NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
20791 | 2gj0 | 7064 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLY 1 H GLY 1 3.392 2.886 3.158 2 1HA GLY 1 2HA GLY 1 3.049 4.662 1.655 3 2HA GLY 1 1HA GLY 1 4.536 5.401 2.224 4 H SER 2 H SER 2 5.827 2.626 1.861 5 HA SER 2 HA SER 2 6.669 3.125 -0.863 6 1HB SER 2 2HB SER 2 7.599 1.055 1.137 7 2HB SER 2 1HB SER 2 8.369 1.402 -0.411 8 HG SER 2 HG SER 2 8.082 3.171 1.793 9 H ILE 3 H ILE 3 5.681 2.268 -2.531 10 HA ILE 3 HA ILE 3 3.786 0.162 -2.314 11 HB ILE 3 HB ILE 3 4.919 1.650 -4.670 12 1HG1 ILE 3 2HG1 ILE 3 2.496 2.318 -4.905 13 2HG1 ILE 3 1HG1 ILE 3 2.195 1.515 -3.370 14 1HG2 ILE 3 1HG2 ILE 3 2.670 0.164 -5.512 15 2HG2 ILE 3 2HG2 ILE 3 3.796 -0.964 -4.757 16 3HG2 ILE 3 3HG2 ILE 3 4.333 0.057 -6.091 17 1HD1 ILE 3 1HD1 ILE 3 2.933 4.158 -3.776 18 2HD1 ILE 3 2HD1 ILE 3 4.380 3.373 -3.143 19 3HD1 ILE 3 3HD1 ILE 3 2.865 3.291 -2.241 20 HA PRO 4 HA PRO 4 6.993 -2.467 -4.899 21 1HB PRO 4 2HB PRO 4 9.614 -1.676 -4.617 22 2HB PRO 4 1HB PRO 4 8.584 -1.262 -5.991 23 1HG PRO 4 2HG PRO 4 9.248 0.357 -3.565 24 2HG PRO 4 1HG PRO 4 9.144 0.869 -5.261 25 1HD PRO 4 2HD PRO 4 7.163 1.373 -3.536 26 2HD PRO 4 1HD PRO 4 6.825 0.943 -5.225 27 H ALA 5 H ALA 5 7.803 -1.030 -1.820 28 HA ALA 5 HA ALA 5 9.442 -3.116 -0.852 29 1HB ALA 5 1HB ALA 5 9.458 -2.002 1.162 30 2HB ALA 5 2HB ALA 5 7.794 -1.440 0.988 31 3HB ALA 5 3HB ALA 5 9.080 -0.697 0.037 32 H CYS 6 H CYS 6 5.965 -2.470 -0.461 33 HA CYS 6 HA CYS 6 5.616 -4.880 1.081 34 1HB CYS 6 2HB CYS 6 4.275 -2.787 1.451 35 2HB CYS 6 1HB CYS 6 3.450 -3.123 -0.068 36 H GLY 7 H GLY 7 4.437 -3.745 -2.092 37 1HA GLY 7 2HA GLY 7 3.864 -4.909 -3.987 38 2HA GLY 7 1HA GLY 7 4.792 -6.258 -3.347 39 H GLU 8 H GLU 8 2.133 -4.868 -1.577 40 HA GLU 8 HA GLU 8 0.644 -7.371 -1.933 41 1HB GLU 8 2HB GLU 8 1.400 -6.118 0.370 42 2HB GLU 8 1HB GLU 8 -0.226 -5.483 0.157 43 1HG GLU 8 2HG GLU 8 0.318 -8.416 -0.015 44 2HG GLU 8 1HG GLU 8 0.100 -7.616 1.534 45 H SER 9 H SER 9 -1.725 -7.223 -2.111 46 HA SER 9 HA SER 9 -2.564 -4.679 -3.360 47 1HB SER 9 2HB SER 9 -3.364 -7.458 -4.254 48 2HB SER 9 1HB SER 9 -3.845 -5.936 -5.006 49 HG SER 9 HG SER 9 -1.118 -6.369 -4.692 50 H CYS 10 H CYS 10 -4.283 -3.777 -2.467 51 HA CYS 10 HA CYS 10 -5.872 -5.344 -0.596 52 1HB CYS 10 2HB CYS 10 -6.803 -3.032 -0.007 53 2HB CYS 10 1HB CYS 10 -5.137 -3.375 0.431 54 H PHE 11 H PHE 11 -8.000 -5.663 -0.765 55 HA PHE 11 HA PHE 11 -9.582 -4.413 -2.828 56 1HB PHE 11 2HB PHE 11 -10.305 -6.847 -3.558 57 2HB PHE 11 1HB PHE 11 -8.911 -6.069 -4.294 58 HD1 PHE 11 1HD PHE 11 -9.505 -8.061 -1.169 59 HD2 PHE 11 2HD PHE 11 -7.193 -7.506 -4.699 60 HE1 PHE 11 1HE PHE 11 -8.090 -9.971 -0.538 61 HE2 PHE 11 2HE PHE 11 -5.776 -9.415 -4.074 62 HZ PHE 11 HZ PHE 11 -6.223 -10.650 -1.991 63 H LYS 12 H LYS 12 -11.064 -7.272 -2.250 64 HA LYS 12 HA LYS 12 -12.799 -6.125 -0.247 65 1HB LYS 12 2HB LYS 12 -12.817 -8.819 -1.623 66 2HB LYS 12 1HB LYS 12 -14.037 -8.295 -0.472 67 1HG LYS 12 2HG LYS 12 -14.631 -6.437 -1.952 68 2HG LYS 12 1HG LYS 12 -13.416 -6.982 -3.111 69 1HD LYS 12 2HD LYS 12 -14.598 -9.087 -3.394 70 2HD LYS 12 1HD LYS 12 -15.786 -8.603 -2.181 71 1HE LYS 12 2HE LYS 12 -15.280 -7.189 -4.798 72 2HE LYS 12 1HE LYS 12 -16.612 -8.299 -4.481 73 1HZ LYS 12 1HZ LYS 12 -16.132 -5.679 -3.168 74 2HZ LYS 12 2HZ LYS 12 -17.339 -6.767 -2.702 75 3HZ LYS 12 3HZ LYS 12 -17.384 -6.064 -4.239 76 H GLY 13 H GLY 13 -10.394 -6.219 0.853 77 1HA GLY 13 2HA GLY 13 -10.725 -7.687 3.218 78 2HA GLY 13 1HA GLY 13 -9.612 -8.564 2.174 79 H LYS 14 H LYS 14 -8.979 -7.373 4.705 80 HA LYS 14 HA LYS 14 -7.642 -4.902 4.370 81 1HB LYS 14 2HB LYS 14 -6.619 -5.553 6.587 82 2HB LYS 14 1HB LYS 14 -8.379 -5.547 6.549 83 1HG LYS 14 2HG LYS 14 -7.932 -7.512 7.663 84 2HG LYS 14 1HG LYS 14 -8.112 -8.081 6.003 85 1HD LYS 14 2HD LYS 14 -5.506 -7.549 5.983 86 2HD LYS 14 1HD LYS 14 -5.718 -7.878 7.686 87 1HE LYS 14 2HE LYS 14 -5.180 -9.966 6.853 88 2HE LYS 14 1HE LYS 14 -6.943 -10.012 6.882 89 1HZ LYS 14 1HZ LYS 14 -6.051 -8.933 4.423 90 2HZ LYS 14 2HZ LYS 14 -6.965 -10.334 4.699 91 3HZ LYS 14 3HZ LYS 14 -5.277 -10.413 4.701 92 H CYS 15 H CYS 15 -5.262 -4.658 4.687 93 HA CYS 15 HA CYS 15 -3.799 -5.938 2.691 94 1HB CYS 15 2HB CYS 15 -2.749 -4.527 5.152 95 2HB CYS 15 1HB CYS 15 -1.819 -4.886 3.701 96 H TYR 16 H TYR 16 -2.504 -7.689 2.619 97 HA TYR 16 HA TYR 16 -2.762 -9.598 4.762 98 1HB TYR 16 2HB TYR 16 -1.371 -9.711 2.083 99 2HB TYR 16 1HB TYR 16 -1.358 -11.047 3.231 100 HD1 TYR 16 1HD TYR 16 -3.936 -8.737 1.773 101 HD2 TYR 16 2HD TYR 16 -2.838 -12.730 2.748 102 HE1 TYR 16 1HE TYR 16 -6.082 -9.538 0.883 103 HE2 TYR 16 2HE TYR 16 -4.980 -13.541 1.857 104 HH TYR 16 HH TYR 16 -6.840 -12.013 -0.136 105 H THR 17 H THR 17 -0.131 -7.744 3.286 106 HA THR 17 HA THR 17 1.817 -8.821 5.063 107 HB THR 17 HB THR 17 2.076 -6.364 3.327 108 HG1 THR 17 1HG THR 17 2.536 -7.699 1.685 109 1HG2 THR 17 1HG2 THR 17 4.133 -6.235 4.183 110 2HG2 THR 17 2HG2 THR 17 4.479 -7.839 3.535 111 3HG2 THR 17 3HG2 THR 17 3.841 -7.666 5.169 112 HA PRO 18 HA PRO 18 0.647 -6.272 8.540 113 1HB PRO 18 2HB PRO 18 2.989 -6.834 9.937 114 2HB PRO 18 1HB PRO 18 1.496 -7.772 10.010 115 1HG PRO 18 2HG PRO 18 3.975 -8.270 8.427 116 2HG PRO 18 1HG PRO 18 2.900 -9.431 9.227 117 1HD PRO 18 2HD PRO 18 2.840 -9.060 6.571 118 2HD PRO 18 1HD PRO 18 1.360 -9.387 7.496 119 H GLY 19 H GLY 19 0.930 -4.184 8.838 120 1HA GLY 19 2HA GLY 19 2.213 -2.242 9.246 121 2HA GLY 19 1HA GLY 19 3.569 -2.994 8.424 122 H CYS 20 H CYS 20 1.349 -3.747 6.291 123 HA CYS 20 HA CYS 20 1.886 -1.342 4.742 124 1HB CYS 20 2HB CYS 20 0.476 -3.867 3.881 125 2HB CYS 20 1HB CYS 20 1.043 -2.570 2.835 126 H SER 21 H SER 21 0.351 -0.028 3.835 127 HA SER 21 HA SER 21 -2.388 -0.336 4.870 128 1HB SER 21 2HB SER 21 -0.909 2.277 4.472 129 2HB SER 21 1HB SER 21 -2.519 2.071 5.162 130 HG SER 21 HG SER 21 -0.750 0.532 6.474 131 H CYS 22 H CYS 22 -4.033 0.088 3.449 132 HA CYS 22 HA CYS 22 -3.404 0.005 0.654 133 1HB CYS 22 2HB CYS 22 -5.332 -1.203 1.671 134 2HB CYS 22 1HB CYS 22 -6.093 0.345 2.007 135 H SER 23 H SER 23 -2.225 2.237 1.423 136 HA SER 23 HA SER 23 -3.976 4.525 1.066 137 1HB SER 23 2HB SER 23 -0.963 4.481 1.374 138 2HB SER 23 1HB SER 23 -2.049 5.848 1.640 139 HG SER 23 HG SER 23 -2.770 4.940 3.483 140 H LYS 24 H LYS 24 -3.025 2.422 -1.050 141 HA LYS 24 HA LYS 24 -2.781 4.343 -3.216 142 1HB LYS 24 2HB LYS 24 -0.708 2.208 -2.678 143 2HB LYS 24 1HB LYS 24 -0.866 3.039 -4.217 144 1HG LYS 24 2HG LYS 24 -0.301 4.411 -1.597 145 2HG LYS 24 1HG LYS 24 0.931 3.930 -2.765 146 1HD LYS 24 2HD LYS 24 0.040 5.415 -4.418 147 2HD LYS 24 1HD LYS 24 -1.372 5.763 -3.417 148 1HE LYS 24 2HE LYS 24 0.235 7.594 -3.329 149 2HE LYS 24 1HE LYS 24 0.066 6.826 -1.752 150 1HZ LYS 24 1HZ LYS 24 2.209 5.973 -3.580 151 2HZ LYS 24 2HZ LYS 24 2.148 5.883 -1.892 152 3HZ LYS 24 3HZ LYS 24 2.404 7.373 -2.651 153 H TYR 25 H TYR 25 -5.007 3.247 -3.106 154 HA TYR 25 HA TYR 25 -5.532 0.622 -3.703 155 1HB TYR 25 2HB TYR 25 -6.975 3.106 -4.635 156 2HB TYR 25 1HB TYR 25 -7.594 1.480 -4.893 157 HD1 TYR 25 1HD TYR 25 -8.917 0.472 -3.277 158 HD2 TYR 25 2HD TYR 25 -6.512 3.807 -2.187 159 HE1 TYR 25 1HE TYR 25 -10.002 0.525 -1.074 160 HE2 TYR 25 2HE TYR 25 -7.589 3.867 0.021 161 HH TYR 25 HH TYR 25 -9.910 1.398 1.004 162 HA PRO 26 HA PRO 26 -6.366 -0.769 -4.548 163 1HB PRO 26 2HB PRO 26 -6.456 -2.947 -6.094 164 2HB PRO 26 1HB PRO 26 -7.482 -1.547 -6.420 165 1HG PRO 26 2HG PRO 26 -5.128 -2.528 -7.898 166 2HG PRO 26 1HG PRO 26 -6.449 -1.490 -8.453 167 1HD PRO 26 2HD PRO 26 -3.811 -0.723 -7.523 168 2HD PRO 26 1HD PRO 26 -5.084 0.304 -8.214 169 H LEU 27 H LEU 27 -3.598 -0.326 -4.040 170 HA LEU 27 HA LEU 27 -2.835 -3.051 -3.330 171 1HB LEU 27 2HB LEU 27 -0.542 -2.748 -4.045 172 2HB LEU 27 1HB LEU 27 -1.640 -2.560 -5.397 173 HG LEU 27 HG LEU 27 -1.399 0.006 -4.721 174 1HD1 LEU 27 1HD1 LEU 27 1.413 -0.785 -4.266 175 2HD1 LEU 27 2HD1 LEU 27 0.296 -0.952 -2.910 176 3HD1 LEU 27 3HD1 LEU 27 0.517 0.618 -3.683 177 1HD2 LEU 27 1HD2 LEU 27 0.050 0.251 -6.561 178 2HD2 LEU 27 2HD2 LEU 27 -0.902 -1.194 -6.899 179 3HD2 LEU 27 3HD2 LEU 27 0.756 -1.346 -6.318 180 H CYS 28 H CYS 28 -1.473 -3.253 -1.546 181 HA CYS 28 HA CYS 28 -1.680 -1.019 0.304 182 1HB CYS 28 2HB CYS 28 -0.882 -3.907 0.695 183 2HB CYS 28 1HB CYS 28 -0.887 -2.709 1.985 184 H ALA 29 H ALA 29 -0.063 0.288 0.744 185 HA ALA 29 HA ALA 29 2.612 -0.362 -0.239 186 1HB ALA 29 1HB ALA 29 1.710 1.778 -0.934 187 2HB ALA 29 2HB ALA 29 3.082 2.030 0.145 188 3HB ALA 29 3HB ALA 29 1.438 2.238 0.748 189 H LYS 30 H LYS 30 4.372 -0.547 1.096 190 HA LYS 30 HA LYS 30 3.796 -0.913 3.925 191 1HB LYS 30 2HB LYS 30 5.166 -2.583 2.669 192 2HB LYS 30 1HB LYS 30 6.391 -1.346 2.423 193 1HG LYS 30 2HG LYS 30 6.828 -2.977 4.287 194 2HG LYS 30 1HG LYS 30 6.916 -1.269 4.724 195 1HD LYS 30 2HD LYS 30 4.756 -1.345 5.742 196 2HD LYS 30 1HD LYS 30 4.458 -2.968 5.118 197 1HE LYS 30 2HE LYS 30 6.752 -2.386 6.961 198 2HE LYS 30 1HE LYS 30 5.135 -2.720 7.579 199 1HZ LYS 30 1HZ LYS 30 6.220 -4.586 5.619 200 2HZ LYS 30 2HZ LYS 30 5.241 -4.879 6.970 201 3HZ LYS 30 3HZ LYS 30 6.903 -4.618 7.167 202 H ASN 31 H ASN 31 3.674 0.949 4.972 203 HA ASN 31 HA ASN 31 4.194 2.977 5.828 204 1HB ASN 31 2HB ASN 31 7.007 2.054 5.187 205 2HB ASN 31 1HB ASN 31 6.637 3.498 6.121 206 1HD2 ASN 31 1HD2 ASN 31 6.736 3.237 8.218 207 2HD2 ASN 31 2HD2 ASN 31 6.448 1.772 9.084 Start of MODEL 2 1 H GLY 1 H GLY 1 3.249 3.035 2.906 2 1HA GLY 1 2HA GLY 1 3.044 4.889 1.424 3 2HA GLY 1 1HA GLY 1 4.645 5.415 1.910 4 H SER 2 H SER 2 5.884 2.791 1.545 5 HA SER 2 HA SER 2 6.289 3.000 -1.315 6 1HB SER 2 2HB SER 2 8.205 2.791 0.244 7 2HB SER 2 1HB SER 2 7.640 1.181 0.691 8 HG SER 2 HG SER 2 9.309 1.571 -1.125 9 H ILE 3 H ILE 3 5.305 1.800 -2.778 10 HA ILE 3 HA ILE 3 3.578 -0.357 -2.038 11 HB ILE 3 HB ILE 3 4.337 0.809 -4.708 12 1HG1 ILE 3 2HG1 ILE 3 2.830 2.095 -3.195 13 2HG1 ILE 3 1HG1 ILE 3 2.062 1.634 -4.712 14 1HG2 ILE 3 1HG2 ILE 3 2.587 -1.568 -4.131 15 2HG2 ILE 3 2HG2 ILE 3 3.957 -1.461 -5.236 16 3HG2 ILE 3 3HG2 ILE 3 2.454 -0.621 -5.613 17 1HD1 ILE 3 1HD1 ILE 3 0.448 1.235 -3.091 18 2HD1 ILE 3 2HD1 ILE 3 1.614 0.532 -1.969 19 3HD1 ILE 3 3HD1 ILE 3 1.133 -0.358 -3.414 20 HA PRO 4 HA PRO 4 6.831 -3.000 -4.642 21 1HB PRO 4 2HB PRO 4 9.254 -1.384 -4.035 22 2HB PRO 4 1HB PRO 4 8.826 -2.265 -5.506 23 1HG PRO 4 2HG PRO 4 8.661 0.384 -5.431 24 2HG PRO 4 1HG PRO 4 7.424 -0.575 -6.266 25 1HD PRO 4 2HD PRO 4 7.308 0.750 -3.587 26 2HD PRO 4 1HD PRO 4 6.052 0.620 -4.835 27 H ALA 5 H ALA 5 7.702 -1.233 -1.725 28 HA ALA 5 HA ALA 5 9.323 -3.240 -0.568 29 1HB ALA 5 1HB ALA 5 9.685 -1.244 0.468 30 2HB ALA 5 2HB ALA 5 8.532 -1.946 1.603 31 3HB ALA 5 3HB ALA 5 7.986 -0.774 0.404 32 H CYS 6 H CYS 6 5.864 -2.621 -0.508 33 HA CYS 6 HA CYS 6 5.376 -4.642 1.486 34 1HB CYS 6 2HB CYS 6 3.935 -2.625 1.278 35 2HB CYS 6 1HB CYS 6 3.377 -3.226 -0.282 36 H GLY 7 H GLY 7 4.670 -4.272 -1.981 37 1HA GLY 7 2HA GLY 7 4.403 -5.843 -3.636 38 2HA GLY 7 1HA GLY 7 5.192 -6.994 -2.568 39 H GLU 8 H GLU 8 2.164 -5.216 -2.051 40 HA GLU 8 HA GLU 8 0.665 -7.704 -2.337 41 1HB GLU 8 2HB GLU 8 1.216 -7.610 0.030 42 2HB GLU 8 1HB GLU 8 0.606 -5.965 0.136 43 1HG GLU 8 2HG GLU 8 -0.975 -7.547 1.070 44 2HG GLU 8 1HG GLU 8 -1.645 -6.751 -0.350 45 H SER 9 H SER 9 -1.430 -7.475 -2.922 46 HA SER 9 HA SER 9 -2.200 -4.840 -3.924 47 1HB SER 9 2HB SER 9 -3.504 -7.530 -4.393 48 2HB SER 9 1HB SER 9 -3.809 -6.035 -5.282 49 HG SER 9 HG SER 9 -1.172 -6.896 -5.179 50 H CYS 10 H CYS 10 -4.045 -3.789 -3.301 51 HA CYS 10 HA CYS 10 -5.171 -4.600 -0.750 52 1HB CYS 10 2HB CYS 10 -4.487 -2.298 -0.963 53 2HB CYS 10 1HB CYS 10 -5.467 -2.092 -2.409 54 H PHE 11 H PHE 11 -6.123 -4.352 -4.110 55 HA PHE 11 HA PHE 11 -8.904 -4.433 -3.785 56 1HB PHE 11 2HB PHE 11 -8.993 -5.236 -6.121 57 2HB PHE 11 1HB PHE 11 -7.950 -3.838 -5.916 58 HD1 PHE 11 1HD PHE 11 -5.894 -3.847 -6.926 59 HD2 PHE 11 2HD PHE 11 -7.750 -7.571 -6.031 60 HE1 PHE 11 1HE PHE 11 -4.092 -5.026 -8.110 61 HE2 PHE 11 2HE PHE 11 -5.944 -8.757 -7.206 62 HZ PHE 11 HZ PHE 11 -4.112 -7.485 -8.249 63 H LYS 12 H LYS 12 -6.637 -6.830 -3.104 64 HA LYS 12 HA LYS 12 -8.125 -9.161 -3.696 65 1HB LYS 12 2HB LYS 12 -5.868 -8.607 -1.777 66 2HB LYS 12 1HB LYS 12 -6.579 -10.204 -1.963 67 1HG LYS 12 2HG LYS 12 -5.849 -10.387 -4.191 68 2HG LYS 12 1HG LYS 12 -5.471 -8.667 -4.289 69 1HD LYS 12 2HD LYS 12 -3.448 -10.033 -4.083 70 2HD LYS 12 1HD LYS 12 -3.651 -8.955 -2.704 71 1HE LYS 12 2HE LYS 12 -4.607 -10.839 -1.420 72 2HE LYS 12 1HE LYS 12 -4.297 -11.901 -2.794 73 1HZ LYS 12 1HZ LYS 12 -2.106 -11.979 -2.338 74 2HZ LYS 12 2HZ LYS 12 -2.579 -11.522 -0.781 75 3HZ LYS 12 3HZ LYS 12 -2.019 -10.352 -1.867 76 H GLY 13 H GLY 13 -8.208 -6.882 -1.079 77 1HA GLY 13 2HA GLY 13 -10.614 -7.201 -0.064 78 2HA GLY 13 1HA GLY 13 -9.851 -8.653 0.573 79 H LYS 14 H LYS 14 -7.344 -7.741 1.138 80 HA LYS 14 HA LYS 14 -7.280 -5.331 2.596 81 1HB LYS 14 2HB LYS 14 -6.978 -6.425 4.874 82 2HB LYS 14 1HB LYS 14 -8.621 -6.330 4.268 83 1HG LYS 14 2HG LYS 14 -8.365 -8.457 5.271 84 2HG LYS 14 1HG LYS 14 -8.390 -8.717 3.528 85 1HD LYS 14 2HD LYS 14 -6.044 -9.064 3.462 86 2HD LYS 14 1HD LYS 14 -5.842 -8.479 5.111 87 1HE LYS 14 2HE LYS 14 -7.361 -10.965 4.338 88 2HE LYS 14 1HE LYS 14 -5.694 -10.946 4.907 89 1HZ LYS 14 1HZ LYS 14 -6.435 -10.014 6.994 90 2HZ LYS 14 2HZ LYS 14 -7.264 -11.455 6.684 91 3HZ LYS 14 3HZ LYS 14 -8.037 -9.970 6.448 92 H CYS 15 H CYS 15 -5.197 -5.018 3.643 93 HA CYS 15 HA CYS 15 -3.089 -6.158 2.125 94 1HB CYS 15 2HB CYS 15 -2.903 -4.549 4.682 95 2HB CYS 15 1HB CYS 15 -1.612 -4.809 3.512 96 H TYR 16 H TYR 16 -1.978 -7.968 2.481 97 HA TYR 16 HA TYR 16 -2.523 -9.531 4.857 98 1HB TYR 16 2HB TYR 16 -2.300 -10.428 2.448 99 2HB TYR 16 1HB TYR 16 -0.569 -10.248 2.679 100 HD1 TYR 16 1HD TYR 16 0.344 -12.364 2.883 101 HD2 TYR 16 2HD TYR 16 -3.246 -11.466 4.981 102 HE1 TYR 16 1HE TYR 16 0.437 -14.567 3.974 103 HE2 TYR 16 2HE TYR 16 -3.163 -13.664 6.078 104 HH TYR 16 HH TYR 16 -0.446 -15.608 6.102 105 H THR 17 H THR 17 0.214 -7.993 3.273 106 HA THR 17 HA THR 17 2.181 -8.776 5.117 107 HB THR 17 HB THR 17 2.362 -6.236 3.528 108 HG1 THR 17 1HG THR 17 2.985 -7.661 1.745 109 1HG2 THR 17 1HG2 THR 17 4.662 -6.778 3.378 110 2HG2 THR 17 2HG2 THR 17 4.381 -8.437 3.907 111 3HG2 THR 17 3HG2 THR 17 4.206 -7.106 5.051 112 HA PRO 18 HA PRO 18 0.856 -6.250 8.569 113 1HB PRO 18 2HB PRO 18 3.208 -6.706 9.985 114 2HB PRO 18 1HB PRO 18 1.754 -7.703 10.061 115 1HG PRO 18 2HG PRO 18 4.263 -8.121 8.507 116 2HG PRO 18 1HG PRO 18 3.222 -9.313 9.305 117 1HD PRO 18 2HD PRO 18 3.186 -8.959 6.642 118 2HD PRO 18 1HD PRO 18 1.712 -9.356 7.551 119 H GLY 19 H GLY 19 1.076 -4.147 8.844 120 1HA GLY 19 2HA GLY 19 2.324 -2.168 9.219 121 2HA GLY 19 1HA GLY 19 3.673 -2.887 8.354 122 H CYS 20 H CYS 20 1.316 -3.703 6.345 123 HA CYS 20 HA CYS 20 1.783 -1.332 4.718 124 1HB CYS 20 2HB CYS 20 0.312 -3.867 4.003 125 2HB CYS 20 1HB CYS 20 0.768 -2.577 2.899 126 H SER 21 H SER 21 0.195 -0.058 3.821 127 HA SER 21 HA SER 21 -2.504 -0.336 4.952 128 1HB SER 21 2HB SER 21 -1.009 2.276 4.597 129 2HB SER 21 1HB SER 21 -2.617 2.068 5.292 130 HG SER 21 HG SER 21 -1.001 0.474 6.627 131 H CYS 22 H CYS 22 -4.180 0.240 3.576 132 HA CYS 22 HA CYS 22 -3.595 0.140 0.768 133 1HB CYS 22 2HB CYS 22 -5.585 -0.949 1.869 134 2HB CYS 22 1HB CYS 22 -6.261 0.657 2.103 135 H SER 23 H SER 23 -2.286 2.280 1.542 136 HA SER 23 HA SER 23 -3.913 4.675 1.217 137 1HB SER 23 2HB SER 23 -0.914 4.507 1.557 138 2HB SER 23 1HB SER 23 -1.963 5.887 1.886 139 HG SER 23 HG SER 23 -2.558 5.020 3.738 140 H LYS 24 H LYS 24 -3.000 2.561 -0.909 141 HA LYS 24 HA LYS 24 -2.608 4.515 -3.033 142 1HB LYS 24 2HB LYS 24 -0.747 2.161 -2.603 143 2HB LYS 24 1HB LYS 24 -0.779 3.159 -4.045 144 1HG LYS 24 2HG LYS 24 -0.165 4.216 -1.297 145 2HG LYS 24 1HG LYS 24 1.061 3.668 -2.441 146 1HD LYS 24 2HD LYS 24 0.341 5.356 -4.043 147 2HD LYS 24 1HD LYS 24 -0.927 5.884 -2.934 148 1HE LYS 24 2HE LYS 24 0.985 7.379 -2.814 149 2HE LYS 24 1HE LYS 24 0.779 6.513 -1.292 150 1HZ LYS 24 1HZ LYS 24 2.624 5.499 -3.358 151 2HZ LYS 24 2HZ LYS 24 2.634 5.203 -1.692 152 3HZ LYS 24 3HZ LYS 24 3.118 6.711 -2.286 153 H TYR 25 H TYR 25 -4.913 3.336 -2.580 154 HA TYR 25 HA TYR 25 -5.530 0.810 -3.413 155 1HB TYR 25 2HB TYR 25 -7.084 2.623 -2.523 156 2HB TYR 25 1HB TYR 25 -7.179 3.227 -4.174 157 HD1 TYR 25 1HD TYR 25 -7.539 -0.029 -2.360 158 HD2 TYR 25 2HD TYR 25 -8.996 2.545 -5.418 159 HE1 TYR 25 1HE TYR 25 -9.349 -1.623 -2.829 160 HE2 TYR 25 2HE TYR 25 -10.813 0.957 -5.894 161 HH TYR 25 HH TYR 25 -11.514 -1.709 -3.835 162 HA PRO 26 HA PRO 26 -6.511 -0.514 -4.371 163 1HB PRO 26 2HB PRO 26 -6.568 -2.561 -6.069 164 2HB PRO 26 1HB PRO 26 -7.678 -1.198 -6.246 165 1HG PRO 26 2HG PRO 26 -5.256 -1.883 -7.824 166 2HG PRO 26 1HG PRO 26 -6.741 -1.066 -8.338 167 1HD PRO 26 2HD PRO 26 -4.271 0.141 -7.612 168 2HD PRO 26 1HD PRO 26 -5.803 0.961 -7.969 169 H LEU 27 H LEU 27 -3.627 0.110 -4.295 170 HA LEU 27 HA LEU 27 -2.600 -2.614 -3.840 171 1HB LEU 27 2HB LEU 27 -1.121 -0.155 -4.757 172 2HB LEU 27 1HB LEU 27 -0.328 -1.628 -4.223 173 HG LEU 27 HG LEU 27 -2.303 -1.599 -6.472 174 1HD1 LEU 27 1HD1 LEU 27 0.675 -1.164 -6.556 175 2HD1 LEU 27 2HD1 LEU 27 -0.588 -0.103 -7.179 176 3HD1 LEU 27 3HD1 LEU 27 -0.276 -1.654 -7.959 177 1HD2 LEU 27 1HD2 LEU 27 -1.609 -3.726 -5.220 178 2HD2 LEU 27 2HD2 LEU 27 -0.052 -3.522 -6.024 179 3HD2 LEU 27 3HD2 LEU 27 -1.519 -3.732 -6.981 180 H CYS 28 H CYS 28 -1.135 -2.886 -2.125 181 HA CYS 28 HA CYS 28 -1.703 -1.087 0.121 182 1HB CYS 28 2HB CYS 28 -0.639 -3.911 -0.018 183 2HB CYS 28 1HB CYS 28 -0.681 -2.977 1.473 184 H ALA 29 H ALA 29 -0.244 0.273 0.841 185 HA ALA 29 HA ALA 29 2.487 0.081 -0.186 186 1HB ALA 29 1HB ALA 29 2.682 2.386 0.150 187 2HB ALA 29 2HB ALA 29 1.333 2.426 1.285 188 3HB ALA 29 3HB ALA 29 1.032 2.170 -0.434 189 H LYS 30 H LYS 30 4.180 -0.306 1.082 190 HA LYS 30 HA LYS 30 3.712 -0.860 3.902 191 1HB LYS 30 2HB LYS 30 5.028 -2.451 2.490 192 2HB LYS 30 1HB LYS 30 6.233 -1.195 2.255 193 1HG LYS 30 2HG LYS 30 6.789 -2.919 3.983 194 2HG LYS 30 1HG LYS 30 6.864 -1.246 4.537 195 1HD LYS 30 2HD LYS 30 4.809 -1.440 5.696 196 2HD LYS 30 1HD LYS 30 4.429 -2.973 4.911 197 1HE LYS 30 2HE LYS 30 6.843 -2.650 6.665 198 2HE LYS 30 1HE LYS 30 5.257 -3.036 7.333 199 1HZ LYS 30 1HZ LYS 30 5.356 -5.124 6.578 200 2HZ LYS 30 2HZ LYS 30 7.026 -4.859 6.481 201 3HZ LYS 30 3HZ LYS 30 6.063 -4.686 5.101 202 H ASN 31 H ASN 31 3.374 1.181 4.661 203 HA ASN 31 HA ASN 31 3.884 3.177 5.581 204 1HB ASN 31 2HB ASN 31 5.955 1.747 6.331 205 2HB ASN 31 1HB ASN 31 6.824 2.718 5.147 206 1HD2 ASN 31 1HD2 ASN 31 6.131 2.485 8.304 207 2HD2 ASN 31 2HD2 ASN 31 6.267 4.140 8.774 Start of MODEL 3 1 H GLY 1 H GLY 1 3.370 2.778 3.140 2 1HA GLY 1 2HA GLY 1 3.145 4.679 1.749 3 2HA GLY 1 1HA GLY 1 4.653 5.299 2.396 4 H SER 2 H SER 2 5.827 2.505 1.942 5 HA SER 2 HA SER 2 6.688 3.064 -0.778 6 1HB SER 2 2HB SER 2 8.355 2.539 0.977 7 2HB SER 2 1HB SER 2 7.652 0.930 1.139 8 HG SER 2 HG SER 2 9.561 1.553 -0.448 9 H ILE 3 H ILE 3 5.710 2.209 -2.448 10 HA ILE 3 HA ILE 3 3.796 0.132 -2.248 11 HB ILE 3 HB ILE 3 5.012 1.558 -4.602 12 1HG1 ILE 3 2HG1 ILE 3 2.630 2.311 -4.892 13 2HG1 ILE 3 1HG1 ILE 3 2.245 1.503 -3.378 14 1HG2 ILE 3 1HG2 ILE 3 2.736 0.108 -5.450 15 2HG2 ILE 3 2HG2 ILE 3 3.836 -1.029 -4.670 16 3HG2 ILE 3 3HG2 ILE 3 4.401 -0.033 -6.013 17 1HD1 ILE 3 1HD1 ILE 3 2.935 3.240 -2.200 18 2HD1 ILE 3 2HD1 ILE 3 3.063 4.126 -3.721 19 3HD1 ILE 3 3HD1 ILE 3 4.474 3.301 -3.060 20 HA PRO 4 HA PRO 4 7.023 -2.585 -4.727 21 1HB PRO 4 2HB PRO 4 9.567 -1.282 -3.943 22 2HB PRO 4 1HB PRO 4 9.077 -1.954 -5.502 23 1HG PRO 4 2HG PRO 4 9.206 0.680 -5.135 24 2HG PRO 4 1HG PRO 4 7.909 -0.044 -6.106 25 1HD PRO 4 2HD PRO 4 7.826 0.972 -3.291 26 2HD PRO 4 1HD PRO 4 6.627 1.150 -4.588 27 H ALA 5 H ALA 5 7.789 -1.147 -1.625 28 HA ALA 5 HA ALA 5 9.297 -3.302 -0.593 29 1HB ALA 5 1HB ALA 5 9.563 -1.980 1.179 30 2HB ALA 5 2HB ALA 5 7.824 -1.805 1.416 31 3HB ALA 5 3HB ALA 5 8.666 -0.769 0.264 32 H CYS 6 H CYS 6 5.834 -2.607 -0.581 33 HA CYS 6 HA CYS 6 5.273 -4.823 1.178 34 1HB CYS 6 2HB CYS 6 3.908 -2.701 1.091 35 2HB CYS 6 1HB CYS 6 3.271 -3.266 -0.452 36 H GLY 7 H GLY 7 4.313 -4.079 -2.177 37 1HA GLY 7 2HA GLY 7 4.096 -5.461 -4.002 38 2HA GLY 7 1HA GLY 7 4.919 -6.714 -3.086 39 H GLU 8 H GLU 8 1.992 -5.176 -1.912 40 HA GLU 8 HA GLU 8 0.439 -7.545 -2.683 41 1HB GLU 8 2HB GLU 8 1.195 -7.747 -0.298 42 2HB GLU 8 1HB GLU 8 0.301 -6.275 0.060 43 1HG GLU 8 2HG GLU 8 -1.774 -7.372 -0.644 44 2HG GLU 8 1HG GLU 8 -0.873 -8.849 -0.973 45 H SER 9 H SER 9 -1.667 -7.141 -3.241 46 HA SER 9 HA SER 9 -2.410 -4.304 -3.378 47 1HB SER 9 2HB SER 9 -3.494 -6.610 -5.008 48 2HB SER 9 1HB SER 9 -3.775 -4.889 -5.287 49 HG SER 9 HG SER 9 -1.148 -5.319 -5.175 50 H CYS 10 H CYS 10 -4.266 -3.561 -2.514 51 HA CYS 10 HA CYS 10 -5.758 -5.358 -0.787 52 1HB CYS 10 2HB CYS 10 -6.875 -3.070 -0.173 53 2HB CYS 10 1HB CYS 10 -5.249 -3.424 0.392 54 H PHE 11 H PHE 11 -8.002 -3.177 -1.193 55 HA PHE 11 HA PHE 11 -9.930 -2.912 -2.358 56 1HB PHE 11 2HB PHE 11 -8.708 -2.496 -4.367 57 2HB PHE 11 1HB PHE 11 -8.325 -4.202 -4.566 58 HD1 PHE 11 1HD PHE 11 -11.444 -2.190 -4.085 59 HD2 PHE 11 2HD PHE 11 -9.405 -5.190 -6.313 60 HE1 PHE 11 1HE PHE 11 -13.429 -2.476 -5.509 61 HE2 PHE 11 2HE PHE 11 -11.387 -5.477 -7.744 62 HZ PHE 11 HZ PHE 11 -13.402 -4.120 -7.342 63 H LYS 12 H LYS 12 -8.593 -6.111 -3.142 64 HA LYS 12 HA LYS 12 -11.079 -7.445 -3.266 65 1HB LYS 12 2HB LYS 12 -8.957 -8.268 -4.262 66 2HB LYS 12 1HB LYS 12 -8.346 -8.584 -2.646 67 1HG LYS 12 2HG LYS 12 -10.110 -10.229 -2.291 68 2HG LYS 12 1HG LYS 12 -10.741 -9.904 -3.908 69 1HD LYS 12 2HD LYS 12 -7.972 -10.932 -3.294 70 2HD LYS 12 1HD LYS 12 -9.328 -11.926 -3.833 71 1HE LYS 12 2HE LYS 12 -9.434 -10.686 -5.920 72 2HE LYS 12 1HE LYS 12 -8.142 -9.618 -5.373 73 1HZ LYS 12 1HZ LYS 12 -6.587 -11.112 -5.901 74 2HZ LYS 12 2HZ LYS 12 -7.785 -11.847 -6.843 75 3HZ LYS 12 3HZ LYS 12 -7.467 -12.418 -5.282 76 H GLY 13 H GLY 13 -8.926 -6.653 -0.660 77 1HA GLY 13 2HA GLY 13 -10.838 -6.968 1.345 78 2HA GLY 13 1HA GLY 13 -9.873 -8.440 1.292 79 H LYS 14 H LYS 14 -8.873 -8.129 3.275 80 HA LYS 14 HA LYS 14 -7.442 -5.678 3.790 81 1HB LYS 14 2HB LYS 14 -6.883 -6.832 5.920 82 2HB LYS 14 1HB LYS 14 -8.616 -6.781 5.614 83 1HG LYS 14 2HG LYS 14 -8.351 -8.955 6.298 84 2HG LYS 14 1HG LYS 14 -8.196 -9.137 4.548 85 1HD LYS 14 2HD LYS 14 -5.667 -8.721 5.032 86 2HD LYS 14 1HD LYS 14 -6.115 -9.215 6.645 87 1HE LYS 14 2HE LYS 14 -5.445 -11.216 5.691 88 2HE LYS 14 1HE LYS 14 -7.195 -11.255 5.473 89 1HZ LYS 14 1HZ LYS 14 -5.219 -11.402 3.509 90 2HZ LYS 14 2HZ LYS 14 -6.025 -9.931 3.277 91 3HZ LYS 14 3HZ LYS 14 -6.897 -11.385 3.291 92 H CYS 15 H CYS 15 -5.133 -5.678 4.160 93 HA CYS 15 HA CYS 15 -3.765 -7.533 2.390 94 1HB CYS 15 2HB CYS 15 -2.845 -4.978 3.716 95 2HB CYS 15 1HB CYS 15 -1.817 -5.988 2.699 96 H TYR 16 H TYR 16 -2.171 -8.913 3.023 97 HA TYR 16 HA TYR 16 -2.349 -9.828 5.747 98 1HB TYR 16 2HB TYR 16 -2.118 -11.231 3.592 99 2HB TYR 16 1HB TYR 16 -0.412 -10.839 3.684 100 HD1 TYR 16 1HD TYR 16 -2.882 -11.742 6.336 101 HD2 TYR 16 2HD TYR 16 0.735 -12.738 4.328 102 HE1 TYR 16 1HE TYR 16 -2.526 -13.598 7.908 103 HE2 TYR 16 2HE TYR 16 1.099 -14.599 5.894 104 HH TYR 16 HH TYR 16 -0.054 -14.924 8.663 105 H THR 17 H THR 17 0.100 -8.380 3.683 106 HA THR 17 HA THR 17 2.270 -8.645 5.409 107 HB THR 17 HB THR 17 1.967 -6.341 3.501 108 HG1 THR 17 1HG THR 17 1.348 -8.107 2.286 109 1HG2 THR 17 1HG2 THR 17 4.379 -6.814 3.151 110 2HG2 THR 17 2HG2 THR 17 4.281 -8.054 4.401 111 3HG2 THR 17 3HG2 THR 17 3.999 -6.363 4.813 112 HA PRO 18 HA PRO 18 0.895 -5.841 8.649 113 1HB PRO 18 2HB PRO 18 3.205 -6.199 10.125 114 2HB PRO 18 1HB PRO 18 1.764 -7.211 10.243 115 1HG PRO 18 2HG PRO 18 4.306 -7.693 8.755 116 2HG PRO 18 1HG PRO 18 3.288 -8.843 9.644 117 1HD PRO 18 2HD PRO 18 3.262 -8.690 6.955 118 2HD PRO 18 1HD PRO 18 1.801 -9.074 7.890 119 H GLY 19 H GLY 19 1.182 -3.727 8.738 120 1HA GLY 19 2HA GLY 19 2.529 -1.770 8.915 121 2HA GLY 19 1HA GLY 19 3.802 -2.607 8.037 122 H CYS 20 H CYS 20 1.391 -3.546 6.208 123 HA CYS 20 HA CYS 20 1.756 -1.284 4.407 124 1HB CYS 20 2HB CYS 20 0.313 -3.882 3.915 125 2HB CYS 20 1HB CYS 20 0.701 -2.664 2.713 126 H SER 21 H SER 21 0.161 -0.035 3.587 127 HA SER 21 HA SER 21 -2.529 -0.328 4.733 128 1HB SER 21 2HB SER 21 -1.043 2.292 4.392 129 2HB SER 21 1HB SER 21 -2.662 2.085 5.061 130 HG SER 21 HG SER 21 -0.861 0.518 6.338 131 H CYS 22 H CYS 22 -4.205 0.201 3.341 132 HA CYS 22 HA CYS 22 -3.608 0.100 0.542 133 1HB CYS 22 2HB CYS 22 -5.601 -0.963 1.720 134 2HB CYS 22 1HB CYS 22 -6.298 0.649 1.812 135 H SER 23 H SER 23 -2.346 2.289 1.434 136 HA SER 23 HA SER 23 -3.957 4.663 0.966 137 1HB SER 23 2HB SER 23 -0.977 4.469 1.500 138 2HB SER 23 1HB SER 23 -2.017 5.884 1.701 139 HG SER 23 HG SER 23 -2.882 5.022 3.491 140 H LYS 24 H LYS 24 -3.203 2.590 -1.105 141 HA LYS 24 HA LYS 24 -2.555 4.445 -3.230 142 1HB LYS 24 2HB LYS 24 -0.772 2.122 -2.499 143 2HB LYS 24 1HB LYS 24 -0.806 2.792 -4.123 144 1HG LYS 24 2HG LYS 24 -0.166 4.375 -1.646 145 2HG LYS 24 1HG LYS 24 1.039 3.650 -2.712 146 1HD LYS 24 2HD LYS 24 0.362 5.029 -4.539 147 2HD LYS 24 1HD LYS 24 -1.055 5.602 -3.657 148 1HE LYS 24 2HE LYS 24 1.816 6.124 -2.891 149 2HE LYS 24 1HE LYS 24 0.751 7.270 -3.707 150 1HZ LYS 24 1HZ LYS 24 -0.625 6.414 -1.471 151 2HZ LYS 24 2HZ LYS 24 0.102 7.927 -1.707 152 3HZ LYS 24 3HZ LYS 24 0.961 6.688 -0.942 153 H TYR 25 H TYR 25 -4.921 3.490 -2.945 154 HA TYR 25 HA TYR 25 -5.783 1.028 -3.657 155 1HB TYR 25 2HB TYR 25 -7.249 2.926 -3.105 156 2HB TYR 25 1HB TYR 25 -6.883 3.669 -4.655 157 HD1 TYR 25 1HD TYR 25 -8.395 3.388 -6.368 158 HD2 TYR 25 2HD TYR 25 -8.231 0.455 -3.288 159 HE1 TYR 25 1HE TYR 25 -10.313 2.231 -7.377 160 HE2 TYR 25 2HE TYR 25 -10.147 -0.714 -4.294 161 HH TYR 25 HH TYR 25 -12.118 -0.051 -5.808 162 HA PRO 26 HA PRO 26 -6.529 -0.369 -4.455 163 1HB PRO 26 2HB PRO 26 -6.719 -2.541 -5.997 164 2HB PRO 26 1HB PRO 26 -7.719 -1.115 -6.291 165 1HG PRO 26 2HG PRO 26 -5.435 -2.152 -7.840 166 2HG PRO 26 1HG PRO 26 -6.750 -1.085 -8.356 167 1HD PRO 26 2HD PRO 26 -4.069 -0.378 -7.505 168 2HD PRO 26 1HD PRO 26 -5.337 0.677 -8.162 169 H LEU 27 H LEU 27 -3.643 -0.012 -4.180 170 HA LEU 27 HA LEU 27 -2.981 -2.769 -3.438 171 1HB LEU 27 2HB LEU 27 -0.692 -2.525 -4.186 172 2HB LEU 27 1HB LEU 27 -1.810 -2.311 -5.519 173 HG LEU 27 HG LEU 27 -1.485 0.249 -4.851 174 1HD1 LEU 27 1HD1 LEU 27 1.322 -0.535 -4.488 175 2HD1 LEU 27 2HD1 LEU 27 0.265 -0.832 -3.108 176 3HD1 LEU 27 3HD1 LEU 27 0.408 0.794 -3.775 177 1HD2 LEU 27 1HD2 LEU 27 -0.854 0.162 -6.977 178 2HD2 LEU 27 2HD2 LEU 27 -0.431 -1.543 -6.823 179 3HD2 LEU 27 3HD2 LEU 27 0.761 -0.301 -6.440 180 H CYS 28 H CYS 28 -1.530 -3.011 -1.695 181 HA CYS 28 HA CYS 28 -1.712 -0.820 0.204 182 1HB CYS 28 2HB CYS 28 -1.100 -3.739 0.404 183 2HB CYS 28 1HB CYS 28 -0.560 -2.663 1.688 184 H ALA 29 H ALA 29 -0.091 0.392 0.872 185 HA ALA 29 HA ALA 29 2.563 -0.089 -0.274 186 1HB ALA 29 1HB ALA 29 1.256 2.129 -0.554 187 2HB ALA 29 2HB ALA 29 2.966 2.199 -0.131 188 3HB ALA 29 3HB ALA 29 1.739 2.438 1.113 189 H LYS 30 H LYS 30 4.257 -0.554 1.008 190 HA LYS 30 HA LYS 30 3.766 -1.112 3.800 191 1HB LYS 30 2HB LYS 30 5.107 -2.643 2.405 192 2HB LYS 30 1HB LYS 30 6.287 -1.369 2.140 193 1HG LYS 30 2HG LYS 30 6.925 -3.084 3.839 194 2HG LYS 30 1HG LYS 30 6.974 -1.415 4.408 195 1HD LYS 30 2HD LYS 30 5.042 -1.670 5.690 196 2HD LYS 30 1HD LYS 30 4.539 -3.114 4.810 197 1HE LYS 30 2HE LYS 30 7.074 -3.089 6.403 198 2HE LYS 30 1HE LYS 30 5.519 -3.372 7.186 199 1HZ LYS 30 1HZ LYS 30 5.349 -5.406 6.303 200 2HZ LYS 30 2HZ LYS 30 7.027 -5.297 6.100 201 3HZ LYS 30 3HZ LYS 30 5.993 -4.949 4.805 202 H ASN 31 H ASN 31 3.491 0.779 4.842 203 HA ASN 31 HA ASN 31 3.970 2.736 5.863 204 1HB ASN 31 2HB ASN 31 6.851 1.940 5.360 205 2HB ASN 31 1HB ASN 31 6.323 3.214 6.453 206 1HD2 ASN 31 1HD2 ASN 31 7.597 0.346 6.545 207 2HD2 ASN 31 2HD2 ASN 31 6.826 -0.336 7.930 Start of MODEL 4 1 H GLY 1 H GLY 1 3.436 2.594 3.411 2 1HA GLY 1 2HA GLY 1 3.197 4.696 2.297 3 2HA GLY 1 1HA GLY 1 4.786 5.149 2.886 4 H SER 2 H SER 2 5.833 2.429 2.051 5 HA SER 2 HA SER 2 6.296 3.188 -0.739 6 1HB SER 2 2HB SER 2 7.771 1.183 0.979 7 2HB SER 2 1HB SER 2 8.262 1.756 -0.615 8 HG SER 2 HG SER 2 7.810 3.600 1.456 9 H ILE 3 H ILE 3 4.941 2.300 -2.143 10 HA ILE 3 HA ILE 3 3.458 -0.047 -1.737 11 HB ILE 3 HB ILE 3 4.107 1.346 -4.340 12 1HG1 ILE 3 2HG1 ILE 3 1.637 2.036 -4.067 13 2HG1 ILE 3 1HG1 ILE 3 1.824 1.556 -2.385 14 1HG2 ILE 3 1HG2 ILE 3 2.338 0.099 -5.362 15 2HG2 ILE 3 2HG2 ILE 3 1.927 -0.668 -3.828 16 3HG2 ILE 3 3HG2 ILE 3 3.459 -1.042 -4.617 17 1HD1 ILE 3 1HD1 ILE 3 2.687 3.529 -1.908 18 2HD1 ILE 3 2HD1 ILE 3 2.465 4.020 -3.588 19 3HD1 ILE 3 3HD1 ILE 3 3.980 3.273 -3.080 20 HA PRO 4 HA PRO 4 6.632 -2.231 -4.824 21 1HB PRO 4 2HB PRO 4 9.045 -0.645 -4.102 22 2HB PRO 4 1HB PRO 4 8.579 -1.343 -5.658 23 1HG PRO 4 2HG PRO 4 8.354 1.269 -5.235 24 2HG PRO 4 1HG PRO 4 7.108 0.389 -6.141 25 1HD PRO 4 2HD PRO 4 7.065 1.369 -3.316 26 2HD PRO 4 1HD PRO 4 5.763 1.346 -4.522 27 H ALA 5 H ALA 5 7.609 -0.850 -1.738 28 HA ALA 5 HA ALA 5 9.281 -2.997 -0.933 29 1HB ALA 5 1HB ALA 5 8.667 -0.481 0.053 30 2HB ALA 5 2HB ALA 5 9.743 -1.667 0.791 31 3HB ALA 5 3HB ALA 5 8.049 -1.589 1.277 32 H CYS 6 H CYS 6 5.853 -2.442 -0.836 33 HA CYS 6 HA CYS 6 5.359 -4.559 1.065 34 1HB CYS 6 2HB CYS 6 3.882 -2.580 0.959 35 2HB CYS 6 1HB CYS 6 3.390 -3.058 -0.664 36 H GLY 7 H GLY 7 4.454 -4.024 -2.343 37 1HA GLY 7 2HA GLY 7 4.558 -5.578 -4.087 38 2HA GLY 7 1HA GLY 7 4.945 -6.833 -2.918 39 H GLU 8 H GLU 8 2.766 -6.353 -1.149 40 HA GLU 8 HA GLU 8 0.787 -7.956 -2.348 41 1HB GLU 8 2HB GLU 8 1.207 -7.935 0.074 42 2HB GLU 8 1HB GLU 8 0.607 -6.284 0.165 43 1HG GLU 8 2HG GLU 8 -1.589 -7.093 -0.655 44 2HG GLU 8 1HG GLU 8 -0.966 -8.739 -0.578 45 H SER 9 H SER 9 -1.154 -7.526 -3.218 46 HA SER 9 HA SER 9 -1.705 -4.744 -3.923 47 1HB SER 9 2HB SER 9 -2.979 -7.265 -5.014 48 2HB SER 9 1HB SER 9 -3.093 -5.638 -5.688 49 HG SER 9 HG SER 9 -0.510 -6.415 -5.361 50 H CYS 10 H CYS 10 -3.495 -3.699 -3.224 51 HA CYS 10 HA CYS 10 -5.068 -4.975 -1.142 52 1HB CYS 10 2HB CYS 10 -4.199 -2.702 -0.770 53 2HB CYS 10 1HB CYS 10 -5.078 -2.128 -2.179 54 H PHE 11 H PHE 11 -6.275 -6.431 -2.371 55 HA PHE 11 HA PHE 11 -7.757 -5.721 -4.650 56 1HB PHE 11 2HB PHE 11 -9.118 -7.856 -3.924 57 2HB PHE 11 1HB PHE 11 -7.475 -7.995 -4.534 58 HD1 PHE 11 1HD PHE 11 -9.389 -7.738 -1.342 59 HD2 PHE 11 2HD PHE 11 -5.890 -9.141 -3.315 60 HE1 PHE 11 1HE PHE 11 -8.725 -8.940 0.698 61 HE2 PHE 11 2HE PHE 11 -5.221 -10.347 -1.279 62 HZ PHE 11 HZ PHE 11 -6.639 -10.247 0.731 63 H LYS 12 H LYS 12 -8.701 -5.922 -1.234 64 HA LYS 12 HA LYS 12 -10.486 -3.808 -1.297 65 1HB LYS 12 2HB LYS 12 -12.675 -4.932 -1.233 66 2HB LYS 12 1HB LYS 12 -11.881 -5.149 -2.785 67 1HG LYS 12 2HG LYS 12 -11.202 -7.402 -2.125 68 2HG LYS 12 1HG LYS 12 -12.001 -7.184 -0.567 69 1HD LYS 12 2HD LYS 12 -14.146 -6.894 -1.707 70 2HD LYS 12 1HD LYS 12 -13.348 -7.105 -3.266 71 1HE LYS 12 2HE LYS 12 -12.681 -9.366 -2.619 72 2HE LYS 12 1HE LYS 12 -13.468 -9.153 -1.055 73 1HZ LYS 12 1HZ LYS 12 -15.563 -9.179 -2.020 74 2HZ LYS 12 2HZ LYS 12 -14.735 -10.366 -2.895 75 3HZ LYS 12 3HZ LYS 12 -14.980 -8.834 -3.571 76 H GLY 13 H GLY 13 -11.417 -3.399 0.706 77 1HA GLY 13 2HA GLY 13 -11.990 -3.827 2.923 78 2HA GLY 13 1HA GLY 13 -11.251 -5.411 2.789 79 H LYS 14 H LYS 14 -8.820 -5.450 2.761 80 HA LYS 14 HA LYS 14 -7.375 -3.194 3.703 81 1HB LYS 14 2HB LYS 14 -6.843 -4.287 5.968 82 2HB LYS 14 1HB LYS 14 -8.388 -3.469 5.804 83 1HG LYS 14 2HG LYS 14 -8.797 -5.483 6.978 84 2HG LYS 14 1HG LYS 14 -9.421 -5.717 5.345 85 1HD LYS 14 2HD LYS 14 -7.375 -6.928 4.749 86 2HD LYS 14 1HD LYS 14 -6.771 -6.706 6.385 87 1HE LYS 14 2HE LYS 14 -7.654 -8.885 6.339 88 2HE LYS 14 1HE LYS 14 -8.871 -7.909 7.161 89 1HZ LYS 14 1HZ LYS 14 -9.120 -9.434 4.790 90 2HZ LYS 14 2HZ LYS 14 -9.475 -7.811 4.462 91 3HZ LYS 14 3HZ LYS 14 -10.323 -8.632 5.672 92 H CYS 15 H CYS 15 -5.142 -3.763 4.300 93 HA CYS 15 HA CYS 15 -4.134 -5.850 2.576 94 1HB CYS 15 2HB CYS 15 -2.625 -3.940 4.373 95 2HB CYS 15 1HB CYS 15 -1.939 -4.929 3.086 96 H TYR 16 H TYR 16 -2.728 -7.534 3.283 97 HA TYR 16 HA TYR 16 -3.363 -8.404 6.015 98 1HB TYR 16 2HB TYR 16 -2.503 -9.936 3.564 99 2HB TYR 16 1HB TYR 16 -2.563 -10.662 5.169 100 HD1 TYR 16 1HD TYR 16 -4.745 -8.655 2.885 101 HD2 TYR 16 2HD TYR 16 -4.499 -11.767 5.773 102 HE1 TYR 16 1HE TYR 16 -7.149 -9.079 2.621 103 HE2 TYR 16 2HE TYR 16 -6.905 -12.206 5.510 104 HH TYR 16 HH TYR 16 -8.663 -11.684 3.378 105 H THR 17 H THR 17 -0.626 -8.001 3.801 106 HA THR 17 HA THR 17 1.367 -8.939 5.544 107 HB THR 17 HB THR 17 1.611 -6.858 3.361 108 HG1 THR 17 1HG THR 17 0.846 -8.848 2.569 109 1HG2 THR 17 1HG2 THR 17 3.556 -8.025 5.203 110 2HG2 THR 17 2HG2 THR 17 3.698 -6.614 4.154 111 3HG2 THR 17 3HG2 THR 17 3.994 -8.228 3.506 112 HA PRO 18 HA PRO 18 1.195 -5.839 8.746 113 1HB PRO 18 2HB PRO 18 3.921 -6.895 9.267 114 2HB PRO 18 1HB PRO 18 2.556 -6.709 10.373 115 1HG PRO 18 2HG PRO 18 3.263 -9.114 9.455 116 2HG PRO 18 1HG PRO 18 1.558 -8.682 9.687 117 1HD PRO 18 2HD PRO 18 3.140 -8.870 7.164 118 2HD PRO 18 1HD PRO 18 1.439 -9.276 7.464 119 H GLY 19 H GLY 19 1.771 -3.772 8.729 120 1HA GLY 19 2HA GLY 19 3.304 -1.978 8.554 121 2HA GLY 19 1HA GLY 19 4.329 -2.989 7.547 122 H CYS 20 H CYS 20 1.765 -3.781 6.027 123 HA CYS 20 HA CYS 20 1.984 -1.567 4.153 124 1HB CYS 20 2HB CYS 20 0.467 -4.157 3.893 125 2HB CYS 20 1HB CYS 20 0.703 -2.965 2.626 126 H SER 21 H SER 21 0.309 -0.358 3.396 127 HA SER 21 HA SER 21 -2.264 -0.548 4.787 128 1HB SER 21 2HB SER 21 -0.745 2.035 4.330 129 2HB SER 21 1HB SER 21 -2.306 1.862 5.135 130 HG SER 21 HG SER 21 -0.610 0.228 6.338 131 H CYS 22 H CYS 22 -4.014 -0.041 3.515 132 HA CYS 22 HA CYS 22 -3.624 -0.087 0.676 133 1HB CYS 22 2HB CYS 22 -5.510 -1.205 1.981 134 2HB CYS 22 1HB CYS 22 -6.222 0.394 2.142 135 H SER 23 H SER 23 -2.307 2.067 1.323 136 HA SER 23 HA SER 23 -3.966 4.441 1.266 137 1HB SER 23 2HB SER 23 -0.946 4.213 1.149 138 2HB SER 23 1HB SER 23 -1.892 5.646 1.566 139 HG SER 23 HG SER 23 -2.385 4.786 3.490 140 H LYS 24 H LYS 24 -2.896 2.334 -1.043 141 HA LYS 24 HA LYS 24 -3.140 4.366 -3.136 142 1HB LYS 24 2HB LYS 24 -0.910 2.324 -2.992 143 2HB LYS 24 1HB LYS 24 -1.234 3.365 -4.370 144 1HG LYS 24 2HG LYS 24 -0.546 4.374 -1.621 145 2HG LYS 24 1HG LYS 24 0.628 4.127 -2.912 146 1HD LYS 24 2HD LYS 24 -0.514 5.750 -4.305 147 2HD LYS 24 1HD LYS 24 -1.777 5.940 -3.085 148 1HE LYS 24 2HE LYS 24 -0.073 6.763 -1.499 149 2HE LYS 24 1HE LYS 24 1.138 6.645 -2.776 150 1HZ LYS 24 1HZ LYS 24 0.019 8.894 -2.347 151 2HZ LYS 24 2HZ LYS 24 -1.308 8.243 -3.170 152 3HZ LYS 24 3HZ LYS 24 0.187 8.378 -3.951 153 H TYR 25 H TYR 25 -5.222 2.897 -2.616 154 HA TYR 25 HA TYR 25 -5.571 0.325 -3.480 155 1HB TYR 25 2HB TYR 25 -7.283 1.928 -2.478 156 2HB TYR 25 1HB TYR 25 -7.521 2.549 -4.107 157 HD1 TYR 25 1HD TYR 25 -9.225 1.637 -5.380 158 HD2 TYR 25 2HD TYR 25 -7.523 -0.699 -2.259 159 HE1 TYR 25 1HE TYR 25 -10.897 -0.120 -5.791 160 HE2 TYR 25 2HE TYR 25 -9.184 -2.463 -2.666 161 HH TYR 25 HH TYR 25 -10.656 -3.252 -4.373 162 HA PRO 26 HA PRO 26 -6.323 -1.126 -4.435 163 1HB PRO 26 2HB PRO 26 -6.173 -3.105 -6.213 164 2HB PRO 26 1HB PRO 26 -7.492 -1.931 -6.263 165 1HG PRO 26 2HG PRO 26 -5.126 -2.187 -8.030 166 2HG PRO 26 1HG PRO 26 -6.740 -1.559 -8.395 167 1HD PRO 26 2HD PRO 26 -4.391 -0.068 -7.752 168 2HD PRO 26 1HD PRO 26 -6.030 0.556 -8.018 169 H LEU 27 H LEU 27 -3.626 -0.092 -4.347 170 HA LEU 27 HA LEU 27 -2.137 -2.623 -4.145 171 1HB LEU 27 2HB LEU 27 -1.120 0.091 -4.968 172 2HB LEU 27 1HB LEU 27 -0.076 -1.261 -4.559 173 HG LEU 27 HG LEU 27 -2.157 -1.490 -6.685 174 1HD1 LEU 27 1HD1 LEU 27 0.433 -0.072 -6.778 175 2HD1 LEU 27 2HD1 LEU 27 -1.020 0.159 -7.751 176 3HD1 LEU 27 3HD1 LEU 27 0.089 -1.160 -8.123 177 1HD2 LEU 27 1HD2 LEU 27 0.032 -3.124 -5.639 178 2HD2 LEU 27 2HD2 LEU 27 -0.036 -3.032 -7.398 179 3HD2 LEU 27 3HD2 LEU 27 -1.436 -3.602 -6.490 180 H CYS 28 H CYS 28 -0.851 -2.921 -2.390 181 HA CYS 28 HA CYS 28 -1.477 -1.180 -0.126 182 1HB CYS 28 2HB CYS 28 -0.245 -3.934 -0.285 183 2HB CYS 28 1HB CYS 28 -0.403 -3.025 1.215 184 H ALA 29 H ALA 29 -0.049 0.088 0.853 185 HA ALA 29 HA ALA 29 2.669 0.143 -0.250 186 1HB ALA 29 1HB ALA 29 2.439 2.352 -0.315 187 2HB ALA 29 2HB ALA 29 2.092 2.397 1.414 188 3HB ALA 29 3HB ALA 29 0.780 2.171 0.257 189 H LYS 30 H LYS 30 4.271 -0.591 0.969 190 HA LYS 30 HA LYS 30 3.845 -1.329 3.725 191 1HB LYS 30 2HB LYS 30 5.241 -2.717 2.249 192 2HB LYS 30 1HB LYS 30 6.336 -1.367 1.993 193 1HG LYS 30 2HG LYS 30 7.487 -2.573 3.554 194 2HG LYS 30 1HG LYS 30 6.587 -1.471 4.596 195 1HD LYS 30 2HD LYS 30 6.461 -3.710 5.490 196 2HD LYS 30 1HD LYS 30 4.869 -3.224 4.903 197 1HE LYS 30 2HE LYS 30 5.424 -5.538 4.281 198 2HE LYS 30 1HE LYS 30 5.191 -4.506 2.872 199 1HZ LYS 30 1HZ LYS 30 7.264 -4.878 2.194 200 2HZ LYS 30 2HZ LYS 30 7.337 -6.115 3.347 201 3HZ LYS 30 3HZ LYS 30 7.917 -4.575 3.728 202 H ASN 31 H ASN 31 3.705 0.299 5.098 203 HA ASN 31 HA ASN 31 3.962 2.301 6.079 204 1HB ASN 31 2HB ASN 31 6.253 2.856 6.852 205 2HB ASN 31 1HB ASN 31 5.801 1.190 7.166 206 1HD2 ASN 31 1HD2 ASN 31 7.972 3.305 5.572 207 2HD2 ASN 31 2HD2 ASN 31 9.015 2.096 4.914 Start of MODEL 5 1 H GLY 1 H GLY 1 3.385 2.741 3.073 2 1HA GLY 1 2HA GLY 1 3.387 4.724 1.738 3 2HA GLY 1 1HA GLY 1 4.881 5.209 2.524 4 H SER 2 H SER 2 6.032 2.484 2.187 5 HA SER 2 HA SER 2 7.079 2.925 -0.472 6 1HB SER 2 2HB SER 2 7.764 0.805 1.575 7 2HB SER 2 1HB SER 2 8.672 1.149 0.103 8 HG SER 2 HG SER 2 8.277 2.875 2.324 9 H ILE 3 H ILE 3 5.713 2.304 -2.058 10 HA ILE 3 HA ILE 3 3.972 0.097 -1.920 11 HB ILE 3 HB ILE 3 4.936 1.743 -4.244 12 1HG1 ILE 3 2HG1 ILE 3 2.411 2.228 -4.320 13 2HG1 ILE 3 1HG1 ILE 3 2.342 1.475 -2.731 14 1HG2 ILE 3 1HG2 ILE 3 4.596 -0.172 -5.440 15 2HG2 ILE 3 2HG2 ILE 3 2.956 0.478 -5.431 16 3HG2 ILE 3 3HG2 ILE 3 3.404 -0.805 -4.306 17 1HD1 ILE 3 1HD1 ILE 3 2.892 3.399 -1.810 18 2HD1 ILE 3 2HD1 ILE 3 2.993 4.143 -3.405 19 3HD1 ILE 3 3HD1 ILE 3 4.421 3.394 -2.689 20 HA PRO 4 HA PRO 4 7.128 -2.294 -4.781 21 1HB PRO 4 2HB PRO 4 9.753 -1.501 -4.434 22 2HB PRO 4 1HB PRO 4 8.730 -1.033 -5.795 23 1HG PRO 4 2HG PRO 4 9.374 0.480 -3.299 24 2HG PRO 4 1HG PRO 4 9.240 1.069 -4.966 25 1HD PRO 4 2HD PRO 4 7.274 1.455 -3.190 26 2HD PRO 4 1HD PRO 4 6.920 1.111 -4.895 27 H ALA 5 H ALA 5 8.096 -1.005 -1.662 28 HA ALA 5 HA ALA 5 9.476 -3.400 -0.861 29 1HB ALA 5 1HB ALA 5 8.526 -1.403 1.132 30 2HB ALA 5 2HB ALA 5 9.761 -0.917 -0.029 31 3HB ALA 5 3HB ALA 5 10.054 -2.281 1.052 32 H CYS 6 H CYS 6 6.248 -2.387 -1.002 33 HA CYS 6 HA CYS 6 5.307 -3.998 1.189 34 1HB CYS 6 2HB CYS 6 4.120 -1.955 0.631 35 2HB CYS 6 1HB CYS 6 3.798 -2.559 -0.993 36 H GLY 7 H GLY 7 4.466 -4.049 -2.283 37 1HA GLY 7 2HA GLY 7 4.325 -5.884 -3.713 38 2HA GLY 7 1HA GLY 7 4.794 -6.931 -2.379 39 H GLU 8 H GLU 8 2.752 -5.842 -0.604 40 HA GLU 8 HA GLU 8 0.674 -7.657 -1.100 41 1HB GLU 8 2HB GLU 8 1.283 -6.917 1.145 42 2HB GLU 8 1HB GLU 8 0.761 -5.282 0.764 43 1HG GLU 8 2HG GLU 8 -0.918 -6.386 2.079 44 2HG GLU 8 1HG GLU 8 -1.531 -6.112 0.447 45 H SER 9 H SER 9 -1.394 -7.438 -1.768 46 HA SER 9 HA SER 9 -2.024 -4.997 -3.273 47 1HB SER 9 2HB SER 9 -3.249 -7.763 -3.455 48 2HB SER 9 1HB SER 9 -3.644 -6.388 -4.488 49 HG SER 9 HG SER 9 -0.985 -7.287 -4.261 50 H CYS 10 H CYS 10 -4.031 -3.976 -2.986 51 HA CYS 10 HA CYS 10 -5.160 -4.352 -0.335 52 1HB CYS 10 2HB CYS 10 -4.626 -2.083 -1.157 53 2HB CYS 10 1HB CYS 10 -5.780 -2.288 -2.466 54 H PHE 11 H PHE 11 -5.944 -4.765 -3.690 55 HA PHE 11 HA PHE 11 -7.582 -5.826 -4.820 56 1HB PHE 11 2HB PHE 11 -6.958 -7.705 -3.353 57 2HB PHE 11 1HB PHE 11 -8.132 -7.162 -2.161 58 HD1 PHE 11 1HD PHE 11 -8.312 -7.581 -5.867 59 HD2 PHE 11 2HD PHE 11 -9.855 -8.674 -2.053 60 HE1 PHE 11 1HE PHE 11 -10.049 -8.936 -6.962 61 HE2 PHE 11 2HE PHE 11 -11.594 -10.031 -3.141 62 HZ PHE 11 HZ PHE 11 -11.693 -10.164 -5.599 63 H LYS 12 H LYS 12 -9.302 -5.757 -1.733 64 HA LYS 12 HA LYS 12 -10.846 -3.475 -2.163 65 1HB LYS 12 2HB LYS 12 -11.623 -5.130 -4.054 66 2HB LYS 12 1HB LYS 12 -12.509 -5.902 -2.747 67 1HG LYS 12 2HG LYS 12 -13.744 -3.895 -2.316 68 2HG LYS 12 1HG LYS 12 -12.760 -2.994 -3.473 69 1HD LYS 12 2HD LYS 12 -13.574 -4.705 -5.200 70 2HD LYS 12 1HD LYS 12 -14.796 -5.134 -4.002 71 1HE LYS 12 2HE LYS 12 -15.677 -3.497 -5.567 72 2HE LYS 12 1HE LYS 12 -15.552 -2.804 -3.950 73 1HZ LYS 12 1HZ LYS 12 -14.303 -1.195 -4.784 74 2HZ LYS 12 2HZ LYS 12 -14.404 -1.871 -6.329 75 3HZ LYS 12 3HZ LYS 12 -13.141 -2.318 -5.293 76 H GLY 13 H GLY 13 -9.592 -4.452 0.044 77 1HA GLY 13 2HA GLY 13 -11.764 -4.616 1.894 78 2HA GLY 13 1HA GLY 13 -10.946 -6.160 1.730 79 H LYS 14 H LYS 14 -8.475 -6.021 2.009 80 HA LYS 14 HA LYS 14 -7.412 -3.879 3.535 81 1HB LYS 14 2HB LYS 14 -7.068 -5.345 5.629 82 2HB LYS 14 1HB LYS 14 -8.634 -4.588 5.395 83 1HG LYS 14 2HG LYS 14 -9.061 -6.786 6.132 84 2HG LYS 14 1HG LYS 14 -9.419 -6.773 4.406 85 1HD LYS 14 2HD LYS 14 -7.275 -7.804 3.928 86 2HD LYS 14 1HD LYS 14 -6.843 -7.745 5.632 87 1HE LYS 14 2HE LYS 14 -7.553 -9.965 5.178 88 2HE LYS 14 1HE LYS 14 -8.852 -9.190 6.085 89 1HZ LYS 14 1HZ LYS 14 -8.816 -10.152 3.344 90 2HZ LYS 14 2HZ LYS 14 -9.592 -8.663 3.578 91 3HZ LYS 14 3HZ LYS 14 -10.107 -10.026 4.437 92 H CYS 15 H CYS 15 -5.210 -4.203 4.122 93 HA CYS 15 HA CYS 15 -3.803 -5.926 2.302 94 1HB CYS 15 2HB CYS 15 -2.616 -4.274 4.537 95 2HB CYS 15 1HB CYS 15 -1.829 -4.811 3.056 96 H TYR 16 H TYR 16 -2.699 -7.801 2.799 97 HA TYR 16 HA TYR 16 -3.274 -8.954 5.408 98 1HB TYR 16 2HB TYR 16 -2.080 -10.162 2.905 99 2HB TYR 16 1HB TYR 16 -2.351 -11.053 4.400 100 HD1 TYR 16 1HD TYR 16 -4.199 -8.946 1.925 101 HD2 TYR 16 2HD TYR 16 -4.353 -12.184 4.680 102 HE1 TYR 16 1HE TYR 16 -6.514 -9.405 1.245 103 HE2 TYR 16 2HE TYR 16 -6.669 -12.655 4.002 104 HH TYR 16 HH TYR 16 -8.041 -11.838 1.410 105 H THR 17 H THR 17 -0.477 -8.215 3.371 106 HA THR 17 HA THR 17 1.501 -9.126 5.143 107 HB THR 17 HB THR 17 1.702 -6.956 3.046 108 HG1 THR 17 1HG THR 17 1.003 -9.016 2.236 109 1HG2 THR 17 1HG2 THR 17 3.992 -7.041 3.208 110 2HG2 THR 17 2HG2 THR 17 3.995 -8.680 3.859 111 3HG2 THR 17 3HG2 THR 17 3.558 -7.320 4.894 112 HA PRO 18 HA PRO 18 1.040 -6.119 8.427 113 1HB PRO 18 2HB PRO 18 3.722 -7.201 9.103 114 2HB PRO 18 1HB PRO 18 2.286 -7.041 10.117 115 1HG PRO 18 2HG PRO 18 3.044 -9.422 9.186 116 2HG PRO 18 1HG PRO 18 1.329 -8.986 9.302 117 1HD PRO 18 2HD PRO 18 3.101 -9.099 6.901 118 2HD PRO 18 1HD PRO 18 1.385 -9.526 7.059 119 H GLY 19 H GLY 19 1.643 -4.055 8.540 120 1HA GLY 19 2HA GLY 19 3.242 -2.294 8.523 121 2HA GLY 19 1HA GLY 19 4.253 -3.268 7.464 122 H CYS 20 H CYS 20 1.724 -3.930 5.862 123 HA CYS 20 HA CYS 20 1.966 -1.582 4.160 124 1HB CYS 20 2HB CYS 20 0.648 -4.244 3.725 125 2HB CYS 20 1HB CYS 20 0.559 -2.922 2.576 126 H SER 21 H SER 21 0.298 -0.369 3.427 127 HA SER 21 HA SER 21 -2.313 -0.644 4.728 128 1HB SER 21 2HB SER 21 -0.791 1.968 4.489 129 2HB SER 21 1HB SER 21 -2.381 1.743 5.221 130 HG SER 21 HG SER 21 -0.733 0.043 6.391 131 H CYS 22 H CYS 22 -4.044 0.177 3.465 132 HA CYS 22 HA CYS 22 -3.582 0.103 0.642 133 1HB CYS 22 2HB CYS 22 -5.647 -0.748 1.888 134 2HB CYS 22 1HB CYS 22 -6.147 0.933 2.005 135 H SER 23 H SER 23 -1.999 1.975 0.985 136 HA SER 23 HA SER 23 -2.885 4.597 1.417 137 1HB SER 23 2HB SER 23 -0.489 3.672 -0.186 138 2HB SER 23 1HB SER 23 -0.722 5.273 0.518 139 HG SER 23 HG SER 23 -0.439 4.460 2.512 140 H LYS 24 H LYS 24 -2.829 2.625 -1.490 141 HA LYS 24 HA LYS 24 -4.518 4.566 -2.775 142 1HB LYS 24 2HB LYS 24 -3.161 4.809 -4.797 143 2HB LYS 24 1HB LYS 24 -2.333 5.450 -3.387 144 1HG LYS 24 2HG LYS 24 -0.834 3.626 -3.320 145 2HG LYS 24 1HG LYS 24 -1.796 2.701 -4.475 146 1HD LYS 24 2HD LYS 24 -0.209 5.210 -5.010 147 2HD LYS 24 1HD LYS 24 0.121 3.587 -5.618 148 1HE LYS 24 2HE LYS 24 -2.237 5.340 -6.304 149 2HE LYS 24 1HE LYS 24 -0.896 4.912 -7.364 150 1HZ LYS 24 1HZ LYS 24 -2.335 3.344 -8.051 151 2HZ LYS 24 2HZ LYS 24 -3.239 3.362 -6.621 152 3HZ LYS 24 3HZ LYS 24 -1.788 2.497 -6.692 153 H TYR 25 H TYR 25 -6.110 3.385 -3.361 154 HA TYR 25 HA TYR 25 -6.215 0.642 -3.714 155 1HB TYR 25 2HB TYR 25 -8.100 2.315 -3.372 156 2HB TYR 25 1HB TYR 25 -7.997 2.655 -5.094 157 HD1 TYR 25 1HD TYR 25 -9.415 1.511 -6.507 158 HD2 TYR 25 2HD TYR 25 -8.372 -0.255 -2.779 159 HE1 TYR 25 1HE TYR 25 -10.974 -0.338 -6.953 160 HE2 TYR 25 2HE TYR 25 -9.923 -2.110 -3.218 161 HH TYR 25 HH TYR 25 -10.920 -3.215 -5.285 162 HA PRO 26 HA PRO 26 -6.744 -0.941 -4.508 163 1HB PRO 26 2HB PRO 26 -6.692 -3.102 -6.069 164 2HB PRO 26 1HB PRO 26 -7.841 -1.794 -6.376 165 1HG PRO 26 2HG PRO 26 -5.453 -2.579 -7.911 166 2HG PRO 26 1HG PRO 26 -6.852 -1.625 -8.426 167 1HD PRO 26 2HD PRO 26 -4.251 -0.701 -7.468 168 2HD PRO 26 1HD PRO 26 -5.561 0.235 -8.221 169 H LEU 27 H LEU 27 -3.837 -0.210 -4.523 170 HA LEU 27 HA LEU 27 -2.766 -2.853 -3.799 171 1HB LEU 27 2HB LEU 27 -0.521 -2.063 -4.481 172 2HB LEU 27 1HB LEU 27 -1.651 -2.232 -5.810 173 HG LEU 27 HG LEU 27 -1.365 0.457 -4.574 174 1HD1 LEU 27 1HD1 LEU 27 0.950 -0.532 -4.895 175 2HD1 LEU 27 2HD1 LEU 27 0.618 0.984 -5.734 176 3HD1 LEU 27 3HD1 LEU 27 0.594 -0.540 -6.622 177 1HD2 LEU 27 1HD2 LEU 27 -1.716 -0.545 -7.396 178 2HD2 LEU 27 2HD2 LEU 27 -1.681 1.150 -6.910 179 3HD2 LEU 27 3HD2 LEU 27 -2.983 0.099 -6.351 180 H CYS 28 H CYS 28 -1.111 -2.862 -2.148 181 HA CYS 28 HA CYS 28 -1.610 -0.731 -0.206 182 1HB CYS 28 2HB CYS 28 -0.540 -3.533 0.140 183 2HB CYS 28 1HB CYS 28 -0.738 -2.369 1.445 184 H ALA 29 H ALA 29 0.076 0.169 1.004 185 HA ALA 29 HA ALA 29 2.728 -0.010 -0.268 186 1HB ALA 29 1HB ALA 29 1.959 2.152 -0.744 187 2HB ALA 29 2HB ALA 29 2.991 2.362 0.671 188 3HB ALA 29 3HB ALA 29 1.238 2.344 0.853 189 H LYS 30 H LYS 30 4.418 -0.463 1.037 190 HA LYS 30 HA LYS 30 3.893 -1.243 3.760 191 1HB LYS 30 2HB LYS 30 5.401 -2.548 2.304 192 2HB LYS 30 1HB LYS 30 6.482 -1.169 2.186 193 1HG LYS 30 2HG LYS 30 7.505 -2.538 3.749 194 2HG LYS 30 1HG LYS 30 6.660 -1.349 4.742 195 1HD LYS 30 2HD LYS 30 6.348 -3.576 5.655 196 2HD LYS 30 1HD LYS 30 4.815 -2.948 5.051 197 1HE LYS 30 2HE LYS 30 5.127 -5.299 4.444 198 2HE LYS 30 1HE LYS 30 5.053 -4.265 3.019 199 1HZ LYS 30 1HZ LYS 30 7.715 -4.746 4.052 200 2HZ LYS 30 2HZ LYS 30 7.155 -4.755 2.453 201 3HZ LYS 30 3HZ LYS 30 6.933 -6.114 3.438 202 H ASN 31 H ASN 31 3.303 0.686 4.699 203 HA ASN 31 HA ASN 31 3.545 2.634 5.811 204 1HB ASN 31 2HB ASN 31 5.515 1.175 6.763 205 2HB ASN 31 1HB ASN 31 6.532 2.288 5.856 206 1HD2 ASN 31 1HD2 ASN 31 5.329 1.697 8.802 207 2HD2 ASN 31 2HD2 ASN 31 5.301 3.294 9.454 Start of MODEL 6 1 H GLY 1 H GLY 1 3.336 3.135 2.661 2 1HA GLY 1 2HA GLY 1 3.277 4.964 1.058 3 2HA GLY 1 1HA GLY 1 4.769 5.557 1.774 4 H SER 2 H SER 2 5.871 2.812 1.933 5 HA SER 2 HA SER 2 7.009 2.755 -0.721 6 1HB SER 2 2HB SER 2 7.553 0.927 1.628 7 2HB SER 2 1HB SER 2 8.560 1.127 0.193 8 HG SER 2 HG SER 2 8.189 2.844 2.374 9 H ILE 3 H ILE 3 5.437 2.001 -2.129 10 HA ILE 3 HA ILE 3 3.786 -0.237 -1.670 11 HB ILE 3 HB ILE 3 4.626 1.072 -4.256 12 1HG1 ILE 3 2HG1 ILE 3 2.086 1.615 -4.200 13 2HG1 ILE 3 1HG1 ILE 3 2.195 1.211 -2.492 14 1HG2 ILE 3 1HG2 ILE 3 4.136 -1.296 -4.663 15 2HG2 ILE 3 2HG2 ILE 3 2.930 -0.237 -5.395 16 3HG2 ILE 3 3HG2 ILE 3 2.559 -1.094 -3.899 17 1HD1 ILE 3 1HD1 ILE 3 4.298 3.005 -3.099 18 2HD1 ILE 3 2HD1 ILE 3 2.894 3.252 -2.060 19 3HD1 ILE 3 3HD1 ILE 3 2.803 3.651 -3.776 20 HA PRO 4 HA PRO 4 7.030 -2.660 -4.571 21 1HB PRO 4 2HB PRO 4 9.437 -1.235 -3.530 22 2HB PRO 4 1HB PRO 4 9.146 -1.942 -5.124 23 1HG PRO 4 2HG PRO 4 9.000 0.680 -4.790 24 2HG PRO 4 1HG PRO 4 7.821 -0.160 -5.816 25 1HD PRO 4 2HD PRO 4 7.501 0.921 -3.052 26 2HD PRO 4 1HD PRO 4 6.339 0.886 -4.392 27 H ALA 5 H ALA 5 7.642 -1.539 -1.297 28 HA ALA 5 HA ALA 5 9.225 -3.694 -0.431 29 1HB ALA 5 1HB ALA 5 8.323 -1.354 0.686 30 2HB ALA 5 2HB ALA 5 9.247 -2.606 1.516 31 3HB ALA 5 3HB ALA 5 7.488 -2.589 1.627 32 H CYS 6 H CYS 6 5.710 -3.161 -0.147 33 HA CYS 6 HA CYS 6 5.306 -5.807 0.931 34 1HB CYS 6 2HB CYS 6 3.099 -4.045 -0.091 35 2HB CYS 6 1HB CYS 6 3.065 -5.205 1.233 36 H GLY 7 H GLY 7 4.483 -4.110 -2.084 37 1HA GLY 7 2HA GLY 7 4.006 -4.891 -4.192 38 2HA GLY 7 1HA GLY 7 4.887 -6.348 -3.748 39 H GLU 8 H GLU 8 2.115 -5.237 -1.971 40 HA GLU 8 HA GLU 8 0.667 -7.645 -2.788 41 1HB GLU 8 2HB GLU 8 1.158 -7.277 -0.371 42 2HB GLU 8 1HB GLU 8 0.162 -5.830 -0.428 43 1HG GLU 8 2HG GLU 8 -1.754 -7.258 -1.118 44 2HG GLU 8 1HG GLU 8 -0.730 -8.670 -0.851 45 H SER 9 H SER 9 -1.355 -7.574 -3.626 46 HA SER 9 HA SER 9 -2.266 -5.001 -4.629 47 1HB SER 9 2HB SER 9 -3.424 -7.755 -5.127 48 2HB SER 9 1HB SER 9 -3.739 -6.286 -6.053 49 HG SER 9 HG SER 9 -1.090 -6.773 -5.914 50 H CYS 10 H CYS 10 -3.841 -3.887 -3.678 51 HA CYS 10 HA CYS 10 -5.218 -5.058 -1.404 52 1HB CYS 10 2HB CYS 10 -4.280 -2.871 -1.060 53 2HB CYS 10 1HB CYS 10 -5.087 -2.243 -2.492 54 H PHE 11 H PHE 11 -7.236 -5.771 -1.456 55 HA PHE 11 HA PHE 11 -9.107 -4.754 -3.437 56 1HB PHE 11 2HB PHE 11 -9.772 -7.232 -3.886 57 2HB PHE 11 1HB PHE 11 -8.393 -6.547 -4.736 58 HD1 PHE 11 1HD PHE 11 -6.717 -8.060 -5.033 59 HD2 PHE 11 2HD PHE 11 -8.893 -8.137 -1.376 60 HE1 PHE 11 1HE PHE 11 -5.293 -9.896 -4.230 61 HE2 PHE 11 2HE PHE 11 -7.470 -9.973 -0.566 62 HZ PHE 11 HZ PHE 11 -5.668 -10.855 -1.993 63 H LYS 12 H LYS 12 -8.928 -4.404 -0.651 64 HA LYS 12 HA LYS 12 -11.580 -4.894 0.132 65 1HB LYS 12 2HB LYS 12 -11.222 -6.504 1.965 66 2HB LYS 12 1HB LYS 12 -10.864 -7.217 0.398 67 1HG LYS 12 2HG LYS 12 -8.480 -6.921 0.790 68 2HG LYS 12 1HG LYS 12 -8.821 -6.161 2.345 69 1HD LYS 12 2HD LYS 12 -8.200 -8.465 2.700 70 2HD LYS 12 1HD LYS 12 -9.909 -8.258 3.084 71 1HE LYS 12 2HE LYS 12 -10.518 -9.171 0.906 72 2HE LYS 12 1HE LYS 12 -8.812 -9.346 0.492 73 1HZ LYS 12 1HZ LYS 12 -8.534 -11.067 1.992 74 2HZ LYS 12 2HZ LYS 12 -10.084 -11.373 1.376 75 3HZ LYS 12 3HZ LYS 12 -9.908 -10.654 2.895 76 H GLY 13 H GLY 13 -8.942 -3.153 0.253 77 1HA GLY 13 2HA GLY 13 -8.405 -1.302 1.525 78 2HA GLY 13 1HA GLY 13 -9.730 -1.708 2.607 79 H LYS 14 H LYS 14 -8.709 -4.439 2.997 80 HA LYS 14 HA LYS 14 -6.772 -3.816 5.074 81 1HB LYS 14 2HB LYS 14 -8.044 -6.494 4.516 82 2HB LYS 14 1HB LYS 14 -7.312 -5.937 6.013 83 1HG LYS 14 2HG LYS 14 -9.912 -5.043 4.802 84 2HG LYS 14 1HG LYS 14 -9.666 -5.928 6.309 85 1HD LYS 14 2HD LYS 14 -8.524 -4.009 7.268 86 2HD LYS 14 1HD LYS 14 -8.706 -3.125 5.754 87 1HE LYS 14 2HE LYS 14 -10.964 -4.111 7.495 88 2HE LYS 14 1HE LYS 14 -10.394 -2.446 7.394 89 1HZ LYS 14 1HZ LYS 14 -12.354 -3.565 5.864 90 2HZ LYS 14 2HZ LYS 14 -11.021 -3.545 4.822 91 3HZ LYS 14 3HZ LYS 14 -11.555 -2.109 5.541 92 H CYS 15 H CYS 15 -4.720 -4.522 5.084 93 HA CYS 15 HA CYS 15 -3.804 -5.980 2.702 94 1HB CYS 15 2HB CYS 15 -2.218 -4.174 4.541 95 2HB CYS 15 1HB CYS 15 -1.602 -4.976 3.098 96 H TYR 16 H TYR 16 -2.545 -7.772 2.918 97 HA TYR 16 HA TYR 16 -2.762 -9.166 5.430 98 1HB TYR 16 2HB TYR 16 -1.564 -9.913 2.759 99 2HB TYR 16 1HB TYR 16 -1.536 -10.985 4.152 100 HD1 TYR 16 1HD TYR 16 -2.975 -12.741 3.689 101 HD2 TYR 16 2HD TYR 16 -4.251 -8.776 2.818 102 HE1 TYR 16 1HE TYR 16 -5.200 -13.593 3.085 103 HE2 TYR 16 2HE TYR 16 -6.481 -9.617 2.216 104 HH TYR 16 HH TYR 16 -7.173 -13.095 2.164 105 H THR 17 H THR 17 -0.219 -7.726 3.486 106 HA THR 17 HA THR 17 1.966 -8.598 5.028 107 HB THR 17 HB THR 17 3.008 -6.397 3.986 108 HG1 THR 17 1HG THR 17 0.719 -6.853 2.326 109 1HG2 THR 17 1HG2 THR 17 2.145 -8.740 2.286 110 2HG2 THR 17 2HG2 THR 17 3.554 -8.714 3.346 111 3HG2 THR 17 3HG2 THR 17 3.482 -7.640 1.950 112 HA PRO 18 HA PRO 18 1.157 -6.279 8.744 113 1HB PRO 18 2HB PRO 18 3.702 -6.700 9.779 114 2HB PRO 18 1HB PRO 18 2.305 -7.754 10.004 115 1HG PRO 18 2HG PRO 18 4.576 -7.994 8.088 116 2HG PRO 18 1HG PRO 18 3.700 -9.267 8.958 117 1HD PRO 18 2HD PRO 18 3.267 -8.777 6.350 118 2HD PRO 18 1HD PRO 18 1.955 -9.276 7.438 119 H GLY 19 H GLY 19 1.222 -4.194 8.987 120 1HA GLY 19 2HA GLY 19 2.225 -2.108 9.325 121 2HA GLY 19 1HA GLY 19 3.702 -2.725 8.603 122 H CYS 20 H CYS 20 1.641 -3.721 6.385 123 HA CYS 20 HA CYS 20 2.044 -1.318 4.790 124 1HB CYS 20 2HB CYS 20 0.935 -4.005 3.965 125 2HB CYS 20 1HB CYS 20 1.368 -2.687 2.886 126 H SER 21 H SER 21 0.379 -0.188 3.779 127 HA SER 21 HA SER 21 -2.329 -0.783 4.754 128 1HB SER 21 2HB SER 21 -1.315 1.022 6.116 129 2HB SER 21 1HB SER 21 -1.059 1.965 4.648 130 HG SER 21 HG SER 21 -3.197 1.931 6.157 131 H CYS 22 H CYS 22 -4.018 -0.176 3.422 132 HA CYS 22 HA CYS 22 -3.419 -0.096 0.607 133 1HB CYS 22 2HB CYS 22 -5.301 -1.412 1.640 134 2HB CYS 22 1HB CYS 22 -6.105 0.113 1.990 135 H SER 23 H SER 23 -2.292 2.083 1.549 136 HA SER 23 HA SER 23 -3.925 4.394 1.699 137 1HB SER 23 2HB SER 23 -0.973 4.257 1.039 138 2HB SER 23 1HB SER 23 -1.852 5.608 1.762 139 HG SER 23 HG SER 23 -2.376 3.790 3.412 140 H LYS 24 H LYS 24 -2.644 2.567 -0.917 141 HA LYS 24 HA LYS 24 -3.616 4.613 -2.783 142 1HB LYS 24 2HB LYS 24 -1.139 2.938 -3.211 143 2HB LYS 24 1HB LYS 24 -1.771 4.164 -4.298 144 1HG LYS 24 2HG LYS 24 -1.401 5.833 -2.451 145 2HG LYS 24 1HG LYS 24 -0.533 4.563 -1.590 146 1HD LYS 24 2HD LYS 24 1.028 5.976 -2.801 147 2HD LYS 24 1HD LYS 24 1.016 4.349 -3.482 148 1HE LYS 24 2HE LYS 24 -0.473 5.113 -5.270 149 2HE LYS 24 1HE LYS 24 -0.459 6.738 -4.588 150 1HZ LYS 24 1HZ LYS 24 1.534 5.391 -6.187 151 2HZ LYS 24 2HZ LYS 24 2.160 6.232 -4.861 152 3HZ LYS 24 3HZ LYS 24 1.224 7.045 -6.011 153 H TYR 25 H TYR 25 -5.521 3.183 -2.601 154 HA TYR 25 HA TYR 25 -5.636 0.519 -3.377 155 1HB TYR 25 2HB TYR 25 -7.500 1.950 -2.413 156 2HB TYR 25 1HB TYR 25 -7.724 2.613 -4.026 157 HD1 TYR 25 1HD TYR 25 -7.530 -0.714 -2.332 158 HD2 TYR 25 2HD TYR 25 -9.352 1.657 -5.357 159 HE1 TYR 25 1HE TYR 25 -9.041 -2.576 -2.872 160 HE2 TYR 25 2HE TYR 25 -10.870 -0.200 -5.905 161 HH TYR 25 HH TYR 25 -10.542 -3.033 -5.471 162 HA PRO 26 HA PRO 26 -6.336 -0.957 -4.385 163 1HB PRO 26 2HB PRO 26 -6.229 -2.864 -6.251 164 2HB PRO 26 1HB PRO 26 -7.548 -1.690 -6.207 165 1HG PRO 26 2HG PRO 26 -5.295 -1.909 -8.098 166 2HG PRO 26 1HG PRO 26 -6.875 -1.143 -8.316 167 1HD PRO 26 2HD PRO 26 -4.356 0.090 -7.616 168 2HD PRO 26 1HD PRO 26 -5.918 0.872 -7.933 169 H LEU 27 H LEU 27 -3.670 -0.038 -4.084 170 HA LEU 27 HA LEU 27 -2.312 -2.620 -3.956 171 1HB LEU 27 2HB LEU 27 -0.136 -1.447 -4.552 172 2HB LEU 27 1HB LEU 27 -1.243 -1.814 -5.859 173 HG LEU 27 HG LEU 27 -1.394 0.886 -4.627 174 1HD1 LEU 27 1HD1 LEU 27 0.529 1.703 -5.516 175 2HD1 LEU 27 2HD1 LEU 27 0.536 0.540 -6.841 176 3HD1 LEU 27 3HD1 LEU 27 1.070 0.048 -5.235 177 1HD2 LEU 27 1HD2 LEU 27 -2.982 0.385 -6.338 178 2HD2 LEU 27 2HD2 LEU 27 -1.723 -0.248 -7.400 179 3HD2 LEU 27 3HD2 LEU 27 -1.784 1.477 -7.033 180 H CYS 28 H CYS 28 -1.035 -2.945 -2.202 181 HA CYS 28 HA CYS 28 -1.419 -1.057 -0.028 182 1HB CYS 28 2HB CYS 28 -0.297 -3.861 -0.110 183 2HB CYS 28 1HB CYS 28 -0.408 -2.895 1.357 184 H ALA 29 H ALA 29 0.128 0.087 0.978 185 HA ALA 29 HA ALA 29 2.865 -0.125 -0.089 186 1HB ALA 29 1HB ALA 29 2.864 2.405 0.630 187 2HB ALA 29 2HB ALA 29 1.122 2.235 0.403 188 3HB ALA 29 3HB ALA 29 2.224 1.900 -0.934 189 H LYS 30 H LYS 30 4.507 -0.202 1.322 190 HA LYS 30 HA LYS 30 3.936 -0.577 4.126 191 1HB LYS 30 2HB LYS 30 5.611 -1.967 2.971 192 2HB LYS 30 1HB LYS 30 6.564 -0.534 2.615 193 1HG LYS 30 2HG LYS 30 7.555 -1.698 4.454 194 2HG LYS 30 1HG LYS 30 6.867 -0.185 5.044 195 1HD LYS 30 2HD LYS 30 4.920 -1.375 5.881 196 2HD LYS 30 1HD LYS 30 5.550 -2.893 5.235 197 1HE LYS 30 2HE LYS 30 7.498 -2.701 6.707 198 2HE LYS 30 1HE LYS 30 6.854 -1.195 7.358 199 1HZ LYS 30 1HZ LYS 30 5.191 -3.614 7.456 200 2HZ LYS 30 2HZ LYS 30 5.221 -2.281 8.499 201 3HZ LYS 30 3HZ LYS 30 6.449 -3.438 8.575 202 H ASN 31 H ASN 31 3.146 1.474 4.666 203 HA ASN 31 HA ASN 31 3.228 3.605 5.428 204 1HB ASN 31 2HB ASN 31 6.189 3.013 5.715 205 2HB ASN 31 1HB ASN 31 5.370 4.408 6.410 206 1HD2 ASN 31 1HD2 ASN 31 4.728 4.218 8.424 207 2HD2 ASN 31 2HD2 ASN 31 4.460 2.740 9.274 Start of MODEL 7 1 H GLY 1 H GLY 1 3.331 3.236 2.615 2 1HA GLY 1 2HA GLY 1 3.315 5.169 1.065 3 2HA GLY 1 1HA GLY 1 4.903 5.565 1.703 4 H SER 2 H SER 2 5.931 2.898 1.724 5 HA SER 2 HA SER 2 6.734 2.731 -1.034 6 1HB SER 2 2HB SER 2 7.467 0.962 1.309 7 2HB SER 2 1HB SER 2 8.293 1.020 -0.249 8 HG SER 2 HG SER 2 8.514 2.684 1.905 9 H ILE 3 H ILE 3 5.449 1.780 -2.477 10 HA ILE 3 HA ILE 3 3.573 -0.270 -1.800 11 HB ILE 3 HB ILE 3 4.412 0.884 -4.457 12 1HG1 ILE 3 2HG1 ILE 3 3.114 2.306 -2.827 13 2HG1 ILE 3 1HG1 ILE 3 2.332 2.065 -4.385 14 1HG2 ILE 3 1HG2 ILE 3 3.624 -1.529 -4.562 15 2HG2 ILE 3 2HG2 ILE 3 2.749 -0.366 -5.558 16 3HG2 ILE 3 3HG2 ILE 3 2.051 -0.928 -4.039 17 1HD1 ILE 3 1HD1 ILE 3 1.542 1.160 -1.697 18 2HD1 ILE 3 2HD1 ILE 3 1.227 0.050 -3.030 19 3HD1 ILE 3 3HD1 ILE 3 0.554 1.681 -3.061 20 HA PRO 4 HA PRO 4 6.563 -3.024 -4.636 21 1HB PRO 4 2HB PRO 4 9.110 -1.664 -3.907 22 2HB PRO 4 1HB PRO 4 8.634 -2.428 -5.428 23 1HG PRO 4 2HG PRO 4 8.671 0.214 -5.214 24 2HG PRO 4 1HG PRO 4 7.366 -0.600 -6.099 25 1HD PRO 4 2HD PRO 4 7.340 0.604 -3.363 26 2HD PRO 4 1HD PRO 4 6.079 0.614 -4.613 27 H ALA 5 H ALA 5 7.530 -1.631 -1.557 28 HA ALA 5 HA ALA 5 9.063 -3.770 -0.591 29 1HB ALA 5 1HB ALA 5 8.558 -2.816 1.662 30 2HB ALA 5 2HB ALA 5 7.468 -1.677 0.871 31 3HB ALA 5 3HB ALA 5 9.191 -1.654 0.496 32 H CYS 6 H CYS 6 5.589 -3.175 -0.496 33 HA CYS 6 HA CYS 6 5.076 -5.456 1.189 34 1HB CYS 6 2HB CYS 6 3.063 -3.903 -0.430 35 2HB CYS 6 1HB CYS 6 2.775 -4.864 1.018 36 H GLY 7 H GLY 7 4.508 -4.625 -2.217 37 1HA GLY 7 2HA GLY 7 4.274 -5.960 -4.073 38 2HA GLY 7 1HA GLY 7 4.981 -7.264 -3.128 39 H GLU 8 H GLU 8 2.019 -5.477 -2.418 40 HA GLU 8 HA GLU 8 0.400 -7.785 -3.167 41 1HB GLU 8 2HB GLU 8 1.008 -8.093 -0.777 42 2HB GLU 8 1HB GLU 8 0.283 -6.533 -0.414 43 1HG GLU 8 2HG GLU 8 -1.887 -7.396 -1.222 44 2HG GLU 8 1HG GLU 8 -1.137 -8.972 -1.460 45 H SER 9 H SER 9 -1.561 -7.241 -3.930 46 HA SER 9 HA SER 9 -2.184 -4.393 -4.088 47 1HB SER 9 2HB SER 9 -3.463 -6.695 -5.582 48 2HB SER 9 1HB SER 9 -3.603 -4.976 -5.954 49 HG SER 9 HG SER 9 -1.394 -4.961 -6.459 50 H CYS 10 H CYS 10 -3.716 -3.541 -2.843 51 HA CYS 10 HA CYS 10 -5.459 -5.289 -1.309 52 1HB CYS 10 2HB CYS 10 -6.093 -3.189 -0.127 53 2HB CYS 10 1HB CYS 10 -4.370 -3.525 -0.073 54 H PHE 11 H PHE 11 -6.146 -5.551 -3.847 55 HA PHE 11 HA PHE 11 -7.894 -3.754 -5.014 56 1HB PHE 11 2HB PHE 11 -8.943 -5.965 -5.995 57 2HB PHE 11 1HB PHE 11 -7.334 -5.435 -6.463 58 HD1 PHE 11 1HD PHE 11 -5.758 -7.069 -6.602 59 HD2 PHE 11 2HD PHE 11 -8.866 -7.487 -3.725 60 HE1 PHE 11 1HE PHE 11 -4.833 -9.245 -5.925 61 HE2 PHE 11 2HE PHE 11 -7.943 -9.662 -3.039 62 HZ PHE 11 HZ PHE 11 -5.924 -10.543 -4.139 63 H LYS 12 H LYS 12 -8.535 -6.067 -2.457 64 HA LYS 12 HA LYS 12 -11.325 -5.133 -2.394 65 1HB LYS 12 2HB LYS 12 -10.103 -7.685 -1.330 66 2HB LYS 12 1HB LYS 12 -11.761 -7.188 -1.025 67 1HG LYS 12 2HG LYS 12 -12.227 -7.260 -3.422 68 2HG LYS 12 1HG LYS 12 -10.563 -7.761 -3.728 69 1HD LYS 12 2HD LYS 12 -12.041 -9.690 -3.747 70 2HD LYS 12 1HD LYS 12 -10.937 -9.779 -2.375 71 1HE LYS 12 2HE LYS 12 -12.706 -8.905 -0.912 72 2HE LYS 12 1HE LYS 12 -13.806 -8.851 -2.288 73 1HZ LYS 12 1HZ LYS 12 -14.348 -10.931 -1.814 74 2HZ LYS 12 2HZ LYS 12 -13.162 -11.036 -0.612 75 3HZ LYS 12 3HZ LYS 12 -12.776 -11.417 -2.214 76 H GLY 13 H GLY 13 -9.066 -3.677 -1.309 77 1HA GLY 13 2HA GLY 13 -8.493 -2.508 0.583 78 2HA GLY 13 1HA GLY 13 -10.113 -2.876 1.155 79 H LYS 14 H LYS 14 -7.366 -5.020 0.482 80 HA LYS 14 HA LYS 14 -7.201 -5.677 3.313 81 1HB LYS 14 2HB LYS 14 -8.716 -7.314 2.493 82 2HB LYS 14 1HB LYS 14 -7.735 -7.599 1.067 83 1HG LYS 14 2HG LYS 14 -6.698 -8.215 3.812 84 2HG LYS 14 1HG LYS 14 -7.716 -9.356 2.924 85 1HD LYS 14 2HD LYS 14 -6.096 -9.062 1.012 86 2HD LYS 14 1HD LYS 14 -5.032 -8.257 2.148 87 1HE LYS 14 2HE LYS 14 -4.985 -10.259 3.546 88 2HE LYS 14 1HE LYS 14 -6.074 -11.077 2.424 89 1HZ LYS 14 1HZ LYS 14 -3.523 -11.435 2.254 90 2HZ LYS 14 2HZ LYS 14 -3.535 -9.959 1.420 91 3HZ LYS 14 3HZ LYS 14 -4.439 -11.273 0.844 92 H CYS 15 H CYS 15 -5.215 -6.074 4.037 93 HA CYS 15 HA CYS 15 -3.042 -6.482 2.117 94 1HB CYS 15 2HB CYS 15 -2.987 -4.574 4.473 95 2HB CYS 15 1HB CYS 15 -1.610 -4.976 3.458 96 H TYR 16 H TYR 16 -1.749 -8.137 2.705 97 HA TYR 16 HA TYR 16 -2.354 -9.490 5.218 98 1HB TYR 16 2HB TYR 16 -2.146 -10.639 2.940 99 2HB TYR 16 1HB TYR 16 -0.414 -10.396 3.098 100 HD1 TYR 16 1HD TYR 16 0.595 -12.424 3.545 101 HD2 TYR 16 2HD TYR 16 -3.035 -11.457 5.541 102 HE1 TYR 16 1HE TYR 16 0.770 -14.497 4.857 103 HE2 TYR 16 2HE TYR 16 -2.869 -13.524 6.860 104 HH TYR 16 HH TYR 16 -0.506 -15.109 7.508 105 H THR 17 H THR 17 0.365 -8.058 3.515 106 HA THR 17 HA THR 17 2.314 -8.672 5.461 107 HB THR 17 HB THR 17 3.100 -8.199 3.297 108 HG1 THR 17 1HG THR 17 4.734 -6.965 3.872 109 1HG2 THR 17 1HG2 THR 17 2.767 -5.990 2.211 110 2HG2 THR 17 2HG2 THR 17 1.650 -5.577 3.511 111 3HG2 THR 17 3HG2 THR 17 1.282 -6.917 2.427 112 HA PRO 18 HA PRO 18 0.905 -5.951 8.691 113 1HB PRO 18 2HB PRO 18 3.562 -6.662 9.781 114 2HB PRO 18 1HB PRO 18 1.965 -6.825 10.515 115 1HG PRO 18 2HG PRO 18 3.317 -8.956 9.600 116 2HG PRO 18 1HG PRO 18 1.550 -8.849 9.492 117 1HD PRO 18 2HD PRO 18 3.604 -8.485 7.359 118 2HD PRO 18 1HD PRO 18 1.976 -9.180 7.254 119 H GLY 19 H GLY 19 1.131 -3.837 8.864 120 1HA GLY 19 2HA GLY 19 2.434 -1.870 9.211 121 2HA GLY 19 1HA GLY 19 3.757 -2.635 8.342 122 H CYS 20 H CYS 20 1.728 -3.571 6.249 123 HA CYS 20 HA CYS 20 1.884 -1.094 4.718 124 1HB CYS 20 2HB CYS 20 1.049 -3.853 3.845 125 2HB CYS 20 1HB CYS 20 1.228 -2.468 2.788 126 H SER 21 H SER 21 0.143 -0.068 3.800 127 HA SER 21 HA SER 21 -2.523 -0.933 4.678 128 1HB SER 21 2HB SER 21 -1.493 1.912 4.816 129 2HB SER 21 1HB SER 21 -3.095 1.353 5.300 130 HG SER 21 HG SER 21 -1.326 -0.141 6.571 131 H CYS 22 H CYS 22 -4.250 -0.206 3.360 132 HA CYS 22 HA CYS 22 -3.592 -0.023 0.579 133 1HB CYS 22 2HB CYS 22 -5.601 -1.210 1.671 134 2HB CYS 22 1HB CYS 22 -6.331 0.388 1.768 135 H SER 23 H SER 23 -2.380 2.095 1.580 136 HA SER 23 HA SER 23 -3.962 4.471 1.654 137 1HB SER 23 2HB SER 23 -0.967 4.259 1.273 138 2HB SER 23 1HB SER 23 -1.875 5.615 1.947 139 HG SER 23 HG SER 23 -2.091 4.577 3.803 140 H LYS 24 H LYS 24 -2.349 2.647 -0.798 141 HA LYS 24 HA LYS 24 -3.026 4.731 -2.760 142 1HB LYS 24 2HB LYS 24 -0.701 2.804 -2.930 143 2HB LYS 24 1HB LYS 24 -1.092 4.077 -4.080 144 1HG LYS 24 2HG LYS 24 -0.720 5.741 -2.270 145 2HG LYS 24 1HG LYS 24 -0.180 4.423 -1.232 146 1HD LYS 24 2HD LYS 24 1.615 3.906 -2.802 147 2HD LYS 24 1HD LYS 24 1.070 5.205 -3.865 148 1HE LYS 24 2HE LYS 24 1.559 6.850 -2.159 149 2HE LYS 24 1HE LYS 24 2.003 5.578 -1.021 150 1HZ LYS 24 1HZ LYS 24 3.428 5.637 -3.566 151 2HZ LYS 24 2HZ LYS 24 3.993 5.251 -2.015 152 3HZ LYS 24 3HZ LYS 24 3.783 6.871 -2.465 153 H TYR 25 H TYR 25 -5.046 3.361 -2.487 154 HA TYR 25 HA TYR 25 -5.421 0.777 -3.304 155 1HB TYR 25 2HB TYR 25 -7.166 2.334 -2.412 156 2HB TYR 25 1HB TYR 25 -7.226 3.111 -3.989 157 HD1 TYR 25 1HD TYR 25 -8.838 2.414 -5.492 158 HD2 TYR 25 2HD TYR 25 -7.575 -0.279 -2.451 159 HE1 TYR 25 1HE TYR 25 -10.550 0.803 -6.215 160 HE2 TYR 25 2HE TYR 25 -9.278 -1.898 -3.169 161 HH TYR 25 HH TYR 25 -10.780 -2.416 -4.750 162 HA PRO 26 HA PRO 26 -6.151 -0.653 -4.232 163 1HB PRO 26 2HB PRO 26 -6.076 -2.671 -5.983 164 2HB PRO 26 1HB PRO 26 -7.339 -1.437 -6.051 165 1HG PRO 26 2HG PRO 26 -5.031 -1.865 -7.841 166 2HG PRO 26 1HG PRO 26 -6.572 -1.057 -8.167 167 1HD PRO 26 2HD PRO 26 -4.038 0.134 -7.469 168 2HD PRO 26 1HD PRO 26 -5.567 0.947 -7.857 169 H LEU 27 H LEU 27 -3.445 0.197 -3.993 170 HA LEU 27 HA LEU 27 -2.090 -2.408 -3.816 171 1HB LEU 27 2HB LEU 27 -0.902 0.254 -4.573 172 2HB LEU 27 1HB LEU 27 0.046 -1.173 -4.191 173 HG LEU 27 HG LEU 27 -2.030 -1.264 -6.325 174 1HD1 LEU 27 1HD1 LEU 27 -0.608 0.648 -6.868 175 2HD1 LEU 27 2HD1 LEU 27 -0.305 -0.693 -7.974 176 3HD1 LEU 27 3HD1 LEU 27 0.829 -0.355 -6.665 177 1HD2 LEU 27 1HD2 LEU 27 -0.993 -3.191 -7.006 178 2HD2 LEU 27 2HD2 LEU 27 -0.697 -3.258 -5.268 179 3HD2 LEU 27 3HD2 LEU 27 0.574 -2.704 -6.359 180 H CYS 28 H CYS 28 -0.880 -2.812 -2.044 181 HA CYS 28 HA CYS 28 -1.474 -1.179 0.288 182 1HB CYS 28 2HB CYS 28 0.001 -3.812 0.022 183 2HB CYS 28 1HB CYS 28 -0.377 -3.020 1.546 184 H ALA 29 H ALA 29 -0.162 0.329 1.012 185 HA ALA 29 HA ALA 29 2.602 0.394 0.050 186 1HB ALA 29 1HB ALA 29 0.716 2.510 1.023 187 2HB ALA 29 2HB ALA 29 1.546 2.390 -0.529 188 3HB ALA 29 3HB ALA 29 2.452 2.798 0.928 189 H LYS 30 H LYS 30 4.239 0.097 1.350 190 HA LYS 30 HA LYS 30 3.865 -0.488 4.154 191 1HB LYS 30 2HB LYS 30 5.583 -1.386 2.255 192 2HB LYS 30 1HB LYS 30 6.590 -0.170 3.026 193 1HG LYS 30 2HG LYS 30 5.536 -2.737 4.088 194 2HG LYS 30 1HG LYS 30 7.158 -2.063 4.166 195 1HD LYS 30 2HD LYS 30 6.426 -0.451 5.836 196 2HD LYS 30 1HD LYS 30 4.779 -1.090 5.739 197 1HE LYS 30 2HE LYS 30 7.254 -2.450 6.767 198 2HE LYS 30 1HE LYS 30 5.752 -2.115 7.629 199 1HZ LYS 30 1HZ LYS 30 5.011 -4.102 7.018 200 2HZ LYS 30 2HZ LYS 30 6.440 -4.405 6.163 201 3HZ LYS 30 3HZ LYS 30 5.133 -3.666 5.385 202 H ASN 31 H ASN 31 3.014 1.681 4.510 203 HA ASN 31 HA ASN 31 3.135 3.775 5.365 204 1HB ASN 31 2HB ASN 31 5.071 2.582 6.696 205 2HB ASN 31 1HB ASN 31 6.118 3.568 5.682 206 1HD2 ASN 31 1HD2 ASN 31 4.689 3.436 8.592 207 2HD2 ASN 31 2HD2 ASN 31 4.574 5.119 8.954 Start of MODEL 8 1 H GLY 1 H GLY 1 3.311 3.292 2.522 2 1HA GLY 1 2HA GLY 1 3.538 5.149 0.938 3 2HA GLY 1 1HA GLY 1 5.005 5.599 1.795 4 H SER 2 H SER 2 5.743 2.703 2.015 5 HA SER 2 HA SER 2 7.201 2.575 -0.466 6 1HB SER 2 2HB SER 2 7.135 0.577 1.805 7 2HB SER 2 1HB SER 2 8.353 0.689 0.534 8 HG SER 2 HG SER 2 7.857 2.463 2.676 9 H ILE 3 H ILE 3 5.821 2.119 -2.134 10 HA ILE 3 HA ILE 3 3.777 0.166 -2.062 11 HB ILE 3 HB ILE 3 5.108 1.668 -4.295 12 1HG1 ILE 3 2HG1 ILE 3 2.726 2.412 -4.666 13 2HG1 ILE 3 1HG1 ILE 3 2.293 1.539 -3.203 14 1HG2 ILE 3 1HG2 ILE 3 4.545 0.211 -5.864 15 2HG2 ILE 3 2HG2 ILE 3 2.866 0.253 -5.325 16 3HG2 ILE 3 3HG2 ILE 3 3.988 -0.909 -4.620 17 1HD1 ILE 3 1HD1 ILE 3 4.496 3.326 -2.725 18 2HD1 ILE 3 2HD1 ILE 3 2.921 3.229 -1.933 19 3HD1 ILE 3 3HD1 ILE 3 3.110 4.176 -3.410 20 HA PRO 4 HA PRO 4 6.829 -2.678 -4.616 21 1HB PRO 4 2HB PRO 4 9.497 -2.172 -4.213 22 2HB PRO 4 1HB PRO 4 8.565 -1.582 -5.592 23 1HG PRO 4 2HG PRO 4 9.294 -0.171 -3.055 24 2HG PRO 4 1HG PRO 4 9.323 0.436 -4.723 25 1HD PRO 4 2HD PRO 4 7.327 1.060 -3.055 26 2HD PRO 4 1HD PRO 4 7.025 0.755 -4.779 27 H ALA 5 H ALA 5 7.460 -1.517 -1.407 28 HA ALA 5 HA ALA 5 8.988 -3.680 -0.455 29 1HB ALA 5 1HB ALA 5 9.138 -1.986 1.029 30 2HB ALA 5 2HB ALA 5 7.801 -2.848 1.791 31 3HB ALA 5 3HB ALA 5 7.478 -1.456 0.760 32 H CYS 6 H CYS 6 5.479 -3.077 -0.305 33 HA CYS 6 HA CYS 6 5.006 -5.632 0.939 34 1HB CYS 6 2HB CYS 6 2.898 -3.853 -0.262 35 2HB CYS 6 1HB CYS 6 2.736 -5.000 1.064 36 H GLY 7 H GLY 7 4.179 -4.174 -2.213 37 1HA GLY 7 2HA GLY 7 3.768 -5.144 -4.260 38 2HA GLY 7 1HA GLY 7 4.631 -6.561 -3.668 39 H GLU 8 H GLU 8 1.828 -5.205 -2.117 40 HA GLU 8 HA GLU 8 0.258 -7.570 -2.887 41 1HB GLU 8 2HB GLU 8 0.743 -7.844 -0.608 42 2HB GLU 8 1HB GLU 8 0.566 -6.131 -0.267 43 1HG GLU 8 2HG GLU 8 -1.838 -6.306 -0.545 44 2HG GLU 8 1HG GLU 8 -1.679 -8.016 -0.948 45 H SER 9 H SER 9 -1.760 -7.237 -3.661 46 HA SER 9 HA SER 9 -2.576 -4.471 -4.098 47 1HB SER 9 2HB SER 9 -3.714 -7.019 -5.270 48 2HB SER 9 1HB SER 9 -4.059 -5.373 -5.800 49 HG SER 9 HG SER 9 -1.966 -5.178 -6.521 50 H CYS 10 H CYS 10 -4.373 -3.573 -3.246 51 HA CYS 10 HA CYS 10 -6.057 -5.272 -1.528 52 1HB CYS 10 2HB CYS 10 -6.478 -3.218 -0.182 53 2HB CYS 10 1HB CYS 10 -4.793 -3.728 -0.163 54 H PHE 11 H PHE 11 -8.296 -4.886 -1.535 55 HA PHE 11 HA PHE 11 -9.393 -2.899 -3.335 56 1HB PHE 11 2HB PHE 11 -8.905 -4.781 -4.846 57 2HB PHE 11 1HB PHE 11 -9.842 -5.856 -3.815 58 HD1 PHE 11 1HD PHE 11 -11.768 -6.492 -4.869 59 HD2 PHE 11 2HD PHE 11 -10.478 -2.452 -5.214 60 HE1 PHE 11 1HE PHE 11 -13.795 -5.959 -6.160 61 HE2 PHE 11 2HE PHE 11 -12.504 -1.910 -6.503 62 HZ PHE 11 HZ PHE 11 -14.165 -3.665 -6.977 63 H LYS 12 H LYS 12 -10.235 -5.877 -1.569 64 HA LYS 12 HA LYS 12 -12.147 -4.394 0.038 65 1HB LYS 12 2HB LYS 12 -12.942 -6.715 -1.728 66 2HB LYS 12 1HB LYS 12 -13.909 -6.167 -0.368 67 1HG LYS 12 2HG LYS 12 -14.068 -3.939 -1.442 68 2HG LYS 12 1HG LYS 12 -13.215 -4.597 -2.839 69 1HD LYS 12 2HD LYS 12 -15.002 -6.248 -3.143 70 2HD LYS 12 1HD LYS 12 -15.857 -5.573 -1.753 71 1HE LYS 12 2HE LYS 12 -15.210 -4.147 -4.332 72 2HE LYS 12 1HE LYS 12 -16.798 -4.716 -3.820 73 1HZ LYS 12 1HZ LYS 12 -15.180 -2.559 -2.583 74 2HZ LYS 12 2HZ LYS 12 -16.579 -3.197 -1.878 75 3HZ LYS 12 3HZ LYS 12 -16.670 -2.403 -3.368 76 H GLY 13 H GLY 13 -10.189 -5.004 1.374 77 1HA GLY 13 2HA GLY 13 -10.912 -7.115 3.112 78 2HA GLY 13 1HA GLY 13 -9.569 -7.612 2.094 79 H LYS 14 H LYS 14 -7.987 -7.691 3.616 80 HA LYS 14 HA LYS 14 -7.099 -5.138 4.692 81 1HB LYS 14 2HB LYS 14 -8.377 -6.139 6.480 82 2HB LYS 14 1HB LYS 14 -7.563 -7.676 6.258 83 1HG LYS 14 2HG LYS 14 -6.047 -5.220 7.054 84 2HG LYS 14 1HG LYS 14 -6.889 -6.221 8.245 85 1HD LYS 14 2HD LYS 14 -5.678 -8.178 7.226 86 2HD LYS 14 1HD LYS 14 -4.685 -7.012 6.373 87 1HE LYS 14 2HE LYS 14 -3.525 -7.696 8.372 88 2HE LYS 14 1HE LYS 14 -4.040 -6.019 8.552 89 1HZ LYS 14 1HZ LYS 14 -5.911 -6.776 9.880 90 2HZ LYS 14 2HZ LYS 14 -4.450 -7.292 10.558 91 3HZ LYS 14 3HZ LYS 14 -5.417 -8.385 9.703 92 H CYS 15 H CYS 15 -4.955 -4.872 4.442 93 HA CYS 15 HA CYS 15 -3.462 -6.529 2.783 94 1HB CYS 15 2HB CYS 15 -2.306 -4.597 4.798 95 2HB CYS 15 1HB CYS 15 -1.583 -5.117 3.279 96 H TYR 16 H TYR 16 -2.392 -8.347 3.089 97 HA TYR 16 HA TYR 16 -2.268 -9.584 5.666 98 1HB TYR 16 2HB TYR 16 -1.161 -10.336 2.959 99 2HB TYR 16 1HB TYR 16 -0.897 -11.316 4.394 100 HD1 TYR 16 1HD TYR 16 -2.219 -13.196 4.441 101 HD2 TYR 16 2HD TYR 16 -3.859 -9.604 2.856 102 HE1 TYR 16 1HE TYR 16 -4.352 -14.351 4.039 103 HE2 TYR 16 2HE TYR 16 -5.996 -10.748 2.454 104 HH TYR 16 HH TYR 16 -6.919 -12.889 2.218 105 H THR 17 H THR 17 -0.044 -7.913 3.547 106 HA THR 17 HA THR 17 2.334 -8.545 4.907 107 HB THR 17 HB THR 17 1.989 -5.926 3.488 108 HG1 THR 17 1HG THR 17 0.959 -7.339 2.089 109 1HG2 THR 17 1HG2 THR 17 4.174 -6.510 4.450 110 2HG2 THR 17 2HG2 THR 17 4.243 -6.443 2.689 111 3HG2 THR 17 3HG2 THR 17 4.187 -8.002 3.510 112 HA PRO 18 HA PRO 18 1.451 -6.311 8.685 113 1HB PRO 18 2HB PRO 18 4.329 -6.806 9.135 114 2HB PRO 18 1HB PRO 18 2.946 -7.199 10.158 115 1HG PRO 18 2HG PRO 18 4.244 -9.099 8.789 116 2HG PRO 18 1HG PRO 18 2.488 -9.158 9.024 117 1HD PRO 18 2HD PRO 18 4.053 -8.397 6.601 118 2HD PRO 18 1HD PRO 18 2.511 -9.265 6.724 119 H GLY 19 H GLY 19 1.434 -4.231 8.969 120 1HA GLY 19 2HA GLY 19 2.317 -2.094 9.269 121 2HA GLY 19 1HA GLY 19 3.789 -2.614 8.466 122 H CYS 20 H CYS 20 1.603 -3.694 6.356 123 HA CYS 20 HA CYS 20 1.863 -1.266 4.768 124 1HB CYS 20 2HB CYS 20 0.780 -3.965 3.961 125 2HB CYS 20 1HB CYS 20 1.123 -2.617 2.884 126 H SER 21 H SER 21 0.181 -0.157 3.843 127 HA SER 21 HA SER 21 -2.515 -0.784 4.826 128 1HB SER 21 2HB SER 21 -1.285 1.983 4.747 129 2HB SER 21 1HB SER 21 -2.908 1.575 5.304 130 HG SER 21 HG SER 21 -1.240 0.043 6.646 131 H CYS 22 H CYS 22 -4.200 -0.182 3.463 132 HA CYS 22 HA CYS 22 -3.573 -0.131 0.673 133 1HB CYS 22 2HB CYS 22 -5.540 -1.309 1.750 134 2HB CYS 22 1HB CYS 22 -6.274 0.272 1.972 135 H SER 23 H SER 23 -2.360 2.061 1.572 136 HA SER 23 HA SER 23 -4.097 4.376 1.238 137 1HB SER 23 2HB SER 23 -1.114 4.336 1.750 138 2HB SER 23 1HB SER 23 -2.241 5.665 2.038 139 HG SER 23 HG SER 23 -2.949 4.712 3.818 140 H LYS 24 H LYS 24 -3.058 2.398 -0.923 141 HA LYS 24 HA LYS 24 -2.586 4.441 -2.936 142 1HB LYS 24 2HB LYS 24 -0.637 2.211 -2.350 143 2HB LYS 24 1HB LYS 24 -0.673 3.061 -3.885 144 1HG LYS 24 2HG LYS 24 -0.208 4.369 -1.215 145 2HG LYS 24 1HG LYS 24 1.063 3.886 -2.339 146 1HD LYS 24 2HD LYS 24 0.177 5.401 -4.023 147 2HD LYS 24 1HD LYS 24 -1.151 5.845 -2.948 148 1HE LYS 24 2HE LYS 24 0.480 6.733 -1.335 149 2HE LYS 24 1HE LYS 24 1.784 6.328 -2.450 150 1HZ LYS 24 1HZ LYS 24 0.201 7.784 -4.023 151 2HZ LYS 24 2HZ LYS 24 1.477 8.434 -3.122 152 3HZ LYS 24 3HZ LYS 24 -0.105 8.523 -2.531 153 H TYR 25 H TYR 25 -4.873 3.375 -2.981 154 HA TYR 25 HA TYR 25 -5.406 0.830 -3.844 155 1HB TYR 25 2HB TYR 25 -6.772 3.398 -4.668 156 2HB TYR 25 1HB TYR 25 -7.410 1.795 -5.007 157 HD1 TYR 25 1HD TYR 25 -6.398 4.021 -2.197 158 HD2 TYR 25 2HD TYR 25 -8.764 0.716 -3.451 159 HE1 TYR 25 1HE TYR 25 -7.528 4.009 -0.015 160 HE2 TYR 25 2HE TYR 25 -9.900 0.693 -1.272 161 HH TYR 25 HH TYR 25 -9.944 1.545 0.791 162 HA PRO 26 HA PRO 26 -6.166 -0.486 -4.842 163 1HB PRO 26 2HB PRO 26 -6.146 -2.530 -6.567 164 2HB PRO 26 1HB PRO 26 -7.175 -1.118 -6.824 165 1HG PRO 26 2HG PRO 26 -4.738 -1.945 -8.262 166 2HG PRO 26 1HG PRO 26 -6.047 -0.877 -8.791 167 1HD PRO 26 2HD PRO 26 -3.467 -0.166 -7.671 168 2HD PRO 26 1HD PRO 26 -4.720 0.903 -8.333 169 H LEU 27 H LEU 27 -3.508 -0.093 -4.037 170 HA LEU 27 HA LEU 27 -2.757 -2.842 -3.494 171 1HB LEU 27 2HB LEU 27 -0.409 -2.511 -4.085 172 2HB LEU 27 1HB LEU 27 -1.468 -2.371 -5.474 173 HG LEU 27 HG LEU 27 -1.305 0.204 -4.889 174 1HD1 LEU 27 1HD1 LEU 27 1.479 -0.519 -4.177 175 2HD1 LEU 27 2HD1 LEU 27 0.253 -0.602 -2.911 176 3HD1 LEU 27 3HD1 LEU 27 0.537 0.915 -3.767 177 1HD2 LEU 27 1HD2 LEU 27 0.892 0.120 -6.344 178 2HD2 LEU 27 2HD2 LEU 27 -0.676 -0.324 -7.020 179 3HD2 LEU 27 3HD2 LEU 27 0.445 -1.580 -6.496 180 H CYS 28 H CYS 28 -1.271 -3.100 -1.764 181 HA CYS 28 HA CYS 28 -1.653 -1.071 0.280 182 1HB CYS 28 2HB CYS 28 -0.482 -3.857 0.411 183 2HB CYS 28 1HB CYS 28 -0.750 -2.812 1.802 184 H ALA 29 H ALA 29 -0.119 0.264 0.984 185 HA ALA 29 HA ALA 29 2.619 -0.119 -0.021 186 1HB ALA 29 1HB ALA 29 2.764 2.081 -0.473 187 2HB ALA 29 2HB ALA 29 1.865 2.542 0.973 188 3HB ALA 29 3HB ALA 29 1.002 2.008 -0.470 189 H LYS 30 H LYS 30 4.292 -0.121 1.378 190 HA LYS 30 HA LYS 30 3.701 -0.447 4.176 191 1HB LYS 30 2HB LYS 30 5.383 -1.842 2.985 192 2HB LYS 30 1HB LYS 30 6.376 -0.411 2.759 193 1HG LYS 30 2HG LYS 30 7.095 -1.896 4.619 194 2HG LYS 30 1HG LYS 30 6.781 -0.228 5.100 195 1HD LYS 30 2HD LYS 30 4.734 -0.803 6.115 196 2HD LYS 30 1HD LYS 30 4.703 -2.386 5.339 197 1HE LYS 30 2HE LYS 30 6.875 -1.614 7.262 198 2HE LYS 30 1HE LYS 30 5.336 -2.271 7.821 199 1HZ LYS 30 1HZ LYS 30 5.767 -4.308 6.926 200 2HZ LYS 30 2HZ LYS 30 7.347 -3.831 7.315 201 3HZ LYS 30 3HZ LYS 30 6.796 -3.706 5.721 202 H ASN 31 H ASN 31 2.849 1.645 4.514 203 HA ASN 31 HA ASN 31 2.876 3.793 5.224 204 1HB ASN 31 2HB ASN 31 4.641 2.607 6.780 205 2HB ASN 31 1HB ASN 31 5.799 3.581 5.881 206 1HD2 ASN 31 1HD2 ASN 31 4.005 3.482 8.597 207 2HD2 ASN 31 2HD2 ASN 31 3.867 5.170 8.930 Start of MODEL 9 1 H GLY 1 H GLY 1 3.412 2.814 2.989 2 1HA GLY 1 2HA GLY 1 3.314 4.839 1.693 3 2HA GLY 1 1HA GLY 1 4.859 5.302 2.386 4 H SER 2 H SER 2 6.039 2.623 1.934 5 HA SER 2 HA SER 2 6.764 3.084 -0.841 6 1HB SER 2 2HB SER 2 8.515 2.707 0.871 7 2HB SER 2 1HB SER 2 7.888 1.079 1.126 8 HG SER 2 HG SER 2 9.699 1.740 -0.576 9 H ILE 3 H ILE 3 5.645 2.157 -2.404 10 HA ILE 3 HA ILE 3 3.962 -0.095 -1.985 11 HB ILE 3 HB ILE 3 4.745 1.382 -4.489 12 1HG1 ILE 3 2HG1 ILE 3 2.220 1.823 -4.465 13 2HG1 ILE 3 1HG1 ILE 3 2.237 1.191 -2.823 14 1HG2 ILE 3 1HG2 ILE 3 2.539 -0.219 -5.093 15 2HG2 ILE 3 2HG2 ILE 3 3.695 -1.288 -4.298 16 3HG2 ILE 3 3HG2 ILE 3 4.179 -0.371 -5.724 17 1HD1 ILE 3 1HD1 ILE 3 2.775 3.192 -2.076 18 2HD1 ILE 3 2HD1 ILE 3 2.806 3.813 -3.727 19 3HD1 ILE 3 3HD1 ILE 3 4.271 3.145 -3.007 20 HA PRO 4 HA PRO 4 7.229 -2.458 -4.772 21 1HB PRO 4 2HB PRO 4 9.681 -0.963 -4.015 22 2HB PRO 4 1HB PRO 4 9.219 -1.651 -5.575 23 1HG PRO 4 2HG PRO 4 9.125 0.978 -5.170 24 2HG PRO 4 1HG PRO 4 7.875 0.156 -6.125 25 1HD PRO 4 2HD PRO 4 7.764 1.143 -3.302 26 2HD PRO 4 1HD PRO 4 6.519 1.201 -4.567 27 H ALA 5 H ALA 5 8.152 -0.980 -1.704 28 HA ALA 5 HA ALA 5 9.545 -3.339 -0.794 29 1HB ALA 5 1HB ALA 5 10.489 -1.827 0.529 30 2HB ALA 5 2HB ALA 5 8.966 -1.698 1.411 31 3HB ALA 5 3HB ALA 5 9.298 -0.614 0.059 32 H CYS 6 H CYS 6 6.337 -2.410 -1.033 33 HA CYS 6 HA CYS 6 5.385 -3.737 1.334 34 1HB CYS 6 2HB CYS 6 4.143 -1.839 0.512 35 2HB CYS 6 1HB CYS 6 3.927 -2.612 -1.056 36 H GLY 7 H GLY 7 4.767 -4.301 -2.139 37 1HA GLY 7 2HA GLY 7 4.480 -6.267 -3.306 38 2HA GLY 7 1HA GLY 7 5.254 -7.104 -1.965 39 H GLU 8 H GLU 8 2.339 -5.115 -1.912 40 HA GLU 8 HA GLU 8 0.652 -7.459 -1.488 41 1HB GLU 8 2HB GLU 8 1.349 -6.882 0.753 42 2HB GLU 8 1HB GLU 8 0.989 -5.185 0.478 43 1HG GLU 8 2HG GLU 8 -0.726 -6.128 1.839 44 2HG GLU 8 1HG GLU 8 -1.400 -5.778 0.248 45 H SER 9 H SER 9 -1.544 -7.093 -1.929 46 HA SER 9 HA SER 9 -2.197 -4.436 -3.024 47 1HB SER 9 2HB SER 9 -3.076 -7.097 -4.177 48 2HB SER 9 1HB SER 9 -3.457 -5.498 -4.820 49 HG SER 9 HG SER 9 -0.770 -6.023 -4.444 50 H CYS 10 H CYS 10 -4.009 -3.570 -2.195 51 HA CYS 10 HA CYS 10 -5.507 -5.160 -0.299 52 1HB CYS 10 2HB CYS 10 -6.670 -2.909 0.099 53 2HB CYS 10 1HB CYS 10 -4.992 -3.061 0.577 54 H PHE 11 H PHE 11 -6.045 -6.309 -2.526 55 HA PHE 11 HA PHE 11 -8.291 -5.205 -3.940 56 1HB PHE 11 2HB PHE 11 -8.378 -7.597 -4.895 57 2HB PHE 11 1HB PHE 11 -6.963 -6.620 -5.259 58 HD1 PHE 11 1HD PHE 11 -7.949 -8.797 -2.367 59 HD2 PHE 11 2HD PHE 11 -5.077 -7.894 -5.375 60 HE1 PHE 11 1HE PHE 11 -6.486 -10.571 -1.498 61 HE2 PHE 11 2HE PHE 11 -3.610 -9.668 -4.510 62 HZ PHE 11 HZ PHE 11 -4.314 -11.010 -2.570 63 H LYS 12 H LYS 12 -8.648 -5.336 -1.145 64 HA LYS 12 HA LYS 12 -11.251 -6.385 -0.963 65 1HB LYS 12 2HB LYS 12 -9.378 -8.375 -0.670 66 2HB LYS 12 1HB LYS 12 -9.643 -7.879 0.996 67 1HG LYS 12 2HG LYS 12 -11.872 -8.509 0.965 68 2HG LYS 12 1HG LYS 12 -11.964 -8.460 -0.797 69 1HD LYS 12 2HD LYS 12 -10.474 -10.489 0.869 70 2HD LYS 12 1HD LYS 12 -11.972 -10.761 -0.024 71 1HE LYS 12 2HE LYS 12 -9.249 -10.137 -1.161 72 2HE LYS 12 1HE LYS 12 -10.144 -11.649 -1.306 73 1HZ LYS 12 1HZ LYS 12 -10.525 -9.110 -2.719 74 2HZ LYS 12 2HZ LYS 12 -11.904 -10.039 -2.388 75 3HZ LYS 12 3HZ LYS 12 -10.641 -10.700 -3.296 76 H GLY 13 H GLY 13 -9.680 -4.018 -0.460 77 1HA GLY 13 2HA GLY 13 -9.801 -2.264 1.014 78 2HA GLY 13 1HA GLY 13 -10.782 -3.271 2.063 79 H LYS 14 H LYS 14 -9.357 -5.164 3.035 80 HA LYS 14 HA LYS 14 -7.281 -3.803 4.516 81 1HB LYS 14 2HB LYS 14 -7.238 -5.964 5.847 82 2HB LYS 14 1HB LYS 14 -8.730 -5.040 5.892 83 1HG LYS 14 2HG LYS 14 -9.427 -7.249 5.685 84 2HG LYS 14 1HG LYS 14 -9.552 -6.612 4.048 85 1HD LYS 14 2HD LYS 14 -7.396 -7.632 3.490 86 2HD LYS 14 1HD LYS 14 -7.274 -8.267 5.132 87 1HE LYS 14 2HE LYS 14 -9.445 -8.939 3.149 88 2HE LYS 14 1HE LYS 14 -8.059 -9.960 3.529 89 1HZ LYS 14 1HZ LYS 14 -9.665 -10.828 4.886 90 2HZ LYS 14 2HZ LYS 14 -10.412 -9.339 5.173 91 3HZ LYS 14 3HZ LYS 14 -8.952 -9.712 5.939 92 H CYS 15 H CYS 15 -5.166 -4.474 4.757 93 HA CYS 15 HA CYS 15 -4.060 -5.861 2.438 94 1HB CYS 15 2HB CYS 15 -2.665 -4.325 4.647 95 2HB CYS 15 1HB CYS 15 -1.904 -4.958 3.191 96 H TYR 16 H TYR 16 -2.866 -7.752 2.609 97 HA TYR 16 HA TYR 16 -3.305 -9.275 5.026 98 1HB TYR 16 2HB TYR 16 -1.956 -10.021 2.419 99 2HB TYR 16 1HB TYR 16 -2.236 -11.134 3.753 100 HD1 TYR 16 1HD TYR 16 -4.052 -12.526 3.562 101 HD2 TYR 16 2HD TYR 16 -4.214 -8.719 1.667 102 HE1 TYR 16 1HE TYR 16 -6.262 -13.082 2.641 103 HE2 TYR 16 2HE TYR 16 -6.426 -9.265 0.745 104 HH TYR 16 HH TYR 16 -7.644 -12.311 0.583 105 H THR 17 H THR 17 -0.552 -8.105 3.139 106 HA THR 17 HA THR 17 1.435 -9.073 4.891 107 HB THR 17 HB THR 17 1.612 -6.825 2.879 108 HG1 THR 17 1HG THR 17 0.981 -8.819 1.933 109 1HG2 THR 17 1HG2 THR 17 3.818 -8.536 4.032 110 2HG2 THR 17 2HG2 THR 17 3.466 -6.887 4.546 111 3HG2 THR 17 3HG2 THR 17 3.994 -7.201 2.893 112 HA PRO 18 HA PRO 18 0.798 -6.161 8.239 113 1HB PRO 18 2HB PRO 18 3.151 -6.897 9.516 114 2HB PRO 18 1HB PRO 18 1.582 -7.672 9.748 115 1HG PRO 18 2HG PRO 18 3.878 -8.511 8.037 116 2HG PRO 18 1HG PRO 18 2.769 -9.506 8.999 117 1HD PRO 18 2HD PRO 18 2.529 -9.307 6.335 118 2HD PRO 18 1HD PRO 18 1.104 -9.428 7.388 119 H GLY 19 H GLY 19 1.414 -4.109 8.428 120 1HA GLY 19 2HA GLY 19 3.062 -2.387 8.556 121 2HA GLY 19 1HA GLY 19 4.090 -3.340 7.495 122 H CYS 20 H CYS 20 1.615 -3.901 5.781 123 HA CYS 20 HA CYS 20 1.948 -1.485 4.189 124 1HB CYS 20 2HB CYS 20 0.604 -4.104 3.589 125 2HB CYS 20 1HB CYS 20 0.598 -2.734 2.492 126 H SER 21 H SER 21 0.312 -0.223 3.445 127 HA SER 21 HA SER 21 -2.318 -0.501 4.718 128 1HB SER 21 2HB SER 21 -0.972 1.207 5.940 129 2HB SER 21 1HB SER 21 -0.774 2.096 4.431 130 HG SER 21 HG SER 21 -2.612 2.576 6.049 131 H CYS 22 H CYS 22 -4.039 0.121 3.403 132 HA CYS 22 HA CYS 22 -3.523 0.099 0.589 133 1HB CYS 22 2HB CYS 22 -5.506 -0.974 1.737 134 2HB CYS 22 1HB CYS 22 -6.166 0.643 1.950 135 H SER 23 H SER 23 -2.150 2.194 1.192 136 HA SER 23 HA SER 23 -3.730 4.629 1.073 137 1HB SER 23 2HB SER 23 -0.719 4.348 0.960 138 2HB SER 23 1HB SER 23 -1.654 5.773 1.422 139 HG SER 23 HG SER 23 -2.489 3.986 3.056 140 H LYS 24 H LYS 24 -3.240 2.472 -1.136 141 HA LYS 24 HA LYS 24 -3.200 4.341 -3.349 142 1HB LYS 24 2HB LYS 24 -1.091 2.197 -3.004 143 2HB LYS 24 1HB LYS 24 -1.459 2.935 -4.556 144 1HG LYS 24 2HG LYS 24 -0.580 4.499 -2.146 145 2HG LYS 24 1HG LYS 24 0.530 3.867 -3.364 146 1HD LYS 24 2HD LYS 24 -0.470 5.207 -5.071 147 2HD LYS 24 1HD LYS 24 -1.795 5.678 -4.003 148 1HE LYS 24 2HE LYS 24 1.111 6.378 -3.594 149 2HE LYS 24 1HE LYS 24 -0.110 7.457 -4.269 150 1HZ LYS 24 1HZ LYS 24 0.479 6.938 -1.562 151 2HZ LYS 24 2HZ LYS 24 -1.124 6.484 -1.870 152 3HZ LYS 24 3HZ LYS 24 -0.606 8.061 -2.211 153 H TYR 25 H TYR 25 -5.365 3.013 -2.583 154 HA TYR 25 HA TYR 25 -5.907 0.432 -3.241 155 1HB TYR 25 2HB TYR 25 -7.506 2.159 -2.320 156 2HB TYR 25 1HB TYR 25 -7.729 2.735 -3.967 157 HD1 TYR 25 1HD TYR 25 -7.837 -0.506 -2.097 158 HD2 TYR 25 2HD TYR 25 -9.587 1.960 -5.090 159 HE1 TYR 25 1HE TYR 25 -9.607 -2.179 -2.431 160 HE2 TYR 25 2HE TYR 25 -11.364 0.293 -5.431 161 HH TYR 25 HH TYR 25 -12.312 -1.583 -4.622 162 HA PRO 26 HA PRO 26 -6.741 -1.046 -4.014 163 1HB PRO 26 2HB PRO 26 -6.822 -3.182 -5.604 164 2HB PRO 26 1HB PRO 26 -8.063 -1.928 -5.688 165 1HG PRO 26 2HG PRO 26 -5.852 -2.519 -7.566 166 2HG PRO 26 1HG PRO 26 -7.424 -1.769 -7.880 167 1HD PRO 26 2HD PRO 26 -4.896 -0.473 -7.473 168 2HD PRO 26 1HD PRO 26 -6.475 0.282 -7.763 169 H LEU 27 H LEU 27 -3.897 -0.225 -4.328 170 HA LEU 27 HA LEU 27 -2.718 -2.844 -3.718 171 1HB LEU 27 2HB LEU 27 -0.528 -1.964 -4.581 172 2HB LEU 27 1HB LEU 27 -1.738 -2.333 -5.792 173 HG LEU 27 HG LEU 27 -1.633 0.472 -4.862 174 1HD1 LEU 27 1HD1 LEU 27 0.615 -0.914 -6.245 175 2HD1 LEU 27 2HD1 LEU 27 0.658 0.364 -5.031 176 3HD1 LEU 27 3HD1 LEU 27 0.215 0.744 -6.696 177 1HD2 LEU 27 1HD2 LEU 27 -1.519 0.024 -7.696 178 2HD2 LEU 27 2HD2 LEU 27 -2.803 0.756 -6.733 179 3HD2 LEU 27 3HD2 LEU 27 -2.767 -0.990 -6.972 180 H CYS 28 H CYS 28 -1.393 -2.964 -1.964 181 HA CYS 28 HA CYS 28 -1.639 -0.770 -0.095 182 1HB CYS 28 2HB CYS 28 -0.416 -3.512 0.243 183 2HB CYS 28 1HB CYS 28 -0.715 -2.357 1.535 184 H ALA 29 H ALA 29 0.058 0.158 1.040 185 HA ALA 29 HA ALA 29 2.687 0.021 -0.284 186 1HB ALA 29 1HB ALA 29 2.876 2.426 0.680 187 2HB ALA 29 2HB ALA 29 1.116 2.352 0.749 188 3HB ALA 29 3HB ALA 29 1.946 2.162 -0.795 189 H LYS 30 H LYS 30 4.394 -0.402 1.008 190 HA LYS 30 HA LYS 30 3.920 -1.117 3.762 191 1HB LYS 30 2HB LYS 30 5.406 -2.453 2.307 192 2HB LYS 30 1HB LYS 30 6.480 -1.074 2.140 193 1HG LYS 30 2HG LYS 30 7.511 -2.455 3.712 194 2HG LYS 30 1HG LYS 30 6.752 -1.184 4.670 195 1HD LYS 30 2HD LYS 30 6.403 -3.369 5.691 196 2HD LYS 30 1HD LYS 30 4.873 -2.675 5.158 197 1HE LYS 30 2HE LYS 30 5.020 -5.061 4.628 198 2HE LYS 30 1HE LYS 30 4.899 -4.075 3.173 199 1HZ LYS 30 1HZ LYS 30 7.534 -4.925 4.186 200 2HZ LYS 30 2HZ LYS 30 7.092 -4.486 2.611 201 3HZ LYS 30 3HZ LYS 30 6.598 -5.975 3.246 202 H ASN 31 H ASN 31 3.364 0.810 4.697 203 HA ASN 31 HA ASN 31 3.626 2.779 5.762 204 1HB ASN 31 2HB ASN 31 5.525 1.454 6.812 205 2HB ASN 31 1HB ASN 31 6.605 2.251 5.674 206 1HD2 ASN 31 1HD2 ASN 31 7.644 3.891 6.532 207 2HD2 ASN 31 2HD2 ASN 31 7.045 4.958 7.747 Start of MODEL 10 1 H GLY 1 H GLY 1 3.495 2.592 3.530 2 1HA GLY 1 2HA GLY 1 3.288 4.616 2.294 3 2HA GLY 1 1HA GLY 1 4.860 5.112 2.902 4 H SER 2 H SER 2 6.011 2.437 2.256 5 HA SER 2 HA SER 2 6.661 3.050 -0.499 6 1HB SER 2 2HB SER 2 7.752 0.914 1.346 7 2HB SER 2 1HB SER 2 8.411 1.347 -0.233 8 HG SER 2 HG SER 2 8.224 3.040 2.042 9 H ILE 3 H ILE 3 4.969 2.453 -1.782 10 HA ILE 3 HA ILE 3 3.428 0.131 -1.536 11 HB ILE 3 HB ILE 3 3.989 1.750 -4.028 12 1HG1 ILE 3 2HG1 ILE 3 1.513 2.427 -3.497 13 2HG1 ILE 3 1HG1 ILE 3 1.916 1.905 -1.866 14 1HG2 ILE 3 1HG2 ILE 3 1.829 0.712 -4.827 15 2HG2 ILE 3 2HG2 ILE 3 2.016 -0.458 -3.520 16 3HG2 ILE 3 3HG2 ILE 3 3.237 -0.350 -4.787 17 1HD1 ILE 3 1HD1 ILE 3 2.516 4.368 -3.188 18 2HD1 ILE 3 2HD1 ILE 3 4.007 3.579 -2.673 19 3HD1 ILE 3 3HD1 ILE 3 2.738 3.920 -1.496 20 HA PRO 4 HA PRO 4 6.261 -1.873 -5.024 21 1HB PRO 4 2HB PRO 4 8.867 -0.941 -4.926 22 2HB PRO 4 1HB PRO 4 7.658 -0.457 -6.119 23 1HG PRO 4 2HG PRO 4 8.507 0.929 -3.609 24 2HG PRO 4 1HG PRO 4 8.138 1.617 -5.203 25 1HD PRO 4 2HD PRO 4 6.377 1.761 -3.201 26 2HD PRO 4 1HD PRO 4 5.842 1.468 -4.870 27 H ALA 5 H ALA 5 7.514 -0.824 -1.918 28 HA ALA 5 HA ALA 5 9.284 -2.993 -1.507 29 1HB ALA 5 1HB ALA 5 8.666 -2.227 1.013 30 2HB ALA 5 2HB ALA 5 8.206 -0.787 0.104 31 3HB ALA 5 3HB ALA 5 9.850 -1.415 -0.013 32 H CYS 6 H CYS 6 5.875 -2.489 -0.737 33 HA CYS 6 HA CYS 6 5.698 -4.978 0.707 34 1HB CYS 6 2HB CYS 6 4.290 -2.971 1.246 35 2HB CYS 6 1HB CYS 6 3.421 -3.248 -0.261 36 H GLY 7 H GLY 7 4.400 -3.744 -2.380 37 1HA GLY 7 2HA GLY 7 4.082 -4.909 -4.363 38 2HA GLY 7 1HA GLY 7 4.659 -6.365 -3.568 39 H GLU 8 H GLU 8 2.782 -6.216 -1.376 40 HA GLU 8 HA GLU 8 0.707 -7.778 -2.343 41 1HB GLU 8 2HB GLU 8 1.485 -7.554 0.048 42 2HB GLU 8 1HB GLU 8 0.567 -6.057 0.132 43 1HG GLU 8 2HG GLU 8 -1.477 -7.338 -0.435 44 2HG GLU 8 1HG GLU 8 -0.521 -8.817 -0.362 45 H SER 9 H SER 9 -1.279 -7.401 -3.133 46 HA SER 9 HA SER 9 -1.998 -4.624 -3.697 47 1HB SER 9 2HB SER 9 -3.237 -7.152 -4.805 48 2HB SER 9 1HB SER 9 -3.409 -5.512 -5.433 49 HG SER 9 HG SER 9 -0.814 -6.080 -5.279 50 H CYS 10 H CYS 10 -3.672 -3.650 -2.689 51 HA CYS 10 HA CYS 10 -5.174 -5.206 -0.750 52 1HB CYS 10 2HB CYS 10 -6.088 -2.939 -0.088 53 2HB CYS 10 1HB CYS 10 -4.370 -3.176 0.159 54 H PHE 11 H PHE 11 -7.239 -5.742 -0.908 55 HA PHE 11 HA PHE 11 -8.648 -4.970 -3.356 56 1HB PHE 11 2HB PHE 11 -8.906 -7.336 -1.511 57 2HB PHE 11 1HB PHE 11 -10.191 -6.914 -2.637 58 HD1 PHE 11 1HD PHE 11 -6.499 -7.480 -2.617 59 HD2 PHE 11 2HD PHE 11 -10.191 -7.896 -4.691 60 HE1 PHE 11 1HE PHE 11 -5.346 -8.714 -4.409 61 HE2 PHE 11 2HE PHE 11 -9.047 -9.136 -6.487 62 HZ PHE 11 HZ PHE 11 -6.622 -9.545 -6.346 63 H LYS 12 H LYS 12 -11.090 -6.073 -1.806 64 HA LYS 12 HA LYS 12 -11.981 -3.476 -0.902 65 1HB LYS 12 2HB LYS 12 -13.471 -6.108 -0.962 66 2HB LYS 12 1HB LYS 12 -14.179 -4.517 -0.717 67 1HG LYS 12 2HG LYS 12 -12.847 -5.524 -3.223 68 2HG LYS 12 1HG LYS 12 -14.573 -5.250 -2.977 69 1HD LYS 12 2HD LYS 12 -14.135 -2.861 -2.646 70 2HD LYS 12 1HD LYS 12 -12.415 -3.140 -2.910 71 1HE LYS 12 2HE LYS 12 -13.438 -2.286 -4.932 72 2HE LYS 12 1HE LYS 12 -12.913 -3.952 -5.176 73 1HZ LYS 12 1HZ LYS 12 -15.277 -4.586 -4.631 74 2HZ LYS 12 2HZ LYS 12 -15.045 -3.798 -6.109 75 3HZ LYS 12 3HZ LYS 12 -15.670 -2.948 -4.788 76 H GLY 13 H GLY 13 -10.034 -4.039 0.768 77 1HA GLY 13 2HA GLY 13 -11.249 -4.055 3.296 78 2HA GLY 13 1HA GLY 13 -10.618 -5.664 2.984 79 H LYS 14 H LYS 14 -9.215 -5.351 4.775 80 HA LYS 14 HA LYS 14 -7.160 -3.333 4.588 81 1HB LYS 14 2HB LYS 14 -6.431 -4.344 6.775 82 2HB LYS 14 1HB LYS 14 -8.070 -3.707 6.766 83 1HG LYS 14 2HG LYS 14 -8.292 -5.720 7.888 84 2HG LYS 14 1HG LYS 14 -8.774 -6.138 6.246 85 1HD LYS 14 2HD LYS 14 -6.251 -6.719 5.960 86 2HD LYS 14 1HD LYS 14 -6.278 -6.803 7.711 87 1HE LYS 14 2HE LYS 14 -6.670 -9.004 7.000 88 2HE LYS 14 1HE LYS 14 -8.259 -8.384 7.448 89 1HZ LYS 14 1HZ LYS 14 -7.739 -9.591 5.128 90 2HZ LYS 14 2HZ LYS 14 -7.489 -7.978 4.677 91 3HZ LYS 14 3HZ LYS 14 -8.977 -8.456 5.331 92 H CYS 15 H CYS 15 -4.900 -3.877 4.718 93 HA CYS 15 HA CYS 15 -4.122 -5.875 2.843 94 1HB CYS 15 2HB CYS 15 -2.416 -4.216 4.716 95 2HB CYS 15 1HB CYS 15 -1.832 -5.132 3.330 96 H TYR 16 H TYR 16 -2.682 -7.663 3.264 97 HA TYR 16 HA TYR 16 -3.323 -8.934 5.811 98 1HB TYR 16 2HB TYR 16 -2.129 -10.016 3.255 99 2HB TYR 16 1HB TYR 16 -2.321 -10.977 4.717 100 HD1 TYR 16 1HD TYR 16 -4.372 -8.760 2.503 101 HD2 TYR 16 2HD TYR 16 -4.220 -12.273 4.899 102 HE1 TYR 16 1HE TYR 16 -6.688 -9.281 1.872 103 HE2 TYR 16 2HE TYR 16 -6.536 -12.806 4.270 104 HH TYR 16 HH TYR 16 -8.063 -12.020 1.992 105 H THR 17 H THR 17 -0.530 -8.009 3.871 106 HA THR 17 HA THR 17 1.398 -8.975 5.720 107 HB THR 17 HB THR 17 1.715 -6.887 3.554 108 HG1 THR 17 1HG THR 17 0.981 -8.946 2.780 109 1HG2 THR 17 1HG2 THR 17 3.543 -7.947 5.526 110 2HG2 THR 17 2HG2 THR 17 3.790 -6.657 4.347 111 3HG2 THR 17 3HG2 THR 17 4.083 -8.335 3.892 112 HA PRO 18 HA PRO 18 0.758 -5.799 8.823 113 1HB PRO 18 2HB PRO 18 3.368 -6.857 9.749 114 2HB PRO 18 1HB PRO 18 1.862 -6.643 10.643 115 1HG PRO 18 2HG PRO 18 2.685 -9.071 9.885 116 2HG PRO 18 1HG PRO 18 0.967 -8.635 9.883 117 1HD PRO 18 2HD PRO 18 2.863 -8.892 7.594 118 2HD PRO 18 1HD PRO 18 1.131 -9.277 7.678 119 H GLY 19 H GLY 19 1.334 -3.739 8.767 120 1HA GLY 19 2HA GLY 19 2.959 -1.986 8.792 121 2HA GLY 19 1HA GLY 19 4.044 -3.030 7.882 122 H CYS 20 H CYS 20 1.651 -3.794 6.135 123 HA CYS 20 HA CYS 20 2.001 -1.540 4.317 124 1HB CYS 20 2HB CYS 20 0.598 -4.156 3.796 125 2HB CYS 20 1HB CYS 20 1.076 -2.958 2.606 126 H SER 21 H SER 21 0.365 -0.318 3.512 127 HA SER 21 HA SER 21 -2.333 -0.724 4.591 128 1HB SER 21 2HB SER 21 -0.895 1.944 4.533 129 2HB SER 21 1HB SER 21 -2.525 1.643 5.138 130 HG SER 21 HG SER 21 -0.822 -0.024 6.348 131 H CYS 22 H CYS 22 -3.986 -0.061 3.201 132 HA CYS 22 HA CYS 22 -3.306 0.036 0.433 133 1HB CYS 22 2HB CYS 22 -5.382 -1.026 1.478 134 2HB CYS 22 1HB CYS 22 -6.027 0.605 1.610 135 H SER 23 H SER 23 -1.918 2.021 0.918 136 HA SER 23 HA SER 23 -3.069 4.551 1.337 137 1HB SER 23 2HB SER 23 -0.485 3.867 -0.094 138 2HB SER 23 1HB SER 23 -0.911 5.432 0.604 139 HG SER 23 HG SER 23 -0.790 4.566 2.626 140 H LYS 24 H LYS 24 -2.778 2.569 -1.486 141 HA LYS 24 HA LYS 24 -4.438 4.397 -2.961 142 1HB LYS 24 2HB LYS 24 -2.903 4.397 -4.958 143 2HB LYS 24 1HB LYS 24 -2.363 5.374 -3.603 144 1HG LYS 24 2HG LYS 24 -0.784 3.645 -2.957 145 2HG LYS 24 1HG LYS 24 -1.356 2.613 -4.269 146 1HD LYS 24 2HD LYS 24 0.715 3.734 -4.893 147 2HD LYS 24 1HD LYS 24 -0.623 4.287 -5.901 148 1HE LYS 24 2HE LYS 24 -0.841 6.287 -4.498 149 2HE LYS 24 1HE LYS 24 0.508 5.734 -3.507 150 1HZ LYS 24 1HZ LYS 24 0.520 6.976 -6.120 151 2HZ LYS 24 2HZ LYS 24 1.582 5.670 -5.956 152 3HZ LYS 24 3HZ LYS 24 1.700 6.992 -4.907 153 H TYR 25 H TYR 25 -5.973 3.084 -3.539 154 HA TYR 25 HA TYR 25 -5.804 0.301 -3.771 155 1HB TYR 25 2HB TYR 25 -7.882 1.670 -3.379 156 2HB TYR 25 1HB TYR 25 -7.838 2.127 -5.076 157 HD1 TYR 25 1HD TYR 25 -7.869 -0.938 -2.934 158 HD2 TYR 25 2HD TYR 25 -9.084 0.891 -6.578 159 HE1 TYR 25 1HE TYR 25 -9.174 -2.943 -3.499 160 HE2 TYR 25 2HE TYR 25 -10.392 -1.110 -7.152 161 HH TYR 25 HH TYR 25 -10.035 -3.880 -6.175 162 HA PRO 26 HA PRO 26 -6.056 -1.342 -4.484 163 1HB PRO 26 2HB PRO 26 -5.714 -3.513 -5.997 164 2HB PRO 26 1HB PRO 26 -7.066 -2.411 -6.288 165 1HG PRO 26 2HG PRO 26 -4.645 -2.857 -7.903 166 2HG PRO 26 1HG PRO 26 -6.191 -2.134 -8.376 167 1HD PRO 26 2HD PRO 26 -3.723 -0.812 -7.526 168 2HD PRO 26 1HD PRO 26 -5.175 -0.101 -8.263 169 H LEU 27 H LEU 27 -3.426 -0.203 -4.241 170 HA LEU 27 HA LEU 27 -1.843 -2.654 -3.858 171 1HB LEU 27 2HB LEU 27 -0.904 0.039 -4.802 172 2HB LEU 27 1HB LEU 27 0.178 -1.243 -4.283 173 HG LEU 27 HG LEU 27 -1.834 -1.696 -6.439 174 1HD1 LEU 27 1HD1 LEU 27 -0.719 0.035 -7.469 175 2HD1 LEU 27 2HD1 LEU 27 0.298 -1.331 -7.931 176 3HD1 LEU 27 3HD1 LEU 27 0.784 -0.279 -6.601 177 1HD2 LEU 27 1HD2 LEU 27 0.749 -3.014 -6.598 178 2HD2 LEU 27 2HD2 LEU 27 -0.877 -3.697 -6.650 179 3HD2 LEU 27 3HD2 LEU 27 -0.108 -3.367 -5.098 180 H CYS 28 H CYS 28 -0.829 -2.960 -2.038 181 HA CYS 28 HA CYS 28 -1.359 -1.144 0.172 182 1HB CYS 28 2HB CYS 28 -0.171 -3.921 0.047 183 2HB CYS 28 1HB CYS 28 -0.297 -2.992 1.536 184 H ALA 29 H ALA 29 0.071 0.215 0.977 185 HA ALA 29 HA ALA 29 2.794 0.192 -0.078 186 1HB ALA 29 1HB ALA 29 2.925 2.458 0.908 187 2HB ALA 29 2HB ALA 29 1.265 2.274 1.478 188 3HB ALA 29 3HB ALA 29 1.608 2.286 -0.253 189 H LYS 30 H LYS 30 4.442 -0.526 1.098 190 HA LYS 30 HA LYS 30 4.037 -1.392 3.822 191 1HB LYS 30 2HB LYS 30 5.414 -2.676 2.201 192 2HB LYS 30 1HB LYS 30 6.556 -1.341 2.137 193 1HG LYS 30 2HG LYS 30 7.551 -2.848 3.592 194 2HG LYS 30 1HG LYS 30 6.777 -1.691 4.677 195 1HD LYS 30 2HD LYS 30 4.910 -3.190 5.001 196 2HD LYS 30 1HD LYS 30 5.574 -4.319 3.821 197 1HE LYS 30 2HE LYS 30 7.599 -4.494 5.313 198 2HE LYS 30 1HE LYS 30 6.676 -3.603 6.525 199 1HZ LYS 30 1HZ LYS 30 5.609 -6.065 5.288 200 2HZ LYS 30 2HZ LYS 30 5.150 -5.334 6.744 201 3HZ LYS 30 3HZ LYS 30 6.639 -6.134 6.629 202 H ASN 31 H ASN 31 3.674 0.436 5.006 203 HA ASN 31 HA ASN 31 4.103 2.319 6.185 204 1HB ASN 31 2HB ASN 31 6.190 0.827 6.739 205 2HB ASN 31 1HB ASN 31 7.057 1.975 5.727 206 1HD2 ASN 31 1HD2 ASN 31 6.455 1.261 8.796 207 2HD2 ASN 31 2HD2 ASN 31 6.510 2.829 9.514 Start of MODEL 11 1 H GLY 1 H GLY 1 3.253 2.847 3.007 2 1HA GLY 1 2HA GLY 1 2.986 4.757 1.601 3 2HA GLY 1 1HA GLY 1 4.558 5.327 2.134 4 H SER 2 H SER 2 5.812 2.678 1.724 5 HA SER 2 HA SER 2 6.257 2.993 -1.134 6 1HB SER 2 2HB SER 2 8.189 2.880 0.416 7 2HB SER 2 1HB SER 2 7.715 1.240 0.857 8 HG SER 2 HG SER 2 9.355 1.731 -0.961 9 H ILE 3 H ILE 3 4.910 1.926 -2.420 10 HA ILE 3 HA ILE 3 3.516 -0.427 -1.688 11 HB ILE 3 HB ILE 3 3.963 0.734 -4.441 12 1HG1 ILE 3 2HG1 ILE 3 1.666 0.983 -2.487 13 2HG1 ILE 3 1HG1 ILE 3 2.784 2.262 -2.949 14 1HG2 ILE 3 1HG2 ILE 3 1.771 -0.611 -4.844 15 2HG2 ILE 3 2HG2 ILE 3 2.317 -1.563 -3.464 16 3HG2 ILE 3 3HG2 ILE 3 3.327 -1.439 -4.904 17 1HD1 ILE 3 1HD1 ILE 3 1.528 2.802 -4.683 18 2HD1 ILE 3 2HD1 ILE 3 0.326 1.649 -4.102 19 3HD1 ILE 3 3HD1 ILE 3 1.540 1.141 -5.276 20 HA PRO 4 HA PRO 4 6.709 -2.639 -4.763 21 1HB PRO 4 2HB PRO 4 9.226 -1.471 -4.500 22 2HB PRO 4 1HB PRO 4 8.148 -1.295 -5.888 23 1HG PRO 4 2HG PRO 4 8.568 0.536 -3.569 24 2HG PRO 4 1HG PRO 4 8.311 0.929 -5.279 25 1HD PRO 4 2HD PRO 4 6.340 1.195 -3.503 26 2HD PRO 4 1HD PRO 4 6.014 0.582 -5.138 27 H ALA 5 H ALA 5 7.667 -1.079 -1.747 28 HA ALA 5 HA ALA 5 9.460 -3.072 -0.865 29 1HB ALA 5 1HB ALA 5 9.749 -1.190 0.376 30 2HB ALA 5 2HB ALA 5 8.658 -2.053 1.459 31 3HB ALA 5 3HB ALA 5 8.029 -0.801 0.389 32 H CYS 6 H CYS 6 5.978 -2.656 -0.502 33 HA CYS 6 HA CYS 6 5.732 -4.967 1.210 34 1HB CYS 6 2HB CYS 6 4.218 -2.929 1.312 35 2HB CYS 6 1HB CYS 6 3.488 -3.504 -0.183 36 H GLY 7 H GLY 7 4.828 -4.110 -2.118 37 1HA GLY 7 2HA GLY 7 4.516 -5.415 -3.983 38 2HA GLY 7 1HA GLY 7 5.393 -6.687 -3.143 39 H GLU 8 H GLU 8 2.367 -5.118 -2.200 40 HA GLU 8 HA GLU 8 0.910 -7.593 -2.757 41 1HB GLU 8 2HB GLU 8 1.641 -7.736 -0.425 42 2HB GLU 8 1HB GLU 8 0.939 -6.159 -0.094 43 1HG GLU 8 2HG GLU 8 -1.284 -7.166 -0.772 44 2HG GLU 8 1HG GLU 8 -0.476 -8.731 -0.702 45 H SER 9 H SER 9 -1.242 -7.320 -3.222 46 HA SER 9 HA SER 9 -2.140 -4.547 -3.554 47 1HB SER 9 2HB SER 9 -2.118 -5.909 -5.610 48 2HB SER 9 1HB SER 9 -3.168 -7.097 -4.839 49 HG SER 9 HG SER 9 -3.875 -4.367 -5.202 50 H CYS 10 H CYS 10 -3.974 -3.832 -2.529 51 HA CYS 10 HA CYS 10 -4.994 -5.547 -0.423 52 1HB CYS 10 2HB CYS 10 -6.319 -3.321 0.048 53 2HB CYS 10 1HB CYS 10 -4.618 -3.461 0.465 54 H PHE 11 H PHE 11 -5.791 -4.760 -3.566 55 HA PHE 11 HA PHE 11 -7.504 -5.242 -4.948 56 1HB PHE 11 2HB PHE 11 -7.433 -7.449 -3.897 57 2HB PHE 11 1HB PHE 11 -8.520 -6.894 -2.630 58 HD1 PHE 11 1HD PHE 11 -8.555 -6.585 -6.353 59 HD2 PHE 11 2HD PHE 11 -10.566 -7.901 -2.839 60 HE1 PHE 11 1HE PHE 11 -10.488 -7.258 -7.716 61 HE2 PHE 11 2HE PHE 11 -12.502 -8.578 -4.197 62 HZ PHE 11 HZ PHE 11 -12.465 -8.258 -6.638 63 H LYS 12 H LYS 12 -9.185 -5.066 -1.800 64 HA LYS 12 HA LYS 12 -10.386 -2.549 -2.349 65 1HB LYS 12 2HB LYS 12 -11.652 -3.894 -3.973 66 2HB LYS 12 1HB LYS 12 -12.121 -5.012 -2.706 67 1HG LYS 12 2HG LYS 12 -13.905 -3.433 -3.377 68 2HG LYS 12 1HG LYS 12 -13.497 -3.359 -1.662 69 1HD LYS 12 2HD LYS 12 -11.891 -1.447 -2.414 70 2HD LYS 12 1HD LYS 12 -12.937 -1.384 -3.836 71 1HE LYS 12 2HE LYS 12 -13.676 0.195 -2.130 72 2HE LYS 12 1HE LYS 12 -14.882 -1.063 -2.397 73 1HZ LYS 12 1HZ LYS 12 -14.825 -1.365 -0.207 74 2HZ LYS 12 2HZ LYS 12 -13.439 -0.415 -0.018 75 3HZ LYS 12 3HZ LYS 12 -13.290 -2.057 -0.406 76 H GLY 13 H GLY 13 -9.014 -4.126 -0.213 77 1HA GLY 13 2HA GLY 13 -10.678 -3.216 1.942 78 2HA GLY 13 1HA GLY 13 -10.608 -4.967 1.843 79 H LYS 14 H LYS 14 -9.540 -5.318 3.711 80 HA LYS 14 HA LYS 14 -7.219 -3.883 4.492 81 1HB LYS 14 2HB LYS 14 -7.042 -5.733 6.229 82 2HB LYS 14 1HB LYS 14 -8.502 -4.761 6.257 83 1HG LYS 14 2HG LYS 14 -9.227 -6.957 6.593 84 2HG LYS 14 1HG LYS 14 -9.585 -6.627 4.901 85 1HD LYS 14 2HD LYS 14 -7.497 -7.781 4.268 86 2HD LYS 14 1HD LYS 14 -7.219 -8.159 5.965 87 1HE LYS 14 2HE LYS 14 -9.304 -9.436 6.024 88 2HE LYS 14 1HE LYS 14 -9.590 -9.048 4.328 89 1HZ LYS 14 1HZ LYS 14 -8.175 -10.624 3.658 90 2HZ LYS 14 2HZ LYS 14 -8.300 -11.244 5.229 91 3HZ LYS 14 3HZ LYS 14 -7.013 -10.225 4.824 92 H CYS 15 H CYS 15 -5.094 -4.590 4.639 93 HA CYS 15 HA CYS 15 -4.271 -6.322 2.466 94 1HB CYS 15 2HB CYS 15 -2.575 -4.784 4.444 95 2HB CYS 15 1HB CYS 15 -2.030 -5.510 2.936 96 H TYR 16 H TYR 16 -2.067 -7.571 3.218 97 HA TYR 16 HA TYR 16 -2.898 -9.227 5.514 98 1HB TYR 16 2HB TYR 16 -1.538 -10.058 2.946 99 2HB TYR 16 1HB TYR 16 -1.681 -11.108 4.354 100 HD1 TYR 16 1HD TYR 16 -3.523 -12.500 4.533 101 HD2 TYR 16 2HD TYR 16 -3.797 -9.049 2.061 102 HE1 TYR 16 1HE TYR 16 -5.762 -13.204 3.805 103 HE2 TYR 16 2HE TYR 16 -6.034 -9.745 1.325 104 HH TYR 16 HH TYR 16 -7.273 -12.175 1.209 105 H THR 17 H THR 17 -0.082 -8.066 3.677 106 HA THR 17 HA THR 17 1.826 -8.928 5.577 107 HB THR 17 HB THR 17 2.087 -6.709 3.541 108 HG1 THR 17 1HG THR 17 1.577 -8.641 2.502 109 1HG2 THR 17 1HG2 THR 17 3.808 -6.964 5.473 110 2HG2 THR 17 2HG2 THR 17 4.395 -6.816 3.817 111 3HG2 THR 17 3HG2 THR 17 4.329 -8.400 4.591 112 HA PRO 18 HA PRO 18 0.888 -6.015 8.835 113 1HB PRO 18 2HB PRO 18 3.283 -6.516 10.169 114 2HB PRO 18 1HB PRO 18 1.769 -7.391 10.408 115 1HG PRO 18 2HG PRO 18 4.144 -8.123 8.759 116 2HG PRO 18 1HG PRO 18 3.082 -9.163 9.728 117 1HD PRO 18 2HD PRO 18 2.883 -9.065 7.059 118 2HD PRO 18 1HD PRO 18 1.441 -9.226 8.086 119 H GLY 19 H GLY 19 1.269 -3.911 8.961 120 1HA GLY 19 2HA GLY 19 2.657 -1.999 9.110 121 2HA GLY 19 1HA GLY 19 3.908 -2.871 8.236 122 H CYS 20 H CYS 20 1.589 -3.740 6.334 123 HA CYS 20 HA CYS 20 1.969 -1.440 4.590 124 1HB CYS 20 2HB CYS 20 0.616 -4.073 3.996 125 2HB CYS 20 1HB CYS 20 1.076 -2.844 2.826 126 H SER 21 H SER 21 0.313 -0.264 3.650 127 HA SER 21 HA SER 21 -2.387 -0.638 4.741 128 1HB SER 21 2HB SER 21 -0.967 2.032 4.559 129 2HB SER 21 1HB SER 21 -2.594 1.748 5.179 130 HG SER 21 HG SER 21 -0.941 0.141 6.485 131 H CYS 22 H CYS 22 -4.025 -0.184 3.322 132 HA CYS 22 HA CYS 22 -3.368 -0.043 0.536 133 1HB CYS 22 2HB CYS 22 -5.282 -1.357 1.569 134 2HB CYS 22 1HB CYS 22 -6.114 0.177 1.783 135 H SER 23 H SER 23 -2.272 2.162 1.405 136 HA SER 23 HA SER 23 -3.967 4.448 1.490 137 1HB SER 23 2HB SER 23 -0.988 4.337 0.954 138 2HB SER 23 1HB SER 23 -1.911 5.713 1.563 139 HG SER 23 HG SER 23 -2.134 4.737 3.490 140 H LYS 24 H LYS 24 -2.157 2.800 -1.028 141 HA LYS 24 HA LYS 24 -3.150 4.784 -2.955 142 1HB LYS 24 2HB LYS 24 -0.775 2.945 -3.276 143 2HB LYS 24 1HB LYS 24 -1.285 4.203 -4.396 144 1HG LYS 24 2HG LYS 24 -0.917 5.846 -2.505 145 2HG LYS 24 1HG LYS 24 -0.117 4.529 -1.649 146 1HD LYS 24 2HD LYS 24 1.534 5.879 -2.786 147 2HD LYS 24 1HD LYS 24 1.448 4.287 -3.540 148 1HE LYS 24 2HE LYS 24 0.044 5.199 -5.318 149 2HE LYS 24 1HE LYS 24 0.101 6.789 -4.557 150 1HZ LYS 24 1HZ LYS 24 2.524 6.770 -4.875 151 2HZ LYS 24 2HZ LYS 24 1.684 6.686 -6.341 152 3HZ LYS 24 3HZ LYS 24 2.400 5.296 -5.698 153 H TYR 25 H TYR 25 -5.120 3.469 -2.692 154 HA TYR 25 HA TYR 25 -5.573 0.875 -3.396 155 1HB TYR 25 2HB TYR 25 -7.276 2.500 -2.590 156 2HB TYR 25 1HB TYR 25 -7.281 3.249 -4.182 157 HD1 TYR 25 1HD TYR 25 -8.749 2.481 -5.824 158 HD2 TYR 25 2HD TYR 25 -7.906 0.009 -2.465 159 HE1 TYR 25 1HE TYR 25 -10.483 0.900 -6.558 160 HE2 TYR 25 2HE TYR 25 -9.633 -1.577 -3.193 161 HH TYR 25 HH TYR 25 -10.716 -2.196 -5.454 162 HA PRO 26 HA PRO 26 -6.422 -0.563 -4.268 163 1HB PRO 26 2HB PRO 26 -6.450 -2.668 -5.910 164 2HB PRO 26 1HB PRO 26 -7.637 -1.368 -6.067 165 1HG PRO 26 2HG PRO 26 -5.318 -2.015 -7.782 166 2HG PRO 26 1HG PRO 26 -6.819 -1.170 -8.191 167 1HD PRO 26 2HD PRO 26 -4.258 -0.032 -7.538 168 2HD PRO 26 1HD PRO 26 -5.758 0.815 -7.962 169 H LEU 27 H LEU 27 -3.493 0.168 -4.645 170 HA LEU 27 HA LEU 27 -2.331 -2.480 -4.136 171 1HB LEU 27 2HB LEU 27 -1.108 0.087 -5.105 172 2HB LEU 27 1HB LEU 27 -0.138 -1.252 -4.516 173 HG LEU 27 HG LEU 27 -2.129 -1.602 -6.721 174 1HD1 LEU 27 1HD1 LEU 27 -0.842 -0.478 -8.144 175 2HD1 LEU 27 2HD1 LEU 27 0.514 -1.533 -7.745 176 3HD1 LEU 27 3HD1 LEU 27 0.250 -0.050 -6.827 177 1HD2 LEU 27 1HD2 LEU 27 -0.772 -3.433 -5.264 178 2HD2 LEU 27 2HD2 LEU 27 0.343 -3.176 -6.606 179 3HD2 LEU 27 3HD2 LEU 27 -1.316 -3.684 -6.923 180 H CYS 28 H CYS 28 -1.262 -2.911 -2.315 181 HA CYS 28 HA CYS 28 -1.682 -1.047 -0.127 182 1HB CYS 28 2HB CYS 28 -2.101 -3.600 -0.031 183 2HB CYS 28 1HB CYS 28 -0.352 -3.724 0.135 184 H ALA 29 H ALA 29 -0.135 0.063 0.853 185 HA ALA 29 HA ALA 29 2.582 -0.144 -0.255 186 1HB ALA 29 1HB ALA 29 0.890 2.147 0.578 187 2HB ALA 29 2HB ALA 29 1.970 1.978 -0.807 188 3HB ALA 29 3HB ALA 29 2.635 2.282 0.799 189 H LYS 30 H LYS 30 4.279 -0.465 1.038 190 HA LYS 30 HA LYS 30 3.790 -1.032 3.843 191 1HB LYS 30 2HB LYS 30 5.198 -2.542 2.450 192 2HB LYS 30 1HB LYS 30 6.341 -1.229 2.220 193 1HG LYS 30 2HG LYS 30 6.942 -2.961 3.952 194 2HG LYS 30 1HG LYS 30 7.011 -1.277 4.474 195 1HD LYS 30 2HD LYS 30 5.124 -1.472 5.792 196 2HD LYS 30 1HD LYS 30 4.509 -2.856 4.886 197 1HE LYS 30 2HE LYS 30 7.043 -3.053 6.472 198 2HE LYS 30 1HE LYS 30 5.471 -3.240 7.250 199 1HZ LYS 30 1HZ LYS 30 5.653 -4.797 4.870 200 2HZ LYS 30 2HZ LYS 30 5.271 -5.282 6.448 201 3HZ LYS 30 3HZ LYS 30 6.890 -5.195 5.956 202 H ASN 31 H ASN 31 3.425 0.913 4.781 203 HA ASN 31 HA ASN 31 3.844 2.926 5.730 204 1HB ASN 31 2HB ASN 31 5.900 1.576 6.502 205 2HB ASN 31 1HB ASN 31 6.786 2.444 5.257 206 1HD2 ASN 31 1HD2 ASN 31 4.380 4.430 6.446 207 2HD2 ASN 31 2HD2 ASN 31 5.312 5.299 7.606 Start of MODEL 12 1 H GLY 1 H GLY 1 3.628 2.993 3.203 2 1HA GLY 1 2HA GLY 1 3.511 4.977 1.866 3 2HA GLY 1 1HA GLY 1 5.139 5.377 2.387 4 H SER 2 H SER 2 6.199 2.687 1.888 5 HA SER 2 HA SER 2 6.577 3.020 -0.974 6 1HB SER 2 2HB SER 2 8.525 2.698 0.537 7 2HB SER 2 1HB SER 2 7.930 1.083 0.917 8 HG SER 2 HG SER 2 9.545 1.610 -0.969 9 H ILE 3 H ILE 3 5.115 2.107 -2.248 10 HA ILE 3 HA ILE 3 3.537 -0.133 -1.538 11 HB ILE 3 HB ILE 3 4.000 1.112 -4.254 12 1HG1 ILE 3 2HG1 ILE 3 1.543 1.817 -3.807 13 2HG1 ILE 3 1HG1 ILE 3 1.905 1.461 -2.123 14 1HG2 ILE 3 1HG2 ILE 3 2.628 -1.335 -3.501 15 2HG2 ILE 3 2HG2 ILE 3 3.083 -0.736 -5.096 16 3HG2 ILE 3 3HG2 ILE 3 1.578 -0.200 -4.349 17 1HD1 ILE 3 1HD1 ILE 3 2.451 3.814 -3.608 18 2HD1 ILE 3 2HD1 ILE 3 3.982 3.104 -3.099 19 3HD1 ILE 3 3HD1 ILE 3 2.746 3.486 -1.901 20 HA PRO 4 HA PRO 4 6.426 -2.558 -4.733 21 1HB PRO 4 2HB PRO 4 8.929 -1.029 -4.229 22 2HB PRO 4 1HB PRO 4 8.341 -1.768 -5.722 23 1HG PRO 4 2HG PRO 4 8.231 0.864 -5.387 24 2HG PRO 4 1HG PRO 4 6.905 -0.004 -6.184 25 1HD PRO 4 2HD PRO 4 7.064 1.081 -3.403 26 2HD PRO 4 1HD PRO 4 5.691 1.056 -4.528 27 H ALA 5 H ALA 5 7.655 -1.085 -1.771 28 HA ALA 5 HA ALA 5 9.325 -3.234 -0.995 29 1HB ALA 5 1HB ALA 5 9.916 -1.813 0.604 30 2HB ALA 5 2HB ALA 5 8.288 -1.828 1.282 31 3HB ALA 5 3HB ALA 5 8.699 -0.689 -0.001 32 H CYS 6 H CYS 6 5.915 -2.577 -0.578 33 HA CYS 6 HA CYS 6 5.544 -4.710 1.324 34 1HB CYS 6 2HB CYS 6 4.115 -2.681 1.348 35 2HB CYS 6 1HB CYS 6 3.459 -3.155 -0.217 36 H GLY 7 H GLY 7 4.719 -4.132 -2.082 37 1HA GLY 7 2HA GLY 7 4.306 -5.594 -3.803 38 2HA GLY 7 1HA GLY 7 5.142 -6.813 -2.851 39 H GLU 8 H GLU 8 2.178 -5.040 -2.052 40 HA GLU 8 HA GLU 8 0.626 -7.490 -2.393 41 1HB GLU 8 2HB GLU 8 1.571 -6.839 0.080 42 2HB GLU 8 1HB GLU 8 0.019 -6.010 0.086 43 1HG GLU 8 2HG GLU 8 0.212 -8.876 -0.736 44 2HG GLU 8 1HG GLU 8 0.163 -8.425 0.961 45 H SER 9 H SER 9 -1.657 -7.130 -2.517 46 HA SER 9 HA SER 9 -2.335 -4.328 -3.175 47 1HB SER 9 2HB SER 9 -3.473 -6.812 -4.477 48 2HB SER 9 1HB SER 9 -3.782 -5.138 -4.941 49 HG SER 9 HG SER 9 -1.121 -5.904 -4.860 50 H CYS 10 H CYS 10 -4.052 -3.474 -2.173 51 HA CYS 10 HA CYS 10 -5.463 -5.135 -0.265 52 1HB CYS 10 2HB CYS 10 -6.466 -2.843 0.349 53 2HB CYS 10 1HB CYS 10 -4.779 -3.137 0.708 54 H PHE 11 H PHE 11 -6.095 -5.736 -2.940 55 HA PHE 11 HA PHE 11 -8.543 -4.453 -3.663 56 1HB PHE 11 2HB PHE 11 -8.740 -6.148 -5.403 57 2HB PHE 11 1HB PHE 11 -7.114 -5.485 -5.376 58 HD1 PHE 11 1HD PHE 11 -9.168 -8.443 -4.602 59 HD2 PHE 11 2HD PHE 11 -5.232 -6.856 -4.912 60 HE1 PHE 11 1HE PHE 11 -8.246 -10.721 -4.504 61 HE2 PHE 11 2HE PHE 11 -4.303 -9.132 -4.811 62 HZ PHE 11 HZ PHE 11 -5.811 -11.068 -4.609 63 H LYS 12 H LYS 12 -7.645 -7.221 -1.762 64 HA LYS 12 HA LYS 12 -10.436 -8.012 -1.443 65 1HB LYS 12 2HB LYS 12 -9.591 -9.961 -0.237 66 2HB LYS 12 1HB LYS 12 -8.816 -9.818 -1.806 67 1HG LYS 12 2HG LYS 12 -7.471 -8.683 0.605 68 2HG LYS 12 1HG LYS 12 -7.422 -10.421 0.308 69 1HD LYS 12 2HD LYS 12 -6.447 -10.023 -1.896 70 2HD LYS 12 1HD LYS 12 -6.514 -8.282 -1.615 71 1HE LYS 12 2HE LYS 12 -5.018 -10.170 0.188 72 2HE LYS 12 1HE LYS 12 -4.279 -9.411 -1.221 73 1HZ LYS 12 1HZ LYS 12 -4.881 -7.240 -0.249 74 2HZ LYS 12 2HZ LYS 12 -3.772 -8.105 0.684 75 3HZ LYS 12 3HZ LYS 12 -5.403 -8.027 1.158 76 H GLY 13 H GLY 13 -9.785 -5.499 -0.446 77 1HA GLY 13 2HA GLY 13 -10.414 -4.321 1.444 78 2HA GLY 13 1HA GLY 13 -10.595 -5.847 2.296 79 H LYS 14 H LYS 14 -9.192 -6.233 3.852 80 HA LYS 14 HA LYS 14 -7.111 -4.439 4.444 81 1HB LYS 14 2HB LYS 14 -6.522 -6.118 6.235 82 2HB LYS 14 1HB LYS 14 -8.154 -5.477 6.277 83 1HG LYS 14 2HG LYS 14 -8.370 -7.761 6.742 84 2HG LYS 14 1HG LYS 14 -8.862 -7.589 5.058 85 1HD LYS 14 2HD LYS 14 -6.763 -8.438 4.288 86 2HD LYS 14 1HD LYS 14 -6.092 -8.398 5.916 87 1HE LYS 14 2HE LYS 14 -8.423 -10.111 5.074 88 2HE LYS 14 1HE LYS 14 -6.754 -10.670 5.143 89 1HZ LYS 14 1HZ LYS 14 -6.761 -10.054 7.530 90 2HZ LYS 14 2HZ LYS 14 -7.840 -11.299 7.147 91 3HZ LYS 14 3HZ LYS 14 -8.418 -9.732 7.412 92 H CYS 15 H CYS 15 -4.896 -4.782 4.641 93 HA CYS 15 HA CYS 15 -3.736 -6.194 2.420 94 1HB CYS 15 2HB CYS 15 -2.443 -4.602 4.646 95 2HB CYS 15 1HB CYS 15 -1.621 -5.194 3.206 96 H TYR 16 H TYR 16 -2.274 -7.895 2.529 97 HA TYR 16 HA TYR 16 -2.635 -9.617 4.834 98 1HB TYR 16 2HB TYR 16 -1.524 -9.970 2.080 99 2HB TYR 16 1HB TYR 16 -1.070 -11.121 3.334 100 HD1 TYR 16 1HD TYR 16 -2.163 -13.046 2.470 101 HD2 TYR 16 2HD TYR 16 -4.366 -9.457 3.073 102 HE1 TYR 16 1HE TYR 16 -4.264 -14.281 2.128 103 HE2 TYR 16 2HE TYR 16 -6.467 -10.680 2.729 104 HH TYR 16 HH TYR 16 -6.488 -14.079 1.791 105 H THR 17 H THR 17 -0.018 -7.879 3.228 106 HA THR 17 HA THR 17 2.007 -8.865 4.962 107 HB THR 17 HB THR 17 2.137 -6.347 3.300 108 HG1 THR 17 1HG THR 17 2.881 -7.735 1.627 109 1HG2 THR 17 1HG2 THR 17 4.467 -8.124 3.568 110 2HG2 THR 17 2HG2 THR 17 3.953 -7.351 5.068 111 3HG2 THR 17 3HG2 THR 17 4.367 -6.365 3.664 112 HA PRO 18 HA PRO 18 0.757 -6.387 8.482 113 1HB PRO 18 2HB PRO 18 3.435 -7.248 9.419 114 2HB PRO 18 1HB PRO 18 1.866 -7.387 10.218 115 1HG PRO 18 2HG PRO 18 3.056 -9.522 9.139 116 2HG PRO 18 1HG PRO 18 1.296 -9.310 9.065 117 1HD PRO 18 2HD PRO 18 3.349 -8.909 6.936 118 2HD PRO 18 1HD PRO 18 1.694 -9.538 6.806 119 H GLY 19 H GLY 19 1.044 -4.302 8.835 120 1HA GLY 19 2HA GLY 19 2.325 -2.362 9.251 121 2HA GLY 19 1HA GLY 19 3.669 -3.096 8.391 122 H CYS 20 H CYS 20 1.338 -3.794 6.306 123 HA CYS 20 HA CYS 20 1.895 -1.374 4.783 124 1HB CYS 20 2HB CYS 20 0.409 -3.849 3.912 125 2HB CYS 20 1HB CYS 20 0.949 -2.530 2.880 126 H SER 21 H SER 21 0.392 -0.004 3.944 127 HA SER 21 HA SER 21 -2.344 -0.238 5.011 128 1HB SER 21 2HB SER 21 -0.778 2.319 4.571 129 2HB SER 21 1HB SER 21 -2.405 2.189 5.243 130 HG SER 21 HG SER 21 -0.538 0.649 6.537 131 H CYS 22 H CYS 22 -4.009 0.316 3.607 132 HA CYS 22 HA CYS 22 -3.433 0.073 0.820 133 1HB CYS 22 2HB CYS 22 -5.489 -0.824 2.000 134 2HB CYS 22 1HB CYS 22 -6.079 0.832 2.067 135 H SER 23 H SER 23 -1.987 2.027 0.880 136 HA SER 23 HA SER 23 -3.416 4.573 0.772 137 1HB SER 23 2HB SER 23 -0.442 4.065 0.535 138 2HB SER 23 1HB SER 23 -1.239 5.602 0.873 139 HG SER 23 HG SER 23 -1.967 4.696 2.847 140 H LYS 24 H LYS 24 -3.574 2.404 -1.264 141 HA LYS 24 HA LYS 24 -3.311 4.066 -3.584 142 1HB LYS 24 2HB LYS 24 -1.652 1.577 -3.247 143 2HB LYS 24 1HB LYS 24 -2.137 2.143 -4.838 144 1HG LYS 24 2HG LYS 24 -0.563 3.756 -2.844 145 2HG LYS 24 1HG LYS 24 0.127 2.864 -4.198 146 1HD LYS 24 2HD LYS 24 -1.091 4.238 -5.775 147 2HD LYS 24 1HD LYS 24 -1.922 5.066 -4.455 148 1HE LYS 24 2HE LYS 24 0.258 5.906 -3.656 149 2HE LYS 24 1HE LYS 24 1.037 5.138 -5.038 150 1HZ LYS 24 1HZ LYS 24 -0.574 7.556 -4.923 151 2HZ LYS 24 2HZ LYS 24 -0.814 6.573 -6.279 152 3HZ LYS 24 3HZ LYS 24 0.730 7.169 -5.930 153 H TYR 25 H TYR 25 -4.471 3.244 -5.323 154 HA TYR 25 HA TYR 25 -6.684 1.530 -4.505 155 1HB TYR 25 2HB TYR 25 -7.607 2.720 -6.681 156 2HB TYR 25 1HB TYR 25 -7.511 3.572 -5.138 157 HD1 TYR 25 1HD TYR 25 -7.194 5.829 -5.851 158 HD2 TYR 25 2HD TYR 25 -4.695 2.765 -7.415 159 HE1 TYR 25 1HE TYR 25 -5.695 7.530 -6.812 160 HE2 TYR 25 2HE TYR 25 -3.198 4.429 -8.363 161 HH TYR 25 HH TYR 25 -3.927 7.460 -8.936 162 HA PRO 26 HA PRO 26 -6.342 -0.235 -3.965 163 1HB PRO 26 2HB PRO 26 -6.833 -2.847 -4.183 164 2HB PRO 26 1HB PRO 26 -7.961 -1.684 -4.893 165 1HG PRO 26 2HG PRO 26 -6.124 -3.537 -6.246 166 2HG PRO 26 1HG PRO 26 -7.504 -2.649 -6.913 167 1HD PRO 26 2HD PRO 26 -4.638 -1.915 -6.897 168 2HD PRO 26 1HD PRO 26 -5.952 -1.303 -7.930 169 H LEU 27 H LEU 27 -3.756 0.261 -4.175 170 HA LEU 27 HA LEU 27 -2.323 -2.248 -3.764 171 1HB LEU 27 2HB LEU 27 -1.378 0.428 -4.689 172 2HB LEU 27 1HB LEU 27 -0.264 -0.821 -4.160 173 HG LEU 27 HG LEU 27 -2.286 -1.323 -6.311 174 1HD1 LEU 27 1HD1 LEU 27 0.324 0.098 -6.458 175 2HD1 LEU 27 2HD1 LEU 27 -1.155 0.358 -7.383 176 3HD1 LEU 27 3HD1 LEU 27 -0.105 -1.007 -7.765 177 1HD2 LEU 27 1HD2 LEU 27 -1.462 -3.377 -6.179 178 2HD2 LEU 27 2HD2 LEU 27 -0.285 -2.865 -4.969 179 3HD2 LEU 27 3HD2 LEU 27 0.105 -2.745 -6.684 180 H CYS 28 H CYS 28 -1.208 -2.716 -2.005 181 HA CYS 28 HA CYS 28 -1.545 -1.015 0.328 182 1HB CYS 28 2HB CYS 28 -0.330 -3.766 -0.003 183 2HB CYS 28 1HB CYS 28 -0.470 -2.923 1.535 184 H ALA 29 H ALA 29 -0.030 0.294 1.096 185 HA ALA 29 HA ALA 29 2.666 0.153 -0.062 186 1HB ALA 29 1HB ALA 29 2.791 2.511 1.000 187 2HB ALA 29 2HB ALA 29 1.033 2.384 1.088 188 3HB ALA 29 3HB ALA 29 1.848 2.288 -0.473 189 H LYS 30 H LYS 30 4.385 -0.302 1.189 190 HA LYS 30 HA LYS 30 3.898 -0.936 3.989 191 1HB LYS 30 2HB LYS 30 5.184 -2.495 2.512 192 2HB LYS 30 1HB LYS 30 6.432 -1.267 2.364 193 1HG LYS 30 2HG LYS 30 6.867 -3.105 4.030 194 2HG LYS 30 1HG LYS 30 7.030 -1.456 4.636 195 1HD LYS 30 2HD LYS 30 4.973 -1.566 5.785 196 2HD LYS 30 1HD LYS 30 4.478 -3.019 4.918 197 1HE LYS 30 2HE LYS 30 6.894 -2.990 6.697 198 2HE LYS 30 1HE LYS 30 5.276 -3.270 7.341 199 1HZ LYS 30 1HZ LYS 30 5.228 -5.329 6.528 200 2HZ LYS 30 2HZ LYS 30 6.909 -5.183 6.359 201 3HZ LYS 30 3HZ LYS 30 5.897 -4.878 5.037 202 H ASN 31 H ASN 31 3.653 1.025 4.924 203 HA ASN 31 HA ASN 31 4.207 2.968 5.923 204 1HB ASN 31 2HB ASN 31 7.061 2.048 5.477 205 2HB ASN 31 1HB ASN 31 6.573 3.375 6.525 206 1HD2 ASN 31 1HD2 ASN 31 7.720 0.453 6.707 207 2HD2 ASN 31 2HD2 ASN 31 6.911 -0.151 8.109 Start of MODEL 13 1 H GLY 1 H GLY 1 3.197 2.856 2.997 2 1HA GLY 1 2HA GLY 1 3.287 4.719 1.483 3 2HA GLY 1 1HA GLY 1 4.824 5.176 2.199 4 H SER 2 H SER 2 5.853 2.420 2.127 5 HA SER 2 HA SER 2 6.958 2.513 -0.515 6 1HB SER 2 2HB SER 2 7.282 0.257 1.458 7 2HB SER 2 1HB SER 2 8.411 0.789 0.212 8 HG SER 2 HG SER 2 8.163 2.891 1.620 9 H ILE 3 H ILE 3 5.618 1.944 -2.162 10 HA ILE 3 HA ILE 3 3.696 -0.165 -1.945 11 HB ILE 3 HB ILE 3 4.643 1.463 -4.298 12 1HG1 ILE 3 2HG1 ILE 3 3.178 2.502 -2.524 13 2HG1 ILE 3 1HG1 ILE 3 2.524 2.549 -4.158 14 1HG2 ILE 3 1HG2 ILE 3 3.327 -1.078 -4.365 15 2HG2 ILE 3 2HG2 ILE 3 3.839 -0.052 -5.704 16 3HG2 ILE 3 3HG2 ILE 3 2.245 0.169 -4.984 17 1HD1 ILE 3 1HD1 ILE 3 1.742 0.629 -1.978 18 2HD1 ILE 3 2HD1 ILE 3 1.111 0.615 -3.625 19 3HD1 ILE 3 3HD1 ILE 3 0.795 1.993 -2.571 20 HA PRO 4 HA PRO 4 6.646 -2.541 -5.030 21 1HB PRO 4 2HB PRO 4 9.278 -1.729 -4.945 22 2HB PRO 4 1HB PRO 4 8.117 -1.243 -6.185 23 1HG PRO 4 2HG PRO 4 8.998 0.225 -3.732 24 2HG PRO 4 1HG PRO 4 8.715 0.845 -5.369 25 1HD PRO 4 2HD PRO 4 6.915 1.198 -3.423 26 2HD PRO 4 1HD PRO 4 6.410 0.872 -5.095 27 H ALA 5 H ALA 5 7.805 -1.279 -1.986 28 HA ALA 5 HA ALA 5 9.432 -3.527 -1.334 29 1HB ALA 5 1HB ALA 5 8.747 -0.998 -0.127 30 2HB ALA 5 2HB ALA 5 10.176 -2.006 0.103 31 3HB ALA 5 3HB ALA 5 8.726 -2.301 1.063 32 H CYS 6 H CYS 6 6.076 -2.663 -0.794 33 HA CYS 6 HA CYS 6 5.633 -4.832 1.043 34 1HB CYS 6 2HB CYS 6 4.345 -2.759 1.251 35 2HB CYS 6 1HB CYS 6 3.645 -3.028 -0.343 36 H GLY 7 H GLY 7 4.533 -4.100 -2.280 37 1HA GLY 7 2HA GLY 7 4.223 -5.599 -4.033 38 2HA GLY 7 1HA GLY 7 4.639 -6.916 -2.947 39 H GLU 8 H GLU 8 2.661 -6.089 -0.950 40 HA GLU 8 HA GLU 8 0.518 -7.697 -1.654 41 1HB GLU 8 2HB GLU 8 0.996 -7.184 0.650 42 2HB GLU 8 1HB GLU 8 0.691 -5.475 0.382 43 1HG GLU 8 2HG GLU 8 -1.170 -6.418 1.531 44 2HG GLU 8 1HG GLU 8 -1.669 -6.017 -0.109 45 H SER 9 H SER 9 -1.519 -7.363 -2.408 46 HA SER 9 HA SER 9 -1.992 -4.747 -3.682 47 1HB SER 9 2HB SER 9 -3.033 -7.467 -4.505 48 2HB SER 9 1HB SER 9 -3.331 -5.946 -5.347 49 HG SER 9 HG SER 9 -0.687 -6.741 -4.845 50 H CYS 10 H CYS 10 -3.717 -3.624 -3.130 51 HA CYS 10 HA CYS 10 -5.548 -4.701 -1.143 52 1HB CYS 10 2HB CYS 10 -4.547 -2.469 -0.803 53 2HB CYS 10 1HB CYS 10 -5.289 -1.914 -2.296 54 H PHE 11 H PHE 11 -6.210 -6.180 -2.989 55 HA PHE 11 HA PHE 11 -7.825 -5.123 -5.089 56 1HB PHE 11 2HB PHE 11 -8.446 -7.591 -5.371 57 2HB PHE 11 1HB PHE 11 -6.754 -7.155 -5.574 58 HD1 PHE 11 1HD PHE 11 -5.248 -8.616 -4.677 59 HD2 PHE 11 2HD PHE 11 -9.020 -8.148 -2.758 60 HE1 PHE 11 1HE PHE 11 -4.603 -10.305 -3.008 61 HE2 PHE 11 2HE PHE 11 -8.377 -9.835 -1.083 62 HZ PHE 11 HZ PHE 11 -6.167 -10.914 -1.206 63 H LYS 12 H LYS 12 -8.896 -3.981 -2.901 64 HA LYS 12 HA LYS 12 -10.921 -3.483 -1.978 65 1HB LYS 12 2HB LYS 12 -12.103 -5.863 -3.413 66 2HB LYS 12 1HB LYS 12 -12.950 -4.457 -2.790 67 1HG LYS 12 2HG LYS 12 -12.055 -3.064 -4.495 68 2HG LYS 12 1HG LYS 12 -10.944 -4.330 -5.024 69 1HD LYS 12 2HD LYS 12 -13.951 -4.396 -5.191 70 2HD LYS 12 1HD LYS 12 -12.835 -4.194 -6.542 71 1HE LYS 12 2HE LYS 12 -13.178 -6.624 -4.788 72 2HE LYS 12 1HE LYS 12 -13.597 -6.475 -6.492 73 1HZ LYS 12 1HZ LYS 12 -11.046 -5.885 -6.641 74 2HZ LYS 12 2HZ LYS 12 -11.592 -7.485 -6.679 75 3HZ LYS 12 3HZ LYS 12 -10.982 -6.835 -5.239 76 H GLY 13 H GLY 13 -9.471 -4.456 -0.195 77 1HA GLY 13 2HA GLY 13 -11.146 -6.062 1.455 78 2HA GLY 13 1HA GLY 13 -9.785 -6.989 0.841 79 H LYS 14 H LYS 14 -7.934 -6.900 1.917 80 HA LYS 14 HA LYS 14 -7.134 -4.578 3.389 81 1HB LYS 14 2HB LYS 14 -6.857 -5.969 5.542 82 2HB LYS 14 1HB LYS 14 -8.450 -5.340 5.162 83 1HG LYS 14 2HG LYS 14 -8.786 -7.537 5.922 84 2HG LYS 14 1HG LYS 14 -8.971 -7.607 4.170 85 1HD LYS 14 2HD LYS 14 -6.710 -8.476 3.948 86 2HD LYS 14 1HD LYS 14 -6.472 -8.346 5.690 87 1HE LYS 14 2HE LYS 14 -8.544 -10.073 4.341 88 2HE LYS 14 1HE LYS 14 -6.995 -10.647 4.954 89 1HZ LYS 14 1HZ LYS 14 -9.138 -9.404 6.591 90 2HZ LYS 14 2HZ LYS 14 -7.659 -9.982 7.173 91 3HZ LYS 14 3HZ LYS 14 -8.789 -11.058 6.521 92 H CYS 15 H CYS 15 -4.956 -4.629 3.963 93 HA CYS 15 HA CYS 15 -3.354 -6.339 2.322 94 1HB CYS 15 2HB CYS 15 -2.349 -4.473 4.466 95 2HB CYS 15 1HB CYS 15 -1.528 -4.982 2.994 96 H TYR 16 H TYR 16 -2.328 -8.182 2.882 97 HA TYR 16 HA TYR 16 -2.762 -9.237 5.539 98 1HB TYR 16 2HB TYR 16 -1.419 -10.360 3.078 99 2HB TYR 16 1HB TYR 16 -1.487 -11.225 4.608 100 HD1 TYR 16 1HD TYR 16 -3.840 -9.430 2.308 101 HD2 TYR 16 2HD TYR 16 -3.165 -12.783 4.837 102 HE1 TYR 16 1HE TYR 16 -6.056 -10.310 1.719 103 HE2 TYR 16 2HE TYR 16 -5.379 -13.676 4.251 104 HH TYR 16 HH TYR 16 -7.062 -12.947 1.758 105 H THR 17 H THR 17 -0.073 -8.086 3.595 106 HA THR 17 HA THR 17 1.995 -8.781 5.370 107 HB THR 17 HB THR 17 2.031 -6.458 3.439 108 HG1 THR 17 1HG THR 17 2.776 -8.062 1.926 109 1HG2 THR 17 1HG2 THR 17 4.002 -7.752 5.116 110 2HG2 THR 17 2HG2 THR 17 4.141 -6.278 4.156 111 3HG2 THR 17 3HG2 THR 17 4.454 -7.847 3.414 112 HA PRO 18 HA PRO 18 1.014 -5.885 8.649 113 1HB PRO 18 2HB PRO 18 3.417 -6.310 9.966 114 2HB PRO 18 1HB PRO 18 1.946 -7.256 10.199 115 1HG PRO 18 2HG PRO 18 4.350 -7.865 8.542 116 2HG PRO 18 1HG PRO 18 3.344 -8.960 9.508 117 1HD PRO 18 2HD PRO 18 3.137 -8.837 6.831 118 2HD PRO 18 1HD PRO 18 1.720 -9.119 7.865 119 H GLY 19 H GLY 19 1.350 -3.771 8.722 120 1HA GLY 19 2HA GLY 19 2.747 -1.841 8.825 121 2HA GLY 19 1HA GLY 19 3.955 -2.709 7.887 122 H CYS 20 H CYS 20 1.585 -3.647 6.125 123 HA CYS 20 HA CYS 20 1.788 -1.354 4.342 124 1HB CYS 20 2HB CYS 20 0.474 -4.022 3.849 125 2HB CYS 20 1HB CYS 20 0.827 -2.786 2.650 126 H SER 21 H SER 21 0.096 -0.197 3.553 127 HA SER 21 HA SER 21 -2.562 -0.697 4.691 128 1HB SER 21 2HB SER 21 -1.197 2.007 4.606 129 2HB SER 21 1HB SER 21 -2.832 1.687 5.187 130 HG SER 21 HG SER 21 -1.065 0.069 6.418 131 H CYS 22 H CYS 22 -4.287 0.048 3.423 132 HA CYS 22 HA CYS 22 -3.795 0.079 0.602 133 1HB CYS 22 2HB CYS 22 -5.787 -0.970 1.799 134 2HB CYS 22 1HB CYS 22 -6.409 0.662 2.003 135 H SER 23 H SER 23 -2.396 2.149 1.433 136 HA SER 23 HA SER 23 -3.869 4.616 1.442 137 1HB SER 23 2HB SER 23 -0.881 4.235 1.163 138 2HB SER 23 1HB SER 23 -1.736 5.661 1.759 139 HG SER 23 HG SER 23 -2.130 4.669 3.633 140 H LYS 24 H LYS 24 -2.802 2.537 -0.980 141 HA LYS 24 HA LYS 24 -3.189 4.627 -2.986 142 1HB LYS 24 2HB LYS 24 -0.839 2.722 -3.016 143 2HB LYS 24 1HB LYS 24 -1.251 3.859 -4.292 144 1HG LYS 24 2HG LYS 24 -0.969 5.691 -2.578 145 2HG LYS 24 1HG LYS 24 -0.279 4.466 -1.517 146 1HD LYS 24 2HD LYS 24 1.448 3.990 -3.180 147 2HD LYS 24 1HD LYS 24 0.753 5.205 -4.254 148 1HE LYS 24 2HE LYS 24 1.928 5.700 -1.519 149 2HE LYS 24 1HE LYS 24 2.680 6.101 -3.063 150 1HZ LYS 24 1HZ LYS 24 0.780 7.584 -3.505 151 2HZ LYS 24 2HZ LYS 24 1.670 8.052 -2.145 152 3HZ LYS 24 3HZ LYS 24 0.184 7.265 -1.953 153 H TYR 25 H TYR 25 -5.212 3.230 -2.702 154 HA TYR 25 HA TYR 25 -5.549 0.636 -3.519 155 1HB TYR 25 2HB TYR 25 -7.352 2.052 -2.639 156 2HB TYR 25 1HB TYR 25 -7.330 3.017 -4.107 157 HD1 TYR 25 1HD TYR 25 -7.887 -0.488 -2.942 158 HD2 TYR 25 2HD TYR 25 -8.787 2.502 -5.832 159 HE1 TYR 25 1HE TYR 25 -9.572 -1.972 -3.947 160 HE2 TYR 25 2HE TYR 25 -10.472 1.027 -6.844 161 HH TYR 25 HH TYR 25 -11.728 -0.854 -6.475 162 HA PRO 26 HA PRO 26 -6.288 -0.806 -4.491 163 1HB PRO 26 2HB PRO 26 -6.119 -2.822 -6.228 164 2HB PRO 26 1HB PRO 26 -7.388 -1.601 -6.362 165 1HG PRO 26 2HG PRO 26 -4.962 -1.989 -8.015 166 2HG PRO 26 1HG PRO 26 -6.519 -1.268 -8.453 167 1HD PRO 26 2HD PRO 26 -4.107 0.076 -7.687 168 2HD PRO 26 1HD PRO 26 -5.677 0.799 -8.084 169 H LEU 27 H LEU 27 -3.505 0.130 -4.396 170 HA LEU 27 HA LEU 27 -2.162 -2.467 -4.064 171 1HB LEU 27 2HB LEU 27 -1.010 0.201 -4.843 172 2HB LEU 27 1HB LEU 27 -0.026 -1.164 -4.341 173 HG LEU 27 HG LEU 27 -1.960 -1.346 -6.615 174 1HD1 LEU 27 1HD1 LEU 27 -0.599 -0.234 -7.987 175 2HD1 LEU 27 2HD1 LEU 27 0.795 -1.165 -7.438 176 3HD1 LEU 27 3HD1 LEU 27 0.306 0.288 -6.566 177 1HD2 LEU 27 1HD2 LEU 27 -0.085 -3.095 -7.218 178 2HD2 LEU 27 2HD2 LEU 27 -1.391 -3.497 -6.104 179 3HD2 LEU 27 3HD2 LEU 27 0.193 -3.044 -5.477 180 H CYS 28 H CYS 28 -0.931 -2.809 -2.274 181 HA CYS 28 HA CYS 28 -1.599 -1.080 -0.010 182 1HB CYS 28 2HB CYS 28 -0.541 -3.894 -0.189 183 2HB CYS 28 1HB CYS 28 -0.587 -2.999 1.327 184 H ALA 29 H ALA 29 -0.188 0.236 0.881 185 HA ALA 29 HA ALA 29 2.594 0.096 -0.041 186 1HB ALA 29 1HB ALA 29 1.079 2.386 1.207 187 2HB ALA 29 2HB ALA 29 1.413 2.179 -0.513 188 3HB ALA 29 3HB ALA 29 2.741 2.444 0.618 189 H LYS 30 H LYS 30 4.126 -0.534 1.316 190 HA LYS 30 HA LYS 30 3.535 -1.040 4.093 191 1HB LYS 30 2HB LYS 30 5.042 -2.506 2.710 192 2HB LYS 30 1HB LYS 30 6.193 -1.183 2.628 193 1HG LYS 30 2HG LYS 30 5.314 -2.264 5.279 194 2HG LYS 30 1HG LYS 30 6.558 -3.085 4.339 195 1HD LYS 30 2HD LYS 30 6.636 -0.209 5.258 196 2HD LYS 30 1HD LYS 30 7.543 -1.548 5.968 197 1HE LYS 30 2HE LYS 30 8.979 -1.703 4.170 198 2HE LYS 30 1HE LYS 30 7.822 -0.988 3.049 199 1HZ LYS 30 1HZ LYS 30 8.540 0.862 5.080 200 2HZ LYS 30 2HZ LYS 30 8.679 1.014 3.400 201 3HZ LYS 30 3HZ LYS 30 9.922 0.286 4.292 202 H ASN 31 H ASN 31 3.025 0.979 4.885 203 HA ASN 31 HA ASN 31 3.325 3.052 5.735 204 1HB ASN 31 2HB ASN 31 6.116 1.939 5.994 205 2HB ASN 31 1HB ASN 31 5.726 3.569 6.532 206 1HD2 ASN 31 1HD2 ASN 31 6.071 0.493 7.556 207 2HD2 ASN 31 2HD2 ASN 31 5.046 0.524 8.942 Start of MODEL 14 1 H GLY 1 H GLY 1 3.566 2.601 3.460 2 1HA GLY 1 2HA GLY 1 3.530 4.775 2.386 3 2HA GLY 1 1HA GLY 1 5.154 5.041 2.995 4 H SER 2 H SER 2 6.021 2.309 2.228 5 HA SER 2 HA SER 2 6.593 2.957 -0.551 6 1HB SER 2 2HB SER 2 7.701 0.749 1.194 7 2HB SER 2 1HB SER 2 8.317 1.238 -0.385 8 HG SER 2 HG SER 2 8.081 3.188 1.603 9 H ILE 3 H ILE 3 4.984 2.367 -1.885 10 HA ILE 3 HA ILE 3 3.293 0.148 -1.553 11 HB ILE 3 HB ILE 3 3.938 1.740 -4.038 12 1HG1 ILE 3 2HG1 ILE 3 1.481 2.444 -3.634 13 2HG1 ILE 3 1HG1 ILE 3 1.710 1.797 -2.014 14 1HG2 ILE 3 1HG2 ILE 3 1.446 0.290 -4.157 15 2HG2 ILE 3 2HG2 ILE 3 2.821 -0.803 -3.991 16 3HG2 ILE 3 3HG2 ILE 3 2.770 0.356 -5.320 17 1HD1 ILE 3 1HD1 ILE 3 3.743 3.712 -2.962 18 2HD1 ILE 3 2HD1 ILE 3 3.011 3.518 -1.369 19 3HD1 ILE 3 3HD1 ILE 3 2.129 4.350 -2.650 20 HA PRO 4 HA PRO 4 6.038 -2.109 -4.962 21 1HB PRO 4 2HB PRO 4 8.632 -0.759 -4.428 22 2HB PRO 4 1HB PRO 4 7.944 -1.317 -5.958 23 1HG PRO 4 2HG PRO 4 7.996 1.272 -5.373 24 2HG PRO 4 1HG PRO 4 6.589 0.556 -6.181 25 1HD PRO 4 2HD PRO 4 6.933 1.336 -3.312 26 2HD PRO 4 1HD PRO 4 5.520 1.525 -4.370 27 H ALA 5 H ALA 5 7.336 -1.007 -1.891 28 HA ALA 5 HA ALA 5 9.003 -3.232 -1.385 29 1HB ALA 5 1HB ALA 5 8.233 -2.284 1.099 30 2HB ALA 5 2HB ALA 5 8.125 -0.875 0.045 31 3HB ALA 5 3HB ALA 5 9.638 -1.772 0.166 32 H CYS 6 H CYS 6 5.610 -2.571 -0.654 33 HA CYS 6 HA CYS 6 5.323 -5.006 0.859 34 1HB CYS 6 2HB CYS 6 3.990 -2.864 1.239 35 2HB CYS 6 1HB CYS 6 3.074 -3.302 -0.200 36 H GLY 7 H GLY 7 4.176 -3.814 -2.296 37 1HA GLY 7 2HA GLY 7 3.865 -5.008 -4.253 38 2HA GLY 7 1HA GLY 7 4.370 -6.462 -3.411 39 H GLU 8 H GLU 8 2.432 -6.402 -1.326 40 HA GLU 8 HA GLU 8 0.348 -7.816 -2.493 41 1HB GLU 8 2HB GLU 8 0.947 -7.954 -0.101 42 2HB GLU 8 1HB GLU 8 0.285 -6.344 0.148 43 1HG GLU 8 2HG GLU 8 -1.922 -7.148 -0.529 44 2HG GLU 8 1HG GLU 8 -1.258 -8.761 -0.766 45 H SER 9 H SER 9 -1.540 -7.321 -3.384 46 HA SER 9 HA SER 9 -2.165 -4.522 -3.834 47 1HB SER 9 2HB SER 9 -3.569 -6.959 -4.945 48 2HB SER 9 1HB SER 9 -3.610 -5.313 -5.578 49 HG SER 9 HG SER 9 -1.080 -5.960 -5.467 50 H CYS 10 H CYS 10 -3.973 -3.484 -3.075 51 HA CYS 10 HA CYS 10 -5.664 -5.031 -1.230 52 1HB CYS 10 2HB CYS 10 -6.091 -2.879 -0.060 53 2HB CYS 10 1HB CYS 10 -4.402 -3.366 -0.020 54 H PHE 11 H PHE 11 -7.698 -5.297 -1.794 55 HA PHE 11 HA PHE 11 -8.761 -4.033 -4.137 56 1HB PHE 11 2HB PHE 11 -9.256 -6.371 -3.682 57 2HB PHE 11 1HB PHE 11 -10.011 -5.941 -2.152 58 HD1 PHE 11 1HD PHE 11 -10.306 -4.861 -5.717 59 HD2 PHE 11 2HD PHE 11 -12.282 -6.064 -2.148 60 HE1 PHE 11 1HE PHE 11 -12.479 -4.635 -6.851 61 HE2 PHE 11 2HE PHE 11 -14.460 -5.844 -3.275 62 HZ PHE 11 HZ PHE 11 -14.560 -5.128 -5.629 63 H LYS 12 H LYS 12 -9.541 -3.964 -0.681 64 HA LYS 12 HA LYS 12 -10.556 -1.286 -0.899 65 1HB LYS 12 2HB LYS 12 -12.803 -1.802 -0.008 66 2HB LYS 12 1HB LYS 12 -12.548 -2.504 -1.600 67 1HG LYS 12 2HG LYS 12 -12.306 -4.680 -0.704 68 2HG LYS 12 1HG LYS 12 -12.189 -4.062 0.945 69 1HD LYS 12 2HD LYS 12 -14.555 -3.107 0.487 70 2HD LYS 12 1HD LYS 12 -14.591 -4.283 -0.830 71 1HE LYS 12 2HE LYS 12 -15.595 -5.218 1.177 72 2HE LYS 12 1HE LYS 12 -14.109 -6.076 0.769 73 1HZ LYS 12 1HZ LYS 12 -14.741 -4.511 3.102 74 2HZ LYS 12 2HZ LYS 12 -13.239 -4.124 2.428 75 3HZ LYS 12 3HZ LYS 12 -13.572 -5.716 2.894 76 H GLY 13 H GLY 13 -8.467 -1.716 0.444 77 1HA GLY 13 2HA GLY 13 -7.596 -1.292 2.541 78 2HA GLY 13 1HA GLY 13 -9.223 -1.375 3.203 79 H LYS 14 H LYS 14 -7.163 -3.678 1.454 80 HA LYS 14 HA LYS 14 -7.369 -5.513 3.715 81 1HB LYS 14 2HB LYS 14 -8.970 -6.246 2.042 82 2HB LYS 14 1HB LYS 14 -7.760 -6.121 0.777 83 1HG LYS 14 2HG LYS 14 -7.499 -8.036 3.079 84 2HG LYS 14 1HG LYS 14 -8.326 -8.447 1.573 85 1HD LYS 14 2HD LYS 14 -6.225 -7.735 0.389 86 2HD LYS 14 1HD LYS 14 -5.452 -7.673 1.957 87 1HE LYS 14 2HE LYS 14 -5.985 -10.050 2.304 88 2HE LYS 14 1HE LYS 14 -6.725 -10.106 0.704 89 1HZ LYS 14 1HZ LYS 14 -3.881 -9.366 1.176 90 2HZ LYS 14 2HZ LYS 14 -4.630 -9.693 -0.310 91 3HZ LYS 14 3HZ LYS 14 -4.396 -10.939 0.806 92 H CYS 15 H CYS 15 -5.415 -5.994 4.415 93 HA CYS 15 HA CYS 15 -3.214 -6.437 2.605 94 1HB CYS 15 2HB CYS 15 -3.080 -4.359 4.806 95 2HB CYS 15 1HB CYS 15 -1.739 -4.892 3.815 96 H TYR 16 H TYR 16 -2.115 -8.153 3.329 97 HA TYR 16 HA TYR 16 -2.644 -9.097 6.048 98 1HB TYR 16 2HB TYR 16 -1.600 -10.392 3.549 99 2HB TYR 16 1HB TYR 16 -1.312 -11.139 5.116 100 HD1 TYR 16 1HD TYR 16 -2.575 -13.118 4.399 101 HD2 TYR 16 2HD TYR 16 -4.411 -9.285 4.593 102 HE1 TYR 16 1HE TYR 16 -4.791 -14.180 4.310 103 HE2 TYR 16 2HE TYR 16 -6.629 -10.337 4.503 104 HH TYR 16 HH TYR 16 -7.263 -13.365 5.170 105 H THR 17 H THR 17 -0.069 -8.016 3.957 106 HA THR 17 HA THR 17 2.107 -8.732 5.590 107 HB THR 17 HB THR 17 2.050 -6.351 3.739 108 HG1 THR 17 1HG THR 17 1.212 -8.031 2.525 109 1HG2 THR 17 1HG2 THR 17 4.333 -6.542 3.649 110 2HG2 THR 17 2HG2 THR 17 4.310 -8.277 3.957 111 3HG2 THR 17 3HG2 THR 17 4.061 -7.142 5.283 112 HA PRO 18 HA PRO 18 1.276 -5.942 8.995 113 1HB PRO 18 2HB PRO 18 4.064 -6.657 9.678 114 2HB PRO 18 1HB PRO 18 2.602 -6.769 10.660 115 1HG PRO 18 2HG PRO 18 3.747 -8.955 9.627 116 2HG PRO 18 1HG PRO 18 1.985 -8.804 9.758 117 1HD PRO 18 2HD PRO 18 3.740 -8.535 7.359 118 2HD PRO 18 1HD PRO 18 2.107 -9.220 7.495 119 H GLY 19 H GLY 19 1.515 -3.828 9.063 120 1HA GLY 19 2HA GLY 19 2.746 -1.816 9.143 121 2HA GLY 19 1HA GLY 19 4.053 -2.611 8.280 122 H CYS 20 H CYS 20 1.607 -3.625 6.501 123 HA CYS 20 HA CYS 20 1.942 -1.427 4.625 124 1HB CYS 20 2HB CYS 20 0.584 -4.093 4.282 125 2HB CYS 20 1HB CYS 20 0.811 -2.906 3.012 126 H SER 21 H SER 21 0.327 -0.240 3.755 127 HA SER 21 HA SER 21 -2.373 -0.513 4.854 128 1HB SER 21 2HB SER 21 -2.403 2.044 5.020 129 2HB SER 21 1HB SER 21 -1.471 1.190 6.251 130 HG SER 21 HG SER 21 0.408 1.655 5.062 131 H CYS 22 H CYS 22 -4.002 0.116 3.422 132 HA CYS 22 HA CYS 22 -3.318 0.061 0.652 133 1HB CYS 22 2HB CYS 22 -5.430 -0.871 1.757 134 2HB CYS 22 1HB CYS 22 -6.016 0.786 1.798 135 H SER 23 H SER 23 -1.871 1.976 0.889 136 HA SER 23 HA SER 23 -2.862 4.571 1.313 137 1HB SER 23 2HB SER 23 -0.408 3.759 -0.257 138 2HB SER 23 1HB SER 23 -0.709 5.324 0.500 139 HG SER 23 HG SER 23 -1.002 3.711 2.452 140 H LYS 24 H LYS 24 -2.694 2.596 -1.598 141 HA LYS 24 HA LYS 24 -4.407 4.477 -2.934 142 1HB LYS 24 2HB LYS 24 -2.925 4.710 -4.928 143 2HB LYS 24 1HB LYS 24 -2.331 5.533 -3.494 144 1HG LYS 24 2HG LYS 24 -0.611 3.992 -3.174 145 2HG LYS 24 1HG LYS 24 -1.378 2.783 -4.207 146 1HD LYS 24 2HD LYS 24 -0.258 5.418 -5.160 147 2HD LYS 24 1HD LYS 24 0.570 3.863 -5.278 148 1HE LYS 24 2HE LYS 24 -1.229 2.999 -6.682 149 2HE LYS 24 1HE LYS 24 -2.091 4.531 -6.538 150 1HZ LYS 24 1HZ LYS 24 -0.973 4.569 -8.593 151 2HZ LYS 24 2HZ LYS 24 0.479 4.021 -7.921 152 3HZ LYS 24 3HZ LYS 24 -0.078 5.579 -7.573 153 H TYR 25 H TYR 25 -5.875 3.306 -3.831 154 HA TYR 25 HA TYR 25 -5.795 0.539 -4.217 155 1HB TYR 25 2HB TYR 25 -7.865 1.793 -3.947 156 2HB TYR 25 1HB TYR 25 -7.563 2.673 -5.437 157 HD1 TYR 25 1HD TYR 25 -8.048 -0.823 -4.204 158 HD2 TYR 25 2HD TYR 25 -8.580 1.952 -7.384 159 HE1 TYR 25 1HE TYR 25 -9.326 -2.510 -5.457 160 HE2 TYR 25 2HE TYR 25 -9.858 0.273 -8.645 161 HH TYR 25 HH TYR 25 -11.079 -2.519 -7.270 162 HA PRO 26 HA PRO 26 -6.038 -1.044 -5.054 163 1HB PRO 26 2HB PRO 26 -5.617 -3.148 -6.636 164 2HB PRO 26 1HB PRO 26 -6.870 -1.964 -7.026 165 1HG PRO 26 2HG PRO 26 -4.287 -2.452 -8.354 166 2HG PRO 26 1HG PRO 26 -5.731 -1.639 -8.976 167 1HD PRO 26 2HD PRO 26 -3.339 -0.468 -7.776 168 2HD PRO 26 1HD PRO 26 -4.670 0.342 -8.630 169 H LEU 27 H LEU 27 -3.257 -0.019 -4.739 170 HA LEU 27 HA LEU 27 -1.936 -2.577 -4.127 171 1HB LEU 27 2HB LEU 27 -0.723 -0.004 -5.092 172 2HB LEU 27 1HB LEU 27 0.220 -1.333 -4.438 173 HG LEU 27 HG LEU 27 -1.646 -1.727 -6.738 174 1HD1 LEU 27 1HD1 LEU 27 1.016 -1.613 -7.674 175 2HD1 LEU 27 2HD1 LEU 27 0.733 -0.145 -6.737 176 3HD1 LEU 27 3HD1 LEU 27 -0.327 -0.547 -8.089 177 1HD2 LEU 27 1HD2 LEU 27 -0.448 -3.707 -7.125 178 2HD2 LEU 27 2HD2 LEU 27 -0.672 -3.641 -5.377 179 3HD2 LEU 27 3HD2 LEU 27 0.882 -3.203 -6.083 180 H CYS 28 H CYS 28 -1.023 -2.882 -2.242 181 HA CYS 28 HA CYS 28 -1.597 -0.942 -0.147 182 1HB CYS 28 2HB CYS 28 -2.055 -3.471 0.031 183 2HB CYS 28 1HB CYS 28 -0.317 -3.640 0.249 184 H ALA 29 H ALA 29 -0.027 0.041 1.095 185 HA ALA 29 HA ALA 29 2.691 -0.101 -0.021 186 1HB ALA 29 1HB ALA 29 1.917 2.054 -0.416 187 2HB ALA 29 2HB ALA 29 2.879 2.221 1.052 188 3HB ALA 29 3HB ALA 29 1.119 2.159 1.152 189 H LYS 30 H LYS 30 4.336 -0.634 1.210 190 HA LYS 30 HA LYS 30 3.921 -1.406 3.960 191 1HB LYS 30 2HB LYS 30 5.333 -2.818 2.623 192 2HB LYS 30 1HB LYS 30 6.301 -1.454 2.092 193 1HG LYS 30 2HG LYS 30 7.549 -2.742 3.671 194 2HG LYS 30 1HG LYS 30 7.132 -1.191 4.400 195 1HD LYS 30 2HD LYS 30 5.299 -2.257 5.619 196 2HD LYS 30 1HD LYS 30 5.705 -3.808 4.877 197 1HE LYS 30 2HE LYS 30 7.907 -3.741 5.919 198 2HE LYS 30 1HE LYS 30 7.534 -2.174 6.634 199 1HZ LYS 30 1HZ LYS 30 7.128 -4.586 7.801 200 2HZ LYS 30 2HZ LYS 30 5.579 -4.184 7.252 201 3HZ LYS 30 3HZ LYS 30 6.415 -3.131 8.280 202 H ASN 31 H ASN 31 3.605 0.320 5.223 203 HA ASN 31 HA ASN 31 3.799 2.357 6.170 204 1HB ASN 31 2HB ASN 31 6.032 2.885 7.143 205 2HB ASN 31 1HB ASN 31 5.456 1.267 7.502 206 1HD2 ASN 31 1HD2 ASN 31 7.863 3.169 5.946 207 2HD2 ASN 31 2HD2 ASN 31 8.912 1.868 5.509 Start of MODEL 15 1 H GLY 1 H GLY 1 3.282 3.308 2.549 2 1HA GLY 1 2HA GLY 1 3.398 5.118 0.897 3 2HA GLY 1 1HA GLY 1 4.925 5.584 1.631 4 H SER 2 H SER 2 5.874 2.844 1.894 5 HA SER 2 HA SER 2 6.980 2.583 -0.749 6 1HB SER 2 2HB SER 2 7.384 0.847 1.696 7 2HB SER 2 1HB SER 2 8.382 0.846 0.241 8 HG SER 2 HG SER 2 8.159 2.807 2.248 9 H ILE 3 H ILE 3 5.378 1.882 -2.155 10 HA ILE 3 HA ILE 3 3.602 -0.259 -1.620 11 HB ILE 3 HB ILE 3 4.457 0.946 -4.256 12 1HG1 ILE 3 2HG1 ILE 3 1.959 1.638 -4.175 13 2HG1 ILE 3 1HG1 ILE 3 2.069 1.272 -2.458 14 1HG2 ILE 3 1HG2 ILE 3 2.253 -0.284 -4.995 15 2HG2 ILE 3 2HG2 ILE 3 2.691 -1.379 -3.684 16 3HG2 ILE 3 3HG2 ILE 3 3.811 -1.110 -5.019 17 1HD1 ILE 3 1HD1 ILE 3 2.891 3.277 -2.088 18 2HD1 ILE 3 2HD1 ILE 3 2.798 3.638 -3.812 19 3HD1 ILE 3 3HD1 ILE 3 4.263 2.923 -3.138 20 HA PRO 4 HA PRO 4 6.731 -2.859 -4.484 21 1HB PRO 4 2HB PRO 4 9.204 -1.489 -3.532 22 2HB PRO 4 1HB PRO 4 8.851 -2.215 -5.105 23 1HG PRO 4 2HG PRO 4 8.807 0.416 -4.820 24 2HG PRO 4 1HG PRO 4 7.575 -0.400 -5.801 25 1HD PRO 4 2HD PRO 4 7.363 0.731 -3.044 26 2HD PRO 4 1HD PRO 4 6.173 0.739 -4.361 27 H ALA 5 H ALA 5 7.387 -1.655 -1.256 28 HA ALA 5 HA ALA 5 8.927 -3.826 -0.330 29 1HB ALA 5 1HB ALA 5 9.018 -1.905 0.993 30 2HB ALA 5 2HB ALA 5 8.067 -3.037 1.954 31 3HB ALA 5 3HB ALA 5 7.262 -1.751 1.054 32 H CYS 6 H CYS 6 5.445 -3.158 -0.106 33 HA CYS 6 HA CYS 6 4.901 -5.736 1.078 34 1HB CYS 6 2HB CYS 6 2.811 -3.902 -0.057 35 2HB CYS 6 1HB CYS 6 2.698 -4.986 1.326 36 H GLY 7 H GLY 7 3.998 -4.091 -1.946 37 1HA GLY 7 2HA GLY 7 3.891 -4.946 -4.087 38 2HA GLY 7 1HA GLY 7 4.380 -6.507 -3.458 39 H GLU 8 H GLU 8 2.181 -6.697 -1.518 40 HA GLU 8 HA GLU 8 0.299 -7.851 -3.298 41 1HB GLU 8 2HB GLU 8 -0.677 -8.838 -1.492 42 2HB GLU 8 1HB GLU 8 0.914 -8.502 -0.833 43 1HG GLU 8 2HG GLU 8 -1.221 -6.474 -0.462 44 2HG GLU 8 1HG GLU 8 -1.292 -7.954 0.488 45 H SER 9 H SER 9 -1.884 -7.458 -3.514 46 HA SER 9 HA SER 9 -2.566 -4.626 -3.538 47 1HB SER 9 2HB SER 9 -4.079 -6.953 -4.748 48 2HB SER 9 1HB SER 9 -4.302 -5.238 -5.099 49 HG SER 9 HG SER 9 -1.736 -5.903 -5.484 50 H CYS 10 H CYS 10 -4.465 -3.842 -2.572 51 HA CYS 10 HA CYS 10 -5.318 -5.398 -0.271 52 1HB CYS 10 2HB CYS 10 -6.171 -3.390 0.607 53 2HB CYS 10 1HB CYS 10 -4.706 -2.914 -0.227 54 H PHE 11 H PHE 11 -6.463 -4.338 -3.344 55 HA PHE 11 HA PHE 11 -8.441 -4.421 -4.439 56 1HB PHE 11 2HB PHE 11 -9.364 -6.770 -4.579 57 2HB PHE 11 1HB PHE 11 -7.670 -6.568 -4.990 58 HD1 PHE 11 1HD PHE 11 -9.919 -7.641 -2.221 59 HD2 PHE 11 2HD PHE 11 -6.055 -7.887 -3.989 60 HE1 PHE 11 1HE PHE 11 -9.322 -9.440 -0.656 61 HE2 PHE 11 2HE PHE 11 -5.453 -9.688 -2.425 62 HZ PHE 11 HZ PHE 11 -7.086 -10.465 -0.756 63 H LYS 12 H LYS 12 -9.022 -3.035 -2.294 64 HA LYS 12 HA LYS 12 -10.772 -2.219 -1.097 65 1HB LYS 12 2HB LYS 12 -12.370 -4.378 -2.487 66 2HB LYS 12 1HB LYS 12 -13.052 -3.070 -1.536 67 1HG LYS 12 2HG LYS 12 -12.180 -1.447 -3.138 68 2HG LYS 12 1HG LYS 12 -11.489 -2.765 -4.092 69 1HD LYS 12 2HD LYS 12 -13.746 -3.700 -4.397 70 2HD LYS 12 1HD LYS 12 -14.417 -2.350 -3.481 71 1HE LYS 12 2HE LYS 12 -12.895 -2.141 -6.075 72 2HE LYS 12 1HE LYS 12 -14.643 -2.016 -5.895 73 1HZ LYS 12 1HZ LYS 12 -14.351 0.142 -5.573 74 2HZ LYS 12 2HZ LYS 12 -12.665 -0.021 -5.553 75 3HZ LYS 12 3HZ LYS 12 -13.552 -0.203 -4.121 76 H GLY 13 H GLY 13 -9.083 -3.961 0.231 77 1HA GLY 13 2HA GLY 13 -10.801 -4.776 2.369 78 2HA GLY 13 1HA GLY 13 -10.126 -6.144 1.501 79 H LYS 14 H LYS 14 -8.989 -6.839 3.285 80 HA LYS 14 HA LYS 14 -7.111 -5.149 4.624 81 1HB LYS 14 2HB LYS 14 -6.546 -7.289 5.819 82 2HB LYS 14 1HB LYS 14 -8.233 -6.806 5.924 83 1HG LYS 14 2HG LYS 14 -8.370 -9.080 5.520 84 2HG LYS 14 1HG LYS 14 -8.573 -8.396 3.908 85 1HD LYS 14 2HD LYS 14 -6.043 -8.666 3.682 86 2HD LYS 14 1HD LYS 14 -6.164 -9.693 5.096 87 1HE LYS 14 2HE LYS 14 -6.295 -11.220 3.358 88 2HE LYS 14 1HE LYS 14 -7.993 -10.932 3.741 89 1HZ LYS 14 1HZ LYS 14 -6.960 -9.081 1.808 90 2HZ LYS 14 2HZ LYS 14 -8.346 -10.052 1.738 91 3HZ LYS 14 3HZ LYS 14 -6.844 -10.690 1.282 92 H CYS 15 H CYS 15 -4.858 -5.487 4.707 93 HA CYS 15 HA CYS 15 -3.707 -6.248 2.159 94 1HB CYS 15 2HB CYS 15 -2.493 -5.026 4.648 95 2HB CYS 15 1HB CYS 15 -1.596 -5.356 3.169 96 H TYR 16 H TYR 16 -1.194 -7.154 2.911 97 HA TYR 16 HA TYR 16 -1.788 -9.591 4.452 98 1HB TYR 16 2HB TYR 16 -0.352 -9.430 1.798 99 2HB TYR 16 1HB TYR 16 -0.296 -10.844 2.846 100 HD1 TYR 16 1HD TYR 16 -2.040 -12.428 2.824 101 HD2 TYR 16 2HD TYR 16 -2.606 -8.668 0.918 102 HE1 TYR 16 1HE TYR 16 -4.153 -13.238 1.863 103 HE2 TYR 16 2HE TYR 16 -4.718 -9.467 -0.047 104 HH TYR 16 HH TYR 16 -5.582 -12.390 -0.448 105 H THR 17 H THR 17 0.715 -7.435 3.177 106 HA THR 17 HA THR 17 2.714 -8.487 4.937 107 HB THR 17 HB THR 17 2.772 -5.889 3.390 108 HG1 THR 17 1HG THR 17 2.681 -7.284 1.756 109 1HG2 THR 17 1HG2 THR 17 5.033 -5.790 3.801 110 2HG2 THR 17 2HG2 THR 17 5.179 -7.533 4.021 111 3HG2 THR 17 3HG2 THR 17 4.483 -6.538 5.300 112 HA PRO 18 HA PRO 18 1.175 -6.362 8.541 113 1HB PRO 18 2HB PRO 18 3.950 -6.797 9.478 114 2HB PRO 18 1HB PRO 18 2.423 -7.231 10.247 115 1HG PRO 18 2HG PRO 18 3.966 -9.086 9.090 116 2HG PRO 18 1HG PRO 18 2.197 -9.176 9.023 117 1HD PRO 18 2HD PRO 18 4.138 -8.373 6.908 118 2HD PRO 18 1HD PRO 18 2.592 -9.234 6.757 119 H GLY 19 H GLY 19 1.059 -4.278 8.905 120 1HA GLY 19 2HA GLY 19 1.886 -2.142 9.424 121 2HA GLY 19 1HA GLY 19 3.436 -2.599 8.735 122 H CYS 20 H CYS 20 1.434 -3.637 6.424 123 HA CYS 20 HA CYS 20 1.793 -1.177 4.912 124 1HB CYS 20 2HB CYS 20 0.804 -3.881 4.000 125 2HB CYS 20 1HB CYS 20 1.169 -2.509 2.958 126 H SER 21 H SER 21 0.171 -0.086 3.839 127 HA SER 21 HA SER 21 -2.597 -0.748 4.557 128 1HB SER 21 2HB SER 21 -1.393 2.029 4.734 129 2HB SER 21 1HB SER 21 -3.062 1.586 5.099 130 HG SER 21 HG SER 21 -1.471 0.011 6.522 131 H CYS 22 H CYS 22 -4.118 -0.192 2.986 132 HA CYS 22 HA CYS 22 -3.089 0.092 0.330 133 1HB CYS 22 2HB CYS 22 -5.127 -1.276 1.036 134 2HB CYS 22 1HB CYS 22 -5.995 0.254 1.115 135 H SER 23 H SER 23 -2.137 2.274 1.345 136 HA SER 23 HA SER 23 -3.896 4.536 1.241 137 1HB SER 23 2HB SER 23 -0.874 4.551 1.089 138 2HB SER 23 1HB SER 23 -1.930 5.840 1.668 139 HG SER 23 HG SER 23 -2.066 4.888 3.548 140 H LYS 24 H LYS 24 -2.264 2.617 -0.995 141 HA LYS 24 HA LYS 24 -2.626 4.621 -3.111 142 1HB LYS 24 2HB LYS 24 -0.552 2.426 -2.950 143 2HB LYS 24 1HB LYS 24 -0.772 3.521 -4.310 144 1HG LYS 24 2HG LYS 24 -0.066 4.391 -1.516 145 2HG LYS 24 1HG LYS 24 1.099 4.141 -2.812 146 1HD LYS 24 2HD LYS 24 -1.171 6.131 -2.805 147 2HD LYS 24 1HD LYS 24 0.540 6.503 -2.599 148 1HE LYS 24 2HE LYS 24 -0.717 5.288 -5.059 149 2HE LYS 24 1HE LYS 24 -0.233 6.973 -4.879 150 1HZ LYS 24 1HZ LYS 24 1.357 4.683 -5.513 151 2HZ LYS 24 2HZ LYS 24 2.006 5.564 -4.223 152 3HZ LYS 24 3HZ LYS 24 1.712 6.327 -5.704 153 H TYR 25 H TYR 25 -4.797 3.488 -2.715 154 HA TYR 25 HA TYR 25 -5.576 0.989 -3.319 155 1HB TYR 25 2HB TYR 25 -7.162 2.694 -2.722 156 2HB TYR 25 1HB TYR 25 -6.819 3.603 -4.187 157 HD1 TYR 25 1HD TYR 25 -8.239 3.394 -5.988 158 HD2 TYR 25 2HD TYR 25 -8.123 0.269 -3.103 159 HE1 TYR 25 1HE TYR 25 -10.105 2.279 -7.132 160 HE2 TYR 25 2HE TYR 25 -9.989 -0.858 -4.245 161 HH TYR 25 HH TYR 25 -10.964 -0.120 -7.329 162 HA PRO 26 HA PRO 26 -6.302 -0.466 -3.991 163 1HB PRO 26 2HB PRO 26 -6.475 -2.721 -5.408 164 2HB PRO 26 1HB PRO 26 -7.570 -1.367 -5.710 165 1HG PRO 26 2HG PRO 26 -5.317 -2.360 -7.341 166 2HG PRO 26 1HG PRO 26 -6.734 -1.422 -7.835 167 1HD PRO 26 2HD PRO 26 -4.069 -0.473 -7.225 168 2HD PRO 26 1HD PRO 26 -5.461 0.453 -7.821 169 H LEU 27 H LEU 27 -3.336 0.034 -4.358 170 HA LEU 27 HA LEU 27 -2.321 -2.640 -3.674 171 1HB LEU 27 2HB LEU 27 -0.960 -0.189 -4.753 172 2HB LEU 27 1HB LEU 27 -0.065 -1.541 -4.087 173 HG LEU 27 HG LEU 27 -2.041 -1.924 -6.299 174 1HD1 LEU 27 1HD1 LEU 27 -0.192 -1.763 -7.890 175 2HD1 LEU 27 2HD1 LEU 27 0.896 -1.294 -6.583 176 3HD1 LEU 27 3HD1 LEU 27 -0.435 -0.233 -7.046 177 1HD2 LEU 27 1HD2 LEU 27 0.098 -3.671 -6.539 178 2HD2 LEU 27 2HD2 LEU 27 -1.504 -4.044 -5.900 179 3HD2 LEU 27 3HD2 LEU 27 -0.204 -3.577 -4.804 180 H CYS 28 H CYS 28 -1.124 -3.001 -1.873 181 HA CYS 28 HA CYS 28 -1.523 -1.082 0.279 182 1HB CYS 28 2HB CYS 28 -0.437 -3.903 0.251 183 2HB CYS 28 1HB CYS 28 -0.585 -2.920 1.705 184 H ALA 29 H ALA 29 -0.019 0.254 1.002 185 HA ALA 29 HA ALA 29 2.742 -0.105 0.054 186 1HB ALA 29 1HB ALA 29 1.666 1.878 -0.851 187 2HB ALA 29 2HB ALA 29 2.959 2.330 0.259 188 3HB ALA 29 3HB ALA 29 1.278 2.429 0.778 189 H LYS 30 H LYS 30 4.380 -0.113 1.478 190 HA LYS 30 HA LYS 30 3.748 -0.358 4.281 191 1HB LYS 30 2HB LYS 30 5.439 -1.799 3.097 192 2HB LYS 30 1HB LYS 30 6.465 -0.380 2.949 193 1HG LYS 30 2HG LYS 30 7.019 -1.945 4.830 194 2HG LYS 30 1HG LYS 30 6.792 -0.255 5.284 195 1HD LYS 30 2HD LYS 30 4.705 -0.676 6.252 196 2HD LYS 30 1HD LYS 30 4.534 -2.225 5.424 197 1HE LYS 30 2HE LYS 30 6.694 -1.720 7.448 198 2HE LYS 30 1HE LYS 30 5.087 -2.279 7.911 199 1HZ LYS 30 1HZ LYS 30 6.311 -3.779 5.767 200 2HZ LYS 30 2HZ LYS 30 5.483 -4.325 7.140 201 3HZ LYS 30 3HZ LYS 30 7.119 -3.896 7.250 202 H ASN 31 H ASN 31 2.942 1.748 4.577 203 HA ASN 31 HA ASN 31 3.012 3.904 5.251 204 1HB ASN 31 2HB ASN 31 4.877 2.778 6.736 205 2HB ASN 31 1HB ASN 31 5.972 3.725 5.735 206 1HD2 ASN 31 1HD2 ASN 31 4.428 3.716 8.578 207 2HD2 ASN 31 2HD2 ASN 31 4.270 5.412 8.854 Start of MODEL 16 1 H GLY 1 H GLY 1 3.447 2.459 3.291 2 1HA GLY 1 2HA GLY 1 3.121 4.458 2.008 3 2HA GLY 1 1HA GLY 1 4.633 5.074 2.649 4 H SER 2 H SER 2 5.898 2.378 2.102 5 HA SER 2 HA SER 2 6.653 2.998 -0.635 6 1HB SER 2 2HB SER 2 8.397 2.531 1.053 7 2HB SER 2 1HB SER 2 7.758 0.898 1.245 8 HG SER 2 HG SER 2 9.602 1.514 -0.371 9 H ILE 3 H ILE 3 5.479 2.187 -2.224 10 HA ILE 3 HA ILE 3 3.796 -0.072 -1.967 11 HB ILE 3 HB ILE 3 4.675 1.494 -4.385 12 1HG1 ILE 3 2HG1 ILE 3 2.147 1.992 -4.381 13 2HG1 ILE 3 1HG1 ILE 3 2.151 1.341 -2.747 14 1HG2 ILE 3 1HG2 ILE 3 2.913 -0.934 -4.256 15 2HG2 ILE 3 2HG2 ILE 3 4.318 -0.647 -5.281 16 3HG2 ILE 3 3HG2 ILE 3 2.820 0.236 -5.572 17 1HD1 ILE 3 1HD1 ILE 3 2.728 3.328 -1.988 18 2HD1 ILE 3 2HD1 ILE 3 2.817 3.954 -3.636 19 3HD1 ILE 3 3HD1 ILE 3 4.241 3.226 -2.891 20 HA PRO 4 HA PRO 4 7.071 -2.311 -4.895 21 1HB PRO 4 2HB PRO 4 9.503 -0.892 -3.923 22 2HB PRO 4 1HB PRO 4 9.126 -1.511 -5.536 23 1HG PRO 4 2HG PRO 4 9.004 1.093 -5.038 24 2HG PRO 4 1HG PRO 4 7.786 0.311 -6.065 25 1HD PRO 4 2HD PRO 4 7.576 1.202 -3.219 26 2HD PRO 4 1HD PRO 4 6.370 1.285 -4.519 27 H ALA 5 H ALA 5 7.920 -1.124 -1.685 28 HA ALA 5 HA ALA 5 9.324 -3.504 -0.930 29 1HB ALA 5 1HB ALA 5 10.032 -2.224 0.738 30 2HB ALA 5 2HB ALA 5 8.387 -2.020 1.337 31 3HB ALA 5 3HB ALA 5 9.023 -0.920 0.115 32 H CYS 6 H CYS 6 6.025 -2.494 -0.926 33 HA CYS 6 HA CYS 6 5.194 -4.410 1.054 34 1HB CYS 6 2HB CYS 6 4.029 -2.240 0.726 35 2HB CYS 6 1HB CYS 6 3.473 -2.820 -0.843 36 H GLY 7 H GLY 7 4.421 -4.021 -2.421 37 1HA GLY 7 2HA GLY 7 4.250 -5.689 -4.043 38 2HA GLY 7 1HA GLY 7 4.589 -6.894 -2.807 39 H GLU 8 H GLU 8 2.557 -6.032 -0.997 40 HA GLU 8 HA GLU 8 0.390 -7.606 -1.748 41 1HB GLU 8 2HB GLU 8 0.990 -6.956 0.574 42 2HB GLU 8 1HB GLU 8 0.423 -5.326 0.239 43 1HG GLU 8 2HG GLU 8 -1.444 -6.116 1.210 44 2HG GLU 8 1HG GLU 8 -1.774 -6.672 -0.430 45 H SER 9 H SER 9 -1.591 -7.190 -2.656 46 HA SER 9 HA SER 9 -2.068 -4.438 -3.592 47 1HB SER 9 2HB SER 9 -2.795 -6.985 -5.059 48 2HB SER 9 1HB SER 9 -3.040 -5.336 -5.635 49 HG SER 9 HG SER 9 -0.450 -6.049 -4.894 50 H CYS 10 H CYS 10 -3.784 -3.611 -2.606 51 HA CYS 10 HA CYS 10 -5.778 -5.354 -1.421 52 1HB CYS 10 2HB CYS 10 -6.664 -3.143 -0.524 53 2HB CYS 10 1HB CYS 10 -5.063 -3.620 0.022 54 H PHE 11 H PHE 11 -5.970 -5.623 -4.089 55 HA PHE 11 HA PHE 11 -7.672 -3.778 -5.368 56 1HB PHE 11 2HB PHE 11 -8.108 -5.695 -6.978 57 2HB PHE 11 1HB PHE 11 -6.434 -5.198 -6.784 58 HD1 PHE 11 1HD PHE 11 -4.795 -6.716 -6.088 59 HD2 PHE 11 2HD PHE 11 -8.903 -7.787 -5.815 60 HE1 PHE 11 1HE PHE 11 -4.153 -9.042 -5.615 61 HE2 PHE 11 2HE PHE 11 -8.268 -10.114 -5.331 62 HZ PHE 11 HZ PHE 11 -5.890 -10.745 -5.233 63 H LYS 12 H LYS 12 -8.346 -6.691 -3.505 64 HA LYS 12 HA LYS 12 -11.071 -5.784 -3.077 65 1HB LYS 12 2HB LYS 12 -10.434 -8.437 -4.384 66 2HB LYS 12 1HB LYS 12 -11.977 -8.082 -3.626 67 1HG LYS 12 2HG LYS 12 -12.305 -6.233 -5.222 68 2HG LYS 12 1HG LYS 12 -10.786 -6.670 -6.005 69 1HD LYS 12 2HD LYS 12 -12.666 -7.610 -7.224 70 2HD LYS 12 1HD LYS 12 -11.701 -8.897 -6.501 71 1HE LYS 12 2HE LYS 12 -14.098 -9.312 -6.232 72 2HE LYS 12 1HE LYS 12 -13.299 -9.095 -4.675 73 1HZ LYS 12 1HZ LYS 12 -15.345 -7.886 -4.676 74 2HZ LYS 12 2HZ LYS 12 -14.951 -7.093 -6.117 75 3HZ LYS 12 3HZ LYS 12 -14.077 -6.765 -4.707 76 H GLY 13 H GLY 13 -8.892 -5.910 -1.340 77 1HA GLY 13 2HA GLY 13 -9.993 -7.324 0.828 78 2HA GLY 13 1HA GLY 13 -8.675 -8.270 0.148 79 H LYS 14 H LYS 14 -8.745 -7.158 2.761 80 HA LYS 14 HA LYS 14 -7.195 -4.776 2.864 81 1HB LYS 14 2HB LYS 14 -6.896 -5.421 5.294 82 2HB LYS 14 1HB LYS 14 -8.555 -5.225 4.756 83 1HG LYS 14 2HG LYS 14 -8.554 -7.127 6.130 84 2HG LYS 14 1HG LYS 14 -8.620 -7.746 4.481 85 1HD LYS 14 2HD LYS 14 -6.234 -8.214 4.540 86 2HD LYS 14 1HD LYS 14 -6.122 -7.524 6.157 87 1HE LYS 14 2HE LYS 14 -7.827 -9.903 5.445 88 2HE LYS 14 1HE LYS 14 -6.190 -10.020 6.091 89 1HZ LYS 14 1HZ LYS 14 -8.458 -8.680 7.462 90 2HZ LYS 14 2HZ LYS 14 -6.903 -8.913 8.085 91 3HZ LYS 14 3HZ LYS 14 -7.909 -10.244 7.804 92 H CYS 15 H CYS 15 -5.002 -4.586 3.616 93 HA CYS 15 HA CYS 15 -3.210 -6.324 2.301 94 1HB CYS 15 2HB CYS 15 -2.412 -4.501 4.560 95 2HB CYS 15 1HB CYS 15 -1.497 -4.930 3.118 96 H TYR 16 H TYR 16 -2.144 -8.111 2.999 97 HA TYR 16 HA TYR 16 -2.867 -9.157 5.612 98 1HB TYR 16 2HB TYR 16 -1.356 -10.381 3.295 99 2HB TYR 16 1HB TYR 16 -1.665 -11.215 4.812 100 HD1 TYR 16 1HD TYR 16 -3.541 -12.556 4.971 101 HD2 TYR 16 2HD TYR 16 -3.510 -9.417 2.100 102 HE1 TYR 16 1HE TYR 16 -5.713 -13.325 4.115 103 HE2 TYR 16 2HE TYR 16 -5.684 -10.174 1.239 104 HH TYR 16 HH TYR 16 -7.057 -12.149 1.189 105 H THR 17 H THR 17 0.021 -8.243 3.795 106 HA THR 17 HA THR 17 1.843 -8.921 5.852 107 HB THR 17 HB THR 17 2.735 -8.807 3.671 108 HG1 THR 17 1HG THR 17 4.094 -7.924 5.373 109 1HG2 THR 17 1HG2 THR 17 2.805 -6.260 2.746 110 2HG2 THR 17 2HG2 THR 17 1.225 -6.304 3.528 111 3HG2 THR 17 3HG2 THR 17 1.616 -7.470 2.263 112 HA PRO 18 HA PRO 18 0.901 -5.705 8.769 113 1HB PRO 18 2HB PRO 18 3.559 -6.567 9.782 114 2HB PRO 18 1HB PRO 18 2.021 -6.423 10.639 115 1HG PRO 18 2HG PRO 18 2.993 -8.815 9.971 116 2HG PRO 18 1HG PRO 18 1.254 -8.475 9.884 117 1HD PRO 18 2HD PRO 18 3.264 -8.648 7.680 118 2HD PRO 18 1HD PRO 18 1.568 -9.166 7.702 119 H GLY 19 H GLY 19 1.380 -3.603 8.782 120 1HA GLY 19 2HA GLY 19 2.921 -1.775 8.788 121 2HA GLY 19 1HA GLY 19 4.028 -2.755 7.834 122 H CYS 20 H CYS 20 1.583 -3.621 6.172 123 HA CYS 20 HA CYS 20 1.819 -1.360 4.350 124 1HB CYS 20 2HB CYS 20 0.612 -4.088 4.002 125 2HB CYS 20 1HB CYS 20 0.510 -2.826 2.788 126 H SER 21 H SER 21 0.158 -0.239 3.502 127 HA SER 21 HA SER 21 -2.496 -0.545 4.698 128 1HB SER 21 2HB SER 21 -1.035 2.100 4.436 129 2HB SER 21 1HB SER 21 -2.661 1.862 5.078 130 HG SER 21 HG SER 21 -0.998 0.256 6.394 131 H CYS 22 H CYS 22 -4.175 0.039 3.306 132 HA CYS 22 HA CYS 22 -3.517 0.017 0.512 133 1HB CYS 22 2HB CYS 22 -5.523 -1.123 1.603 134 2HB CYS 22 1HB CYS 22 -6.251 0.475 1.716 135 H SER 23 H SER 23 -2.280 2.168 1.365 136 HA SER 23 HA SER 23 -3.915 4.547 1.146 137 1HB SER 23 2HB SER 23 -0.893 4.316 1.310 138 2HB SER 23 1HB SER 23 -1.881 5.739 1.668 139 HG SER 23 HG SER 23 -2.495 4.869 3.539 140 H LYS 24 H LYS 24 -3.297 2.519 -1.091 141 HA LYS 24 HA LYS 24 -3.050 4.466 -3.218 142 1HB LYS 24 2HB LYS 24 -0.998 2.289 -2.773 143 2HB LYS 24 1HB LYS 24 -1.252 3.036 -4.342 144 1HG LYS 24 2HG LYS 24 -0.528 4.578 -1.867 145 2HG LYS 24 1HG LYS 24 0.656 3.944 -3.010 146 1HD LYS 24 2HD LYS 24 -0.201 5.307 -4.771 147 2HD LYS 24 1HD LYS 24 -1.605 5.769 -3.807 148 1HE LYS 24 2HE LYS 24 1.260 6.470 -3.180 149 2HE LYS 24 1HE LYS 24 0.079 7.556 -3.913 150 1HZ LYS 24 1HZ LYS 24 0.472 6.927 -1.174 151 2HZ LYS 24 2HZ LYS 24 -1.120 6.569 -1.631 152 3HZ LYS 24 3HZ LYS 24 -0.500 8.129 -1.865 153 H TYR 25 H TYR 25 -5.292 3.152 -2.673 154 HA TYR 25 HA TYR 25 -5.772 0.591 -3.504 155 1HB TYR 25 2HB TYR 25 -7.443 2.234 -2.553 156 2HB TYR 25 1HB TYR 25 -7.582 2.926 -4.165 157 HD1 TYR 25 1HD TYR 25 -7.880 -0.345 -2.392 158 HD2 TYR 25 2HD TYR 25 -9.222 2.108 -5.598 159 HE1 TYR 25 1HE TYR 25 -9.583 -2.025 -2.955 160 HE2 TYR 25 2HE TYR 25 -10.932 0.433 -6.169 161 HH TYR 25 HH TYR 25 -10.903 -2.721 -4.902 162 HA PRO 26 HA PRO 26 -6.562 -0.826 -4.425 163 1HB PRO 26 2HB PRO 26 -6.596 -2.825 -6.188 164 2HB PRO 26 1HB PRO 26 -7.818 -1.549 -6.221 165 1HG PRO 26 2HG PRO 26 -5.547 -2.030 -8.055 166 2HG PRO 26 1HG PRO 26 -7.086 -1.206 -8.359 167 1HD PRO 26 2HD PRO 26 -4.533 -0.037 -7.722 168 2HD PRO 26 1HD PRO 26 -6.068 0.791 -8.049 169 H LEU 27 H LEU 27 -3.792 -0.057 -4.282 170 HA LEU 27 HA LEU 27 -2.636 -2.718 -3.920 171 1HB LEU 27 2HB LEU 27 -0.388 -1.756 -4.617 172 2HB LEU 27 1HB LEU 27 -1.528 -2.154 -5.885 173 HG LEU 27 HG LEU 27 -1.524 0.643 -4.906 174 1HD1 LEU 27 1HD1 LEU 27 0.414 0.188 -7.032 175 2HD1 LEU 27 2HD1 LEU 27 0.900 -0.510 -5.486 176 3HD1 LEU 27 3HD1 LEU 27 0.524 1.210 -5.599 177 1HD2 LEU 27 1HD2 LEU 27 -2.757 -0.710 -6.941 178 2HD2 LEU 27 2HD2 LEU 27 -1.397 0.052 -7.766 179 3HD2 LEU 27 3HD2 LEU 27 -2.546 1.039 -6.862 180 H CYS 28 H CYS 28 -1.323 -2.966 -2.165 181 HA CYS 28 HA CYS 28 -1.616 -0.930 -0.129 182 1HB CYS 28 2HB CYS 28 -0.504 -3.736 -0.030 183 2HB CYS 28 1HB CYS 28 -0.629 -2.673 1.366 184 H ALA 29 H ALA 29 0.002 0.105 0.938 185 HA ALA 29 HA ALA 29 2.678 -0.058 -0.282 186 1HB ALA 29 1HB ALA 29 2.827 2.322 0.798 187 2HB ALA 29 2HB ALA 29 1.066 2.238 0.743 188 3HB ALA 29 3HB ALA 29 2.002 2.098 -0.745 189 H LYS 30 H LYS 30 4.341 -0.596 1.010 190 HA LYS 30 HA LYS 30 3.823 -1.296 3.765 191 1HB LYS 30 2HB LYS 30 5.256 -2.736 2.383 192 2HB LYS 30 1HB LYS 30 6.374 -1.403 2.133 193 1HG LYS 30 2HG LYS 30 7.225 -2.949 3.796 194 2HG LYS 30 1HG LYS 30 6.886 -1.376 4.520 195 1HD LYS 30 2HD LYS 30 5.786 -2.548 6.080 196 2HD LYS 30 1HD LYS 30 4.514 -2.683 4.867 197 1HE LYS 30 2HE LYS 30 6.740 -4.672 5.265 198 2HE LYS 30 1HE LYS 30 5.114 -4.839 5.916 199 1HZ LYS 30 1HZ LYS 30 4.792 -5.988 4.030 200 2HZ LYS 30 2HZ LYS 30 6.072 -5.242 3.206 201 3HZ LYS 30 3HZ LYS 30 4.578 -4.458 3.338 202 H ASN 31 H ASN 31 3.518 0.485 4.963 203 HA ASN 31 HA ASN 31 3.926 2.413 6.068 204 1HB ASN 31 2HB ASN 31 5.940 1.033 6.784 205 2HB ASN 31 1HB ASN 31 6.861 1.884 5.549 206 1HD2 ASN 31 1HD2 ASN 31 8.024 3.471 6.334 207 2HD2 ASN 31 2HD2 ASN 31 7.608 4.481 7.670 Start of MODEL 17 1 H GLY 1 H GLY 1 3.472 2.820 2.934 2 1HA GLY 1 2HA GLY 1 3.787 4.917 1.719 3 2HA GLY 1 1HA GLY 1 5.281 5.131 2.617 4 H SER 2 H SER 2 5.997 2.274 2.278 5 HA SER 2 HA SER 2 7.207 2.581 -0.348 6 1HB SER 2 2HB SER 2 7.657 0.439 1.738 7 2HB SER 2 1HB SER 2 8.666 0.764 0.327 8 HG SER 2 HG SER 2 8.225 2.944 1.949 9 H ILE 3 H ILE 3 5.918 1.983 -1.981 10 HA ILE 3 HA ILE 3 4.002 -0.105 -1.804 11 HB ILE 3 HB ILE 3 5.074 1.446 -4.152 12 1HG1 ILE 3 2HG1 ILE 3 2.614 2.136 -4.239 13 2HG1 ILE 3 1HG1 ILE 3 2.451 1.377 -2.661 14 1HG2 ILE 3 1HG2 ILE 3 2.841 -0.558 -4.341 15 2HG2 ILE 3 2HG2 ILE 3 4.507 -0.929 -4.782 16 3HG2 ILE 3 3HG2 ILE 3 3.627 0.329 -5.647 17 1HD1 ILE 3 1HD1 ILE 3 3.133 3.240 -1.704 18 2HD1 ILE 3 2HD1 ILE 3 3.317 3.993 -3.290 19 3HD1 ILE 3 3HD1 ILE 3 4.672 3.131 -2.560 20 HA PRO 4 HA PRO 4 7.135 -2.630 -4.623 21 1HB PRO 4 2HB PRO 4 9.681 -1.366 -3.760 22 2HB PRO 4 1HB PRO 4 9.200 -1.960 -5.354 23 1HG PRO 4 2HG PRO 4 9.299 0.649 -4.861 24 2HG PRO 4 1HG PRO 4 7.997 -0.038 -5.851 25 1HD PRO 4 2HD PRO 4 7.939 0.847 -2.993 26 2HD PRO 4 1HD PRO 4 6.717 1.061 -4.264 27 H ALA 5 H ALA 5 8.030 -1.393 -1.460 28 HA ALA 5 HA ALA 5 9.431 -3.704 -0.592 29 1HB ALA 5 1HB ALA 5 9.464 -1.299 0.365 30 2HB ALA 5 2HB ALA 5 9.620 -2.667 1.466 31 3HB ALA 5 3HB ALA 5 8.073 -1.836 1.306 32 H CYS 6 H CYS 6 6.062 -2.747 -0.541 33 HA CYS 6 HA CYS 6 5.287 -4.872 1.241 34 1HB CYS 6 2HB CYS 6 4.086 -2.659 1.057 35 2HB CYS 6 1HB CYS 6 3.482 -3.199 -0.508 36 H GLY 7 H GLY 7 4.755 -4.147 -2.202 37 1HA GLY 7 2HA GLY 7 4.344 -5.501 -4.000 38 2HA GLY 7 1HA GLY 7 5.211 -6.747 -3.119 39 H GLU 8 H GLU 8 2.137 -5.168 -2.284 40 HA GLU 8 HA GLU 8 0.606 -7.482 -3.043 41 1HB GLU 8 2HB GLU 8 1.437 -8.297 -0.932 42 2HB GLU 8 1HB GLU 8 1.013 -6.795 -0.128 43 1HG GLU 8 2HG GLU 8 -0.547 -8.549 0.446 44 2HG GLU 8 1HG GLU 8 -1.353 -7.272 -0.459 45 H SER 9 H SER 9 -1.558 -7.109 -3.142 46 HA SER 9 HA SER 9 -2.352 -4.304 -3.117 47 1HB SER 9 2HB SER 9 -4.358 -5.148 -4.325 48 2HB SER 9 1HB SER 9 -2.849 -5.600 -5.118 49 HG SER 9 HG SER 9 -3.155 -7.624 -3.715 50 H CYS 10 H CYS 10 -4.524 -3.721 -2.219 51 HA CYS 10 HA CYS 10 -4.817 -4.985 0.385 52 1HB CYS 10 2HB CYS 10 -6.315 -3.129 0.937 53 2HB CYS 10 1HB CYS 10 -4.784 -2.541 0.311 54 H PHE 11 H PHE 11 -6.159 -5.157 -2.682 55 HA PHE 11 HA PHE 11 -7.949 -6.210 -3.596 56 1HB PHE 11 2HB PHE 11 -6.819 -8.080 -2.308 57 2HB PHE 11 1HB PHE 11 -8.006 -7.820 -1.037 58 HD1 PHE 11 1HD PHE 11 -8.388 -7.864 -4.743 59 HD2 PHE 11 2HD PHE 11 -9.377 -9.674 -1.021 60 HE1 PHE 11 1HE PHE 11 -9.948 -9.376 -5.898 61 HE2 PHE 11 2HE PHE 11 -10.939 -11.188 -2.168 62 HZ PHE 11 HZ PHE 11 -11.226 -11.040 -4.610 63 H LYS 12 H LYS 12 -8.607 -3.847 -2.526 64 HA LYS 12 HA LYS 12 -10.351 -2.546 -1.911 65 1HB LYS 12 2HB LYS 12 -11.923 -5.104 -2.274 66 2HB LYS 12 1HB LYS 12 -12.651 -3.533 -1.985 67 1HG LYS 12 2HG LYS 12 -12.828 -3.697 -4.259 68 2HG LYS 12 1HG LYS 12 -11.298 -2.836 -4.107 69 1HD LYS 12 2HD LYS 12 -10.071 -4.908 -4.412 70 2HD LYS 12 1HD LYS 12 -11.582 -5.819 -4.472 71 1HE LYS 12 2HE LYS 12 -12.235 -4.545 -6.479 72 2HE LYS 12 1HE LYS 12 -10.683 -3.710 -6.433 73 1HZ LYS 12 1HZ LYS 12 -9.610 -5.483 -7.263 74 2HZ LYS 12 2HZ LYS 12 -11.136 -5.929 -7.837 75 3HZ LYS 12 3HZ LYS 12 -10.541 -6.606 -6.406 76 H GLY 13 H GLY 13 -8.795 -3.402 0.209 77 1HA GLY 13 2HA GLY 13 -10.328 -2.800 2.395 78 2HA GLY 13 1HA GLY 13 -10.445 -4.543 2.255 79 H LYS 14 H LYS 14 -9.262 -5.426 3.714 80 HA LYS 14 HA LYS 14 -7.165 -4.300 5.132 81 1HB LYS 14 2HB LYS 14 -6.803 -6.711 5.873 82 2HB LYS 14 1HB LYS 14 -8.399 -6.026 6.139 83 1HG LYS 14 2HG LYS 14 -8.786 -8.190 5.325 84 2HG LYS 14 1HG LYS 14 -9.075 -7.132 3.946 85 1HD LYS 14 2HD LYS 14 -6.595 -7.574 3.387 86 2HD LYS 14 1HD LYS 14 -6.762 -8.934 4.484 87 1HE LYS 14 2HE LYS 14 -7.284 -9.950 2.499 88 2HE LYS 14 1HE LYS 14 -8.888 -9.434 3.019 89 1HZ LYS 14 1HZ LYS 14 -7.652 -8.823 0.641 90 2HZ LYS 14 2HZ LYS 14 -7.567 -7.385 1.534 91 3HZ LYS 14 3HZ LYS 14 -9.067 -8.116 1.250 92 H CYS 15 H CYS 15 -4.974 -4.987 5.328 93 HA CYS 15 HA CYS 15 -3.741 -5.614 2.743 94 1HB CYS 15 2HB CYS 15 -2.694 -4.175 5.179 95 2HB CYS 15 1HB CYS 15 -1.650 -4.698 3.860 96 H TYR 16 H TYR 16 -2.236 -7.256 2.570 97 HA TYR 16 HA TYR 16 -2.476 -9.327 4.571 98 1HB TYR 16 2HB TYR 16 -0.982 -9.357 1.938 99 2HB TYR 16 1HB TYR 16 -1.360 -10.756 2.937 100 HD1 TYR 16 1HD TYR 16 -3.249 -12.006 2.412 101 HD2 TYR 16 2HD TYR 16 -3.075 -7.940 1.174 102 HE1 TYR 16 1HE TYR 16 -5.379 -12.281 1.211 103 HE2 TYR 16 2HE TYR 16 -5.199 -8.204 -0.025 104 HH TYR 16 HH TYR 16 -6.457 -10.827 -0.991 105 H THR 17 H THR 17 0.152 -7.517 3.009 106 HA THR 17 HA THR 17 2.167 -8.616 4.669 107 HB THR 17 HB THR 17 2.364 -6.029 3.131 108 HG1 THR 17 1HG THR 17 3.127 -7.492 1.411 109 1HG2 THR 17 1HG2 THR 17 4.577 -6.153 3.487 110 2HG2 THR 17 2HG2 THR 17 4.621 -7.878 3.125 111 3HG2 THR 17 3HG2 THR 17 4.190 -7.329 4.744 112 HA PRO 18 HA PRO 18 1.314 -6.308 8.369 113 1HB PRO 18 2HB PRO 18 4.167 -6.850 8.929 114 2HB PRO 18 1HB PRO 18 2.741 -7.213 9.902 115 1HG PRO 18 2HG PRO 18 4.046 -9.142 8.587 116 2HG PRO 18 1HG PRO 18 2.281 -9.163 8.751 117 1HD PRO 18 2HD PRO 18 3.960 -8.441 6.392 118 2HD PRO 18 1HD PRO 18 2.394 -9.274 6.453 119 H GLY 19 H GLY 19 1.346 -4.219 8.711 120 1HA GLY 19 2HA GLY 19 2.281 -2.103 9.033 121 2HA GLY 19 1HA GLY 19 3.747 -2.654 8.237 122 H CYS 20 H CYS 20 1.343 -3.640 6.230 123 HA CYS 20 HA CYS 20 1.784 -1.324 4.518 124 1HB CYS 20 2HB CYS 20 0.405 -3.944 3.959 125 2HB CYS 20 1HB CYS 20 0.654 -2.671 2.778 126 H SER 21 H SER 21 0.186 -0.120 3.587 127 HA SER 21 HA SER 21 -2.550 -0.406 4.613 128 1HB SER 21 2HB SER 21 -1.054 2.230 4.487 129 2HB SER 21 1HB SER 21 -2.701 1.982 5.066 130 HG SER 21 HG SER 21 -1.175 0.336 6.432 131 H CYS 22 H CYS 22 -4.114 0.083 3.043 132 HA CYS 22 HA CYS 22 -3.176 0.186 0.344 133 1HB CYS 22 2HB CYS 22 -5.322 -0.962 1.207 134 2HB CYS 22 1HB CYS 22 -6.047 0.641 1.151 135 H SER 23 H SER 23 -1.945 2.214 0.947 136 HA SER 23 HA SER 23 -3.200 4.706 1.234 137 1HB SER 23 2HB SER 23 -0.479 4.094 0.042 138 2HB SER 23 1HB SER 23 -1.007 5.643 0.705 139 HG SER 23 HG SER 23 -0.927 4.831 2.711 140 H LYS 24 H LYS 24 -2.857 2.671 -1.478 141 HA LYS 24 HA LYS 24 -4.159 4.650 -3.137 142 1HB LYS 24 2HB LYS 24 -2.588 4.105 -5.060 143 2HB LYS 24 1HB LYS 24 -1.948 5.148 -3.801 144 1HG LYS 24 2HG LYS 24 -0.780 3.216 -2.823 145 2HG LYS 24 1HG LYS 24 -1.389 2.207 -4.138 146 1HD LYS 24 2HD LYS 24 0.894 2.931 -4.591 147 2HD LYS 24 1HD LYS 24 -0.227 3.629 -5.761 148 1HE LYS 24 2HE LYS 24 -0.239 5.724 -4.490 149 2HE LYS 24 1HE LYS 24 0.887 5.024 -3.328 150 1HZ LYS 24 1HZ LYS 24 2.599 5.016 -4.877 151 2HZ LYS 24 2HZ LYS 24 1.824 6.489 -5.176 152 3HZ LYS 24 3HZ LYS 24 1.555 5.170 -6.200 153 H TYR 25 H TYR 25 -5.919 3.625 -3.612 154 HA TYR 25 HA TYR 25 -6.367 0.883 -3.580 155 1HB TYR 25 2HB TYR 25 -8.154 2.532 -3.396 156 2HB TYR 25 1HB TYR 25 -7.843 3.093 -5.033 157 HD1 TYR 25 1HD TYR 25 -9.094 2.239 -6.782 158 HD2 TYR 25 2HD TYR 25 -8.848 0.020 -3.160 159 HE1 TYR 25 1HE TYR 25 -10.758 0.652 -7.650 160 HE2 TYR 25 2HE TYR 25 -10.508 -1.577 -4.022 161 HH TYR 25 HH TYR 25 -12.450 -0.971 -6.653 162 HA PRO 26 HA PRO 26 -6.812 -0.754 -4.028 163 1HB PRO 26 2HB PRO 26 -6.996 -3.106 -5.253 164 2HB PRO 26 1HB PRO 26 -8.057 -1.773 -5.725 165 1HG PRO 26 2HG PRO 26 -5.790 -2.962 -7.190 166 2HG PRO 26 1HG PRO 26 -7.137 -1.992 -7.807 167 1HD PRO 26 2HD PRO 26 -4.443 -1.130 -7.039 168 2HD PRO 26 1HD PRO 26 -5.693 -0.233 -7.931 169 H LEU 27 H LEU 27 -3.844 -0.253 -4.331 170 HA LEU 27 HA LEU 27 -2.885 -2.898 -3.460 171 1HB LEU 27 2HB LEU 27 -0.642 -2.224 -4.217 172 2HB LEU 27 1HB LEU 27 -1.817 -2.318 -5.514 173 HG LEU 27 HG LEU 27 -1.339 0.333 -4.257 174 1HD1 LEU 27 1HD1 LEU 27 0.894 -0.840 -4.726 175 2HD1 LEU 27 2HD1 LEU 27 0.641 0.761 -5.420 176 3HD1 LEU 27 3HD1 LEU 27 0.465 -0.676 -6.429 177 1HD2 LEU 27 1HD2 LEU 27 -1.775 -0.527 -7.116 178 2HD2 LEU 27 2HD2 LEU 27 -1.786 1.125 -6.498 179 3HD2 LEU 27 3HD2 LEU 27 -3.048 -0.006 -6.012 180 H CYS 28 H CYS 28 -1.458 -3.070 -1.746 181 HA CYS 28 HA CYS 28 -1.714 -0.943 0.213 182 1HB CYS 28 2HB CYS 28 -0.662 -3.766 0.391 183 2HB CYS 28 1HB CYS 28 -0.639 -2.634 1.739 184 H ALA 29 H ALA 29 -0.145 0.299 0.935 185 HA ALA 29 HA ALA 29 2.541 -0.025 -0.210 186 1HB ALA 29 1HB ALA 29 0.876 2.211 -0.087 187 2HB ALA 29 2HB ALA 29 2.593 2.195 -0.488 188 3HB ALA 29 3HB ALA 29 2.079 2.477 1.175 189 H LYS 30 H LYS 30 4.158 -0.549 1.160 190 HA LYS 30 HA LYS 30 3.530 -1.142 3.890 191 1HB LYS 30 2HB LYS 30 5.127 -2.399 2.313 192 2HB LYS 30 1HB LYS 30 6.284 -1.123 2.657 193 1HG LYS 30 2HG LYS 30 5.054 -2.433 4.992 194 2HG LYS 30 1HG LYS 30 6.150 -3.417 4.021 195 1HD LYS 30 2HD LYS 30 7.911 -1.797 4.293 196 2HD LYS 30 1HD LYS 30 6.813 -0.696 5.130 197 1HE LYS 30 2HE LYS 30 7.615 -3.438 6.095 198 2HE LYS 30 1HE LYS 30 8.278 -1.914 6.684 199 1HZ LYS 30 1HZ LYS 30 6.622 -2.496 8.205 200 2HZ LYS 30 2HZ LYS 30 5.527 -2.955 7.000 201 3HZ LYS 30 3HZ LYS 30 5.897 -1.316 7.229 202 H ASN 31 H ASN 31 2.937 0.785 4.767 203 HA ASN 31 HA ASN 31 3.029 2.862 5.609 204 1HB ASN 31 2HB ASN 31 5.013 3.401 7.039 205 2HB ASN 31 1HB ASN 31 4.229 1.875 7.405 206 1HD2 ASN 31 1HD2 ASN 31 7.062 3.411 6.107 207 2HD2 ASN 31 2HD2 ASN 31 8.082 2.017 6.161 Start of MODEL 18 1 H GLY 1 H GLY 1 3.495 2.749 3.328 2 1HA GLY 1 2HA GLY 1 3.167 4.764 2.082 3 2HA GLY 1 1HA GLY 1 4.757 5.298 2.598 4 H SER 2 H SER 2 5.991 2.672 1.955 5 HA SER 2 HA SER 2 6.376 3.213 -0.874 6 1HB SER 2 2HB SER 2 7.796 1.269 0.959 7 2HB SER 2 1HB SER 2 8.286 1.684 -0.685 8 HG SER 2 HG SER 2 8.008 3.598 1.388 9 H ILE 3 H ILE 3 4.874 2.346 -2.171 10 HA ILE 3 HA ILE 3 3.423 -0.007 -1.655 11 HB ILE 3 HB ILE 3 3.874 1.407 -4.289 12 1HG1 ILE 3 2HG1 ILE 3 1.392 2.000 -3.857 13 2HG1 ILE 3 1HG1 ILE 3 1.720 1.542 -2.190 14 1HG2 ILE 3 1HG2 ILE 3 1.497 -0.267 -4.059 15 2HG2 ILE 3 2HG2 ILE 3 3.009 -1.174 -4.018 16 3HG2 ILE 3 3HG2 ILE 3 2.653 -0.110 -5.380 17 1HD1 ILE 3 1HD1 ILE 3 2.611 3.519 -1.777 18 2HD1 ILE 3 2HD1 ILE 3 2.129 4.024 -3.398 19 3HD1 ILE 3 3HD1 ILE 3 3.737 3.349 -3.126 20 HA PRO 4 HA PRO 4 6.354 -2.184 -4.966 21 1HB PRO 4 2HB PRO 4 8.801 -0.549 -4.531 22 2HB PRO 4 1HB PRO 4 8.174 -1.268 -6.018 23 1HG PRO 4 2HG PRO 4 7.955 1.342 -5.598 24 2HG PRO 4 1HG PRO 4 6.629 0.433 -6.346 25 1HD PRO 4 2HD PRO 4 6.899 1.429 -3.538 26 2HD PRO 4 1HD PRO 4 5.470 1.402 -4.590 27 H ALA 5 H ALA 5 7.554 -0.773 -1.984 28 HA ALA 5 HA ALA 5 9.425 -2.789 -1.341 29 1HB ALA 5 1HB ALA 5 9.144 -1.892 1.009 30 2HB ALA 5 2HB ALA 5 7.960 -0.771 0.338 31 3HB ALA 5 3HB ALA 5 9.632 -0.723 -0.218 32 H CYS 6 H CYS 6 5.986 -2.392 -0.613 33 HA CYS 6 HA CYS 6 5.938 -4.773 1.010 34 1HB CYS 6 2HB CYS 6 4.448 -2.793 1.432 35 2HB CYS 6 1HB CYS 6 3.569 -3.220 -0.033 36 H GLY 7 H GLY 7 4.649 -3.829 -2.181 37 1HA GLY 7 2HA GLY 7 4.060 -5.120 -4.001 38 2HA GLY 7 1HA GLY 7 5.037 -6.408 -3.300 39 H GLU 8 H GLU 8 2.359 -4.827 -1.746 40 HA GLU 8 HA GLU 8 0.906 -7.373 -1.644 41 1HB GLU 8 2HB GLU 8 1.560 -6.618 0.527 42 2HB GLU 8 1HB GLU 8 1.003 -4.987 0.198 43 1HG GLU 8 2HG GLU 8 -0.543 -5.981 1.678 44 2HG GLU 8 1HG GLU 8 -1.321 -5.883 0.100 45 H SER 9 H SER 9 -1.289 -7.442 -1.989 46 HA SER 9 HA SER 9 -2.429 -5.097 -3.369 47 1HB SER 9 2HB SER 9 -3.251 -8.008 -3.600 48 2HB SER 9 1HB SER 9 -3.899 -6.661 -4.537 49 HG SER 9 HG SER 9 -1.158 -7.377 -4.540 50 H CYS 10 H CYS 10 -4.074 -4.087 -2.334 51 HA CYS 10 HA CYS 10 -5.005 -5.281 0.142 52 1HB CYS 10 2HB CYS 10 -5.841 -3.143 0.719 53 2HB CYS 10 1HB CYS 10 -4.298 -2.863 -0.069 54 H PHE 11 H PHE 11 -6.222 -4.483 -3.026 55 HA PHE 11 HA PHE 11 -8.132 -4.964 -4.138 56 1HB PHE 11 2HB PHE 11 -7.576 -7.276 -3.446 57 2HB PHE 11 1HB PHE 11 -8.515 -7.050 -1.976 58 HD1 PHE 11 1HD PHE 11 -10.389 -8.369 -2.077 59 HD2 PHE 11 2HD PHE 11 -9.201 -6.211 -5.547 60 HE1 PHE 11 1HE PHE 11 -12.406 -9.152 -3.249 61 HE2 PHE 11 2HE PHE 11 -11.217 -6.988 -6.725 62 HZ PHE 11 HZ PHE 11 -12.823 -8.458 -5.576 63 H LYS 12 H LYS 12 -9.549 -5.887 -1.051 64 HA LYS 12 HA LYS 12 -11.656 -3.955 -1.405 65 1HB LYS 12 2HB LYS 12 -12.129 -6.209 -0.518 66 2HB LYS 12 1HB LYS 12 -11.121 -5.866 0.881 67 1HG LYS 12 2HG LYS 12 -13.498 -5.648 1.396 68 2HG LYS 12 1HG LYS 12 -12.646 -4.114 1.583 69 1HD LYS 12 2HD LYS 12 -13.433 -3.452 -0.670 70 2HD LYS 12 1HD LYS 12 -14.358 -4.952 -0.757 71 1HE LYS 12 2HE LYS 12 -15.674 -4.283 1.166 72 2HE LYS 12 1HE LYS 12 -14.709 -2.818 1.345 73 1HZ LYS 12 1HZ LYS 12 -16.268 -3.432 -1.100 74 2HZ LYS 12 2HZ LYS 12 -15.558 -1.961 -0.667 75 3HZ LYS 12 3HZ LYS 12 -16.896 -2.537 0.191 76 H GLY 13 H GLY 13 -8.808 -4.363 0.584 77 1HA GLY 13 2HA GLY 13 -8.130 -1.825 1.066 78 2HA GLY 13 1HA GLY 13 -9.434 -2.045 2.224 79 H LYS 14 H LYS 14 -9.096 -4.496 3.196 80 HA LYS 14 HA LYS 14 -6.969 -4.209 4.989 81 1HB LYS 14 2HB LYS 14 -9.168 -5.450 5.322 82 2HB LYS 14 1HB LYS 14 -8.439 -6.775 4.420 83 1HG LYS 14 2HG LYS 14 -8.256 -7.096 6.835 84 2HG LYS 14 1HG LYS 14 -6.670 -6.954 6.068 85 1HD LYS 14 2HD LYS 14 -6.571 -4.603 6.701 86 2HD LYS 14 1HD LYS 14 -8.156 -4.736 7.460 87 1HE LYS 14 2HE LYS 14 -5.633 -6.184 8.277 88 2HE LYS 14 1HE LYS 14 -6.404 -4.858 9.144 89 1HZ LYS 14 1HZ LYS 14 -8.229 -6.991 8.688 90 2HZ LYS 14 2HZ LYS 14 -7.765 -6.273 10.148 91 3HZ LYS 14 3HZ LYS 14 -6.853 -7.544 9.504 92 H CYS 15 H CYS 15 -4.910 -4.648 4.726 93 HA CYS 15 HA CYS 15 -4.043 -6.370 2.538 94 1HB CYS 15 2HB CYS 15 -2.353 -4.712 4.420 95 2HB CYS 15 1HB CYS 15 -1.840 -5.452 2.907 96 H TYR 16 H TYR 16 -2.731 -8.188 2.891 97 HA TYR 16 HA TYR 16 -3.183 -9.489 5.430 98 1HB TYR 16 2HB TYR 16 -1.799 -10.378 2.892 99 2HB TYR 16 1HB TYR 16 -1.916 -11.384 4.329 100 HD1 TYR 16 1HD TYR 16 -4.453 -9.186 2.672 101 HD2 TYR 16 2HD TYR 16 -3.344 -13.129 3.816 102 HE1 TYR 16 1HE TYR 16 -6.637 -10.015 1.906 103 HE2 TYR 16 2HE TYR 16 -5.524 -13.970 3.053 104 HH TYR 16 HH TYR 16 -7.795 -11.901 1.354 105 H THR 17 H THR 17 -0.510 -8.188 3.577 106 HA THR 17 HA THR 17 1.565 -8.998 5.317 107 HB THR 17 HB THR 17 1.619 -6.644 3.424 108 HG1 THR 17 1HG THR 17 0.882 -8.556 2.346 109 1HG2 THR 17 1HG2 THR 17 3.733 -6.495 4.137 110 2HG2 THR 17 2HG2 THR 17 4.026 -8.055 3.366 111 3HG2 THR 17 3HG2 THR 17 3.587 -7.983 5.073 112 HA PRO 18 HA PRO 18 0.545 -6.209 8.699 113 1HB PRO 18 2HB PRO 18 3.197 -7.221 9.584 114 2HB PRO 18 1HB PRO 18 1.665 -7.156 10.463 115 1HG PRO 18 2HG PRO 18 2.584 -9.466 9.514 116 2HG PRO 18 1HG PRO 18 0.853 -9.081 9.455 117 1HD PRO 18 2HD PRO 18 2.885 -9.016 7.266 118 2HD PRO 18 1HD PRO 18 1.184 -9.522 7.213 119 H GLY 19 H GLY 19 1.045 -4.141 9.041 120 1HA GLY 19 2HA GLY 19 2.454 -2.275 9.257 121 2HA GLY 19 1HA GLY 19 3.711 -3.151 8.396 122 H CYS 20 H CYS 20 1.471 -3.869 6.348 123 HA CYS 20 HA CYS 20 1.979 -1.474 4.768 124 1HB CYS 20 2HB CYS 20 0.733 -4.095 3.956 125 2HB CYS 20 1HB CYS 20 1.170 -2.785 2.868 126 H SER 21 H SER 21 0.447 -0.228 3.811 127 HA SER 21 HA SER 21 -2.357 -0.611 4.589 128 1HB SER 21 2HB SER 21 -1.306 1.023 6.152 129 2HB SER 21 1HB SER 21 -0.860 2.022 4.770 130 HG SER 21 HG SER 21 -3.216 1.865 6.078 131 H CYS 22 H CYS 22 -3.779 -0.127 2.957 132 HA CYS 22 HA CYS 22 -2.690 0.206 0.340 133 1HB CYS 22 2HB CYS 22 -4.777 -1.141 1.041 134 2HB CYS 22 1HB CYS 22 -5.619 0.405 0.979 135 H SER 23 H SER 23 -1.650 2.292 0.760 136 HA SER 23 HA SER 23 -3.276 4.629 1.091 137 1HB SER 23 2HB SER 23 -0.392 4.485 0.193 138 2HB SER 23 1HB SER 23 -1.212 5.848 0.955 139 HG SER 23 HG SER 23 -1.579 4.083 2.692 140 H LYS 24 H LYS 24 -2.481 2.644 -1.529 141 HA LYS 24 HA LYS 24 -3.540 4.627 -3.395 142 1HB LYS 24 2HB LYS 24 -1.034 3.018 -3.917 143 2HB LYS 24 1HB LYS 24 -1.844 4.049 -5.087 144 1HG LYS 24 2HG LYS 24 -1.443 5.945 -3.422 145 2HG LYS 24 1HG LYS 24 -0.320 4.843 -2.632 146 1HD LYS 24 2HD LYS 24 0.851 6.302 -4.199 147 2HD LYS 24 1HD LYS 24 0.936 4.618 -4.720 148 1HE LYS 24 2HE LYS 24 0.478 6.141 -6.592 149 2HE LYS 24 1HE LYS 24 -0.839 4.998 -6.330 150 1HZ LYS 24 1HZ LYS 24 -1.343 7.291 -4.804 151 2HZ LYS 24 2HZ LYS 24 -2.222 6.696 -6.121 152 3HZ LYS 24 3HZ LYS 24 -0.958 7.791 -6.374 153 H TYR 25 H TYR 25 -5.385 3.234 -3.029 154 HA TYR 25 HA TYR 25 -5.626 0.554 -3.486 155 1HB TYR 25 2HB TYR 25 -7.495 2.842 -3.959 156 2HB TYR 25 1HB TYR 25 -7.970 1.213 -4.430 157 HD1 TYR 25 1HD TYR 25 -8.961 -0.185 -2.875 158 HD2 TYR 25 2HD TYR 25 -6.703 3.148 -1.500 159 HE1 TYR 25 1HE TYR 25 -9.682 -0.652 -0.575 160 HE2 TYR 25 2HE TYR 25 -7.420 2.687 0.805 161 HH TYR 25 HH TYR 25 -9.876 0.340 1.526 162 HA PRO 26 HA PRO 26 -6.484 -0.948 -4.116 163 1HB PRO 26 2HB PRO 26 -6.442 -3.239 -5.481 164 2HB PRO 26 1HB PRO 26 -7.708 -2.038 -5.756 165 1HG PRO 26 2HG PRO 26 -5.384 -2.753 -7.451 166 2HG PRO 26 1HG PRO 26 -6.961 -2.096 -7.921 167 1HD PRO 26 2HD PRO 26 -4.500 -0.673 -7.546 168 2HD PRO 26 1HD PRO 26 -6.090 -0.007 -7.970 169 H LEU 27 H LEU 27 -3.595 -0.121 -4.827 170 HA LEU 27 HA LEU 27 -2.228 -2.598 -4.092 171 1HB LEU 27 2HB LEU 27 -1.265 -0.019 -5.278 172 2HB LEU 27 1HB LEU 27 -0.150 -1.182 -4.581 173 HG LEU 27 HG LEU 27 -2.095 -1.902 -6.751 174 1HD1 LEU 27 1HD1 LEU 27 -0.464 -0.063 -7.392 175 2HD1 LEU 27 2HD1 LEU 27 -0.434 -1.520 -8.385 176 3HD1 LEU 27 3HD1 LEU 27 0.813 -1.258 -7.164 177 1HD2 LEU 27 1HD2 LEU 27 -1.157 -3.723 -5.366 178 2HD2 LEU 27 2HD2 LEU 27 0.461 -3.219 -5.856 179 3HD2 LEU 27 3HD2 LEU 27 -0.678 -3.821 -7.061 180 H CYS 28 H CYS 28 -1.173 -2.894 -2.296 181 HA CYS 28 HA CYS 28 -1.577 -0.966 -0.157 182 1HB CYS 28 2HB CYS 28 -1.983 -3.524 -0.036 183 2HB CYS 28 1HB CYS 28 -0.236 -3.629 0.156 184 H ALA 29 H ALA 29 0.056 -0.015 1.022 185 HA ALA 29 HA ALA 29 2.741 -0.158 -0.190 186 1HB ALA 29 1HB ALA 29 1.903 1.979 -0.643 187 2HB ALA 29 2HB ALA 29 2.952 2.201 0.757 188 3HB ALA 29 3HB ALA 29 1.202 2.142 0.968 189 H LYS 30 H LYS 30 4.490 -0.426 1.081 190 HA LYS 30 HA LYS 30 4.056 -1.152 3.869 191 1HB LYS 30 2HB LYS 30 5.499 -2.614 2.567 192 2HB LYS 30 1HB LYS 30 6.504 -1.255 2.084 193 1HG LYS 30 2HG LYS 30 7.726 -2.364 3.742 194 2HG LYS 30 1HG LYS 30 7.033 -0.958 4.550 195 1HD LYS 30 2HD LYS 30 6.725 -2.762 6.038 196 2HD LYS 30 1HD LYS 30 5.149 -2.495 5.290 197 1HE LYS 30 2HE LYS 30 5.602 -4.323 3.715 198 2HE LYS 30 1HE LYS 30 7.162 -4.596 4.489 199 1HZ LYS 30 1HZ LYS 30 4.601 -4.749 5.974 200 2HZ LYS 30 2HZ LYS 30 6.120 -5.317 6.453 201 3HZ LYS 30 3HZ LYS 30 5.287 -6.089 5.202 202 H ASN 31 H ASN 31 3.770 0.660 5.047 203 HA ASN 31 HA ASN 31 4.168 2.659 6.049 204 1HB ASN 31 2HB ASN 31 7.042 1.909 5.450 205 2HB ASN 31 1HB ASN 31 6.552 3.209 6.530 206 1HD2 ASN 31 1HD2 ASN 31 6.611 2.690 8.581 207 2HD2 ASN 31 2HD2 ASN 31 6.356 1.120 9.250 Start of MODEL 19 1 H GLY 1 H GLY 1 3.132 2.878 2.913 2 1HA GLY 1 2HA GLY 1 3.016 4.701 1.380 3 2HA GLY 1 1HA GLY 1 4.509 5.327 2.063 4 H SER 2 H SER 2 5.745 2.586 1.939 5 HA SER 2 HA SER 2 6.672 2.837 -0.796 6 1HB SER 2 2HB SER 2 7.575 0.955 1.392 7 2HB SER 2 1HB SER 2 8.409 1.259 -0.132 8 HG SER 2 HG SER 2 7.809 3.471 1.447 9 H ILE 3 H ILE 3 5.319 1.975 -2.258 10 HA ILE 3 HA ILE 3 3.719 -0.315 -1.828 11 HB ILE 3 HB ILE 3 4.513 1.027 -4.418 12 1HG1 ILE 3 2HG1 ILE 3 2.004 1.617 -4.348 13 2HG1 ILE 3 1HG1 ILE 3 2.074 1.159 -2.651 14 1HG2 ILE 3 1HG2 ILE 3 2.389 -1.078 -4.045 15 2HG2 ILE 3 2HG2 ILE 3 3.985 -1.378 -4.734 16 3HG2 ILE 3 3HG2 ILE 3 2.861 -0.292 -5.552 17 1HD1 ILE 3 1HD1 ILE 3 4.206 2.959 -3.181 18 2HD1 ILE 3 2HD1 ILE 3 2.801 3.173 -2.134 19 3HD1 ILE 3 3HD1 ILE 3 2.713 3.635 -3.835 20 HA PRO 4 HA PRO 4 7.013 -2.666 -4.639 21 1HB PRO 4 2HB PRO 4 9.412 -1.060 -3.917 22 2HB PRO 4 1HB PRO 4 8.987 -1.822 -5.453 23 1HG PRO 4 2HG PRO 4 8.778 0.810 -5.151 24 2HG PRO 4 1HG PRO 4 7.557 -0.098 -6.064 25 1HD PRO 4 2HD PRO 4 7.423 0.998 -3.284 26 2HD PRO 4 1HD PRO 4 6.166 0.944 -4.537 27 H ALA 5 H ALA 5 7.902 -1.099 -1.614 28 HA ALA 5 HA ALA 5 9.494 -3.224 -0.601 29 1HB ALA 5 1HB ALA 5 9.867 -1.865 1.140 30 2HB ALA 5 2HB ALA 5 8.149 -1.559 1.391 31 3HB ALA 5 3HB ALA 5 9.037 -0.651 0.168 32 H CYS 6 H CYS 6 6.086 -2.493 -0.564 33 HA CYS 6 HA CYS 6 5.504 -4.527 1.384 34 1HB CYS 6 2HB CYS 6 4.118 -2.491 1.220 35 2HB CYS 6 1HB CYS 6 3.598 -2.997 -0.388 36 H GLY 7 H GLY 7 4.708 -4.095 -2.077 37 1HA GLY 7 2HA GLY 7 4.364 -5.658 -3.732 38 2HA GLY 7 1HA GLY 7 5.230 -6.812 -2.720 39 H GLU 8 H GLU 8 2.261 -5.007 -2.095 40 HA GLU 8 HA GLU 8 0.711 -7.487 -2.093 41 1HB GLU 8 2HB GLU 8 1.305 -7.345 0.185 42 2HB GLU 8 1HB GLU 8 1.128 -5.600 0.215 43 1HG GLU 8 2HG GLU 8 -0.673 -6.473 1.440 44 2HG GLU 8 1HG GLU 8 -1.339 -5.953 -0.105 45 H SER 9 H SER 9 -1.493 -7.219 -2.398 46 HA SER 9 HA SER 9 -2.325 -4.525 -3.270 47 1HB SER 9 2HB SER 9 -3.358 -7.205 -4.246 48 2HB SER 9 1HB SER 9 -3.837 -5.617 -4.848 49 HG SER 9 HG SER 9 -1.201 -6.665 -4.947 50 H CYS 10 H CYS 10 -4.180 -3.702 -2.335 51 HA CYS 10 HA CYS 10 -5.222 -5.255 -0.119 52 1HB CYS 10 2HB CYS 10 -6.117 -3.257 0.727 53 2HB CYS 10 1HB CYS 10 -4.593 -2.783 0.011 54 H PHE 11 H PHE 11 -6.137 -4.151 -3.258 55 HA PHE 11 HA PHE 11 -7.829 -4.614 -4.670 56 1HB PHE 11 2HB PHE 11 -7.215 -6.928 -4.150 57 2HB PHE 11 1HB PHE 11 -8.347 -6.929 -2.803 58 HD1 PHE 11 1HD PHE 11 -8.621 -5.770 -6.342 59 HD2 PHE 11 2HD PHE 11 -10.108 -8.319 -3.274 60 HE1 PHE 11 1HE PHE 11 -10.413 -6.528 -7.847 61 HE2 PHE 11 2HE PHE 11 -11.901 -9.083 -4.774 62 HZ PHE 11 HZ PHE 11 -12.057 -8.187 -7.065 63 H LYS 12 H LYS 12 -9.301 -5.498 -1.540 64 HA LYS 12 HA LYS 12 -11.114 -3.279 -1.619 65 1HB LYS 12 2HB LYS 12 -12.148 -4.743 -3.310 66 2HB LYS 12 1HB LYS 12 -12.186 -6.065 -2.156 67 1HG LYS 12 2HG LYS 12 -14.376 -5.022 -2.439 68 2HG LYS 12 1HG LYS 12 -13.782 -4.863 -0.786 69 1HD LYS 12 2HD LYS 12 -12.868 -2.570 -1.649 70 2HD LYS 12 1HD LYS 12 -14.091 -2.780 -2.905 71 1HE LYS 12 2HE LYS 12 -14.996 -1.493 -1.062 72 2HE LYS 12 1HE LYS 12 -15.803 -3.059 -1.165 73 1HZ LYS 12 1HZ LYS 12 -15.335 -3.164 1.011 74 2HZ LYS 12 2HZ LYS 12 -14.128 -1.983 0.929 75 3HZ LYS 12 3HZ LYS 12 -13.769 -3.586 0.516 76 H GLY 13 H GLY 13 -9.189 -5.015 0.090 77 1HA GLY 13 2HA GLY 13 -10.797 -4.759 2.508 78 2HA GLY 13 1HA GLY 13 -10.182 -6.364 2.147 79 H LYS 14 H LYS 14 -8.912 -6.419 4.009 80 HA LYS 14 HA LYS 14 -6.901 -4.388 4.400 81 1HB LYS 14 2HB LYS 14 -6.305 -5.763 6.408 82 2HB LYS 14 1HB LYS 14 -7.962 -5.188 6.386 83 1HG LYS 14 2HG LYS 14 -8.112 -7.389 7.146 84 2HG LYS 14 1HG LYS 14 -8.569 -7.486 5.444 85 1HD LYS 14 2HD LYS 14 -6.287 -8.195 4.888 86 2HD LYS 14 1HD LYS 14 -5.857 -8.114 6.590 87 1HE LYS 14 2HE LYS 14 -7.426 -9.879 7.110 88 2HE LYS 14 1HE LYS 14 -7.985 -9.905 5.437 89 1HZ LYS 14 1HZ LYS 14 -5.469 -10.902 6.570 90 2HZ LYS 14 2HZ LYS 14 -5.470 -10.344 4.973 91 3HZ LYS 14 3HZ LYS 14 -6.492 -11.615 5.424 92 H CYS 15 H CYS 15 -4.672 -4.771 4.411 93 HA CYS 15 HA CYS 15 -3.782 -6.600 2.383 94 1HB CYS 15 2HB CYS 15 -2.061 -4.931 4.220 95 2HB CYS 15 1HB CYS 15 -1.653 -5.541 2.620 96 H TYR 16 H TYR 16 -2.352 -8.365 2.678 97 HA TYR 16 HA TYR 16 -2.717 -9.725 5.196 98 1HB TYR 16 2HB TYR 16 -1.321 -10.473 2.627 99 2HB TYR 16 1HB TYR 16 -1.288 -11.503 4.053 100 HD1 TYR 16 1HD TYR 16 -3.947 -9.564 2.254 101 HD2 TYR 16 2HD TYR 16 -2.706 -13.298 3.872 102 HE1 TYR 16 1HE TYR 16 -6.098 -10.555 1.599 103 HE2 TYR 16 2HE TYR 16 -4.855 -14.300 3.218 104 HH TYR 16 HH TYR 16 -6.877 -13.073 1.051 105 H THR 17 H THR 17 -0.096 -8.182 3.447 106 HA THR 17 HA THR 17 1.951 -8.972 5.235 107 HB THR 17 HB THR 17 1.951 -6.629 3.326 108 HG1 THR 17 1HG THR 17 1.686 -8.387 2.048 109 1HG2 THR 17 1HG2 THR 17 4.052 -6.243 3.969 110 2HG2 THR 17 2HG2 THR 17 4.482 -7.935 3.713 111 3HG2 THR 17 3HG2 THR 17 3.829 -7.416 5.267 112 HA PRO 18 HA PRO 18 0.779 -6.262 8.610 113 1HB PRO 18 2HB PRO 18 3.101 -6.787 10.033 114 2HB PRO 18 1HB PRO 18 1.617 -7.738 10.125 115 1HG PRO 18 2HG PRO 18 4.109 -8.255 8.569 116 2HG PRO 18 1HG PRO 18 3.054 -9.401 9.415 117 1HD PRO 18 2HD PRO 18 2.988 -9.124 6.743 118 2HD PRO 18 1HD PRO 18 1.518 -9.459 7.682 119 H GLY 19 H GLY 19 1.171 -4.169 8.919 120 1HA GLY 19 2HA GLY 19 2.517 -2.251 9.167 121 2HA GLY 19 1HA GLY 19 3.812 -3.080 8.317 122 H CYS 20 H CYS 20 1.438 -3.849 6.344 123 HA CYS 20 HA CYS 20 1.990 -1.542 4.655 124 1HB CYS 20 2HB CYS 20 0.553 -4.117 4.065 125 2HB CYS 20 1HB CYS 20 0.805 -2.828 2.903 126 H SER 21 H SER 21 0.490 -0.273 3.700 127 HA SER 21 HA SER 21 -2.293 -0.429 4.635 128 1HB SER 21 2HB SER 21 -0.640 2.115 4.587 129 2HB SER 21 1HB SER 21 -2.337 1.983 5.054 130 HG SER 21 HG SER 21 -0.840 0.243 6.463 131 H CYS 22 H CYS 22 -3.772 0.053 3.021 132 HA CYS 22 HA CYS 22 -2.769 0.180 0.348 133 1HB CYS 22 2HB CYS 22 -4.926 -0.980 1.174 134 2HB CYS 22 1HB CYS 22 -5.656 0.620 1.085 135 H SER 23 H SER 23 -1.550 2.196 0.748 136 HA SER 23 HA SER 23 -2.772 4.686 1.156 137 1HB SER 23 2HB SER 23 -0.215 4.140 -0.365 138 2HB SER 23 1HB SER 23 -0.663 5.634 0.461 139 HG SER 23 HG SER 23 -0.469 4.602 2.416 140 H LYS 24 H LYS 24 -2.108 2.865 -1.797 141 HA LYS 24 HA LYS 24 -3.721 4.847 -3.243 142 1HB LYS 24 2HB LYS 24 -2.368 4.255 -5.295 143 2HB LYS 24 1HB LYS 24 -1.542 5.210 -4.076 144 1HG LYS 24 2HG LYS 24 -0.305 3.305 -3.325 145 2HG LYS 24 1HG LYS 24 -1.254 2.227 -4.351 146 1HD LYS 24 2HD LYS 24 0.937 2.706 -5.336 147 2HD LYS 24 1HD LYS 24 -0.374 3.325 -6.343 148 1HE LYS 24 2HE LYS 24 -0.026 5.564 -5.369 149 2HE LYS 24 1HE LYS 24 1.325 4.927 -4.431 150 1HZ LYS 24 1HZ LYS 24 2.320 5.870 -6.285 151 2HZ LYS 24 2HZ LYS 24 1.130 5.313 -7.350 152 3HZ LYS 24 3HZ LYS 24 2.250 4.229 -6.693 153 H TYR 25 H TYR 25 -5.533 3.668 -2.914 154 HA TYR 25 HA TYR 25 -6.041 0.998 -3.190 155 1HB TYR 25 2HB TYR 25 -7.613 2.844 -2.460 156 2HB TYR 25 1HB TYR 25 -7.891 3.182 -4.164 157 HD1 TYR 25 1HD TYR 25 -9.732 2.215 -5.154 158 HD2 TYR 25 2HD TYR 25 -7.960 0.289 -1.801 159 HE1 TYR 25 1HE TYR 25 -11.515 0.522 -5.191 160 HE2 TYR 25 2HE TYR 25 -9.735 -1.410 -1.832 161 HH TYR 25 HH TYR 25 -11.343 -2.332 -3.858 162 HA PRO 26 HA PRO 26 -6.758 -0.571 -3.719 163 1HB PRO 26 2HB PRO 26 -6.955 -2.871 -5.055 164 2HB PRO 26 1HB PRO 26 -8.204 -1.628 -5.191 165 1HG PRO 26 2HG PRO 26 -6.169 -2.468 -7.159 166 2HG PRO 26 1HG PRO 26 -7.727 -1.670 -7.423 167 1HD PRO 26 2HD PRO 26 -5.093 -0.478 -7.273 168 2HD PRO 26 1HD PRO 26 -6.641 0.306 -7.650 169 H LEU 27 H LEU 27 -3.947 0.157 -4.706 170 HA LEU 27 HA LEU 27 -2.558 -2.370 -4.215 171 1HB LEU 27 2HB LEU 27 -1.689 0.281 -5.314 172 2HB LEU 27 1HB LEU 27 -0.515 -0.899 -4.754 173 HG LEU 27 HG LEU 27 -2.598 -1.581 -6.797 174 1HD1 LEU 27 1HD1 LEU 27 -0.645 0.328 -7.192 175 2HD1 LEU 27 2HD1 LEU 27 -1.465 -0.592 -8.454 176 3HD1 LEU 27 3HD1 LEU 27 0.088 -1.146 -7.825 177 1HD2 LEU 27 1HD2 LEU 27 -1.710 -3.606 -6.662 178 2HD2 LEU 27 2HD2 LEU 27 -0.618 -3.040 -5.398 179 3HD2 LEU 27 3HD2 LEU 27 -0.129 -2.952 -7.090 180 H CYS 28 H CYS 28 -1.449 -2.795 -2.449 181 HA CYS 28 HA CYS 28 -1.680 -0.920 -0.244 182 1HB CYS 28 2HB CYS 28 -2.126 -3.480 -0.160 183 2HB CYS 28 1HB CYS 28 -0.372 -3.608 -0.046 184 H ALA 29 H ALA 29 -0.016 -0.008 0.836 185 HA ALA 29 HA ALA 29 2.685 -0.330 -0.287 186 1HB ALA 29 1HB ALA 29 1.036 2.073 0.047 187 2HB ALA 29 2HB ALA 29 2.409 1.779 -1.021 188 3HB ALA 29 3HB ALA 29 2.681 2.221 0.664 189 H LYS 30 H LYS 30 4.293 -0.594 1.205 190 HA LYS 30 HA LYS 30 3.460 -0.898 3.965 191 1HB LYS 30 2HB LYS 30 5.215 -2.309 2.514 192 2HB LYS 30 1HB LYS 30 6.326 -1.131 3.208 193 1HG LYS 30 2HG LYS 30 5.191 -1.764 5.448 194 2HG LYS 30 1HG LYS 30 4.664 -3.198 4.568 195 1HD LYS 30 2HD LYS 30 7.492 -2.284 5.013 196 2HD LYS 30 1HD LYS 30 6.699 -3.674 5.750 197 1HE LYS 30 2HE LYS 30 7.205 -3.327 2.798 198 2HE LYS 30 1HE LYS 30 8.205 -4.288 3.885 199 1HZ LYS 30 1HZ LYS 30 6.465 -5.815 4.220 200 2HZ LYS 30 2HZ LYS 30 6.499 -5.537 2.552 201 3HZ LYS 30 3HZ LYS 30 5.310 -4.804 3.509 202 H ASN 31 H ASN 31 3.099 1.048 4.832 203 HA ASN 31 HA ASN 31 3.451 3.109 5.680 204 1HB ASN 31 2HB ASN 31 6.338 2.200 5.583 205 2HB ASN 31 1HB ASN 31 5.808 3.691 6.357 206 1HD2 ASN 31 1HD2 ASN 31 6.764 0.717 7.038 207 2HD2 ASN 31 2HD2 ASN 31 5.849 0.397 8.466 Start of MODEL 20 1 H GLY 1 H GLY 1 3.453 2.704 3.166 2 1HA GLY 1 2HA GLY 1 3.345 4.831 2.005 3 2HA GLY 1 1HA GLY 1 4.945 5.188 2.630 4 H SER 2 H SER 2 6.071 2.575 1.984 5 HA SER 2 HA SER 2 6.544 3.105 -0.835 6 1HB SER 2 2HB SER 2 8.444 2.741 0.727 7 2HB SER 2 1HB SER 2 7.890 1.085 0.969 8 HG SER 2 HG SER 2 9.518 1.900 -0.871 9 H ILE 3 H ILE 3 5.280 2.184 -2.292 10 HA ILE 3 HA ILE 3 3.722 -0.134 -1.764 11 HB ILE 3 HB ILE 3 4.221 1.318 -4.365 12 1HG1 ILE 3 2HG1 ILE 3 1.732 1.886 -3.982 13 2HG1 ILE 3 1HG1 ILE 3 2.007 1.374 -2.323 14 1HG2 ILE 3 1HG2 ILE 3 3.683 -0.956 -4.904 15 2HG2 ILE 3 2HG2 ILE 3 2.268 0.047 -5.223 16 3HG2 ILE 3 3HG2 ILE 3 2.332 -0.953 -3.771 17 1HD1 ILE 3 1HD1 ILE 3 2.625 3.870 -3.598 18 2HD1 ILE 3 2HD1 ILE 3 4.072 3.155 -2.885 19 3HD1 ILE 3 3HD1 ILE 3 2.646 3.444 -1.887 20 HA PRO 4 HA PRO 4 6.785 -2.297 -4.932 21 1HB PRO 4 2HB PRO 4 9.244 -0.743 -4.328 22 2HB PRO 4 1HB PRO 4 8.677 -1.400 -5.867 23 1HG PRO 4 2HG PRO 4 8.530 1.210 -5.372 24 2HG PRO 4 1HG PRO 4 7.229 0.373 -6.241 25 1HD PRO 4 2HD PRO 4 7.333 1.271 -3.389 26 2HD PRO 4 1HD PRO 4 5.981 1.325 -4.538 27 H ALA 5 H ALA 5 7.932 -0.885 -1.907 28 HA ALA 5 HA ALA 5 9.457 -3.230 -1.192 29 1HB ALA 5 1HB ALA 5 10.452 -1.455 -0.189 30 2HB ALA 5 2HB ALA 5 9.350 -1.896 1.115 31 3HB ALA 5 3HB ALA 5 8.936 -0.579 0.018 32 H CYS 6 H CYS 6 6.221 -2.412 -1.149 33 HA CYS 6 HA CYS 6 5.504 -3.804 1.264 34 1HB CYS 6 2HB CYS 6 4.113 -1.967 0.620 35 2HB CYS 6 1HB CYS 6 3.856 -2.651 -0.982 36 H GLY 7 H GLY 7 4.675 -4.347 -2.167 37 1HA GLY 7 2HA GLY 7 4.447 -6.317 -3.348 38 2HA GLY 7 1HA GLY 7 5.238 -7.149 -2.014 39 H GLU 8 H GLU 8 2.280 -5.208 -2.024 40 HA GLU 8 HA GLU 8 0.639 -7.570 -1.551 41 1HB GLU 8 2HB GLU 8 1.277 -6.960 0.682 42 2HB GLU 8 1HB GLU 8 0.945 -5.264 0.374 43 1HG GLU 8 2HG GLU 8 -0.810 -6.088 1.714 44 2HG GLU 8 1HG GLU 8 -1.459 -5.875 0.091 45 H SER 9 H SER 9 -1.514 -7.293 -2.090 46 HA SER 9 HA SER 9 -2.188 -4.706 -3.347 47 1HB SER 9 2HB SER 9 -3.182 -7.436 -4.197 48 2HB SER 9 1HB SER 9 -3.461 -5.901 -5.022 49 HG SER 9 HG SER 9 -0.834 -6.764 -4.543 50 H CYS 10 H CYS 10 -4.088 -3.772 -2.768 51 HA CYS 10 HA CYS 10 -5.714 -5.261 -0.829 52 1HB CYS 10 2HB CYS 10 -6.465 -2.976 -0.081 53 2HB CYS 10 1HB CYS 10 -4.784 -3.353 0.232 54 H PHE 11 H PHE 11 -7.689 -5.822 -1.390 55 HA PHE 11 HA PHE 11 -8.923 -4.448 -3.680 56 1HB PHE 11 2HB PHE 11 -8.352 -6.970 -3.812 57 2HB PHE 11 1HB PHE 11 -9.700 -7.197 -2.704 58 HD1 PHE 11 1HD PHE 11 -9.349 -4.871 -5.590 59 HD2 PHE 11 2HD PHE 11 -11.347 -8.248 -3.942 60 HE1 PHE 11 1HE PHE 11 -10.908 -4.872 -7.493 61 HE2 PHE 11 2HE PHE 11 -12.910 -8.256 -5.842 62 HZ PHE 11 HZ PHE 11 -12.691 -6.566 -7.620 63 H LYS 12 H LYS 12 -11.412 -6.098 -2.749 64 HA LYS 12 HA LYS 12 -12.516 -3.958 -1.172 65 1HB LYS 12 2HB LYS 12 -13.748 -5.218 -3.007 66 2HB LYS 12 1HB LYS 12 -13.864 -6.563 -1.883 67 1HG LYS 12 2HG LYS 12 -15.906 -5.228 -1.909 68 2HG LYS 12 1HG LYS 12 -15.124 -5.185 -0.327 69 1HD LYS 12 2HD LYS 12 -14.122 -3.010 -0.909 70 2HD LYS 12 1HD LYS 12 -14.966 -3.051 -2.458 71 1HE LYS 12 2HE LYS 12 -17.110 -3.064 -1.303 72 2HE LYS 12 1HE LYS 12 -16.283 -3.072 0.255 73 1HZ LYS 12 1HZ LYS 12 -15.503 -0.907 -0.072 74 2HZ LYS 12 2HZ LYS 12 -17.110 -0.852 -0.597 75 3HZ LYS 12 3HZ LYS 12 -15.855 -0.920 -1.727 76 H GLY 13 H GLY 13 -10.679 -4.628 0.427 77 1HA GLY 13 2HA GLY 13 -11.988 -5.772 2.702 78 2HA GLY 13 1HA GLY 13 -10.747 -6.836 2.051 79 H LYS 14 H LYS 14 -8.585 -6.292 2.264 80 HA LYS 14 HA LYS 14 -7.627 -3.791 3.134 81 1HB LYS 14 2HB LYS 14 -7.265 -4.031 5.417 82 2HB LYS 14 1HB LYS 14 -8.855 -4.749 5.229 83 1HG LYS 14 2HG LYS 14 -6.254 -6.252 5.453 84 2HG LYS 14 1HG LYS 14 -7.452 -6.051 6.729 85 1HD LYS 14 2HD LYS 14 -8.120 -7.329 4.095 86 2HD LYS 14 1HD LYS 14 -7.450 -8.245 5.441 87 1HE LYS 14 2HE LYS 14 -9.984 -6.611 5.535 88 2HE LYS 14 1HE LYS 14 -9.916 -8.362 5.335 89 1HZ LYS 14 1HZ LYS 14 -8.668 -8.382 7.509 90 2HZ LYS 14 2HZ LYS 14 -10.308 -7.981 7.603 91 3HZ LYS 14 3HZ LYS 14 -9.134 -6.767 7.704 92 H CYS 15 H CYS 15 -5.354 -4.414 4.390 93 HA CYS 15 HA CYS 15 -3.954 -6.072 2.424 94 1HB CYS 15 2HB CYS 15 -2.766 -4.205 4.487 95 2HB CYS 15 1HB CYS 15 -1.932 -4.946 3.126 96 H TYR 16 H TYR 16 -2.852 -7.901 3.006 97 HA TYR 16 HA TYR 16 -3.316 -8.845 5.731 98 1HB TYR 16 2HB TYR 16 -2.461 -10.233 3.192 99 2HB TYR 16 1HB TYR 16 -2.407 -11.027 4.761 100 HD1 TYR 16 1HD TYR 16 -4.861 -8.946 2.834 101 HD2 TYR 16 2HD TYR 16 -4.189 -12.416 5.204 102 HE1 TYR 16 1HE TYR 16 -7.236 -9.542 2.624 103 HE2 TYR 16 2HE TYR 16 -6.563 -13.022 4.995 104 HH TYR 16 HH TYR 16 -8.467 -12.411 3.109 105 H THR 17 H THR 17 -0.751 -8.122 3.468 106 HA THR 17 HA THR 17 1.424 -9.031 4.998 107 HB THR 17 HB THR 17 1.374 -6.781 2.978 108 HG1 THR 17 1HG THR 17 0.578 -8.759 2.120 109 1HG2 THR 17 1HG2 THR 17 3.791 -8.149 2.822 110 2HG2 THR 17 2HG2 THR 17 3.498 -7.977 4.553 111 3HG2 THR 17 3HG2 THR 17 3.533 -6.549 3.519 112 HA PRO 18 HA PRO 18 1.139 -6.138 8.410 113 1HB PRO 18 2HB PRO 18 3.887 -7.184 8.841 114 2HB PRO 18 1HB PRO 18 2.534 -7.072 9.971 115 1HG PRO 18 2HG PRO 18 3.242 -9.417 8.920 116 2HG PRO 18 1HG PRO 18 1.536 -9.007 9.178 117 1HD PRO 18 2HD PRO 18 3.117 -9.041 6.647 118 2HD PRO 18 1HD PRO 18 1.420 -9.484 6.926 119 H GLY 19 H GLY 19 1.697 -4.070 8.565 120 1HA GLY 19 2HA GLY 19 3.174 -2.234 8.501 121 2HA GLY 19 1HA GLY 19 4.231 -3.154 7.441 122 H CYS 20 H CYS 20 1.686 -3.882 5.841 123 HA CYS 20 HA CYS 20 1.886 -1.507 4.166 124 1HB CYS 20 2HB CYS 20 0.627 -4.185 3.646 125 2HB CYS 20 1HB CYS 20 0.623 -2.848 2.509 126 H SER 21 H SER 21 0.210 -0.328 3.431 127 HA SER 21 HA SER 21 -2.433 -0.716 4.636 128 1HB SER 21 2HB SER 21 -0.969 1.939 4.520 129 2HB SER 21 1HB SER 21 -2.592 1.670 5.160 130 HG SER 21 HG SER 21 -0.868 -0.012 6.338 131 H CYS 22 H CYS 22 -4.137 -0.024 3.293 132 HA CYS 22 HA CYS 22 -3.519 0.050 0.501 133 1HB CYS 22 2HB CYS 22 -5.565 -1.019 1.613 134 2HB CYS 22 1HB CYS 22 -6.222 0.610 1.716 135 H SER 23 H SER 23 -2.151 2.081 1.121 136 HA SER 23 HA SER 23 -3.541 4.568 1.314 137 1HB SER 23 2HB SER 23 -0.649 4.088 0.561 138 2HB SER 23 1HB SER 23 -1.349 5.569 1.217 139 HG SER 23 HG SER 23 -1.560 4.623 3.171 140 H LYS 24 H LYS 24 -2.706 2.494 -1.275 141 HA LYS 24 HA LYS 24 -3.582 4.529 -3.179 142 1HB LYS 24 2HB LYS 24 -1.100 2.852 -3.595 143 2HB LYS 24 1HB LYS 24 -1.794 3.971 -4.759 144 1HG LYS 24 2HG LYS 24 -1.446 5.760 -2.961 145 2HG LYS 24 1HG LYS 24 -0.400 4.576 -2.180 146 1HD LYS 24 2HD LYS 24 0.976 4.448 -4.188 147 2HD LYS 24 1HD LYS 24 -0.082 5.605 -4.997 148 1HE LYS 24 2HE LYS 24 1.595 6.112 -2.542 149 2HE LYS 24 1HE LYS 24 1.905 6.723 -4.166 150 1HZ LYS 24 1HZ LYS 24 -0.681 7.335 -2.935 151 2HZ LYS 24 2HZ LYS 24 0.250 8.256 -4.007 152 3HZ LYS 24 3HZ LYS 24 0.680 8.171 -2.374 153 H TYR 25 H TYR 25 -5.447 3.067 -2.769 154 HA TYR 25 HA TYR 25 -5.731 0.428 -3.418 155 1HB TYR 25 2HB TYR 25 -7.499 1.978 -2.538 156 2HB TYR 25 1HB TYR 25 -7.680 2.624 -4.163 157 HD1 TYR 25 1HD TYR 25 -7.777 -0.655 -2.366 158 HD2 TYR 25 2HD TYR 25 -9.352 1.754 -5.499 159 HE1 TYR 25 1HE TYR 25 -9.448 -2.391 -2.854 160 HE2 TYR 25 2HE TYR 25 -11.026 0.024 -5.996 161 HH TYR 25 HH TYR 25 -11.138 -2.593 -5.619 162 HA PRO 26 HA PRO 26 -6.443 -1.107 -4.253 163 1HB PRO 26 2HB PRO 26 -6.278 -3.217 -5.874 164 2HB PRO 26 1HB PRO 26 -7.610 -2.063 -6.007 165 1HG PRO 26 2HG PRO 26 -5.257 -2.443 -7.768 166 2HG PRO 26 1HG PRO 26 -6.874 -1.836 -8.163 167 1HD PRO 26 2HD PRO 26 -4.507 -0.316 -7.629 168 2HD PRO 26 1HD PRO 26 -6.138 0.294 -7.966 169 H LEU 27 H LEU 27 -3.710 -0.037 -4.374 170 HA LEU 27 HA LEU 27 -2.235 -2.545 -3.951 171 1HB LEU 27 2HB LEU 27 -1.247 0.078 -5.045 172 2HB LEU 27 1HB LEU 27 -0.179 -1.211 -4.512 173 HG LEU 27 HG LEU 27 -2.290 -1.685 -6.570 174 1HD1 LEU 27 1HD1 LEU 27 -1.188 -0.480 -8.085 175 2HD1 LEU 27 2HD1 LEU 27 0.255 -1.454 -7.800 176 3HD1 LEU 27 3HD1 LEU 27 -0.021 0.011 -6.858 177 1HD2 LEU 27 1HD2 LEU 27 -0.721 -3.491 -7.234 178 2HD2 LEU 27 2HD2 LEU 27 -1.352 -3.665 -5.596 179 3HD2 LEU 27 3HD2 LEU 27 0.287 -3.066 -5.851 180 H CYS 28 H CYS 28 -1.163 -2.820 -2.149 181 HA CYS 28 HA CYS 28 -1.582 -0.900 -0.011 182 1HB CYS 28 2HB CYS 28 -0.326 -3.651 0.007 183 2HB CYS 28 1HB CYS 28 -0.622 -2.668 1.435 184 H ALA 29 H ALA 29 -0.002 0.175 1.079 185 HA ALA 29 HA ALA 29 2.669 0.153 -0.159 186 1HB ALA 29 1HB ALA 29 2.597 2.474 1.239 187 2HB ALA 29 2HB ALA 29 0.900 2.302 0.793 188 3HB ALA 29 3HB ALA 29 2.142 2.324 -0.459 189 H LYS 30 H LYS 30 4.363 -0.397 1.062 190 HA LYS 30 HA LYS 30 3.958 -1.261 3.787 191 1HB LYS 30 2HB LYS 30 5.401 -2.531 2.244 192 2HB LYS 30 1HB LYS 30 6.462 -1.142 2.082 193 1HG LYS 30 2HG LYS 30 7.575 -2.543 3.562 194 2HG LYS 30 1HG LYS 30 6.809 -1.349 4.609 195 1HD LYS 30 2HD LYS 30 6.554 -3.592 5.523 196 2HD LYS 30 1HD LYS 30 4.987 -2.923 5.067 197 1HE LYS 30 2HE LYS 30 5.208 -5.277 4.407 198 2HE LYS 30 1HE LYS 30 5.000 -4.219 3.015 199 1HZ LYS 30 1HZ LYS 30 6.771 -6.047 2.923 200 2HZ LYS 30 2HZ LYS 30 7.697 -5.019 3.895 201 3HZ LYS 30 3HZ LYS 30 7.189 -4.505 2.363 202 H ASN 31 H ASN 31 3.410 0.648 4.789 203 HA ASN 31 HA ASN 31 3.701 2.560 5.937 204 1HB ASN 31 2HB ASN 31 5.602 1.192 6.913 205 2HB ASN 31 1HB ASN 31 6.675 2.011 5.783 206 1HD2 ASN 31 1HD2 ASN 31 7.745 3.614 6.664 207 2HD2 ASN 31 2HD2 ASN 31 7.185 4.648 7.928
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