -13.716 -6.622 207 HA2 GLY 8 1HA GLY 8 1.659 -15.748 -6.950 208 HA3 GLY 8 2HA GLY 8 0.215 -16.287 -7.844 209 H SER 9 H SER 9 1.404 -17.270 -9.524 210 HA SER 9 HA SER 9 3.426 -15.903 -11.006 211 HB2 SER 9 1HB SER 9 1.602 -18.123 -11.995 212 HB3 SER 9 2HB SER 9 3.119 -17.588 -12.669 213 HG SER 9 HG SER 9 4.221 -18.369 -10.898 214 H HIS 10 H HIS 10 0.036 -15.386 -10.995 215 HA HIS 10 HA HIS 10 -0.249 -14.621 -13.689 216 HB2 HIS 10 1HB HIS 10 -1.789 -13.507 -11.360 217 HB3 HIS 10 2HB HIS 10 -2.193 -13.303 -13.048 218 HD1 HIS 10 HD1 HIS 10 -2.350 -15.770 -10.173 219 HD2 HIS 10 HD2 HIS 10 -3.140 -15.692 -14.312 220 HE1 HIS 10 HE1 HIS 10 -3.641 -17.825 -10.748 221 H LEU 11 H LEU 11 1.140 -12.941 -10.980 222 HA LEU 11 HA LEU 11 1.160 -10.339 -12.209 223 HB2 LEU 11 1HB LEU 11 1.548 -10.690 -9.764 224 HB3 LEU 11 2HB LEU 11 3.050 -11.469 -10.081 225 HG LEU 11 HG LEU 11 3.874 -9.302 -11.124 226 HD11 LEU 11 1HD1 LEU 11 2.642 -7.207 -10.292 227 HD12 LEU 11 2HD1 LEU 11 1.186 -8.259 -10.110 228 HD13 LEU 11 3HD1 LEU 11 1.953 -7.994 -11.713 229 HD21 LEU 11 3HD2 LEU 11 4.210 -8.168 -8.877 230 HD22 LEU 11 1HD2 LEU 11 4.422 -9.955 -8.778 231 HD23 LEU 11 2HD2 LEU 11 2.931 -9.242 -8.163 232 H VAL 12 H VAL 12 3.559 -12.998 -12.005 233 HA VAL 12 HA VAL 12 5.544 -11.806 -13.658 234 HB VAL 12 HB VAL 12 4.831 -14.739 -13.102 235 HG11 VAL 12 1HG1 VAL 12 7.340 -15.126 -13.869 236 HG12 VAL 12 2HG1 VAL 12 6.206 -14.693 -15.162 237 HG13 VAL 12 3HG1 VAL 12 7.272 -13.458 -14.528 238 HG21 VAL 12 3HG2 VAL 12 6.854 -12.826 -11.904 239 HG22 VAL 12 1HG2 VAL 12 5.513 -13.658 -11.080 240 HG23 VAL 12 2HG2 VAL 12 6.953 -14.583 -11.648 241 H GLU 13 H GLU 13 2.719 -13.908 -14.531 242 HA GLU 13 HA GLU 13 3.336 -14.013 -17.266 243 HB2 GLU 13 1HB GLU 13 1.600 -15.429 -16.275 244 HB3 GLU 13 2HB GLU 13 0.638 -14.029 -15.895 245 HG2 GLU 13 1HG GLU 13 0.372 -13.502 -18.253 246 HG3 GLU 13 2HG GLU 13 1.465 -14.808 -18.737 247 H ALA 14 H ALA 14 1.439 -11.569 -15.362 248 HA ALA 14 HA ALA 14 0.647 -9.987 -17.664 249 HB1 ALA 14 3HB ALA 14 0.278 -8.195 -16.114 250 HB2 ALA 14 1HB ALA 14 -0.402 -9.725 -15.535 251 HB3 ALA 14 2HB ALA 14 1.086 -9.129 -14.841 252 H LEU 15 H LEU 15 3.486 -9.599 -15.478 253 HA LEU 15 HA LEU 15 4.556 -7.268 -16.684 254 HB2 LEU 15 1HB LEU 15 5.540 -9.477 -14.887 255 HB3 LEU 15 2HB LEU 15 6.732 -8.545 -15.697 256 HG LEU 15 HG LEU 15 6.299 -7.795 -13.410 257 HD11 LEU 15 1HD1 LEU 15 7.058 -6.209 -15.431 258 HD12 LEU 15 2HD1 LEU 15 6.585 -5.425 -13.892 259 HD13 LEU 15 3HD1 LEU 15 5.439 -5.513 -15.244 260 HD21 LEU 15 3HD2 LEU 15 4.341 -6.541 -12.822 261 HD22 LEU 15 1HD2 LEU 15 3.857 -8.165 -13.290 262 HD23 LEU 15 2HD2 LEU 15 3.677 -6.770 -14.423 263 H TYR 16 H TYR 16 5.100 -10.737 -17.290 264 HA TYR 16 HA TYR 16 7.029 -10.435 -19.353 265 HB2 TYR 16 1HB TYR 16 6.403 -12.512 -18.278 266 HB3 TYR 16 2HB TYR 16 4.830 -12.507 -19.109 267 HD1 TYR 16 HD1 TYR 16 8.616 -12.588 -19.730 268 HD2 TYR 16 HD2 TYR 16 4.674 -13.411 -21.367 269 HE1 TYR 16 HE1 TYR 16 9.606 -13.845 -21.659 270 HE2 TYR 16 HE2 TYR 16 5.701 -14.574 -23.256 271 HH TYR 16 HH TYR 16 9.195 -15.011 -23.513 272 H LEU 17 H LEU 17 3.438 -10.512 -19.599 273 HA LEU 17 HA LEU 17 3.551 -10.189 -22.430 274 HB2 LEU 17 1HB LEU 17 1.396 -9.866 -20.305 275 HB3 LEU 17 2HB LEU 17 1.030 -9.557 -21.964 276 HG LEU 17 HG LEU 17 2.221 -12.189 -20.974 277 HD11 LEU 17 1HD1 LEU 17 -0.077 -13.118 -21.103 278 HD12 LEU 17 2HD1 LEU 17 -0.747 -11.555 -21.732 279 HD13 LEU 17 3HD1 LEU 17 -0.117 -11.722 -20.091 280 HD21 LEU 17 3HD2 LEU 17 0.841 -11.524 -23.626 281 HD22 LEU 17 1HD2 LEU 17 1.481 -13.080 -23.088 282 HD23 LEU 17 2HD2 LEU 17 2.605 -11.754 -23.429 283 H VAL 18 H VAL 18 3.054 -7.753 -19.877 284 HA VAL 18 HA VAL 18 2.475 -5.681 -21.820 285 HB VAL 18 HB VAL 18 2.979 -5.440 -18.815 286 HG11 VAL 18 1HG1 VAL 18 1.845 -3.446 -20.860 287 HG12 VAL 18 2HG1 VAL 18 1.823 -3.225 -19.157 288 HG13 VAL 18 3HG1 VAL 18 3.368 -3.287 -20.035 289 HG21 VAL 18 3HG2 VAL 18 0.602 -6.290 -20.484 290 HG22 VAL 18 1HG2 VAL 18 0.839 -6.430 -18.710 291 HG23 VAL 18 2HG2 VAL 18 0.295 -4.899 -19.406 292 H CYS 19 H CYS 19 5.312 -6.260 -19.702 293 HA CYS 19 HA CYS 19 6.712 -4.098 -21.122 294 HB2 CYS 19 1HB CYS 19 7.635 -5.890 -18.815 295 HB3 CYS 19 2HB CYS 19 8.498 -4.437 -19.471 296 H GLY 20 H GLY 20 6.614 -7.588 -21.428 297 HA2 GLY 20 1HA GLY 20 7.740 -8.920 -23.028 298 HA3 GLY 20 2HA GLY 20 8.247 -7.360 -23.742 299 H GLU 21 H GLU 21 9.082 -8.329 -20.552 300 HA GLU 21 HA GLU 21 11.006 -8.721 -19.407 301 HB2 GLU 21 1HB GLU 21 11.354 -10.357 -21.316 302 HB3 GLU 21 2HB GLU 21 12.575 -9.240 -21.855 303 HG2 GLU 21 1HG GLU 21 13.644 -9.435 -19.590 304 HG3 GLU 21 2HG GLU 21 12.431 -10.680 -19.246 305 H ARG 22 H ARG 22 10.494 -6.157 -21.517 306 HA ARG 22 HA ARG 22 13.153 -4.979 -21.142 307 HB2 ARG 22 1HB ARG 22 10.531 -3.752 -22.242 308 HB3 ARG 22 2HB ARG 22 12.101 -2.978 -22.375 309 HG2 ARG 22 1HG ARG 22 12.916 -4.817 -23.729 310 HG3 ARG 22 2HG ARG 22 11.369 -5.686 -23.529 311 HD2 ARG 22 1HD ARG 22 10.132 -3.873 -24.646 312 HD3 ARG 22 2HD ARG 22 11.657 -2.972 -24.793 313 HE ARG 22 HE ARG 22 11.882 -5.648 -25.869 314 HH11 ARG 22 1HH1 ARG 22 10.463 -2.572 -26.684 315 HH12 ARG 22 2HH1 ARG 22 10.277 -2.922 -28.387 316 HH21 ARG 22 1HH2 ARG 22 11.643 -6.118 -28.079 317 HH22 ARG 22 2HH2 ARG 22 10.976 -4.918 -29.171 318 H GLY 23 H GLY 23 12.632 -5.440 -18.625 319 HA2 GLY 23 1HA GLY 23 12.721 -2.969 -17.382 320 HA3 GLY 23 2HA GLY 23 10.980 -3.306 -17.462 321 H PHE 24 H PHE 24 10.490 -5.679 -16.745 322 HA PHE 24 HA PHE 24 11.545 -5.960 -13.985 323 HB2 PHE 24 1HB PHE 24 9.768 -7.340 -13.589 324 HB3 PHE 24 2HB PHE 24 9.116 -6.309 -14.844 325 HD1 PHE 24 HD1 PHE 24 9.217 -7.133 -17.298 326 HD2 PHE 24 HD2 PHE 24 9.807 -9.708 -13.925 327 HE1 PHE 24 HE1 PHE 24 8.663 -9.106 -18.718 328 HE2 PHE 24 HE2 PHE 24 9.255 -11.697 -15.329 329 HZ PHE 24 HZ PHE 24 8.716 -11.360 -17.747 330 H PHE 25 H PHE 25 12.203 -8.055 -13.125 331 HA PHE 25 HA PHE 25 13.658 -9.755 -15.057 332 HB2 PHE 25 1HB PHE 25 14.945 -7.768 -13.546 333 HB3 PHE 25 2HB PHE 25 15.285 -9.223 -12.642 334 HD1 PHE 25 HD2 PHE 25 15.543 -7.502 -15.947 335 HD2 PHE 25 HD1 PHE 25 16.918 -10.834 -13.549 336 HE1 PHE 25 HE2 PHE 25 17.230 -8.101 -17.694 337 HE2 PHE 25 HE1 PHE 25 18.586 -11.373 -15.379 338 HZ PHE 25 HZ PHE 25 18.773 -10.036 -17.406 339 H NVA 26 H ARX 26 12.634 -11.566 -14.627 340 HA NVA 26 HA ARX 26 12.202 -12.487 -11.863 341 HB2 NVA 26 1HB ARX 26 10.182 -12.421 -13.411 342 HB3 NVA 26 2HB ARX 26 11.095 -13.285 -14.633 343 HG2 NVA 26 1HG ARX 26 10.972 -14.862 -12.118 344 HG3 NVA 26 2HG ARX 26 9.412 -14.244 -12.641 345 HD2 NVA 26 1HD ARX 26 9.309 -15.477 -14.651 346 HD3 NVA 26 2HD ARX 26 11.064 -15.473 -14.808 347 H THR 27 H THR 27 14.194 -13.215 -14.677 348 HA THR 27 HA THR 27 15.918 -14.641 -15.051 349 HB THR 27 HB THR 27 17.240 -15.632 -13.280 350 HG1 THR 27 HG1 THR 27 14.804 -15.264 -11.860 351 HG21 THR 27 1HG2 THR 27 17.512 -13.247 -13.577 352 HG22 THR 27 2HG2 THR 27 17.659 -13.698 -11.845 353 HG23 THR 27 3HG2 THR 27 16.190 -12.908 -12.418 354 HA PRO 28 HA PRO 28 14.018 -18.274 -15.913 355 HB2 PRO 28 1HB PRO 28 15.952 -20.176 -16.451 356 HB3 PRO 28 2HB PRO 28 15.793 -18.657 -17.396 357 HG2 PRO 28 1HG PRO 28 17.674 -19.283 -15.131 358 HG3 PRO 28 2HG PRO 28 17.965 -18.527 -16.752 359 HD2 PRO 28 1HD PRO 28 17.650 -17.077 -14.468 360 HD3 PRO 28 2HD PRO 28 17.213 -16.485 -16.127 361 H HIX 29 H HIX 29 12.776 -18.808 -14.186 362 HA HIX 29 HA HIX 29 13.678 -20.616 -12.075 363 HB1 HIX 29 1HB HIX 29 10.974 -20.626 -11.651 364 HB2 HIX 29 2HB HIX 29 12.067 -19.441 -11.038 365 HD2 HIX 29 HD2 HIX 29 11.965 -17.024 -12.316 366 HD1 HIX 29 HD1 HIX 29 9.301 -19.884 -13.545 367 HE1 HIX 29 HE1 HIX 29 9.641 -17.907 -15.080 368 H THR 30 H THR 30 14.249 -22.475 -12.476 369 HA THR 30 HA THR 30 12.429 -24.313 -13.957 370 HB THR 30 HB THR 30 14.505 -25.449 -14.864 371 HG1 THR 30 HG1 THR 30 15.788 -23.060 -13.968 372 HG21 THR 30 1HG2 THR 30 14.023 -22.546 -15.673 373 HG22 THR 30 2HG2 THR 30 13.382 -23.961 -16.465 374 HG23 THR 30 3HG2 THR 30 15.119 -23.558 -16.517 Start of MODEL 26 1 H1 GLY 1 1H GLY 1 1.151 0.135 0.258 2 H2 GLY 1 2H GLY 1 2.488 0.896 0.846 3 H3 GLY 1 3H GLY 1 1.465 1.689 -0.210 4 HA2 GLY 1 1HA GLY 1 3.394 1.060 -1.458 5 HA3 GLY 1 2HA GLY 1 3.242 -0.590 -0.805 6 H ILE 2 H ILE 2 3.383 -0.673 -3.454 7 HA ILE 2 HA ILE 2 0.814 -0.225 -4.670 8 HB ILE 2 HB ILE 2 2.656 0.646 -5.878 9 HG12 ILE 2 1HG1 ILE 2 1.918 -1.891 -7.293 10 HG13 ILE 2 2HG1 ILE 2 0.878 -0.489 -7.207 11 HG21 ILE 2 1HG2 ILE 2 4.491 -0.695 -4.819 12 HG22 ILE 2 2HG2 ILE 2 4.008 -2.106 -5.724 13 HG23 ILE 2 3HG2 ILE 2 4.596 -0.713 -6.591 14 HD11 ILE 2 3HD1 ILE 2 2.653 0.861 -8.335 15 HD12 ILE 2 1HD1 ILE 2 3.607 -0.637 -8.507 16 HD13 ILE 2 2HD1 ILE 2 2.044 -0.463 -9.332 17 H VAL 3 H VAL 3 2.889 -3.084 -4.035 18 HA VAL 3 HA VAL 3 1.677 -4.789 -5.884 19 HB VAL 3 HB VAL 3 2.862 -5.671 -3.210 20 HG11 VAL 3 1HG1 VAL 3 3.519 -7.714 -4.497 21 HG12 VAL 3 2HG1 VAL 3 1.823 -7.573 -4.313 22 HG13 VAL 3 3HG1 VAL 3 2.557 -7.130 -5.847 23 HG21 VAL 3 3HG2 VAL 3 4.264 -5.026 -5.866 24 HG22 VAL 3 1HG2 VAL 3 4.491 -4.183 -4.261 25 HG23 VAL 3 2HG2 VAL 3 5.032 -5.897 -4.506 26 H GLU 4 H GLU 4 0.853 -4.763 -2.365 27 HA GLU 4 HA GLU 4 -1.252 -6.673 -2.596 28 HB2 GLU 4 1HB GLU 4 -0.136 -5.923 -0.500 29 HB3 GLU 4 2HB GLU 4 -0.926 -4.395 -0.632 30 HG2 GLU 4 1HG GLU 4 -3.127 -5.447 -0.282 31 HG3 GLU 4 2HG GLU 4 -2.331 -7.072 -0.325 32 H GLN 5 H GLN 5 -1.190 -3.117 -2.772 33 HA GLN 5 HA GLN 5 -3.958 -2.619 -2.825 34 HB2 GLN 5 1HB GLN 5 -1.906 -1.029 -2.666 35 HB3 GLN 5 2HB GLN 5 -1.871 -1.151 -4.416 36 HG2 GLN 5 1HG GLN 5 -2.991 0.830 -3.984 37 HG3 GLN 5 2HG GLN 5 -4.256 -0.345 -4.478 38 HE21 GLN 5 2HE2 GLN 5 -3.018 1.706 -2.017 39 HE22 GLN 5 1HE2 GLN 5 -4.290 1.427 -0.855 40 H CYS 6 H CYS 6 -1.753 -3.523 -5.481 41 HA CYS 6 HA CYS 6 -3.669 -3.136 -7.530 42 HB2 CYS 6 1HB CYS 6 -1.036 -3.177 -7.612 43 HB3 CYS 6 2HB CYS 6 -1.258 -4.918 -7.709 44 H CYS 7 H CYS 7 -2.216 -5.936 -5.901 45 HA CYS 7 HA CYS 7 -3.648 -7.888 -7.351 46 HB2 CYS 7 1HB CYS 7 -2.122 -7.932 -4.731 47 HB3 CYS 7 2HB CYS 7 -2.872 -9.362 -5.436 48 H THR 8 H THR 8 -4.585 -6.376 -4.278 49 HA THR 8 HA THR 8 -6.436 -8.508 -3.594 50 HB THR 8 HB THR 8 -6.624 -5.657 -2.517 51 HG1 THR 8 HG1 THR 8 -4.485 -6.195 -2.256 52 HG21 THR 8 1HG2 THR 8 -7.268 -6.839 -0.385 53 HG22 THR 8 2HG2 THR 8 -7.143 -8.410 -1.213 54 HG23 THR 8 3HG2 THR 8 -8.363 -7.254 -1.687 55 H SER 9 H SER 9 -6.507 -6.995 -6.276 56 HA SER 9 HA SER 9 -9.352 -6.996 -6.780 57 HB2 SER 9 1HB SER 9 -8.917 -4.755 -5.520 58 HB3 SER 9 2HB SER 9 -8.081 -4.251 -6.996 59 HG SER 9 HG SER 9 -10.611 -4.016 -6.598 60 H ILE 10 H ILE 10 -9.371 -5.380 -9.078 61 HA ILE 10 HA ILE 10 -7.619 -7.093 -10.770 62 HB ILE 10 HB ILE 10 -9.794 -5.116 -11.536 63 HG12 ILE 10 1HG1 ILE 10 -10.692 -6.973 -10.218 64 HG13 ILE 10 2HG1 ILE 10 -11.288 -6.982 -11.877 65 HG21 ILE 10 1HG2 ILE 10 -9.707 -6.429 -13.762 66 HG22 ILE 10 2HG2 ILE 10 -8.268 -5.459 -13.361 67 HG23 ILE 10 3HG2 ILE 10 -8.233 -7.218 -13.133 68 HD11 ILE 10 3HD1 ILE 10 -9.769 -8.810 -12.483 69 HD12 ILE 10 1HD1 ILE 10 -9.080 -8.804 -10.849 70 HD13 ILE 10 2HD1 ILE 10 -10.788 -9.259 -11.102 71 H CYS 11 H CYS 11 -5.665 -6.367 -11.297 72 HA CYS 11 HA CYS 11 -4.883 -3.577 -11.187 73 HB2 CYS 11 1HB CYS 11 -3.661 -6.024 -12.487 74 HB3 CYS 11 2HB CYS 11 -2.891 -4.438 -12.454 75 H SER 12 H SER 12 -4.968 -2.008 -12.669 76 HA SER 12 HA SER 12 -6.133 -2.615 -15.299 77 HB2 SER 12 1HB SER 12 -5.295 0.066 -14.093 78 HB3 SER 12 2HB SER 12 -6.292 -0.195 -15.550 79 HG SER 12 HG SER 12 -7.580 0.273 -13.673 80 H LEU 13 H LEU 13 -5.038 -1.569 -17.230 81 HA LEU 13 HA LEU 13 -2.490 -2.567 -17.463 82 HB2 LEU 13 1HB LEU 13 -4.045 -2.087 -19.330 83 HB3 LEU 13 2HB LEU 13 -3.729 -0.345 -19.114 84 HG LEU 13 HG LEU 13 -1.440 -0.589 -19.774 85 HD11 LEU 13 1HD1 LEU 13 -0.620 -2.849 -20.701 86 HD12 LEU 13 2HD1 LEU 13 -2.041 -3.572 -19.902 87 HD13 LEU 13 3HD1 LEU 13 -0.759 -2.717 -18.963 88 HD21 LEU 13 3HD2 LEU 13 -3.094 -0.255 -21.523 89 HD22 LEU 13 1HD2 LEU 13 -3.327 -2.006 -21.714 90 HD23 LEU 13 2HD2 LEU 13 -1.758 -1.248 -22.139 91 H TYR 14 H TYR 14 -3.416 0.856 -16.878 92 HA TYR 14 HA TYR 14 -0.709 1.855 -16.988 93 HB2 TYR 14 1HB TYR 14 -1.906 3.782 -15.552 94 HB3 TYR 14 2HB TYR 14 -2.142 3.633 -17.291 95 HD1 TYR 14 HD1 TYR 14 -4.180 2.826 -18.207 96 HD2 TYR 14 HD2 TYR 14 -3.693 3.186 -13.995 97 HE1 TYR 14 HE1 TYR 14 -6.684 2.675 -17.940 98 HE2 TYR 14 HE2 TYR 14 -6.278 3.063 -13.706 99 HH TYR 14 HH TYR 14 -8.306 3.019 -14.793 100 H GLN 15 H GLN 15 -2.742 0.658 -14.335 101 HA GLN 15 HA GLN 15 -0.876 1.482 -12.275 102 HB2 GLN 15 1HB GLN 15 -2.903 -0.783 -12.295 103 HB3 GLN 15 2HB GLN 15 -2.009 -0.271 -10.892 104 HG2 GLN 15 1HG GLN 15 -3.418 1.924 -12.328 105 HG3 GLN 15 2HG GLN 15 -4.499 0.629 -11.811 106 HE21 GLN 15 2HE2 GLN 15 -4.624 0.147 -9.525 107 HE22 GLN 15 1HE2 GLN 15 -4.286 1.426 -8.390 108 H LEU 16 H LEU 16 -1.161 -1.331 -14.452 109 HA LEU 16 HA LEU 16 0.918 -2.877 -13.199 110 HB2 LEU 16 1HB LEU 16 -0.881 -3.680 -14.732 111 HB3 LEU 16 2HB LEU 16 -0.033 -2.927 -16.067 112 HG LEU 16 HG LEU 16 1.091 -5.186 -14.405 113 HD11 LEU 16 1HD1 LEU 16 -0.291 -5.138 -17.110 114 HD12 LEU 16 2HD1 LEU 16 -0.886 -5.859 -15.593 115 HD13 LEU 16 3HD1 LEU 16 0.534 -6.565 -16.365 116 HD21 LEU 16 3HD2 LEU 16 2.070 -3.784 -16.894 117 HD22 LEU 16 1HD2 LEU 16 2.571 -5.463 -16.438 118 HD23 LEU 16 2HD2 LEU 16 2.948 -4.112 -15.400 119 H GLU 17 H GLU 17 0.761 -0.540 -15.936 120 HA GLU 17 HA GLU 17 3.454 -0.727 -16.761 121 HB2 GLU 17 1HB GLU 17 1.479 1.518 -16.908 122 HB3 GLU 17 2HB GLU 17 3.126 1.717 -17.469 123 HG2 GLU 17 1HG GLU 17 1.448 -0.592 -18.544 124 HG3 GLU 17 2HG GLU 17 1.243 1.052 -19.157 125 H ASN 18 H ASN 18 1.998 0.978 -14.033 126 HA ASN 18 HA ASN 18 4.176 2.677 -13.447 127 HB2 ASN 18 1HB ASN 18 1.745 2.498 -12.517 128 HB3 ASN 18 2HB ASN 18 2.378 1.397 -11.308 129 HD21 ASN 18 2HD2 ASN 18 2.117 4.693 -12.400 130 HD22 ASN 18 1HD2 ASN 18 2.909 5.407 -11.032 131 H TYR 19 H TYR 19 4.090 -0.730 -13.230 132 HA TYR 19 HA TYR 19 6.076 -0.956 -11.030 133 HB2 TYR 19 1HB TYR 19 4.981 -2.999 -13.047 134 HB3 TYR 19 2HB TYR 19 6.242 -3.373 -11.863 135 HD1 TYR 19 HD2 TYR 19 5.637 -2.835 -9.341 136 HD2 TYR 19 HD1 TYR 19 2.807 -3.593 -12.505 137 HE1 TYR 19 HE2 TYR 19 3.949 -3.582 -7.654 138 HE2 TYR 19 HE1 TYR 19 1.175 -4.338 -10.824 139 HH TYR 19 HH TYR 19 0.655 -4.640 -8.593 140 H CYS 20 H CYS 20 5.992 -0.418 -14.464 141 HA CYS 20 HA CYS 20 8.579 -1.788 -14.813 142 HB2 CYS 20 1HB CYS 20 6.295 -1.905 -16.325 143 HB3 CYS 20 2HB CYS 20 7.136 -0.571 -17.093 144 H ASN 21 H ASN 21 10.249 -0.716 -16.172 145 HA ASN 21 HA ASN 21 10.531 2.071 -15.218 146 HB2 ASN 21 1HB ASN 21 12.876 1.878 -15.693 147 HB3 ASN 21 2HB ASN 21 12.408 0.494 -14.756 148 HD21 ASN 21 2HD2 ASN 21 12.131 -1.545 -15.905 149 HD22 ASN 21 1HD2 ASN 21 13.049 -1.788 -17.357 150 H1 PHE 1 1H PHE 1 -2.237 -9.565 -23.089 151 H2 PHE 1 2H PHE 1 -2.940 -8.095 -23.257 152 H3 PHE 1 3H PHE 1 -1.311 -8.220 -23.131 153 HA PHE 1 HA PHE 1 -1.425 -8.986 -20.933 154 HB2 PHE 1 1HB PHE 1 -1.421 -6.555 -21.075 155 HB3 PHE 1 2HB PHE 1 -3.123 -6.497 -21.412 156 HD1 PHE 1 HD1 PHE 1 -1.415 -8.630 -18.783 157 HD2 PHE 1 HD2 PHE 1 -3.887 -5.197 -19.626 158 HE1 PHE 1 HE1 PHE 1 -2.003 -8.516 -16.408 159 HE2 PHE 1 HE2 PHE 1 -4.378 -5.022 -17.218 160 HZ PHE 1 HZ PHE 1 -3.448 -6.738 -15.601 161 H VAL 2 H VAL 2 -4.756 -7.709 -21.359 162 HA VAL 2 HA VAL 2 -6.774 -8.406 -20.658 163 HB VAL 2 HB VAL 2 -5.716 -11.222 -20.409 164 HG11 VAL 2 1HG1 VAL 2 -8.153 -11.839 -20.628 165 HG12 VAL 2 2HG1 VAL 2 -7.814 -10.892 -19.169 166 HG13 VAL 2 3HG1 VAL 2 -8.555 -10.128 -20.587 167 HG21 VAL 2 3HG2 VAL 2 -5.403 -10.505 -22.711 168 HG22 VAL 2 1HG2 VAL 2 -6.804 -11.580 -22.638 169 HG23 VAL 2 2HG2 VAL 2 -7.066 -9.800 -22.741 170 H ASN 3 H ASN 3 -7.683 -7.989 -18.781 171 HA ASN 3 HA ASN 3 -5.855 -7.525 -16.545 172 HB2 ASN 3 1HB ASN 3 -7.725 -6.429 -15.488 173 HB3 ASN 3 2HB ASN 3 -7.625 -5.920 -17.151 174 HD21 ASN 3 2HD2 ASN 3 -9.386 -6.327 -18.458 175 HD22 ASN 3 1HD2 ASN 3 -10.849 -7.146 -17.925 176 H GLN 4 H GLN 4 -6.045 -8.239 -14.423 177 HA GLN 4 HA GLN 4 -7.690 -10.516 -13.692 178 HB2 GLN 4 1HB GLN 4 -5.105 -10.908 -14.984 179 HB3 GLN 4 2HB GLN 4 -4.978 -11.412 -13.285 180 HG2 GLN 4 1HG GLN 4 -7.284 -12.449 -14.951 181 HG3 GLN 4 2HG GLN 4 -5.703 -13.156 -15.135 182 HE21 GLN 4 2HE2 GLN 4 -6.080 -15.114 -14.273 183 HE22 GLN 4 1HE2 GLN 4 -6.607 -15.385 -12.607 184 H HIS 5 H HIS 5 -6.840 -11.381 -11.476 185 HA HIS 5 HA HIS 5 -6.358 -9.094 -9.634 186 HB2 HIS 5 1HB HIS 5 -7.002 -12.022 -9.481 187 HB3 HIS 5 2HB HIS 5 -6.017 -11.351 -8.148 188 HD1 HIS 5 HD1 HIS 5 -9.404 -10.869 -9.815 189 HD2 HIS 5 HD2 HIS 5 -7.440 -9.887 -6.347 190 HE1 HIS 5 HE1 HIS 5 -11.141 -9.774 -8.278 191 H LEU 6 H LEU 6 -4.498 -11.177 -11.517 192 HA LEU 6 HA LEU 6 -2.338 -11.617 -11.817 193 HB2 LEU 6 1HB LEU 6 -1.742 -9.211 -10.070 194 HB3 LEU 6 2HB LEU 6 -0.717 -10.001 -11.231 195 HG LEU 6 HG LEU 6 -3.080 -8.248 -11.788 196 HD11 LEU 6 1HD1 LEU 6 -0.121 -8.199 -12.587 197 HD12 LEU 6 2HD1 LEU 6 -0.904 -7.166 -11.389 198 HD13 LEU 6 3HD1 LEU 6 -1.352 -6.975 -13.032 199 HD21 LEU 6 3HD2 LEU 6 -1.578 -10.029 -13.731 200 HD22 LEU 6 1HD2 LEU 6 -2.643 -8.723 -14.221 201 HD23 LEU 6 2HD2 LEU 6 -3.284 -10.077 -13.353 202 H CYS 7 H CYS 7 -2.427 -10.799 -8.246 203 HA CYS 7 HA CYS 7 0.018 -12.265 -7.772 204 HB2 CYS 7 1HB CYS 7 -2.329 -11.360 -6.078 205 HB3 CYS 7 2HB CYS 7 -1.148 -12.471 -5.351 206 H GLY 8 H GLY 8 0.415 -14.484 -7.375 207 HA2 GLY 8 1HA GLY 8 -0.384 -16.783 -7.018 208 HA3 GLY 8 2HA GLY 8 -1.906 -16.260 -7.795 209 H SER 9 H SER 9 1.531 -15.888 -8.633 210 HA SER 9 HA SER 9 2.758 -16.161 -10.501 211 HB2 SER 9 1HB SER 9 2.636 -18.156 -11.685 212 HB3 SER 9 2HB SER 9 2.231 -18.516 -10.046 213 HG SER 9 HG SER 9 -0.049 -18.282 -11.039 214 H HIS 10 H HIS 10 -0.660 -15.687 -11.439 215 HA HIS 10 HA HIS 10 -0.044 -15.014 -14.124 216 HB2 HIS 10 1HB HIS 10 -2.201 -13.909 -12.298 217 HB3 HIS 10 2HB HIS 10 -2.116 -13.665 -14.034 218 HD1 HIS 10 HD1 HIS 10 -3.188 -16.245 -11.489 219 HD2 HIS 10 HD2 HIS 10 -2.701 -15.935 -15.632 220 HE1 HIS 10 HE1 HIS 10 -4.497 -18.159 -12.597 221 H LEU 11 H LEU 11 0.895 -13.276 -11.326 222 HA LEU 11 HA LEU 11 0.923 -10.654 -12.477 223 HB2 LEU 11 1HB LEU 11 1.204 -11.280 -10.006 224 HB3 LEU 11 2HB LEU 11 2.840 -11.736 -10.371 225 HG LEU 11 HG LEU 11 2.116 -9.017 -11.279 226 HD11 LEU 11 1HD1 LEU 11 2.082 -9.644 -8.319 227 HD12 LEU 11 2HD1 LEU 11 0.667 -9.227 -9.290 228 HD13 LEU 11 3HD1 LEU 11 1.969 -8.045 -8.999 229 HD21 LEU 11 3HD2 LEU 11 4.322 -10.004 -9.426 230 HD22 LEU 11 1HD2 LEU 11 4.193 -8.311 -10.051 231 HD23 LEU 11 2HD2 LEU 11 4.472 -9.692 -11.188 232 H VAL 12 H VAL 12 3.109 -13.396 -12.516 233 HA VAL 12 HA VAL 12 5.342 -11.934 -13.625 234 HB VAL 12 HB VAL 12 4.765 -14.928 -13.635 235 HG11 VAL 12 1HG1 VAL 12 6.579 -14.374 -15.235 236 HG12 VAL 12 2HG1 VAL 12 7.434 -13.438 -13.958 237 HG13 VAL 12 3HG1 VAL 12 7.280 -15.228 -13.845 238 HG21 VAL 12 3HG2 VAL 12 6.256 -13.294 -11.559 239 HG22 VAL 12 1HG2 VAL 12 4.725 -14.211 -11.316 240 HG23 VAL 12 2HG2 VAL 12 6.227 -15.069 -11.609 241 H GLU 13 H GLU 13 2.714 -13.976 -14.892 242 HA GLU 13 HA GLU 13 3.595 -13.938 -17.655 243 HB2 GLU 13 1HB GLU 13 0.835 -14.237 -16.387 244 HB3 GLU 13 2HB GLU 13 1.253 -14.484 -18.080 245 HG2 GLU 13 1HG GLU 13 2.755 -16.319 -17.486 246 HG3 GLU 13 2HG GLU 13 2.283 -16.039 -15.765 247 H ALA 14 H ALA 14 1.421 -11.828 -15.778 248 HA ALA 14 HA ALA 14 0.552 -10.101 -17.862 249 HB1 ALA 14 3HB ALA 14 -0.520 -10.232 -15.741 250 HB2 ALA 14 1HB ALA 14 0.965 -9.669 -14.935 251 HB3 ALA 14 2HB ALA 14 0.036 -8.564 -16.013 252 H LEU 15 H LEU 15 3.234 -9.754 -15.506 253 HA LEU 15 HA LEU 15 4.142 -7.227 -16.575 254 HB2 LEU 15 1HB LEU 15 5.258 -9.302 -14.700 255 HB3 LEU 15 2HB LEU 15 6.436 -8.258 -15.486 256 HG LEU 15 HG LEU 15 5.800 -7.510 -13.235 257 HD11 LEU 15 1HD1 LEU 15 6.640 -5.971 -14.976 258 HD12 LEU 15 2HD1 LEU 15 5.585 -5.110 -13.875 259 HD13 LEU 15 3HD1 LEU 15 5.004 -5.561 -15.466 260 HD21 LEU 15 3HD2 LEU 15 3.024 -6.939 -14.341 261 HD22 LEU 15 1HD2 LEU 15 3.655 -6.377 -12.760 262 HD23 LEU 15 2HD2 LEU 15 3.471 -8.139 -13.095 263 H TYR 16 H TYR 16 4.962 -10.617 -17.351 264 HA TYR 16 HA TYR 16 7.108 -10.011 -19.132 265 HB2 TYR 16 1HB TYR 16 6.632 -12.200 -18.006 266 HB3 TYR 16 2HB TYR 16 5.215 -12.417 -19.020 267 HD1 TYR 16 HD2 TYR 16 8.981 -11.714 -19.434 268 HD2 TYR 16 HD1 TYR 16 5.465 -13.800 -20.920 269 HE1 TYR 16 HE2 TYR 16 10.419 -12.903 -21.142 270 HE2 TYR 16 HE1 TYR 16 6.942 -14.967 -22.565 271 HH TYR 16 HH TYR 16 9.080 -15.236 -23.461 272 H LEU 17 H LEU 17 3.600 -10.389 -19.574 273 HA LEU 17 HA LEU 17 3.726 -10.068 -22.449 274 HB2 LEU 17 1HB LEU 17 1.494 -9.661 -20.484 275 HB3 LEU 17 2HB LEU 17 1.253 -9.364 -22.170 276 HG LEU 17 HG LEU 17 2.326 -11.981 -21.188 277 HD11 LEU 17 1HD1 LEU 17 -0.575 -11.205 -21.423 278 HD12 LEU 17 2HD1 LEU 17 0.289 -11.599 -19.959 279 HD13 LEU 17 3HD1 LEU 17 0.012 -12.839 -21.114 280 HD21 LEU 17 3HD2 LEU 17 0.739 -11.242 -23.637 281 HD22 LEU 17 1HD2 LEU 17 1.338 -12.815 -23.260 282 HD23 LEU 17 2HD2 LEU 17 2.466 -11.509 -23.562 283 H VAL 18 H VAL 18 3.625 -7.676 -19.824 284 HA VAL 18 HA VAL 18 3.000 -5.599 -21.834 285 HB VAL 18 HB VAL 18 3.137 -5.448 -18.804 286 HG11 VAL 18 1HG1 VAL 18 1.999 -3.184 -19.110 287 HG12 VAL 18 2HG1 VAL 18 3.657 -3.203 -19.628 288 HG13 VAL 18 3HG1 VAL 18 2.348 -3.336 -20.830 289 HG21 VAL 18 3HG2 VAL 18 0.868 -5.528 -20.812 290 HG22 VAL 18 1HG2 VAL 18 1.229 -6.786 -19.596 291 HG23 VAL 18 2HG2 VAL 18 0.631 -5.246 -19.053 292 H CYS 19 H CYS 19 5.675 -6.297 -19.509 293 HA CYS 19 HA CYS 19 7.117 -3.943 -20.506 294 HB2 CYS 19 1HB CYS 19 7.999 -6.286 -18.769 295 HB3 CYS 19 2HB CYS 19 8.995 -4.843 -19.064 296 H GLY 20 H GLY 20 6.885 -7.380 -21.206 297 HA2 GLY 20 1HA GLY 20 7.495 -8.217 -23.301 298 HA3 GLY 20 2HA GLY 20 8.821 -6.985 -23.411 299 H GLU 21 H GLU 21 10.712 -7.997 -23.411 300 HA GLU 21 HA GLU 21 11.098 -10.722 -22.657 301 HB2 GLU 21 1HB GLU 21 13.257 -8.565 -22.621 302 HB3 GLU 21 2HB GLU 21 13.458 -10.302 -22.834 303 HG2 GLU 21 1HG GLU 21 13.527 -9.747 -25.038 304 HG3 GLU 21 2HG GLU 21 11.771 -9.722 -24.927 305 H ARG 22 H ARG 22 11.613 -7.777 -20.746 306 HA ARG 22 HA ARG 22 11.785 -9.244 -18.203 307 HB2 ARG 22 1HB ARG 22 14.014 -8.443 -17.660 308 HB3 ARG 22 2HB ARG 22 14.061 -9.641 -18.948 309 HG2 ARG 22 1HG ARG 22 14.279 -7.894 -20.672 310 HG3 ARG 22 2HG ARG 22 14.195 -6.630 -19.436 311 HD2 ARG 22 1HD ARG 22 16.321 -8.762 -19.429 312 HD3 ARG 22 2HD ARG 22 16.559 -7.215 -20.195 313 HE ARG 22 HE ARG 22 16.383 -7.889 -17.299 314 HH11 ARG 22 1HH1 ARG 22 16.528 -5.274 -19.659 315 HH12 ARG 22 2HH1 ARG 22 17.011 -4.083 -18.501 316 HH21 ARG 22 1HH2 ARG 22 16.958 -6.307 -15.803 317 HH22 ARG 22 2HH2 ARG 22 17.232 -4.675 -16.344 318 H GLY 23 H GLY 23 12.025 -7.646 -16.415 319 HA2 GLY 23 1HA GLY 23 12.530 -5.056 -16.452 320 HA3 GLY 23 2HA GLY 23 10.939 -5.047 -17.212 321 H PHE 24 H PHE 24 11.478 -7.425 -14.670 322 HA PHE 24 HA PHE 24 10.169 -5.555 -12.782 323 HB2 PHE 24 1HB PHE 24 8.681 -7.503 -12.123 324 HB3 PHE 24 2HB PHE 24 8.370 -6.744 -13.671 325 HD1 PHE 24 HD1 PHE 24 8.873 -7.876 -15.765 326 HD2 PHE 24 HD2 PHE 24 9.560 -9.808 -11.993 327 HE1 PHE 24 HE1 PHE 24 9.035 -10.061 -16.955 328 HE2 PHE 24 HE2 PHE 24 9.746 -12.061 -13.135 329 HZ PHE 24 HZ PHE 24 9.489 -12.167 -15.599 330 H PHE 25 H PHE 25 12.087 -8.486 -13.039 331 HA PHE 25 HA PHE 25 13.389 -9.698 -11.624 332 HB2 PHE 25 1HB PHE 25 14.563 -7.468 -11.570 333 HB3 PHE 25 2HB PHE 25 13.765 -7.155 -10.016 334 HD1 PHE 25 HD2 PHE 25 14.232 -8.834 -8.077 335 HD2 PHE 25 HD1 PHE 25 16.519 -8.843 -11.736 336 HE1 PHE 25 HE2 PHE 25 16.028 -10.119 -6.955 337 HE2 PHE 25 HE1 PHE 25 18.317 -10.189 -10.593 338 HZ PHE 25 HZ PHE 25 18.015 -10.784 -8.163 339 H NVA 26 H ARX 26 11.862 -11.063 -10.838 340 HA NVA 26 HA ARX 26 10.333 -10.595 -8.493 341 HB2 NVA 26 1HB ARX 26 9.410 -12.032 -10.335 342 HB3 NVA 26 2HB ARX 26 10.830 -13.160 -10.236 343 HG2 NVA 26 1HG ARX 26 10.018 -13.869 -7.920 344 HG3 NVA 26 2HG ARX 26 8.774 -12.657 -7.951 345 HD2 NVA 26 1HD ARX 26 7.423 -14.387 -8.551 346 HD3 NVA 26 2HD ARX 26 8.011 -13.987 -10.208 347 H THR 27 H THR 27 12.441 -13.288 -8.962 348 HA THR 27 HA THR 27 14.562 -12.952 -7.186 349 HB THR 27 HB THR 27 13.381 -14.978 -5.600 350 HG1 THR 27 HG1 THR 27 11.538 -12.837 -5.819 351 HG21 THR 27 1HG2 THR 27 13.319 -13.293 -3.784 352 HG22 THR 27 2HG2 THR 27 13.637 -12.007 -5.040 353 HG23 THR 27 3HG2 THR 27 14.879 -13.277 -4.715 354 HA PRO 28 HA PRO 28 15.073 -16.543 -9.655 355 HB2 PRO 28 1HB PRO 28 16.531 -18.435 -8.314 356 HB3 PRO 28 2HB PRO 28 17.269 -16.930 -8.868 357 HG2 PRO 28 1HG PRO 28 16.363 -17.675 -6.161 358 HG3 PRO 28 2HG PRO 28 17.817 -16.783 -6.645 359 HD2 PRO 28 1HD PRO 28 15.576 -15.497 -5.726 360 HD3 PRO 28 2HD PRO 28 16.728 -14.775 -6.865 361 H HIX 29 H HIX 29 13.274 -17.533 -10.160 362 HA HIX 29 HA HIX 29 11.622 -18.871 -8.172 363 HB1 HIX 29 1HB HIX 29 11.416 -18.276 -11.166 364 HB2 HIX 29 2HB HIX 29 10.347 -19.452 -10.411 365 HD2 HIX 29 HD2 HIX 29 10.232 -15.758 -10.971 366 HD1 HIX 29 HD1 HIX 29 9.267 -18.507 -7.989 367 HE1 HIX 29 HE1 HIX 29 7.408 -16.908 -8.684 368 H THR 30 H THR 30 12.741 -20.483 -7.312 369 HA THR 30 HA THR 30 13.057 -23.044 -8.836 370 HB THR 30 HB THR 30 15.125 -23.356 -7.370 371 HG1 THR 30 HG1 THR 30 14.873 -21.734 -5.858 372 HG21 THR 30 1HG2 THR 30 15.430 -20.977 -9.195 373 HG22 THR 30 2HG2 THR 30 15.178 -22.641 -9.809 374 HG23 THR 30 3HG2 THR 30 16.654 -22.271 -8.845 Start of MODEL 27 1 H1 GLY 1 1H GLY 1 0.343 0.891 0.003 2 H2 GLY 1 2H GLY 1 0.790 1.634 -1.453 3 H3 GLY 1 3H GLY 1 -0.745 0.959 -1.269 4 HA2 GLY 1 1HA GLY 1 1.806 -0.466 -1.405 5 HA3 GLY 1 2HA GLY 1 0.252 -1.258 -0.975 6 H ILE 2 H ILE 2 1.677 -2.110 -3.356 7 HA ILE 2 HA ILE 2 -0.361 -1.111 -5.335 8 HB ILE 2 HB ILE 2 1.816 0.112 -5.657 9 HG12 ILE 2 1HG1 ILE 2 1.088 -1.776 -7.986 10 HG13 ILE 2 2HG1 ILE 2 0.228 -0.302 -7.580 11 HG21 ILE 2 1HG2 ILE 2 3.788 -1.090 -6.554 12 HG22 ILE 2 2HG2 ILE 2 3.362 -1.825 -5.005 13 HG23 ILE 2 3HG2 ILE 2 2.917 -2.646 -6.536 14 HD11 ILE 2 3HD1 ILE 2 1.589 0.230 -9.409 15 HD12 ILE 2 1HD1 ILE 2 2.313 1.028 -8.033 16 HD13 ILE 2 2HD1 ILE 2 3.018 -0.457 -8.692 17 H VAL 3 H VAL 3 2.010 -3.751 -4.538 18 HA VAL 3 HA VAL 3 1.021 -5.439 -6.568 19 HB VAL 3 HB VAL 3 2.334 -6.165 -3.930 20 HG11 VAL 3 1HG1 VAL 3 1.741 -7.765 -6.462 21 HG12 VAL 3 2HG1 VAL 3 2.994 -8.231 -5.265 22 HG13 VAL 3 3HG1 VAL 3 1.278 -8.179 -4.780 23 HG21 VAL 3 3HG2 VAL 3 3.902 -4.801 -5.213 24 HG22 VAL 3 1HG2 VAL 3 4.338 -6.524 -5.431 25 HG23 VAL 3 2HG2 VAL 3 3.465 -5.686 -6.733 26 H GLU 4 H GLU 4 0.174 -5.204 -3.063 27 HA GLU 4 HA GLU 4 -1.746 -7.349 -3.181 28 HB2 GLU 4 1HB GLU 4 -1.594 -4.937 -1.381 29 HB3 GLU 4 2HB GLU 4 -2.702 -6.296 -1.185 30 HG2 GLU 4 1HG GLU 4 -0.722 -7.830 -1.038 31 HG3 GLU 4 2HG GLU 4 0.284 -6.361 -0.927 32 H GLN 5 H GLN 5 -1.904 -3.952 -4.139 33 HA GLN 5 HA GLN 5 -4.803 -3.745 -4.259 34 HB2 GLN 5 1HB GLN 5 -2.594 -2.106 -5.600 35 HB3 GLN 5 2HB GLN 5 -4.320 -1.773 -5.789 36 HG2 GLN 5 1HG GLN 5 -4.444 -1.663 -3.259 37 HG3 GLN 5 2HG GLN 5 -2.644 -1.616 -3.308 38 HE21 GLN 5 2HE2 GLN 5 -4.024 0.502 -2.138 39 HE22 GLN 5 1HE2 GLN 5 -3.826 1.884 -3.220 40 H CYS 6 H CYS 6 -2.201 -4.497 -6.665 41 HA CYS 6 HA CYS 6 -4.003 -4.833 -8.851 42 HB2 CYS 6 1HB CYS 6 -1.295 -4.781 -8.539 43 HB3 CYS 6 2HB CYS 6 -1.538 -6.543 -8.582 44 H CYS 7 H CYS 7 -2.708 -7.118 -6.425 45 HA CYS 7 HA CYS 7 -3.694 -9.526 -7.662 46 HB2 CYS 7 1HB CYS 7 -2.785 -8.710 -4.877 47 HB3 CYS 7 2HB CYS 7 -3.476 -10.320 -5.165 48 H THR 8 H THR 8 -5.083 -7.751 -4.813 49 HA THR 8 HA THR 8 -7.319 -9.564 -4.894 50 HB THR 8 HB THR 8 -7.319 -7.117 -3.092 51 HG1 THR 8 HG1 THR 8 -5.700 -7.834 -1.871 52 HG21 THR 8 1HG2 THR 8 -8.187 -8.668 -1.480 53 HG22 THR 8 2HG2 THR 8 -7.758 -10.046 -2.493 54 HG23 THR 8 3HG2 THR 8 -9.046 -8.950 -2.999 55 H SER 9 H SER 9 -6.927 -7.774 -7.270 56 HA SER 9 HA SER 9 -9.668 -6.915 -7.498 57 HB2 SER 9 1HB SER 9 -8.375 -4.900 -6.387 58 HB3 SER 9 2HB SER 9 -7.610 -4.757 -8.003 59 HG SER 9 HG SER 9 -9.593 -3.505 -7.550 60 H ILE 10 H ILE 10 -9.768 -5.714 -9.762 61 HA ILE 10 HA ILE 10 -8.614 -7.400 -11.806 62 HB ILE 10 HB ILE 10 -9.912 -4.625 -11.977 63 HG12 ILE 10 1HG1 ILE 10 -11.444 -6.366 -11.065 64 HG13 ILE 10 2HG1 ILE 10 -11.975 -5.658 -12.573 65 HG21 ILE 10 1HG2 ILE 10 -9.133 -6.622 -14.135 66 HG22 ILE 10 2HG2 ILE 10 -10.329 -5.373 -14.427 67 HG23 ILE 10 3HG2 ILE 10 -8.697 -4.893 -14.018 68 HD11 ILE 10 3HD1 ILE 10 -11.561 -7.568 -13.870 69 HD12 ILE 10 1HD1 ILE 10 -10.636 -8.352 -12.556 70 HD13 ILE 10 2HD1 ILE 10 -12.395 -8.124 -12.404 71 H CYS 11 H CYS 11 -6.405 -7.275 -12.364 72 HA CYS 11 HA CYS 11 -4.769 -5.031 -11.487 73 HB2 CYS 11 1HB CYS 11 -4.413 -7.436 -13.224 74 HB3 CYS 11 2HB CYS 11 -3.246 -6.140 -13.429 75 H SER 12 H SER 12 -3.921 -3.202 -12.716 76 HA SER 12 HA SER 12 -5.584 -2.658 -15.175 77 HB2 SER 12 1HB SER 12 -4.400 -0.845 -13.035 78 HB3 SER 12 2HB SER 12 -5.284 -0.282 -14.522 79 HG SER 12 HG SER 12 -6.372 -2.163 -12.705 80 H LEU 13 H LEU 13 -4.620 -1.986 -17.025 81 HA LEU 13 HA LEU 13 -2.003 -2.871 -17.611 82 HB2 LEU 13 1HB LEU 13 -3.721 -2.220 -19.322 83 HB3 LEU 13 2HB LEU 13 -3.550 -0.526 -18.877 84 HG LEU 13 HG LEU 13 -1.290 -0.528 -19.789 85 HD11 LEU 13 1HD1 LEU 13 -1.894 -3.300 -20.799 86 HD12 LEU 13 2HD1 LEU 13 -0.637 -2.835 -19.634 87 HD13 LEU 13 3HD1 LEU 13 -0.549 -2.251 -21.320 88 HD21 LEU 13 3HD2 LEU 13 -3.485 -1.594 -21.711 89 HD22 LEU 13 1HD2 LEU 13 -2.053 -0.602 -22.202 90 HD23 LEU 13 2HD2 LEU 13 -3.312 0.138 -21.123 91 H TYR 14 H TYR 14 -3.056 0.492 -16.777 92 HA TYR 14 HA TYR 14 -0.394 1.504 -17.283 93 HB2 TYR 14 1HB TYR 14 -1.258 3.643 -16.457 94 HB3 TYR 14 2HB TYR 14 -2.456 2.870 -17.479 95 HD1 TYR 14 HD1 TYR 14 -4.550 1.953 -16.560 96 HD2 TYR 14 HD2 TYR 14 -1.713 4.001 -14.015 97 HE1 TYR 14 HE1 TYR 14 -6.303 2.131 -14.765 98 HE2 TYR 14 HE2 TYR 14 -3.498 4.278 -12.259 99 HH TYR 14 HH TYR 14 -5.727 3.801 -11.656 100 H GLN 15 H GLN 15 -1.960 0.154 -14.460 101 HA GLN 15 HA GLN 15 0.017 1.201 -12.623 102 HB2 GLN 15 1HB GLN 15 -1.906 -1.100 -12.218 103 HB3 GLN 15 2HB GLN 15 -0.874 -0.394 -10.939 104 HG2 GLN 15 1HG GLN 15 -2.131 1.825 -11.208 105 HG3 GLN 15 2HG GLN 15 -3.072 1.039 -12.481 106 HE21 GLN 15 2HE2 GLN 15 -5.079 1.257 -11.509 107 HE22 GLN 15 1HE2 GLN 15 -5.513 0.366 -10.044 108 H LEU 16 H LEU 16 -0.468 -1.811 -14.538 109 HA LEU 16 HA LEU 16 1.862 -3.161 -13.471 110 HB2 LEU 16 1HB LEU 16 0.501 -3.303 -16.181 111 HB3 LEU 16 2HB LEU 16 1.788 -4.376 -15.687 112 HG LEU 16 HG LEU 16 -0.733 -4.128 -14.102 113 HD11 LEU 16 1HD1 LEU 16 -1.507 -6.172 -15.165 114 HD12 LEU 16 2HD1 LEU 16 -0.061 -6.194 -16.199 115 HD13 LEU 16 3HD1 LEU 16 -1.241 -4.910 -16.396 116 HD21 LEU 16 3HD2 LEU 16 -0.140 -6.369 -13.336 117 HD22 LEU 16 1HD2 LEU 16 0.930 -5.041 -12.779 118 HD23 LEU 16 2HD2 LEU 16 1.447 -6.096 -14.120 119 H GLU 17 H GLU 17 1.394 -0.815 -16.248 120 HA GLU 17 HA GLU 17 4.174 -0.870 -16.978 121 HB2 GLU 17 1HB GLU 17 2.128 1.297 -17.261 122 HB3 GLU 17 2HB GLU 17 3.783 1.434 -17.868 123 HG2 GLU 17 1HG GLU 17 3.344 -0.723 -19.190 124 HG3 GLU 17 2HG GLU 17 1.644 -0.616 -18.712 125 H ASN 18 H ASN 18 2.450 0.816 -14.384 126 HA ASN 18 HA ASN 18 4.483 2.657 -13.816 127 HB2 ASN 18 1HB ASN 18 2.056 2.087 -12.813 128 HB3 ASN 18 2HB ASN 18 3.060 1.448 -11.509 129 HD21 ASN 18 2HD2 ASN 18 4.123 2.895 -10.189 130 HD22 ASN 18 1HD2 ASN 18 3.923 4.661 -10.333 131 H TYR 19 H TYR 19 4.556 -0.834 -13.277 132 HA TYR 19 HA TYR 19 6.715 -0.743 -11.272 133 HB2 TYR 19 1HB TYR 19 5.736 -2.870 -13.153 134 HB3 TYR 19 2HB TYR 19 7.047 -3.116 -12.002 135 HD1 TYR 19 HD2 TYR 19 6.411 -2.954 -9.394 136 HD2 TYR 19 HD1 TYR 19 3.379 -2.894 -12.523 137 HE1 TYR 19 HE2 TYR 19 4.792 -3.731 -7.785 138 HE2 TYR 19 HE1 TYR 19 1.732 -3.630 -10.902 139 HH TYR 19 HH TYR 19 2.537 -4.273 -7.529 140 H CYS 20 H CYS 20 6.446 -0.634 -14.780 141 HA CYS 20 HA CYS 20 9.172 -1.657 -15.163 142 HB2 CYS 20 1HB CYS 20 7.133 -0.435 -17.153 143 HB3 CYS 20 2HB CYS 20 8.648 -1.275 -17.614 144 H ASN 21 H ASN 21 10.748 -0.465 -16.336 145 HA ASN 21 HA ASN 21 11.083 2.213 -15.190 146 HB2 ASN 21 1HB ASN 21 12.774 0.602 -17.191 147 HB3 ASN 21 2HB ASN 21 13.263 2.047 -16.360 148 HD21 ASN 21 2HD2 ASN 21 13.914 -1.013 -16.394 149 HD22 ASN 21 1HD2 ASN 21 14.050 -1.305 -14.666 150 H1 PHE 1 1H PHE 1 -2.587 -7.967 -23.457 151 H2 PHE 1 2H PHE 1 -2.775 -6.360 -23.199 152 H3 PHE 1 3H PHE 1 -1.318 -7.098 -22.902 153 HA PHE 1 HA PHE 1 -2.187 -8.325 -21.099 154 HB2 PHE 1 1HB PHE 1 -1.430 -6.101 -20.582 155 HB3 PHE 1 2HB PHE 1 -3.040 -5.425 -20.955 156 HD1 PHE 1 HD1 PHE 1 -1.490 -8.056 -18.813 157 HD2 PHE 1 HD2 PHE 1 -4.478 -4.935 -19.202 158 HE1 PHE 1 HE1 PHE 1 -2.339 -8.535 -16.459 159 HE2 PHE 1 HE2 PHE 1 -5.158 -5.291 -16.816 160 HZ PHE 1 HZ PHE 1 -4.113 -7.121 -15.494 161 H VAL 2 H VAL 2 -4.095 -8.876 -19.640 162 HA VAL 2 HA VAL 2 -6.697 -8.396 -21.105 163 HB VAL 2 HB VAL 2 -5.818 -10.947 -19.615 164 HG11 VAL 2 1HG1 VAL 2 -7.991 -11.880 -20.377 165 HG12 VAL 2 2HG1 VAL 2 -8.160 -10.590 -19.182 166 HG13 VAL 2 3HG1 VAL 2 -8.484 -10.247 -20.891 167 HG21 VAL 2 3HG2 VAL 2 -6.367 -10.428 -22.614 168 HG22 VAL 2 1HG2 VAL 2 -4.803 -10.849 -21.877 169 HG23 VAL 2 2HG2 VAL 2 -6.118 -12.052 -21.887 170 H ASN 3 H ASN 3 -8.171 -7.314 -19.829 171 HA ASN 3 HA ASN 3 -7.142 -6.494 -17.259 172 HB2 ASN 3 1HB ASN 3 -9.793 -6.003 -18.643 173 HB3 ASN 3 2HB ASN 3 -9.294 -5.193 -17.157 174 HD21 ASN 3 2HD2 ASN 3 -9.887 -4.097 -19.819 175 HD22 ASN 3 1HD2 ASN 3 -8.477 -3.143 -20.243 176 H GLN 4 H GLN 4 -7.177 -8.185 -15.702 177 HA GLN 4 HA GLN 4 -9.746 -9.174 -14.736 178 HB2 GLN 4 1HB GLN 4 -8.866 -10.648 -16.754 179 HB3 GLN 4 2HB GLN 4 -7.666 -11.248 -15.618 180 HG2 GLN 4 1HG GLN 4 -9.350 -12.367 -14.354 181 HG3 GLN 4 2HG GLN 4 -10.635 -11.341 -14.991 182 HE21 GLN 4 2HE2 GLN 4 -11.919 -13.030 -15.730 183 HE22 GLN 4 1HE2 GLN 4 -11.476 -14.050 -17.053 184 H HIS 5 H HIS 5 -8.982 -10.999 -12.923 185 HA HIS 5 HA HIS 5 -7.134 -9.620 -11.131 186 HB2 HIS 5 1HB HIS 5 -8.868 -12.163 -10.943 187 HB3 HIS 5 2HB HIS 5 -7.671 -11.752 -9.722 188 HD1 HIS 5 HD1 HIS 5 -10.708 -9.897 -11.154 189 HD2 HIS 5 HD2 HIS 5 -8.581 -10.559 -7.654 190 HE1 HIS 5 HE1 HIS 5 -12.026 -8.744 -9.343 191 H LEU 6 H LEU 6 -5.034 -10.058 -11.207 192 HA LEU 6 HA LEU 6 -4.095 -12.800 -11.955 193 HB2 LEU 6 1HB LEU 6 -3.105 -10.187 -13.090 194 HB3 LEU 6 2HB LEU 6 -2.137 -11.650 -13.024 195 HG LEU 6 HG LEU 6 -4.283 -12.680 -14.368 196 HD11 LEU 6 1HD1 LEU 6 -4.038 -9.712 -15.107 197 HD12 LEU 6 2HD1 LEU 6 -5.526 -10.541 -14.516 198 HD13 LEU 6 3HD1 LEU 6 -4.865 -10.892 -16.145 199 HD21 LEU 6 3HD2 LEU 6 -2.894 -12.447 -16.387 200 HD22 LEU 6 1HD2 LEU 6 -1.810 -12.662 -14.993 201 HD23 LEU 6 2HD2 LEU 6 -2.056 -11.046 -15.674 202 H CYS 7 H CYS 7 -2.658 -13.402 -10.403 203 HA CYS 7 HA CYS 7 -1.066 -11.491 -8.811 204 HB2 CYS 7 1HB CYS 7 -3.310 -11.825 -7.629 205 HB3 CYS 7 2HB CYS 7 -2.869 -13.512 -7.444 206 H GLY 8 H GLY 8 0.662 -12.622 -7.674 207 HA2 GLY 8 1HA GLY 8 2.084 -14.349 -7.154 208 HA3 GLY 8 2HA GLY 8 0.780 -15.465 -7.549 209 H SER 9 H SER 9 1.482 -16.924 -9.018 210 HA SER 9 HA SER 9 3.666 -16.601 -10.789 211 HB2 SER 9 1HB SER 9 2.283 -18.520 -12.045 212 HB3 SER 9 2HB SER 9 2.966 -18.857 -10.420 213 HG SER 9 HG SER 9 0.421 -18.961 -11.182 214 H HIS 10 H HIS 10 0.235 -15.729 -11.051 215 HA HIS 10 HA HIS 10 0.276 -15.338 -13.902 216 HB2 HIS 10 1HB HIS 10 -1.704 -14.243 -11.933 217 HB3 HIS 10 2HB HIS 10 -1.925 -14.445 -13.641 218 HD1 HIS 10 HD1 HIS 10 -2.107 -16.281 -10.394 219 HD2 HIS 10 HD2 HIS 10 -2.293 -17.177 -14.465 220 HE1 HIS 10 HE1 HIS 10 -2.889 -18.681 -10.580 221 H LEU 11 H LEU 11 1.371 -13.423 -11.176 222 HA LEU 11 HA LEU 11 0.821 -10.907 -12.514 223 HB2 LEU 11 1HB LEU 11 1.204 -11.337 -9.947 224 HB3 LEU 11 2HB LEU 11 2.897 -11.455 -10.393 225 HG LEU 11 HG LEU 11 2.269 -9.072 -11.536 226 HD11 LEU 11 1HD1 LEU 11 0.727 -7.775 -10.238 227 HD12 LEU 11 2HD1 LEU 11 0.385 -9.138 -9.136 228 HD13 LEU 11 3HD1 LEU 11 -0.079 -9.207 -10.883 229 HD21 LEU 11 3HD2 LEU 11 4.068 -9.383 -10.006 230 HD22 LEU 11 1HD2 LEU 11 3.010 -9.534 -8.606 231 HD23 LEU 11 2HD2 LEU 11 3.139 -7.992 -9.492 232 H VAL 12 H VAL 12 3.372 -13.319 -12.185 233 HA VAL 12 HA VAL 12 5.524 -11.836 -13.344 234 HB VAL 12 HB VAL 12 4.973 -14.894 -13.544 235 HG11 VAL 12 1HG1 VAL 12 7.254 -15.176 -13.897 236 HG12 VAL 12 2HG1 VAL 12 6.783 -13.878 -14.958 237 HG13 VAL 12 3HG1 VAL 12 7.653 -13.520 -13.461 238 HG21 VAL 12 3HG2 VAL 12 6.582 -14.997 -11.488 239 HG22 VAL 12 1HG2 VAL 12 6.179 -13.294 -11.203 240 HG23 VAL 12 2HG2 VAL 12 4.912 -14.578 -11.211 241 H GLU 13 H GLU 13 2.936 -13.950 -14.606 242 HA GLU 13 HA GLU 13 3.521 -13.599 -17.369 243 HB2 GLU 13 1HB GLU 13 0.935 -14.143 -15.972 244 HB3 GLU 13 2HB GLU 13 1.150 -14.335 -17.719 245 HG2 GLU 13 1HG GLU 13 2.784 -16.175 -17.421 246 HG3 GLU 13 2HG GLU 13 2.689 -15.982 -15.659 247 H ALA 14 H ALA 14 1.494 -11.606 -15.166 248 HA ALA 14 HA ALA 14 0.367 -10.008 -17.255 249 HB1 ALA 14 3HB ALA 14 -0.152 -8.310 -15.620 250 HB2 ALA 14 1HB ALA 14 -0.459 -9.951 -14.943 251 HB3 ALA 14 2HB ALA 14 0.991 -9.052 -14.428 252 H LEU 15 H LEU 15 3.322 -9.465 -15.290 253 HA LEU 15 HA LEU 15 4.010 -6.997 -16.654 254 HB2 LEU 15 1HB LEU 15 5.560 -8.953 -14.906 255 HB3 LEU 15 2HB LEU 15 6.313 -7.590 -15.722 256 HG LEU 15 HG LEU 15 6.059 -7.091 -13.425 257 HD11 LEU 15 1HD1 LEU 15 4.901 -4.931 -13.616 258 HD12 LEU 15 2HD1 LEU 15 4.140 -5.423 -15.091 259 HD13 LEU 15 3HD1 LEU 15 5.913 -5.262 -15.025 260 HD21 LEU 15 3HD2 LEU 15 4.197 -8.440 -12.776 261 HD22 LEU 15 1HD2 LEU 15 3.086 -7.447 -13.734 262 HD23 LEU 15 2HD2 LEU 15 3.890 -6.774 -12.322 263 H TYR 16 H TYR 16 4.781 -10.432 -17.200 264 HA TYR 16 HA TYR 16 6.822 -9.980 -19.123 265 HB2 TYR 16 1HB TYR 16 6.339 -12.211 -18.215 266 HB3 TYR 16 2HB TYR 16 4.763 -12.181 -19.017 267 HD1 TYR 16 HD1 TYR 16 4.557 -12.449 -21.444 268 HD2 TYR 16 HD2 TYR 16 8.387 -12.468 -19.535 269 HE1 TYR 16 HE1 TYR 16 5.592 -13.414 -23.566 270 HE2 TYR 16 HE2 TYR 16 9.431 -13.337 -21.578 271 HH TYR 16 HH TYR 16 7.671 -14.380 -24.434 272 H LEU 17 H LEU 17 3.242 -10.288 -19.453 273 HA LEU 17 HA LEU 17 3.224 -9.858 -22.289 274 HB2 LEU 17 1HB LEU 17 1.096 -9.718 -20.103 275 HB3 LEU 17 2HB LEU 17 0.713 -9.386 -21.762 276 HG LEU 17 HG LEU 17 1.980 -11.984 -20.838 277 HD11 LEU 17 1HD1 LEU 17 -0.271 -11.941 -19.816 278 HD12 LEU 17 2HD1 LEU 17 -0.395 -12.909 -21.275 279 HD13 LEU 17 3HD1 LEU 17 -0.980 -11.251 -21.297 280 HD21 LEU 17 3HD2 LEU 17 2.390 -11.676 -23.233 281 HD22 LEU 17 1HD2 LEU 17 0.750 -11.047 -23.467 282 HD23 LEU 17 2HD2 LEU 17 1.021 -12.772 -23.101 283 H VAL 18 H VAL 18 3.010 -7.512 -19.603 284 HA VAL 18 HA VAL 18 2.048 -5.400 -21.404 285 HB VAL 18 HB VAL 18 3.050 -5.345 -18.507 286 HG11 VAL 18 1HG1 VAL 18 1.877 -3.095 -20.205 287 HG12 VAL 18 2HG1 VAL 18 1.946 -3.028 -18.445 288 HG13 VAL 18 3HG1 VAL 18 3.436 -3.099 -19.380 289 HG21 VAL 18 3HG2 VAL 18 0.266 -5.175 -19.745 290 HG22 VAL 18 1HG2 VAL 18 0.882 -6.483 -18.699 291 HG23 VAL 18 2HG2 VAL 18 0.603 -4.878 -18.043 292 H CYS 19 H CYS 19 5.241 -6.198 -19.831 293 HA CYS 19 HA CYS 19 6.264 -3.869 -21.434 294 HB2 CYS 19 1HB CYS 19 7.227 -5.041 -18.785 295 HB3 CYS 19 2HB CYS 19 7.992 -3.738 -19.644 296 H GLY 20 H GLY 20 6.158 -7.056 -21.768 297 HA2 GLY 20 1HA GLY 20 7.442 -8.441 -23.139 298 HA3 GLY 20 2HA GLY 20 8.442 -7.025 -23.464 299 H GLU 21 H GLU 21 8.011 -8.238 -20.214 300 HA GLU 21 HA GLU 21 9.362 -9.022 -18.620 301 HB2 GLU 21 1HB GLU 21 9.816 -10.859 -20.321 302 HB3 GLU 21 2HB GLU 21 11.279 -9.903 -20.739 303 HG2 GLU 21 1HG GLU 21 12.112 -10.189 -18.449 304 HG3 GLU 21 2HG GLU 21 10.671 -11.125 -18.014 305 H ARG 22 H ARG 22 10.636 -6.870 -20.945 306 HA ARG 22 HA ARG 22 13.131 -6.376 -19.840 307 HB2 ARG 22 1HB ARG 22 11.252 -4.333 -21.114 308 HB3 ARG 22 2HB ARG 22 13.036 -4.169 -21.068 309 HG2 ARG 22 1HG ARG 22 11.558 -6.342 -22.537 310 HG3 ARG 22 2HG ARG 22 12.078 -4.830 -23.292 311 HD2 ARG 22 1HD ARG 22 14.399 -5.363 -22.868 312 HD3 ARG 22 2HD ARG 22 13.973 -6.744 -21.835 313 HE ARG 22 HE ARG 22 13.804 -6.656 -24.788 314 HH11 ARG 22 1HH1 ARG 22 13.410 -8.531 -21.845 315 HH12 ARG 22 2HH1 ARG 22 13.516 -10.056 -22.673 316 HH21 ARG 22 1HH2 ARG 22 13.923 -8.647 -25.817 317 HH22 ARG 22 2HH2 ARG 22 13.777 -10.089 -24.892 318 H GLY 23 H GLY 23 10.021 -5.353 -18.743 319 HA2 GLY 23 1HA GLY 23 11.073 -3.119 -17.170 320 HA3 GLY 23 2HA GLY 23 9.411 -3.638 -17.312 321 H PHE 24 H PHE 24 10.913 -6.457 -16.459 322 HA PHE 24 HA PHE 24 10.812 -5.691 -13.629 323 HB2 PHE 24 1HB PHE 24 8.964 -6.874 -12.949 324 HB3 PHE 24 2HB PHE 24 8.460 -6.244 -14.516 325 HD1 PHE 24 HD2 PHE 24 9.074 -7.968 -16.582 326 HD2 PHE 24 HD1 PHE 24 8.593 -9.113 -12.441 327 HE1 PHE 24 HE2 PHE 24 8.494 -10.306 -17.261 328 HE2 PHE 24 HE1 PHE 24 7.958 -11.355 -13.123 329 HZ PHE 24 HZ PHE 24 7.927 -11.998 -15.533 330 H PHE 25 H PHE 25 11.373 -7.326 -12.094 331 HA PHE 25 HA PHE 25 13.071 -9.491 -13.200 332 HB2 PHE 25 1HB PHE 25 14.296 -7.768 -11.929 333 HB3 PHE 25 2HB PHE 25 13.227 -8.007 -10.552 334 HD1 PHE 25 HD2 PHE 25 15.987 -9.691 -12.552 335 HD2 PHE 25 HD1 PHE 25 13.425 -9.903 -9.051 336 HE1 PHE 25 HE2 PHE 25 17.325 -11.506 -11.694 337 HE2 PHE 25 HE1 PHE 25 14.817 -11.851 -8.186 338 HZ PHE 25 HZ PHE 25 16.795 -12.616 -9.525 339 H NVA 26 H ARX 26 12.665 -11.453 -12.703 340 HA NVA 26 HA ARX 26 10.793 -12.141 -10.483 341 HB2 NVA 26 1HB ARX 26 9.980 -14.155 -11.641 342 HB3 NVA 26 2HB ARX 26 9.761 -12.777 -12.712 343 HG2 NVA 26 1HG ARX 26 11.790 -13.557 -14.111 344 HG3 NVA 26 2HG ARX 26 12.118 -14.778 -12.839 345 HD2 NVA 26 1HD ARX 26 9.478 -15.497 -13.584 346 HD3 NVA 26 2HD ARX 26 10.170 -14.925 -15.113 347 H THR 27 H THR 27 11.242 -13.991 -9.221 348 HA THR 27 HA THR 27 14.044 -14.199 -8.656 349 HB THR 27 HB THR 27 13.269 -16.196 -7.302 350 HG1 THR 27 HG1 THR 27 11.018 -16.272 -7.079 351 HG21 THR 27 1HG2 THR 27 13.572 -13.886 -6.441 352 HG22 THR 27 2HG2 THR 27 12.323 -14.824 -5.604 353 HG23 THR 27 3HG2 THR 27 11.873 -13.557 -6.776 354 HA PRO 28 HA PRO 28 15.015 -16.503 -11.918 355 HB2 PRO 28 1HB PRO 28 17.353 -17.769 -11.240 356 HB3 PRO 28 2HB PRO 28 17.211 -15.989 -11.380 357 HG2 PRO 28 1HG PRO 28 16.962 -17.725 -8.832 358 HG3 PRO 28 2HG PRO 28 17.980 -16.321 -9.116 359 HD2 PRO 28 1HD PRO 28 15.679 -16.092 -7.939 360 HD3 PRO 28 2HD PRO 28 16.191 -14.844 -9.130 361 H HIX 29 H HIX 29 13.589 -17.902 -12.586 362 HA HIX 29 HA HIX 29 13.599 -20.686 -11.697 363 HB1 HIX 29 1HB HIX 29 11.739 -20.789 -13.547 364 HB2 HIX 29 2HB HIX 29 11.484 -19.938 -12.002 365 HD2 HIX 29 HD2 HIX 29 11.178 -17.281 -12.110 366 HD1 HIX 29 HD1 HIX 29 11.916 -19.233 -15.700 367 HE1 HIX 29 HE1 HIX 29 12.360 -16.677 -15.713 368 H THR 30 H THR 30 15.795 -20.773 -12.265 369 HA THR 30 HA THR 30 16.793 -21.077 -14.977 370 HB THR 30 HB THR 30 18.027 -22.220 -12.406 371 HG1 THR 30 HG1 THR 30 18.908 -20.253 -12.094 372 HG21 THR 30 1HG2 THR 30 19.006 -22.963 -14.623 373 HG22 THR 30 2HG2 THR 30 20.146 -22.019 -13.663 374 HG23 THR 30 3HG2 THR 30 19.281 -21.272 -15.021 Start of MODEL 28 1 H1 GLY 1 1H GLY 1 1.747 3.533 -1.312 2 H2 GLY 1 2H GLY 1 0.211 3.022 -1.149 3 H3 GLY 1 3H GLY 1 1.265 2.838 0.095 4 HA2 GLY 1 1HA GLY 1 2.614 1.356 -1.552 5 HA3 GLY 1 2HA GLY 1 1.188 0.697 -0.683 6 H ILE 2 H ILE 2 2.074 -0.502 -3.115 7 HA ILE 2 HA ILE 2 -0.304 0.136 -4.761 8 HB ILE 2 HB ILE 2 1.518 1.298 -5.934 9 HG12 ILE 2 1HG1 ILE 2 0.623 -1.196 -7.440 10 HG13 ILE 2 2HG1 ILE 2 -0.338 0.214 -7.091 11 HG21 ILE 2 1HG2 ILE 2 3.549 -0.054 -5.204 12 HG22 ILE 2 2HG2 ILE 2 2.985 -1.438 -6.109 13 HG23 ILE 2 3HG2 ILE 2 3.523 0.008 -6.927 14 HD11 ILE 2 3HD1 ILE 2 1.293 1.596 -8.408 15 HD12 ILE 2 1HD1 ILE 2 2.235 0.119 -8.821 16 HD13 ILE 2 2HD1 ILE 2 0.572 0.306 -9.408 17 H VAL 3 H VAL 3 2.293 -2.405 -4.242 18 HA VAL 3 HA VAL 3 1.131 -4.397 -5.844 19 HB VAL 3 HB VAL 3 2.689 -4.794 -3.243 20 HG11 VAL 3 1HG1 VAL 3 1.655 -6.862 -3.970 21 HG12 VAL 3 2HG1 VAL 3 2.257 -6.599 -5.622 22 HG13 VAL 3 3HG1 VAL 3 3.372 -6.931 -4.284 23 HG21 VAL 3 3HG2 VAL 3 4.072 -3.384 -4.663 24 HG22 VAL 3 1HG2 VAL 3 4.674 -5.050 -4.894 25 HG23 VAL 3 2HG2 VAL 3 3.637 -4.310 -6.114 26 H GLU 4 H GLU 4 0.514 -4.049 -2.264 27 HA GLU 4 HA GLU 4 -1.197 -6.360 -2.126 28 HB2 GLU 4 1HB GLU 4 -0.069 -5.155 -0.242 29 HB3 GLU 4 2HB GLU 4 -1.228 -3.813 -0.485 30 HG2 GLU 4 1HG GLU 4 -3.077 -5.312 0.088 31 HG3 GLU 4 2HG GLU 4 -1.976 -6.674 0.318 32 H GLN 5 H GLN 5 -1.841 -2.869 -2.652 33 HA GLN 5 HA GLN 5 -4.718 -3.216 -2.825 34 HB2 GLN 5 1HB GLN 5 -2.748 -1.113 -3.901 35 HB3 GLN 5 2HB GLN 5 -4.498 -1.057 -4.210 36 HG2 GLN 5 1HG GLN 5 -3.722 0.447 -2.343 37 HG3 GLN 5 2HG GLN 5 -5.074 -0.651 -1.964 38 HE21 GLN 5 2HE2 GLN 5 -4.989 -1.499 -0.004 39 HE22 GLN 5 1HE2 GLN 5 -3.535 -1.913 0.876 40 H CYS 6 H CYS 6 -2.151 -3.707 -5.217 41 HA CYS 6 HA CYS 6 -4.056 -3.510 -7.427 42 HB2 CYS 6 1HB CYS 6 -1.518 -3.074 -7.394 43 HB3 CYS 6 2HB CYS 6 -1.351 -4.819 -7.511 44 H CYS 7 H CYS 7 -2.396 -6.012 -5.554 45 HA CYS 7 HA CYS 7 -3.412 -8.261 -6.940 46 HB2 CYS 7 1HB CYS 7 -2.101 -7.736 -4.283 47 HB3 CYS 7 2HB CYS 7 -2.798 -9.334 -4.588 48 H THR 8 H THR 8 -4.751 -6.431 -4.113 49 HA THR 8 HA THR 8 -6.874 -8.496 -3.759 50 HB THR 8 HB THR 8 -7.693 -6.939 -2.025 51 HG1 THR 8 HG1 THR 8 -5.270 -5.447 -2.399 52 HG21 THR 8 1HG2 THR 8 -5.653 -7.040 -0.585 53 HG22 THR 8 2HG2 THR 8 -4.765 -7.713 -2.011 54 HG23 THR 8 3HG2 THR 8 -6.157 -8.599 -1.299 55 H SER 9 H SER 9 -6.527 -7.134 -6.315 56 HA SER 9 HA SER 9 -9.350 -6.504 -6.734 57 HB2 SER 9 1HB SER 9 -8.263 -4.360 -5.813 58 HB3 SER 9 2HB SER 9 -7.407 -4.281 -7.395 59 HG SER 9 HG SER 9 -9.570 -3.191 -7.123 60 H ILE 10 H ILE 10 -9.369 -5.448 -9.157 61 HA ILE 10 HA ILE 10 -7.765 -7.248 -10.892 62 HB ILE 10 HB ILE 10 -9.925 -5.148 -11.529 63 HG12 ILE 10 1HG1 ILE 10 -10.705 -7.316 -10.395 64 HG13 ILE 10 2HG1 ILE 10 -11.436 -6.920 -11.941 65 HG21 ILE 10 1HG2 ILE 10 -8.333 -5.220 -13.425 66 HG22 ILE 10 2HG2 ILE 10 -8.560 -7.010 -13.512 67 HG23 ILE 10 3HG2 ILE 10 -9.900 -5.896 -13.869 68 HD11 ILE 10 3HD1 ILE 10 -10.090 -8.659 -13.073 69 HD12 ILE 10 1HD1 ILE 10 -9.190 -8.991 -11.570 70 HD13 ILE 10 2HD1 ILE 10 -10.929 -9.368 -11.704 71 H CYS 11 H CYS 11 -5.681 -6.618 -11.516 72 HA CYS 11 HA CYS 11 -4.852 -3.898 -10.922 73 HB2 CYS 11 1HB CYS 11 -3.630 -6.152 -12.457 74 HB3 CYS 11 2HB CYS 11 -2.857 -4.559 -12.337 75 H SER 12 H SER 12 -5.114 -2.156 -12.219 76 HA SER 12 HA SER 12 -6.280 -2.389 -14.852 77 HB2 SER 12 1HB SER 12 -4.914 0.009 -13.672 78 HB3 SER 12 2HB SER 12 -6.236 -0.041 -14.913 79 HG SER 12 HG SER 12 -7.507 0.119 -13.229 80 H LEU 13 H LEU 13 -5.237 -1.918 -16.855 81 HA LEU 13 HA LEU 13 -2.662 -2.994 -17.218 82 HB2 LEU 13 1HB LEU 13 -4.359 -2.721 -18.967 83 HB3 LEU 13 2HB LEU 13 -4.168 -0.979 -18.938 84 HG LEU 13 HG LEU 13 -1.768 -1.314 -19.684 85 HD11 LEU 13 1HD1 LEU 13 -2.863 -4.052 -20.566 86 HD12 LEU 13 2HD1 LEU 13 -1.782 -3.836 -19.168 87 HD13 LEU 13 3HD1 LEU 13 -1.192 -3.406 -20.760 88 HD21 LEU 13 3HD2 LEU 13 -2.574 -1.662 -22.030 89 HD22 LEU 13 1HD2 LEU 13 -3.422 -0.412 -21.085 90 HD23 LEU 13 2HD2 LEU 13 -4.195 -2.004 -21.331 91 H TYR 14 H TYR 14 -3.436 0.494 -16.777 92 HA TYR 14 HA TYR 14 -0.790 1.338 -17.286 93 HB2 TYR 14 1HB TYR 14 -1.758 3.505 -16.110 94 HB3 TYR 14 2HB TYR 14 -2.214 3.064 -17.768 95 HD1 TYR 14 HD1 TYR 14 -3.468 3.249 -14.315 96 HD2 TYR 14 HD2 TYR 14 -4.396 2.247 -18.354 97 HE1 TYR 14 HE1 TYR 14 -5.902 3.327 -13.741 98 HE2 TYR 14 HE2 TYR 14 -6.816 2.147 -17.717 99 HH TYR 14 HH TYR 14 -8.333 2.607 -16.298 100 H GLN 15 H GLN 15 -2.499 0.333 -14.354 101 HA GLN 15 HA GLN 15 -0.490 1.404 -12.546 102 HB2 GLN 15 1HB GLN 15 -2.552 -0.813 -12.216 103 HB3 GLN 15 2HB GLN 15 -1.484 -0.287 -10.945 104 HG2 GLN 15 1HG GLN 15 -2.461 2.058 -11.309 105 HG3 GLN 15 2HG GLN 15 -3.709 1.264 -12.297 106 HE21 GLN 15 2HE2 GLN 15 -5.379 0.256 -11.258 107 HE22 GLN 15 1HE2 GLN 15 -5.553 0.223 -9.516 108 H LEU 16 H LEU 16 -1.134 -1.576 -14.327 109 HA LEU 16 HA LEU 16 1.037 -3.059 -13.134 110 HB2 LEU 16 1HB LEU 16 -0.952 -4.037 -14.284 111 HB3 LEU 16 2HB LEU 16 -0.398 -3.301 -15.767 112 HG LEU 16 HG LEU 16 0.831 -5.599 -14.270 113 HD11 LEU 16 1HD1 LEU 16 -1.078 -6.277 -15.502 114 HD12 LEU 16 2HD1 LEU 16 0.167 -6.574 -16.644 115 HD13 LEU 16 3HD1 LEU 16 -0.800 -5.118 -16.798 116 HD21 LEU 16 3HD2 LEU 16 2.276 -5.925 -16.294 117 HD22 LEU 16 1HD2 LEU 16 2.786 -4.601 -15.191 118 HD23 LEU 16 2HD2 LEU 16 1.912 -4.192 -16.714 119 H GLU 17 H GLU 17 0.686 -1.069 -16.164 120 HA GLU 17 HA GLU 17 3.446 -1.635 -16.793 121 HB2 GLU 17 1HB GLU 17 3.262 -0.456 -18.670 122 HB3 GLU 17 2HB GLU 17 1.540 -0.845 -18.340 123 HG2 GLU 17 1HG GLU 17 1.407 1.323 -18.912 124 HG3 GLU 17 2HG GLU 17 1.517 1.437 -17.120 125 H ASN 18 H ASN 18 2.130 0.625 -14.529 126 HA ASN 18 HA ASN 18 4.322 2.420 -14.421 127 HB2 ASN 18 1HB ASN 18 2.034 2.414 -13.128 128 HB3 ASN 18 2HB ASN 18 2.875 1.491 -11.918 129 HD21 ASN 18 2HD2 ASN 18 2.698 4.562 -13.467 130 HD22 ASN 18 1HD2 ASN 18 3.619 5.414 -12.262 131 H TYR 19 H TYR 19 4.071 -0.934 -13.417 132 HA TYR 19 HA TYR 19 6.372 -0.797 -11.599 133 HB2 TYR 19 1HB TYR 19 5.119 -3.018 -13.164 134 HB3 TYR 19 2HB TYR 19 6.420 -3.284 -12.020 135 HD1 TYR 19 HD1 TYR 19 5.892 -2.151 -9.527 136 HD2 TYR 19 HD2 TYR 19 2.937 -3.587 -12.383 137 HE1 TYR 19 HE1 TYR 19 4.141 -2.312 -7.707 138 HE2 TYR 19 HE2 TYR 19 1.339 -3.825 -10.459 139 HH TYR 19 HH TYR 19 1.911 -2.774 -7.255 140 H CYS 20 H CYS 20 6.089 -0.664 -15.114 141 HA CYS 20 HA CYS 20 8.431 -2.284 -15.689 142 HB2 CYS 20 1HB CYS 20 7.164 -0.062 -17.441 143 HB3 CYS 20 2HB CYS 20 8.200 -1.405 -18.008 144 H ASN 21 H ASN 21 10.519 -1.816 -15.946 145 HA ASN 21 HA ASN 21 11.259 0.889 -14.925 146 HB2 ASN 21 1HB ASN 21 13.546 0.018 -14.880 147 HB3 ASN 21 2HB ASN 21 12.520 -1.157 -14.083 148 HD21 ASN 21 2HD2 ASN 21 12.828 -3.166 -14.555 149 HD22 ASN 21 1HD2 ASN 21 13.522 -3.784 -16.058 150 H1 PHE 1 1H PHE 1 -3.517 -7.929 -22.878 151 H2 PHE 1 2H PHE 1 -1.972 -8.290 -22.773 152 H3 PHE 1 3H PHE 1 -3.068 -9.465 -22.938 153 HA PHE 1 HA PHE 1 -2.264 -9.450 -20.712 154 HB2 PHE 1 1HB PHE 1 -1.639 -7.140 -20.575 155 HB3 PHE 1 2HB PHE 1 -3.259 -6.545 -20.865 156 HD1 PHE 1 HD2 PHE 1 -2.144 -9.365 -18.516 157 HD2 PHE 1 HD1 PHE 1 -3.709 -5.381 -18.895 158 HE1 PHE 1 HE2 PHE 1 -2.527 -9.284 -16.134 159 HE2 PHE 1 HE1 PHE 1 -4.118 -5.268 -16.459 160 HZ PHE 1 HZ PHE 1 -3.477 -7.265 -15.073 161 H VAL 2 H VAL 2 -5.262 -7.418 -21.068 162 HA VAL 2 HA VAL 2 -7.492 -7.880 -20.716 163 HB VAL 2 HB VAL 2 -6.994 -10.871 -20.187 164 HG11 VAL 2 1HG1 VAL 2 -9.377 -11.075 -20.914 165 HG12 VAL 2 2HG1 VAL 2 -9.216 -10.048 -19.521 166 HG13 VAL 2 3HG1 VAL 2 -9.443 -9.296 -21.105 167 HG21 VAL 2 3HG2 VAL 2 -6.114 -10.328 -22.469 168 HG22 VAL 2 1HG2 VAL 2 -7.566 -11.346 -22.524 169 HG23 VAL 2 2HG2 VAL 2 -7.681 -9.617 -22.884 170 H ASN 3 H ASN 3 -8.885 -8.073 -18.764 171 HA ASN 3 HA ASN 3 -7.503 -7.252 -16.390 172 HB2 ASN 3 1HB ASN 3 -10.332 -8.247 -16.900 173 HB3 ASN 3 2HB ASN 3 -9.807 -7.720 -15.312 174 HD21 ASN 3 2HD2 ASN 3 -11.673 -6.781 -17.570 175 HD22 ASN 3 1HD2 ASN 3 -11.261 -5.046 -17.706 176 H GLN 4 H GLN 4 -6.524 -8.346 -14.794 177 HA GLN 4 HA GLN 4 -7.447 -11.029 -13.952 178 HB2 GLN 4 1HB GLN 4 -4.560 -10.342 -14.741 179 HB3 GLN 4 2HB GLN 4 -5.025 -11.737 -13.816 180 HG2 GLN 4 1HG GLN 4 -6.442 -12.513 -15.731 181 HG3 GLN 4 2HG GLN 4 -5.878 -11.133 -16.664 182 HE21 GLN 4 2HE2 GLN 4 -5.435 -14.337 -16.371 183 HE22 GLN 4 1HE2 GLN 4 -3.733 -14.470 -16.697 184 H HIS 5 H HIS 5 -6.716 -11.547 -11.823 185 HA HIS 5 HA HIS 5 -6.494 -9.223 -10.016 186 HB2 HIS 5 1HB HIS 5 -7.569 -11.901 -9.974 187 HB3 HIS 5 2HB HIS 5 -6.346 -11.783 -8.674 188 HD1 HIS 5 HD1 HIS 5 -9.732 -10.440 -9.885 189 HD2 HIS 5 HD2 HIS 5 -7.237 -10.170 -6.566 190 HE1 HIS 5 HE1 HIS 5 -11.035 -9.282 -8.017 191 H LEU 6 H LEU 6 -4.443 -11.146 -11.693 192 HA LEU 6 HA LEU 6 -2.284 -11.674 -11.714 193 HB2 LEU 6 1HB LEU 6 -2.113 -9.258 -9.932 194 HB3 LEU 6 2HB LEU 6 -0.749 -10.056 -10.639 195 HG LEU 6 HG LEU 6 -2.731 -8.243 -11.926 196 HD11 LEU 6 1HD1 LEU 6 -0.647 -7.402 -13.032 197 HD12 LEU 6 2HD1 LEU 6 0.295 -8.593 -12.136 198 HD13 LEU 6 3HD1 LEU 6 -0.551 -7.299 -11.267 199 HD21 LEU 6 3HD2 LEU 6 -1.138 -10.359 -13.396 200 HD22 LEU 6 1HD2 LEU 6 -1.935 -8.973 -14.138 201 HD23 LEU 6 2HD2 LEU 6 -2.929 -10.182 -13.350 202 H CYS 7 H CYS 7 -2.737 -10.928 -8.194 203 HA CYS 7 HA CYS 7 -0.282 -12.047 -7.512 204 HB2 CYS 7 1HB CYS 7 -2.638 -11.264 -6.077 205 HB3 CYS 7 2HB CYS 7 -1.912 -12.706 -5.335 206 H GLY 8 H GLY 8 0.679 -13.906 -7.213 207 HA2 GLY 8 1HA GLY 8 0.355 -16.305 -6.471 208 HA3 GLY 8 2HA GLY 8 -1.017 -16.284 -7.553 209 H SER 9 H SER 9 -0.729 -16.520 -9.785 210 HA SER 9 HA SER 9 2.159 -16.745 -10.543 211 HB2 SER 9 1HB SER 9 1.157 -18.938 -10.436 212 HB3 SER 9 2HB SER 9 -0.175 -18.394 -11.511 213 HG SER 9 HG SER 9 1.808 -19.595 -12.372 214 H HIS 10 H HIS 10 -1.004 -15.514 -11.515 215 HA HIS 10 HA HIS 10 -0.262 -15.042 -14.249 216 HB2 HIS 10 1HB HIS 10 -2.273 -13.653 -12.425 217 HB3 HIS 10 2HB HIS 10 -2.123 -13.374 -14.175 218 HD1 HIS 10 HD1 HIS 10 -4.382 -15.000 -12.045 219 HD2 HIS 10 HD2 HIS 10 -2.280 -16.231 -15.453 220 HE1 HIS 10 HE1 HIS 10 -5.729 -16.808 -13.139 221 H LEU 11 H LEU 11 0.573 -13.296 -11.293 222 HA LEU 11 HA LEU 11 0.960 -10.680 -12.258 223 HB2 LEU 11 1HB LEU 11 1.190 -11.543 -9.914 224 HB3 LEU 11 2HB LEU 11 2.740 -12.230 -10.339 225 HG LEU 11 HG LEU 11 2.613 -9.383 -11.051 226 HD11 LEU 11 1HD1 LEU 11 2.239 -9.986 -8.065 227 HD12 LEU 11 2HD1 LEU 11 0.903 -9.478 -9.091 228 HD13 LEU 11 3HD1 LEU 11 2.290 -8.411 -8.851 229 HD21 LEU 11 3HD2 LEU 11 4.579 -9.282 -9.535 230 HD22 LEU 11 1HD2 LEU 11 4.719 -10.541 -10.768 231 HD23 LEU 11 2HD2 LEU 11 4.263 -10.975 -9.073 232 H VAL 12 H VAL 12 3.252 -13.477 -12.480 233 HA VAL 12 HA VAL 12 5.354 -11.868 -13.559 234 HB VAL 12 HB VAL 12 4.833 -14.914 -13.568 235 HG11 VAL 12 1HG1 VAL 12 7.206 -13.333 -14.716 236 HG12 VAL 12 2HG1 VAL 12 7.291 -15.037 -14.265 237 HG13 VAL 12 3HG1 VAL 12 6.176 -14.527 -15.520 238 HG21 VAL 12 3HG2 VAL 12 5.358 -13.948 -11.359 239 HG22 VAL 12 1HG2 VAL 12 6.731 -14.854 -11.940 240 HG23 VAL 12 2HG2 VAL 12 6.749 -13.101 -12.018 241 H GLU 13 H GLU 13 2.792 -13.966 -15.038 242 HA GLU 13 HA GLU 13 3.599 -13.656 -17.765 243 HB2 GLU 13 1HB GLU 13 0.932 -14.110 -16.382 244 HB3 GLU 13 2HB GLU 13 1.077 -14.045 -18.133 245 HG2 GLU 13 1HG GLU 13 2.832 -15.930 -16.648 246 HG3 GLU 13 2HG GLU 13 1.089 -16.321 -16.842 247 H ALA 14 H ALA 14 1.431 -11.713 -15.682 248 HA ALA 14 HA ALA 14 0.648 -9.931 -17.770 249 HB1 ALA 14 3HB ALA 14 -0.392 -10.156 -15.559 250 HB2 ALA 14 1HB ALA 14 1.071 -9.480 -14.807 251 HB3 ALA 14 2HB ALA 14 0.082 -8.465 -15.870 252 H LEU 15 H LEU 15 3.434 -9.740 -15.448 253 HA LEU 15 HA LEU 15 4.305 -7.208 -16.438 254 HB2 LEU 15 1HB LEU 15 5.511 -9.425 -14.822 255 HB3 LEU 15 2HB LEU 15 6.470 -8.014 -15.267 256 HG LEU 15 HG LEU 15 3.810 -7.708 -13.856 257 HD11 LEU 15 1HD1 LEU 15 6.584 -8.216 -12.691 258 HD12 LEU 15 2HD1 LEU 15 5.107 -9.212 -12.510 259 HD13 LEU 15 3HD1 LEU 15 5.182 -7.610 -11.738 260 HD21 LEU 15 3HD2 LEU 15 4.671 -5.572 -13.123 261 HD22 LEU 15 1HD2 LEU 15 4.891 -5.659 -14.847 262 HD23 LEU 15 2HD2 LEU 15 6.272 -5.926 -13.791 263 H TYR 16 H TYR 16 5.155 -10.584 -17.305 264 HA TYR 16 HA TYR 16 7.228 -10.005 -19.175 265 HB2 TYR 16 1HB TYR 16 6.509 -12.227 -18.259 266 HB3 TYR 16 2HB TYR 16 5.092 -12.182 -19.329 267 HD1 TYR 16 HD1 TYR 16 8.867 -11.635 -19.631 268 HD2 TYR 16 HD2 TYR 16 5.239 -13.316 -21.358 269 HE1 TYR 16 HE1 TYR 16 10.183 -12.576 -21.449 270 HE2 TYR 16 HE2 TYR 16 6.575 -14.287 -23.195 271 HH TYR 16 HH TYR 16 8.659 -14.607 -23.997 272 H LEU 17 H LEU 17 3.615 -10.134 -19.520 273 HA LEU 17 HA LEU 17 3.664 -9.814 -22.373 274 HB2 LEU 17 1HB LEU 17 1.545 -9.300 -20.260 275 HB3 LEU 17 2HB LEU 17 1.228 -9.034 -21.967 276 HG LEU 17 HG LEU 17 2.192 -11.734 -21.068 277 HD11 LEU 17 1HD1 LEU 17 0.008 -12.531 -20.707 278 HD12 LEU 17 2HD1 LEU 17 -0.749 -11.094 -21.463 279 HD13 LEU 17 3HD1 LEU 17 0.022 -10.975 -19.840 280 HD21 LEU 17 3HD2 LEU 17 1.279 -12.469 -23.140 281 HD22 LEU 17 1HD2 LEU 17 2.221 -11.017 -23.527 282 HD23 LEU 17 2HD2 LEU 17 0.430 -10.937 -23.415 283 H VAL 18 H VAL 18 3.352 -7.450 -19.752 284 HA VAL 18 HA VAL 18 2.771 -5.268 -21.645 285 HB VAL 18 HB VAL 18 2.916 -5.333 -18.584 286 HG11 VAL 18 1HG1 VAL 18 1.518 -3.116 -18.879 287 HG12 VAL 18 2HG1 VAL 18 3.252 -3.025 -19.175 288 HG13 VAL 18 3HG1 VAL 18 2.110 -3.105 -20.523 289 HG21 VAL 18 3HG2 VAL 18 1.089 -6.726 -19.484 290 HG22 VAL 18 1HG2 VAL 18 0.437 -5.299 -18.718 291 HG23 VAL 18 2HG2 VAL 18 0.530 -5.366 -20.466 292 H CYS 19 H CYS 19 5.350 -6.047 -19.210 293 HA CYS 19 HA CYS 19 6.867 -3.595 -20.050 294 HB2 CYS 19 1HB CYS 19 7.641 -5.791 -18.024 295 HB3 CYS 19 2HB CYS 19 8.403 -4.223 -18.222 296 H GLY 20 H GLY 20 6.676 -7.024 -20.632 297 HA2 GLY 20 1HA GLY 20 7.977 -8.264 -22.256 298 HA3 GLY 20 2HA GLY 20 9.023 -6.840 -22.453 299 H GLU 21 H GLU 21 10.924 -8.175 -22.230 300 HA GLU 21 HA GLU 21 11.300 -9.731 -19.805 301 HB2 GLU 21 1HB GLU 21 13.285 -8.645 -21.799 302 HB3 GLU 21 2HB GLU 21 13.633 -9.956 -20.624 303 HG2 GLU 21 1HG GLU 21 12.032 -11.419 -21.712 304 HG3 GLU 21 2HG GLU 21 11.581 -10.137 -22.859 305 H ARG 22 H ARG 22 11.152 -6.427 -20.032 306 HA ARG 22 HA ARG 22 13.281 -6.037 -17.954 307 HB2 ARG 22 1HB ARG 22 12.198 -4.064 -19.970 308 HB3 ARG 22 2HB ARG 22 13.436 -3.712 -18.809 309 HG2 ARG 22 1HG ARG 22 14.976 -5.357 -19.912 310 HG3 ARG 22 2HG ARG 22 13.705 -5.669 -21.101 311 HD2 ARG 22 1HD ARG 22 13.732 -3.295 -21.721 312 HD3 ARG 22 2HD ARG 22 15.009 -2.971 -20.544 313 HE ARG 22 HE ARG 22 15.665 -5.161 -22.350 314 HH11 ARG 22 1HH1 ARG 22 15.500 -1.616 -22.338 315 HH12 ARG 22 2HH1 ARG 22 16.588 -1.477 -23.702 316 HH21 ARG 22 1HH2 ARG 22 17.102 -4.875 -24.058 317 HH22 ARG 22 2HH2 ARG 22 17.489 -3.265 -24.623 318 H GLY 23 H GLY 23 11.309 -6.857 -16.626 319 HA2 GLY 23 1HA GLY 23 10.416 -4.460 -15.244 320 HA3 GLY 23 2HA GLY 23 9.098 -5.330 -15.991 321 H PHE 24 H PHE 24 11.375 -7.657 -15.040 322 HA PHE 24 HA PHE 24 10.683 -7.559 -12.227 323 HB2 PHE 24 1HB PHE 24 9.520 -9.745 -12.213 324 HB3 PHE 24 2HB PHE 24 8.640 -8.477 -13.106 325 HD1 PHE 24 HD2 PHE 24 8.745 -8.548 -15.673 326 HD2 PHE 24 HD1 PHE 24 10.096 -11.733 -13.177 327 HE1 PHE 24 HE2 PHE 24 8.746 -10.096 -17.667 328 HE2 PHE 24 HE1 PHE 24 10.082 -13.309 -15.114 329 HZ PHE 24 HZ PHE 24 9.432 -12.501 -17.361 330 H PHE 25 H PHE 25 11.685 -9.542 -11.226 331 HA PHE 25 HA PHE 25 14.220 -10.252 -12.628 332 HB2 PHE 25 1HB PHE 25 14.396 -9.275 -10.411 333 HB3 PHE 25 2HB PHE 25 13.404 -10.593 -9.697 334 HD1 PHE 25 HD2 PHE 25 16.673 -9.830 -11.377 335 HD2 PHE 25 HD1 PHE 25 14.341 -12.707 -9.176 336 HE1 PHE 25 HE2 PHE 25 18.711 -11.156 -11.056 337 HE2 PHE 25 HE1 PHE 25 16.369 -14.174 -8.939 338 HZ PHE 25 HZ PHE 25 18.596 -13.379 -9.857 339 H NVA 26 H ARX 26 11.992 -11.755 -10.274 340 HA NVA 26 HA ARX 26 11.168 -13.713 -9.840 341 HB2 NVA 26 1HB ARX 26 10.124 -13.541 -12.207 342 HB3 NVA 26 2HB ARX 26 11.423 -14.633 -12.685 343 HG2 NVA 26 1HG ARX 26 10.518 -16.090 -10.618 344 HG3 NVA 26 2HG ARX 26 9.006 -15.202 -10.909 345 HD2 NVA 26 1HD ARX 26 8.880 -16.109 -13.174 346 HD3 NVA 26 2HD ARX 26 10.583 -16.633 -13.167 347 H THR 27 H THR 27 11.796 -15.314 -8.799 348 HA THR 27 HA THR 27 14.543 -16.229 -8.753 349 HB THR 27 HB THR 27 13.748 -17.586 -6.806 350 HG1 THR 27 HG1 THR 27 11.551 -17.385 -6.211 351 HG21 THR 27 1HG2 THR 27 13.045 -15.770 -5.299 352 HG22 THR 27 2HG2 THR 27 12.595 -14.755 -6.708 353 HG23 THR 27 3HG2 THR 27 14.322 -15.180 -6.449 354 HA PRO 28 HA PRO 28 13.859 -19.667 -11.329 355 HB2 PRO 28 1HB PRO 28 15.387 -21.724 -10.345 356 HB3 PRO 28 2HB PRO 28 16.074 -20.245 -11.056 357 HG2 PRO 28 1HG PRO 28 15.567 -20.865 -8.136 358 HG3 PRO 28 2HG PRO 28 17.107 -20.332 -8.932 359 HD2 PRO 28 1HD PRO 28 15.458 -18.547 -7.709 360 HD3 PRO 28 2HD PRO 28 16.350 -18.169 -9.246 361 H HIX 29 H HIX 29 11.662 -20.114 -11.200 362 HA HIX 29 HA HIX 29 10.724 -22.131 -9.131 363 HB1 HIX 29 1HB HIX 29 8.402 -21.671 -10.268 364 HB2 HIX 29 2HB HIX 29 8.984 -20.513 -9.072 365 HD2 HIX 29 HD2 HIX 29 10.241 -18.181 -10.179 366 HD1 HIX 29 HD1 HIX 29 7.852 -20.612 -12.565 367 HE1 HIX 29 HE1 HIX 29 9.223 -18.924 -13.812 368 H THR 30 H THR 30 12.045 -23.810 -10.044 369 HA THR 30 HA THR 30 10.643 -25.435 -12.065 370 HB THR 30 HB THR 30 11.837 -24.240 -13.747 371 HG1 THR 30 HG1 THR 30 12.395 -26.421 -13.798 372 HG21 THR 30 1HG2 THR 30 14.109 -24.013 -11.732 373 HG22 THR 30 2HG2 THR 30 13.157 -22.701 -12.452 374 HG23 THR 30 3HG2 THR 30 14.298 -23.621 -13.451 Start of MODEL 29 1 H1 GLY 1 1H GLY 1 -0.654 -1.301 0.360 2 H2 GLY 1 2H GLY 1 0.422 -0.518 1.277 3 H3 GLY 1 3H GLY 1 -0.350 0.306 0.132 4 HA2 GLY 1 1HA GLY 1 1.823 -0.002 -0.736 5 HA3 GLY 1 2HA GLY 1 1.744 -1.728 -0.287 6 H ILE 2 H ILE 2 2.285 -0.461 -2.966 7 HA ILE 2 HA ILE 2 -0.081 -0.759 -4.571 8 HB ILE 2 HB ILE 2 1.907 0.627 -5.170 9 HG12 ILE 2 1HG1 ILE 2 1.221 -1.490 -7.203 10 HG13 ILE 2 2HG1 ILE 2 0.204 -0.108 -6.805 11 HG21 ILE 2 1HG2 ILE 2 3.979 -0.468 -6.067 12 HG22 ILE 2 2HG2 ILE 2 3.752 -0.913 -4.414 13 HG23 ILE 2 3HG2 ILE 2 3.347 -2.077 -5.718 14 HD11 ILE 2 3HD1 ILE 2 2.956 -0.031 -8.183 15 HD12 ILE 2 1HD1 ILE 2 1.412 0.486 -8.825 16 HD13 ILE 2 2HD1 ILE 2 2.132 1.399 -7.515 17 H VAL 3 H VAL 3 2.341 -3.057 -3.447 18 HA VAL 3 HA VAL 3 2.006 -5.044 -5.377 19 HB VAL 3 HB VAL 3 2.418 -5.771 -2.457 20 HG11 VAL 3 1HG1 VAL 3 2.328 -7.606 -4.213 21 HG12 VAL 3 2HG1 VAL 3 3.620 -6.783 -5.117 22 HG13 VAL 3 3HG1 VAL 3 3.939 -7.452 -3.506 23 HG21 VAL 3 3HG2 VAL 3 3.922 -3.815 -2.736 24 HG22 VAL 3 1HG2 VAL 3 4.909 -5.287 -2.851 25 HG23 VAL 3 2HG2 VAL 3 4.502 -4.442 -4.296 26 H GLU 4 H GLU 4 0.321 -4.950 -2.103 27 HA GLU 4 HA GLU 4 -1.322 -7.144 -2.807 28 HB2 GLU 4 1HB GLU 4 -0.836 -6.273 -0.508 29 HB3 GLU 4 2HB GLU 4 -1.956 -4.954 -0.837 30 HG2 GLU 4 1HG GLU 4 -3.707 -6.664 -1.293 31 HG3 GLU 4 2HG GLU 4 -2.582 -7.884 -0.566 32 H GLN 5 H GLN 5 -1.835 -3.680 -3.097 33 HA GLN 5 HA GLN 5 -4.575 -3.759 -3.878 34 HB2 GLN 5 1HB GLN 5 -2.345 -1.838 -4.603 35 HB3 GLN 5 2HB GLN 5 -4.066 -1.541 -4.922 36 HG2 GLN 5 1HG GLN 5 -4.660 -1.676 -2.626 37 HG3 GLN 5 2HG GLN 5 -3.009 -2.021 -2.159 38 HE21 GLN 5 2HE2 GLN 5 -3.684 -0.066 -0.848 39 HE22 GLN 5 1HE2 GLN 5 -3.398 1.552 -1.528 40 H CYS 6 H CYS 6 -1.601 -4.048 -5.883 41 HA CYS 6 HA CYS 6 -3.196 -4.088 -8.313 42 HB2 CYS 6 1HB CYS 6 -0.794 -3.326 -8.208 43 HB3 CYS 6 2HB CYS 6 -0.317 -4.995 -7.884 44 H CYS 7 H CYS 7 -1.600 -6.544 -6.224 45 HA CYS 7 HA CYS 7 -2.088 -8.888 -7.686 46 HB2 CYS 7 1HB CYS 7 -1.768 -8.223 -4.817 47 HB3 CYS 7 2HB CYS 7 -2.315 -9.818 -5.241 48 H THR 8 H THR 8 -4.024 -7.675 -4.959 49 HA THR 8 HA THR 8 -6.099 -9.664 -5.404 50 HB THR 8 HB THR 8 -6.586 -7.384 -3.573 51 HG1 THR 8 HG1 THR 8 -4.638 -7.460 -2.891 52 HG21 THR 8 1HG2 THR 8 -7.969 -9.316 -3.238 53 HG22 THR 8 2HG2 THR 8 -6.704 -9.451 -1.967 54 HG23 THR 8 3HG2 THR 8 -6.611 -10.453 -3.464 55 H SER 9 H SER 9 -5.727 -7.852 -7.721 56 HA SER 9 HA SER 9 -8.536 -7.004 -7.836 57 HB2 SER 9 1HB SER 9 -7.418 -5.090 -6.885 58 HB3 SER 9 2HB SER 9 -6.236 -5.017 -8.199 59 HG SER 9 HG SER 9 -7.831 -3.525 -8.570 60 H ILE 10 H ILE 10 -9.095 -6.275 -10.080 61 HA ILE 10 HA ILE 10 -7.509 -7.643 -12.183 62 HB ILE 10 HB ILE 10 -9.903 -5.729 -12.417 63 HG12 ILE 10 1HG1 ILE 10 -10.599 -7.725 -11.104 64 HG13 ILE 10 2HG1 ILE 10 -11.379 -7.635 -12.673 65 HG21 ILE 10 1HG2 ILE 10 -10.089 -7.030 -14.733 66 HG22 ILE 10 2HG2 ILE 10 -8.796 -5.803 -14.569 67 HG23 ILE 10 3HG2 ILE 10 -8.423 -7.528 -14.402 68 HD11 ILE 10 3HD1 ILE 10 -10.725 -9.939 -12.147 69 HD12 ILE 10 1HD1 ILE 10 -9.916 -9.359 -13.619 70 HD13 ILE 10 2HD1 ILE 10 -9.022 -9.445 -12.056 71 H CYS 11 H CYS 11 -5.581 -6.580 -11.684 72 HA CYS 11 HA CYS 11 -5.306 -3.720 -11.432 73 HB2 CYS 11 1HB CYS 11 -3.715 -5.693 -10.785 74 HB3 CYS 11 2HB CYS 11 -3.166 -5.506 -12.449 75 H SER 12 H SER 12 -4.945 -2.125 -12.883 76 HA SER 12 HA SER 12 -5.743 -2.679 -15.546 77 HB2 SER 12 1HB SER 12 -4.670 -0.195 -14.314 78 HB3 SER 12 2HB SER 12 -5.447 -0.292 -15.914 79 HG SER 12 HG SER 12 -6.536 -0.305 -13.334 80 H LEU 13 H LEU 13 -4.597 -1.924 -17.497 81 HA LEU 13 HA LEU 13 -2.107 -3.178 -17.740 82 HB2 LEU 13 1HB LEU 13 -3.588 -2.729 -19.569 83 HB3 LEU 13 2HB LEU 13 -3.299 -0.986 -19.439 84 HG LEU 13 HG LEU 13 -0.758 -2.313 -19.616 85 HD11 LEU 13 1HD1 LEU 13 -2.156 -4.220 -20.460 86 HD12 LEU 13 2HD1 LEU 13 -0.949 -3.597 -21.584 87 HD13 LEU 13 3HD1 LEU 13 -2.667 -3.171 -21.801 88 HD21 LEU 13 3HD2 LEU 13 -1.180 -0.055 -20.460 89 HD22 LEU 13 1HD2 LEU 13 -2.277 -0.694 -21.693 90 HD23 LEU 13 2HD2 LEU 13 -0.582 -1.114 -21.754 91 H TYR 14 H TYR 14 -2.767 0.384 -17.424 92 HA TYR 14 HA TYR 14 0.005 1.069 -17.548 93 HB2 TYR 14 1HB TYR 14 -0.739 3.303 -17.046 94 HB3 TYR 14 2HB TYR 14 -1.899 2.560 -18.186 95 HD1 TYR 14 HD2 TYR 14 -4.125 1.691 -17.262 96 HD2 TYR 14 HD1 TYR 14 -1.458 4.122 -14.934 97 HE1 TYR 14 HE2 TYR 14 -5.966 2.187 -15.775 98 HE2 TYR 14 HE1 TYR 14 -3.379 4.586 -13.340 99 HH TYR 14 HH TYR 14 -6.637 3.472 -14.079 100 H GLN 15 H GLN 15 -2.092 0.113 -14.931 101 HA GLN 15 HA GLN 15 -0.476 1.102 -12.751 102 HB2 GLN 15 1HB GLN 15 -2.480 -1.215 -12.994 103 HB3 GLN 15 2HB GLN 15 -1.748 -0.692 -11.442 104 HG2 GLN 15 1HG GLN 15 -2.727 1.577 -11.759 105 HG3 GLN 15 2HG GLN 15 -3.494 1.040 -13.218 106 HE21 GLN 15 2HE2 GLN 15 -4.413 2.072 -10.558 107 HE22 GLN 15 1HE2 GLN 15 -5.628 0.914 -10.034 108 H LEU 16 H LEU 16 -0.653 -1.974 -14.616 109 HA LEU 16 HA LEU 16 1.454 -3.347 -13.245 110 HB2 LEU 16 1HB LEU 16 0.091 -3.475 -15.925 111 HB3 LEU 16 2HB LEU 16 1.586 -4.354 -15.734 112 HG LEU 16 HG LEU 16 -0.664 -4.740 -13.773 113 HD11 LEU 16 1HD1 LEU 16 -1.589 -4.993 -16.059 114 HD12 LEU 16 2HD1 LEU 16 -1.637 -6.504 -15.130 115 HD13 LEU 16 3HD1 LEU 16 -0.391 -6.301 -16.369 116 HD21 LEU 16 3HD2 LEU 16 1.570 -5.645 -13.286 117 HD22 LEU 16 1HD2 LEU 16 1.414 -6.694 -14.735 118 HD23 LEU 16 2HD2 LEU 16 0.282 -6.869 -13.380 119 H GLU 17 H GLU 17 1.498 -1.229 -16.182 120 HA GLU 17 HA GLU 17 4.285 -1.677 -16.706 121 HB2 GLU 17 1HB GLU 17 3.920 -0.598 -18.574 122 HB3 GLU 17 2HB GLU 17 2.219 -0.585 -18.085 123 HG2 GLU 17 1HG GLU 17 2.665 1.612 -18.786 124 HG3 GLU 17 2HG GLU 17 2.716 1.677 -17.017 125 H ASN 18 H ASN 18 2.578 0.442 -14.597 126 HA ASN 18 HA ASN 18 4.628 2.420 -14.116 127 HB2 ASN 18 1HB ASN 18 2.143 1.617 -12.965 128 HB3 ASN 18 2HB ASN 18 3.259 1.464 -11.650 129 HD21 ASN 18 2HD2 ASN 18 1.165 3.506 -12.959 130 HD22 ASN 18 1HD2 ASN 18 1.883 5.013 -12.418 131 H TYR 19 H TYR 19 4.551 -0.986 -13.286 132 HA TYR 19 HA TYR 19 6.461 -0.776 -11.005 133 HB2 TYR 19 1HB TYR 19 5.385 -3.064 -12.756 134 HB3 TYR 19 2HB TYR 19 6.675 -3.283 -11.592 135 HD1 TYR 19 HD1 TYR 19 6.368 -2.789 -9.167 136 HD2 TYR 19 HD2 TYR 19 3.161 -3.197 -11.993 137 HE1 TYR 19 HE1 TYR 19 4.730 -3.267 -7.274 138 HE2 TYR 19 HE2 TYR 19 1.559 -3.739 -10.102 139 HH TYR 19 HH TYR 19 2.670 -3.856 -6.693 140 H CYS 20 H CYS 20 6.389 -1.138 -14.526 141 HA CYS 20 HA CYS 20 9.141 -2.210 -14.670 142 HB2 CYS 20 1HB CYS 20 7.129 -1.280 -16.795 143 HB3 CYS 20 2HB CYS 20 8.709 -2.081 -17.101 144 H ASN 21 H ASN 21 10.745 -1.279 -15.843 145 HA ASN 21 HA ASN 21 10.840 1.745 -15.821 146 HB2 ASN 21 1HB ASN 21 13.368 1.402 -15.591 147 HB3 ASN 21 2HB ASN 21 12.429 0.980 -14.135 148 HD21 ASN 21 2HD2 ASN 21 13.448 -0.746 -17.123 149 HD22 ASN 21 1HD2 ASN 21 14.150 -2.109 -16.270 150 H1 PHE 1 1H PHE 1 -1.294 -7.952 -22.682 151 H2 PHE 1 2H PHE 1 -1.742 -9.452 -22.971 152 H3 PHE 1 3H PHE 1 -2.871 -8.290 -23.056 153 HA PHE 1 HA PHE 1 -1.576 -9.374 -20.687 154 HB2 PHE 1 1HB PHE 1 -1.395 -6.958 -20.530 155 HB3 PHE 1 2HB PHE 1 -3.081 -6.768 -21.071 156 HD1 PHE 1 HD2 PHE 1 -1.505 -9.097 -18.467 157 HD2 PHE 1 HD1 PHE 1 -4.308 -5.845 -19.202 158 HE1 PHE 1 HE2 PHE 1 -2.253 -9.198 -16.183 159 HE2 PHE 1 HE1 PHE 1 -5.051 -5.975 -16.815 160 HZ PHE 1 HZ PHE 1 -4.069 -7.599 -15.350 161 H VAL 2 H VAL 2 -4.742 -7.819 -21.518 162 HA VAL 2 HA VAL 2 -6.890 -8.433 -21.360 163 HB VAL 2 HB VAL 2 -6.024 -11.390 -21.215 164 HG11 VAL 2 1HG1 VAL 2 -8.397 -10.915 -20.617 165 HG12 VAL 2 2HG1 VAL 2 -8.608 -9.988 -22.109 166 HG13 VAL 2 3HG1 VAL 2 -8.288 -11.731 -22.184 167 HG21 VAL 2 3HG2 VAL 2 -5.030 -10.629 -23.277 168 HG22 VAL 2 1HG2 VAL 2 -6.581 -11.286 -23.761 169 HG23 VAL 2 2HG2 VAL 2 -6.381 -9.507 -23.605 170 H ASN 3 H ASN 3 -8.338 -8.501 -19.796 171 HA ASN 3 HA ASN 3 -7.288 -7.932 -17.258 172 HB2 ASN 3 1HB ASN 3 -10.118 -8.461 -18.208 173 HB3 ASN 3 2HB ASN 3 -9.768 -8.024 -16.545 174 HD21 ASN 3 2HD2 ASN 3 -10.939 -6.069 -16.701 175 HD22 ASN 3 1HD2 ASN 3 -10.256 -4.699 -17.525 176 H GLN 4 H GLN 4 -6.869 -9.175 -15.487 177 HA GLN 4 HA GLN 4 -8.424 -11.558 -14.784 178 HB2 GLN 4 1HB GLN 4 -6.479 -13.112 -14.801 179 HB3 GLN 4 2HB GLN 4 -6.964 -12.563 -16.438 180 HG2 GLN 4 1HG GLN 4 -5.020 -10.863 -16.255 181 HG3 GLN 4 2HG GLN 4 -4.575 -11.686 -14.771 182 HE21 GLN 4 2HE2 GLN 4 -3.709 -11.462 -17.881 183 HE22 GLN 4 1HE2 GLN 4 -3.077 -13.084 -18.132 184 H HIS 5 H HIS 5 -7.547 -12.489 -12.625 185 HA HIS 5 HA HIS 5 -6.628 -10.281 -10.945 186 HB2 HIS 5 1HB HIS 5 -8.059 -12.845 -10.505 187 HB3 HIS 5 2HB HIS 5 -6.718 -12.577 -9.343 188 HD1 HIS 5 HD1 HIS 5 -10.052 -11.142 -10.451 189 HD2 HIS 5 HD2 HIS 5 -7.159 -10.553 -7.514 190 HE1 HIS 5 HE1 HIS 5 -10.946 -9.447 -8.794 191 H LEU 6 H LEU 6 -4.710 -10.468 -9.646 192 HA LEU 6 HA LEU 6 -2.666 -12.022 -11.150 193 HB2 LEU 6 1HB LEU 6 -2.363 -9.387 -9.652 194 HB3 LEU 6 2HB LEU 6 -1.143 -10.219 -10.637 195 HG LEU 6 HG LEU 6 -3.682 -8.880 -11.611 196 HD11 LEU 6 1HD1 LEU 6 -1.855 -7.409 -10.964 197 HD12 LEU 6 2HD1 LEU 6 -2.029 -7.432 -12.704 198 HD13 LEU 6 3HD1 LEU 6 -0.735 -8.337 -11.931 199 HD21 LEU 6 3HD2 LEU 6 -3.184 -10.867 -13.022 200 HD22 LEU 6 1HD2 LEU 6 -1.497 -10.394 -13.140 201 HD23 LEU 6 2HD2 LEU 6 -2.741 -9.388 -13.866 202 H CYS 7 H CYS 7 -0.626 -11.076 -9.345 203 HA CYS 7 HA CYS 7 0.668 -11.938 -7.722 204 HB2 CYS 7 1HB CYS 7 -1.890 -12.070 -6.445 205 HB3 CYS 7 2HB CYS 7 -0.959 -13.479 -5.974 206 H GLY 8 H GLY 8 1.489 -14.200 -6.938 207 HA2 GLY 8 1HA GLY 8 1.982 -16.428 -7.547 208 HA3 GLY 8 2HA GLY 8 0.388 -16.514 -8.283 209 H SER 9 H SER 9 1.202 -17.725 -10.059 210 HA SER 9 HA SER 9 3.271 -16.656 -11.782 211 HB2 SER 9 1HB SER 9 0.885 -18.315 -12.596 212 HB3 SER 9 2HB SER 9 2.506 -18.236 -13.381 213 HG SER 9 HG SER 9 2.096 -20.008 -11.811 214 H HIS 10 H HIS 10 -0.173 -15.781 -11.450 215 HA HIS 10 HA HIS 10 -0.419 -14.705 -14.159 216 HB2 HIS 10 1HB HIS 10 -1.954 -14.034 -11.681 217 HB3 HIS 10 2HB HIS 10 -2.353 -13.386 -13.294 218 HD1 HIS 10 HD1 HIS 10 -4.615 -14.683 -12.336 219 HD2 HIS 10 HD2 HIS 10 -1.519 -16.958 -13.898 220 HE1 HIS 10 HE1 HIS 10 -5.583 -16.960 -12.913 221 H LEU 11 H LEU 11 0.723 -13.231 -11.111 222 HA LEU 11 HA LEU 11 0.851 -10.548 -12.119 223 HB2 LEU 11 1HB LEU 11 1.219 -11.185 -9.728 224 HB3 LEU 11 2HB LEU 11 2.700 -11.933 -10.181 225 HG LEU 11 HG LEU 11 3.608 -9.761 -10.831 226 HD11 LEU 11 1HD1 LEU 11 1.584 -8.611 -11.581 227 HD12 LEU 11 2HD1 LEU 11 2.358 -7.650 -10.270 228 HD13 LEU 11 3HD1 LEU 11 0.912 -8.629 -9.922 229 HD21 LEU 11 3HD2 LEU 11 3.805 -10.601 -8.439 230 HD22 LEU 11 1HD2 LEU 11 2.376 -9.623 -8.027 231 HD23 LEU 11 2HD2 LEU 11 3.862 -8.826 -8.589 232 H VAL 12 H VAL 12 3.066 -13.371 -12.301 233 HA VAL 12 HA VAL 12 5.251 -11.792 -13.316 234 HB VAL 12 HB VAL 12 4.776 -14.760 -13.730 235 HG11 VAL 12 1HG1 VAL 12 7.266 -13.071 -13.877 236 HG12 VAL 12 2HG1 VAL 12 7.288 -14.836 -13.728 237 HG13 VAL 12 3HG1 VAL 12 6.534 -14.078 -15.166 238 HG21 VAL 12 3HG2 VAL 12 6.212 -13.344 -11.425 239 HG22 VAL 12 1HG2 VAL 12 4.689 -14.224 -11.301 240 HG23 VAL 12 2HG2 VAL 12 6.159 -15.097 -11.676 241 H GLU 13 H GLU 13 2.801 -13.915 -14.785 242 HA GLU 13 HA GLU 13 3.717 -13.434 -17.467 243 HB2 GLU 13 1HB GLU 13 1.047 -14.344 -16.325 244 HB3 GLU 13 2HB GLU 13 1.350 -14.130 -18.055 245 HG2 GLU 13 1HG GLU 13 3.140 -15.907 -16.364 246 HG3 GLU 13 2HG GLU 13 1.604 -16.485 -17.028 247 H ALA 14 H ALA 14 1.253 -11.812 -15.505 248 HA ALA 14 HA ALA 14 0.261 -10.079 -17.474 249 HB1 ALA 14 3HB ALA 14 -0.634 -10.208 -15.260 250 HB2 ALA 14 1HB ALA 14 0.880 -9.582 -14.543 251 HB3 ALA 14 2HB ALA 14 -0.138 -8.551 -15.595 252 H LEU 15 H LEU 15 3.128 -9.596 -15.352 253 HA LEU 15 HA LEU 15 3.725 -6.989 -16.510 254 HB2 LEU 15 1HB LEU 15 5.258 -9.030 -14.884 255 HB3 LEU 15 2HB LEU 15 5.935 -7.474 -15.364 256 HG LEU 15 HG LEU 15 3.288 -7.506 -13.928 257 HD11 LEU 15 1HD1 LEU 15 6.082 -7.807 -12.621 258 HD12 LEU 15 2HD1 LEU 15 4.635 -8.801 -12.390 259 HD13 LEU 15 3HD1 LEU 15 4.624 -7.131 -11.767 260 HD21 LEU 15 3HD2 LEU 15 4.144 -5.305 -13.185 261 HD22 LEU 15 1HD2 LEU 15 4.215 -5.415 -14.968 262 HD23 LEU 15 2HD2 LEU 15 5.698 -5.568 -14.016 263 H TYR 16 H TYR 16 4.765 -10.346 -17.281 264 HA TYR 16 HA TYR 16 6.914 -9.645 -19.042 265 HB2 TYR 16 1HB TYR 16 6.291 -11.931 -18.035 266 HB3 TYR 16 2HB TYR 16 5.044 -12.030 -19.257 267 HD1 TYR 16 HD1 TYR 16 8.693 -11.867 -18.687 268 HD2 TYR 16 HD2 TYR 16 5.571 -12.683 -21.523 269 HE1 TYR 16 HE1 TYR 16 10.368 -12.863 -20.168 270 HE2 TYR 16 HE2 TYR 16 7.235 -13.713 -23.007 271 HH TYR 16 HH TYR 16 10.741 -13.929 -22.076 272 H LEU 17 H LEU 17 3.410 -10.016 -19.443 273 HA LEU 17 HA LEU 17 3.402 -9.704 -22.290 274 HB2 LEU 17 1HB LEU 17 1.387 -9.728 -20.072 275 HB3 LEU 17 2HB LEU 17 0.916 -9.243 -21.708 276 HG LEU 17 HG LEU 17 2.243 -11.891 -21.029 277 HD11 LEU 17 1HD1 LEU 17 -0.691 -11.691 -21.500 278 HD12 LEU 17 2HD1 LEU 17 -0.008 -11.432 -19.871 279 HD13 LEU 17 3HD1 LEU 17 0.278 -12.969 -20.700 280 HD21 LEU 17 3HD2 LEU 17 2.226 -11.113 -23.477 281 HD22 LEU 17 1HD2 LEU 17 0.486 -11.236 -23.447 282 HD23 LEU 17 2HD2 LEU 17 1.478 -12.672 -23.178 283 H VAL 18 H VAL 18 2.778 -7.431 -19.585 284 HA VAL 18 HA VAL 18 1.815 -5.284 -21.337 285 HB VAL 18 HB VAL 18 2.683 -5.321 -18.394 286 HG11 VAL 18 1HG1 VAL 18 1.583 -3.046 -20.021 287 HG12 VAL 18 2HG1 VAL 18 1.555 -3.111 -18.219 288 HG13 VAL 18 3HG1 VAL 18 3.127 -3.129 -19.123 289 HG21 VAL 18 3HG2 VAL 18 -0.053 -5.082 -19.718 290 HG22 VAL 18 1HG2 VAL 18 0.534 -6.502 -18.794 291 HG23 VAL 18 2HG2 VAL 18 0.260 -4.957 -17.975 292 H CYS 19 H CYS 19 4.909 -5.949 -19.610 293 HA CYS 19 HA CYS 19 5.967 -3.447 -20.833 294 HB2 CYS 19 1HB CYS 19 7.413 -5.358 -18.961 295 HB3 CYS 19 2HB CYS 19 7.759 -3.660 -19.309 296 H GLY 20 H GLY 20 7.234 -6.860 -20.542 297 HA2 GLY 20 1HA GLY 20 8.359 -8.145 -22.191 298 HA3 GLY 20 2HA GLY 20 7.647 -7.062 -23.397 299 H GLU 21 H GLU 21 9.699 -5.667 -20.948 300 HA GLU 21 HA GLU 21 11.972 -5.573 -22.867 301 HB2 GLU 21 1HB GLU 21 10.976 -3.236 -21.170 302 HB3 GLU 21 2HB GLU 21 12.316 -3.232 -22.295 303 HG2 GLU 21 1HG GLU 21 10.761 -3.699 -24.231 304 HG3 GLU 21 2HG GLU 21 9.391 -3.548 -23.118 305 H ARG 22 H ARG 22 11.358 -7.090 -20.312 306 HA ARG 22 HA ARG 22 12.321 -7.738 -18.377 307 HB2 ARG 22 1HB ARG 22 14.905 -6.544 -19.383 308 HB3 ARG 22 2HB ARG 22 14.698 -7.817 -18.198 309 HG2 ARG 22 1HG ARG 22 13.791 -9.256 -19.968 310 HG3 ARG 22 2HG ARG 22 14.079 -7.977 -21.123 311 HD2 ARG 22 1HD ARG 22 16.100 -9.439 -19.439 312 HD3 ARG 22 2HD ARG 22 15.858 -9.668 -21.175 313 HE ARG 22 HE ARG 22 16.351 -6.866 -20.714 314 HH11 ARG 22 1HH1 ARG 22 18.118 -10.000 -20.582 315 HH12 ARG 22 2HH1 ARG 22 19.656 -9.262 -20.917 316 HH21 ARG 22 1HH2 ARG 22 18.357 -6.029 -21.187 317 HH22 ARG 22 2HH2 ARG 22 19.798 -7.049 -21.300 318 H GLY 23 H GLY 23 10.774 -5.468 -18.298 319 HA2 GLY 23 1HA GLY 23 12.191 -3.421 -16.865 320 HA3 GLY 23 2HA GLY 23 10.441 -3.464 -17.177 321 H PHE 24 H PHE 24 10.695 -6.430 -15.766 322 HA PHE 24 HA PHE 24 10.917 -5.336 -13.001 323 HB2 PHE 24 1HB PHE 24 8.955 -6.444 -12.324 324 HB3 PHE 24 2HB PHE 24 8.524 -5.758 -13.871 325 HD1 PHE 24 HD2 PHE 24 8.328 -7.281 -15.889 326 HD2 PHE 24 HD1 PHE 24 9.081 -8.838 -11.945 327 HE1 PHE 24 HE2 PHE 24 7.748 -9.539 -16.659 328 HE2 PHE 24 HE1 PHE 24 8.513 -11.100 -12.728 329 HZ PHE 24 HZ PHE 24 7.820 -11.458 -15.114 330 H PHE 25 H PHE 25 11.443 -7.104 -11.475 331 HA PHE 25 HA PHE 25 12.771 -9.453 -12.766 332 HB2 PHE 25 1HB PHE 25 14.422 -7.684 -12.238 333 HB3 PHE 25 2HB PHE 25 13.961 -7.759 -10.524 334 HD1 PHE 25 HD2 PHE 25 15.677 -9.490 -13.327 335 HD2 PHE 25 HD1 PHE 25 14.650 -9.664 -9.152 336 HE1 PHE 25 HE2 PHE 25 17.358 -11.307 -13.004 337 HE2 PHE 25 HE1 PHE 25 16.248 -11.512 -8.859 338 HZ PHE 25 HZ PHE 25 17.637 -12.338 -10.778 339 H NVA 26 H ARX 26 12.474 -11.334 -11.684 340 HA NVA 26 HA ARX 26 11.202 -11.307 -9.032 341 HB2 NVA 26 1HB ARX 26 9.668 -12.148 -10.848 342 HB3 NVA 26 2HB ARX 26 10.841 -13.351 -11.283 343 HG2 NVA 26 1HG ARX 26 10.526 -14.181 -8.834 344 HG3 NVA 26 2HG ARX 26 9.228 -13.043 -8.651 345 HD2 NVA 26 1HD ARX 26 7.764 -14.223 -9.849 346 HD3 NVA 26 2HD ARX 26 8.956 -14.745 -11.037 347 H THR 27 H THR 27 11.976 -12.705 -7.498 348 HA THR 27 HA THR 27 14.730 -13.463 -7.609 349 HB THR 27 HB THR 27 14.145 -14.454 -5.278 350 HG1 THR 27 HG1 THR 27 11.879 -14.742 -5.721 351 HG21 THR 27 1HG2 THR 27 13.527 -11.572 -5.896 352 HG22 THR 27 2HG2 THR 27 15.103 -12.260 -5.433 353 HG23 THR 27 3HG2 THR 27 13.762 -12.222 -4.267 354 HA PRO 28 HA PRO 28 14.107 -17.437 -9.153 355 HB2 PRO 28 1HB PRO 28 15.494 -19.261 -7.642 356 HB3 PRO 28 2HB PRO 28 16.259 -18.105 -8.810 357 HG2 PRO 28 1HG PRO 28 16.008 -17.924 -5.809 358 HG3 PRO 28 2HG PRO 28 17.424 -17.589 -6.897 359 HD2 PRO 28 1HD PRO 28 15.851 -15.640 -5.923 360 HD3 PRO 28 2HD PRO 28 16.596 -15.541 -7.533 361 H HIX 29 H HIX 29 12.376 -18.718 -9.166 362 HA HIX 29 HA HIX 29 10.725 -19.131 -6.731 363 HB1 HIX 29 1HB HIX 29 10.097 -19.816 -9.613 364 HB2 HIX 29 2HB HIX 29 9.031 -20.132 -8.328 365 HD2 HIX 29 HD2 HIX 29 10.153 -17.151 -10.473 366 HD1 HIX 29 HD1 HIX 29 8.174 -17.900 -6.929 367 HE1 HIX 29 HE1 HIX 29 6.966 -16.423 -8.644 368 H THR 30 H THR 30 11.401 -20.577 -5.297 369 HA THR 30 HA THR 30 12.810 -23.004 -5.996 370 HB THR 30 HB THR 30 11.071 -22.474 -3.515 371 HG1 THR 30 HG1 THR 30 12.552 -21.053 -2.961 372 HG21 THR 30 1HG2 THR 30 13.440 -24.281 -3.920 373 HG22 THR 30 2HG2 THR 30 11.769 -24.764 -3.634 374 HG23 THR 30 3HG2 THR 30 12.706 -23.949 -2.346 Start of MODEL 30 1 H1 GLY 1 1H GLY 1 1.221 -3.680 0.104 2 H2 GLY 1 2H GLY 1 1.766 -2.522 1.145 3 H3 GLY 1 3H GLY 1 0.527 -2.178 0.104 4 HA2 GLY 1 1HA GLY 1 2.515 -1.085 -0.672 5 HA3 GLY 1 2HA GLY 1 3.295 -2.735 -0.754 6 H ILE 2 H ILE 2 3.364 -1.335 -3.086 7 HA ILE 2 HA ILE 2 1.017 -1.205 -4.636 8 HB ILE 2 HB ILE 2 3.224 -0.184 -5.205 9 HG12 ILE 2 1HG1 ILE 2 1.965 -1.719 -7.435 10 HG13 ILE 2 2HG1 ILE 2 1.319 -0.226 -6.781 11 HG21 ILE 2 1HG2 ILE 2 4.952 -1.326 -6.421 12 HG22 ILE 2 2HG2 ILE 2 4.666 -2.216 -4.894 13 HG23 ILE 2 3HG2 ILE 2 4.007 -2.852 -6.422 14 HD11 ILE 2 3HD1 ILE 2 2.393 0.341 -8.814 15 HD12 ILE 2 1HD1 ILE 2 3.454 0.957 -7.468 16 HD13 ILE 2 2HD1 ILE 2 3.871 -0.561 -8.367 17 H VAL 3 H VAL 3 3.150 -4.008 -4.167 18 HA VAL 3 HA VAL 3 2.076 -5.669 -6.270 19 HB VAL 3 HB VAL 3 3.271 -6.379 -3.573 20 HG11 VAL 3 1HG1 VAL 3 2.098 -8.316 -4.482 21 HG12 VAL 3 2HG1 VAL 3 2.927 -8.074 -6.042 22 HG13 VAL 3 3HG1 VAL 3 3.823 -8.538 -4.573 23 HG21 VAL 3 3HG2 VAL 3 5.372 -6.661 -4.976 24 HG22 VAL 3 1HG2 VAL 3 4.440 -6.094 -6.369 25 HG23 VAL 3 2HG2 VAL 3 4.748 -4.988 -5.010 26 H GLU 4 H GLU 4 1.089 -5.282 -2.876 27 HA GLU 4 HA GLU 4 -0.822 -7.403 -2.895 28 HB2 GLU 4 1HB GLU 4 -0.879 -4.892 -1.197 29 HB3 GLU 4 2HB GLU 4 -1.600 -6.459 -0.839 30 HG2 GLU 4 1HG GLU 4 0.639 -7.484 -0.722 31 HG3 GLU 4 2HG GLU 4 1.404 -5.950 -1.075 32 H GLN 5 H GLN 5 -1.125 -3.885 -3.375 33 HA GLN 5 HA GLN 5 -3.931 -3.827 -3.749 34 HB2 GLN 5 1HB GLN 5 -1.734 -1.973 -4.780 35 HB3 GLN 5 2HB GLN 5 -3.438 -1.657 -5.008 36 HG2 GLN 5 1HG GLN 5 -3.529 -2.037 -2.371 37 HG3 GLN 5 2HG GLN 5 -1.819 -1.544 -2.499 38 HE21 GLN 5 2HE2 GLN 5 -1.363 0.612 -3.236 39 HE22 GLN 5 1HE2 GLN 5 -2.601 1.829 -3.294 40 H CYS 6 H CYS 6 -1.197 -4.447 -6.012 41 HA CYS 6 HA CYS 6 -2.982 -4.476 -8.317 42 HB2 CYS 6 1HB CYS 6 -0.546 -4.003 -8.313 43 HB3 CYS 6 2HB CYS 6 -0.230 -5.682 -7.906 44 H CYS 7 H CYS 7 -1.550 -7.080 -6.213 45 HA CYS 7 HA CYS 7 -2.898 -9.265 -7.522 46 HB2 CYS 7 1HB CYS 7 -2.135 -8.769 -4.699 47 HB3 CYS 7 2HB CYS 7 -3.028 -10.214 -5.163 48 H THR 8 H THR 8 -4.175 -7.241 -4.792 49 HA THR 8 HA THR 8 -6.546 -8.922 -4.771 50 HB THR 8 HB THR 8 -6.380 -6.260 -3.310 51 HG1 THR 8 HG1 THR 8 -4.335 -7.078 -3.086 52 HG21 THR 8 1HG2 THR 8 -7.167 -9.078 -2.329 53 HG22 THR 8 2HG2 THR 8 -8.360 -7.874 -2.916 54 HG23 THR 8 3HG2 THR 8 -7.331 -7.546 -1.442 55 H SER 9 H SER 9 -6.108 -7.374 -7.270 56 HA SER 9 HA SER 9 -8.839 -6.225 -7.427 57 HB2 SER 9 1HB SER 9 -7.400 -4.310 -6.485 58 HB3 SER 9 2HB SER 9 -6.342 -4.477 -7.870 59 HG SER 9 HG SER 9 -7.749 -2.890 -8.436 60 H ILE 10 H ILE 10 -9.194 -5.369 -9.741 61 HA ILE 10 HA ILE 10 -7.922 -7.232 -11.651 62 HB ILE 10 HB ILE 10 -9.814 -4.865 -12.209 63 HG12 ILE 10 1HG1 ILE 10 -10.909 -6.462 -10.805 64 HG13 ILE 10 2HG1 ILE 10 -11.638 -6.483 -12.378 65 HG21 ILE 10 1HG2 ILE 10 -10.240 -6.080 -14.412 66 HG22 ILE 10 2HG2 ILE 10 -8.506 -5.613 -14.257 67 HG23 ILE 10 3HG2 ILE 10 -9.002 -7.291 -13.966 68 HD11 ILE 10 3HD1 ILE 10 -11.463 -8.738 -11.256 69 HD12 ILE 10 1HD1 ILE 10 -10.744 -8.624 -12.932 70 HD13 ILE 10 2HD1 ILE 10 -9.683 -8.634 -11.493 71 H CYS 11 H CYS 11 -5.708 -6.548 -11.504 72 HA CYS 11 HA CYS 11 -4.925 -3.888 -11.234 73 HB2 CYS 11 1HB CYS 11 -3.598 -6.029 -10.886 74 HB3 CYS 11 2HB CYS 11 -3.138 -5.941 -12.571 75 H SER 12 H SER 12 -4.910 -2.235 -12.629 76 HA SER 12 HA SER 12 -5.888 -2.701 -15.332 77 HB2 SER 12 1HB SER 12 -4.957 -0.118 -14.033 78 HB3 SER 12 2HB SER 12 -5.901 -0.294 -15.505 79 HG SER 12 HG SER 12 -6.855 -1.635 -13.262 80 H LEU 13 H LEU 13 -4.866 -1.781 -17.297 81 HA LEU 13 HA LEU 13 -2.348 -2.832 -17.801 82 HB2 LEU 13 1HB LEU 13 -4.061 -2.012 -19.493 83 HB3 LEU 13 2HB LEU 13 -3.618 -0.394 -19.084 84 HG LEU 13 HG LEU 13 -1.383 -0.701 -20.102 85 HD11 LEU 13 1HD1 LEU 13 -2.361 -3.380 -21.068 86 HD12 LEU 13 2HD1 LEU 13 -1.190 -3.115 -19.780 87 HD13 LEU 13 3HD1 LEU 13 -0.831 -2.542 -21.433 88 HD21 LEU 13 3HD2 LEU 13 -3.209 0.244 -21.434 89 HD22 LEU 13 1HD2 LEU 13 -3.683 -1.358 -21.961 90 HD23 LEU 13 2HD2 LEU 13 -2.051 -0.708 -22.430 91 H TYR 14 H TYR 14 -3.082 0.502 -17.008 92 HA TYR 14 HA TYR 14 -0.431 1.414 -17.256 93 HB2 TYR 14 1HB TYR 14 -1.458 3.493 -16.177 94 HB3 TYR 14 2HB TYR 14 -2.068 2.950 -17.733 95 HD1 TYR 14 HD2 TYR 14 -2.801 2.850 -14.047 96 HD2 TYR 14 HD1 TYR 14 -4.435 2.580 -17.999 97 HE1 TYR 14 HE2 TYR 14 -5.131 2.874 -13.099 98 HE2 TYR 14 HE1 TYR 14 -6.761 2.561 -17.038 99 HH TYR 14 HH TYR 14 -7.255 2.846 -13.469 100 H GLN 15 H GLN 15 -2.233 -0.063 -14.676 101 HA GLN 15 HA GLN 15 -0.533 0.990 -12.578 102 HB2 GLN 15 1HB GLN 15 -2.380 -1.403 -12.649 103 HB3 GLN 15 2HB GLN 15 -1.430 -0.890 -11.191 104 HG2 GLN 15 1HG GLN 15 -2.769 1.292 -11.270 105 HG3 GLN 15 2HG GLN 15 -3.674 0.700 -12.668 106 HE21 GLN 15 2HE2 GLN 15 -3.409 0.696 -9.197 107 HE22 GLN 15 1HE2 GLN 15 -4.814 -0.357 -8.900 108 H LEU 16 H LEU 16 -0.659 -1.905 -14.742 109 HA LEU 16 HA LEU 16 1.655 -3.197 -13.591 110 HB2 LEU 16 1HB LEU 16 0.286 -3.250 -16.258 111 HB3 LEU 16 2HB LEU 16 1.705 -4.205 -15.958 112 HG LEU 16 HG LEU 16 -0.790 -4.427 -14.277 113 HD11 LEU 16 1HD1 LEU 16 -1.220 -6.394 -15.702 114 HD12 LEU 16 2HD1 LEU 16 0.160 -6.019 -16.687 115 HD13 LEU 16 3HD1 LEU 16 -1.254 -4.927 -16.650 116 HD21 LEU 16 3HD2 LEU 16 0.147 -6.663 -13.697 117 HD22 LEU 16 1HD2 LEU 16 1.274 -5.347 -13.229 118 HD23 LEU 16 2HD2 LEU 16 1.563 -6.339 -14.683 119 H GLU 17 H GLU 17 1.176 -0.904 -16.289 120 HA GLU 17 HA GLU 17 3.899 -0.821 -17.071 121 HB2 GLU 17 1HB GLU 17 1.704 1.309 -17.252 122 HB3 GLU 17 2HB GLU 17 3.294 1.581 -17.860 123 HG2 GLU 17 1HG GLU 17 1.627 -0.831 -18.791 124 HG3 GLU 17 2HG GLU 17 1.463 0.744 -19.588 125 H ASN 18 H ASN 18 2.184 0.695 -14.392 126 HA ASN 18 HA ASN 18 4.139 2.701 -13.786 127 HB2 ASN 18 1HB ASN 18 1.742 1.849 -12.720 128 HB3 ASN 18 2HB ASN 18 2.835 1.308 -11.476 129 HD21 ASN 18 2HD2 ASN 18 4.824 3.226 -11.524 130 HD22 ASN 18 1HD2 ASN 18 4.112 4.727 -11.036 131 H TYR 19 H TYR 19 4.336 -0.752 -13.389 132 HA TYR 19 HA TYR 19 6.312 -0.663 -11.222 133 HB2 TYR 19 1HB TYR 19 5.370 -2.851 -13.136 134 HB3 TYR 19 2HB TYR 19 6.704 -3.099 -12.011 135 HD1 TYR 19 HD1 TYR 19 3.074 -2.292 -12.082 136 HD2 TYR 19 HD2 TYR 19 6.437 -3.831 -9.872 137 HE1 TYR 19 HE1 TYR 19 1.495 -3.077 -10.313 138 HE2 TYR 19 HE2 TYR 19 4.953 -4.687 -8.120 139 HH TYR 19 HH TYR 19 1.341 -4.052 -8.359 140 H CYS 20 H CYS 20 6.202 -0.530 -14.712 141 HA CYS 20 HA CYS 20 8.699 -1.815 -15.110 142 HB2 CYS 20 1HB CYS 20 7.031 -0.425 -17.169 143 HB3 CYS 20 2HB CYS 20 8.352 -1.524 -17.486 144 H ASN 21 H ASN 21 10.551 -1.098 -16.254 145 HA ASN 21 HA ASN 21 11.310 1.350 -14.786 146 HB2 ASN 21 1HB ASN 21 12.989 -0.399 -16.627 147 HB3 ASN 21 2HB ASN 21 13.587 0.778 -15.440 148 HD21 ASN 21 2HD2 ASN 21 12.681 0.353 -13.160 149 HD22 ASN 21 1HD2 ASN 21 12.792 -1.317 -12.644 150 H1 PHE 1 1H PHE 1 -2.350 -9.723 -23.142 151 H2 PHE 1 2H PHE 1 -2.365 -8.051 -23.276 152 H3 PHE 1 3H PHE 1 -1.010 -8.713 -22.692 153 HA PHE 1 HA PHE 1 -2.144 -9.517 -20.689 154 HB2 PHE 1 1HB PHE 1 -1.132 -7.229 -20.789 155 HB3 PHE 1 2HB PHE 1 -2.717 -6.608 -21.302 156 HD1 PHE 1 HD2 PHE 1 -1.712 -9.050 -18.683 157 HD2 PHE 1 HD1 PHE 1 -3.712 -5.364 -19.586 158 HE1 PHE 1 HE2 PHE 1 -2.518 -8.892 -16.317 159 HE2 PHE 1 HE1 PHE 1 -4.466 -5.119 -17.236 160 HZ PHE 1 HZ PHE 1 -3.960 -6.951 -15.663 161 H VAL 2 H VAL 2 -4.046 -9.742 -19.483 162 HA VAL 2 HA VAL 2 -6.557 -9.139 -20.860 163 HB VAL 2 HB VAL 2 -5.866 -11.493 -21.339 164 HG11 VAL 2 1HG1 VAL 2 -4.744 -12.131 -19.274 165 HG12 VAL 2 2HG1 VAL 2 -6.273 -11.979 -18.382 166 HG13 VAL 2 3HG1 VAL 2 -6.076 -13.243 -19.626 167 HG21 VAL 2 3HG2 VAL 2 -8.077 -12.386 -21.121 168 HG22 VAL 2 1HG2 VAL 2 -8.395 -11.397 -19.695 169 HG23 VAL 2 2HG2 VAL 2 -8.250 -10.645 -21.283 170 H ASN 3 H ASN 3 -8.314 -8.767 -19.299 171 HA ASN 3 HA ASN 3 -7.299 -7.773 -16.732 172 HB2 ASN 3 1HB ASN 3 -9.491 -6.871 -16.477 173 HB3 ASN 3 2HB ASN 3 -8.822 -6.411 -18.027 174 HD21 ASN 3 2HD2 ASN 3 -11.644 -7.127 -16.670 175 HD22 ASN 3 1HD2 ASN 3 -12.485 -7.994 -17.954 176 H GLN 4 H GLN 4 -6.926 -9.104 -15.172 177 HA GLN 4 HA GLN 4 -9.293 -10.469 -14.014 178 HB2 GLN 4 1HB GLN 4 -7.962 -12.027 -15.719 179 HB3 GLN 4 2HB GLN 4 -6.800 -12.120 -14.405 180 HG2 GLN 4 1HG GLN 4 -7.978 -13.831 -13.738 181 HG3 GLN 4 2HG GLN 4 -9.111 -12.650 -13.082 182 HE21 GLN 4 2HE2 GLN 4 -9.100 -15.520 -14.456 183 HE22 GLN 4 1HE2 GLN 4 -10.530 -15.344 -15.483 184 H HIS 5 H HIS 5 -8.518 -11.466 -11.815 185 HA HIS 5 HA HIS 5 -6.741 -9.644 -10.377 186 HB2 HIS 5 1HB HIS 5 -8.209 -12.145 -9.658 187 HB3 HIS 5 2HB HIS 5 -6.924 -11.522 -8.628 188 HD1 HIS 5 HD1 HIS 5 -10.151 -10.043 -10.152 189 HD2 HIS 5 HD2 HIS 5 -7.843 -9.946 -6.686 190 HE1 HIS 5 HE1 HIS 5 -11.356 -8.548 -8.479 191 H LEU 6 H LEU 6 -4.559 -10.209 -9.649 192 HA LEU 6 HA LEU 6 -3.311 -12.185 -11.596 193 HB2 LEU 6 1HB LEU 6 -2.955 -9.382 -10.827 194 HB3 LEU 6 2HB LEU 6 -1.454 -10.313 -10.745 195 HG LEU 6 HG LEU 6 -1.209 -10.438 -12.958 196 HD11 LEU 6 1HD1 LEU 6 -3.310 -11.752 -13.474 197 HD12 LEU 6 2HD1 LEU 6 -3.012 -10.491 -14.655 198 HD13 LEU 6 3HD1 LEU 6 -4.249 -10.265 -13.391 199 HD21 LEU 6 3HD2 LEU 6 -1.588 -8.078 -12.213 200 HD22 LEU 6 1HD2 LEU 6 -3.220 -8.195 -12.879 201 HD23 LEU 6 2HD2 LEU 6 -1.812 -8.346 -13.939 202 H CYS 7 H CYS 7 -3.653 -12.094 -8.231 203 HA CYS 7 HA CYS 7 -0.892 -12.789 -7.590 204 HB2 CYS 7 1HB CYS 7 -3.318 -12.245 -6.112 205 HB3 CYS 7 2HB CYS 7 -2.695 -13.878 -5.611 206 H GLY 8 H GLY 8 -0.146 -14.910 -6.891 207 HA2 GLY 8 1HA GLY 8 -0.170 -17.284 -7.115 208 HA3 GLY 8 2HA GLY 8 -1.783 -17.183 -7.827 209 H SER 9 H SER 9 1.415 -15.794 -8.582 210 HA SER 9 HA SER 9 2.830 -15.842 -10.266 211 HB2 SER 9 1HB SER 9 1.461 -18.431 -11.003 212 HB3 SER 9 2HB SER 9 2.959 -17.865 -11.722 213 HG SER 9 HG SER 9 3.390 -19.199 -9.911 214 H HIS 10 H HIS 10 -0.504 -15.629 -11.291 215 HA HIS 10 HA HIS 10 0.056 -15.071 -14.077 216 HB2 HIS 10 1HB HIS 10 -2.110 -14.019 -12.279 217 HB3 HIS 10 2HB HIS 10 -2.022 -13.825 -14.041 218 HD1 HIS 10 HD1 HIS 10 -3.377 -16.197 -11.585 219 HD2 HIS 10 HD2 HIS 10 -2.119 -16.312 -15.543 220 HE1 HIS 10 HE1 HIS 10 -4.382 -18.263 -12.614 221 H LEU 11 H LEU 11 0.772 -13.277 -11.250 222 HA LEU 11 HA LEU 11 0.811 -10.688 -12.294 223 HB2 LEU 11 1HB LEU 11 0.956 -11.450 -9.895 224 HB3 LEU 11 2HB LEU 11 2.607 -11.914 -10.207 225 HG LEU 11 HG LEU 11 3.324 -9.605 -10.720 226 HD11 LEU 11 1HD1 LEU 11 0.415 -9.018 -9.961 227 HD12 LEU 11 2HD1 LEU 11 1.235 -8.611 -11.478 228 HD13 LEU 11 3HD1 LEU 11 1.724 -7.788 -10.004 229 HD21 LEU 11 3HD2 LEU 11 3.466 -10.598 -8.419 230 HD22 LEU 11 1HD2 LEU 11 1.859 -9.927 -8.043 231 HD23 LEU 11 2HD2 LEU 11 3.231 -8.849 -8.393 232 H VAL 12 H VAL 12 3.116 -13.318 -12.414 233 HA VAL 12 HA VAL 12 5.316 -11.774 -13.352 234 HB VAL 12 HB VAL 12 4.763 -14.775 -13.682 235 HG11 VAL 12 1HG1 VAL 12 7.310 -14.889 -13.880 236 HG12 VAL 12 2HG1 VAL 12 6.712 -13.791 -15.105 237 HG13 VAL 12 3HG1 VAL 12 7.460 -13.186 -13.639 238 HG21 VAL 12 3HG2 VAL 12 6.040 -13.304 -11.359 239 HG22 VAL 12 1HG2 VAL 12 4.615 -14.351 -11.354 240 HG23 VAL 12 2HG2 VAL 12 6.190 -15.035 -11.678 241 H GLU 13 H GLU 13 2.717 -13.797 -14.691 242 HA GLU 13 HA GLU 13 3.554 -13.716 -17.403 243 HB2 GLU 13 1HB GLU 13 0.721 -13.958 -16.364 244 HB3 GLU 13 2HB GLU 13 1.259 -14.319 -17.992 245 HG2 GLU 13 1HG GLU 13 2.717 -16.159 -17.152 246 HG3 GLU 13 2HG GLU 13 2.144 -15.838 -15.512 247 H ALA 14 H ALA 14 1.307 -11.581 -15.505 248 HA ALA 14 HA ALA 14 0.422 -10.009 -17.660 249 HB1 ALA 14 3HB ALA 14 -0.718 -9.942 -15.570 250 HB2 ALA 14 1HB ALA 14 0.700 -9.394 -14.675 251 HB3 ALA 14 2HB ALA 14 -0.157 -8.326 -15.854 252 H LEU 15 H LEU 15 3.124 -9.401 -15.400 253 HA LEU 15 HA LEU 15 3.905 -6.992 -16.778 254 HB2 LEU 15 1HB LEU 15 5.298 -8.721 -14.795 255 HB3 LEU 15 2HB LEU 15 6.031 -7.262 -15.492 256 HG LEU 15 HG LEU 15 3.391 -7.171 -14.099 257 HD11 LEU 15 1HD1 LEU 15 4.855 -8.232 -12.559 258 HD12 LEU 15 2HD1 LEU 15 4.676 -6.560 -12.057 259 HD13 LEU 15 3HD1 LEU 15 6.145 -7.059 -12.891 260 HD21 LEU 15 3HD2 LEU 15 4.191 -4.875 -13.561 261 HD22 LEU 15 1HD2 LEU 15 3.771 -5.176 -15.234 262 HD23 LEU 15 2HD2 LEU 15 5.496 -5.141 -14.704 263 H TYR 16 H TYR 16 4.873 -10.435 -17.267 264 HA TYR 16 HA TYR 16 7.049 -9.836 -18.976 265 HB2 TYR 16 1HB TYR 16 6.591 -12.123 -17.944 266 HB3 TYR 16 2HB TYR 16 5.233 -12.249 -19.124 267 HD1 TYR 16 HD2 TYR 16 8.899 -11.342 -19.167 268 HD2 TYR 16 HD1 TYR 16 5.655 -13.408 -21.142 269 HE1 TYR 16 HE2 TYR 16 10.420 -12.017 -20.968 270 HE2 TYR 16 HE1 TYR 16 7.151 -14.187 -22.929 271 HH TYR 16 HH TYR 16 9.301 -14.052 -23.758 272 H LEU 17 H LEU 17 3.604 -10.148 -19.399 273 HA LEU 17 HA LEU 17 3.752 -10.029 -22.299 274 HB2 LEU 17 1HB LEU 17 1.441 -9.868 -20.351 275 HB3 LEU 17 2HB LEU 17 1.269 -9.700 -22.091 276 HG LEU 17 HG LEU 17 2.519 -12.116 -20.842 277 HD11 LEU 17 1HD1 LEU 17 0.215 -11.901 -19.996 278 HD12 LEU 17 2HD1 LEU 17 0.326 -13.246 -21.149 279 HD13 LEU 17 3HD1 LEU 17 -0.401 -11.717 -21.677 280 HD21 LEU 17 3HD2 LEU 17 1.417 -11.587 -23.598 281 HD22 LEU 17 1HD2 LEU 17 1.862 -13.196 -22.976 282 HD23 LEU 17 2HD2 LEU 17 3.118 -11.953 -23.158 283 H VAL 18 H VAL 18 3.088 -7.579 -19.772 284 HA VAL 18 HA VAL 18 2.428 -5.591 -21.734 285 HB VAL 18 HB VAL 18 2.753 -5.474 -18.639 286 HG11 VAL 18 1HG1 VAL 18 3.217 -3.221 -19.328 287 HG12 VAL 18 2HG1 VAL 18 1.916 -3.252 -20.559 288 HG13 VAL 18 3HG1 VAL 18 1.512 -3.283 -18.807 289 HG21 VAL 18 3HG2 VAL 18 0.219 -5.177 -18.743 290 HG22 VAL 18 1HG2 VAL 18 0.331 -5.319 -20.501 291 HG23 VAL 18 2HG2 VAL 18 0.771 -6.679 -19.517 292 H CYS 19 H CYS 19 5.167 -6.404 -19.567 293 HA CYS 19 HA CYS 19 6.681 -4.344 -21.161 294 HB2 CYS 19 1HB CYS 19 7.215 -5.028 -18.254 295 HB3 CYS 19 2HB CYS 19 8.034 -3.824 -19.232 296 H GLY 20 H GLY 20 6.837 -7.685 -20.146 297 HA2 GLY 20 1HA GLY 20 8.377 -9.197 -20.969 298 HA3 GLY 20 2HA GLY 20 8.805 -7.946 -22.147 299 H GLU 21 H GLU 21 9.421 -8.756 -18.686 300 HA GLU 21 HA GLU 21 11.289 -8.710 -17.403 301 HB2 GLU 21 1HB GLU 21 12.158 -10.270 -18.979 302 HB3 GLU 21 2HB GLU 21 12.812 -9.019 -20.046 303 HG2 GLU 21 1HG GLU 21 13.621 -9.265 -17.205 304 HG3 GLU 21 2HG GLU 21 14.327 -10.271 -18.440 305 H ARG 22 H ARG 22 10.996 -6.162 -19.689 306 HA ARG 22 HA ARG 22 12.885 -4.432 -18.389 307 HB2 ARG 22 1HB ARG 22 10.481 -3.671 -20.073 308 HB3 ARG 22 2HB ARG 22 11.871 -2.643 -19.798 309 HG2 ARG 22 1HG ARG 22 13.295 -4.159 -21.064 310 HG3 ARG 22 2HG ARG 22 11.941 -5.235 -21.367 311 HD2 ARG 22 1HD ARG 22 11.903 -2.333 -22.224 312 HD3 ARG 22 2HD ARG 22 12.517 -3.677 -23.198 313 HE ARG 22 HE ARG 22 10.146 -4.675 -22.428 314 HH11 ARG 22 1HH1 ARG 22 10.950 -1.641 -24.015 315 HH12 ARG 22 2HH1 ARG 22 9.376 -1.493 -24.713 316 HH21 ARG 22 1HH2 ARG 22 8.149 -4.412 -23.333 317 HH22 ARG 22 2HH2 ARG 22 7.773 -3.040 -24.347 318 H GLY 23 H GLY 23 10.963 -5.746 -16.440 319 HA2 GLY 23 1HA GLY 23 10.082 -3.285 -15.176 320 HA3 GLY 23 2HA GLY 23 8.680 -4.075 -15.909 321 H PHE 24 H PHE 24 11.008 -6.292 -14.804 322 HA PHE 24 HA PHE 24 10.300 -6.256 -12.036 323 HB2 PHE 24 1HB PHE 24 9.106 -8.385 -11.993 324 HB3 PHE 24 2HB PHE 24 8.197 -7.214 -12.879 325 HD1 PHE 24 HD1 PHE 24 8.249 -7.319 -15.424 326 HD2 PHE 24 HD2 PHE 24 9.818 -10.495 -12.995 327 HE1 PHE 24 HE1 PHE 24 8.114 -8.882 -17.386 328 HE2 PHE 24 HE2 PHE 24 9.587 -12.024 -14.880 329 HZ PHE 24 HZ PHE 24 8.775 -11.243 -17.080 330 H PHE 25 H PHE 25 11.353 -8.248 -10.976 331 HA PHE 25 HA PHE 25 13.550 -9.255 -12.719 332 HB2 PHE 25 1HB PHE 25 14.275 -7.399 -11.121 333 HB3 PHE 25 2HB PHE 25 13.904 -8.496 -9.830 334 HD1 PHE 25 HD1 PHE 25 15.125 -10.902 -9.955 335 HD2 PHE 25 HD2 PHE 25 16.410 -7.374 -12.191 336 HE1 PHE 25 HE1 PHE 25 17.338 -11.876 -10.241 337 HE2 PHE 25 HE2 PHE 25 18.618 -8.440 -12.521 338 HZ PHE 25 HZ PHE 25 19.150 -10.647 -11.519 339 H NVA 26 H ARX 26 12.967 -11.160 -13.049 340 HA NVA 26 HA ARX 26 12.099 -12.924 -10.741 341 HB2 NVA 26 1HB ARX 26 10.286 -12.809 -12.450 342 HB3 NVA 26 2HB ARX 26 11.404 -13.169 -13.751 343 HG2 NVA 26 1HG ARX 26 10.297 -15.198 -13.379 344 HG3 NVA 26 2HG ARX 26 11.801 -15.398 -12.619 345 HD2 NVA 26 1HD ARX 26 10.549 -14.568 -10.451 346 HD3 NVA 26 2HD ARX 26 9.116 -15.079 -11.279 347 H THR 27 H THR 27 13.525 -14.150 -10.037 348 HA THR 27 HA THR 27 16.109 -14.628 -11.254 349 HB THR 27 HB THR 27 16.237 -16.248 -9.193 350 HG1 THR 27 HG1 THR 27 13.842 -16.422 -9.100 351 HG21 THR 27 1HG2 THR 27 16.193 -14.301 -7.582 352 HG22 THR 27 2HG2 THR 27 15.517 -13.313 -8.880 353 HG23 THR 27 3HG2 THR 27 17.126 -13.990 -9.062 354 HA PRO 28 HA PRO 28 15.085 -18.370 -13.185 355 HB2 PRO 28 1HB PRO 28 17.126 -20.117 -12.691 356 HB3 PRO 28 2HB PRO 28 17.275 -18.664 -13.740 357 HG2 PRO 28 1HG PRO 28 18.062 -19.105 -10.894 358 HG3 PRO 28 2HG PRO 28 19.023 -18.445 -12.222 359 HD2 PRO 28 1HD PRO 28 17.787 -16.838 -10.500 360 HD3 PRO 28 2HD PRO 28 17.949 -16.452 -12.230 361 H HIX 29 H HIX 29 13.419 -19.291 -12.548 362 HA HIX 29 HA HIX 29 13.103 -20.371 -9.881 363 HB1 HIX 29 1HB HIX 29 11.167 -20.318 -12.230 364 HB2 HIX 29 2HB HIX 29 10.725 -20.765 -10.609 365 HD2 HIX 29 HD2 HIX 29 10.408 -17.823 -12.685 366 HD1 HIX 29 HD1 HIX 29 11.745 -18.559 -8.794 367 HE1 HIX 29 HE1 HIX 29 9.715 -16.997 -9.010 368 H THR 30 H THR 30 13.608 -22.216 -9.215 369 HA THR 30 HA THR 30 13.658 -24.591 -11.109 370 HB THR 30 HB THR 30 15.456 -25.473 -9.665 371 HG1 THR 30 HG1 THR 30 15.048 -24.106 -7.931 372 HG21 THR 30 1HG2 THR 30 16.105 -22.883 -11.009 373 HG22 THR 30 2HG2 THR 30 15.848 -24.475 -11.786 374 HG23 THR 30 3HG2 THR 30 17.201 -24.219 -10.674
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