NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
2805 | 1clh | 4037 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Orig H atom name Start of MODEL 1 Raw file had 1274 H/Q atoms Start of MODEL 1 1 1H ALA 1 2H ALA 1 10.237 -8.295 18.683 2 2H ALA 1 3H ALA 1 11.581 -8.445 19.632 3 3H ALA 1 1H ALA 1 10.615 -7.112 19.772 4 HA ALA 1 HA ALA 1 11.169 -6.379 17.526 5 1HB ALA 1 1HB ALA 1 12.573 -5.559 19.447 6 2HB ALA 1 2HB ALA 1 13.630 -6.989 19.304 7 3HB ALA 1 3HB ALA 1 13.573 -5.784 17.990 8 H LYS 2 H LYS 2 13.407 -8.878 18.633 9 HA LYS 2 HA LYS 2 14.566 -10.604 17.442 10 1HB LYS 2 1HB LYS 2 12.059 -10.473 15.660 11 2HB LYS 2 2HB LYS 2 13.206 -11.815 15.730 12 1HG LYS 2 1HG LYS 2 11.442 -10.776 18.037 13 2HG LYS 2 2HG LYS 2 11.194 -12.277 17.141 14 1HD LYS 2 1HD LYS 2 13.433 -13.135 17.972 15 2HD LYS 2 2HD LYS 2 13.681 -11.657 18.889 16 1HE LYS 2 1HE LYS 2 11.340 -13.641 19.344 17 2HE LYS 2 2HE LYS 2 12.855 -13.657 20.241 18 1HZ LYS 2 3HZ LYS 2 12.357 -11.421 21.065 19 2HZ LYS 2 1HZ LYS 2 10.933 -11.384 20.229 20 3HZ LYS 2 2HZ LYS 2 11.144 -12.473 21.453 21 H GLY 3 H GLY 3 12.897 -9.815 14.571 22 1HA GLY 3 1HA GLY 3 14.518 -7.755 13.352 23 2HA GLY 3 2HA GLY 3 15.353 -9.286 13.004 24 H ASP 4 H ASP 4 12.719 -7.251 12.360 25 HA ASP 4 HA ASP 4 12.011 -8.598 9.815 26 1HB ASP 4 1HB ASP 4 10.014 -8.776 12.158 27 2HB ASP 4 2HB ASP 4 9.624 -9.137 10.471 28 HA PRO 5 HA PRO 5 11.503 -4.161 9.491 29 1HB PRO 5 1HB PRO 5 10.840 -5.328 6.739 30 2HB PRO 5 2HB PRO 5 11.833 -3.897 7.112 31 1HG PRO 5 1HG PRO 5 13.097 -6.223 6.521 32 2HG PRO 5 2HG PRO 5 13.669 -5.284 7.922 33 1HD PRO 5 1HD PRO 5 11.900 -7.787 7.947 34 2HD PRO 5 2HD PRO 5 13.247 -7.352 9.048 35 H HIS 6 H HIS 6 9.880 -2.925 9.679 36 HA HIS 6 HA HIS 6 7.089 -3.619 8.681 37 1HB HIS 6 1HB HIS 6 7.687 -3.027 11.648 38 2HB HIS 6 2HB HIS 6 6.086 -3.180 10.922 39 HD2 HIS 6 HD2 HIS 6 8.075 -5.683 9.124 40 HE1 HIS 6 HE1 HIS 6 6.677 -7.781 12.435 41 HE2 HIS 6 HE2 HIS 6 7.768 -8.126 10.129 42 H VAL 7 H VAL 7 6.569 -2.041 7.603 43 HA VAL 7 HA VAL 7 7.456 0.808 8.074 44 HB VAL 7 HB VAL 7 5.527 -0.545 6.116 45 1HG1 VAL 7 1HG2 VAL 7 5.962 2.487 6.482 46 2HG1 VAL 7 2HG2 VAL 7 5.076 1.711 5.141 47 3HG1 VAL 7 3HG2 VAL 7 4.447 1.600 6.803 48 1HG2 VAL 7 2HG1 VAL 7 8.017 -0.595 5.677 49 2HG2 VAL 7 3HG1 VAL 7 7.181 0.438 4.481 50 3HG2 VAL 7 1HG1 VAL 7 8.078 1.180 5.832 51 H LEU 8 H LEU 8 6.886 1.327 10.009 52 HA LEU 8 HA LEU 8 4.133 0.841 11.116 53 1HB LEU 8 1HB LEU 8 6.335 0.973 12.496 54 2HB LEU 8 2HB LEU 8 6.220 2.733 12.310 55 HG LEU 8 HG LEU 8 3.842 2.633 13.191 56 1HD1 LEU 8 2HD1 LEU 8 3.346 0.291 12.411 57 2HD1 LEU 8 3HD1 LEU 8 4.501 -0.362 13.599 58 3HD1 LEU 8 1HD1 LEU 8 3.017 0.454 14.156 59 1HD2 LEU 8 3HD2 LEU 8 5.724 3.031 14.807 60 2HD2 LEU 8 1HD2 LEU 8 4.421 2.083 15.571 61 3HD2 LEU 8 2HD2 LEU 8 5.915 1.270 15.033 62 H LEU 9 H LEU 9 2.518 2.045 10.994 63 HA LEU 9 HA LEU 9 2.677 4.988 10.182 64 1HB LEU 9 1HB LEU 9 1.461 2.742 8.549 65 2HB LEU 9 2HB LEU 9 0.585 4.278 8.612 66 HG LEU 9 HG LEU 9 3.594 4.162 8.087 67 1HD1 LEU 9 2HD1 LEU 9 2.419 2.849 6.281 68 2HD1 LEU 9 3HD1 LEU 9 1.305 4.212 6.000 69 3HD1 LEU 9 1HD1 LEU 9 3.042 4.387 5.632 70 1HD2 LEU 9 3HD2 LEU 9 2.643 6.354 8.850 71 2HD2 LEU 9 1HD2 LEU 9 3.174 6.461 7.152 72 3HD2 LEU 9 2HD2 LEU 9 1.440 6.308 7.534 73 H THR 10 H THR 10 1.532 6.164 11.048 74 HA THR 10 HA THR 10 -0.878 5.244 12.756 75 HB THR 10 HB THR 10 1.043 7.611 13.186 76 HG1 THR 10 HG1 THR 10 0.629 5.190 14.608 77 1HG2 THR 10 3HG2 THR 10 -1.323 6.546 14.869 78 2HG2 THR 10 1HG2 THR 10 -0.239 7.884 15.336 79 3HG2 THR 10 2HG2 THR 10 -1.322 8.062 13.930 80 H THR 11 H THR 11 -2.302 5.501 11.233 81 HA THR 11 HA THR 11 -2.753 8.169 9.839 82 HB THR 11 HB THR 11 -4.927 7.069 9.129 83 HG1 THR 11 HG1 THR 11 -3.645 4.832 10.317 84 1HG2 THR 11 2HG2 THR 11 -2.871 7.104 7.705 85 2HG2 THR 11 3HG2 THR 11 -2.291 5.605 8.481 86 3HG2 THR 11 1HG2 THR 11 -3.773 5.581 7.479 87 H SER 12 H SER 12 -4.791 9.125 10.034 88 HA SER 12 HA SER 12 -5.355 10.308 12.533 89 1HB SER 12 1HB SER 12 -7.641 10.824 11.690 90 2HB SER 12 2HB SER 12 -6.428 11.047 10.415 91 HG SER 12 HG SER 12 -8.243 9.865 9.723 92 H ALA 13 H ALA 13 -6.711 7.331 11.238 93 HA ALA 13 HA ALA 13 -8.571 6.673 13.343 94 1HB ALA 13 2HB ALA 13 -8.448 5.408 11.189 95 2HB ALA 13 3HB ALA 13 -6.868 4.733 11.660 96 3HB ALA 13 1HB ALA 13 -8.335 4.304 12.579 97 H GLY 14 H GLY 14 -5.417 5.428 12.868 98 1HA GLY 14 1HA GLY 14 -4.416 5.751 15.638 99 2HA GLY 14 2HA GLY 14 -5.087 4.123 15.473 100 H ASN 15 H ASN 15 -2.686 4.317 16.214 101 HA ASN 15 HA ASN 15 -0.619 4.246 14.046 102 1HB ASN 15 1HB ASN 15 -0.064 4.961 16.368 103 2HB ASN 15 2HB ASN 15 -0.523 3.372 16.995 104 1HD2 ASN 15 1HD2 ASN 15 2.544 2.781 14.379 105 2HD2 ASN 15 2HD2 ASN 15 0.854 3.289 13.874 106 H ILE 16 H ILE 16 -0.788 2.796 12.640 107 HA ILE 16 HA ILE 16 -1.178 -0.169 13.382 108 HB ILE 16 HB ILE 16 -1.569 -0.485 10.947 109 1HG1 ILE 16 1HG1 ILE 16 -1.335 2.584 10.903 110 2HG1 ILE 16 2HG1 ILE 16 -0.272 1.446 10.064 111 1HG2 ILE 16 2HG2 ILE 16 -3.428 -0.148 12.555 112 2HG2 ILE 16 3HG2 ILE 16 -3.326 1.618 12.329 113 3HG2 ILE 16 1HG2 ILE 16 -3.826 0.570 10.971 114 1HD1 ILE 16 3HD1 ILE 16 -3.312 1.770 9.544 115 2HD1 ILE 16 1HD1 ILE 16 -2.009 2.377 8.489 116 3HD1 ILE 16 2HD1 ILE 16 -2.250 0.620 8.690 117 H GLU 17 H GLU 17 -0.042 -1.359 11.378 118 HA GLU 17 HA GLU 17 2.877 -0.594 11.114 119 1HB GLU 17 1HB GLU 17 2.007 -3.001 12.814 120 2HB GLU 17 2HB GLU 17 3.674 -2.515 12.460 121 1HG GLU 17 1HG GLU 17 3.279 -0.301 13.624 122 2HG GLU 17 2HG GLU 17 1.607 -0.754 13.941 123 H LEU 18 H LEU 18 2.892 -0.961 9.043 124 HA LEU 18 HA LEU 18 2.135 -3.616 7.796 125 1HB LEU 18 1HB LEU 18 3.669 -1.176 6.738 126 2HB LEU 18 2HB LEU 18 3.690 -2.728 5.905 127 HG LEU 18 HG LEU 18 1.925 -1.525 4.884 128 1HD1 LEU 18 2HD1 LEU 18 1.396 -3.926 5.409 129 2HD1 LEU 18 3HD1 LEU 18 0.676 -3.438 6.965 130 3HD1 LEU 18 1HD1 LEU 18 -0.083 -2.932 5.434 131 1HD2 LEU 18 3HD2 LEU 18 1.597 0.247 6.604 132 2HD2 LEU 18 1HD2 LEU 18 0.041 -0.475 6.126 133 3HD2 LEU 18 2HD2 LEU 18 0.787 -0.926 7.684 134 H GLU 19 H GLU 19 3.601 -4.941 6.863 135 HA GLU 19 HA GLU 19 6.497 -4.938 7.853 136 1HB GLU 19 1HB GLU 19 5.065 -6.380 9.379 137 2HB GLU 19 2HB GLU 19 4.623 -7.374 7.993 138 1HG GLU 19 1HG GLU 19 7.497 -6.874 9.025 139 2HG GLU 19 2HG GLU 19 6.553 -8.324 9.347 140 H LEU 20 H LEU 20 7.783 -5.240 6.357 141 HA LEU 20 HA LEU 20 6.766 -6.105 3.573 142 1HB LEU 20 1HB LEU 20 8.871 -3.990 4.300 143 2HB LEU 20 2HB LEU 20 8.273 -4.373 2.680 144 HG LEU 20 HG LEU 20 6.567 -3.330 5.021 145 1HD1 LEU 20 2HD1 LEU 20 8.108 -1.591 4.066 146 2HD1 LEU 20 3HD1 LEU 20 7.496 -1.932 2.426 147 3HD1 LEU 20 1HD1 LEU 20 6.412 -1.228 3.654 148 1HD2 LEU 20 3HD2 LEU 20 5.265 -4.833 3.486 149 2HD2 LEU 20 1HD2 LEU 20 4.736 -3.140 3.313 150 3HD2 LEU 20 2HD2 LEU 20 5.794 -3.873 2.078 151 H ASP 21 H ASP 21 7.884 -7.233 2.313 152 HA ASP 21 HA ASP 21 9.904 -9.150 3.179 153 1HB ASP 21 1HB ASP 21 9.360 -8.028 0.372 154 2HB ASP 21 2HB ASP 21 10.294 -9.490 0.730 155 H LYS 22 H LYS 22 11.252 -8.282 0.554 156 HA LYS 22 HA LYS 22 12.992 -6.119 0.556 157 1HB LYS 22 1HB LYS 22 13.330 -6.358 3.013 158 2HB LYS 22 2HB LYS 22 13.807 -8.053 2.808 159 1HG LYS 22 1HG LYS 22 15.687 -7.280 1.258 160 2HG LYS 22 2HG LYS 22 15.300 -5.610 1.637 161 1HD LYS 22 1HD LYS 22 16.190 -7.746 3.695 162 2HD LYS 22 2HD LYS 22 17.267 -6.601 2.907 163 1HE LYS 22 1HE LYS 22 16.019 -4.657 3.962 164 2HE LYS 22 2HE LYS 22 14.941 -5.796 4.784 165 1HZ LYS 22 3HZ LYS 22 17.896 -5.672 5.152 166 2HZ LYS 22 1HZ LYS 22 16.763 -5.111 6.215 167 3HZ LYS 22 2HZ LYS 22 16.887 -6.732 5.919 168 H GLN 23 H GLN 23 13.508 -9.495 1.393 169 HA GLN 23 HA GLN 23 15.823 -9.988 -0.269 170 1HB GLN 23 1HB GLN 23 15.030 -11.553 1.521 171 2HB GLN 23 2HB GLN 23 13.612 -11.974 0.547 172 1HG GLN 23 1HG GLN 23 15.142 -12.775 -1.311 173 2HG GLN 23 2HG GLN 23 16.548 -12.364 -0.327 174 1HE2 GLN 23 2HE2 GLN 23 14.522 -15.846 0.397 175 2HE2 GLN 23 1HE2 GLN 23 14.016 -14.633 -0.884 176 H LYS 24 H LYS 24 12.434 -10.824 -0.852 177 HA LYS 24 HA LYS 24 12.902 -11.838 -3.554 178 1HB LYS 24 1HB LYS 24 10.971 -12.437 -2.042 179 2HB LYS 24 2HB LYS 24 10.255 -10.852 -2.370 180 1HG LYS 24 1HG LYS 24 9.346 -12.607 -3.920 181 2HG LYS 24 2HG LYS 24 10.180 -11.325 -4.806 182 1HD LYS 24 1HD LYS 24 12.266 -12.741 -4.928 183 2HD LYS 24 2HD LYS 24 11.474 -14.040 -4.052 184 1HE LYS 24 1HE LYS 24 10.535 -12.958 -6.803 185 2HE LYS 24 2HE LYS 24 11.611 -14.335 -6.585 186 1HZ LYS 24 2HZ LYS 24 9.846 -15.484 -5.363 187 2HZ LYS 24 3HZ LYS 24 8.819 -14.205 -5.562 188 3HZ LYS 24 1HZ LYS 24 9.337 -15.061 -6.877 189 H ALA 25 H ALA 25 12.894 -8.650 -2.515 190 HA ALA 25 HA ALA 25 12.883 -7.632 -5.326 191 1HB ALA 25 2HB ALA 25 10.409 -7.767 -4.894 192 2HB ALA 25 3HB ALA 25 10.596 -6.755 -3.437 193 3HB ALA 25 1HB ALA 25 10.939 -6.074 -5.049 194 HA PRO 26 HA PRO 26 15.737 -5.558 -2.266 195 1HB PRO 26 1HB PRO 26 17.232 -5.846 -4.916 196 2HB PRO 26 2HB PRO 26 17.876 -6.036 -3.267 197 1HG PRO 26 1HG PRO 26 17.342 -8.266 -4.722 198 2HG PRO 26 2HG PRO 26 16.816 -8.216 -3.021 199 1HD PRO 26 1HD PRO 26 15.096 -7.745 -5.520 200 2HD PRO 26 2HD PRO 26 14.698 -8.685 -4.044 201 H VAL 27 H VAL 27 15.427 -5.104 -5.759 202 HA VAL 27 HA VAL 27 16.195 -2.378 -6.020 203 HB VAL 27 HB VAL 27 13.929 -3.809 -7.527 204 1HG1 VAL 27 3HG2 VAL 27 13.912 -1.317 -7.842 205 2HG1 VAL 27 1HG2 VAL 27 15.641 -1.348 -8.275 206 3HG1 VAL 27 2HG2 VAL 27 14.443 -2.138 -9.334 207 1HG2 VAL 27 2HG1 VAL 27 16.112 -5.055 -7.579 208 2HG2 VAL 27 3HG1 VAL 27 15.747 -4.354 -9.177 209 3HG2 VAL 27 1HG1 VAL 27 16.954 -3.579 -8.118 210 H SER 28 H SER 28 12.857 -3.503 -5.935 211 HA SER 28 HA SER 28 11.532 -1.013 -5.739 212 1HB SER 28 1HB SER 28 9.635 -2.230 -4.659 213 2HB SER 28 2HB SER 28 10.314 -3.134 -6.025 214 HG SER 28 HG SER 28 9.996 -4.424 -4.185 215 H VAL 29 H VAL 29 12.533 -3.059 -3.014 216 HA VAL 29 HA VAL 29 11.655 -1.492 -0.836 217 HB VAL 29 HB VAL 29 13.526 -2.517 0.442 218 1HG1 VAL 29 3HG2 VAL 29 11.445 -3.812 -0.084 219 2HG1 VAL 29 1HG2 VAL 29 12.174 -4.387 -1.605 220 3HG1 VAL 29 2HG2 VAL 29 12.864 -4.892 -0.039 221 1HG2 VAL 29 1HG1 VAL 29 14.500 -3.482 -2.325 222 2HG2 VAL 29 2HG1 VAL 29 15.342 -2.310 -1.280 223 3HG2 VAL 29 3HG1 VAL 29 15.168 -4.004 -0.755 224 H GLN 30 H GLN 30 14.756 -1.247 -2.528 225 HA GLN 30 HA GLN 30 15.930 0.939 -1.075 226 1HB GLN 30 1HB GLN 30 17.106 -0.349 -2.884 227 2HB GLN 30 2HB GLN 30 16.075 0.404 -4.109 228 1HG GLN 30 1HG GLN 30 18.242 1.615 -3.956 229 2HG GLN 30 2HG GLN 30 16.918 2.676 -3.463 230 1HE2 GLN 30 2HE2 GLN 30 18.311 3.199 -0.238 231 2HE2 GLN 30 1HE2 GLN 30 17.138 3.681 -1.564 232 H ASN 31 H ASN 31 13.901 1.007 -3.962 233 HA ASN 31 HA ASN 31 13.695 3.829 -4.382 234 1HB ASN 31 1HB ASN 31 11.478 1.714 -4.728 235 2HB ASN 31 2HB ASN 31 11.477 3.320 -5.468 236 1HD2 ASN 31 1HD2 ASN 31 14.654 2.344 -7.313 237 2HD2 ASN 31 2HD2 ASN 31 14.269 3.505 -5.946 238 H PHE 32 H PHE 32 11.264 1.832 -2.747 239 HA PHE 32 HA PHE 32 9.710 4.067 -1.801 240 1HB PHE 32 1HB PHE 32 8.515 2.561 -0.337 241 2HB PHE 32 2HB PHE 32 8.788 1.790 -1.893 242 HD1 PHE 32 HD2 PHE 32 9.852 1.872 1.630 243 HD2 PHE 32 HD1 PHE 32 10.150 -0.182 -2.043 244 HE1 PHE 32 HE2 PHE 32 10.768 -0.062 2.783 245 HE2 PHE 32 HE1 PHE 32 11.059 -2.115 -0.885 246 HZ PHE 32 HZ PHE 32 11.347 -2.064 1.529 247 H VAL 33 H VAL 33 12.231 2.208 -0.137 248 HA VAL 33 HA VAL 33 12.202 3.560 2.416 249 HB VAL 33 HB VAL 33 13.673 1.609 1.907 250 1HG1 VAL 33 3HG2 VAL 33 14.391 2.308 -0.400 251 2HG1 VAL 33 1HG2 VAL 33 15.310 3.672 0.287 252 3HG1 VAL 33 2HG2 VAL 33 15.811 1.995 0.632 253 1HG2 VAL 33 2HG1 VAL 33 14.161 3.108 3.862 254 2HG2 VAL 33 3HG1 VAL 33 15.675 2.471 3.166 255 3HG2 VAL 33 1HG1 VAL 33 15.173 4.149 2.828 256 H ASP 34 H ASP 34 13.631 4.494 -0.656 257 HA ASP 34 HA ASP 34 14.957 6.967 0.014 258 1HB ASP 34 1HB ASP 34 13.073 6.339 -2.346 259 2HB ASP 34 2HB ASP 34 14.121 7.757 -2.259 260 OH TYR 35 OH TYR 35 9.563 8.643 -6.087 261 H TYR 35 H TYR 35 11.630 6.489 -1.018 262 HA TYR 35 HA TYR 35 10.580 9.101 -0.178 263 1HB TYR 35 1HB TYR 35 9.145 6.391 -0.489 264 2HB TYR 35 2HB TYR 35 8.325 7.931 -0.219 265 HD1 TYR 35 HD2 TYR 35 10.862 6.388 -2.471 266 HD2 TYR 35 HD1 TYR 35 7.787 9.249 -2.049 267 HE1 TYR 35 HE2 TYR 35 11.007 6.898 -4.845 268 HE2 TYR 35 HE1 TYR 35 7.933 9.754 -4.422 269 HH TYR 35 HH TYR 35 10.245 8.096 -6.483 270 H VAL 36 H VAL 36 10.173 5.904 1.265 271 HA VAL 36 HA VAL 36 8.980 6.430 3.733 272 HB VAL 36 HB VAL 36 11.488 4.702 3.348 273 1HG1 VAL 36 3HG2 VAL 36 10.893 5.099 5.755 274 2HG1 VAL 36 1HG2 VAL 36 9.219 4.572 5.444 275 3HG1 VAL 36 2HG2 VAL 36 10.563 3.406 5.303 276 1HG2 VAL 36 2HG1 VAL 36 9.670 4.165 1.692 277 2HG2 VAL 36 3HG1 VAL 36 9.835 2.851 2.886 278 3HG2 VAL 36 1HG1 VAL 36 8.489 4.015 3.018 279 H ASN 37 H ASN 37 12.447 6.543 3.122 280 HA ASN 37 HA ASN 37 13.555 7.392 5.524 281 1HB ASN 37 1HB ASN 37 14.163 8.705 2.804 282 2HB ASN 37 2HB ASN 37 15.218 8.752 4.223 283 1HD2 ASN 37 1HD2 ASN 37 15.580 5.007 4.057 284 2HD2 ASN 37 2HD2 ASN 37 14.857 6.212 5.236 285 H SER 38 H SER 38 11.511 9.311 3.452 286 HA SER 38 HA SER 38 10.331 10.984 5.296 287 1HB SER 38 1HB SER 38 11.747 13.004 5.615 288 2HB SER 38 2HB SER 38 12.581 11.554 6.207 289 HG SER 38 HG SER 38 13.899 12.867 4.899 290 H GLY 39 H GLY 39 9.463 12.916 4.665 291 1HA GLY 39 1HA GLY 39 8.511 14.484 3.124 292 2HA GLY 39 2HA GLY 39 9.879 14.197 2.041 293 H PHE 40 H PHE 40 6.819 12.964 3.192 294 HA PHE 40 HA PHE 40 5.566 12.555 0.682 295 1HB PHE 40 1HB PHE 40 7.429 10.941 0.176 296 2HB PHE 40 2HB PHE 40 6.983 9.966 1.577 297 HD1 PHE 40 HD1 PHE 40 4.525 9.140 1.659 298 HD2 PHE 40 HD2 PHE 40 6.354 10.549 -1.872 299 HE1 PHE 40 HE1 PHE 40 2.871 7.958 0.328 300 HE2 PHE 40 HE2 PHE 40 4.699 9.364 -3.199 301 HZ PHE 40 HZ PHE 40 2.958 8.068 -2.101 302 OH TYR 41 OH TYR 41 6.367 5.125 0.754 303 H TYR 41 H TYR 41 6.004 10.068 3.125 304 HA TYR 41 HA TYR 41 3.147 9.602 3.473 305 1HB TYR 41 1HB TYR 41 5.428 8.870 5.402 306 2HB TYR 41 2HB TYR 41 3.829 8.128 5.344 307 HD1 TYR 41 HD2 TYR 41 3.158 6.836 3.328 308 HD2 TYR 41 HD1 TYR 41 7.085 8.319 3.773 309 HE1 TYR 41 HE2 TYR 41 3.933 5.316 1.594 310 HE2 TYR 41 HE1 TYR 41 7.855 6.798 2.039 311 HH TYR 41 HH TYR 41 7.310 5.250 0.626 312 H ASN 42 H ASN 42 5.426 11.614 5.180 313 HA ASN 42 HA ASN 42 4.461 11.936 7.709 314 1HB ASN 42 1HB ASN 42 5.123 14.346 5.905 315 2HB ASN 42 2HB ASN 42 5.131 14.353 7.676 316 1HD2 ASN 42 1HD2 ASN 42 8.645 13.721 6.762 317 2HD2 ASN 42 2HD2 ASN 42 7.396 15.065 6.736 318 H ASN 43 H ASN 43 2.833 13.267 4.892 319 HA ASN 43 HA ASN 43 0.259 13.469 6.432 320 1HB ASN 43 1HB ASN 43 1.300 15.595 7.079 321 2HB ASN 43 2HB ASN 43 1.662 16.005 5.394 322 1HD2 ASN 43 1HD2 ASN 43 -1.663 17.103 4.675 323 2HD2 ASN 43 2HD2 ASN 43 0.012 16.690 4.050 324 H THR 44 H THR 44 0.915 11.861 4.501 325 HA THR 44 HA THR 44 -0.731 12.718 2.056 326 HB THR 44 HB THR 44 -0.466 10.328 1.382 327 HG1 THR 44 HG1 THR 44 1.008 9.100 2.601 328 1HG2 THR 44 2HG2 THR 44 1.227 12.049 0.665 329 2HG2 THR 44 3HG2 THR 44 2.175 11.744 2.144 330 3HG2 THR 44 1HG2 THR 44 2.003 10.462 0.914 331 H THR 45 H THR 45 -1.779 9.915 2.187 332 HA THR 45 HA THR 45 -3.316 9.625 4.698 333 HB THR 45 HB THR 45 -5.594 9.851 3.671 334 HG1 THR 45 HG1 THR 45 -5.692 11.022 1.723 335 1HG2 THR 45 2HG2 THR 45 -4.604 11.742 5.006 336 2HG2 THR 45 3HG2 THR 45 -3.857 12.403 3.528 337 3HG2 THR 45 1HG2 THR 45 -5.633 12.365 3.689 338 H PHE 46 H PHE 46 -5.533 8.533 3.148 339 HA PHE 46 HA PHE 46 -4.396 6.081 1.740 340 1HB PHE 46 1HB PHE 46 -6.130 5.969 4.296 341 2HB PHE 46 2HB PHE 46 -5.932 4.609 3.191 342 HD1 PHE 46 HD2 PHE 46 -2.933 5.819 2.646 343 HD2 PHE 46 HD1 PHE 46 -5.093 4.356 5.959 344 HE1 PHE 46 HE2 PHE 46 -0.850 5.169 3.719 345 HE2 PHE 46 HE1 PHE 46 -3.010 3.700 7.026 346 HZ PHE 46 HZ PHE 46 -0.888 4.108 5.908 347 H HIS 47 H HIS 47 -5.221 6.952 -0.002 348 HA HIS 47 HA HIS 47 -7.381 8.283 -0.821 349 1HB HIS 47 1HB HIS 47 -7.024 5.461 -1.988 350 2HB HIS 47 2HB HIS 47 -7.654 6.889 -2.822 351 HD2 HIS 47 HD2 HIS 47 -5.898 8.461 -3.989 352 HE1 HIS 47 HE1 HIS 47 -2.403 6.843 -2.403 353 HE2 HIS 47 HE2 HIS 47 -3.242 8.558 -4.134 354 NH1 ARG 48 NH2 ARG 48 -12.135 2.451 3.717 355 NH2 ARG 48 NH1 ARG 48 -10.127 3.248 4.423 356 H ARG 48 H ARG 48 -7.871 4.815 -0.471 357 HA ARG 48 HA ARG 48 -9.912 5.002 1.560 358 1HB ARG 48 1HB ARG 48 -11.268 5.999 -0.333 359 2HB ARG 48 2HB ARG 48 -11.093 4.482 -1.231 360 1HG ARG 48 1HG ARG 48 -13.237 4.499 0.034 361 2HG ARG 48 2HG ARG 48 -12.195 3.203 0.607 362 1HD ARG 48 1HD ARG 48 -12.534 5.952 1.985 363 2HD ARG 48 2HD ARG 48 -13.389 4.504 2.458 364 HE ARG 48 HE ARG 48 -10.487 5.143 3.002 365 1HH1 ARG 48 2HH2 ARG 48 -12.964 2.592 3.129 366 2HH1 ARG 48 1HH2 ARG 48 -11.949 1.654 4.336 367 1HH2 ARG 48 1HH1 ARG 48 -9.423 3.993 4.374 368 2HH2 ARG 48 2HH1 ARG 48 -10.081 2.396 4.991 369 H VAL 49 H VAL 49 -11.543 2.920 0.228 370 HA VAL 49 HA VAL 49 -9.881 0.495 -0.077 371 HB VAL 49 HB VAL 49 -9.375 0.885 2.306 372 1HG1 VAL 49 1HG2 VAL 49 -12.443 0.913 2.693 373 2HG1 VAL 49 2HG2 VAL 49 -11.235 0.966 4.005 374 3HG1 VAL 49 3HG2 VAL 49 -11.365 2.322 2.855 375 1HG2 VAL 49 2HG1 VAL 49 -9.739 -1.481 1.528 376 2HG2 VAL 49 3HG1 VAL 49 -10.277 -1.290 3.218 377 3HG2 VAL 49 1HG1 VAL 49 -11.477 -1.349 1.900 378 H ILE 50 H ILE 50 -10.907 -1.006 -0.866 379 HA ILE 50 HA ILE 50 -13.893 -1.215 -1.125 380 HB ILE 50 HB ILE 50 -12.376 -2.329 -2.753 381 1HG1 ILE 50 1HG1 ILE 50 -13.980 -4.258 -0.970 382 2HG1 ILE 50 2HG1 ILE 50 -14.645 -3.264 -2.272 383 1HG2 ILE 50 2HG2 ILE 50 -10.480 -2.825 -1.178 384 2HG2 ILE 50 3HG2 ILE 50 -11.490 -4.016 -0.319 385 3HG2 ILE 50 1HG2 ILE 50 -11.010 -4.309 -2.012 386 1HD1 ILE 50 3HD1 ILE 50 -12.477 -5.449 -2.640 387 2HD1 ILE 50 1HD1 ILE 50 -14.196 -5.606 -3.088 388 3HD1 ILE 50 2HD1 ILE 50 -13.152 -4.447 -3.952 389 HA PRO 51 HA PRO 51 -14.681 -2.171 3.122 390 1HB PRO 51 1HB PRO 51 -16.920 -3.812 2.610 391 2HB PRO 51 2HB PRO 51 -16.926 -2.034 2.623 392 1HG PRO 51 1HG PRO 51 -16.663 -3.883 0.201 393 2HG PRO 51 2HG PRO 51 -17.722 -2.462 0.378 394 1HD PRO 51 1HD PRO 51 -15.336 -2.252 -0.967 395 2HD PRO 51 2HD PRO 51 -15.834 -0.922 0.131 396 H GLY 52 H GLY 52 -14.560 -3.785 4.525 397 1HA GLY 52 1HA GLY 52 -12.838 -5.525 5.140 398 2HA GLY 52 2HA GLY 52 -14.382 -6.349 4.912 399 H PHE 53 H PHE 53 -11.850 -5.040 2.820 400 HA PHE 53 HA PHE 53 -11.255 -7.799 1.662 401 1HB PHE 53 1HB PHE 53 -13.147 -6.792 0.320 402 2HB PHE 53 2HB PHE 53 -12.142 -5.382 -0.032 403 HD1 PHE 53 HD1 PHE 53 -11.945 -9.112 -0.135 404 HD2 PHE 53 HD2 PHE 53 -10.866 -5.482 -1.994 405 HE1 PHE 53 HE1 PHE 53 -10.941 -10.348 -1.971 406 HE2 PHE 53 HE2 PHE 53 -9.862 -6.723 -3.828 407 HZ PHE 53 HZ PHE 53 -9.900 -9.155 -3.817 408 H MET 54 H MET 54 -10.611 -4.326 1.220 409 HA MET 54 HA MET 54 -7.644 -4.654 1.498 410 1HB MET 54 1HB MET 54 -7.994 -5.802 -0.671 411 2HB MET 54 2HB MET 54 -8.975 -4.458 -1.272 412 1HG MET 54 1HG MET 54 -6.981 -2.905 -1.040 413 2HG MET 54 2HG MET 54 -5.992 -4.280 -0.509 414 1HE MET 54 1HE MET 54 -8.337 -2.878 -3.400 415 2HE MET 54 3HE MET 54 -8.076 -4.074 -4.703 416 3HE MET 54 2HE MET 54 -8.961 -4.549 -3.226 417 H ILE 55 H ILE 55 -7.160 -2.974 2.439 418 HA ILE 55 HA ILE 55 -8.047 -0.195 1.486 419 HB ILE 55 HB ILE 55 -6.792 0.670 3.399 420 1HG1 ILE 55 1HG1 ILE 55 -6.184 -2.288 3.996 421 2HG1 ILE 55 2HG1 ILE 55 -5.003 -1.066 3.500 422 1HG2 ILE 55 2HG2 ILE 55 -9.189 0.014 3.710 423 2HG2 ILE 55 3HG2 ILE 55 -8.694 -1.637 4.165 424 3HG2 ILE 55 1HG2 ILE 55 -8.265 -0.257 5.211 425 1HD1 ILE 55 3HD1 ILE 55 -6.718 -0.938 6.082 426 2HD1 ILE 55 1HD1 ILE 55 -4.985 -1.352 6.010 427 3HD1 ILE 55 2HD1 ILE 55 -5.529 0.293 5.586 428 H GLN 56 H GLN 56 -6.531 1.284 0.882 429 HA GLN 56 HA GLN 56 -4.653 0.194 -1.068 430 1HB GLN 56 1HB GLN 56 -4.940 3.071 -0.125 431 2HB GLN 56 2HB GLN 56 -4.225 2.534 -1.656 432 1HG GLN 56 1HG GLN 56 -6.417 1.435 -2.294 433 2HG GLN 56 2HG GLN 56 -7.150 2.048 -0.809 434 1HE2 GLN 56 2HE2 GLN 56 -7.861 4.423 -3.676 435 2HE2 GLN 56 1HE2 GLN 56 -8.058 2.620 -3.396 436 H GLY 57 H GLY 57 -1.538 1.665 0.971 437 1HA GLY 57 1HA GLY 57 -3.496 3.098 -0.856 438 2HA GLY 57 2HA GLY 57 -3.382 3.761 0.778 439 H GLY 58 H GLY 58 -2.152 5.351 0.937 440 1HA GLY 58 1HA GLY 58 -0.343 6.899 0.627 441 2HA GLY 58 2HA GLY 58 0.668 5.519 0.175 442 H GLY 59 H GLY 59 -0.926 8.267 -0.806 443 1HA GLY 59 1HA GLY 59 0.197 8.311 -3.509 444 2HA GLY 59 2HA GLY 59 -1.501 7.813 -3.641 445 H PHE 60 H PHE 60 -2.745 9.337 -4.113 446 HA PHE 60 HA PHE 60 -2.223 12.117 -4.279 447 1HB PHE 60 1HB PHE 60 -4.945 10.832 -3.619 448 2HB PHE 60 2HB PHE 60 -4.710 12.465 -4.241 449 HD1 PHE 60 HD2 PHE 60 -3.974 8.904 -5.032 450 HD2 PHE 60 HD1 PHE 60 -4.514 12.798 -6.562 451 HE1 PHE 60 HE2 PHE 60 -3.941 8.022 -7.296 452 HE2 PHE 60 HE1 PHE 60 -4.483 11.911 -8.824 453 HZ PHE 60 HZ PHE 60 -4.197 9.524 -9.193 454 H THR 61 H THR 61 -1.497 13.386 -2.856 455 HA THR 61 HA THR 61 -1.664 13.106 0.028 456 HB THR 61 HB THR 61 0.003 14.512 -1.183 457 HG1 THR 61 HG1 THR 61 -0.160 16.254 0.276 458 1HG2 THR 61 2HG2 THR 61 -1.549 15.523 -2.887 459 2HG2 THR 61 3HG2 THR 61 -2.387 16.426 -1.596 460 3HG2 THR 61 1HG2 THR 61 -0.683 16.794 -1.981 461 H GLU 62 H GLU 62 -3.310 13.145 1.209 462 HA GLU 62 HA GLU 62 -5.344 13.840 2.258 463 1HB GLU 62 1HB GLU 62 -4.879 16.369 0.570 464 2HB GLU 62 2HB GLU 62 -6.035 16.225 1.906 465 1HG GLU 62 1HG GLU 62 -4.133 15.614 3.475 466 2HG GLU 62 2HG GLU 62 -2.985 15.775 2.150 467 H GLN 63 H GLN 63 -6.594 16.023 0.227 468 HA GLN 63 HA GLN 63 -8.992 14.711 -0.442 469 1HB GLN 63 1HB GLN 63 -7.474 16.705 -2.243 470 2HB GLN 63 2HB GLN 63 -9.144 16.195 -2.491 471 1HG GLN 63 1HG GLN 63 -9.269 18.277 -1.305 472 2HG GLN 63 2HG GLN 63 -9.726 17.023 -0.151 473 1HE2 GLN 63 2HE2 GLN 63 -7.093 19.509 1.216 474 2HE2 GLN 63 1HE2 GLN 63 -8.574 19.753 0.160 475 H MET 64 H MET 64 -6.192 15.001 -2.552 476 HA MET 64 HA MET 64 -5.371 12.677 -3.441 477 1HB MET 64 1HB MET 64 -6.896 11.481 -4.981 478 2HB MET 64 2HB MET 64 -7.589 11.574 -3.358 479 1HG MET 64 1HG MET 64 -8.898 13.667 -4.119 480 2HG MET 64 2HG MET 64 -8.318 13.360 -5.768 481 1HE MET 64 1HE MET 64 -8.610 10.780 -6.896 482 2HE MET 64 3HE MET 64 -8.223 9.938 -5.361 483 3HE MET 64 2HE MET 64 -9.744 9.572 -6.223 484 H GLN 65 H GLN 65 -3.953 13.934 -4.249 485 HA GLN 65 HA GLN 65 -4.257 14.813 -7.103 486 1HB GLN 65 1HB GLN 65 -3.672 16.897 -4.903 487 2HB GLN 65 2HB GLN 65 -3.594 17.187 -6.646 488 1HG GLN 65 1HG GLN 65 -6.108 16.320 -5.080 489 2HG GLN 65 2HG GLN 65 -5.781 17.950 -5.682 490 1HE2 GLN 65 2HE2 GLN 65 -7.673 16.982 -8.549 491 2HE2 GLN 65 1HE2 GLN 65 -7.523 18.029 -7.050 492 H GLN 66 H GLN 66 -2.725 13.724 -7.785 493 HA GLN 66 HA GLN 66 -0.556 12.495 -6.743 494 1HB GLN 66 1HB GLN 66 -0.274 14.244 -9.259 495 2HB GLN 66 2HB GLN 66 0.767 12.883 -8.820 496 1HG GLN 66 1HG GLN 66 -2.273 12.709 -9.329 497 2HG GLN 66 2HG GLN 66 -1.015 12.216 -10.470 498 1HE2 GLN 66 2HE2 GLN 66 -1.455 9.974 -6.992 499 2HE2 GLN 66 1HE2 GLN 66 -1.753 11.785 -7.002 500 H LYS 67 H LYS 67 1.191 12.740 -5.800 501 HA LYS 67 HA LYS 67 2.274 15.267 -4.678 502 1HB LYS 67 1HB LYS 67 3.510 12.507 -5.199 503 2HB LYS 67 2HB LYS 67 4.371 13.815 -4.378 504 1HG LYS 67 1HG LYS 67 1.654 12.651 -3.469 505 2HG LYS 67 2HG LYS 67 3.214 12.176 -2.813 506 1HD LYS 67 1HD LYS 67 2.261 13.706 -1.262 507 2HD LYS 67 2HD LYS 67 3.624 14.531 -1.978 508 1HE LYS 67 1HE LYS 67 0.676 14.981 -2.856 509 2HE LYS 67 2HE LYS 67 1.460 15.897 -1.573 510 1HZ LYS 67 2HZ LYS 67 3.100 16.698 -3.180 511 2HZ LYS 67 3HZ LYS 67 2.373 15.858 -4.402 512 3HZ LYS 67 1HZ LYS 67 1.566 17.089 -3.652 513 H LYS 68 H LYS 68 4.369 13.295 -6.241 514 HA LYS 68 HA LYS 68 4.230 14.245 -9.005 515 1HB LYS 68 1HB LYS 68 5.218 16.313 -8.006 516 2HB LYS 68 2HB LYS 68 6.577 15.374 -7.363 517 1HG LYS 68 1HG LYS 68 7.140 14.605 -9.698 518 2HG LYS 68 2HG LYS 68 5.829 15.564 -10.360 519 1HD LYS 68 1HD LYS 68 8.243 16.766 -8.820 520 2HD LYS 68 2HD LYS 68 8.201 16.511 -10.547 521 1HE LYS 68 1HE LYS 68 7.700 18.795 -10.342 522 2HE LYS 68 2HE LYS 68 6.148 18.059 -10.722 523 1HZ LYS 68 1HZ LYS 68 7.066 18.876 -7.999 524 2HZ LYS 68 2HZ LYS 68 5.966 19.678 -8.937 525 3HZ LYS 68 3HZ LYS 68 5.601 18.186 -8.328 526 HA PRO 69 HA PRO 69 6.425 10.264 -7.821 527 1HB PRO 69 1HB PRO 69 4.242 9.247 -9.671 528 2HB PRO 69 2HB PRO 69 4.777 8.570 -8.117 529 1HG PRO 69 1HG PRO 69 2.428 9.934 -8.223 530 2HG PRO 69 2HG PRO 69 3.542 10.254 -6.869 531 1HD PRO 69 1HD PRO 69 3.196 11.924 -9.430 532 2HD PRO 69 2HD PRO 69 3.281 12.488 -7.731 533 H ASN 70 H ASN 70 6.429 8.327 -9.603 534 HA ASN 70 HA ASN 70 6.786 7.636 -11.851 535 1HB ASN 70 1HB ASN 70 7.143 9.109 -13.687 536 2HB ASN 70 2HB ASN 70 5.944 9.879 -12.651 537 1HD2 ASN 70 1HD2 ASN 70 9.647 11.610 -13.185 538 2HD2 ASN 70 2HD2 ASN 70 9.247 9.924 -13.789 539 HA PRO 71 HA PRO 71 11.458 7.577 -11.211 540 1HB PRO 71 1HB PRO 71 11.990 6.530 -8.781 541 2HB PRO 71 2HB PRO 71 11.411 8.217 -8.853 542 1HG PRO 71 1HG PRO 71 9.735 5.688 -8.333 543 2HG PRO 71 2HG PRO 71 9.802 7.154 -7.324 544 1HD PRO 71 1HD PRO 71 7.842 6.750 -9.300 545 2HD PRO 71 2HD PRO 71 8.431 8.383 -8.854 546 HA PRO 72 HA PRO 72 9.145 3.703 -12.304 547 1HB PRO 72 1HB PRO 72 10.885 4.021 -14.801 548 2HB PRO 72 2HB PRO 72 9.160 3.597 -14.710 549 1HG PRO 72 1HG PRO 72 9.813 6.150 -15.338 550 2HG PRO 72 2HG PRO 72 8.544 5.884 -14.115 551 1HD PRO 72 1HD PRO 72 11.495 6.590 -13.622 552 2HD PRO 72 2HD PRO 72 10.036 7.267 -12.832 553 H ILE 73 H ILE 73 9.821 2.124 -11.162 554 HA ILE 73 HA ILE 73 12.640 1.028 -11.210 555 HB ILE 73 HB ILE 73 11.757 -0.592 -9.569 556 1HG1 ILE 73 1HG1 ILE 73 9.111 0.911 -10.047 557 2HG1 ILE 73 2HG1 ILE 73 9.421 -0.791 -10.412 558 1HG2 ILE 73 2HG2 ILE 73 12.653 1.645 -8.874 559 2HG2 ILE 73 3HG2 ILE 73 11.030 2.362 -9.039 560 3HG2 ILE 73 1HG2 ILE 73 11.337 1.130 -7.786 561 1HD1 ILE 73 3HD1 ILE 73 9.534 0.475 -7.584 562 2HD1 ILE 73 1HD1 ILE 73 8.220 -0.557 -8.206 563 3HD1 ILE 73 2HD1 ILE 73 9.846 -1.243 -7.944 564 H LYS 74 H LYS 74 10.861 -1.560 -10.869 565 HA LYS 74 HA LYS 74 10.283 -2.255 -13.764 566 1HB LYS 74 1HB LYS 74 11.902 -4.259 -13.584 567 2HB LYS 74 2HB LYS 74 12.588 -2.667 -13.881 568 1HG LYS 74 1HG LYS 74 13.942 -3.818 -12.227 569 2HG LYS 74 2HG LYS 74 13.222 -2.398 -11.493 570 1HD LYS 74 1HD LYS 74 12.036 -5.240 -11.182 571 2HD LYS 74 2HD LYS 74 13.299 -4.614 -10.132 572 1HE LYS 74 1HE LYS 74 11.822 -2.717 -9.378 573 2HE LYS 74 2HE LYS 74 10.525 -3.290 -10.436 574 1HZ LYS 74 1HZ LYS 74 10.500 -5.382 -9.174 575 2HZ LYS 74 2HZ LYS 74 11.709 -4.845 -8.185 576 3HZ LYS 74 3HZ LYS 74 10.238 -4.091 -8.176 577 H ASN 75 H ASN 75 10.726 -4.999 -13.338 578 HA ASN 75 HA ASN 75 8.130 -5.941 -12.946 579 1HB ASN 75 1HB ASN 75 9.071 -8.165 -12.349 580 2HB ASN 75 2HB ASN 75 9.980 -7.411 -13.666 581 1HD2 ASN 75 1HD2 ASN 75 12.771 -8.396 -11.604 582 2HD2 ASN 75 2HD2 ASN 75 11.678 -8.869 -12.999 583 H GLU 76 H GLU 76 6.854 -6.659 -11.439 584 HA GLU 76 HA GLU 76 7.433 -5.896 -8.501 585 1HB GLU 76 1HB GLU 76 4.882 -5.410 -10.158 586 2HB GLU 76 2HB GLU 76 5.042 -5.153 -8.422 587 1HG GLU 76 1HG GLU 76 5.339 -2.989 -9.489 588 2HG GLU 76 2HG GLU 76 6.886 -3.476 -8.807 589 H ALA 77 H ALA 77 4.405 -6.864 -9.754 590 HA ALA 77 HA ALA 77 3.635 -8.590 -7.760 591 1HB ALA 77 2HB ALA 77 2.159 -8.049 -9.717 592 2HB ALA 77 3HB ALA 77 3.085 -9.176 -10.745 593 3HB ALA 77 1HB ALA 77 2.138 -9.796 -9.370 594 H ASP 78 H ASP 78 5.737 -9.484 -10.430 595 HA ASP 78 HA ASP 78 5.728 -12.379 -9.990 596 1HB ASP 78 1HB ASP 78 7.681 -12.399 -11.485 597 2HB ASP 78 2HB ASP 78 6.436 -11.307 -12.102 598 H ASN 79 H ASN 79 6.308 -10.677 -7.621 599 HA ASN 79 HA ASN 79 8.380 -12.439 -6.343 600 1HB ASN 79 1HB ASN 79 10.009 -10.633 -6.053 601 2HB ASN 79 2HB ASN 79 9.580 -10.722 -7.774 602 1HD2 ASN 79 1HD2 ASN 79 8.399 -7.436 -5.567 603 2HD2 ASN 79 2HD2 ASN 79 8.964 -8.986 -4.765 604 H GLY 80 H GLY 80 6.551 -12.871 -5.141 605 1HA GLY 80 1HA GLY 80 6.301 -11.203 -2.676 606 2HA GLY 80 2HA GLY 80 4.857 -11.087 -3.690 607 H LEU 81 H LEU 81 6.094 -14.092 -4.254 608 HA LEU 81 HA LEU 81 4.966 -16.173 -3.761 609 1HB LEU 81 1HB LEU 81 5.833 -17.091 -1.635 610 2HB LEU 81 2HB LEU 81 7.085 -16.323 -2.604 611 HG LEU 81 HG LEU 81 5.629 -14.825 -0.355 612 1HD1 LEU 81 2HD1 LEU 81 6.692 -16.886 0.608 613 2HD1 LEU 81 3HD1 LEU 81 8.242 -16.464 -0.165 614 3HD1 LEU 81 1HD1 LEU 81 7.575 -15.425 1.121 615 1HD2 LEU 81 3HD2 LEU 81 6.933 -13.417 -2.001 616 2HD2 LEU 81 1HD2 LEU 81 7.707 -13.397 -0.397 617 3HD2 LEU 81 2HD2 LEU 81 8.386 -14.403 -1.703 618 NH1 ARG 82 NH2 ARG 82 6.877 -17.981 0.791 619 NH2 ARG 82 NH1 ARG 82 6.572 -19.042 2.779 620 H ARG 82 H ARG 82 3.909 -17.477 -2.071 621 HA ARG 82 HA ARG 82 1.188 -16.570 -1.983 622 1HB ARG 82 1HB ARG 82 0.693 -18.610 -0.835 623 2HB ARG 82 2HB ARG 82 2.073 -18.971 -1.879 624 1HG ARG 82 1HG ARG 82 2.115 -18.336 1.138 625 2HG ARG 82 2HG ARG 82 2.431 -19.910 0.400 626 1HD ARG 82 1HD ARG 82 4.506 -18.965 -0.728 627 2HD ARG 82 2HD ARG 82 4.170 -17.376 -0.010 628 HE ARG 82 HE ARG 82 4.286 -19.381 2.134 629 1HH1 ARG 82 2HH2 ARG 82 6.463 -17.665 -0.093 630 2HH1 ARG 82 1HH2 ARG 82 7.847 -17.851 1.097 631 1HH2 ARG 82 1HH1 ARG 82 5.930 -19.534 3.410 632 2HH2 ARG 82 2HH1 ARG 82 7.563 -18.838 2.946 633 H ASN 83 H ASN 83 -0.223 -16.263 -0.332 634 HA ASN 83 HA ASN 83 0.250 -16.170 2.434 635 1HB ASN 83 1HB ASN 83 1.946 -14.338 1.806 636 2HB ASN 83 2HB ASN 83 0.570 -13.287 1.429 637 1HD2 ASN 83 1HD2 ASN 83 0.175 -14.621 5.279 638 2HD2 ASN 83 2HD2 ASN 83 0.019 -15.696 3.800 639 H THR 84 H THR 84 -1.149 -13.602 2.963 640 HA THR 84 HA THR 84 -3.935 -13.954 1.857 641 HB THR 84 HB THR 84 -2.897 -15.077 4.518 642 HG1 THR 84 HG1 THR 84 -3.965 -16.908 3.687 643 1HG2 THR 84 3HG2 THR 84 -5.811 -14.615 3.632 644 2HG2 THR 84 1HG2 THR 84 -5.307 -15.556 5.074 645 3HG2 THR 84 2HG2 THR 84 -4.976 -13.804 4.981 646 NH1 ARG 85 NH2 ARG 85 -6.104 -16.135 5.775 647 NH2 ARG 85 NH1 ARG 85 -6.984 -15.993 7.867 648 H ARG 85 H ARG 85 -5.498 -12.746 2.933 649 HA ARG 85 HA ARG 85 -5.083 -10.034 3.351 650 1HB ARG 85 1HB ARG 85 -7.119 -9.896 4.602 651 2HB ARG 85 2HB ARG 85 -7.339 -11.268 3.515 652 1HG ARG 85 1HG ARG 85 -6.508 -11.377 6.487 653 2HG ARG 85 2HG ARG 85 -8.114 -11.753 5.857 654 1HD ARG 85 1HD ARG 85 -7.134 -13.694 4.531 655 2HD ARG 85 2HD ARG 85 -5.529 -13.321 5.190 656 HE ARG 85 HE ARG 85 -7.354 -13.657 7.445 657 1HH1 ARG 85 2HH2 ARG 85 -5.865 -15.651 4.903 658 2HH1 ARG 85 1HH2 ARG 85 -5.961 -17.128 5.986 659 1HH2 ARG 85 1HH1 ARG 85 -7.412 -15.406 8.590 660 2HH2 ARG 85 2HH1 ARG 85 -6.778 -16.996 7.931 661 H GLY 86 H GLY 86 -3.478 -9.394 4.059 662 1HA GLY 86 1HA GLY 86 -2.793 -8.634 6.741 663 2HA GLY 86 2HA GLY 86 -2.097 -10.257 6.540 664 H THR 87 H THR 87 -1.870 -9.785 3.616 665 HA THR 87 HA THR 87 0.948 -8.648 3.672 666 HB THR 87 HB THR 87 0.988 -9.346 1.273 667 HG1 THR 87 HG1 THR 87 -0.799 -10.560 0.565 668 1HG2 THR 87 2HG2 THR 87 1.645 -10.950 3.089 669 2HG2 THR 87 3HG2 THR 87 -0.049 -11.491 3.238 670 3HG2 THR 87 1HG2 THR 87 0.862 -11.810 1.736 671 H ILE 88 H ILE 88 1.651 -7.002 2.687 672 HA ILE 88 HA ILE 88 -0.255 -5.037 1.283 673 HB ILE 88 HB ILE 88 0.723 -3.579 2.616 674 1HG1 ILE 88 1HG1 ILE 88 3.156 -2.880 1.631 675 2HG1 ILE 88 2HG1 ILE 88 2.698 -4.021 0.403 676 1HG2 ILE 88 3HG2 ILE 88 3.274 -5.274 2.862 677 2HG2 ILE 88 1HG2 ILE 88 2.979 -3.729 3.701 678 3HG2 ILE 88 2HG2 ILE 88 1.961 -5.140 4.069 679 1HD1 ILE 88 2HD1 ILE 88 0.482 -2.674 0.086 680 2HD1 ILE 88 3HD1 ILE 88 1.013 -1.581 1.388 681 3HD1 ILE 88 1HD1 ILE 88 1.913 -1.620 -0.146 682 H ALA 89 H ALA 89 0.495 -4.064 -0.545 683 HA ALA 89 HA ALA 89 2.492 -5.393 -2.326 684 1HB ALA 89 2HB ALA 89 0.656 -7.126 -2.444 685 2HB ALA 89 3HB ALA 89 -0.494 -5.875 -2.988 686 3HB ALA 89 1HB ALA 89 0.892 -6.320 -4.012 687 H MET 90 H MET 90 2.974 -4.374 -4.058 688 HA MET 90 HA MET 90 2.176 -1.516 -4.273 689 1HB MET 90 1HB MET 90 4.005 -3.162 -6.100 690 2HB MET 90 2HB MET 90 3.784 -1.406 -6.127 691 1HG MET 90 1HG MET 90 4.356 -1.507 -3.532 692 2HG MET 90 2HG MET 90 5.022 -3.109 -3.899 693 1HE MET 90 3HE MET 90 5.204 0.774 -4.441 694 2HE MET 90 2HE MET 90 6.424 0.959 -5.734 695 3HE MET 90 1HE MET 90 4.824 0.258 -6.111 696 H ALA 91 H ALA 91 1.142 -0.478 -5.752 697 HA ALA 91 HA ALA 91 -1.040 -1.814 -7.232 698 1HB ALA 91 2HB ALA 91 -1.256 0.510 -6.344 699 2HB ALA 91 3HB ALA 91 0.020 1.075 -7.455 700 3HB ALA 91 1HB ALA 91 -1.530 0.479 -8.103 701 NH1 ARG 92 NH2 ARG 92 -4.231 -2.346 -11.980 702 NH2 ARG 92 NH1 ARG 92 -5.171 -0.410 -12.711 703 H ARG 92 H ARG 92 0.104 0.454 -9.331 704 HA ARG 92 HA ARG 92 2.255 -0.837 -10.764 705 1HB ARG 92 1HB ARG 92 1.212 -2.077 -12.514 706 2HB ARG 92 2HB ARG 92 0.405 -2.630 -11.042 707 1HG ARG 92 1HG ARG 92 -0.604 -0.494 -13.030 708 2HG ARG 92 2HG ARG 92 -1.231 -2.138 -12.890 709 1HD ARG 92 1HD ARG 92 -2.031 -1.639 -10.520 710 2HD ARG 92 2HD ARG 92 -1.354 -0.021 -10.637 711 HE ARG 92 HE ARG 92 -3.149 0.703 -12.067 712 1HH1 ARG 92 2HH2 ARG 92 -3.417 -2.808 -11.562 713 2HH1 ARG 92 1HH2 ARG 92 -5.110 -2.791 -12.269 714 1HH2 ARG 92 1HH1 ARG 92 -5.076 0.602 -12.852 715 2HH2 ARG 92 2HH1 ARG 92 -5.983 -0.990 -12.950 716 H THR 93 H THR 93 0.536 -0.500 -13.289 717 HA THR 93 HA THR 93 -0.319 2.192 -13.714 718 HB THR 93 HB THR 93 1.733 3.156 -14.899 719 HG1 THR 93 HG1 THR 93 3.705 2.322 -14.162 720 1HG2 THR 93 1HG2 THR 93 0.982 4.007 -12.665 721 2HG2 THR 93 2HG2 THR 93 1.961 2.758 -11.851 722 3HG2 THR 93 3HG2 THR 93 2.760 4.040 -12.801 723 H ALA 94 H ALA 94 -0.666 2.747 -15.763 724 HA ALA 94 HA ALA 94 -1.550 0.803 -17.581 725 1HB ALA 94 2HB ALA 94 -1.978 3.261 -17.880 726 2HB ALA 94 3HB ALA 94 -0.283 3.510 -18.377 727 3HB ALA 94 1HB ALA 94 -1.378 2.536 -19.392 728 H ASP 95 H ASP 95 1.496 2.554 -17.968 729 HA ASP 95 HA ASP 95 2.699 1.243 -20.123 730 1HB ASP 95 1HB ASP 95 4.093 1.895 -17.454 731 2HB ASP 95 2HB ASP 95 4.925 1.606 -18.987 732 H LYS 96 H LYS 96 3.562 0.319 -16.850 733 HA LYS 96 HA LYS 96 2.979 -2.364 -16.522 734 1HB LYS 96 1HB LYS 96 5.316 -2.177 -18.522 735 2HB LYS 96 2HB LYS 96 4.726 -3.666 -17.762 736 1HG LYS 96 1HG LYS 96 2.462 -3.336 -18.818 737 2HG LYS 96 2HG LYS 96 2.979 -1.785 -19.455 738 1HD LYS 96 1HD LYS 96 3.028 -3.255 -21.293 739 2HD LYS 96 2HD LYS 96 4.709 -2.955 -20.929 740 1HE LYS 96 1HE LYS 96 3.169 -5.495 -20.007 741 2HE LYS 96 2HE LYS 96 3.995 -5.374 -21.557 742 1HZ LYS 96 2HZ LYS 96 6.093 -5.013 -20.388 743 2HZ LYS 96 3HZ LYS 96 5.345 -5.125 -18.920 744 3HZ LYS 96 1HZ LYS 96 5.396 -6.436 -19.923 745 H ASP 97 H ASP 97 6.275 -1.968 -17.346 746 HA ASP 97 HA ASP 97 7.317 -2.250 -14.600 747 1HB ASP 97 1HB ASP 97 8.665 -1.111 -17.124 748 2HB ASP 97 2HB ASP 97 9.504 -1.576 -15.634 749 H SER 98 H SER 98 6.665 -0.834 -13.212 750 HA SER 98 HA SER 98 7.808 1.907 -13.230 751 1HB SER 98 1HB SER 98 5.825 2.174 -14.790 752 2HB SER 98 2HB SER 98 4.745 1.639 -13.489 753 HG SER 98 HG SER 98 6.531 3.853 -13.408 754 H ALA 99 H ALA 99 4.719 1.639 -11.856 755 HA ALA 99 HA ALA 99 4.110 1.952 -9.568 756 1HB ALA 99 2HB ALA 99 4.166 -0.554 -9.654 757 2HB ALA 99 3HB ALA 99 5.902 -0.549 -9.241 758 3HB ALA 99 1HB ALA 99 4.699 0.031 -8.060 759 H THR 100 H THR 100 5.219 3.877 -9.695 760 HA THR 100 HA THR 100 8.057 4.140 -8.893 761 HB THR 100 HB THR 100 7.629 6.574 -9.065 762 HG1 THR 100 HG1 THR 100 4.940 5.727 -9.399 763 1HG2 THR 100 2HG2 THR 100 7.968 5.239 -11.171 764 2HG2 THR 100 3HG2 THR 100 6.213 4.935 -11.268 765 3HG2 THR 100 1HG2 THR 100 6.842 6.594 -11.450 766 H SER 101 H SER 101 4.954 4.859 -7.353 767 HA SER 101 HA SER 101 5.979 4.351 -4.629 768 1HB SER 101 1HB SER 101 5.851 6.684 -3.759 769 2HB SER 101 2HB SER 101 7.097 6.555 -5.015 770 HG SER 101 HG SER 101 5.729 8.347 -5.302 771 H GLN 102 H GLN 102 4.308 3.158 -4.350 772 HA GLN 102 HA GLN 102 1.925 4.169 -3.185 773 1HB GLN 102 1HB GLN 102 1.392 5.176 -5.417 774 2HB GLN 102 2HB GLN 102 1.480 3.579 -6.179 775 1HG GLN 102 1HG GLN 102 -0.368 2.756 -4.661 776 2HG GLN 102 2HG GLN 102 -0.456 4.347 -3.898 777 1HE2 GLN 102 2HE2 GLN 102 -1.631 5.869 -7.114 778 2HE2 GLN 102 1HE2 GLN 102 -0.212 6.071 -5.968 779 H PHE 103 H PHE 103 1.212 2.684 -2.069 780 HA PHE 103 HA PHE 103 1.042 -0.193 -3.076 781 1HB PHE 103 1HB PHE 103 2.025 -1.127 -1.113 782 2HB PHE 103 2HB PHE 103 3.177 0.033 -1.767 783 HD1 PHE 103 HD1 PHE 103 0.948 2.229 -0.506 784 HD2 PHE 103 HD2 PHE 103 3.528 -0.792 0.910 785 HE1 PHE 103 HE1 PHE 103 0.959 3.265 1.694 786 HE2 PHE 103 HE2 PHE 103 3.537 0.245 3.106 787 HZ PHE 103 HZ PHE 103 2.232 2.253 3.507 788 H PHE 104 H PHE 104 -0.066 -1.515 -1.320 789 HA PHE 104 HA PHE 104 -2.398 -0.084 -0.024 790 1HB PHE 104 1HB PHE 104 -4.105 -1.135 -1.449 791 2HB PHE 104 2HB PHE 104 -3.044 -0.130 -2.436 792 HD1 PHE 104 HD1 PHE 104 -3.639 -3.622 -1.346 793 HD2 PHE 104 HD2 PHE 104 -1.760 -1.125 -4.178 794 HE1 PHE 104 HE1 PHE 104 -3.122 -5.563 -2.716 795 HE2 PHE 104 HE2 PHE 104 -1.245 -3.068 -5.546 796 HZ PHE 104 HZ PHE 104 -1.929 -5.287 -4.818 797 H ILE 105 H ILE 105 -3.295 -1.062 1.429 798 HA ILE 105 HA ILE 105 -2.116 -3.727 2.355 799 HB ILE 105 HB ILE 105 -3.847 -1.678 3.839 800 1HG1 ILE 105 1HG1 ILE 105 -0.806 -2.173 3.805 801 2HG1 ILE 105 2HG1 ILE 105 -1.626 -0.777 3.096 802 1HG2 ILE 105 2HG2 ILE 105 -3.964 -4.017 4.756 803 2HG2 ILE 105 3HG2 ILE 105 -2.184 -4.102 4.796 804 3HG2 ILE 105 1HG2 ILE 105 -3.045 -2.954 5.857 805 1HD1 ILE 105 3HD1 ILE 105 -1.693 -1.535 6.098 806 2HD1 ILE 105 1HD1 ILE 105 -0.736 -0.213 5.380 807 3HD1 ILE 105 2HD1 ILE 105 -2.517 -0.125 5.379 808 H ASN 106 H ASN 106 -3.079 -5.432 1.842 809 HA ASN 106 HA ASN 106 -6.015 -5.675 1.241 810 1HB ASN 106 1HB ASN 106 -3.870 -7.835 1.705 811 2HB ASN 106 2HB ASN 106 -5.498 -8.110 1.066 812 1HD2 ASN 106 1HD2 ASN 106 -3.248 -7.785 -1.884 813 2HD2 ASN 106 2HD2 ASN 106 -3.472 -8.902 -0.446 814 H VAL 107 H VAL 107 -6.938 -7.767 2.346 815 HA VAL 107 HA VAL 107 -6.301 -8.070 5.271 816 HB VAL 107 HB VAL 107 -8.551 -7.467 6.064 817 1HG1 VAL 107 3HG2 VAL 107 -6.757 -5.711 6.056 818 2HG1 VAL 107 1HG2 VAL 107 -7.236 -5.213 4.413 819 3HG1 VAL 107 2HG2 VAL 107 -8.358 -4.979 5.778 820 1HG2 VAL 107 2HG1 VAL 107 -9.831 -7.955 3.963 821 2HG2 VAL 107 3HG1 VAL 107 -10.172 -6.301 4.536 822 3HG2 VAL 107 1HG1 VAL 107 -9.068 -6.560 3.158 823 H ALA 108 H ALA 108 -8.547 -8.737 2.639 824 HA ALA 108 HA ALA 108 -9.385 -11.375 3.888 825 1HB ALA 108 2HB ALA 108 -11.121 -9.876 2.885 826 2HB ALA 108 3HB ALA 108 -10.317 -9.986 1.297 827 3HB ALA 108 1HB ALA 108 -11.045 -11.437 2.033 828 H ASP 109 H ASP 109 -9.294 -13.270 2.942 829 HA ASP 109 HA ASP 109 -6.859 -14.180 1.721 830 1HB ASP 109 1HB ASP 109 -9.685 -15.359 1.382 831 2HB ASP 109 2HB ASP 109 -8.171 -16.218 1.055 832 H ASN 110 H ASN 110 -6.067 -13.308 0.033 833 HA ASN 110 HA ASN 110 -7.778 -12.644 -2.419 834 1HB ASN 110 1HB ASN 110 -6.320 -10.860 -1.437 835 2HB ASN 110 2HB ASN 110 -4.889 -11.870 -1.714 836 1HD2 ASN 110 1HD2 ASN 110 -6.896 -11.031 -5.221 837 2HD2 ASN 110 2HD2 ASN 110 -7.702 -11.857 -3.793 838 H ALA 111 H ALA 111 -4.429 -13.167 -2.829 839 HA ALA 111 HA ALA 111 -3.191 -14.878 -3.960 840 1HB ALA 111 2HB ALA 111 -4.362 -16.569 -2.521 841 2HB ALA 111 3HB ALA 111 -5.752 -16.578 -3.640 842 3HB ALA 111 1HB ALA 111 -4.163 -17.178 -4.184 843 H PHE 112 H PHE 112 -6.564 -14.537 -4.888 844 HA PHE 112 HA PHE 112 -6.704 -15.469 -7.495 845 1HB PHE 112 1HB PHE 112 -7.697 -12.643 -6.798 846 2HB PHE 112 2HB PHE 112 -8.375 -13.744 -7.999 847 HD1 PHE 112 HD1 PHE 112 -9.149 -16.078 -7.052 848 HD2 PHE 112 HD2 PHE 112 -8.538 -12.676 -4.632 849 HE1 PHE 112 HE1 PHE 112 -10.529 -17.064 -5.310 850 HE2 PHE 112 HE2 PHE 112 -9.917 -13.665 -2.895 851 HZ PHE 112 HZ PHE 112 -10.904 -15.857 -3.225 852 H LEU 113 H LEU 113 -5.492 -12.297 -6.576 853 HA LEU 113 HA LEU 113 -4.689 -11.346 -9.204 854 1HB LEU 113 1HB LEU 113 -3.619 -10.711 -6.392 855 2HB LEU 113 2HB LEU 113 -3.019 -9.908 -7.842 856 HG LEU 113 HG LEU 113 -5.271 -9.081 -8.420 857 1HD1 LEU 113 3HD1 LEU 113 -6.200 -10.427 -5.802 858 2HD1 LEU 113 1HD1 LEU 113 -7.181 -9.326 -6.804 859 3HD1 LEU 113 2HD1 LEU 113 -6.679 -10.908 -7.450 860 1HD2 LEU 113 3HD2 LEU 113 -3.787 -7.706 -6.926 861 2HD2 LEU 113 1HD2 LEU 113 -5.504 -7.458 -6.513 862 3HD2 LEU 113 2HD2 LEU 113 -4.482 -8.499 -5.488 863 H ASP 114 H ASP 114 -3.223 -13.632 -7.045 864 HA ASP 114 HA ASP 114 -0.483 -13.577 -7.503 865 1HB ASP 114 1HB ASP 114 -2.223 -16.101 -7.777 866 2HB ASP 114 2HB ASP 114 -0.477 -16.087 -7.469 867 H HIS 115 H HIS 115 0.307 -12.813 -9.231 868 HA HIS 115 HA HIS 115 -0.257 -13.096 -11.989 869 1HB HIS 115 1HB HIS 115 1.595 -11.705 -11.316 870 2HB HIS 115 2HB HIS 115 2.418 -13.025 -10.484 871 HD2 HIS 115 HD2 HIS 115 4.619 -13.087 -11.829 872 HE1 HIS 115 HE1 HIS 115 3.079 -13.888 -15.610 873 HE2 HIS 115 HE2 HIS 115 5.302 -13.726 -14.309 874 H GLY 116 H GLY 116 -0.993 -14.781 -12.837 875 1HA GLY 116 1HA GLY 116 0.665 -17.071 -13.601 876 2HA GLY 116 2HA GLY 116 -0.362 -17.573 -12.239 877 H GLN 117 H GLN 117 -0.524 -15.745 -15.242 878 HA GLN 117 HA GLN 117 -2.332 -17.268 -16.789 879 1HB GLN 117 1HB GLN 117 -3.875 -15.474 -14.818 880 2HB GLN 117 2HB GLN 117 -4.563 -16.018 -16.348 881 1HG GLN 117 1HG GLN 117 -3.550 -17.869 -14.113 882 2HG GLN 117 2HG GLN 117 -5.242 -17.528 -14.489 883 1HE2 GLN 117 2HE2 GLN 117 -3.543 -20.565 -16.417 884 2HE2 GLN 117 1HE2 GLN 117 -2.998 -19.811 -14.836 885 NH1 ARG 118 NH2 ARG 118 -7.024 -15.736 -24.121 886 NH2 ARG 118 NH1 ARG 118 -8.424 -16.220 -22.397 887 H ARG 118 H ARG 118 -3.824 -15.846 -18.168 888 HA ARG 118 HA ARG 118 -2.171 -13.838 -19.567 889 1HB ARG 118 1HB ARG 118 -5.218 -14.250 -19.681 890 2HB ARG 118 2HB ARG 118 -4.252 -13.292 -20.813 891 1HG ARG 118 1HG ARG 118 -2.855 -15.394 -21.285 892 2HG ARG 118 2HG ARG 118 -3.975 -16.333 -20.312 893 1HD ARG 118 1HD ARG 118 -4.708 -14.739 -22.868 894 2HD ARG 118 2HD ARG 118 -4.374 -16.470 -22.821 895 HE ARG 118 HE ARG 118 -6.512 -16.120 -20.947 896 1HH1 ARG 118 2HH2 ARG 118 -6.066 -15.532 -24.427 897 2HH1 ARG 118 1HH2 ARG 118 -7.860 -15.784 -24.713 898 1HH2 ARG 118 1HH1 ARG 118 -8.537 -16.386 -21.391 899 2HH2 ARG 118 2HH1 ARG 118 -9.162 -16.234 -23.109 900 H ASP 119 H ASP 119 -1.679 -12.853 -17.448 901 HA ASP 119 HA ASP 119 -2.863 -10.198 -17.225 902 1HB ASP 119 1HB ASP 119 -4.111 -10.411 -15.099 903 2HB ASP 119 2HB ASP 119 -4.832 -11.438 -16.346 904 H PHE 120 H PHE 120 -2.216 -9.021 -15.396 905 HA PHE 120 HA PHE 120 -0.243 -9.734 -13.421 906 1HB PHE 120 1HB PHE 120 1.023 -10.535 -15.489 907 2HB PHE 120 2HB PHE 120 1.040 -8.880 -16.097 908 HD1 PHE 120 HD1 PHE 120 1.281 -8.072 -12.881 909 HD2 PHE 120 HD2 PHE 120 3.512 -10.297 -15.684 910 HE1 PHE 120 HE1 PHE 120 3.307 -7.647 -11.609 911 HE2 PHE 120 HE2 PHE 120 5.535 -9.878 -14.405 912 HZ PHE 120 HZ PHE 120 5.434 -8.552 -12.368 913 H GLY 121 H GLY 121 -0.440 -8.153 -12.141 914 1HA GLY 121 1HA GLY 121 -0.351 -5.244 -13.047 915 2HA GLY 121 2HA GLY 121 -1.889 -5.814 -12.385 916 OH TYR 122 OH TYR 122 -6.674 -4.210 -10.115 917 H TYR 122 H TYR 122 -1.842 -6.754 -10.251 918 HA TYR 122 HA TYR 122 -0.657 -4.709 -8.504 919 1HB TYR 122 1HB TYR 122 -2.103 -7.240 -7.551 920 2HB TYR 122 2HB TYR 122 -1.932 -5.710 -6.704 921 HD1 TYR 122 HD1 TYR 122 -2.786 -3.605 -8.025 922 HD2 TYR 122 HD2 TYR 122 -4.035 -7.557 -8.826 923 HE1 TYR 122 HE1 TYR 122 -4.809 -2.757 -9.075 924 HE2 TYR 122 HE2 TYR 122 -6.056 -6.705 -9.873 925 HH TYR 122 HH TYR 122 -7.203 -4.951 -10.419 926 H ALA 123 H ALA 123 1.152 -4.647 -7.678 927 HA ALA 123 HA ALA 123 3.053 -6.928 -7.468 928 1HB ALA 123 2HB ALA 123 3.832 -4.586 -7.848 929 2HB ALA 123 3HB ALA 123 3.201 -4.099 -6.250 930 3HB ALA 123 1HB ALA 123 4.545 -5.267 -6.365 931 H VAL 124 H VAL 124 4.177 -6.200 -5.008 932 HA VAL 124 HA VAL 124 2.629 -6.705 -2.667 933 HB VAL 124 HB VAL 124 3.473 -9.334 -4.042 934 1HG1 VAL 124 3HG2 VAL 124 4.027 -9.329 -1.596 935 2HG1 VAL 124 1HG2 VAL 124 2.358 -8.843 -1.205 936 3HG1 VAL 124 2HG2 VAL 124 2.675 -10.440 -1.935 937 1HG2 VAL 124 1HG1 VAL 124 0.694 -8.343 -3.124 938 2HG2 VAL 124 2HG1 VAL 124 1.236 -8.507 -4.815 939 3HG2 VAL 124 3HG1 VAL 124 1.050 -9.957 -3.797 940 H PHE 125 H PHE 125 3.951 -6.654 -0.946 941 HA PHE 125 HA PHE 125 6.494 -8.115 -0.857 942 1HB PHE 125 1HB PHE 125 8.129 -6.388 -1.083 943 2HB PHE 125 2HB PHE 125 7.051 -6.159 -2.460 944 HD1 PHE 125 HD2 PHE 125 5.260 -4.357 -2.271 945 HD2 PHE 125 HD1 PHE 125 8.271 -4.789 0.653 946 HE1 PHE 125 HE2 PHE 125 4.720 -2.158 -1.383 947 HE2 PHE 125 HE1 PHE 125 7.729 -2.593 1.536 948 HZ PHE 125 HZ PHE 125 5.942 -1.289 0.540 949 H GLY 126 H GLY 126 4.034 -7.314 0.745 950 1HA GLY 126 1HA GLY 126 5.532 -7.109 3.393 951 2HA GLY 126 2HA GLY 126 4.407 -5.807 2.998 952 H LYS 127 H LYS 127 3.005 -6.051 4.351 953 HA LYS 127 HA LYS 127 1.059 -8.090 4.724 954 1HB LYS 127 1HB LYS 127 3.424 -8.519 6.646 955 2HB LYS 127 2HB LYS 127 1.910 -9.440 6.643 956 1HG LYS 127 1HG LYS 127 2.385 -10.298 4.340 957 2HG LYS 127 2HG LYS 127 3.760 -9.218 4.200 958 1HD LYS 127 1HD LYS 127 4.676 -11.361 4.555 959 2HD LYS 127 2HD LYS 127 4.982 -10.488 6.036 960 1HE LYS 127 1HE LYS 127 2.634 -12.494 5.669 961 2HE LYS 127 2HE LYS 127 4.242 -12.973 6.201 962 1HZ LYS 127 1HZ LYS 127 4.012 -11.522 8.135 963 2HZ LYS 127 2HZ LYS 127 2.497 -11.061 7.663 964 3HZ LYS 127 3HZ LYS 127 2.791 -12.633 8.081 965 H VAL 128 H VAL 128 0.991 -8.341 7.513 966 HA VAL 128 HA VAL 128 0.938 -5.594 8.763 967 HB VAL 128 HB VAL 128 -1.660 -7.089 8.062 968 1HG1 VAL 128 3HG2 VAL 128 -1.711 -5.979 10.315 969 2HG1 VAL 128 1HG2 VAL 128 -1.161 -4.448 9.587 970 3HG1 VAL 128 2HG2 VAL 128 -2.761 -5.113 9.162 971 1HG2 VAL 128 3HG1 VAL 128 -0.649 -5.878 6.104 972 2HG2 VAL 128 1HG1 VAL 128 -2.129 -5.053 6.659 973 3HG2 VAL 128 2HG1 VAL 128 -0.527 -4.388 7.074 974 H VAL 129 H VAL 129 1.578 -5.869 10.606 975 HA VAL 129 HA VAL 129 1.419 -8.507 12.051 976 HB VAL 129 HB VAL 129 2.636 -5.817 12.879 977 1HG1 VAL 129 3HG2 VAL 129 2.056 -7.304 14.821 978 2HG1 VAL 129 1HG2 VAL 129 2.920 -8.662 14.053 979 3HG1 VAL 129 2HG2 VAL 129 3.823 -7.222 14.595 980 1HG2 VAL 129 2HG1 VAL 129 3.687 -6.813 10.824 981 2HG2 VAL 129 3HG1 VAL 129 4.793 -6.929 12.218 982 3HG2 VAL 129 1HG1 VAL 129 3.893 -8.369 11.670 983 H LYS 130 H LYS 130 0.946 -5.244 13.273 984 HA LYS 130 HA LYS 130 -0.959 -6.328 15.355 985 1HB LYS 130 1HB LYS 130 1.030 -4.936 15.935 986 2HB LYS 130 2HB LYS 130 0.352 -3.579 15.018 987 1HG LYS 130 1HG LYS 130 -1.722 -3.642 16.469 988 2HG LYS 130 2HG LYS 130 -1.053 -5.003 17.369 989 1HD LYS 130 1HD LYS 130 0.904 -3.528 18.114 990 2HD LYS 130 2HD LYS 130 0.213 -2.192 17.208 991 1HE LYS 130 1HE LYS 130 -0.390 -1.816 19.498 992 2HE LYS 130 2HE LYS 130 -1.879 -2.279 18.678 993 1HZ LYS 130 2HZ LYS 130 -0.188 -4.088 20.349 994 2HZ LYS 130 3HZ LYS 130 -1.630 -3.418 20.798 995 3HZ LYS 130 1HZ LYS 130 -1.583 -4.542 19.588 996 H GLY 131 H GLY 131 -1.010 -3.049 14.488 997 1HA GLY 131 1HA GLY 131 -3.785 -2.779 14.972 998 2HA GLY 131 2HA GLY 131 -2.832 -1.554 14.142 999 H MET 132 H MET 132 -3.897 -4.815 13.240 1000 HA MET 132 HA MET 132 -4.773 -4.101 10.511 1001 1HB MET 132 1HB MET 132 -4.305 -6.472 11.355 1002 2HB MET 132 2HB MET 132 -5.823 -6.404 12.263 1003 1HG MET 132 1HG MET 132 -6.183 -7.481 10.045 1004 2HG MET 132 2HG MET 132 -7.071 -5.939 10.098 1005 1HE MET 132 3HE MET 132 -7.100 -6.190 7.310 1006 2HE MET 132 2HE MET 132 -5.599 -6.262 6.342 1007 3HE MET 132 1HE MET 132 -6.050 -7.641 7.385 1008 H ASP 133 H ASP 133 -6.394 -4.578 13.611 1009 HA ASP 133 HA ASP 133 -9.106 -3.970 13.035 1010 1HB ASP 133 1HB ASP 133 -8.213 -4.523 15.311 1011 2HB ASP 133 2HB ASP 133 -7.435 -2.933 15.405 1012 H VAL 134 H VAL 134 -6.608 -1.635 13.978 1013 HA VAL 134 HA VAL 134 -7.906 0.850 13.594 1014 HB VAL 134 HB VAL 134 -5.077 0.018 12.736 1015 1HG1 VAL 134 1HG2 VAL 134 -6.291 2.852 12.929 1016 2HG1 VAL 134 2HG2 VAL 134 -4.566 2.475 12.665 1017 3HG1 VAL 134 3HG2 VAL 134 -5.770 2.031 11.431 1018 1HG2 VAL 134 2HG1 VAL 134 -5.616 -0.127 15.194 1019 2HG2 VAL 134 3HG1 VAL 134 -4.465 1.199 14.874 1020 3HG2 VAL 134 1HG1 VAL 134 -6.184 1.564 15.174 1021 H ALA 135 H ALA 135 -6.128 -0.915 11.101 1022 HA ALA 135 HA ALA 135 -6.916 0.540 8.763 1023 1HB ALA 135 2HB ALA 135 -5.316 -1.396 8.703 1024 2HB ALA 135 3HB ALA 135 -6.654 -2.530 9.032 1025 3HB ALA 135 1HB ALA 135 -6.615 -1.612 7.503 1026 H ASP 136 H ASP 136 -8.521 -2.196 10.311 1027 HA ASP 136 HA ASP 136 -10.878 -2.419 8.670 1028 1HB ASP 136 1HB ASP 136 -10.665 -2.734 11.727 1029 2HB ASP 136 2HB ASP 136 -11.993 -3.344 10.725 1030 H LYS 137 H LYS 137 -10.765 -0.912 11.855 1031 HA LYS 137 HA LYS 137 -13.185 0.521 11.854 1032 1HB LYS 137 1HB LYS 137 -11.582 0.502 13.760 1033 2HB LYS 137 2HB LYS 137 -10.499 1.601 12.883 1034 1HG LYS 137 1HG LYS 137 -12.284 3.351 12.780 1035 2HG LYS 137 2HG LYS 137 -13.456 2.220 13.426 1036 1HD LYS 137 1HD LYS 137 -12.951 3.677 15.206 1037 2HD LYS 137 2HD LYS 137 -12.204 2.162 15.649 1038 1HE LYS 137 1HE LYS 137 -10.661 4.543 14.376 1039 2HE LYS 137 2HE LYS 137 -10.895 4.357 16.110 1040 1HZ LYS 137 2HZ LYS 137 -9.699 2.246 16.025 1041 2HZ LYS 137 3HZ LYS 137 -9.460 2.397 14.398 1042 3HZ LYS 137 1HZ LYS 137 -8.766 3.477 15.439 1043 H ILE 138 H ILE 138 -10.114 1.552 10.447 1044 HA ILE 138 HA ILE 138 -10.978 4.105 9.297 1045 HB ILE 138 HB ILE 138 -8.962 2.056 8.200 1046 1HG1 ILE 138 1HG1 ILE 138 -8.783 4.528 10.018 1047 2HG1 ILE 138 2HG1 ILE 138 -8.326 2.872 10.430 1048 1HG2 ILE 138 2HG2 ILE 138 -9.812 3.644 6.443 1049 2HG2 ILE 138 3HG2 ILE 138 -9.446 5.029 7.508 1050 3HG2 ILE 138 1HG2 ILE 138 -8.121 4.016 6.873 1051 1HD1 ILE 138 2HD1 ILE 138 -6.480 2.965 8.666 1052 2HD1 ILE 138 3HD1 ILE 138 -6.959 4.638 8.277 1053 3HD1 ILE 138 1HD1 ILE 138 -6.290 4.258 9.884 1054 H SER 139 H SER 139 -10.662 0.888 7.862 1055 HA SER 139 HA SER 139 -12.326 1.431 5.505 1056 1HB SER 139 1HB SER 139 -12.268 -1.042 5.182 1057 2HB SER 139 2HB SER 139 -10.662 -0.391 5.551 1058 HG SER 139 HG SER 139 -11.178 -2.234 6.771 1059 H GLN 140 H GLN 140 -13.355 1.635 8.453 1060 HA GLN 140 HA GLN 140 -16.038 0.202 8.075 1061 1HB GLN 140 1HB GLN 140 -15.067 1.811 10.508 1062 2HB GLN 140 2HB GLN 140 -16.508 0.792 10.381 1063 1HG GLN 140 1HG GLN 140 -13.571 -0.060 10.407 1064 2HG GLN 140 2HG GLN 140 -14.892 -0.656 11.420 1065 1HE2 GLN 140 2HE2 GLN 140 -14.146 -2.268 7.715 1066 2HE2 GLN 140 1HE2 GLN 140 -13.085 -1.095 8.626 1067 H VAL 141 H VAL 141 -14.694 3.370 8.867 1068 HA VAL 141 HA VAL 141 -17.102 4.955 8.768 1069 HB VAL 141 HB VAL 141 -15.631 6.876 8.218 1070 1HG1 VAL 141 3HG2 VAL 141 -15.712 5.991 10.566 1071 2HG1 VAL 141 1HG2 VAL 141 -14.375 4.870 10.204 1072 3HG1 VAL 141 2HG2 VAL 141 -14.090 6.631 10.192 1073 1HG2 VAL 141 2HG1 VAL 141 -14.193 5.731 6.503 1074 2HG2 VAL 141 3HG1 VAL 141 -13.186 6.476 7.772 1075 3HG2 VAL 141 1HG1 VAL 141 -13.466 4.714 7.774 1076 HA PRO 142 HA PRO 142 -18.754 4.335 4.714 1077 1HB PRO 142 1HB PRO 142 -19.605 7.178 5.472 1078 2HB PRO 142 2HB PRO 142 -20.603 5.895 4.744 1079 1HG PRO 142 1HG PRO 142 -20.822 6.335 7.411 1080 2HG PRO 142 2HG PRO 142 -20.678 4.653 6.843 1081 1HD PRO 142 1HD PRO 142 -18.487 6.401 8.081 1082 2HD PRO 142 2HD PRO 142 -18.817 4.657 8.345 1083 H THR 143 H THR 143 -19.053 5.808 2.800 1084 HA THR 143 HA THR 143 -16.884 7.828 2.230 1085 HB THR 143 HB THR 143 -16.157 6.405 0.181 1086 HG1 THR 143 HG1 THR 143 -16.319 4.173 0.551 1087 1HG2 THR 143 2HG2 THR 143 -14.678 6.879 2.103 1088 2HG2 THR 143 3HG2 THR 143 -15.345 5.473 2.991 1089 3HG2 THR 143 1HG2 THR 143 -14.408 5.228 1.478 1090 H HIS 144 H HIS 144 -16.764 6.837 -0.378 1091 HA HIS 144 HA HIS 144 -19.276 6.662 -1.767 1092 1HB HIS 144 1HB HIS 144 -19.739 8.899 -2.615 1093 2HB HIS 144 2HB HIS 144 -19.745 8.937 -0.854 1094 HD2 HIS 144 HD2 HIS 144 -16.153 8.811 -2.027 1095 HE1 HIS 144 HE1 HIS 144 -17.001 12.869 -1.787 1096 HE2 HIS 144 HE2 HIS 144 -15.053 11.217 -2.057 1097 H ASP 145 H ASP 145 -19.197 6.451 -3.811 1098 HA ASP 145 HA ASP 145 -16.618 6.110 -5.272 1099 1HB ASP 145 1HB ASP 145 -18.692 4.864 -5.910 1100 2HB ASP 145 2HB ASP 145 -19.501 6.398 -6.301 1101 H VAL 146 H VAL 146 -15.477 7.587 -5.968 1102 HA VAL 146 HA VAL 146 -16.199 10.425 -5.551 1103 HB VAL 146 HB VAL 146 -13.680 9.722 -7.047 1104 1HG1 VAL 146 3HG2 VAL 146 -14.297 12.079 -6.375 1105 2HG1 VAL 146 1HG2 VAL 146 -14.418 11.561 -4.674 1106 3HG1 VAL 146 2HG2 VAL 146 -12.838 11.531 -5.499 1107 1HG2 VAL 146 1HG1 VAL 146 -14.102 9.095 -4.055 1108 2HG2 VAL 146 2HG1 VAL 146 -13.790 7.896 -5.340 1109 3HG2 VAL 146 3HG1 VAL 146 -12.538 9.089 -4.915 1110 H GLY 147 H GLY 147 -14.827 8.825 -8.201 1111 1HA GLY 147 1HA GLY 147 -16.757 9.498 -10.315 1112 2HA GLY 147 2HA GLY 147 -15.489 10.751 -10.332 1113 HA PRO 148 HA PRO 148 -12.676 8.010 -12.498 1114 1HB PRO 148 1HB PRO 148 -10.297 8.937 -11.455 1115 2HB PRO 148 2HB PRO 148 -11.317 9.953 -12.502 1116 1HG PRO 148 1HG PRO 148 -11.235 9.943 -9.435 1117 2HG PRO 148 2HG PRO 148 -11.091 11.353 -10.514 1118 1HD PRO 148 1HD PRO 148 -13.516 10.653 -9.359 1119 2HD PRO 148 2HD PRO 148 -13.465 11.316 -11.024 1120 OH TYR 149 OH TYR 149 -5.311 7.550 -10.276 1121 H TYR 149 H TYR 149 -11.296 8.583 -9.309 1122 HA TYR 149 HA TYR 149 -10.799 5.671 -8.808 1123 1HB TYR 149 1HB TYR 149 -10.400 8.158 -7.043 1124 2HB TYR 149 2HB TYR 149 -9.935 6.518 -6.580 1125 HD1 TYR 149 HD1 TYR 149 -8.766 5.235 -8.682 1126 HD2 TYR 149 HD2 TYR 149 -8.605 9.380 -7.898 1127 HE1 TYR 149 HE1 TYR 149 -6.678 5.388 -9.913 1128 HE2 TYR 149 HE2 TYR 149 -6.517 9.531 -9.130 1129 HH TYR 149 HH TYR 149 -5.004 8.460 -10.262 1130 H GLN 150 H GLN 150 -12.513 4.560 -8.598 1131 HA GLN 150 HA GLN 150 -14.887 5.237 -6.914 1132 1HB GLN 150 1HB GLN 150 -13.844 2.511 -7.899 1133 2HB GLN 150 2HB GLN 150 -15.423 2.805 -7.156 1134 1HG GLN 150 1HG GLN 150 -15.991 4.445 -8.991 1135 2HG GLN 150 2HG GLN 150 -14.416 4.162 -9.739 1136 1HE2 GLN 150 2HE2 GLN 150 -15.272 0.720 -10.703 1137 2HE2 GLN 150 1HE2 GLN 150 -13.920 1.695 -9.936 1138 H ASN 151 H ASN 151 -15.189 4.942 -4.894 1139 HA ASN 151 HA ASN 151 -14.871 4.176 -2.630 1140 1HB ASN 151 1HB ASN 151 -12.414 2.683 -3.725 1141 2HB ASN 151 2HB ASN 151 -13.068 2.537 -2.087 1142 1HD2 ASN 151 1HD2 ASN 151 -16.284 1.313 -3.883 1143 2HD2 ASN 151 2HD2 ASN 151 -15.832 2.961 -3.212 1144 H VAL 152 H VAL 152 -14.641 6.148 -2.014 1145 HA VAL 152 HA VAL 152 -11.918 6.864 -0.924 1146 HB VAL 152 HB VAL 152 -13.447 8.702 -2.857 1147 1HG1 VAL 152 1HG2 VAL 152 -11.022 9.301 -1.034 1148 2HG1 VAL 152 2HG2 VAL 152 -11.688 10.403 -2.269 1149 3HG1 VAL 152 3HG2 VAL 152 -12.662 9.973 -0.840 1150 1HG2 VAL 152 1HG1 VAL 152 -10.588 7.508 -2.850 1151 2HG2 VAL 152 2HG1 VAL 152 -11.924 6.990 -3.910 1152 3HG2 VAL 152 3HG1 VAL 152 -11.232 8.625 -4.082 1153 HA PRO 153 HA PRO 153 -14.526 7.618 2.515 1154 1HB PRO 153 1HB PRO 153 -12.499 8.702 4.083 1155 2HB PRO 153 2HB PRO 153 -12.601 6.969 3.689 1156 1HG PRO 153 1HG PRO 153 -10.920 9.102 2.266 1157 2HG PRO 153 2HG PRO 153 -10.372 7.520 2.877 1158 1HD PRO 153 1HD PRO 153 -11.043 7.854 0.220 1159 2HD PRO 153 2HD PRO 153 -11.493 6.335 1.062 1160 H SER 154 H SER 154 -15.916 9.056 1.904 1161 HA SER 154 HA SER 154 -15.685 11.659 0.831 1162 1HB SER 154 1HB SER 154 -17.626 10.818 3.075 1163 2HB SER 154 2HB SER 154 -17.836 12.208 1.992 1164 HG SER 154 HG SER 154 -17.790 10.743 0.237 1165 H LYS 155 H LYS 155 -15.944 10.851 4.252 1166 HA LYS 155 HA LYS 155 -14.619 13.429 5.172 1167 1HB LYS 155 1HB LYS 155 -15.501 10.935 6.737 1168 2HB LYS 155 2HB LYS 155 -14.973 12.477 7.435 1169 1HG LYS 155 1HG LYS 155 -16.853 13.658 6.208 1170 2HG LYS 155 2HG LYS 155 -17.377 12.117 5.530 1171 1HD LYS 155 1HD LYS 155 -17.803 11.240 7.877 1172 2HD LYS 155 2HD LYS 155 -17.329 12.789 8.557 1173 1HE LYS 155 1HE LYS 155 -19.712 12.367 6.615 1174 2HE LYS 155 2HE LYS 155 -19.844 12.405 8.371 1175 1HZ LYS 155 3HZ LYS 155 -19.028 14.698 8.352 1176 2HZ LYS 155 1HZ LYS 155 -18.894 14.682 6.705 1177 3HZ LYS 155 2HZ LYS 155 -20.380 14.548 7.415 1178 HA PRO 156 HA PRO 156 -11.166 10.872 3.749 1179 1HB PRO 156 1HB PRO 156 -9.930 13.653 4.056 1180 2HB PRO 156 2HB PRO 156 -9.716 12.497 2.718 1181 1HG PRO 156 1HG PRO 156 -11.445 14.557 2.376 1182 2HG PRO 156 2HG PRO 156 -11.971 12.926 1.886 1183 1HD PRO 156 1HD PRO 156 -12.717 14.442 4.444 1184 2HD PRO 156 2HD PRO 156 -13.761 13.434 3.391 1185 H VAL 157 H VAL 157 -9.599 9.869 4.611 1186 HA VAL 157 HA VAL 157 -8.722 10.210 7.460 1187 HB VAL 157 HB VAL 157 -7.555 8.547 5.151 1188 1HG1 VAL 157 1HG2 VAL 157 -7.053 8.419 8.196 1189 2HG1 VAL 157 2HG2 VAL 157 -6.413 7.268 6.993 1190 3HG1 VAL 157 3HG2 VAL 157 -5.883 8.969 6.969 1191 1HG2 VAL 157 2HG1 VAL 157 -9.910 7.894 5.751 1192 2HG2 VAL 157 3HG1 VAL 157 -8.749 6.640 6.259 1193 3HG2 VAL 157 1HG1 VAL 157 -9.439 7.752 7.468 1194 H VAL 158 H VAL 158 -6.562 10.557 8.038 1195 HA VAL 158 HA VAL 158 -4.665 11.882 6.099 1196 HB VAL 158 HB VAL 158 -5.650 13.333 8.627 1197 1HG1 VAL 158 3HG2 VAL 158 -3.173 13.558 8.252 1198 2HG1 VAL 158 1HG2 VAL 158 -3.460 14.061 6.568 1199 3HG1 VAL 158 2HG2 VAL 158 -3.999 15.101 7.913 1200 1HG2 VAL 158 2HG1 VAL 158 -7.217 13.516 6.663 1201 2HG2 VAL 158 3HG1 VAL 158 -6.405 15.076 6.968 1202 3HG2 VAL 158 1HG1 VAL 158 -5.866 14.036 5.622 1203 H ILE 159 H ILE 159 -2.959 10.963 6.304 1204 HA ILE 159 HA ILE 159 -2.217 9.201 8.561 1205 HB ILE 159 HB ILE 159 -0.604 10.257 6.176 1206 1HG1 ILE 159 1HG1 ILE 159 -2.147 7.659 6.783 1207 2HG1 ILE 159 2HG1 ILE 159 -2.621 8.899 5.616 1208 1HG2 ILE 159 3HG2 ILE 159 0.015 8.003 8.196 1209 2HG2 ILE 159 1HG2 ILE 159 0.963 8.370 6.728 1210 3HG2 ILE 159 2HG2 ILE 159 0.889 9.551 8.061 1211 1HD1 ILE 159 3HD1 ILE 159 -0.024 7.220 5.477 1212 2HD1 ILE 159 1HD1 ILE 159 -1.474 6.983 4.463 1213 3HD1 ILE 159 2HD1 ILE 159 -0.500 8.470 4.294 1214 H LEU 160 H LEU 160 -0.811 9.333 10.018 1215 HA LEU 160 HA LEU 160 -0.001 12.111 11.009 1216 1HB LEU 160 1HB LEU 160 -0.035 9.394 12.444 1217 2HB LEU 160 2HB LEU 160 0.406 10.946 13.171 1218 HG LEU 160 HG LEU 160 -2.303 10.273 11.879 1219 1HD1 LEU 160 2HD1 LEU 160 -1.958 9.216 14.136 1220 2HD1 LEU 160 3HD1 LEU 160 -1.527 10.803 14.825 1221 3HD1 LEU 160 1HD1 LEU 160 -3.180 10.511 14.224 1222 1HD2 LEU 160 3HD2 LEU 160 -1.655 12.672 11.510 1223 2HD2 LEU 160 1HD2 LEU 160 -3.000 12.553 12.674 1224 3HD2 LEU 160 2HD2 LEU 160 -1.344 12.869 13.255 1225 H SER 161 H SER 161 1.322 8.859 10.474 1226 HA SER 161 HA SER 161 4.023 9.937 9.738 1227 1HB SER 161 1HB SER 161 3.886 10.286 12.239 1228 2HB SER 161 2HB SER 161 3.648 8.542 12.459 1229 HG SER 161 HG SER 161 5.857 9.804 11.186 1230 H ALA 162 H ALA 162 5.654 8.428 9.583 1231 HA ALA 162 HA ALA 162 4.988 5.481 9.250 1232 1HB ALA 162 3HB ALA 162 5.913 7.230 6.871 1233 2HB ALA 162 1HB ALA 162 5.753 5.453 6.871 1234 3HB ALA 162 2HB ALA 162 4.305 6.475 7.038 1235 H LYS 163 H LYS 163 6.403 4.733 10.436 1236 HA LYS 163 HA LYS 163 9.370 5.545 10.162 1237 1HB LYS 163 1HB LYS 163 7.767 4.934 12.715 1238 2HB LYS 163 2HB LYS 163 9.522 5.130 12.650 1239 1HG LYS 163 1HG LYS 163 7.430 7.251 11.844 1240 2HG LYS 163 2HG LYS 163 8.372 7.254 13.339 1241 1HD LYS 163 1HD LYS 163 10.515 7.423 11.980 1242 2HD LYS 163 2HD LYS 163 9.565 7.437 10.490 1243 1HE LYS 163 1HE LYS 163 8.423 9.585 11.236 1244 2HE LYS 163 2HE LYS 163 9.364 9.566 12.735 1245 1HZ LYS 163 3HZ LYS 163 11.397 9.718 11.393 1246 2HZ LYS 163 1HZ LYS 163 10.520 9.737 9.993 1247 3HZ LYS 163 2HZ LYS 163 10.386 10.983 11.069 1248 H VAL 164 H VAL 164 10.261 3.984 9.240 1249 HA VAL 164 HA VAL 164 9.487 1.119 9.533 1250 HB VAL 164 HB VAL 164 11.477 0.735 8.144 1251 1HG1 VAL 164 3HG2 VAL 164 9.332 1.450 7.053 1252 2HG1 VAL 164 1HG2 VAL 164 9.806 3.161 7.217 1253 3HG1 VAL 164 2HG2 VAL 164 10.734 2.078 6.145 1254 1HG2 VAL 164 2HG1 VAL 164 12.988 2.453 9.179 1255 2HG2 VAL 164 3HG1 VAL 164 12.910 2.675 7.411 1256 3HG2 VAL 164 1HG1 VAL 164 11.993 3.761 8.489 1257 H LEU 165 H LEU 165 10.250 -0.302 10.755 1258 HA LEU 165 HA LEU 165 12.404 0.346 12.859 1259 1HB LEU 165 1HB LEU 165 10.344 -1.931 12.741 1260 2HB LEU 165 2HB LEU 165 11.579 -1.726 13.992 1261 HG LEU 165 HG LEU 165 9.393 0.320 13.286 1262 1HD1 LEU 165 2HD1 LEU 165 8.536 -1.686 14.541 1263 2HD1 LEU 165 3HD1 LEU 165 9.790 -1.456 15.787 1264 3HD1 LEU 165 1HD1 LEU 165 8.508 -0.235 15.576 1265 1HD2 LEU 165 3HD2 LEU 165 11.532 1.424 14.009 1266 2HD2 LEU 165 1HD2 LEU 165 10.277 1.601 15.262 1267 3HD2 LEU 165 2HD2 LEU 165 11.580 0.402 15.469 1268 HA PRO 166 HA PRO 166 15.608 -1.716 10.703 1269 1HB PRO 166 1HB PRO 166 16.079 -2.583 13.604 1270 2HB PRO 166 2HB PRO 166 17.278 -1.981 12.434 1271 1HG PRO 166 1HG PRO 166 16.322 -0.260 14.301 1272 2HG PRO 166 2HG PRO 166 16.427 0.297 12.613 1273 1HD PRO 166 1HD PRO 166 13.929 -0.635 14.122 1274 2HD PRO 166 2HD PRO 166 14.098 0.719 12.957 Start of MODEL 2 Raw file had 1274 H/Q atoms Start of MODEL 2 1 1H ALA 1 3H ALA 1 23.261 -4.005 10.223 2 2H ALA 1 1H ALA 1 22.820 -4.783 11.612 3 3H ALA 1 2H ALA 1 24.247 -5.161 10.872 4 HA ALA 1 HA ALA 1 23.097 -6.043 8.930 5 1HB ALA 1 2HB ALA 1 23.698 -7.603 10.805 6 2HB ALA 1 3HB ALA 1 22.158 -7.236 11.627 7 3HB ALA 1 1HB ALA 1 22.154 -8.088 10.060 8 H LYS 2 H LYS 2 21.932 -4.006 8.554 9 HA LYS 2 HA LYS 2 19.293 -3.332 9.395 10 1HB LYS 2 1HB LYS 2 20.329 -3.321 6.500 11 2HB LYS 2 2HB LYS 2 18.974 -2.364 7.122 12 1HG LYS 2 1HG LYS 2 20.535 -1.243 8.774 13 2HG LYS 2 2HG LYS 2 21.879 -2.204 8.155 14 1HD LYS 2 1HD LYS 2 21.555 -1.131 5.847 15 2HD LYS 2 2HD LYS 2 20.226 -0.187 6.500 16 1HE LYS 2 1HE LYS 2 22.117 1.285 6.451 17 2HE LYS 2 2HE LYS 2 21.834 0.926 8.152 18 1HZ LYS 2 1HZ LYS 2 23.911 -0.360 6.432 19 2HZ LYS 2 2HZ LYS 2 24.182 0.793 7.583 20 3HZ LYS 2 3HZ LYS 2 23.663 -0.711 8.027 21 H GLY 3 H GLY 3 17.668 -4.559 9.645 22 1HA GLY 3 1HA GLY 3 16.264 -5.928 7.475 23 2HA GLY 3 2HA GLY 3 17.179 -7.156 8.374 24 H ASP 4 H ASP 4 14.571 -4.970 8.327 25 HA ASP 4 HA ASP 4 12.968 -6.545 10.185 26 1HB ASP 4 1HB ASP 4 14.058 -3.889 11.311 27 2HB ASP 4 2HB ASP 4 12.662 -4.748 11.978 28 HA PRO 5 HA PRO 5 11.099 -3.594 7.039 29 1HB PRO 5 1HB PRO 5 9.688 -6.251 6.526 30 2HB PRO 5 2HB PRO 5 10.255 -5.057 5.334 31 1HG PRO 5 1HG PRO 5 11.721 -7.310 5.722 32 2HG PRO 5 2HG PRO 5 12.572 -5.748 5.627 33 1HD PRO 5 1HD PRO 5 11.843 -7.325 8.162 34 2HD PRO 5 2HD PRO 5 13.382 -6.494 7.761 35 H HIS 6 H HIS 6 9.917 -2.362 8.239 36 HA HIS 6 HA HIS 6 7.125 -3.145 9.023 37 1HB HIS 6 1HB HIS 6 9.205 -2.458 11.191 38 2HB HIS 6 2HB HIS 6 7.459 -2.563 11.451 39 HD2 HIS 6 HD2 HIS 6 9.090 -5.083 9.023 40 HE1 HIS 6 HE1 HIS 6 8.144 -7.212 12.471 41 HE2 HIS 6 HE2 HIS 6 8.977 -7.530 10.056 42 H VAL 7 H VAL 7 7.057 -1.616 7.320 43 HA VAL 7 HA VAL 7 7.735 1.209 7.679 44 HB VAL 7 HB VAL 7 6.123 1.606 5.887 45 1HG1 VAL 7 2HG2 VAL 7 8.311 0.554 5.260 46 2HG1 VAL 7 3HG2 VAL 7 7.598 -1.068 5.457 47 3HG1 VAL 7 1HG2 VAL 7 7.011 0.014 4.165 48 1HG2 VAL 7 2HG1 VAL 7 4.244 0.205 6.740 49 2HG2 VAL 7 3HG1 VAL 7 4.609 -0.211 5.046 50 3HG2 VAL 7 1HG1 VAL 7 5.157 -1.281 6.368 51 H LEU 8 H LEU 8 7.254 1.995 9.542 52 HA LEU 8 HA LEU 8 4.666 1.496 10.968 53 1HB LEU 8 1HB LEU 8 7.120 3.216 11.558 54 2HB LEU 8 2HB LEU 8 5.643 3.334 12.534 55 HG LEU 8 HG LEU 8 7.016 0.667 11.868 56 1HD1 LEU 8 2HD1 LEU 8 8.486 2.059 13.341 57 2HD1 LEU 8 3HD1 LEU 8 7.128 2.320 14.471 58 3HD1 LEU 8 1HD1 LEU 8 7.802 0.682 14.246 59 1HD2 LEU 8 3HD2 LEU 8 4.541 0.539 12.331 60 2HD2 LEU 8 1HD2 LEU 8 5.467 -0.212 13.655 61 3HD2 LEU 8 2HD2 LEU 8 4.772 1.415 13.864 62 H LEU 9 H LEU 9 3.149 2.729 11.388 63 HA LEU 9 HA LEU 9 2.702 5.394 9.979 64 1HB LEU 9 1HB LEU 9 1.306 2.760 9.287 65 2HB LEU 9 2HB LEU 9 0.405 4.273 9.165 66 HG LEU 9 HG LEU 9 3.173 3.979 7.921 67 1HD1 LEU 9 2HD1 LEU 9 1.680 2.210 6.926 68 2HD1 LEU 9 3HD1 LEU 9 0.437 3.440 6.578 69 3HD1 LEU 9 1HD1 LEU 9 2.007 3.494 5.735 70 1HD2 LEU 9 3HD2 LEU 9 2.293 6.307 8.254 71 2HD2 LEU 9 1HD2 LEU 9 2.381 5.910 6.519 72 3HD2 LEU 9 2HD2 LEU 9 0.808 5.887 7.360 73 H THR 10 H THR 10 0.834 6.318 10.409 74 HA THR 10 HA THR 10 -0.928 5.472 12.685 75 HB THR 10 HB THR 10 0.978 7.869 13.038 76 HG1 THR 10 HG1 THR 10 1.712 6.594 14.770 77 1HG2 THR 10 3HG2 THR 10 -1.206 6.697 14.886 78 2HG2 THR 10 1HG2 THR 10 -0.106 8.038 15.305 79 3HG2 THR 10 2HG2 THR 10 -1.317 8.247 14.011 80 H THR 11 H THR 11 -2.205 5.663 10.872 81 HA THR 11 HA THR 11 -2.906 8.324 9.687 82 HB THR 11 HB THR 11 -4.972 7.104 8.899 83 HG1 THR 11 HG1 THR 11 -5.039 5.639 10.637 84 1HG2 THR 11 2HG2 THR 11 -2.860 7.164 7.558 85 2HG2 THR 11 3HG2 THR 11 -2.264 5.711 8.405 86 3HG2 THR 11 1HG2 THR 11 -3.701 5.604 7.344 87 H SER 12 H SER 12 -5.068 9.059 9.798 88 HA SER 12 HA SER 12 -5.803 10.243 12.265 89 1HB SER 12 1HB SER 12 -8.112 10.487 11.352 90 2HB SER 12 2HB SER 12 -6.892 10.831 10.111 91 HG SER 12 HG SER 12 -8.536 9.446 9.378 92 H ALA 13 H ALA 13 -6.843 7.137 10.973 93 HA ALA 13 HA ALA 13 -8.604 6.317 13.131 94 1HB ALA 13 2HB ALA 13 -8.484 5.106 10.943 95 2HB ALA 13 3HB ALA 13 -6.837 4.546 11.330 96 3HB ALA 13 1HB ALA 13 -8.225 3.987 12.302 97 H GLY 14 H GLY 14 -5.363 5.439 12.484 98 1HA GLY 14 1HA GLY 14 -4.168 5.779 15.101 99 2HA GLY 14 2HA GLY 14 -4.843 4.146 15.134 100 H ASN 15 H ASN 15 -2.480 4.116 15.635 101 HA ASN 15 HA ASN 15 -0.431 4.135 13.546 102 1HB ASN 15 1HB ASN 15 0.032 4.063 16.023 103 2HB ASN 15 2HB ASN 15 -0.576 2.403 16.087 104 1HD2 ASN 15 1HD2 ASN 15 2.832 2.973 13.782 105 2HD2 ASN 15 2HD2 ASN 15 1.405 4.121 13.678 106 H ILE 16 H ILE 16 0.665 2.411 12.682 107 HA ILE 16 HA ILE 16 -0.391 -0.337 12.531 108 HB ILE 16 HB ILE 16 -0.989 -0.291 10.070 109 1HG1 ILE 16 1HG1 ILE 16 -0.934 2.745 10.571 110 2HG1 ILE 16 2HG1 ILE 16 0.098 1.855 9.445 111 1HG2 ILE 16 2HG2 ILE 16 -2.690 -0.379 11.883 112 2HG2 ILE 16 3HG2 ILE 16 -2.717 1.402 11.968 113 3HG2 ILE 16 1HG2 ILE 16 -3.289 0.568 10.495 114 1HD1 ILE 16 1HD1 ILE 16 -2.993 2.040 9.271 115 2HD1 ILE 16 2HD1 ILE 16 -1.841 2.917 8.231 116 3HD1 ILE 16 3HD1 ILE 16 -1.962 1.140 8.129 117 H GLU 17 H GLU 17 0.551 -1.497 10.656 118 HA GLU 17 HA GLU 17 3.416 -0.716 9.993 119 1HB GLU 17 1HB GLU 17 2.727 -3.029 11.898 120 2HB GLU 17 2HB GLU 17 4.350 -2.549 11.379 121 1HG GLU 17 1HG GLU 17 4.046 -0.294 12.479 122 2HG GLU 17 2HG GLU 17 2.401 -0.723 12.940 123 H LEU 18 H LEU 18 3.340 -1.245 7.990 124 HA LEU 18 HA LEU 18 2.353 -3.980 7.051 125 1HB LEU 18 1HB LEU 18 3.635 -1.696 5.442 126 2HB LEU 18 2HB LEU 18 3.047 -3.230 4.798 127 HG LEU 18 HG LEU 18 1.279 -1.679 4.418 128 1HD1 LEU 18 2HD1 LEU 18 0.512 -3.881 5.357 129 2HD1 LEU 18 3HD1 LEU 18 0.598 -3.218 7.011 130 3HD1 LEU 18 1HD1 LEU 18 -0.588 -2.567 5.848 131 1HD2 LEU 18 3HD2 LEU 18 2.067 0.136 5.937 132 2HD2 LEU 18 1HD2 LEU 18 0.333 -0.187 6.182 133 3HD2 LEU 18 2HD2 LEU 18 1.527 -0.795 7.361 134 H GLU 19 H GLU 19 3.667 -5.478 7.716 135 HA GLU 19 HA GLU 19 6.641 -5.227 7.863 136 1HB GLU 19 1HB GLU 19 6.628 -7.649 8.300 137 2HB GLU 19 2HB GLU 19 5.474 -6.790 9.312 138 1HG GLU 19 1HG GLU 19 4.307 -8.750 8.576 139 2HG GLU 19 2HG GLU 19 3.605 -7.411 7.676 140 H LEU 20 H LEU 20 7.882 -5.127 6.301 141 HA LEU 20 HA LEU 20 6.994 -5.987 3.481 142 1HB LEU 20 1HB LEU 20 9.052 -3.888 4.387 143 2HB LEU 20 2HB LEU 20 8.731 -4.355 2.717 144 HG LEU 20 HG LEU 20 6.278 -3.744 3.055 145 1HD1 LEU 20 3HD1 LEU 20 7.363 -2.450 5.646 146 2HD1 LEU 20 1HD1 LEU 20 5.734 -2.199 4.967 147 3HD1 LEU 20 2HD1 LEU 20 6.209 -3.807 5.566 148 1HD2 LEU 20 3HD2 LEU 20 7.899 -2.222 1.889 149 2HD2 LEU 20 1HD2 LEU 20 6.706 -1.282 2.821 150 3HD2 LEU 20 2HD2 LEU 20 8.360 -1.496 3.451 151 H ASP 21 H ASP 21 8.039 -7.270 2.325 152 HA ASP 21 HA ASP 21 10.090 -9.129 3.285 153 1HB ASP 21 1HB ASP 21 8.507 -9.410 1.296 154 2HB ASP 21 2HB ASP 21 9.545 -8.304 0.383 155 H LYS 22 H LYS 22 11.218 -8.203 0.473 156 HA LYS 22 HA LYS 22 12.836 -6.027 0.251 157 1HB LYS 22 1HB LYS 22 13.192 -5.998 2.718 158 2HB LYS 22 2HB LYS 22 13.902 -7.621 2.659 159 1HG LYS 22 1HG LYS 22 15.702 -6.769 1.096 160 2HG LYS 22 2HG LYS 22 15.011 -5.149 1.178 161 1HD LYS 22 1HD LYS 22 15.431 -5.086 3.671 162 2HD LYS 22 2HD LYS 22 16.122 -6.700 3.623 163 1HE LYS 22 1HE LYS 22 17.274 -4.255 2.102 164 2HE LYS 22 2HE LYS 22 17.810 -4.785 3.694 165 1HZ LYS 22 2HZ LYS 22 18.495 -6.910 2.721 166 2HZ LYS 22 3HZ LYS 22 18.002 -6.429 1.220 167 3HZ LYS 22 1HZ LYS 22 19.250 -5.647 1.969 168 H GLN 23 H GLN 23 13.644 -9.280 1.352 169 HA GLN 23 HA GLN 23 15.950 -9.712 -0.348 170 1HB GLN 23 1HB GLN 23 15.596 -12.140 0.073 171 2HB GLN 23 2HB GLN 23 15.468 -11.182 1.551 172 1HG GLN 23 1HG GLN 23 12.947 -11.190 1.347 173 2HG GLN 23 2HG GLN 23 13.072 -12.147 -0.134 174 1HE2 GLN 23 2HE2 GLN 23 14.417 -14.044 3.312 175 2HE2 GLN 23 1HE2 GLN 23 14.883 -12.310 2.931 176 H LYS 24 H LYS 24 12.560 -10.609 -0.813 177 HA LYS 24 HA LYS 24 12.939 -11.847 -3.447 178 1HB LYS 24 1HB LYS 24 10.415 -10.658 -2.169 179 2HB LYS 24 2HB LYS 24 10.445 -11.690 -3.601 180 1HG LYS 24 1HG LYS 24 11.478 -12.432 -0.791 181 2HG LYS 24 2HG LYS 24 9.993 -13.035 -1.533 182 1HD LYS 24 1HD LYS 24 11.350 -14.121 -3.372 183 2HD LYS 24 2HD LYS 24 12.843 -13.532 -2.658 184 1HE LYS 24 1HE LYS 24 10.872 -15.472 -1.252 185 2HE LYS 24 2HE LYS 24 12.281 -15.977 -2.181 186 1HZ LYS 24 3HZ LYS 24 13.707 -14.778 -0.614 187 2HZ LYS 24 1HZ LYS 24 12.399 -14.298 0.273 188 3HZ LYS 24 2HZ LYS 24 12.784 -15.901 0.170 189 H ALA 25 H ALA 25 12.734 -8.559 -2.498 190 HA ALA 25 HA ALA 25 13.032 -7.640 -5.333 191 1HB ALA 25 2HB ALA 25 10.533 -7.917 -5.196 192 2HB ALA 25 3HB ALA 25 10.482 -6.852 -3.766 193 3HB ALA 25 1HB ALA 25 10.978 -6.199 -5.350 194 HA PRO 26 HA PRO 26 15.398 -5.384 -2.012 195 1HB PRO 26 1HB PRO 26 17.153 -5.547 -4.512 196 2HB PRO 26 2HB PRO 26 17.653 -5.700 -2.810 197 1HG PRO 26 1HG PRO 26 17.404 -7.957 -4.299 198 2HG PRO 26 2HG PRO 26 16.715 -7.946 -2.656 199 1HD PRO 26 1HD PRO 26 15.217 -7.587 -5.311 200 2HD PRO 26 2HD PRO 26 14.737 -8.544 -3.872 201 H VAL 27 H VAL 27 15.462 -4.878 -5.512 202 HA VAL 27 HA VAL 27 16.023 -2.102 -5.657 203 HB VAL 27 HB VAL 27 14.025 -3.652 -7.407 204 1HG1 VAL 27 3HG2 VAL 27 13.863 -1.158 -7.668 205 2HG1 VAL 27 1HG2 VAL 27 15.624 -1.058 -7.925 206 3HG1 VAL 27 2HG2 VAL 27 14.594 -1.896 -9.117 207 1HG2 VAL 27 2HG1 VAL 27 16.289 -4.738 -7.258 208 2HG2 VAL 27 3HG1 VAL 27 16.037 -4.026 -8.873 209 3HG2 VAL 27 1HG1 VAL 27 17.071 -3.193 -7.681 210 H SER 28 H SER 28 12.789 -3.508 -5.833 211 HA SER 28 HA SER 28 11.195 -1.182 -5.718 212 1HB SER 28 1HB SER 28 9.420 -2.573 -4.634 213 2HB SER 28 2HB SER 28 10.216 -3.425 -5.969 214 HG SER 28 HG SER 28 11.552 -4.442 -4.414 215 H VAL 29 H VAL 29 12.306 -3.058 -2.904 216 HA VAL 29 HA VAL 29 11.318 -1.297 -0.844 217 HB VAL 29 HB VAL 29 13.031 -2.385 0.591 218 1HG1 VAL 29 3HG2 VAL 29 10.864 -3.527 0.060 219 2HG1 VAL 29 1HG2 VAL 29 11.598 -4.277 -1.381 220 3HG1 VAL 29 2HG2 VAL 29 12.174 -4.722 0.248 221 1HG2 VAL 29 2HG1 VAL 29 14.926 -2.456 -1.054 222 2HG2 VAL 29 3HG1 VAL 29 14.586 -4.086 -0.417 223 3HG2 VAL 29 1HG1 VAL 29 14.030 -3.632 -2.050 224 H GLN 30 H GLN 30 14.465 -1.418 -2.469 225 HA GLN 30 HA GLN 30 15.908 0.598 -1.096 226 1HB GLN 30 1HB GLN 30 16.846 -0.692 -3.017 227 2HB GLN 30 2HB GLN 30 15.803 0.182 -4.149 228 1HG GLN 30 1HG GLN 30 18.090 1.192 -4.088 229 2HG GLN 30 2HG GLN 30 16.875 2.351 -3.531 230 1HE2 GLN 30 2HE2 GLN 30 17.849 1.793 0.025 231 2HE2 GLN 30 1HE2 GLN 30 16.341 1.660 -1.012 232 H ASN 31 H ASN 31 14.196 1.253 -4.115 233 HA ASN 31 HA ASN 31 13.966 4.104 -3.939 234 1HB ASN 31 1HB ASN 31 11.825 2.142 -4.981 235 2HB ASN 31 2HB ASN 31 11.903 3.868 -5.348 236 1HD2 ASN 31 1HD2 ASN 31 14.611 1.284 -7.111 237 2HD2 ASN 31 2HD2 ASN 31 13.632 0.801 -5.636 238 H PHE 32 H PHE 32 11.768 1.612 -2.770 239 HA PHE 32 HA PHE 32 9.709 3.052 -1.494 240 1HB PHE 32 1HB PHE 32 9.917 0.555 -1.481 241 2HB PHE 32 2HB PHE 32 11.258 0.650 -0.337 242 HD1 PHE 32 HD2 PHE 32 7.859 2.186 -0.654 243 HD2 PHE 32 HD1 PHE 32 10.619 0.208 1.850 244 HE1 PHE 32 HE2 PHE 32 6.247 2.234 1.164 245 HE2 PHE 32 HE1 PHE 32 9.005 0.261 3.666 246 HZ PHE 32 HZ PHE 32 6.820 1.273 3.325 247 H VAL 33 H VAL 33 12.601 1.958 0.220 248 HA VAL 33 HA VAL 33 12.378 3.516 2.591 249 HB VAL 33 HB VAL 33 14.968 2.895 1.051 250 1HG1 VAL 33 3HG2 VAL 33 15.257 4.627 2.850 251 2HG1 VAL 33 1HG2 VAL 33 14.459 3.553 4.028 252 3HG1 VAL 33 2HG2 VAL 33 16.032 3.092 3.324 253 1HG2 VAL 33 2HG1 VAL 33 13.560 0.860 1.505 254 2HG2 VAL 33 3HG1 VAL 33 15.024 0.853 2.524 255 3HG2 VAL 33 1HG1 VAL 33 13.448 1.308 3.227 256 H ASP 34 H ASP 34 13.661 4.481 -0.534 257 HA ASP 34 HA ASP 34 14.673 7.105 -0.026 258 1HB ASP 34 1HB ASP 34 12.774 6.193 -2.279 259 2HB ASP 34 2HB ASP 34 13.687 7.708 -2.297 260 OH TYR 35 OH TYR 35 9.691 7.966 -6.108 261 H TYR 35 H TYR 35 11.373 6.282 -0.901 262 HA TYR 35 HA TYR 35 10.165 8.861 -0.082 263 1HB TYR 35 1HB TYR 35 8.843 6.098 -0.416 264 2HB TYR 35 2HB TYR 35 7.998 7.647 -0.327 265 HD1 TYR 35 HD2 TYR 35 9.383 9.469 -1.927 266 HD2 TYR 35 HD1 TYR 35 8.933 5.326 -2.602 267 HE1 TYR 35 HE2 TYR 35 9.712 9.819 -4.311 268 HE2 TYR 35 HE1 TYR 35 9.264 5.681 -4.984 269 HH TYR 35 HH TYR 35 9.832 8.901 -6.269 270 H VAL 36 H VAL 36 10.072 5.592 1.234 271 HA VAL 36 HA VAL 36 8.751 5.862 3.695 272 HB VAL 36 HB VAL 36 11.466 4.493 3.293 273 1HG1 VAL 36 3HG2 VAL 36 10.777 4.692 5.697 274 2HG1 VAL 36 1HG2 VAL 36 9.193 3.967 5.320 275 3HG1 VAL 36 2HG2 VAL 36 10.680 2.994 5.162 276 1HG2 VAL 36 2HG1 VAL 36 9.769 3.802 1.566 277 2HG2 VAL 36 3HG1 VAL 36 10.079 2.464 2.704 278 3HG2 VAL 36 1HG1 VAL 36 8.590 3.436 2.853 279 H ASN 37 H ASN 37 12.153 6.533 3.085 280 HA ASN 37 HA ASN 37 13.191 7.278 5.540 281 1HB ASN 37 1HB ASN 37 14.437 7.497 3.380 282 2HB ASN 37 2HB ASN 37 13.515 8.956 2.976 283 1HD2 ASN 37 1HD2 ASN 37 16.599 10.255 4.513 284 2HD2 ASN 37 2HD2 ASN 37 16.001 9.461 2.970 285 H SER 38 H SER 38 10.813 9.065 3.752 286 HA SER 38 HA SER 38 9.307 10.250 5.592 287 1HB SER 38 1HB SER 38 10.364 12.225 6.655 288 2HB SER 38 2HB SER 38 11.309 10.762 6.995 289 HG SER 38 HG SER 38 12.593 12.510 6.313 290 H GLY 39 H GLY 39 8.661 12.531 5.481 291 1HA GLY 39 1HA GLY 39 8.118 14.553 4.240 292 2HA GLY 39 2HA GLY 39 9.127 14.030 2.890 293 H PHE 40 H PHE 40 8.076 11.441 2.650 294 HA PHE 40 HA PHE 40 5.755 12.022 0.865 295 1HB PHE 40 1HB PHE 40 7.477 10.301 0.303 296 2HB PHE 40 2HB PHE 40 7.016 9.349 1.721 297 HD1 PHE 40 HD2 PHE 40 4.252 11.074 0.244 298 HD2 PHE 40 HD1 PHE 40 6.604 7.590 -0.087 299 HE1 PHE 40 HE2 PHE 40 2.496 10.010 -1.058 300 HE2 PHE 40 HE1 PHE 40 4.846 6.528 -1.387 301 HZ PHE 40 HZ PHE 40 2.792 7.735 -1.873 302 OH TYR 41 OH TYR 41 6.215 4.486 1.110 303 H TYR 41 H TYR 41 6.062 9.482 3.270 304 HA TYR 41 HA TYR 41 3.216 9.171 3.701 305 1HB TYR 41 1HB TYR 41 5.494 8.423 5.626 306 2HB TYR 41 2HB TYR 41 3.862 7.742 5.623 307 HD1 TYR 41 HD2 TYR 41 3.646 7.839 2.521 308 HD2 TYR 41 HD1 TYR 41 6.557 6.303 5.163 309 HE1 TYR 41 HE2 TYR 41 4.335 6.231 0.830 310 HE2 TYR 41 HE1 TYR 41 7.246 4.699 3.468 311 HH TYR 41 HH TYR 41 6.932 3.951 1.459 312 H ASN 42 H ASN 42 5.542 11.251 5.235 313 HA ASN 42 HA ASN 42 4.665 11.707 7.790 314 1HB ASN 42 1HB ASN 42 5.351 14.086 7.614 315 2HB ASN 42 2HB ASN 42 6.472 13.051 6.717 316 1HD2 ASN 42 1HD2 ASN 42 5.690 15.843 4.412 317 2HD2 ASN 42 2HD2 ASN 42 6.582 15.529 5.985 318 H ASN 43 H ASN 43 2.959 12.859 4.940 319 HA ASN 43 HA ASN 43 0.395 13.009 6.457 320 1HB ASN 43 1HB ASN 43 1.368 15.150 7.178 321 2HB ASN 43 2HB ASN 43 1.705 15.626 5.502 322 1HD2 ASN 43 1HD2 ASN 43 -2.338 15.146 6.094 323 2HD2 ASN 43 2HD2 ASN 43 -1.132 13.781 6.315 324 H THR 44 H THR 44 1.130 11.489 4.472 325 HA THR 44 HA THR 44 -0.498 12.360 2.034 326 HB THR 44 HB THR 44 -0.273 9.958 1.368 327 HG1 THR 44 HG1 THR 44 1.361 9.878 3.689 328 1HG2 THR 44 3HG2 THR 44 2.375 11.367 2.118 329 2HG2 THR 44 1HG2 THR 44 2.196 10.079 0.896 330 3HG2 THR 44 2HG2 THR 44 1.426 11.667 0.639 331 H THR 45 H THR 45 -1.566 9.490 2.282 332 HA THR 45 HA THR 45 -3.252 9.460 4.727 333 HB THR 45 HB THR 45 -5.450 9.628 3.535 334 HG1 THR 45 HG1 THR 45 -4.619 9.205 1.462 335 1HG2 THR 45 2HG2 THR 45 -4.503 11.622 4.742 336 2HG2 THR 45 3HG2 THR 45 -3.644 12.120 3.260 337 3HG2 THR 45 1HG2 THR 45 -5.428 12.131 3.304 338 H PHE 46 H PHE 46 -5.414 8.293 3.204 339 HA PHE 46 HA PHE 46 -4.433 5.742 1.972 340 1HB PHE 46 1HB PHE 46 -5.646 5.783 4.810 341 2HB PHE 46 2HB PHE 46 -5.754 4.370 3.769 342 HD1 PHE 46 HD1 PHE 46 -3.415 6.527 5.603 343 HD2 PHE 46 HD2 PHE 46 -3.811 3.069 3.221 344 HE1 PHE 46 HE1 PHE 46 -1.197 5.801 6.283 345 HE2 PHE 46 HE2 PHE 46 -1.591 2.350 3.897 346 HZ PHE 46 HZ PHE 46 -0.282 3.715 5.429 347 H HIS 47 H HIS 47 -5.591 7.055 0.481 348 HA HIS 47 HA HIS 47 -8.259 7.905 0.537 349 1HB HIS 47 1HB HIS 47 -8.432 7.399 -1.910 350 2HB HIS 47 2HB HIS 47 -6.942 8.231 -1.466 351 HD2 HIS 47 HD2 HIS 47 -7.568 6.101 -4.001 352 HE1 HIS 47 HE1 HIS 47 -4.321 4.122 -2.315 353 HE2 HIS 47 HE2 HIS 47 -5.684 4.288 -4.489 354 NH1 ARG 48 NH2 ARG 48 -11.034 -0.621 1.232 355 NH2 ARG 48 NH1 ARG 48 -13.209 -1.017 1.756 356 H ARG 48 H ARG 48 -7.654 4.789 -1.048 357 HA ARG 48 HA ARG 48 -9.257 3.207 0.827 358 1HB ARG 48 1HB ARG 48 -11.051 4.715 -0.150 359 2HB ARG 48 2HB ARG 48 -10.708 4.048 -1.750 360 1HG ARG 48 1HG ARG 48 -12.629 2.855 -0.738 361 2HG ARG 48 2HG ARG 48 -11.271 1.747 -0.966 362 1HD ARG 48 1HD ARG 48 -10.624 2.039 1.494 363 2HD ARG 48 2HD ARG 48 -11.968 3.150 1.702 364 HE ARG 48 HE ARG 48 -13.574 1.347 1.620 365 1HH1 ARG 48 2HH2 ARG 48 -10.310 0.071 1.007 366 2HH1 ARG 48 1HH2 ARG 48 -10.913 -1.638 1.299 367 1HH2 ARG 48 1HH1 ARG 48 -14.144 -0.632 1.930 368 2HH2 ARG 48 2HH1 ARG 48 -12.936 -2.006 1.785 369 H VAL 49 H VAL 49 -10.638 1.780 -1.157 370 HA VAL 49 HA VAL 49 -9.123 0.804 -3.340 371 HB VAL 49 HB VAL 49 -8.684 -0.923 -0.835 372 1HG1 VAL 49 1HG2 VAL 49 -8.224 -1.622 -3.811 373 2HG1 VAL 49 2HG2 VAL 49 -7.725 -2.626 -2.423 374 3HG1 VAL 49 3HG2 VAL 49 -9.456 -2.354 -2.752 375 1HG2 VAL 49 1HG1 VAL 49 -6.779 0.316 -2.937 376 2HG2 VAL 49 2HG1 VAL 49 -7.000 0.900 -1.267 377 3HG2 VAL 49 3HG1 VAL 49 -6.275 -0.703 -1.562 378 H ILE 50 H ILE 50 -10.632 -0.971 -0.740 379 HA ILE 50 HA ILE 50 -13.365 -1.018 -1.848 380 HB ILE 50 HB ILE 50 -11.662 -3.559 -2.216 381 1HG1 ILE 50 1HG1 ILE 50 -13.106 -1.740 -4.237 382 2HG1 ILE 50 2HG1 ILE 50 -11.354 -1.879 -4.040 383 1HG2 ILE 50 2HG2 ILE 50 -13.970 -4.038 -1.353 384 2HG2 ILE 50 3HG2 ILE 50 -14.677 -3.054 -2.661 385 3HG2 ILE 50 1HG2 ILE 50 -13.811 -4.565 -3.049 386 1HD1 ILE 50 2HD1 ILE 50 -11.475 -4.343 -4.648 387 2HD1 ILE 50 3HD1 ILE 50 -13.241 -4.202 -4.846 388 3HD1 ILE 50 1HD1 ILE 50 -12.147 -3.323 -5.947 389 HA PRO 51 HA PRO 51 -14.321 -1.820 2.402 390 1HB PRO 51 1HB PRO 51 -16.373 -3.498 0.863 391 2HB PRO 51 2HB PRO 51 -16.660 -2.436 2.264 392 1HG PRO 51 1HG PRO 51 -17.261 -1.493 -0.207 393 2HG PRO 51 2HG PRO 51 -16.362 -0.431 0.905 394 1HD PRO 51 1HD PRO 51 -15.246 -2.052 -1.443 395 2HD PRO 51 2HD PRO 51 -14.810 -0.395 -0.913 396 H GLY 52 H GLY 52 -14.359 -3.507 3.827 397 1HA GLY 52 1HA GLY 52 -12.627 -5.316 4.396 398 2HA GLY 52 2HA GLY 52 -14.241 -6.021 4.283 399 H PHE 53 H PHE 53 -11.582 -5.060 2.185 400 HA PHE 53 HA PHE 53 -11.382 -7.830 0.946 401 1HB PHE 53 1HB PHE 53 -13.162 -6.608 -0.374 402 2HB PHE 53 2HB PHE 53 -12.026 -5.287 -0.679 403 HD1 PHE 53 HD1 PHE 53 -10.569 -8.577 -0.463 404 HD2 PHE 53 HD2 PHE 53 -12.392 -5.846 -3.110 405 HE1 PHE 53 HE1 PHE 53 -9.675 -9.812 -2.356 406 HE2 PHE 53 HE2 PHE 53 -11.497 -7.084 -5.001 407 HZ PHE 53 HZ PHE 53 -10.138 -9.067 -4.626 408 H MET 54 H MET 54 -10.392 -4.443 0.701 409 HA MET 54 HA MET 54 -7.499 -4.986 1.034 410 1HB MET 54 1HB MET 54 -8.491 -4.511 -1.843 411 2HB MET 54 2HB MET 54 -6.802 -4.632 -1.326 412 1HG MET 54 1HG MET 54 -7.225 -6.979 -0.484 413 2HG MET 54 2HG MET 54 -8.915 -6.866 -1.011 414 1HE MET 54 1HE MET 54 -9.686 -6.565 -3.570 415 2HE MET 54 3HE MET 54 -8.642 -5.122 -3.772 416 3HE MET 54 2HE MET 54 -8.548 -6.467 -4.945 417 H ILE 55 H ILE 55 -6.194 -3.255 0.696 418 HA ILE 55 HA ILE 55 -7.290 -0.552 -0.061 419 HB ILE 55 HB ILE 55 -6.679 0.542 2.046 420 1HG1 ILE 55 1HG1 ILE 55 -6.050 -2.288 3.081 421 2HG1 ILE 55 2HG1 ILE 55 -4.837 -1.084 2.635 422 1HG2 ILE 55 2HG2 ILE 55 -9.019 -0.335 1.816 423 2HG2 ILE 55 3HG2 ILE 55 -8.519 -1.893 2.523 424 3HG2 ILE 55 1HG2 ILE 55 -8.485 -0.411 3.516 425 1HD1 ILE 55 2HD1 ILE 55 -5.735 0.505 4.392 426 2HD1 ILE 55 3HD1 ILE 55 -6.966 -0.701 4.852 427 3HD1 ILE 55 1HD1 ILE 55 -5.236 -1.044 5.116 428 H GLN 56 H GLN 56 -5.688 1.067 -0.103 429 HA GLN 56 HA GLN 56 -2.763 0.329 0.068 430 1HB GLN 56 1HB GLN 56 -4.173 0.741 -2.632 431 2HB GLN 56 2HB GLN 56 -2.417 0.706 -2.417 432 1HG GLN 56 1HG GLN 56 -2.564 -1.633 -1.507 433 2HG GLN 56 2HG GLN 56 -4.327 -1.585 -1.635 434 1HE2 GLN 56 2HE2 GLN 56 -2.276 -1.426 -5.249 435 2HE2 GLN 56 1HE2 GLN 56 -1.746 -0.427 -3.803 436 H GLY 57 H GLY 57 -1.527 1.941 0.242 437 1HA GLY 57 1HA GLY 57 -2.667 4.810 -0.016 438 2HA GLY 57 2HA GLY 57 -1.634 4.282 1.306 439 H GLY 58 H GLY 58 -0.419 6.032 0.771 440 1HA GLY 58 1HA GLY 58 1.499 7.123 -0.169 441 2HA GLY 58 2HA GLY 58 2.047 5.514 -0.669 442 H GLY 59 H GLY 59 0.070 8.271 -1.470 443 1HA GLY 59 1HA GLY 59 0.836 8.396 -4.275 444 2HA GLY 59 2HA GLY 59 -0.711 7.530 -4.211 445 H PHE 60 H PHE 60 -2.358 8.652 -4.457 446 HA PHE 60 HA PHE 60 -2.500 11.404 -5.001 447 1HB PHE 60 1HB PHE 60 -4.764 9.803 -3.661 448 2HB PHE 60 2HB PHE 60 -4.954 11.273 -4.620 449 HD1 PHE 60 HD2 PHE 60 -3.812 11.153 -7.011 450 HD2 PHE 60 HD1 PHE 60 -4.954 7.764 -4.775 451 HE1 PHE 60 HE2 PHE 60 -3.891 9.831 -9.050 452 HE2 PHE 60 HE1 PHE 60 -5.032 6.446 -6.815 453 HZ PHE 60 HZ PHE 60 -4.501 7.479 -8.954 454 H THR 61 H THR 61 -2.076 13.084 -3.963 455 HA THR 61 HA THR 61 -1.863 13.412 -1.048 456 HB THR 61 HB THR 61 -1.930 15.857 -1.544 457 HG1 THR 61 HG1 THR 61 -2.167 16.437 -3.729 458 1HG2 THR 61 2HG2 THR 61 0.203 14.567 -1.890 459 2HG2 THR 61 3HG2 THR 61 -0.275 14.209 -3.569 460 3HG2 THR 61 1HG2 THR 61 0.064 15.891 -3.077 461 H GLU 62 H GLU 62 -3.314 13.472 0.361 462 HA GLU 62 HA GLU 62 -5.603 13.014 1.100 463 1HB GLU 62 1HB GLU 62 -6.583 15.123 1.751 464 2HB GLU 62 2HB GLU 62 -4.838 15.215 1.975 465 1HG GLU 62 1HG GLU 62 -6.377 16.308 -0.479 466 2HG GLU 62 2HG GLU 62 -5.908 17.286 0.906 467 H GLN 63 H GLN 63 -6.917 15.717 -0.329 468 HA GLN 63 HA GLN 63 -9.268 14.550 -1.339 469 1HB GLN 63 1HB GLN 63 -7.768 16.896 -2.662 470 2HB GLN 63 2HB GLN 63 -9.486 16.522 -2.861 471 1HG GLN 63 1HG GLN 63 -9.831 16.783 -0.369 472 2HG GLN 63 2HG GLN 63 -8.119 17.169 -0.171 473 1HE2 GLN 63 2HE2 GLN 63 -10.505 20.236 -0.849 474 2HE2 GLN 63 1HE2 GLN 63 -10.903 18.628 -0.060 475 H MET 64 H MET 64 -6.406 15.340 -3.265 476 HA MET 64 HA MET 64 -5.654 13.305 -4.734 477 1HB MET 64 1HB MET 64 -8.360 13.865 -6.038 478 2HB MET 64 2HB MET 64 -7.154 12.708 -6.600 479 1HG MET 64 1HG MET 64 -7.342 11.436 -4.418 480 2HG MET 64 2HG MET 64 -8.627 12.548 -3.891 481 1HE MET 64 2HE MET 64 -10.043 10.148 -3.589 482 2HE MET 64 1HE MET 64 -10.410 9.073 -4.972 483 3HE MET 64 3HE MET 64 -8.733 9.204 -4.367 484 H GLN 65 H GLN 65 -4.222 14.422 -5.276 485 HA GLN 65 HA GLN 65 -4.325 16.115 -7.752 486 1HB GLN 65 1HB GLN 65 -3.407 17.405 -5.100 487 2HB GLN 65 2HB GLN 65 -3.261 18.134 -6.706 488 1HG GLN 65 1HG GLN 65 -5.773 18.015 -6.990 489 2HG GLN 65 2HG GLN 65 -5.918 17.287 -5.386 490 1HE2 GLN 65 2HE2 GLN 65 -4.504 21.198 -5.464 491 2HE2 GLN 65 1HE2 GLN 65 -3.889 19.936 -6.645 492 H GLN 66 H GLN 66 -3.288 14.243 -8.241 493 HA GLN 66 HA GLN 66 -1.301 12.731 -7.422 494 1HB GLN 66 1HB GLN 66 -0.848 14.282 -10.038 495 2HB GLN 66 2HB GLN 66 -0.092 12.743 -9.590 496 1HG GLN 66 1HG GLN 66 -2.368 11.669 -9.400 497 2HG GLN 66 2HG GLN 66 -3.137 13.201 -9.825 498 1HE2 GLN 66 2HE2 GLN 66 -1.943 13.086 -13.291 499 2HE2 GLN 66 1HE2 GLN 66 -2.125 14.234 -11.871 500 H LYS 67 H LYS 67 0.492 12.607 -6.582 501 HA LYS 67 HA LYS 67 1.835 14.912 -5.349 502 1HB LYS 67 1HB LYS 67 2.781 12.025 -5.786 503 2HB LYS 67 2HB LYS 67 3.622 13.207 -4.779 504 1HG LYS 67 1HG LYS 67 0.733 12.207 -4.415 505 2HG LYS 67 2HG LYS 67 2.095 11.768 -3.395 506 1HD LYS 67 1HD LYS 67 0.938 14.617 -3.715 507 2HD LYS 67 2HD LYS 67 0.521 13.528 -2.413 508 1HE LYS 67 1HE LYS 67 3.361 14.669 -2.891 509 2HE LYS 67 2HE LYS 67 2.179 15.318 -1.763 510 1HZ LYS 67 2HZ LYS 67 2.235 13.214 -0.540 511 2HZ LYS 67 3HZ LYS 67 3.343 12.584 -1.591 512 3HZ LYS 67 1HZ LYS 67 3.746 13.875 -0.642 513 H LYS 68 H LYS 68 4.169 13.014 -6.250 514 HA LYS 68 HA LYS 68 5.117 14.568 -8.727 515 1HB LYS 68 1HB LYS 68 5.942 15.724 -6.666 516 2HB LYS 68 2HB LYS 68 6.635 14.212 -6.075 517 1HG LYS 68 1HG LYS 68 8.365 15.640 -7.240 518 2HG LYS 68 2HG LYS 68 8.171 14.046 -7.949 519 1HD LYS 68 1HD LYS 68 8.369 15.508 -9.781 520 2HD LYS 68 2HD LYS 68 6.691 15.024 -9.785 521 1HE LYS 68 1HE LYS 68 7.712 17.715 -8.605 522 2HE LYS 68 2HE LYS 68 7.258 17.508 -10.293 523 1HZ LYS 68 2HZ LYS 68 5.009 16.915 -9.595 524 2HZ LYS 68 3HZ LYS 68 5.406 17.107 -8.003 525 3HZ LYS 68 1HZ LYS 68 5.431 18.407 -9.023 526 HA PRO 69 HA PRO 69 8.004 10.477 -7.781 527 1HB PRO 69 1HB PRO 69 5.543 9.415 -6.287 528 2HB PRO 69 2HB PRO 69 7.235 8.877 -6.124 529 1HG PRO 69 1HG PRO 69 6.274 10.628 -4.291 530 2HG PRO 69 2HG PRO 69 7.872 10.953 -5.006 531 1HD PRO 69 1HD PRO 69 5.214 12.298 -5.676 532 2HD PRO 69 2HD PRO 69 6.851 13.024 -5.599 533 H ASN 70 H ASN 70 8.035 9.188 -9.359 534 HA ASN 70 HA ASN 70 5.697 8.094 -10.801 535 1HB ASN 70 1HB ASN 70 5.840 9.471 -12.833 536 2HB ASN 70 2HB ASN 70 5.383 10.428 -11.420 537 1HD2 ASN 70 1HD2 ASN 70 7.961 12.440 -13.140 538 2HD2 ASN 70 2HD2 ASN 70 6.237 11.864 -13.390 539 HA PRO 71 HA PRO 71 9.645 6.966 -13.368 540 1HB PRO 71 1HB PRO 71 12.109 7.298 -12.157 541 2HB PRO 71 2HB PRO 71 11.310 8.589 -13.087 542 1HG PRO 71 1HG PRO 71 11.310 8.207 -10.053 543 2HG PRO 71 2HG PRO 71 11.657 9.701 -10.958 544 1HD PRO 71 1HD PRO 71 9.166 9.187 -9.871 545 2HD PRO 71 2HD PRO 71 9.285 10.055 -11.429 546 HA PRO 72 HA PRO 72 8.354 3.751 -10.422 547 1HB PRO 72 1HB PRO 72 8.348 2.412 -13.177 548 2HB PRO 72 2HB PRO 72 7.131 2.267 -11.886 549 1HG PRO 72 1HG PRO 72 6.598 3.922 -13.958 550 2HG PRO 72 2HG PRO 72 6.303 4.528 -12.307 551 1HD PRO 72 1HD PRO 72 8.708 5.129 -14.118 552 2HD PRO 72 2HD PRO 72 7.786 6.253 -13.067 553 H ILE 73 H ILE 73 8.833 1.161 -11.207 554 HA ILE 73 HA ILE 73 11.703 0.652 -11.798 555 HB ILE 73 HB ILE 73 12.355 -0.357 -9.705 556 1HG1 ILE 73 1HG1 ILE 73 10.066 -1.176 -9.031 557 2HG1 ILE 73 2HG1 ILE 73 10.994 -0.453 -7.714 558 1HG2 ILE 73 2HG2 ILE 73 12.737 2.107 -9.948 559 2HG2 ILE 73 3HG2 ILE 73 11.155 2.440 -9.198 560 3HG2 ILE 73 1HG2 ILE 73 12.453 1.678 -8.240 561 1HD1 ILE 73 2HD1 ILE 73 9.732 1.722 -7.987 562 2HD1 ILE 73 3HD1 ILE 73 8.775 0.996 -9.306 563 3HD1 ILE 73 1HD1 ILE 73 8.632 0.361 -7.645 564 H LYS 74 H LYS 74 12.192 -1.419 -12.093 565 HA LYS 74 HA LYS 74 10.809 -3.055 -13.652 566 1HB LYS 74 1HB LYS 74 12.020 -4.238 -11.090 567 2HB LYS 74 2HB LYS 74 11.746 -5.106 -12.606 568 1HG LYS 74 1HG LYS 74 13.592 -2.671 -12.182 569 2HG LYS 74 2HG LYS 74 14.119 -4.338 -12.441 570 1HD LYS 74 1HD LYS 74 13.053 -4.311 -14.747 571 2HD LYS 74 2HD LYS 74 12.520 -2.646 -14.480 572 1HE LYS 74 1HE LYS 74 14.946 -1.907 -14.250 573 2HE LYS 74 2HE LYS 74 15.478 -3.573 -14.522 574 1HZ LYS 74 2HZ LYS 74 14.418 -3.490 -16.721 575 2HZ LYS 74 3HZ LYS 74 13.923 -1.934 -16.467 576 3HZ LYS 74 1HZ LYS 74 15.535 -2.283 -16.562 577 H ASN 75 H ASN 75 9.165 -4.234 -13.897 578 HA ASN 75 HA ASN 75 6.710 -3.922 -12.561 579 1HB ASN 75 1HB ASN 75 5.977 -6.036 -13.631 580 2HB ASN 75 2HB ASN 75 6.898 -5.009 -14.737 581 1HD2 ASN 75 1HD2 ASN 75 8.336 -8.372 -15.209 582 2HD2 ASN 75 2HD2 ASN 75 6.803 -7.429 -15.561 583 H GLU 76 H GLU 76 6.779 -7.092 -12.263 584 HA GLU 76 HA GLU 76 7.412 -8.587 -10.323 585 1HB GLU 76 1HB GLU 76 7.604 -5.849 -8.973 586 2HB GLU 76 2HB GLU 76 7.391 -7.315 -8.014 587 1HG GLU 76 1HG GLU 76 9.809 -6.803 -8.237 588 2HG GLU 76 2HG GLU 76 9.413 -8.360 -8.954 589 H ALA 77 H ALA 77 6.166 -9.489 -8.847 590 HA ALA 77 HA ALA 77 3.624 -8.642 -7.774 591 1HB ALA 77 3HB ALA 77 3.351 -10.023 -10.537 592 2HB ALA 77 1HB ALA 77 2.009 -9.650 -9.425 593 3HB ALA 77 2HB ALA 77 2.928 -8.326 -10.183 594 H ASP 78 H ASP 78 5.046 -11.279 -9.642 595 HA ASP 78 HA ASP 78 3.980 -13.464 -7.953 596 1HB ASP 78 1HB ASP 78 5.619 -14.888 -9.165 597 2HB ASP 78 2HB ASP 78 4.657 -13.892 -10.264 598 H ASN 79 H ASN 79 7.119 -11.844 -8.245 599 HA ASN 79 HA ASN 79 8.481 -13.206 -6.045 600 1HB ASN 79 1HB ASN 79 10.038 -11.281 -6.069 601 2HB ASN 79 2HB ASN 79 9.689 -11.816 -7.720 602 1HD2 ASN 79 1HD2 ASN 79 9.324 -8.135 -7.815 603 2HD2 ASN 79 2HD2 ASN 79 10.626 -9.414 -7.631 604 H GLY 80 H GLY 80 6.649 -13.410 -4.716 605 1HA GLY 80 1HA GLY 80 6.783 -11.610 -2.383 606 2HA GLY 80 2HA GLY 80 5.285 -11.292 -3.278 607 H LEU 81 H LEU 81 7.012 -14.342 -2.910 608 HA LEU 81 HA LEU 81 6.121 -16.488 -2.212 609 1HB LEU 81 1HB LEU 81 5.727 -14.673 0.241 610 2HB LEU 81 2HB LEU 81 5.703 -16.436 0.266 611 HG LEU 81 HG LEU 81 7.918 -15.789 0.907 612 1HD1 LEU 81 2HD1 LEU 81 7.779 -17.738 -0.673 613 2HD1 LEU 81 3HD1 LEU 81 7.973 -16.638 -2.063 614 3HD1 LEU 81 1HD1 LEU 81 9.306 -16.846 -0.897 615 1HD2 LEU 81 3HD2 LEU 81 7.915 -13.444 0.020 616 2HD2 LEU 81 1HD2 LEU 81 9.395 -14.315 -0.458 617 3HD2 LEU 81 2HD2 LEU 81 8.089 -14.064 -1.643 618 NH1 ARG 82 NH2 ARG 82 4.766 -21.178 -2.208 619 NH2 ARG 82 NH1 ARG 82 4.416 -22.768 -0.622 620 H ARG 82 H ARG 82 4.069 -16.155 0.080 621 HA ARG 82 HA ARG 82 1.491 -15.410 -1.170 622 1HB ARG 82 1HB ARG 82 0.590 -17.692 -1.514 623 2HB ARG 82 2HB ARG 82 1.997 -17.417 -2.554 624 1HG ARG 82 1HG ARG 82 3.478 -18.558 -0.851 625 2HG ARG 82 2HG ARG 82 2.078 -18.829 0.189 626 1HD ARG 82 1HD ARG 82 1.006 -20.254 -1.616 627 2HD ARG 82 2HD ARG 82 2.379 -19.991 -2.677 628 HE ARG 82 HE ARG 82 2.277 -21.763 -0.222 629 1HH1 ARG 82 2HH2 ARG 82 4.403 -20.357 -2.704 630 2HH1 ARG 82 1HH2 ARG 82 5.674 -21.633 -2.353 631 1HH2 ARG 82 1HH1 ARG 82 3.790 -23.161 0.090 632 2HH2 ARG 82 2HH1 ARG 82 5.348 -23.111 -0.878 633 H ASN 83 H ASN 83 0.108 -15.097 0.289 634 HA ASN 83 HA ASN 83 0.122 -16.543 2.965 635 1HB ASN 83 1HB ASN 83 1.874 -14.721 3.092 636 2HB ASN 83 2HB ASN 83 0.620 -13.520 2.744 637 1HD2 ASN 83 1HD2 ASN 83 -0.525 -15.534 6.096 638 2HD2 ASN 83 2HD2 ASN 83 -0.502 -16.262 4.412 639 H THR 84 H THR 84 -1.191 -13.753 3.579 640 HA THR 84 HA THR 84 -4.008 -14.281 2.517 641 HB THR 84 HB THR 84 -2.935 -14.632 5.377 642 HG1 THR 84 HG1 THR 84 -4.334 -16.313 3.568 643 1HG2 THR 84 3HG2 THR 84 -5.852 -14.611 4.373 644 2HG2 THR 84 1HG2 THR 84 -5.327 -15.074 6.022 645 3HG2 THR 84 2HG2 THR 84 -5.102 -13.401 5.445 646 NH1 ARG 85 NH2 ARG 85 -11.227 -13.029 6.681 647 NH2 ARG 85 NH1 ARG 85 -10.086 -14.442 8.050 648 H ARG 85 H ARG 85 -5.537 -12.901 3.208 649 HA ARG 85 HA ARG 85 -5.173 -10.100 3.094 650 1HB ARG 85 1HB ARG 85 -7.294 -9.913 4.436 651 2HB ARG 85 2HB ARG 85 -7.418 -11.194 3.214 652 1HG ARG 85 1HG ARG 85 -6.731 -12.904 4.946 653 2HG ARG 85 2HG ARG 85 -6.626 -11.632 6.165 654 1HD ARG 85 1HD ARG 85 -9.106 -11.150 5.888 655 2HD ARG 85 2HD ARG 85 -9.214 -12.419 4.653 656 HE ARG 85 HE ARG 85 -8.064 -13.609 7.062 657 1HH1 ARG 85 2HH2 ARG 85 -11.183 -12.314 5.947 658 2HH1 ARG 85 1HH2 ARG 85 -12.072 -13.407 7.123 659 1HH2 ARG 85 1HH1 ARG 85 -9.178 -14.805 8.360 660 2HH2 ARG 85 2HH1 ARG 85 -11.011 -14.721 8.396 661 H GLY 86 H GLY 86 -3.671 -9.242 3.854 662 1HA GLY 86 1HA GLY 86 -3.237 -8.093 6.425 663 2HA GLY 86 2HA GLY 86 -2.508 -9.707 6.565 664 H THR 87 H THR 87 -1.995 -9.683 3.622 665 HA THR 87 HA THR 87 0.817 -8.561 3.793 666 HB THR 87 HB THR 87 1.021 -9.427 1.452 667 HG1 THR 87 HG1 THR 87 -1.191 -9.266 0.952 668 1HG2 THR 87 2HG2 THR 87 1.636 -10.834 3.431 669 2HG2 THR 87 3HG2 THR 87 -0.042 -11.432 3.546 670 3HG2 THR 87 1HG2 THR 87 0.960 -11.843 2.125 671 H ILE 88 H ILE 88 1.497 -6.896 3.075 672 HA ILE 88 HA ILE 88 -0.103 -4.948 1.347 673 HB ILE 88 HB ILE 88 0.931 -3.516 2.700 674 1HG1 ILE 88 1HG1 ILE 88 3.379 -2.949 1.895 675 2HG1 ILE 88 2HG1 ILE 88 3.135 -4.257 0.770 676 1HG2 ILE 88 2HG2 ILE 88 1.929 -5.222 4.248 677 2HG2 ILE 88 3HG2 ILE 88 3.305 -5.433 3.129 678 3HG2 ILE 88 1HG2 ILE 88 3.066 -3.877 3.965 679 1HD1 ILE 88 2HD1 ILE 88 1.007 -2.984 -0.071 680 2HD1 ILE 88 3HD1 ILE 88 1.332 -1.725 1.143 681 3HD1 ILE 88 1HD1 ILE 88 2.469 -1.961 -0.210 682 H ALA 89 H ALA 89 0.870 -4.143 -0.468 683 HA ALA 89 HA ALA 89 2.857 -5.723 -2.037 684 1HB ALA 89 2HB ALA 89 0.934 -7.357 -2.095 685 2HB ALA 89 3HB ALA 89 -0.120 -6.099 -2.796 686 3HB ALA 89 1HB ALA 89 1.277 -6.707 -3.717 687 H MET 90 H MET 90 3.737 -4.559 -3.387 688 HA MET 90 HA MET 90 3.119 -1.821 -3.993 689 1HB MET 90 1HB MET 90 4.656 -3.860 -5.711 690 2HB MET 90 2HB MET 90 4.650 -2.115 -5.996 691 1HG MET 90 1HG MET 90 5.568 -3.469 -3.380 692 2HG MET 90 2HG MET 90 6.646 -2.827 -4.635 693 1HE MET 90 1HE MET 90 6.814 -0.227 -5.317 694 2HE MET 90 3HE MET 90 5.051 -0.148 -5.625 695 3HE MET 90 2HE MET 90 5.829 1.059 -4.563 696 H ALA 91 H ALA 91 1.658 -0.907 -5.013 697 HA ALA 91 HA ALA 91 -0.404 -2.264 -6.660 698 1HB ALA 91 2HB ALA 91 -0.878 -0.196 -5.323 699 2HB ALA 91 3HB ALA 91 0.245 0.740 -6.346 700 3HB ALA 91 1HB ALA 91 -1.247 0.061 -7.046 701 NH1 ARG 92 NH2 ARG 92 1.230 -5.261 -14.855 702 NH2 ARG 92 NH1 ARG 92 -1.021 -4.979 -14.702 703 H ARG 92 H ARG 92 -0.512 -0.071 -8.597 704 HA ARG 92 HA ARG 92 1.821 0.091 -10.299 705 1HB ARG 92 1HB ARG 92 1.524 -2.396 -10.479 706 2HB ARG 92 2HB ARG 92 -0.127 -2.162 -11.077 707 1HG ARG 92 1HG ARG 92 0.782 -0.796 -13.023 708 2HG ARG 92 2HG ARG 92 2.407 -1.009 -12.396 709 1HD ARG 92 1HD ARG 92 2.191 -2.573 -14.199 710 2HD ARG 92 2HD ARG 92 2.209 -3.534 -12.718 711 HE ARG 92 HE ARG 92 -0.585 -2.989 -13.432 712 1HH1 ARG 92 2HH2 ARG 92 2.164 -4.907 -14.620 713 2HH1 ARG 92 1HH2 ARG 92 1.011 -6.105 -15.395 714 1HH2 ARG 92 1HH1 ARG 92 -1.803 -4.415 -14.352 715 2HH2 ARG 92 2HH1 ARG 92 -1.084 -5.843 -15.252 716 H THR 93 H THR 93 -0.153 -0.770 -12.563 717 HA THR 93 HA THR 93 -2.429 0.476 -13.082 718 HB THR 93 HB THR 93 -1.837 2.345 -11.537 719 HG1 THR 93 HG1 THR 93 -2.128 3.089 -14.259 720 1HG2 THR 93 1HG2 THR 93 0.616 2.522 -12.097 721 2HG2 THR 93 2HG2 THR 93 0.206 3.109 -13.730 722 3HG2 THR 93 3HG2 THR 93 -0.199 4.096 -12.300 723 H ALA 94 H ALA 94 -1.977 -0.765 -14.803 724 HA ALA 94 HA ALA 94 -1.510 -1.138 -17.116 725 1HB ALA 94 2HB ALA 94 -2.718 1.051 -17.370 726 2HB ALA 94 3HB ALA 94 -1.192 1.940 -17.118 727 3HB ALA 94 1HB ALA 94 -1.403 0.918 -18.563 728 H ASP 95 H ASP 95 0.548 1.632 -16.371 729 HA ASP 95 HA ASP 95 2.848 1.045 -17.863 730 1HB ASP 95 1HB ASP 95 2.838 2.020 -14.941 731 2HB ASP 95 2HB ASP 95 4.195 2.182 -16.069 732 H LYS 96 H LYS 96 3.736 -0.757 -18.169 733 HA LYS 96 HA LYS 96 3.737 -3.144 -16.644 734 1HB LYS 96 1HB LYS 96 4.655 -2.807 -18.996 735 2HB LYS 96 2HB LYS 96 6.104 -2.078 -18.296 736 1HG LYS 96 1HG LYS 96 6.516 -4.476 -18.758 737 2HG LYS 96 2HG LYS 96 6.596 -4.168 -17.021 738 1HD LYS 96 1HD LYS 96 4.201 -5.010 -16.763 739 2HD LYS 96 2HD LYS 96 4.117 -5.269 -18.498 740 1HE LYS 96 1HE LYS 96 4.506 -7.425 -17.532 741 2HE LYS 96 2HE LYS 96 6.006 -6.979 -18.341 742 1HZ LYS 96 2HZ LYS 96 5.487 -6.752 -15.408 743 2HZ LYS 96 3HZ LYS 96 6.413 -7.906 -16.144 744 3HZ LYS 96 1HZ LYS 96 6.902 -6.327 -16.148 745 H ASP 97 H ASP 97 6.947 -2.495 -16.940 746 HA ASP 97 HA ASP 97 7.642 -2.773 -14.104 747 1HB ASP 97 1HB ASP 97 9.253 -1.501 -16.402 748 2HB ASP 97 2HB ASP 97 9.915 -1.987 -14.832 749 H SER 98 H SER 98 6.968 -1.436 -12.680 750 HA SER 98 HA SER 98 7.828 1.418 -12.651 751 1HB SER 98 1HB SER 98 4.822 0.777 -12.921 752 2HB SER 98 2HB SER 98 5.498 2.372 -12.541 753 HG SER 98 HG SER 98 5.074 2.090 -14.756 754 H ALA 99 H ALA 99 5.033 1.549 -11.184 755 HA ALA 99 HA ALA 99 4.334 1.441 -8.893 756 1HB ALA 99 2HB ALA 99 4.888 -1.010 -8.930 757 2HB ALA 99 3HB ALA 99 6.603 -0.645 -8.608 758 3HB ALA 99 1HB ALA 99 5.367 -0.285 -7.375 759 H THR 100 H THR 100 4.879 3.505 -8.796 760 HA THR 100 HA THR 100 7.646 4.471 -8.282 761 HB THR 100 HB THR 100 6.582 6.703 -8.117 762 HG1 THR 100 HG1 THR 100 4.720 5.983 -7.029 763 1HG2 THR 100 3HG2 THR 100 5.394 4.947 -10.368 764 2HG2 THR 100 1HG2 THR 100 5.542 6.725 -10.405 765 3HG2 THR 100 2HG2 THR 100 7.007 5.708 -10.391 766 H SER 101 H SER 101 4.763 3.905 -6.350 767 HA SER 101 HA SER 101 6.298 3.776 -3.819 768 1HB SER 101 1HB SER 101 5.316 5.795 -2.732 769 2HB SER 101 2HB SER 101 6.322 6.245 -4.121 770 HG SER 101 HG SER 101 4.311 7.302 -4.103 771 H GLN 102 H GLN 102 3.132 4.537 -5.214 772 HA GLN 102 HA GLN 102 1.333 3.686 -3.236 773 1HB GLN 102 1HB GLN 102 0.633 4.427 -5.519 774 2HB GLN 102 2HB GLN 102 1.191 2.895 -6.209 775 1HG GLN 102 1HG GLN 102 -0.413 1.637 -4.717 776 2HG GLN 102 2HG GLN 102 -0.967 3.162 -4.017 777 1HE2 GLN 102 2HE2 GLN 102 -2.405 4.211 -7.309 778 2HE2 GLN 102 1HE2 GLN 102 -1.152 4.832 -6.121 779 H PHE 103 H PHE 103 0.479 1.895 -2.468 780 HA PHE 103 HA PHE 103 1.400 -0.839 -3.235 781 1HB PHE 103 1HB PHE 103 2.650 -1.387 -1.252 782 2HB PHE 103 2HB PHE 103 3.392 0.041 -1.967 783 HD1 PHE 103 HD2 PHE 103 0.670 1.574 -0.772 784 HD2 PHE 103 HD1 PHE 103 3.944 -0.595 0.765 785 HE1 PHE 103 HE2 PHE 103 0.427 2.715 1.359 786 HE2 PHE 103 HE1 PHE 103 3.699 0.548 2.895 787 HZ PHE 103 HZ PHE 103 1.938 2.199 3.194 788 H PHE 104 H PHE 104 0.698 -2.462 -1.846 789 HA PHE 104 HA PHE 104 -2.249 -2.024 -1.253 790 1HB PHE 104 1HB PHE 104 -0.490 -4.544 -1.322 791 2HB PHE 104 2HB PHE 104 -2.188 -4.552 -0.861 792 HD1 PHE 104 HD2 PHE 104 -0.043 -3.287 -3.644 793 HD2 PHE 104 HD1 PHE 104 -3.756 -4.917 -2.490 794 HE1 PHE 104 HE2 PHE 104 -0.648 -3.574 -5.986 795 HE2 PHE 104 HE1 PHE 104 -4.359 -5.201 -4.829 796 HZ PHE 104 HZ PHE 104 -2.796 -4.563 -6.574 797 H ILE 105 H ILE 105 -3.198 -2.569 0.464 798 HA ILE 105 HA ILE 105 -1.831 -4.001 2.701 799 HB ILE 105 HB ILE 105 -3.332 -1.408 3.384 800 1HG1 ILE 105 1HG1 ILE 105 -0.341 -2.149 3.462 801 2HG1 ILE 105 2HG1 ILE 105 -1.081 -0.919 2.429 802 1HG2 ILE 105 2HG2 ILE 105 -3.601 -3.346 4.970 803 2HG2 ILE 105 3HG2 ILE 105 -1.833 -3.548 5.037 804 3HG2 ILE 105 1HG2 ILE 105 -2.585 -2.073 5.710 805 1HD1 ILE 105 3HD1 ILE 105 -1.059 -0.869 5.528 806 2HD1 ILE 105 1HD1 ILE 105 -0.037 0.134 4.468 807 3HD1 ILE 105 2HD1 ILE 105 -1.804 0.380 4.495 808 H ASN 106 H ASN 106 -2.915 -5.598 2.098 809 HA ASN 106 HA ASN 106 -5.731 -5.545 1.215 810 1HB ASN 106 1HB ASN 106 -3.977 -7.941 2.016 811 2HB ASN 106 2HB ASN 106 -5.517 -8.028 1.149 812 1HD2 ASN 106 1HD2 ASN 106 -3.628 -7.825 -1.862 813 2HD2 ASN 106 2HD2 ASN 106 -4.796 -8.752 -0.792 814 H VAL 107 H VAL 107 -7.258 -7.093 2.001 815 HA VAL 107 HA VAL 107 -7.346 -7.839 4.878 816 HB VAL 107 HB VAL 107 -9.332 -6.464 5.469 817 1HG1 VAL 107 3HG2 VAL 107 -7.037 -5.638 6.058 818 2HG1 VAL 107 1HG2 VAL 107 -6.929 -4.787 4.494 819 3HG1 VAL 107 2HG2 VAL 107 -8.130 -4.273 5.709 820 1HG2 VAL 107 2HG1 VAL 107 -10.222 -6.133 3.144 821 2HG2 VAL 107 3HG1 VAL 107 -10.018 -4.564 3.967 822 3HG2 VAL 107 1HG1 VAL 107 -8.830 -5.092 2.746 823 H ALA 108 H ALA 108 -7.341 -9.254 2.637 824 HA ALA 108 HA ALA 108 -9.608 -11.038 3.003 825 1HB ALA 108 2HB ALA 108 -10.921 -9.179 1.925 826 2HB ALA 108 3HB ALA 108 -9.845 -9.229 0.504 827 3HB ALA 108 1HB ALA 108 -10.890 -10.623 0.882 828 H ASP 109 H ASP 109 -9.528 -12.831 1.930 829 HA ASP 109 HA ASP 109 -7.150 -14.084 1.329 830 1HB ASP 109 1HB ASP 109 -9.736 -14.505 -0.285 831 2HB ASP 109 2HB ASP 109 -8.393 -15.656 -0.189 832 H ASN 110 H ASN 110 -5.919 -12.368 0.497 833 HA ASN 110 HA ASN 110 -6.081 -11.520 -2.353 834 1HB ASN 110 1HB ASN 110 -4.855 -10.176 -0.644 835 2HB ASN 110 2HB ASN 110 -3.717 -11.503 -0.378 836 1HD2 ASN 110 1HD2 ASN 110 -1.964 -10.996 -3.488 837 2HD2 ASN 110 2HD2 ASN 110 -2.389 -12.191 -2.162 838 H ALA 111 H ALA 111 -5.368 -12.398 -4.041 839 HA ALA 111 HA ALA 111 -3.146 -14.051 -4.564 840 1HB ALA 111 3HB ALA 111 -5.557 -15.837 -3.810 841 2HB ALA 111 1HB ALA 111 -4.026 -16.405 -4.530 842 3HB ALA 111 2HB ALA 111 -4.032 -15.705 -2.890 843 H PHE 112 H PHE 112 -6.637 -14.300 -5.010 844 HA PHE 112 HA PHE 112 -6.552 -14.758 -7.940 845 1HB PHE 112 1HB PHE 112 -9.009 -14.300 -7.796 846 2HB PHE 112 2HB PHE 112 -8.475 -15.484 -6.604 847 HD1 PHE 112 HD2 PHE 112 -9.331 -11.905 -7.044 848 HD2 PHE 112 HD1 PHE 112 -8.651 -15.009 -4.268 849 HE1 PHE 112 HE2 PHE 112 -10.217 -10.511 -5.263 850 HE2 PHE 112 HE1 PHE 112 -9.538 -13.612 -2.493 851 HZ PHE 112 HZ PHE 112 -10.323 -11.363 -2.987 852 H LEU 113 H LEU 113 -4.833 -12.810 -7.413 853 HA LEU 113 HA LEU 113 -5.466 -10.767 -9.319 854 1HB LEU 113 1HB LEU 113 -6.032 -8.806 -8.101 855 2HB LEU 113 2HB LEU 113 -7.121 -10.060 -7.528 856 HG LEU 113 HG LEU 113 -6.416 -8.849 -5.597 857 1HD1 LEU 113 2HD1 LEU 113 -6.383 -11.334 -5.258 858 2HD1 LEU 113 3HD1 LEU 113 -4.656 -11.380 -5.698 859 3HD1 LEU 113 1HD1 LEU 113 -5.177 -10.528 -4.222 860 1HD2 LEU 113 3HD2 LEU 113 -4.455 -7.670 -6.600 861 2HD2 LEU 113 1HD2 LEU 113 -4.045 -8.361 -5.011 862 3HD2 LEU 113 2HD2 LEU 113 -3.487 -9.163 -6.501 863 H ASP 114 H ASP 114 -3.697 -11.779 -6.507 864 HA ASP 114 HA ASP 114 -1.540 -9.952 -6.304 865 1HB ASP 114 1HB ASP 114 -1.826 -12.003 -4.893 866 2HB ASP 114 2HB ASP 114 -1.379 -13.027 -6.269 867 H HIS 115 H HIS 115 -1.653 -12.826 -8.363 868 HA HIS 115 HA HIS 115 -0.462 -11.625 -10.743 869 1HB HIS 115 1HB HIS 115 1.552 -11.285 -9.367 870 2HB HIS 115 2HB HIS 115 1.511 -12.953 -8.783 871 HD2 HIS 115 HD2 HIS 115 4.133 -12.630 -10.004 872 HE1 HIS 115 HE1 HIS 115 2.694 -13.876 -13.704 873 HE2 HIS 115 HE2 HIS 115 4.879 -13.563 -12.377 874 H GLY 116 H GLY 116 -1.403 -12.743 -12.082 875 1HA GLY 116 1HA GLY 116 -0.794 -15.556 -12.654 876 2HA GLY 116 2HA GLY 116 -2.379 -15.485 -11.850 877 H GLN 117 H GLN 117 -3.980 -15.379 -13.107 878 HA GLN 117 HA GLN 117 -5.222 -15.207 -15.172 879 1HB GLN 117 1HB GLN 117 -4.146 -12.346 -14.800 880 2HB GLN 117 2HB GLN 117 -5.563 -12.798 -15.757 881 1HG GLN 117 1HG GLN 117 -5.207 -13.268 -12.730 882 2HG GLN 117 2HG GLN 117 -6.235 -12.032 -13.468 883 1HE2 GLN 117 2HE2 GLN 117 -8.457 -14.699 -14.893 884 2HE2 GLN 117 1HE2 GLN 117 -7.404 -13.342 -15.539 885 NH1 ARG 118 NH2 ARG 118 -6.798 -13.070 -22.356 886 NH2 ARG 118 NH1 ARG 118 -7.720 -15.019 -21.635 887 H ARG 118 H ARG 118 -2.666 -12.861 -15.781 888 HA ARG 118 HA ARG 118 -1.390 -14.464 -17.969 889 1HB ARG 118 1HB ARG 118 -2.984 -11.920 -18.654 890 2HB ARG 118 2HB ARG 118 -1.972 -12.843 -19.778 891 1HG ARG 118 1HG ARG 118 -3.415 -14.884 -19.402 892 2HG ARG 118 2HG ARG 118 -4.413 -13.974 -18.264 893 1HD ARG 118 1HD ARG 118 -5.069 -12.363 -20.122 894 2HD ARG 118 2HD ARG 118 -4.073 -13.283 -21.266 895 HE ARG 118 HE ARG 118 -5.934 -15.156 -20.035 896 1HH1 ARG 118 2HH2 ARG 118 -6.046 -12.379 -22.255 897 2HH1 ARG 118 1HH2 ARG 118 -7.574 -13.040 -23.027 898 1HH2 ARG 118 1HH1 ARG 118 -7.674 -15.814 -20.988 899 2HH2 ARG 118 2HH1 ARG 118 -8.431 -14.854 -22.356 900 H ASP 119 H ASP 119 -1.559 -11.199 -18.612 901 HA ASP 119 HA ASP 119 1.279 -10.687 -18.196 902 1HB ASP 119 1HB ASP 119 -1.055 -8.681 -18.305 903 2HB ASP 119 2HB ASP 119 0.659 -8.271 -18.490 904 H PHE 120 H PHE 120 1.281 -11.719 -16.070 905 HA PHE 120 HA PHE 120 1.317 -11.623 -13.661 906 1HB PHE 120 1HB PHE 120 2.376 -8.862 -14.515 907 2HB PHE 120 2HB PHE 120 2.487 -9.486 -12.869 908 HD1 PHE 120 HD1 PHE 120 2.678 -12.213 -15.101 909 HD2 PHE 120 HD2 PHE 120 4.965 -9.053 -13.497 910 HE1 PHE 120 HE1 PHE 120 4.720 -13.429 -15.609 911 HE2 PHE 120 HE2 PHE 120 7.004 -10.273 -14.003 912 HZ PHE 120 HZ PHE 120 6.883 -12.459 -15.065 913 H GLY 121 H GLY 121 1.131 -9.127 -12.171 914 1HA GLY 121 1HA GLY 121 -1.572 -7.950 -12.474 915 2HA GLY 121 2HA GLY 121 -1.606 -9.237 -11.254 916 OH TYR 122 OH TYR 122 -6.402 -4.761 -10.152 917 H TYR 122 H TYR 122 -1.798 -8.231 -9.476 918 HA TYR 122 HA TYR 122 -0.485 -5.621 -8.837 919 1HB TYR 122 1HB TYR 122 -2.043 -7.540 -7.005 920 2HB TYR 122 2HB TYR 122 -1.619 -5.866 -6.646 921 HD1 TYR 122 HD2 TYR 122 -2.419 -4.073 -8.281 922 HD2 TYR 122 HD1 TYR 122 -3.995 -7.989 -8.247 923 HE1 TYR 122 HE2 TYR 122 -4.401 -3.288 -9.452 924 HE2 TYR 122 HE1 TYR 122 -5.975 -7.199 -9.416 925 HH TYR 122 HH TYR 122 -6.994 -5.503 -10.298 926 H ALA 123 H ALA 123 1.321 -5.287 -7.982 927 HA ALA 123 HA ALA 123 3.342 -7.282 -7.386 928 1HB ALA 123 2HB ALA 123 3.872 -4.875 -7.831 929 2HB ALA 123 3HB ALA 123 3.117 -4.406 -6.283 930 3HB ALA 123 1HB ALA 123 4.591 -5.410 -6.293 931 H VAL 124 H VAL 124 4.391 -6.601 -4.995 932 HA VAL 124 HA VAL 124 2.730 -6.917 -2.641 933 HB VAL 124 HB VAL 124 3.711 -9.575 -3.851 934 1HG1 VAL 124 3HG2 VAL 124 4.237 -9.438 -1.402 935 2HG1 VAL 124 1HG2 VAL 124 2.548 -8.988 -1.050 936 3HG1 VAL 124 2HG2 VAL 124 2.924 -10.607 -1.700 937 1HG2 VAL 124 1HG1 VAL 124 0.893 -8.624 -3.004 938 2HG2 VAL 124 2HG1 VAL 124 1.457 -8.845 -4.682 939 3HG2 VAL 124 3HG1 VAL 124 1.300 -10.255 -3.603 940 H PHE 125 H PHE 125 3.917 -6.531 -0.978 941 HA PHE 125 HA PHE 125 6.645 -7.651 -0.583 942 1HB PHE 125 1HB PHE 125 7.930 -5.598 -0.795 943 2HB PHE 125 2HB PHE 125 7.017 -5.763 -2.298 944 HD1 PHE 125 HD2 PHE 125 4.677 -4.601 -2.318 945 HD2 PHE 125 HD1 PHE 125 7.649 -3.683 0.531 946 HE1 PHE 125 HE2 PHE 125 3.499 -2.553 -1.746 947 HE2 PHE 125 HE1 PHE 125 6.470 -1.636 1.099 948 HZ PHE 125 HZ PHE 125 4.376 -1.090 -0.010 949 H GLY 126 H GLY 126 3.998 -7.328 0.776 950 1HA GLY 126 1HA GLY 126 5.004 -6.159 3.423 951 2HA GLY 126 2HA GLY 126 3.525 -5.535 2.688 952 H LYS 127 H LYS 127 3.186 -6.166 4.822 953 HA LYS 127 HA LYS 127 1.269 -8.218 5.161 954 1HB LYS 127 1HB LYS 127 3.115 -9.853 4.756 955 2HB LYS 127 2HB LYS 127 4.001 -9.206 6.152 956 1HG LYS 127 1HG LYS 127 2.077 -9.820 7.670 957 2HG LYS 127 2HG LYS 127 1.154 -10.360 6.279 958 1HD LYS 127 1HD LYS 127 1.914 -12.334 7.306 959 2HD LYS 127 2HD LYS 127 2.873 -12.210 5.852 960 1HE LYS 127 1HE LYS 127 3.878 -11.339 8.664 961 2HE LYS 127 2HE LYS 127 4.045 -12.977 8.041 962 1HZ LYS 127 3HZ LYS 127 5.388 -12.123 6.209 963 2HZ LYS 127 1HZ LYS 127 5.247 -10.575 6.767 964 3HZ LYS 127 2HZ LYS 127 6.048 -11.707 7.665 965 H VAL 128 H VAL 128 0.152 -7.648 6.703 966 HA VAL 128 HA VAL 128 0.875 -5.569 8.635 967 HB VAL 128 HB VAL 128 -1.437 -7.587 8.744 968 1HG1 VAL 128 3HG2 VAL 128 -0.970 -6.469 10.945 969 2HG1 VAL 128 1HG2 VAL 128 -0.999 -4.872 10.156 970 3HG1 VAL 128 2HG2 VAL 128 -2.487 -5.854 10.239 971 1HG2 VAL 128 2HG1 VAL 128 -1.374 -6.229 6.627 972 2HG2 VAL 128 3HG1 VAL 128 -2.728 -5.711 7.666 973 3HG2 VAL 128 1HG1 VAL 128 -1.242 -4.729 7.580 974 H VAL 129 H VAL 129 1.830 -5.599 10.403 975 HA VAL 129 HA VAL 129 2.672 -8.208 11.752 976 HB VAL 129 HB VAL 129 4.255 -6.794 12.988 977 1HG1 VAL 129 3HG2 VAL 129 4.873 -7.726 10.741 978 2HG1 VAL 129 1HG2 VAL 129 4.231 -6.268 9.944 979 3HG1 VAL 129 2HG2 VAL 129 5.661 -6.148 11.005 980 1HG2 VAL 129 2HG1 VAL 129 2.871 -4.704 13.132 981 2HG2 VAL 129 3HG1 VAL 129 4.468 -4.351 12.421 982 3HG2 VAL 129 1HG1 VAL 129 3.028 -4.462 11.373 983 H LYS 130 H LYS 130 1.081 -5.114 12.413 984 HA LYS 130 HA LYS 130 -0.797 -6.180 14.382 985 1HB LYS 130 1HB LYS 130 1.297 -6.534 15.714 986 2HB LYS 130 2HB LYS 130 1.718 -4.824 15.522 987 1HG LYS 130 1HG LYS 130 -0.414 -4.150 16.696 988 2HG LYS 130 2HG LYS 130 -0.898 -5.833 16.785 989 1HD LYS 130 1HD LYS 130 -0.153 -5.300 18.951 990 2HD LYS 130 2HD LYS 130 1.102 -6.330 18.308 991 1HE LYS 130 1HE LYS 130 1.279 -3.225 18.378 992 2HE LYS 130 2HE LYS 130 1.806 -4.255 19.704 993 1HZ LYS 130 1HZ LYS 130 3.422 -5.301 18.224 994 2HZ LYS 130 2HZ LYS 130 2.950 -4.344 16.962 995 3HZ LYS 130 3HZ LYS 130 3.656 -3.667 18.294 996 H GLY 131 H GLY 131 -1.917 -4.889 12.953 997 1HA GLY 131 1HA GLY 131 -2.791 -2.377 14.074 998 2HA GLY 131 2HA GLY 131 -1.645 -1.941 12.798 999 H MET 132 H MET 132 -3.266 -4.865 12.172 1000 HA MET 132 HA MET 132 -4.500 -3.963 9.730 1001 1HB MET 132 1HB MET 132 -4.076 -6.391 10.450 1002 2HB MET 132 2HB MET 132 -5.527 -6.293 11.459 1003 1HG MET 132 1HG MET 132 -6.078 -7.250 9.223 1004 2HG MET 132 2HG MET 132 -6.886 -5.674 9.402 1005 1HE MET 132 3HE MET 132 -7.099 -5.786 6.620 1006 2HE MET 132 2HE MET 132 -5.667 -5.875 5.552 1007 3HE MET 132 1HE MET 132 -6.115 -7.284 6.557 1008 H ASP 133 H ASP 133 -5.921 -4.552 12.912 1009 HA ASP 133 HA ASP 133 -8.627 -3.842 12.578 1010 1HB ASP 133 1HB ASP 133 -7.577 -4.457 14.768 1011 2HB ASP 133 2HB ASP 133 -6.767 -2.881 14.836 1012 H VAL 134 H VAL 134 -5.992 -1.593 13.296 1013 HA VAL 134 HA VAL 134 -7.269 0.940 13.058 1014 HB VAL 134 HB VAL 134 -4.538 0.020 11.991 1015 1HG1 VAL 134 3HG2 VAL 134 -5.256 2.089 10.779 1016 2HG1 VAL 134 1HG2 VAL 134 -5.610 2.895 12.331 1017 3HG1 VAL 134 2HG2 VAL 134 -3.932 2.449 11.915 1018 1HG2 VAL 134 2HG1 VAL 134 -4.908 -0.162 14.477 1019 2HG2 VAL 134 3HG1 VAL 134 -3.729 1.124 14.104 1020 3HG2 VAL 134 1HG1 VAL 134 -5.406 1.548 14.535 1021 H ALA 135 H ALA 135 -5.637 -0.755 10.427 1022 HA ALA 135 HA ALA 135 -6.679 0.749 8.197 1023 1HB ALA 135 2HB ALA 135 -4.898 -1.003 7.957 1024 2HB ALA 135 3HB ALA 135 -6.088 -2.284 8.310 1025 3HB ALA 135 1HB ALA 135 -6.240 -1.307 6.825 1026 H ASP 136 H ASP 136 -7.926 -2.143 9.784 1027 HA ASP 136 HA ASP 136 -10.339 -2.580 8.246 1028 1HB ASP 136 1HB ASP 136 -9.918 -2.930 11.279 1029 2HB ASP 136 2HB ASP 136 -11.243 -3.640 10.340 1030 H LYS 137 H LYS 137 -10.198 -1.151 11.461 1031 HA LYS 137 HA LYS 137 -12.665 0.141 11.681 1032 1HB LYS 137 1HB LYS 137 -10.819 0.248 13.390 1033 2HB LYS 137 2HB LYS 137 -9.958 1.425 12.388 1034 1HG LYS 137 1HG LYS 137 -12.765 1.750 13.626 1035 2HG LYS 137 2HG LYS 137 -11.297 2.579 14.153 1036 1HD LYS 137 1HD LYS 137 -11.141 3.730 11.894 1037 2HD LYS 137 2HD LYS 137 -12.603 2.889 11.364 1038 1HE LYS 137 1HE LYS 137 -13.929 4.023 13.219 1039 2HE LYS 137 2HE LYS 137 -12.466 4.869 13.745 1040 1HZ LYS 137 3HZ LYS 137 -13.726 5.139 11.057 1041 2HZ LYS 137 1HZ LYS 137 -13.806 6.245 12.282 1042 3HZ LYS 137 2HZ LYS 137 -12.360 5.929 11.548 1043 H ILE 138 H ILE 138 -9.795 1.427 10.068 1044 HA ILE 138 HA ILE 138 -10.931 3.900 9.011 1045 HB ILE 138 HB ILE 138 -8.854 2.048 7.698 1046 1HG1 ILE 138 1HG1 ILE 138 -8.621 4.392 9.677 1047 2HG1 ILE 138 2HG1 ILE 138 -8.179 2.710 9.990 1048 1HG2 ILE 138 2HG2 ILE 138 -9.866 3.751 6.144 1049 2HG2 ILE 138 3HG2 ILE 138 -9.504 5.046 7.316 1050 3HG2 ILE 138 1HG2 ILE 138 -8.172 4.165 6.522 1051 1HD1 ILE 138 3HD1 ILE 138 -6.856 4.542 7.867 1052 2HD1 ILE 138 1HD1 ILE 138 -6.138 4.081 9.431 1053 3HD1 ILE 138 2HD1 ILE 138 -6.400 2.845 8.172 1054 H SER 139 H SER 139 -10.426 0.753 7.492 1055 HA SER 139 HA SER 139 -12.202 1.229 5.197 1056 1HB SER 139 1HB SER 139 -11.922 -1.205 4.773 1057 2HB SER 139 2HB SER 139 -10.368 -0.425 5.132 1058 HG SER 139 HG SER 139 -10.676 -2.353 6.286 1059 H GLN 140 H GLN 140 -13.142 1.222 8.182 1060 HA GLN 140 HA GLN 140 -15.706 -0.427 7.807 1061 1HB GLN 140 1HB GLN 140 -14.769 1.080 10.318 1062 2HB GLN 140 2HB GLN 140 -16.132 -0.037 10.165 1063 1HG GLN 140 1HG GLN 140 -13.140 -0.658 10.030 1064 2HG GLN 140 2HG GLN 140 -14.370 -1.421 11.045 1065 1HE2 GLN 140 2HE2 GLN 140 -13.649 -2.730 7.221 1066 2HE2 GLN 140 1HE2 GLN 140 -12.641 -1.547 8.177 1067 H VAL 141 H VAL 141 -14.559 2.771 8.760 1068 HA VAL 141 HA VAL 141 -17.055 4.216 8.812 1069 HB VAL 141 HB VAL 141 -15.713 6.235 8.291 1070 1HG1 VAL 141 3HG2 VAL 141 -15.639 5.250 10.599 1071 2HG1 VAL 141 1HG2 VAL 141 -14.259 4.224 10.131 1072 3HG1 VAL 141 2HG2 VAL 141 -14.074 5.998 10.184 1073 1HG2 VAL 141 2HG1 VAL 141 -14.293 5.247 6.468 1074 2HG2 VAL 141 3HG1 VAL 141 -13.271 5.992 7.725 1075 3HG2 VAL 141 1HG1 VAL 141 -13.457 4.218 7.660 1076 HA PRO 142 HA PRO 142 -18.923 3.919 4.836 1077 1HB PRO 142 1HB PRO 142 -19.388 6.848 5.610 1078 2HB PRO 142 2HB PRO 142 -20.564 5.697 4.927 1079 1HG PRO 142 1HG PRO 142 -20.621 6.157 7.599 1080 2HG PRO 142 2HG PRO 142 -20.706 4.470 7.032 1081 1HD PRO 142 1HD PRO 142 -18.274 5.936 8.181 1082 2HD PRO 142 2HD PRO 142 -18.798 4.243 8.455 1083 H THR 143 H THR 143 -19.155 5.525 2.956 1084 HA THR 143 HA THR 143 -16.720 7.180 2.288 1085 HB THR 143 HB THR 143 -16.355 5.758 0.163 1086 HG1 THR 143 HG1 THR 143 -16.917 3.576 0.426 1087 1HG2 THR 143 2HG2 THR 143 -14.732 5.835 2.023 1088 2HG2 THR 143 3HG2 THR 143 -15.609 4.523 2.872 1089 3HG2 THR 143 1HG2 THR 143 -14.801 4.204 1.299 1090 H HIS 144 H HIS 144 -16.781 6.569 -0.302 1091 HA HIS 144 HA HIS 144 -19.265 6.571 -1.679 1092 1HB HIS 144 1HB HIS 144 -19.764 8.905 -2.275 1093 2HB HIS 144 2HB HIS 144 -19.859 8.665 -0.533 1094 HD2 HIS 144 HD2 HIS 144 -16.219 8.812 -1.435 1095 HE1 HIS 144 HE1 HIS 144 -17.224 12.762 -0.621 1096 HE2 HIS 144 HE2 HIS 144 -15.200 11.219 -0.989 1097 H ASP 145 H ASP 145 -19.234 6.645 -3.724 1098 HA ASP 145 HA ASP 145 -16.657 6.592 -5.263 1099 1HB ASP 145 1HB ASP 145 -19.587 6.769 -6.203 1100 2HB ASP 145 2HB ASP 145 -18.188 6.484 -7.253 1101 H VAL 146 H VAL 146 -15.616 8.327 -5.535 1102 HA VAL 146 HA VAL 146 -16.739 10.960 -4.895 1103 HB VAL 146 HB VAL 146 -14.049 10.743 -6.266 1104 1HG1 VAL 146 3HG2 VAL 146 -14.962 12.918 -5.357 1105 2HG1 VAL 146 1HG2 VAL 146 -15.140 12.168 -3.749 1106 3HG1 VAL 146 2HG2 VAL 146 -13.515 12.402 -4.443 1107 1HG2 VAL 146 1HG1 VAL 146 -14.617 9.692 -3.431 1108 2HG2 VAL 146 2HG1 VAL 146 -14.061 8.717 -4.822 1109 3HG2 VAL 146 3HG1 VAL 146 -12.998 9.976 -4.136 1110 H GLY 147 H GLY 147 -15.224 12.542 -6.576 1111 1HA GLY 147 1HA GLY 147 -17.044 13.085 -8.884 1112 2HA GLY 147 2HA GLY 147 -15.458 13.836 -8.616 1113 HA PRO 148 HA PRO 148 -14.047 11.126 -11.949 1114 1HB PRO 148 1HB PRO 148 -11.612 12.372 -12.171 1115 2HB PRO 148 2HB PRO 148 -13.115 13.199 -12.643 1116 1HG PRO 148 1HG PRO 148 -11.629 13.440 -9.967 1117 2HG PRO 148 2HG PRO 148 -12.144 14.768 -11.037 1118 1HD PRO 148 1HD PRO 148 -13.688 13.946 -8.870 1119 2HD PRO 148 2HD PRO 148 -14.463 14.516 -10.384 1120 OH TYR 149 OH TYR 149 -7.430 11.574 -11.357 1121 H TYR 149 H TYR 149 -14.095 10.407 -9.087 1122 HA TYR 149 HA TYR 149 -12.027 8.286 -9.066 1123 1HB TYR 149 1HB TYR 149 -11.654 10.658 -7.127 1124 2HB TYR 149 2HB TYR 149 -10.794 9.120 -7.022 1125 HD1 TYR 149 HD2 TYR 149 -10.148 8.447 -9.721 1126 HD2 TYR 149 HD1 TYR 149 -10.131 12.245 -7.880 1127 HE1 TYR 149 HE2 TYR 149 -8.468 9.207 -11.301 1128 HE2 TYR 149 HE1 TYR 149 -8.453 13.005 -9.462 1129 HH TYR 149 HH TYR 149 -7.213 12.489 -11.167 1130 H GLN 150 H GLN 150 -13.382 6.856 -8.558 1131 HA GLN 150 HA GLN 150 -15.400 7.037 -6.346 1132 1HB GLN 150 1HB GLN 150 -14.234 4.589 -7.801 1133 2HB GLN 150 2HB GLN 150 -15.634 4.583 -6.719 1134 1HG GLN 150 1HG GLN 150 -16.812 6.237 -8.230 1135 2HG GLN 150 2HG GLN 150 -15.416 6.237 -9.314 1136 1HE2 GLN 150 2HE2 GLN 150 -17.464 2.628 -9.015 1137 2HE2 GLN 150 1HE2 GLN 150 -17.071 3.630 -7.529 1138 H ASN 151 H ASN 151 -15.141 4.832 -4.968 1139 HA ASN 151 HA ASN 151 -14.168 4.123 -2.875 1140 1HB ASN 151 1HB ASN 151 -11.986 3.031 -3.219 1141 2HB ASN 151 2HB ASN 151 -13.051 2.712 -4.596 1142 1HD2 ASN 151 1HD2 ASN 151 -9.847 3.683 -6.141 1143 2HD2 ASN 151 2HD2 ASN 151 -10.620 2.294 -5.226 1144 H VAL 152 H VAL 152 -14.509 6.286 -2.111 1145 HA VAL 152 HA VAL 152 -11.995 7.166 -0.707 1146 HB VAL 152 HB VAL 152 -13.616 9.147 -2.407 1147 1HG1 VAL 152 3HG2 VAL 152 -12.807 10.089 -0.223 1148 2HG1 VAL 152 1HG2 VAL 152 -11.152 9.529 -0.578 1149 3HG1 VAL 152 2HG2 VAL 152 -11.900 10.798 -1.585 1150 1HG2 VAL 152 2HG1 VAL 152 -12.075 7.705 -3.780 1151 2HG2 VAL 152 3HG1 VAL 152 -11.463 9.378 -3.702 1152 3HG2 VAL 152 1HG1 VAL 152 -10.716 8.106 -2.699 1153 HA PRO 153 HA PRO 153 -15.312 6.708 2.231 1154 1HB PRO 153 1HB PRO 153 -12.832 7.525 3.833 1155 2HB PRO 153 2HB PRO 153 -14.013 6.250 4.218 1156 1HG PRO 153 1HG PRO 153 -11.635 5.525 3.127 1157 2HG PRO 153 2HG PRO 153 -13.123 4.790 2.480 1158 1HD PRO 153 1HD PRO 153 -11.483 7.074 1.258 1159 2HD PRO 153 2HD PRO 153 -12.267 5.687 0.433 1160 H SER 154 H SER 154 -16.665 8.280 2.111 1161 HA SER 154 HA SER 154 -16.387 11.085 1.880 1162 1HB SER 154 1HB SER 154 -18.591 9.938 1.912 1163 2HB SER 154 2HB SER 154 -18.395 9.535 3.626 1164 HG SER 154 HG SER 154 -19.632 11.413 3.298 1165 H LYS 155 H LYS 155 -16.723 9.285 4.889 1166 HA LYS 155 HA LYS 155 -15.355 11.350 6.619 1167 1HB LYS 155 1HB LYS 155 -15.916 8.355 7.064 1168 2HB LYS 155 2HB LYS 155 -15.293 9.478 8.285 1169 1HG LYS 155 1HG LYS 155 -17.357 10.916 8.013 1170 2HG LYS 155 2HG LYS 155 -17.976 9.802 6.794 1171 1HD LYS 155 1HD LYS 155 -18.025 7.934 8.540 1172 2HD LYS 155 2HD LYS 155 -17.389 9.056 9.732 1173 1HE LYS 155 1HE LYS 155 -19.746 8.917 10.148 1174 2HE LYS 155 2HE LYS 155 -19.469 10.518 9.467 1175 1HZ LYS 155 2HZ LYS 155 -20.502 8.151 7.964 1176 2HZ LYS 155 3HZ LYS 155 -21.397 9.441 8.477 1177 3HZ LYS 155 1HZ LYS 155 -20.249 9.646 7.306 1178 HA PRO 156 HA PRO 156 -11.869 9.776 4.091 1179 1HB PRO 156 1HB PRO 156 -10.435 12.153 4.227 1180 2HB PRO 156 2HB PRO 156 -11.840 11.909 3.166 1181 1HG PRO 156 1HG PRO 156 -11.813 13.216 5.938 1182 2HG PRO 156 2HG PRO 156 -12.523 13.868 4.440 1183 1HD PRO 156 1HD PRO 156 -14.092 12.546 6.283 1184 2HD PRO 156 2HD PRO 156 -14.380 12.286 4.531 1185 H VAL 157 H VAL 157 -9.411 10.817 4.645 1186 HA VAL 157 HA VAL 157 -8.631 10.147 7.496 1187 HB VAL 157 HB VAL 157 -7.726 8.454 5.089 1188 1HG1 VAL 157 3HG2 VAL 157 -5.914 8.848 6.781 1189 2HG1 VAL 157 1HG2 VAL 157 -6.997 8.303 8.088 1190 3HG1 VAL 157 2HG2 VAL 157 -6.464 7.152 6.833 1191 1HG2 VAL 157 2HG1 VAL 157 -10.047 7.875 5.865 1192 2HG2 VAL 157 3HG1 VAL 157 -8.894 6.580 6.281 1193 3HG2 VAL 157 1HG1 VAL 157 -9.454 7.710 7.540 1194 H VAL 158 H VAL 158 -6.602 10.563 8.000 1195 HA VAL 158 HA VAL 158 -4.674 11.774 6.002 1196 HB VAL 158 HB VAL 158 -5.706 13.324 8.452 1197 1HG1 VAL 158 3HG2 VAL 158 -3.217 13.520 8.147 1198 2HG1 VAL 158 1HG2 VAL 158 -3.448 13.963 6.437 1199 3HG1 VAL 158 2HG2 VAL 158 -4.021 15.055 7.726 1200 1HG2 VAL 158 2HG1 VAL 158 -7.207 13.438 6.432 1201 2HG2 VAL 158 3HG1 VAL 158 -6.399 15.005 6.705 1202 3HG2 VAL 158 1HG1 VAL 158 -5.820 13.914 5.418 1203 H ILE 159 H ILE 159 -2.901 10.990 6.298 1204 HA ILE 159 HA ILE 159 -2.285 9.159 8.506 1205 HB ILE 159 HB ILE 159 -0.500 10.352 6.319 1206 1HG1 ILE 159 1HG1 ILE 159 -2.086 7.737 6.699 1207 2HG1 ILE 159 2HG1 ILE 159 -2.435 9.011 5.524 1208 1HG2 ILE 159 3HG2 ILE 159 -0.007 8.003 8.268 1209 2HG2 ILE 159 1HG2 ILE 159 1.045 8.453 6.898 1210 3HG2 ILE 159 2HG2 ILE 159 0.857 9.563 8.280 1211 1HD1 ILE 159 3HD1 ILE 159 0.148 7.309 5.602 1212 2HD1 ILE 159 1HD1 ILE 159 -1.195 7.113 4.441 1213 3HD1 ILE 159 2HD1 ILE 159 -0.195 8.594 4.410 1214 H LEU 160 H LEU 160 -1.244 9.274 10.156 1215 HA LEU 160 HA LEU 160 -0.602 11.961 11.413 1216 1HB LEU 160 1HB LEU 160 -0.465 9.115 12.575 1217 2HB LEU 160 2HB LEU 160 -0.249 10.618 13.483 1218 HG LEU 160 HG LEU 160 -2.769 9.821 11.908 1219 1HD1 LEU 160 2HD1 LEU 160 -2.469 8.527 14.043 1220 2HD1 LEU 160 3HD1 LEU 160 -2.270 10.048 14.951 1221 3HD1 LEU 160 1HD1 LEU 160 -3.833 9.665 14.180 1222 1HD2 LEU 160 3HD2 LEU 160 -2.374 12.301 11.882 1223 2HD2 LEU 160 1HD2 LEU 160 -3.776 11.896 12.907 1224 3HD2 LEU 160 2HD2 LEU 160 -2.213 12.306 13.658 1225 H SER 161 H SER 161 0.953 8.852 10.782 1226 HA SER 161 HA SER 161 3.589 10.101 10.111 1227 1HB SER 161 1HB SER 161 3.476 10.310 12.630 1228 2HB SER 161 2HB SER 161 3.285 8.551 12.759 1229 HG SER 161 HG SER 161 5.444 9.232 12.968 1230 H ALA 162 H ALA 162 5.273 8.605 9.868 1231 HA ALA 162 HA ALA 162 4.719 5.687 9.438 1232 1HB ALA 162 3HB ALA 162 5.054 7.545 6.983 1233 2HB ALA 162 1HB ALA 162 5.005 5.763 6.946 1234 3HB ALA 162 2HB ALA 162 3.559 6.682 7.431 1235 H LYS 163 H LYS 163 6.453 4.724 9.816 1236 HA LYS 163 HA LYS 163 9.147 5.492 8.816 1237 1HB LYS 163 1HB LYS 163 10.135 6.034 11.034 1238 2HB LYS 163 2HB LYS 163 8.891 7.212 10.584 1239 1HG LYS 163 1HG LYS 163 7.189 5.897 11.926 1240 2HG LYS 163 2HG LYS 163 8.437 4.772 12.431 1241 1HD LYS 163 1HD LYS 163 8.401 7.798 13.058 1242 2HD LYS 163 2HD LYS 163 7.813 6.564 14.147 1243 1HE LYS 163 1HE LYS 163 10.760 6.810 13.225 1244 2HE LYS 163 2HE LYS 163 10.108 7.449 14.729 1245 1HZ LYS 163 3HZ LYS 163 9.542 5.181 15.411 1246 2HZ LYS 163 1HZ LYS 163 10.150 4.562 14.006 1247 3HZ LYS 163 2HZ LYS 163 11.155 5.311 15.082 1248 H VAL 164 H VAL 164 10.046 3.723 8.451 1249 HA VAL 164 HA VAL 164 9.130 1.142 9.477 1250 HB VAL 164 HB VAL 164 11.067 0.238 8.278 1251 1HG1 VAL 164 3HG2 VAL 164 9.022 0.906 6.987 1252 2HG1 VAL 164 1HG2 VAL 164 9.682 2.547 6.766 1253 3HG1 VAL 164 2HG2 VAL 164 10.487 1.152 6.001 1254 1HG2 VAL 164 2HG1 VAL 164 12.757 1.977 8.933 1255 2HG2 VAL 164 3HG1 VAL 164 12.713 1.790 7.160 1256 3HG2 VAL 164 1HG1 VAL 164 11.917 3.189 7.931 1257 H LEU 165 H LEU 165 9.677 0.005 11.019 1258 HA LEU 165 HA LEU 165 11.426 1.067 13.238 1259 1HB LEU 165 1HB LEU 165 9.259 -0.067 13.744 1260 2HB LEU 165 2HB LEU 165 9.853 -1.567 13.015 1261 HG LEU 165 HG LEU 165 11.739 -1.647 14.649 1262 1HD1 LEU 165 2HD1 LEU 165 12.027 0.827 14.966 1263 2HD1 LEU 165 3HD1 LEU 165 10.468 0.913 15.826 1264 3HD1 LEU 165 1HD1 LEU 165 11.831 0.010 16.537 1265 1HD2 LEU 165 3HD2 LEU 165 9.560 -2.744 15.263 1266 2HD2 LEU 165 1HD2 LEU 165 10.375 -2.102 16.712 1267 3HD2 LEU 165 2HD2 LEU 165 8.993 -1.225 16.006 1268 HA PRO 166 HA PRO 166 15.214 -0.585 11.605 1269 1HB PRO 166 1HB PRO 166 15.660 -0.327 14.625 1270 2HB PRO 166 2HB PRO 166 16.760 0.157 13.310 1271 1HG PRO 166 1HG PRO 166 15.274 2.078 14.521 1272 2HG PRO 166 2HG PRO 166 15.364 2.075 12.742 1273 1HD PRO 166 1HD PRO 166 13.067 1.059 14.499 1274 2HD PRO 166 2HD PRO 166 12.983 1.976 12.959 Start of MODEL 3 Raw file had 1274 H/Q atoms Start of MODEL 3 1 1H ALA 1 3H ALA 1 9.222 -12.815 11.969 2 2H ALA 1 1H ALA 1 8.615 -14.159 12.712 3 3H ALA 1 2H ALA 1 7.635 -13.226 11.765 4 HA ALA 1 HA ALA 1 7.816 -11.349 13.290 5 1HB ALA 1 2HB ALA 1 5.932 -12.986 13.598 6 2HB ALA 1 3HB ALA 1 6.964 -14.001 14.640 7 3HB ALA 1 1HB ALA 1 6.490 -12.367 15.173 8 H LYS 2 H LYS 2 9.378 -10.387 14.129 9 HA LYS 2 HA LYS 2 10.639 -10.294 16.439 10 1HB LYS 2 1HB LYS 2 10.631 -12.797 16.601 11 2HB LYS 2 2HB LYS 2 11.735 -12.898 15.220 12 1HG LYS 2 1HG LYS 2 13.457 -11.541 16.493 13 2HG LYS 2 2HG LYS 2 12.330 -11.371 17.829 14 1HD LYS 2 1HD LYS 2 13.882 -13.058 18.490 15 2HD LYS 2 2HD LYS 2 12.358 -13.883 18.192 16 1HE LYS 2 1HE LYS 2 13.233 -14.646 15.912 17 2HE LYS 2 2HE LYS 2 14.750 -13.785 16.214 18 1HZ LYS 2 2HZ LYS 2 15.109 -15.227 18.153 19 2HZ LYS 2 3HZ LYS 2 13.692 -16.027 17.869 20 3HZ LYS 2 1HZ LYS 2 14.929 -16.127 16.779 21 H GLY 3 H GLY 3 11.309 -8.489 15.567 22 1HA GLY 3 1HA GLY 3 12.780 -6.954 14.446 23 2HA GLY 3 2HA GLY 3 14.031 -8.197 14.625 24 H ASP 4 H ASP 4 11.705 -6.713 12.631 25 HA ASP 4 HA ASP 4 12.942 -7.665 10.097 26 1HB ASP 4 1HB ASP 4 10.129 -8.680 10.849 27 2HB ASP 4 2HB ASP 4 10.826 -8.761 9.223 28 HA PRO 5 HA PRO 5 11.674 -3.725 8.696 29 1HB PRO 5 1HB PRO 5 11.276 -5.472 6.209 30 2HB PRO 5 2HB PRO 5 12.073 -3.882 6.311 31 1HG PRO 5 1HG PRO 5 13.632 -6.101 6.229 32 2HG PRO 5 2HG PRO 5 14.019 -4.841 7.428 33 1HD PRO 5 1HD PRO 5 12.576 -7.500 7.909 34 2HD PRO 5 2HD PRO 5 13.788 -6.676 8.943 35 H HIS 6 H HIS 6 9.888 -2.803 8.996 36 HA HIS 6 HA HIS 6 7.270 -3.717 7.845 37 1HB HIS 6 1HB HIS 6 7.655 -3.674 10.905 38 2HB HIS 6 2HB HIS 6 6.143 -3.999 10.047 39 HD2 HIS 6 HD2 HIS 6 9.007 -5.531 8.165 40 HE1 HIS 6 HE1 HIS 6 7.657 -8.603 10.627 41 HE2 HIS 6 HE2 HIS 6 9.201 -8.144 8.620 42 H VAL 7 H VAL 7 6.465 -2.043 7.125 43 HA VAL 7 HA VAL 7 7.083 0.728 7.877 44 HB VAL 7 HB VAL 7 6.047 0.102 5.663 45 1HG1 VAL 7 3HG2 VAL 7 4.532 -1.706 6.538 46 2HG1 VAL 7 1HG2 VAL 7 3.550 -0.481 7.382 47 3HG1 VAL 7 2HG2 VAL 7 3.619 -0.496 5.598 48 1HG2 VAL 7 1HG1 VAL 7 4.351 1.994 7.409 49 2HG2 VAL 7 2HG1 VAL 7 5.838 2.435 6.531 50 3HG2 VAL 7 3HG1 VAL 7 4.375 1.968 5.626 51 H LEU 8 H LEU 8 6.300 2.012 9.289 52 HA LEU 8 HA LEU 8 3.630 1.411 10.684 53 1HB LEU 8 1HB LEU 8 6.185 2.446 12.042 54 2HB LEU 8 2HB LEU 8 4.562 2.774 12.654 55 HG LEU 8 HG LEU 8 4.070 0.261 12.535 56 1HD1 LEU 8 2HD1 LEU 8 5.982 -0.387 11.039 57 2HD1 LEU 8 3HD1 LEU 8 7.147 0.125 12.289 58 3HD1 LEU 8 1HD1 LEU 8 6.066 -1.262 12.590 59 1HD2 LEU 8 3HD2 LEU 8 4.486 1.507 14.657 60 2HD2 LEU 8 1HD2 LEU 8 5.180 -0.131 14.749 61 3HD2 LEU 8 2HD2 LEU 8 6.244 1.279 14.474 62 H LEU 9 H LEU 9 2.303 2.752 10.514 63 HA LEU 9 HA LEU 9 2.948 5.733 10.139 64 1HB LEU 9 1HB LEU 9 0.695 4.170 8.734 65 2HB LEU 9 2HB LEU 9 0.762 5.928 8.872 66 HG LEU 9 HG LEU 9 3.024 5.932 7.744 67 1HD1 LEU 9 2HD1 LEU 9 3.711 3.567 8.234 68 2HD1 LEU 9 3HD1 LEU 9 2.380 2.955 7.217 69 3HD1 LEU 9 1HD1 LEU 9 3.719 3.873 6.479 70 1HD2 LEU 9 3HD2 LEU 9 0.910 6.386 6.468 71 2HD2 LEU 9 1HD2 LEU 9 2.090 5.525 5.448 72 3HD2 LEU 9 2HD2 LEU 9 0.710 4.642 6.153 73 H THR 10 H THR 10 0.662 6.796 10.430 74 HA THR 10 HA THR 10 -1.019 5.647 12.615 75 HB THR 10 HB THR 10 0.816 8.056 13.213 76 HG1 THR 10 HG1 THR 10 1.597 6.625 14.797 77 1HG2 THR 10 3HG2 THR 10 -1.326 6.636 14.931 78 2HG2 THR 10 1HG2 THR 10 -0.258 7.952 15.489 79 3HG2 THR 10 2HG2 THR 10 -1.480 8.268 14.229 80 H THR 11 H THR 11 -2.449 5.949 11.068 81 HA THR 11 HA THR 11 -3.185 8.681 10.009 82 HB THR 11 HB THR 11 -5.235 7.472 9.173 83 HG1 THR 11 HG1 THR 11 -5.136 5.200 9.352 84 1HG2 THR 11 3HG2 THR 11 -2.512 6.172 8.528 85 2HG2 THR 11 1HG2 THR 11 -3.970 6.111 7.494 86 3HG2 THR 11 2HG2 THR 11 -3.155 7.668 7.800 87 H SER 12 H SER 12 -5.445 9.256 10.213 88 HA SER 12 HA SER 12 -6.177 10.261 12.764 89 1HB SER 12 1HB SER 12 -8.129 9.178 10.638 90 2HB SER 12 2HB SER 12 -8.548 10.304 11.944 91 HG SER 12 HG SER 12 -6.586 10.726 9.929 92 H ALA 13 H ALA 13 -7.006 7.156 11.333 93 HA ALA 13 HA ALA 13 -8.609 6.031 13.456 94 1HB ALA 13 2HB ALA 13 -8.355 4.948 11.217 95 2HB ALA 13 3HB ALA 13 -6.650 4.574 11.575 96 3HB ALA 13 1HB ALA 13 -7.954 3.803 12.518 97 H GLY 14 H GLY 14 -5.303 5.467 12.772 98 1HA GLY 14 1HA GLY 14 -4.055 5.926 15.308 99 2HA GLY 14 2HA GLY 14 -4.680 4.284 15.480 100 H ASN 15 H ASN 15 -2.457 4.058 15.925 101 HA ASN 15 HA ASN 15 -0.353 3.997 13.842 102 1HB ASN 15 1HB ASN 15 0.115 4.010 16.302 103 2HB ASN 15 2HB ASN 15 -0.609 2.400 16.459 104 1HD2 ASN 15 1HD2 ASN 15 2.997 1.738 16.072 105 2HD2 ASN 15 2HD2 ASN 15 1.801 2.404 17.293 106 H ILE 16 H ILE 16 0.531 2.328 12.831 107 HA ILE 16 HA ILE 16 -0.551 -0.439 12.863 108 HB ILE 16 HB ILE 16 -1.315 -0.460 10.471 109 1HG1 ILE 16 1HG1 ILE 16 -1.065 2.592 10.787 110 2HG1 ILE 16 2HG1 ILE 16 -0.144 1.582 9.665 111 1HG2 ILE 16 2HG2 ILE 16 -2.902 -0.338 12.387 112 2HG2 ILE 16 3HG2 ILE 16 -2.813 1.443 12.366 113 3HG2 ILE 16 1HG2 ILE 16 -3.532 0.569 10.983 114 1HD1 ILE 16 3HD1 ILE 16 -3.227 1.915 9.641 115 2HD1 ILE 16 1HD1 ILE 16 -2.096 2.679 8.494 116 3HD1 ILE 16 2HD1 ILE 16 -2.301 0.907 8.499 117 H GLU 17 H GLU 17 0.241 -1.670 10.994 118 HA GLU 17 HA GLU 17 3.047 -0.968 10.070 119 1HB GLU 17 1HB GLU 17 2.518 -3.166 12.152 120 2HB GLU 17 2HB GLU 17 4.090 -2.744 11.454 121 1HG GLU 17 1HG GLU 17 3.915 -0.423 12.447 122 2HG GLU 17 2HG GLU 17 2.322 -0.806 13.093 123 H LEU 18 H LEU 18 3.286 -1.771 8.257 124 HA LEU 18 HA LEU 18 2.208 -4.550 7.497 125 1HB LEU 18 1HB LEU 18 3.628 -2.478 5.722 126 2HB LEU 18 2HB LEU 18 3.017 -4.056 5.227 127 HG LEU 18 HG LEU 18 1.339 -2.510 4.561 128 1HD1 LEU 18 2HD1 LEU 18 0.431 -4.560 5.700 129 2HD1 LEU 18 3HD1 LEU 18 0.434 -3.704 7.265 130 3HD1 LEU 18 1HD1 LEU 18 -0.644 -3.162 5.953 131 1HD2 LEU 18 3HD2 LEU 18 2.076 -0.539 5.896 132 2HD2 LEU 18 1HD2 LEU 18 0.324 -0.802 6.073 133 3HD2 LEU 18 2HD2 LEU 18 1.432 -1.280 7.387 134 H GLU 19 H GLU 19 3.659 -5.946 6.491 135 HA GLU 19 HA GLU 19 6.624 -5.674 7.296 136 1HB GLU 19 1HB GLU 19 6.763 -8.088 7.485 137 2HB GLU 19 2HB GLU 19 5.523 -7.463 8.562 138 1HG GLU 19 1HG GLU 19 4.525 -9.397 7.572 139 2HG GLU 19 2HG GLU 19 3.748 -8.024 6.793 140 H LEU 20 H LEU 20 7.884 -5.438 5.789 141 HA LEU 20 HA LEU 20 6.957 -5.778 2.880 142 1HB LEU 20 1HB LEU 20 9.141 -4.015 4.141 143 2HB LEU 20 2HB LEU 20 8.823 -4.157 2.413 144 HG LEU 20 HG LEU 20 6.423 -3.425 2.814 145 1HD1 LEU 20 3HD1 LEU 20 7.481 -2.753 5.640 146 2HD1 LEU 20 1HD1 LEU 20 5.908 -2.240 4.977 147 3HD1 LEU 20 2HD1 LEU 20 6.233 -3.968 5.259 148 1HD2 LEU 20 3HD2 LEU 20 8.196 -1.836 2.018 149 2HD2 LEU 20 1HD2 LEU 20 7.036 -1.004 3.084 150 3HD2 LEU 20 2HD2 LEU 20 8.642 -1.469 3.705 151 H ASP 21 H ASP 21 7.623 -7.370 1.870 152 HA ASP 21 HA ASP 21 9.937 -9.088 2.628 153 1HB ASP 21 1HB ASP 21 8.330 -8.944 0.008 154 2HB ASP 21 2HB ASP 21 9.451 -10.239 0.464 155 H LYS 22 H LYS 22 11.712 -7.921 2.675 156 HA LYS 22 HA LYS 22 12.635 -6.053 0.563 157 1HB LYS 22 1HB LYS 22 13.451 -5.914 2.896 158 2HB LYS 22 2HB LYS 22 14.098 -7.561 2.802 159 1HG LYS 22 1HG LYS 22 15.592 -6.851 0.879 160 2HG LYS 22 2HG LYS 22 14.988 -5.200 1.022 161 1HD LYS 22 1HD LYS 22 15.874 -5.080 3.392 162 2HD LYS 22 2HD LYS 22 16.488 -6.722 3.272 163 1HE LYS 22 1HE LYS 22 17.412 -4.365 1.480 164 2HE LYS 22 2HE LYS 22 18.225 -4.881 2.956 165 1HZ LYS 22 1HZ LYS 22 17.871 -6.599 0.551 166 2HZ LYS 22 2HZ LYS 22 19.265 -5.834 0.998 167 3HZ LYS 22 3HZ LYS 22 18.649 -7.045 1.939 168 H GLN 23 H GLN 23 13.651 -9.265 1.604 169 HA GLN 23 HA GLN 23 15.837 -9.703 -0.127 170 1HB GLN 23 1HB GLN 23 15.153 -11.300 1.664 171 2HB GLN 23 2HB GLN 23 13.735 -11.788 0.725 172 1HG GLN 23 1HG GLN 23 15.588 -13.415 0.399 173 2HG GLN 23 2HG GLN 23 15.197 -12.613 -1.127 174 1HE2 GLN 23 2HE2 GLN 23 18.960 -12.617 -0.533 175 2HE2 GLN 23 1HE2 GLN 23 17.649 -13.897 -0.443 176 H LYS 24 H LYS 24 12.562 -10.874 -0.715 177 HA LYS 24 HA LYS 24 13.109 -11.763 -3.440 178 1HB LYS 24 1HB LYS 24 11.245 -12.559 -1.910 179 2HB LYS 24 2HB LYS 24 10.385 -11.047 -2.227 180 1HG LYS 24 1HG LYS 24 9.602 -12.834 -3.780 181 2HG LYS 24 2HG LYS 24 10.367 -11.517 -4.676 182 1HD LYS 24 1HD LYS 24 12.531 -12.838 -4.779 183 2HD LYS 24 2HD LYS 24 11.770 -14.156 -3.880 184 1HE LYS 24 1HE LYS 24 10.075 -14.455 -5.757 185 2HE LYS 24 2HE LYS 24 10.847 -13.142 -6.659 186 1HZ LYS 24 1HZ LYS 24 12.185 -15.680 -5.849 187 2HZ LYS 24 2HZ LYS 24 11.659 -15.305 -7.369 188 3HZ LYS 24 3HZ LYS 24 12.905 -14.457 -6.694 189 H ALA 25 H ALA 25 12.851 -8.627 -2.345 190 HA ALA 25 HA ALA 25 12.756 -7.566 -5.131 191 1HB ALA 25 2HB ALA 25 10.292 -7.867 -4.709 192 2HB ALA 25 3HB ALA 25 10.410 -6.864 -3.239 193 3HB ALA 25 1HB ALA 25 10.715 -6.141 -4.840 194 HA PRO 26 HA PRO 26 15.440 -5.415 -1.981 195 1HB PRO 26 1HB PRO 26 17.027 -5.553 -4.590 196 2HB PRO 26 2HB PRO 26 17.629 -5.764 -2.928 197 1HG PRO 26 1HG PRO 26 17.243 -7.971 -4.461 198 2HG PRO 26 2HG PRO 26 16.661 -7.996 -2.778 199 1HD PRO 26 1HD PRO 26 15.003 -7.524 -5.319 200 2HD PRO 26 2HD PRO 26 14.601 -8.529 -3.888 201 H VAL 27 H VAL 27 15.285 -4.855 -5.467 202 HA VAL 27 HA VAL 27 15.909 -2.081 -5.582 203 HB VAL 27 HB VAL 27 13.839 -3.578 -7.293 204 1HG1 VAL 27 3HG2 VAL 27 13.694 -1.080 -7.517 205 2HG1 VAL 27 1HG2 VAL 27 15.447 -0.993 -7.827 206 3HG1 VAL 27 2HG2 VAL 27 14.374 -1.807 -8.997 207 1HG2 VAL 27 2HG1 VAL 27 16.093 -4.691 -7.235 208 2HG2 VAL 27 3HG1 VAL 27 15.797 -3.950 -8.829 209 3HG2 VAL 27 1HG1 VAL 27 16.879 -3.148 -7.658 210 H SER 28 H SER 28 12.648 -3.419 -5.729 211 HA SER 28 HA SER 28 11.095 -1.078 -5.531 212 1HB SER 28 1HB SER 28 10.160 -3.393 -5.769 213 2HB SER 28 2HB SER 28 10.553 -3.739 -4.073 214 HG SER 28 HG SER 28 8.408 -3.043 -4.363 215 H VAL 29 H VAL 29 12.099 -3.084 -2.790 216 HA VAL 29 HA VAL 29 11.124 -1.489 -0.639 217 HB VAL 29 HB VAL 29 12.909 -2.571 0.717 218 1HG1 VAL 29 3HG2 VAL 29 10.803 -3.793 0.126 219 2HG1 VAL 29 1HG2 VAL 29 11.563 -4.407 -1.365 220 3HG1 VAL 29 2HG2 VAL 29 12.177 -4.924 0.228 221 1HG2 VAL 29 1HG1 VAL 29 13.948 -3.595 -2.005 222 2HG2 VAL 29 2HG1 VAL 29 14.795 -2.448 -0.935 223 3HG2 VAL 29 3HG1 VAL 29 14.535 -4.131 -0.408 224 H GLN 30 H GLN 30 14.300 -1.376 -2.197 225 HA GLN 30 HA GLN 30 15.491 0.757 -0.690 226 1HB GLN 30 1HB GLN 30 16.610 -0.672 -2.481 227 2HB GLN 30 2HB GLN 30 15.808 0.292 -3.724 228 1HG GLN 30 1HG GLN 30 17.720 1.380 -1.555 229 2HG GLN 30 2HG GLN 30 18.172 1.050 -3.227 230 1HE2 GLN 30 2HE2 GLN 30 16.505 4.617 -2.357 231 2HE2 GLN 30 1HE2 GLN 30 17.068 3.388 -1.116 232 H ASN 31 H ASN 31 13.671 0.924 -3.713 233 HA ASN 31 HA ASN 31 13.623 3.754 -4.103 234 1HB ASN 31 1HB ASN 31 11.337 1.768 -4.676 235 2HB ASN 31 2HB ASN 31 11.493 3.384 -5.379 236 1HD2 ASN 31 1HD2 ASN 31 14.842 2.038 -6.803 237 2HD2 ASN 31 2HD2 ASN 31 14.490 3.059 -5.320 238 H PHE 32 H PHE 32 10.993 1.843 -2.685 239 HA PHE 32 HA PHE 32 9.396 4.082 -1.915 240 1HB PHE 32 1HB PHE 32 8.086 2.647 -0.508 241 2HB PHE 32 2HB PHE 32 8.533 1.760 -1.958 242 HD1 PHE 32 HD1 PHE 32 9.313 2.205 1.625 243 HD2 PHE 32 HD2 PHE 32 9.828 -0.238 -1.775 244 HE1 PHE 32 HE1 PHE 32 10.136 0.408 3.038 245 HE2 PHE 32 HE2 PHE 32 10.642 -2.035 -0.357 246 HZ PHE 32 HZ PHE 32 10.785 -1.718 2.050 247 H VAL 33 H VAL 33 11.860 2.384 -0.033 248 HA VAL 33 HA VAL 33 11.639 3.858 2.461 249 HB VAL 33 HB VAL 33 13.156 1.904 2.154 250 1HG1 VAL 33 3HG2 VAL 33 13.974 2.460 -0.159 251 2HG1 VAL 33 1HG2 VAL 33 14.851 3.874 0.479 252 3HG1 VAL 33 2HG2 VAL 33 15.346 2.228 0.956 253 1HG2 VAL 33 2HG1 VAL 33 13.540 3.530 4.028 254 2HG2 VAL 33 3HG1 VAL 33 15.089 2.867 3.445 255 3HG2 VAL 33 1HG1 VAL 33 14.590 4.514 2.976 256 H ASP 34 H ASP 34 13.224 4.623 -0.581 257 HA ASP 34 HA ASP 34 14.514 7.131 0.024 258 1HB ASP 34 1HB ASP 34 12.777 6.352 -2.404 259 2HB ASP 34 2HB ASP 34 13.814 7.781 -2.347 260 OH TYR 35 OH TYR 35 9.502 7.760 -6.529 261 H TYR 35 H TYR 35 11.253 6.583 -1.167 262 HA TYR 35 HA TYR 35 10.186 9.263 -0.712 263 1HB TYR 35 1HB TYR 35 8.720 6.552 -0.659 264 2HB TYR 35 2HB TYR 35 7.927 8.128 -0.706 265 HD1 TYR 35 HD2 TYR 35 10.491 6.124 -2.505 266 HD2 TYR 35 HD1 TYR 35 7.575 9.164 -2.766 267 HE1 TYR 35 HE2 TYR 35 10.782 6.199 -4.919 268 HE2 TYR 35 HE1 TYR 35 7.865 9.232 -5.180 269 HH TYR 35 HH TYR 35 10.170 7.119 -6.782 270 H VAL 36 H VAL 36 9.880 6.296 1.188 271 HA VAL 36 HA VAL 36 8.574 7.291 3.526 272 HB VAL 36 HB VAL 36 10.881 5.259 3.395 273 1HG1 VAL 36 3HG2 VAL 36 10.445 6.106 5.718 274 2HG1 VAL 36 1HG2 VAL 36 8.709 5.739 5.540 275 3HG1 VAL 36 2HG2 VAL 36 9.906 4.415 5.552 276 1HG2 VAL 36 2HG1 VAL 36 8.942 4.702 1.893 277 2HG2 VAL 36 3HG1 VAL 36 9.011 3.579 3.277 278 3HG2 VAL 36 1HG1 VAL 36 7.813 4.901 3.258 279 H ASN 37 H ASN 37 12.049 6.794 3.222 280 HA ASN 37 HA ASN 37 12.929 8.397 5.449 281 1HB ASN 37 1HB ASN 37 14.341 8.036 2.732 282 2HB ASN 37 2HB ASN 37 15.104 8.613 4.221 283 1HD2 ASN 37 1HD2 ASN 37 15.899 5.210 4.906 284 2HD2 ASN 37 2HD2 ASN 37 16.463 6.926 4.582 285 H SER 38 H SER 38 12.401 9.266 2.073 286 HA SER 38 HA SER 38 13.262 12.025 2.144 287 1HB SER 38 1HB SER 38 10.963 10.778 0.515 288 2HB SER 38 2HB SER 38 11.722 12.347 0.180 289 HG SER 38 HG SER 38 13.039 9.829 0.281 290 H GLY 39 H GLY 39 9.924 11.515 1.493 291 1HA GLY 39 1HA GLY 39 8.623 12.475 3.893 292 2HA GLY 39 2HA GLY 39 9.068 13.927 2.966 293 H PHE 40 H PHE 40 7.327 10.951 2.996 294 HA PHE 40 HA PHE 40 5.186 12.003 1.127 295 1HB PHE 40 1HB PHE 40 6.894 11.107 -0.445 296 2HB PHE 40 2HB PHE 40 6.979 9.587 0.449 297 HD1 PHE 40 HD2 PHE 40 4.612 11.759 -1.425 298 HD2 PHE 40 HD1 PHE 40 5.441 7.869 -0.018 299 HE1 PHE 40 HE2 PHE 40 2.763 10.886 -2.741 300 HE2 PHE 40 HE1 PHE 40 3.593 7.001 -1.335 301 HZ PHE 40 HZ PHE 40 2.255 8.505 -2.698 302 OH TYR 41 OH TYR 41 6.313 5.355 1.203 303 H TYR 41 H TYR 41 4.784 11.734 3.591 304 HA TYR 41 HA TYR 41 2.705 9.656 3.837 305 1HB TYR 41 1HB TYR 41 5.176 9.287 5.642 306 2HB TYR 41 2HB TYR 41 3.672 8.367 5.731 307 HD1 TYR 41 HD2 TYR 41 3.030 7.778 2.990 308 HD2 TYR 41 HD1 TYR 41 6.827 7.886 4.831 309 HE1 TYR 41 HE2 TYR 41 3.893 6.241 1.311 310 HE2 TYR 41 HE1 TYR 41 7.684 6.351 3.150 311 HH TYR 41 HH TYR 41 7.241 5.184 1.381 312 H ASN 42 H ASN 42 4.893 11.886 5.409 313 HA ASN 42 HA ASN 42 3.970 12.187 7.969 314 1HB ASN 42 1HB ASN 42 4.448 14.589 6.099 315 2HB ASN 42 2HB ASN 42 4.495 14.636 7.869 316 1HD2 ASN 42 1HD2 ASN 42 8.020 14.193 6.878 317 2HD2 ASN 42 2HD2 ASN 42 6.692 15.459 6.848 318 H ASN 43 H ASN 43 2.238 13.391 5.155 319 HA ASN 43 HA ASN 43 -0.329 13.488 6.733 320 1HB ASN 43 1HB ASN 43 0.662 15.689 7.266 321 2HB ASN 43 2HB ASN 43 0.898 16.052 5.549 322 1HD2 ASN 43 1HD2 ASN 43 -2.507 16.986 5.026 323 2HD2 ASN 43 2HD2 ASN 43 -0.834 16.699 4.329 324 H THR 44 H THR 44 0.446 11.872 4.786 325 HA THR 44 HA THR 44 -1.227 12.561 2.324 326 HB THR 44 HB THR 44 -0.888 10.151 1.763 327 HG1 THR 44 HG1 THR 44 -0.715 9.427 3.904 328 1HG2 THR 44 2HG2 THR 44 0.796 11.878 1.023 329 2HG2 THR 44 3HG2 THR 44 1.706 11.644 2.539 330 3HG2 THR 44 1HG2 THR 44 1.586 10.314 1.356 331 H THR 45 H THR 45 -2.222 9.748 2.551 332 HA THR 45 HA THR 45 -3.844 9.536 5.010 333 HB THR 45 HB THR 45 -6.088 9.726 3.921 334 HG1 THR 45 HG1 THR 45 -6.134 10.856 1.935 335 1HG2 THR 45 2HG2 THR 45 -5.155 11.666 5.220 336 2HG2 THR 45 3HG2 THR 45 -4.356 12.280 3.748 337 3HG2 THR 45 1HG2 THR 45 -6.137 12.245 3.847 338 H PHE 46 H PHE 46 -6.038 8.409 3.446 339 HA PHE 46 HA PHE 46 -4.866 5.899 2.177 340 1HB PHE 46 1HB PHE 46 -6.754 5.891 4.619 341 2HB PHE 46 2HB PHE 46 -6.477 4.489 3.583 342 HD1 PHE 46 HD2 PHE 46 -3.460 5.649 3.162 343 HD2 PHE 46 HD1 PHE 46 -5.817 4.383 6.423 344 HE1 PHE 46 HE2 PHE 46 -1.449 5.035 4.381 345 HE2 PHE 46 HE1 PHE 46 -3.804 3.761 7.635 346 HZ PHE 46 HZ PHE 46 -1.618 4.092 6.617 347 H HIS 47 H HIS 47 -5.687 7.620 0.675 348 HA HIS 47 HA HIS 47 -8.462 8.153 0.160 349 1HB HIS 47 1HB HIS 47 -7.777 8.377 -2.254 350 2HB HIS 47 2HB HIS 47 -6.675 9.216 -1.154 351 HD2 HIS 47 HD2 HIS 47 -6.346 7.337 -4.139 352 HE1 HIS 47 HE1 HIS 47 -3.181 5.797 -1.909 353 HE2 HIS 47 HE2 HIS 47 -4.087 5.938 -4.318 354 NH1 ARG 48 NH2 ARG 48 -9.686 4.438 -6.638 355 NH2 ARG 48 NH1 ARG 48 -9.242 2.234 -6.973 356 H ARG 48 H ARG 48 -6.461 5.615 -1.288 357 HA ARG 48 HA ARG 48 -8.746 4.115 -2.434 358 1HB ARG 48 1HB ARG 48 -5.865 3.215 -1.845 359 2HB ARG 48 2HB ARG 48 -7.027 2.340 -2.850 360 1HG ARG 48 1HG ARG 48 -5.939 5.179 -3.331 361 2HG ARG 48 2HG ARG 48 -5.499 3.757 -4.263 362 1HD ARG 48 1HD ARG 48 -8.352 4.968 -4.120 363 2HD ARG 48 2HD ARG 48 -7.172 5.331 -5.382 364 HE ARG 48 HE ARG 48 -7.478 2.445 -5.359 365 1HH1 ARG 48 2HH2 ARG 48 -9.445 5.304 -6.143 366 2HH1 ARG 48 1HH2 ARG 48 -10.432 4.314 -7.332 367 1HH2 ARG 48 1HH1 ARG 48 -8.666 1.419 -6.736 368 2HH2 ARG 48 2HH1 ARG 48 -10.019 2.264 -7.643 369 H VAL 49 H VAL 49 -10.129 3.076 -1.377 370 HA VAL 49 HA VAL 49 -9.441 1.066 0.737 371 HB VAL 49 HB VAL 49 -9.402 3.186 2.046 372 1HG1 VAL 49 3HG2 VAL 49 -10.937 4.526 0.571 373 2HG1 VAL 49 1HG2 VAL 49 -12.312 3.496 1.047 374 3HG1 VAL 49 2HG2 VAL 49 -11.518 4.538 2.258 375 1HG2 VAL 49 2HG1 VAL 49 -10.234 1.065 3.102 376 2HG2 VAL 49 3HG1 VAL 49 -11.097 2.478 3.765 377 3HG2 VAL 49 1HG1 VAL 49 -11.892 1.430 2.559 378 H ILE 50 H ILE 50 -10.968 -0.267 1.251 379 HA ILE 50 HA ILE 50 -13.804 -0.057 0.358 380 HB ILE 50 HB ILE 50 -12.690 -0.499 -1.829 381 1HG1 ILE 50 1HG1 ILE 50 -14.227 -2.889 -0.644 382 2HG1 ILE 50 2HG1 ILE 50 -14.954 -1.435 -1.336 383 1HG2 ILE 50 2HG2 ILE 50 -10.649 -1.673 -0.948 384 2HG2 ILE 50 3HG2 ILE 50 -11.651 -3.055 -0.434 385 3HG2 ILE 50 1HG2 ILE 50 -11.473 -2.678 -2.169 386 1HD1 ILE 50 3HD1 ILE 50 -13.147 -3.422 -2.883 387 2HD1 ILE 50 1HD1 ILE 50 -14.920 -3.301 -3.027 388 3HD1 ILE 50 2HD1 ILE 50 -13.888 -1.957 -3.581 389 HA PRO 51 HA PRO 51 -14.341 -2.444 3.968 390 1HB PRO 51 1HB PRO 51 -16.543 -3.439 2.079 391 2HB PRO 51 2HB PRO 51 -16.690 -3.034 3.808 392 1HG PRO 51 1HG PRO 51 -17.482 -1.185 1.989 393 2HG PRO 51 2HG PRO 51 -16.468 -0.647 3.351 394 1HD PRO 51 1HD PRO 51 -15.605 -1.141 0.458 395 2HD PRO 51 2HD PRO 51 -15.063 0.140 1.591 396 H GLY 52 H GLY 52 -14.476 -4.562 4.651 397 1HA GLY 52 1HA GLY 52 -12.667 -6.407 4.436 398 2HA GLY 52 2HA GLY 52 -14.297 -7.048 4.217 399 H PHE 53 H PHE 53 -11.700 -5.488 2.428 400 HA PHE 53 HA PHE 53 -11.616 -7.679 0.365 401 1HB PHE 53 1HB PHE 53 -13.519 -6.222 -0.426 402 2HB PHE 53 2HB PHE 53 -12.444 -4.815 -0.428 403 HD1 PHE 53 HD2 PHE 53 -10.882 -7.961 -1.219 404 HD2 PHE 53 HD1 PHE 53 -12.987 -4.715 -2.900 405 HE1 PHE 53 HE2 PHE 53 -10.097 -8.595 -3.430 406 HE2 PHE 53 HE1 PHE 53 -12.200 -5.353 -5.111 407 HZ PHE 53 HZ PHE 53 -10.754 -7.292 -5.376 408 H MET 54 H MET 54 -10.735 -4.293 0.967 409 HA MET 54 HA MET 54 -7.833 -4.813 1.104 410 1HB MET 54 1HB MET 54 -8.874 -3.720 -1.579 411 2HB MET 54 2HB MET 54 -7.177 -3.939 -1.126 412 1HG MET 54 1HG MET 54 -7.564 -6.418 -0.845 413 2HG MET 54 2HG MET 54 -9.270 -6.209 -1.286 414 1HE MET 54 1HE MET 54 -10.121 -5.344 -3.682 415 2HE MET 54 3HE MET 54 -9.095 -3.879 -3.579 416 3HE MET 54 2HE MET 54 -9.028 -4.918 -5.031 417 H ILE 55 H ILE 55 -6.555 -3.029 1.056 418 HA ILE 55 HA ILE 55 -7.686 -0.258 0.856 419 HB ILE 55 HB ILE 55 -6.941 0.500 3.060 420 1HG1 ILE 55 1HG1 ILE 55 -6.277 -2.459 3.591 421 2HG1 ILE 55 2HG1 ILE 55 -5.089 -1.173 3.346 422 1HG2 ILE 55 2HG2 ILE 55 -9.300 -0.321 2.815 423 2HG2 ILE 55 3HG2 ILE 55 -8.785 -1.971 3.252 424 3HG2 ILE 55 1HG2 ILE 55 -8.684 -0.657 4.454 425 1HD1 ILE 55 2HD1 ILE 55 -5.992 0.065 5.370 426 2HD1 ILE 55 3HD1 ILE 55 -7.192 -1.229 5.623 427 3HD1 ILE 55 1HD1 ILE 55 -5.452 -1.576 5.806 428 H GLN 56 H GLN 56 -5.947 1.348 1.319 429 HA GLN 56 HA GLN 56 -3.155 0.453 0.464 430 1HB GLN 56 1HB GLN 56 -4.912 2.294 -1.244 431 2HB GLN 56 2HB GLN 56 -3.332 1.638 -1.679 432 1HG GLN 56 1HG GLN 56 -4.350 -0.693 -1.669 433 2HG GLN 56 2HG GLN 56 -5.919 -0.001 -1.253 434 1HE2 GLN 56 2HE2 GLN 56 -6.485 1.402 -4.537 435 2HE2 GLN 56 1HE2 GLN 56 -6.820 1.607 -2.745 436 H GLY 57 H GLY 57 -1.683 2.152 0.139 437 1HA GLY 57 1HA GLY 57 -2.478 4.988 0.842 438 2HA GLY 57 2HA GLY 57 -1.376 4.224 1.990 439 H GLY 58 H GLY 58 -0.420 6.269 1.135 440 1HA GLY 58 1HA GLY 58 1.470 7.278 0.051 441 2HA GLY 58 2HA GLY 58 1.985 5.662 -0.457 442 H GLY 59 H GLY 59 -0.027 8.409 -1.136 443 1HA GLY 59 1HA GLY 59 0.415 8.398 -4.018 444 2HA GLY 59 2HA GLY 59 -1.149 7.612 -3.733 445 H PHE 60 H PHE 60 -2.587 8.933 -4.275 446 HA PHE 60 HA PHE 60 -2.496 11.781 -4.471 447 1HB PHE 60 1HB PHE 60 -5.017 10.152 -3.781 448 2HB PHE 60 2HB PHE 60 -4.963 11.724 -4.580 449 HD1 PHE 60 HD1 PHE 60 -3.558 11.822 -6.782 450 HD2 PHE 60 HD2 PHE 60 -4.924 8.212 -5.079 451 HE1 PHE 60 HE1 PHE 60 -3.288 10.705 -8.923 452 HE2 PHE 60 HE2 PHE 60 -4.653 7.099 -7.218 453 HZ PHE 60 HZ PHE 60 -3.837 8.345 -9.146 454 H THR 61 H THR 61 -1.982 13.108 -2.987 455 HA THR 61 HA THR 61 -2.278 12.624 -0.070 456 HB THR 61 HB THR 61 -0.429 13.975 -1.030 457 HG1 THR 61 HG1 THR 61 -1.195 14.325 1.079 458 1HG2 THR 61 3HG2 THR 61 -2.660 16.008 -1.691 459 2HG2 THR 61 1HG2 THR 61 -0.907 16.300 -1.856 460 3HG2 THR 61 2HG2 THR 61 -1.711 15.087 -2.889 461 H GLU 62 H GLU 62 -4.199 12.460 0.658 462 HA GLU 62 HA GLU 62 -6.293 13.216 1.545 463 1HB GLU 62 1HB GLU 62 -6.775 15.644 1.480 464 2HB GLU 62 2HB GLU 62 -5.095 15.349 1.963 465 1HG GLU 62 1HG GLU 62 -4.345 15.722 -0.433 466 2HG GLU 62 2HG GLU 62 -6.013 16.009 -0.916 467 H GLN 63 H GLN 63 -7.324 15.648 -0.162 468 HA GLN 63 HA GLN 63 -9.514 14.377 -1.464 469 1HB GLN 63 1HB GLN 63 -8.050 16.914 -2.427 470 2HB GLN 63 2HB GLN 63 -9.684 16.426 -2.900 471 1HG GLN 63 1HG GLN 63 -10.412 16.487 -0.482 472 2HG GLN 63 2HG GLN 63 -8.783 16.968 0.001 473 1HE2 GLN 63 2HE2 GLN 63 -9.310 20.395 -0.807 474 2HE2 GLN 63 1HE2 GLN 63 -8.239 19.083 -0.102 475 H MET 64 H MET 64 -6.455 15.424 -2.913 476 HA MET 64 HA MET 64 -5.471 13.464 -4.375 477 1HB MET 64 1HB MET 64 -7.930 14.197 -6.034 478 2HB MET 64 2HB MET 64 -6.649 13.085 -6.526 479 1HG MET 64 1HG MET 64 -7.150 11.622 -4.514 480 2HG MET 64 2HG MET 64 -8.507 12.691 -4.090 481 1HE MET 64 2HE MET 64 -9.945 10.303 -4.203 482 2HE MET 64 1HE MET 64 -10.093 9.340 -5.704 483 3HE MET 64 3HE MET 64 -8.528 9.412 -4.842 484 H GLN 65 H GLN 65 -3.959 14.574 -4.537 485 HA GLN 65 HA GLN 65 -3.664 16.582 -6.807 486 1HB GLN 65 1HB GLN 65 -4.024 18.038 -4.797 487 2HB GLN 65 2HB GLN 65 -2.731 17.195 -3.929 488 1HG GLN 65 1HG GLN 65 -1.086 17.867 -5.729 489 2HG GLN 65 2HG GLN 65 -2.373 18.706 -6.599 490 1HE2 GLN 65 2HE2 GLN 65 -2.671 21.334 -4.059 491 2HE2 GLN 65 1HE2 GLN 65 -3.690 20.225 -5.107 492 H GLN 66 H GLN 66 -2.861 14.834 -7.729 493 HA GLN 66 HA GLN 66 -1.291 12.777 -7.124 494 1HB GLN 66 1HB GLN 66 -0.400 14.704 -9.357 495 2HB GLN 66 2HB GLN 66 0.033 12.992 -9.236 496 1HG GLN 66 1HG GLN 66 -2.413 12.362 -9.313 497 2HG GLN 66 2HG GLN 66 -2.855 14.068 -9.415 498 1HE2 GLN 66 2HE2 GLN 66 -1.885 14.418 -12.862 499 2HE2 GLN 66 1HE2 GLN 66 -2.194 15.278 -11.271 500 H LYS 67 H LYS 67 0.442 12.126 -6.366 501 HA LYS 67 HA LYS 67 2.026 13.561 -4.487 502 1HB LYS 67 1HB LYS 67 3.081 11.270 -6.234 503 2HB LYS 67 2HB LYS 67 3.599 11.686 -4.599 504 1HG LYS 67 1HG LYS 67 1.998 9.758 -4.545 505 2HG LYS 67 2HG LYS 67 1.366 11.153 -3.681 506 1HD LYS 67 1HD LYS 67 -0.466 10.266 -4.932 507 2HD LYS 67 2HD LYS 67 -0.035 11.790 -5.697 508 1HE LYS 67 1HE LYS 67 1.216 10.496 -7.521 509 2HE LYS 67 2HE LYS 67 0.783 8.976 -6.726 510 1HZ LYS 67 3HZ LYS 67 -1.161 10.956 -7.816 511 2HZ LYS 67 1HZ LYS 67 -0.748 9.519 -8.516 512 3HZ LYS 67 2HZ LYS 67 -1.568 9.533 -7.082 513 H LYS 68 H LYS 68 4.349 12.258 -6.103 514 HA LYS 68 HA LYS 68 5.160 14.241 -8.164 515 1HB LYS 68 1HB LYS 68 5.436 15.622 -6.081 516 2HB LYS 68 2HB LYS 68 6.474 14.369 -5.377 517 1HG LYS 68 1HG LYS 68 8.026 14.583 -7.375 518 2HG LYS 68 2HG LYS 68 7.054 15.902 -8.001 519 1HD LYS 68 1HD LYS 68 8.540 15.954 -5.274 520 2HD LYS 68 2HD LYS 68 9.196 16.537 -6.784 521 1HE LYS 68 1HE LYS 68 8.485 18.512 -5.739 522 2HE LYS 68 2HE LYS 68 7.246 18.228 -6.956 523 1HZ LYS 68 1HZ LYS 68 7.014 17.573 -4.050 524 2HZ LYS 68 2HZ LYS 68 6.295 18.846 -4.819 525 3HZ LYS 68 3HZ LYS 68 5.831 17.300 -5.171 526 HA PRO 69 HA PRO 69 6.594 9.838 -8.015 527 1HB PRO 69 1HB PRO 69 6.388 10.551 -10.980 528 2HB PRO 69 2HB PRO 69 5.940 9.023 -10.185 529 1HG PRO 69 1HG PRO 69 3.967 10.782 -10.797 530 2HG PRO 69 2HG PRO 69 3.958 10.024 -9.185 531 1HD PRO 69 1HD PRO 69 4.879 12.852 -9.915 532 2HD PRO 69 2HD PRO 69 3.954 12.308 -8.478 533 H ASN 70 H ASN 70 8.044 9.499 -10.615 534 HA ASN 70 HA ASN 70 10.506 10.936 -10.869 535 1HB ASN 70 1HB ASN 70 10.517 8.979 -8.485 536 2HB ASN 70 2HB ASN 70 11.996 9.472 -9.315 537 1HD2 ASN 70 1HD2 ASN 70 10.875 13.070 -8.380 538 2HD2 ASN 70 2HD2 ASN 70 10.641 12.118 -9.931 539 HA PRO 71 HA PRO 71 11.738 7.627 -13.669 540 1HB PRO 71 1HB PRO 71 14.280 6.967 -12.682 541 2HB PRO 71 2HB PRO 71 13.933 8.400 -13.678 542 1HG PRO 71 1HG PRO 71 14.113 8.255 -10.624 543 2HG PRO 71 2HG PRO 71 14.904 9.430 -11.704 544 1HD PRO 71 1HD PRO 71 12.568 10.092 -10.425 545 2HD PRO 71 2HD PRO 71 12.787 10.582 -12.135 546 HA PRO 72 HA PRO 72 9.516 4.884 -10.881 547 1HB PRO 72 1HB PRO 72 9.621 3.492 -13.609 548 2HB PRO 72 2HB PRO 72 8.239 3.603 -12.489 549 1HG PRO 72 1HG PRO 72 8.324 5.311 -14.592 550 2HG PRO 72 2HG PRO 72 7.921 5.970 -12.987 551 1HD PRO 72 1HD PRO 72 10.594 6.150 -14.465 552 2HD PRO 72 2HD PRO 72 9.785 7.386 -13.448 553 H ILE 73 H ILE 73 9.847 2.160 -12.161 554 HA ILE 73 HA ILE 73 12.634 1.312 -11.296 555 HB ILE 73 HB ILE 73 11.727 -0.183 -9.534 556 1HG1 ILE 73 1HG1 ILE 73 9.095 1.314 -10.101 557 2HG1 ILE 73 2HG1 ILE 73 9.398 -0.397 -10.421 558 1HG2 ILE 73 2HG2 ILE 73 12.629 2.082 -8.953 559 2HG2 ILE 73 3HG2 ILE 73 11.016 2.803 -9.188 560 3HG2 ILE 73 1HG2 ILE 73 11.291 1.645 -7.859 561 1HD1 ILE 73 3HD1 ILE 73 9.492 0.925 -7.620 562 2HD1 ILE 73 1HD1 ILE 73 8.172 -0.100 -8.240 563 3HD1 ILE 73 2HD1 ILE 73 9.783 -0.804 -7.946 564 H LYS 74 H LYS 74 10.867 -1.229 -10.757 565 HA LYS 74 HA LYS 74 10.413 -2.165 -13.629 566 1HB LYS 74 1HB LYS 74 12.016 -4.059 -13.291 567 2HB LYS 74 2HB LYS 74 12.824 -2.486 -13.283 568 1HG LYS 74 1HG LYS 74 12.684 -2.450 -10.751 569 2HG LYS 74 2HG LYS 74 11.957 -4.048 -10.757 570 1HD LYS 74 1HD LYS 74 14.781 -3.382 -11.837 571 2HD LYS 74 2HD LYS 74 14.440 -3.975 -10.216 572 1HE LYS 74 1HE LYS 74 13.474 -6.121 -11.178 573 2HE LYS 74 2HE LYS 74 13.842 -5.552 -12.812 574 1HZ LYS 74 3HZ LYS 74 15.859 -6.001 -10.666 575 2HZ LYS 74 1HZ LYS 74 15.588 -6.985 -11.965 576 3HZ LYS 74 2HZ LYS 74 16.200 -5.467 -12.191 577 H ASN 75 H ASN 75 10.897 -4.828 -12.826 578 HA ASN 75 HA ASN 75 8.261 -5.780 -12.535 579 1HB ASN 75 1HB ASN 75 10.778 -7.131 -11.386 580 2HB ASN 75 2HB ASN 75 9.243 -7.941 -11.736 581 1HD2 ASN 75 1HD2 ASN 75 11.328 -8.475 -14.752 582 2HD2 ASN 75 2HD2 ASN 75 11.274 -8.972 -12.986 583 H GLU 76 H GLU 76 7.887 -7.466 -10.594 584 HA GLU 76 HA GLU 76 8.272 -6.721 -7.860 585 1HB GLU 76 1HB GLU 76 6.379 -5.349 -7.263 586 2HB GLU 76 2HB GLU 76 7.237 -4.519 -8.561 587 1HG GLU 76 1HG GLU 76 4.714 -6.283 -8.887 588 2HG GLU 76 2HG GLU 76 4.713 -4.523 -8.853 589 H ALA 77 H ALA 77 5.249 -7.089 -9.657 590 HA ALA 77 HA ALA 77 3.891 -8.801 -7.887 591 1HB ALA 77 2HB ALA 77 2.835 -7.885 -9.966 592 2HB ALA 77 3HB ALA 77 3.779 -9.024 -10.966 593 3HB ALA 77 1HB ALA 77 2.553 -9.637 -9.828 594 H ASP 78 H ASP 78 6.347 -9.695 -10.219 595 HA ASP 78 HA ASP 78 5.914 -12.581 -10.170 596 1HB ASP 78 1HB ASP 78 8.105 -12.715 -11.281 597 2HB ASP 78 2HB ASP 78 7.152 -11.378 -11.948 598 H ASN 79 H ASN 79 6.244 -11.230 -7.507 599 HA ASN 79 HA ASN 79 8.675 -12.309 -6.210 600 1HB ASN 79 1HB ASN 79 7.443 -11.908 -4.090 601 2HB ASN 79 2HB ASN 79 7.375 -10.507 -5.168 602 1HD2 ASN 79 1HD2 ASN 79 3.903 -11.001 -3.960 603 2HD2 ASN 79 2HD2 ASN 79 5.551 -10.534 -3.302 604 H GLY 80 H GLY 80 6.347 -13.508 -4.303 605 1HA GLY 80 1HA GLY 80 5.383 -15.967 -5.460 606 2HA GLY 80 2HA GLY 80 7.000 -16.351 -4.826 607 H LEU 81 H LEU 81 7.472 -15.813 -2.678 608 HA LEU 81 HA LEU 81 6.972 -16.402 -0.383 609 1HB LEU 81 1HB LEU 81 5.110 -14.011 -0.950 610 2HB LEU 81 2HB LEU 81 5.553 -14.595 0.654 611 HG LEU 81 HG LEU 81 7.028 -12.771 0.184 612 1HD1 LEU 81 2HD1 LEU 81 8.102 -14.764 1.271 613 2HD1 LEU 81 3HD1 LEU 81 8.552 -15.409 -0.330 614 3HD1 LEU 81 1HD1 LEU 81 9.276 -13.888 0.256 615 1HD2 LEU 81 3HD2 LEU 81 6.762 -12.682 -2.307 616 2HD2 LEU 81 1HD2 LEU 81 8.481 -12.630 -1.838 617 3HD2 LEU 81 2HD2 LEU 81 7.779 -14.137 -2.477 618 NH1 ARG 82 NH2 ARG 82 8.218 -17.602 0.133 619 NH2 ARG 82 NH1 ARG 82 8.344 -18.907 1.991 620 H ARG 82 H ARG 82 4.443 -15.722 0.877 621 HA ARG 82 HA ARG 82 2.189 -17.198 -0.196 622 1HB ARG 82 1HB ARG 82 3.750 -18.857 1.868 623 2HB ARG 82 2HB ARG 82 2.309 -19.333 0.967 624 1HG ARG 82 1HG ARG 82 4.244 -20.394 -0.118 625 2HG ARG 82 2HG ARG 82 3.587 -19.170 -1.193 626 1HD ARG 82 1HD ARG 82 5.975 -18.929 -1.306 627 2HD ARG 82 2HD ARG 82 5.388 -17.527 -0.407 628 HE ARG 82 HE ARG 82 6.127 -19.670 1.485 629 1HH1 ARG 82 2HH2 ARG 82 7.660 -17.295 -0.671 630 2HH1 ARG 82 1HH2 ARG 82 9.166 -17.295 0.377 631 1HH2 ARG 82 1HH1 ARG 82 7.887 -19.592 2.603 632 2HH2 ARG 82 2HH1 ARG 82 9.283 -18.510 2.107 633 H ASN 83 H ASN 83 0.770 -16.046 0.724 634 HA ASN 83 HA ASN 83 0.431 -15.977 3.712 635 1HB ASN 83 1HB ASN 83 1.068 -13.397 2.151 636 2HB ASN 83 2HB ASN 83 0.548 -13.470 3.839 637 1HD2 ASN 83 1HD2 ASN 83 3.678 -15.343 4.738 638 2HD2 ASN 83 2HD2 ASN 83 1.874 -15.676 4.761 639 H THR 84 H THR 84 -1.115 -13.685 3.787 640 HA THR 84 HA THR 84 -3.592 -14.115 2.109 641 HB THR 84 HB THR 84 -3.065 -15.235 4.919 642 HG1 THR 84 HG1 THR 84 -2.629 -16.499 3.081 643 1HG2 THR 84 3HG2 THR 84 -5.780 -14.870 3.510 644 2HG2 THR 84 1HG2 THR 84 -5.512 -15.817 5.009 645 3HG2 THR 84 2HG2 THR 84 -5.246 -14.054 5.001 646 NH1 ARG 85 NH2 ARG 85 -10.569 -13.782 7.668 647 NH2 ARG 85 NH1 ARG 85 -10.271 -11.768 8.678 648 H ARG 85 H ARG 85 -5.394 -13.022 2.930 649 HA ARG 85 HA ARG 85 -5.513 -10.352 3.393 650 1HB ARG 85 1HB ARG 85 -7.398 -10.700 5.053 651 2HB ARG 85 2HB ARG 85 -7.523 -11.807 3.672 652 1HG ARG 85 1HG ARG 85 -6.332 -13.592 4.960 653 2HG ARG 85 2HG ARG 85 -6.139 -12.532 6.343 654 1HD ARG 85 1HD ARG 85 -8.886 -13.442 5.221 655 2HD ARG 85 2HD ARG 85 -8.006 -14.279 6.503 656 HE ARG 85 HE ARG 85 -8.336 -11.468 7.286 657 1HH1 ARG 85 2HH2 ARG 85 -10.234 -14.460 6.974 658 2HH1 ARG 85 1HH2 ARG 85 -11.388 -13.881 8.278 659 1HH2 ARG 85 1HH1 ARG 85 -9.712 -10.911 8.758 660 2HH2 ARG 85 2HH1 ARG 85 -11.110 -12.008 9.217 661 H GLY 86 H GLY 86 -3.916 -9.517 3.966 662 1HA GLY 86 1HA GLY 86 -3.238 -8.334 6.457 663 2HA GLY 86 2HA GLY 86 -2.484 -9.937 6.564 664 H THR 87 H THR 87 -2.298 -9.907 3.540 665 HA THR 87 HA THR 87 0.547 -8.924 3.448 666 HB THR 87 HB THR 87 0.421 -9.627 1.027 667 HG1 THR 87 HG1 THR 87 -1.820 -9.347 0.819 668 1HG2 THR 87 2HG2 THR 87 1.213 -11.164 2.838 669 2HG2 THR 87 3HG2 THR 87 -0.461 -11.715 3.117 670 3HG2 THR 87 1HG2 THR 87 0.352 -12.063 1.563 671 H ILE 88 H ILE 88 1.296 -7.290 2.706 672 HA ILE 88 HA ILE 88 -0.322 -5.230 1.101 673 HB ILE 88 HB ILE 88 0.675 -3.855 2.552 674 1HG1 ILE 88 1HG1 ILE 88 3.093 -3.182 1.743 675 2HG1 ILE 88 2HG1 ILE 88 2.880 -4.453 0.576 676 1HG2 ILE 88 2HG2 ILE 88 1.729 -5.603 4.010 677 2HG2 ILE 88 3HG2 ILE 88 3.095 -5.740 2.868 678 3HG2 ILE 88 1HG2 ILE 88 2.836 -4.226 3.772 679 1HD1 ILE 88 2HD1 ILE 88 0.708 -3.215 -0.215 680 2HD1 ILE 88 3HD1 ILE 88 1.003 -1.989 1.040 681 3HD1 ILE 88 1HD1 ILE 88 2.139 -2.148 -0.324 682 H ALA 89 H ALA 89 0.687 -4.348 -0.638 683 HA ALA 89 HA ALA 89 2.785 -5.757 -2.187 684 1HB ALA 89 2HB ALA 89 0.943 -7.460 -2.470 685 2HB ALA 89 3HB ALA 89 -0.126 -6.201 -3.141 686 3HB ALA 89 1HB ALA 89 1.343 -6.684 -4.022 687 H MET 90 H MET 90 3.561 -4.648 -3.713 688 HA MET 90 HA MET 90 2.982 -1.827 -4.078 689 1HB MET 90 1HB MET 90 4.445 -3.786 -5.940 690 2HB MET 90 2HB MET 90 4.418 -2.033 -6.165 691 1HG MET 90 1HG MET 90 5.448 -3.463 -3.634 692 2HG MET 90 2HG MET 90 6.471 -2.777 -4.912 693 1HE MET 90 1HE MET 90 6.548 -0.151 -5.548 694 2HE MET 90 3HE MET 90 4.767 -0.084 -5.738 695 3HE MET 90 2HE MET 90 5.601 1.101 -4.694 696 H ALA 91 H ALA 91 1.546 -0.811 -5.065 697 HA ALA 91 HA ALA 91 -0.572 -2.124 -6.739 698 1HB ALA 91 2HB ALA 91 -1.120 -0.229 -5.194 699 2HB ALA 91 3HB ALA 91 -0.054 0.857 -6.125 700 3HB ALA 91 1HB ALA 91 -1.521 0.183 -6.879 701 NH1 ARG 92 NH2 ARG 92 -0.277 2.128 -14.767 702 NH2 ARG 92 NH1 ARG 92 0.149 3.545 -13.042 703 H ARG 92 H ARG 92 -1.207 -0.522 -8.624 704 HA ARG 92 HA ARG 92 0.801 0.685 -10.303 705 1HB ARG 92 1HB ARG 92 1.480 -1.875 -10.281 706 2HB ARG 92 2HB ARG 92 0.102 -2.102 -11.359 707 1HG ARG 92 1HG ARG 92 2.615 -0.368 -11.812 708 2HG ARG 92 2HG ARG 92 2.126 -1.801 -12.694 709 1HD ARG 92 1HD ARG 92 1.614 -0.048 -14.185 710 2HD ARG 92 2HD ARG 92 0.036 -0.482 -13.527 711 HE ARG 92 HE ARG 92 1.182 1.697 -11.909 712 1HH1 ARG 92 2HH2 ARG 92 -0.197 1.177 -15.146 713 2HH1 ARG 92 1HH2 ARG 92 -0.711 2.937 -15.225 714 1HH2 ARG 92 1HH1 ARG 92 0.551 3.679 -12.107 715 2HH2 ARG 92 2HH1 ARG 92 -0.314 4.256 -13.619 716 H THR 93 H THR 93 -0.651 -1.274 -12.406 717 HA THR 93 HA THR 93 -3.439 -0.573 -12.583 718 HB THR 93 HB THR 93 -1.575 1.454 -13.962 719 HG1 THR 93 HG1 THR 93 -2.220 1.870 -11.817 720 1HG2 THR 93 2HG2 THR 93 -4.619 1.028 -14.295 721 2HG2 THR 93 3HG2 THR 93 -3.675 2.366 -15.005 722 3HG2 THR 93 1HG2 THR 93 -3.385 0.689 -15.537 723 H ALA 94 H ALA 94 -0.806 -0.040 -14.855 724 HA ALA 94 HA ALA 94 -0.660 -2.607 -16.120 725 1HB ALA 94 3HB ALA 94 -2.787 -0.807 -17.472 726 2HB ALA 94 1HB ALA 94 -2.157 -2.341 -18.127 727 3HB ALA 94 2HB ALA 94 -3.114 -2.342 -16.624 728 H ASP 95 H ASP 95 1.226 -2.385 -16.766 729 HA ASP 95 HA ASP 95 2.240 -1.017 -19.018 730 1HB ASP 95 1HB ASP 95 2.340 0.780 -16.524 731 2HB ASP 95 2HB ASP 95 3.463 0.968 -17.877 732 H LYS 96 H LYS 96 4.300 -1.299 -19.344 733 HA LYS 96 HA LYS 96 5.753 -3.398 -18.110 734 1HB LYS 96 1HB LYS 96 6.972 -0.850 -19.322 735 2HB LYS 96 2HB LYS 96 7.802 -2.402 -19.125 736 1HG LYS 96 1HG LYS 96 6.041 -3.513 -20.562 737 2HG LYS 96 2HG LYS 96 5.236 -1.971 -20.800 738 1HD LYS 96 1HD LYS 96 8.129 -2.610 -21.696 739 2HD LYS 96 2HD LYS 96 6.708 -2.750 -22.723 740 1HE LYS 96 1HE LYS 96 6.252 -0.261 -22.477 741 2HE LYS 96 2HE LYS 96 7.696 -0.098 -21.468 742 1HZ LYS 96 1HZ LYS 96 7.685 -1.043 -24.293 743 2HZ LYS 96 2HZ LYS 96 8.164 0.448 -23.769 744 3HZ LYS 96 3HZ LYS 96 9.032 -0.894 -23.348 745 H ASP 97 H ASP 97 8.043 -1.191 -17.918 746 HA ASP 97 HA ASP 97 8.539 -1.390 -15.043 747 1HB ASP 97 1HB ASP 97 9.489 0.752 -17.042 748 2HB ASP 97 2HB ASP 97 10.170 0.481 -15.428 749 H SER 98 H SER 98 7.414 -0.615 -13.533 750 HA SER 98 HA SER 98 6.619 2.260 -13.380 751 1HB SER 98 1HB SER 98 4.421 0.105 -13.572 752 2HB SER 98 2HB SER 98 4.155 1.805 -13.142 753 HG SER 98 HG SER 98 5.079 2.371 -15.160 754 H ALA 99 H ALA 99 4.358 1.491 -11.671 755 HA ALA 99 HA ALA 99 4.061 1.496 -9.303 756 1HB ALA 99 2HB ALA 99 4.274 -0.983 -9.638 757 2HB ALA 99 3HB ALA 99 6.048 -0.868 -9.490 758 3HB ALA 99 1HB ALA 99 5.009 -0.495 -8.091 759 H THR 100 H THR 100 4.876 3.455 -9.079 760 HA THR 100 HA THR 100 7.782 4.029 -8.822 761 HB THR 100 HB THR 100 7.025 6.337 -8.303 762 HG1 THR 100 HG1 THR 100 4.456 5.130 -8.366 763 1HG2 THR 100 2HG2 THR 100 7.083 5.563 -10.698 764 2HG2 THR 100 3HG2 THR 100 5.400 4.990 -10.560 765 3HG2 THR 100 1HG2 THR 100 5.762 6.733 -10.437 766 H SER 101 H SER 101 5.042 3.812 -6.610 767 HA SER 101 HA SER 101 6.757 3.072 -4.290 768 1HB SER 101 1HB SER 101 5.440 5.864 -4.332 769 2HB SER 101 2HB SER 101 6.194 5.109 -2.914 770 HG SER 101 HG SER 101 7.463 5.665 -5.396 771 H GLN 102 H GLN 102 3.752 4.726 -5.139 772 HA GLN 102 HA GLN 102 1.977 4.020 -3.133 773 1HB GLN 102 1HB GLN 102 0.163 3.815 -4.866 774 2HB GLN 102 2HB GLN 102 1.200 5.225 -5.075 775 1HG GLN 102 1HG GLN 102 0.865 4.237 -7.273 776 2HG GLN 102 2HG GLN 102 2.552 3.991 -6.816 777 1HE2 GLN 102 2HE2 GLN 102 1.710 0.703 -8.099 778 2HE2 GLN 102 1HE2 GLN 102 2.292 2.381 -8.562 779 H PHE 103 H PHE 103 0.800 2.447 -2.432 780 HA PHE 103 HA PHE 103 0.987 -0.355 -3.530 781 1HB PHE 103 1HB PHE 103 1.968 -1.349 -1.563 782 2HB PHE 103 2HB PHE 103 3.070 -0.099 -2.135 783 HD1 PHE 103 HD2 PHE 103 0.645 1.885 -0.844 784 HD2 PHE 103 HD1 PHE 103 3.431 -0.979 0.508 785 HE1 PHE 103 HE2 PHE 103 0.555 2.847 1.385 786 HE2 PHE 103 HE1 PHE 103 3.337 -0.015 2.736 787 HZ PHE 103 HZ PHE 103 1.889 1.883 3.178 788 H PHE 104 H PHE 104 0.109 -1.773 -1.488 789 HA PHE 104 HA PHE 104 -2.475 -0.574 -0.469 790 1HB PHE 104 1HB PHE 104 -3.930 -2.047 -1.781 791 2HB PHE 104 2HB PHE 104 -2.993 -1.019 -2.861 792 HD1 PHE 104 HD2 PHE 104 -3.008 -4.390 -1.298 793 HD2 PHE 104 HD1 PHE 104 -1.667 -2.023 -4.517 794 HE1 PHE 104 HE2 PHE 104 -2.243 -6.393 -2.452 795 HE2 PHE 104 HE1 PHE 104 -0.903 -4.027 -5.672 796 HZ PHE 104 HZ PHE 104 -1.203 -6.211 -4.644 797 H ILE 105 H ILE 105 -3.263 -1.440 1.072 798 HA ILE 105 HA ILE 105 -2.085 -4.054 2.212 799 HB ILE 105 HB ILE 105 -3.644 -1.841 3.650 800 1HG1 ILE 105 1HG1 ILE 105 -0.634 -2.486 3.529 801 2HG1 ILE 105 2HG1 ILE 105 -1.411 -1.061 2.829 802 1HG2 ILE 105 3HG2 ILE 105 -2.072 -4.318 4.625 803 2HG2 ILE 105 1HG2 ILE 105 -2.837 -3.102 5.684 804 3HG2 ILE 105 2HG2 ILE 105 -3.845 -4.144 4.642 805 1HD1 ILE 105 2HD1 ILE 105 -2.189 -0.342 5.139 806 2HD1 ILE 105 3HD1 ILE 105 -1.398 -1.779 5.843 807 3HD1 ILE 105 1HD1 ILE 105 -0.414 -0.509 5.070 808 H ASN 106 H ASN 106 -3.185 -5.555 1.348 809 HA ASN 106 HA ASN 106 -6.052 -5.543 0.690 810 1HB ASN 106 1HB ASN 106 -4.179 -7.920 1.258 811 2HB ASN 106 2HB ASN 106 -5.773 -8.024 0.491 812 1HD2 ASN 106 1HD2 ASN 106 -3.517 -7.851 -2.389 813 2HD2 ASN 106 2HD2 ASN 106 -4.127 -9.007 -1.101 814 H VAL 107 H VAL 107 -7.558 -7.043 1.546 815 HA VAL 107 HA VAL 107 -7.345 -8.024 4.346 816 HB VAL 107 HB VAL 107 -9.216 -6.716 5.286 817 1HG1 VAL 107 3HG2 VAL 107 -6.871 -5.885 5.616 818 2HG1 VAL 107 1HG2 VAL 107 -6.984 -4.931 4.115 819 3HG1 VAL 107 2HG2 VAL 107 -8.014 -4.519 5.512 820 1HG2 VAL 107 2HG1 VAL 107 -10.418 -6.238 3.132 821 2HG2 VAL 107 3HG1 VAL 107 -10.125 -4.731 4.040 822 3HG2 VAL 107 1HG1 VAL 107 -9.107 -5.138 2.633 823 H ALA 108 H ALA 108 -7.543 -9.276 2.086 824 HA ALA 108 HA ALA 108 -9.878 -11.029 2.508 825 1HB ALA 108 2HB ALA 108 -11.080 -9.115 1.391 826 2HB ALA 108 3HB ALA 108 -9.969 -9.217 -0.001 827 3HB ALA 108 1HB ALA 108 -11.084 -10.563 0.353 828 H ASP 109 H ASP 109 -9.496 -12.896 1.812 829 HA ASP 109 HA ASP 109 -7.094 -14.011 1.103 830 1HB ASP 109 1HB ASP 109 -9.744 -14.806 -0.247 831 2HB ASP 109 2HB ASP 109 -8.297 -15.824 -0.155 832 H ASN 110 H ASN 110 -5.692 -13.107 -0.082 833 HA ASN 110 HA ASN 110 -6.186 -11.738 -2.642 834 1HB ASN 110 1HB ASN 110 -4.287 -11.224 -1.078 835 2HB ASN 110 2HB ASN 110 -3.547 -12.788 -1.455 836 1HD2 ASN 110 1HD2 ASN 110 -3.875 -10.760 -4.965 837 2HD2 ASN 110 2HD2 ASN 110 -5.295 -11.464 -4.041 838 H ALA 111 H ALA 111 -3.528 -13.559 -3.256 839 HA ALA 111 HA ALA 111 -3.054 -15.298 -4.816 840 1HB ALA 111 2HB ALA 111 -4.186 -16.731 -3.101 841 2HB ALA 111 3HB ALA 111 -5.776 -16.377 -3.837 842 3HB ALA 111 1HB ALA 111 -4.554 -17.305 -4.750 843 H PHE 112 H PHE 112 -6.580 -15.142 -5.012 844 HA PHE 112 HA PHE 112 -6.621 -15.118 -7.974 845 1HB PHE 112 1HB PHE 112 -9.056 -14.732 -7.721 846 2HB PHE 112 2HB PHE 112 -8.487 -16.071 -6.728 847 HD1 PHE 112 HD1 PHE 112 -7.450 -12.952 -5.335 848 HD2 PHE 112 HD2 PHE 112 -10.753 -15.556 -5.639 849 HE1 PHE 112 HE1 PHE 112 -8.442 -11.926 -3.370 850 HE2 PHE 112 HE2 PHE 112 -11.742 -14.528 -3.672 851 HZ PHE 112 HZ PHE 112 -10.586 -12.713 -2.535 852 H LEU 113 H LEU 113 -4.883 -13.381 -7.516 853 HA LEU 113 HA LEU 113 -5.709 -10.856 -8.701 854 1HB LEU 113 1HB LEU 113 -6.897 -10.607 -6.511 855 2HB LEU 113 2HB LEU 113 -5.378 -10.783 -5.632 856 HG LEU 113 HG LEU 113 -5.856 -8.613 -7.759 857 1HD1 LEU 113 2HD1 LEU 113 -7.508 -8.352 -5.889 858 2HD1 LEU 113 3HD1 LEU 113 -6.187 -8.412 -4.694 859 3HD1 LEU 113 1HD1 LEU 113 -6.292 -7.051 -5.840 860 1HD2 LEU 113 3HD2 LEU 113 -3.437 -9.083 -7.228 861 2HD2 LEU 113 1HD2 LEU 113 -3.916 -7.477 -6.624 862 3HD2 LEU 113 2HD2 LEU 113 -3.763 -8.846 -5.492 863 H ASP 114 H ASP 114 -3.531 -12.548 -6.504 864 HA ASP 114 HA ASP 114 -1.209 -10.975 -6.443 865 1HB ASP 114 1HB ASP 114 -1.406 -13.276 -5.470 866 2HB ASP 114 2HB ASP 114 -1.333 -13.983 -7.093 867 H HIS 115 H HIS 115 -1.281 -13.599 -8.751 868 HA HIS 115 HA HIS 115 -1.125 -12.122 -11.231 869 1HB HIS 115 1HB HIS 115 0.948 -11.093 -10.445 870 2HB HIS 115 2HB HIS 115 1.614 -12.640 -9.915 871 HD2 HIS 115 HD2 HIS 115 3.674 -11.935 -11.680 872 HE1 HIS 115 HE1 HIS 115 1.636 -13.238 -15.067 873 HE2 HIS 115 HE2 HIS 115 3.985 -12.589 -14.238 874 H GLY 116 H GLY 116 -2.163 -13.582 -12.138 875 1HA GLY 116 1HA GLY 116 -0.926 -16.057 -13.147 876 2HA GLY 116 2HA GLY 116 -1.999 -16.465 -11.790 877 H GLN 117 H GLN 117 -1.771 -16.150 -14.991 878 HA GLN 117 HA GLN 117 -3.423 -16.346 -16.723 879 1HB GLN 117 1HB GLN 117 -4.914 -17.522 -15.091 880 2HB GLN 117 2HB GLN 117 -5.453 -15.967 -14.435 881 1HG GLN 117 1HG GLN 117 -6.307 -15.307 -16.731 882 2HG GLN 117 2HG GLN 117 -5.783 -16.867 -17.370 883 1HE2 GLN 117 2HE2 GLN 117 -9.122 -16.674 -14.925 884 2HE2 GLN 117 1HE2 GLN 117 -7.884 -15.321 -14.979 885 NH1 ARG 118 NH2 ARG 118 -6.743 -8.354 -18.896 886 NH2 ARG 118 NH1 ARG 118 -5.959 -6.291 -18.354 887 H ARG 118 H ARG 118 -2.210 -14.486 -17.146 888 HA ARG 118 HA ARG 118 -3.054 -12.364 -18.417 889 1HB ARG 118 1HB ARG 118 -5.071 -12.216 -16.920 890 2HB ARG 118 2HB ARG 118 -4.032 -11.750 -15.562 891 1HG ARG 118 1HG ARG 118 -3.212 -9.752 -16.881 892 2HG ARG 118 2HG ARG 118 -4.231 -10.228 -18.241 893 1HD ARG 118 1HD ARG 118 -6.310 -9.950 -16.750 894 2HD ARG 118 2HD ARG 118 -5.265 -9.445 -15.432 895 HE ARG 118 HE ARG 118 -4.865 -7.304 -16.477 896 1HH1 ARG 118 2HH2 ARG 118 -6.781 -9.353 -18.665 897 2HH1 ARG 118 1HH2 ARG 118 -7.197 -7.889 -19.690 898 1HH2 ARG 118 1HH1 ARG 118 -5.402 -5.715 -17.714 899 2HH2 ARG 118 2HH1 ARG 118 -6.468 -5.970 -19.185 900 H ASP 119 H ASP 119 -1.083 -11.949 -18.819 901 HA ASP 119 HA ASP 119 1.259 -11.924 -17.372 902 1HB ASP 119 1HB ASP 119 0.444 -9.659 -19.290 903 2HB ASP 119 2HB ASP 119 2.106 -10.045 -18.810 904 H PHE 120 H PHE 120 1.584 -11.378 -15.451 905 HA PHE 120 HA PHE 120 1.783 -10.078 -13.458 906 1HB PHE 120 1HB PHE 120 1.985 -7.848 -15.571 907 2HB PHE 120 2HB PHE 120 2.388 -7.647 -13.865 908 HD1 PHE 120 HD2 PHE 120 3.206 -9.760 -16.819 909 HD2 PHE 120 HD1 PHE 120 4.503 -8.289 -13.084 910 HE1 PHE 120 HE2 PHE 120 5.419 -10.683 -17.219 911 HE2 PHE 120 HE1 PHE 120 6.712 -9.212 -13.488 912 HZ PHE 120 HZ PHE 120 7.173 -10.409 -15.557 913 H GLY 121 H GLY 121 1.059 -8.195 -12.288 914 1HA GLY 121 1HA GLY 121 -1.544 -6.894 -12.858 915 2HA GLY 121 2HA GLY 121 -1.774 -8.263 -11.748 916 OH TYR 122 OH TYR 122 -6.596 -4.070 -10.291 917 H TYR 122 H TYR 122 -1.993 -7.535 -9.843 918 HA TYR 122 HA TYR 122 -0.678 -5.028 -8.828 919 1HB TYR 122 1HB TYR 122 -2.319 -7.100 -7.260 920 2HB TYR 122 2HB TYR 122 -1.914 -5.461 -6.752 921 HD1 TYR 122 HD1 TYR 122 -2.293 -3.891 -9.151 922 HD2 TYR 122 HD2 TYR 122 -4.622 -7.089 -7.678 923 HE1 TYR 122 HE1 TYR 122 -4.241 -3.011 -10.312 924 HE2 TYR 122 HE2 TYR 122 -6.566 -6.206 -8.842 925 HH TYR 122 HH TYR 122 -7.346 -4.645 -10.123 926 H ALA 123 H ALA 123 1.255 -4.987 -8.229 927 HA ALA 123 HA ALA 123 3.068 -7.160 -7.716 928 1HB ALA 123 2HB ALA 123 3.811 -4.790 -8.031 929 2HB ALA 123 3HB ALA 123 3.119 -4.345 -6.447 930 3HB ALA 123 1HB ALA 123 4.496 -5.476 -6.538 931 H VAL 124 H VAL 124 4.174 -6.617 -5.250 932 HA VAL 124 HA VAL 124 2.478 -7.018 -2.946 933 HB VAL 124 HB VAL 124 3.373 -9.657 -4.264 934 1HG1 VAL 124 3HG2 VAL 124 3.773 -9.644 -1.788 935 2HG1 VAL 124 1HG2 VAL 124 2.090 -9.132 -1.504 936 3HG1 VAL 124 2HG2 VAL 124 2.429 -10.739 -2.201 937 1HG2 VAL 124 1HG1 VAL 124 0.552 -8.635 -3.530 938 2HG2 VAL 124 2HG1 VAL 124 1.198 -8.821 -5.182 939 3HG2 VAL 124 3HG1 VAL 124 0.936 -10.258 -4.164 940 H PHE 125 H PHE 125 3.684 -6.717 -1.282 941 HA PHE 125 HA PHE 125 6.166 -8.278 -0.844 942 1HB PHE 125 1HB PHE 125 7.803 -6.544 -0.869 943 2HB PHE 125 2HB PHE 125 6.912 -6.304 -2.374 944 HD1 PHE 125 HD2 PHE 125 4.514 -4.930 -1.637 945 HD2 PHE 125 HD1 PHE 125 8.327 -4.526 0.121 946 HE1 PHE 125 HE2 PHE 125 3.879 -2.757 -0.753 947 HE2 PHE 125 HE1 PHE 125 7.688 -2.354 1.002 948 HZ PHE 125 HZ PHE 125 5.456 -1.484 0.593 949 H GLY 126 H GLY 126 3.498 -7.504 0.334 950 1HA GLY 126 1HA GLY 126 4.370 -6.184 2.970 951 2HA GLY 126 2HA GLY 126 2.795 -6.019 2.210 952 H LYS 127 H LYS 127 3.000 -6.514 4.566 953 HA LYS 127 HA LYS 127 1.267 -8.740 5.115 954 1HB LYS 127 1HB LYS 127 4.163 -9.405 5.913 955 2HB LYS 127 2HB LYS 127 2.730 -10.349 6.355 956 1HG LYS 127 1HG LYS 127 2.178 -10.547 3.864 957 2HG LYS 127 2HG LYS 127 3.705 -9.779 3.476 958 1HD LYS 127 1HD LYS 127 3.416 -12.461 5.019 959 2HD LYS 127 2HD LYS 127 3.613 -12.318 3.290 960 1HE LYS 127 1HE LYS 127 5.779 -12.863 4.027 961 2HE LYS 127 2HE LYS 127 5.885 -11.145 3.659 962 1HZ LYS 127 2HZ LYS 127 5.546 -12.330 6.380 963 2HZ LYS 127 3HZ LYS 127 6.940 -11.680 5.773 964 3HZ LYS 127 1HZ LYS 127 5.639 -10.710 6.073 965 H VAL 128 H VAL 128 0.196 -7.603 6.405 966 HA VAL 128 HA VAL 128 0.925 -5.571 8.218 967 HB VAL 128 HB VAL 128 -1.233 -7.707 8.690 968 1HG1 VAL 128 3HG2 VAL 128 -0.699 -6.360 10.742 969 2HG1 VAL 128 1HG2 VAL 128 -0.895 -4.849 9.817 970 3HG1 VAL 128 2HG2 VAL 128 -2.300 -5.913 10.096 971 1HG2 VAL 128 2HG1 VAL 128 -1.410 -6.558 6.461 972 2HG2 VAL 128 3HG1 VAL 128 -2.725 -6.032 7.545 973 3HG2 VAL 128 1HG1 VAL 128 -1.321 -4.967 7.260 974 H VAL 129 H VAL 129 2.234 -5.433 9.728 975 HA VAL 129 HA VAL 129 3.538 -7.671 11.125 976 HB VAL 129 HB VAL 129 4.638 -5.493 10.891 977 1HG1 VAL 129 3HG2 VAL 129 2.599 -4.026 11.052 978 2HG1 VAL 129 1HG2 VAL 129 2.438 -4.429 12.780 979 3HG1 VAL 129 2HG2 VAL 129 3.853 -3.506 12.209 980 1HG2 VAL 129 2HG1 VAL 129 5.239 -6.995 12.812 981 2HG2 VAL 129 3HG1 VAL 129 5.418 -5.281 13.274 982 3HG2 VAL 129 1HG1 VAL 129 3.999 -6.212 13.825 983 H LYS 130 H LYS 130 1.049 -5.334 12.073 984 HA LYS 130 HA LYS 130 -0.700 -7.014 13.525 985 1HB LYS 130 1HB LYS 130 1.301 -7.730 14.852 986 2HB LYS 130 2HB LYS 130 1.614 -6.054 15.319 987 1HG LYS 130 1HG LYS 130 -0.911 -7.701 15.975 988 2HG LYS 130 2HG LYS 130 0.369 -7.278 17.115 989 1HD LYS 130 1HD LYS 130 -0.150 -4.818 16.778 990 2HD LYS 130 2HD LYS 130 -1.442 -5.222 15.658 991 1HE LYS 130 1HE LYS 130 -1.363 -6.082 18.638 992 2HE LYS 130 2HE LYS 130 -2.185 -4.647 18.031 993 1HZ LYS 130 1HZ LYS 130 -3.619 -6.078 16.680 994 2HZ LYS 130 2HZ LYS 130 -2.861 -7.435 17.239 995 3HZ LYS 130 3HZ LYS 130 -3.721 -6.482 18.278 996 H GLY 131 H GLY 131 -1.826 -5.375 12.562 997 1HA GLY 131 1HA GLY 131 -2.829 -3.373 14.455 998 2HA GLY 131 2HA GLY 131 -1.806 -2.541 13.270 999 H MET 132 H MET 132 -3.669 -5.419 12.578 1000 HA MET 132 HA MET 132 -4.947 -4.336 10.207 1001 1HB MET 132 1HB MET 132 -4.640 -6.819 10.886 1002 2HB MET 132 2HB MET 132 -6.081 -6.638 11.896 1003 1HG MET 132 1HG MET 132 -6.694 -7.503 9.644 1004 2HG MET 132 2HG MET 132 -7.380 -5.871 9.839 1005 1HE MET 132 3HE MET 132 -7.527 -6.124 7.000 1006 2HE MET 132 2HE MET 132 -6.055 -6.248 5.991 1007 3HE MET 132 1HE MET 132 -6.552 -7.628 7.011 1008 H ASP 133 H ASP 133 -6.002 -4.634 13.551 1009 HA ASP 133 HA ASP 133 -8.751 -3.917 13.454 1010 1HB ASP 133 1HB ASP 133 -6.642 -2.825 15.415 1011 2HB ASP 133 2HB ASP 133 -8.389 -2.808 15.681 1012 H VAL 134 H VAL 134 -6.094 -1.638 13.958 1013 HA VAL 134 HA VAL 134 -7.441 0.844 13.534 1014 HB VAL 134 HB VAL 134 -4.623 -0.006 12.664 1015 1HG1 VAL 134 1HG2 VAL 134 -5.859 2.823 12.752 1016 2HG1 VAL 134 2HG2 VAL 134 -4.140 2.447 12.453 1017 3HG1 VAL 134 3HG2 VAL 134 -5.379 1.939 11.279 1018 1HG2 VAL 134 2HG1 VAL 134 -5.114 -0.032 15.141 1019 2HG2 VAL 134 3HG1 VAL 134 -3.980 1.284 14.730 1020 3HG2 VAL 134 1HG1 VAL 134 -5.696 1.651 15.046 1021 H ALA 135 H ALA 135 -5.684 -1.009 11.082 1022 HA ALA 135 HA ALA 135 -6.529 0.355 8.715 1023 1HB ALA 135 2HB ALA 135 -4.900 -1.555 8.692 1024 2HB ALA 135 3HB ALA 135 -6.215 -2.702 9.067 1025 3HB ALA 135 1HB ALA 135 -6.207 -1.826 7.512 1026 H ASP 136 H ASP 136 -8.084 -2.339 10.375 1027 HA ASP 136 HA ASP 136 -10.490 -2.587 8.758 1028 1HB ASP 136 1HB ASP 136 -10.140 -2.971 11.795 1029 2HB ASP 136 2HB ASP 136 -11.519 -3.551 10.847 1030 H LYS 137 H LYS 137 -10.165 -1.099 11.936 1031 HA LYS 137 HA LYS 137 -12.510 0.376 12.226 1032 1HB LYS 137 1HB LYS 137 -10.599 0.449 13.837 1033 2HB LYS 137 2HB LYS 137 -9.671 1.457 12.718 1034 1HG LYS 137 1HG LYS 137 -10.788 2.869 14.443 1035 2HG LYS 137 2HG LYS 137 -11.367 3.259 12.820 1036 1HD LYS 137 1HD LYS 137 -13.409 1.799 13.193 1037 2HD LYS 137 2HD LYS 137 -12.835 1.414 14.821 1038 1HE LYS 137 1HE LYS 137 -12.962 3.877 15.449 1039 2HE LYS 137 2HE LYS 137 -13.535 4.263 13.820 1040 1HZ LYS 137 1HZ LYS 137 -14.941 2.479 15.750 1041 2HZ LYS 137 2HZ LYS 137 -15.370 4.028 15.371 1042 3HZ LYS 137 3HZ LYS 137 -15.476 2.839 14.229 1043 H ILE 138 H ILE 138 -9.672 1.406 10.381 1044 HA ILE 138 HA ILE 138 -10.772 3.899 9.300 1045 HB ILE 138 HB ILE 138 -8.771 1.969 7.984 1046 1HG1 ILE 138 1HG1 ILE 138 -8.455 4.343 9.914 1047 2HG1 ILE 138 2HG1 ILE 138 -8.006 2.663 10.231 1048 1HG2 ILE 138 2HG2 ILE 138 -9.792 3.657 6.420 1049 2HG2 ILE 138 3HG2 ILE 138 -9.372 4.970 7.553 1050 3HG2 ILE 138 1HG2 ILE 138 -8.080 4.045 6.743 1051 1HD1 ILE 138 3HD1 ILE 138 -6.752 4.473 8.048 1052 2HD1 ILE 138 1HD1 ILE 138 -5.984 4.030 9.594 1053 3HD1 ILE 138 2HD1 ILE 138 -6.284 2.779 8.356 1054 H SER 139 H SER 139 -10.436 0.670 7.907 1055 HA SER 139 HA SER 139 -12.158 1.114 5.591 1056 1HB SER 139 1HB SER 139 -12.129 -1.362 5.363 1057 2HB SER 139 2HB SER 139 -10.508 -0.720 5.692 1058 HG SER 139 HG SER 139 -11.030 -2.508 6.989 1059 H GLN 140 H GLN 140 -13.099 1.311 8.607 1060 HA GLN 140 HA GLN 140 -15.855 0.006 8.228 1061 1HB GLN 140 1HB GLN 140 -14.743 1.387 10.739 1062 2HB GLN 140 2HB GLN 140 -16.247 0.467 10.579 1063 1HG GLN 140 1HG GLN 140 -13.367 -0.562 10.460 1064 2HG GLN 140 2HG GLN 140 -14.690 -1.137 11.481 1065 1HE2 GLN 140 2HE2 GLN 140 -14.169 -2.561 7.662 1066 2HE2 GLN 140 1HE2 GLN 140 -13.009 -1.506 8.594 1067 H VAL 141 H VAL 141 -14.281 3.043 9.101 1068 HA VAL 141 HA VAL 141 -16.540 4.822 9.161 1069 HB VAL 141 HB VAL 141 -14.953 6.613 8.505 1070 1HG1 VAL 141 3HG2 VAL 141 -14.927 5.716 10.852 1071 2HG1 VAL 141 1HG2 VAL 141 -13.723 4.489 10.382 1072 3HG1 VAL 141 2HG2 VAL 141 -13.291 6.219 10.353 1073 1HG2 VAL 141 1HG1 VAL 141 -13.754 5.363 6.683 1074 2HG2 VAL 141 2HG1 VAL 141 -12.592 6.009 7.872 1075 3HG2 VAL 141 3HG1 VAL 141 -13.023 4.277 7.892 1076 HA PRO 142 HA PRO 142 -18.546 4.333 5.264 1077 1HB PRO 142 1HB PRO 142 -19.071 7.252 6.032 1078 2HB PRO 142 2HB PRO 142 -20.236 6.060 5.402 1079 1HG PRO 142 1HG PRO 142 -20.209 6.538 8.071 1080 2HG PRO 142 2HG PRO 142 -20.261 4.847 7.519 1081 1HD PRO 142 1HD PRO 142 -17.834 6.397 8.566 1082 2HD PRO 142 2HD PRO 142 -18.293 4.690 8.869 1083 H THR 143 H THR 143 -18.893 5.836 3.368 1084 HA THR 143 HA THR 143 -16.582 7.604 2.548 1085 HB THR 143 HB THR 143 -16.257 6.098 0.448 1086 HG1 THR 143 HG1 THR 143 -16.561 3.897 0.910 1087 1HG2 THR 143 2HG2 THR 143 -14.502 6.470 2.156 1088 2HG2 THR 143 3HG2 THR 143 -15.171 5.145 3.156 1089 3HG2 THR 143 1HG2 THR 143 -14.466 4.794 1.544 1090 H HIS 144 H HIS 144 -16.691 6.881 0.001 1091 HA HIS 144 HA HIS 144 -19.245 6.844 -1.322 1092 1HB HIS 144 1HB HIS 144 -19.704 9.161 -1.933 1093 2HB HIS 144 2HB HIS 144 -19.661 9.034 -0.176 1094 HD2 HIS 144 HD2 HIS 144 -16.155 9.040 -1.760 1095 HE1 HIS 144 HE1 HIS 144 -16.881 12.990 -0.711 1096 HE2 HIS 144 HE2 HIS 144 -15.022 11.416 -1.520 1097 H ASP 145 H ASP 145 -19.245 7.499 -3.512 1098 HA ASP 145 HA ASP 145 -16.868 6.823 -5.104 1099 1HB ASP 145 1HB ASP 145 -19.240 8.669 -5.785 1100 2HB ASP 145 2HB ASP 145 -18.078 8.026 -6.958 1101 H VAL 146 H VAL 146 -17.130 9.303 -6.722 1102 HA VAL 146 HA VAL 146 -16.437 11.606 -5.061 1103 HB VAL 146 HB VAL 146 -14.064 11.050 -6.812 1104 1HG1 VAL 146 3HG2 VAL 146 -14.450 13.181 -5.508 1105 2HG1 VAL 146 1HG2 VAL 146 -14.516 12.239 -3.997 1106 3HG1 VAL 146 2HG2 VAL 146 -12.991 12.329 -4.915 1107 1HG2 VAL 146 2HG1 VAL 146 -14.247 8.846 -5.620 1108 2HG2 VAL 146 3HG1 VAL 146 -12.849 9.790 -5.048 1109 3HG2 VAL 146 1HG1 VAL 146 -14.325 9.697 -4.054 1110 H GLY 147 H GLY 147 -15.462 10.307 -8.015 1111 1HA GLY 147 1HA GLY 147 -17.448 11.618 -9.768 1112 2HA GLY 147 2HA GLY 147 -15.929 12.551 -9.839 1113 HA PRO 148 HA PRO 148 -14.311 9.500 -12.729 1114 1HB PRO 148 1HB PRO 148 -11.683 10.296 -12.542 1115 2HB PRO 148 2HB PRO 148 -12.920 11.347 -13.276 1116 1HG PRO 148 1HG PRO 148 -11.867 11.446 -10.395 1117 2HG PRO 148 2HG PRO 148 -11.991 12.799 -11.546 1118 1HD PRO 148 1HD PRO 148 -13.960 12.313 -9.642 1119 2HD PRO 148 2HD PRO 148 -14.396 12.933 -11.268 1120 OH TYR 149 OH TYR 149 -6.875 11.084 -11.758 1121 H TYR 149 H TYR 149 -12.237 10.220 -9.961 1122 HA TYR 149 HA TYR 149 -11.284 7.449 -9.625 1123 1HB TYR 149 1HB TYR 149 -11.141 9.815 -7.661 1124 2HB TYR 149 2HB TYR 149 -10.200 8.325 -7.556 1125 HD1 TYR 149 HD1 TYR 149 -9.032 7.675 -9.871 1126 HD2 TYR 149 HD2 TYR 149 -10.093 11.595 -8.721 1127 HE1 TYR 149 HE1 TYR 149 -7.367 8.574 -11.395 1128 HE2 TYR 149 HE2 TYR 149 -8.428 12.492 -10.246 1129 HH TYR 149 HH TYR 149 -6.887 12.043 -11.707 1130 H GLN 150 H GLN 150 -12.546 5.945 -9.112 1131 HA GLN 150 HA GLN 150 -14.815 6.144 -7.143 1132 1HB GLN 150 1HB GLN 150 -13.469 3.684 -8.411 1133 2HB GLN 150 2HB GLN 150 -14.972 3.680 -7.476 1134 1HG GLN 150 1HG GLN 150 -14.492 5.216 -10.108 1135 2HG GLN 150 2HG GLN 150 -15.432 3.728 -9.938 1136 1HE2 GLN 150 2HE2 GLN 150 -18.093 6.193 -9.878 1137 2HE2 GLN 150 1HE2 GLN 150 -17.029 5.177 -10.975 1138 H ASN 151 H ASN 151 -14.918 5.200 -5.204 1139 HA ASN 151 HA ASN 151 -14.159 4.330 -3.098 1140 1HB ASN 151 1HB ASN 151 -11.510 3.813 -4.580 1141 2HB ASN 151 2HB ASN 151 -11.922 3.227 -2.960 1142 1HD2 ASN 151 1HD2 ASN 151 -12.814 0.403 -5.138 1143 2HD2 ASN 151 2HD2 ASN 151 -11.352 1.260 -4.435 1144 H VAL 152 H VAL 152 -14.405 6.136 -2.116 1145 HA VAL 152 HA VAL 152 -11.976 7.427 -1.001 1146 HB VAL 152 HB VAL 152 -13.842 9.107 -2.778 1147 1HG1 VAL 152 3HG2 VAL 152 -13.231 10.282 -0.644 1148 2HG1 VAL 152 1HG2 VAL 152 -11.506 9.943 -0.936 1149 3HG1 VAL 152 2HG2 VAL 152 -12.399 11.031 -2.032 1150 1HG2 VAL 152 1HG1 VAL 152 -10.815 8.473 -2.942 1151 2HG2 VAL 152 2HG1 VAL 152 -12.070 7.831 -4.036 1152 3HG2 VAL 152 3HG1 VAL 152 -11.695 9.576 -4.034 1153 HA PRO 153 HA PRO 153 -15.028 7.250 2.234 1154 1HB PRO 153 1HB PRO 153 -13.200 7.961 4.196 1155 2HB PRO 153 2HB PRO 153 -13.208 6.353 3.427 1156 1HG PRO 153 1HG PRO 153 -11.459 8.764 2.682 1157 2HG PRO 153 2HG PRO 153 -10.922 7.093 3.003 1158 1HD PRO 153 1HD PRO 153 -11.332 7.996 0.418 1159 2HD PRO 153 2HD PRO 153 -11.788 6.320 0.862 1160 H SER 154 H SER 154 -16.402 8.776 1.984 1161 HA SER 154 HA SER 154 -16.106 11.540 1.426 1162 1HB SER 154 1HB SER 154 -18.317 11.892 2.569 1163 2HB SER 154 2HB SER 154 -18.320 10.488 1.486 1164 HG SER 154 HG SER 154 -19.245 10.036 3.504 1165 H LYS 155 H LYS 155 -16.524 10.109 4.631 1166 HA LYS 155 HA LYS 155 -15.257 12.424 6.099 1167 1HB LYS 155 1HB LYS 155 -17.023 10.936 7.116 1168 2HB LYS 155 2HB LYS 155 -15.923 9.554 6.991 1169 1HG LYS 155 1HG LYS 155 -14.231 10.772 8.423 1170 2HG LYS 155 2HG LYS 155 -15.308 12.167 8.515 1171 1HD LYS 155 1HD LYS 155 -17.064 10.734 9.668 1172 2HD LYS 155 2HD LYS 155 -15.970 9.347 9.596 1173 1HE LYS 155 1HE LYS 155 -14.286 10.597 11.034 1174 2HE LYS 155 2HE LYS 155 -15.372 11.994 11.096 1175 1HZ LYS 155 3HZ LYS 155 -17.036 10.579 12.188 1176 2HZ LYS 155 1HZ LYS 155 -16.022 9.275 12.133 1177 3HZ LYS 155 2HZ LYS 155 -15.625 10.594 13.047 1178 HA PRO 156 HA PRO 156 -11.631 10.388 4.207 1179 1HB PRO 156 1HB PRO 156 -10.217 12.736 3.810 1180 2HB PRO 156 2HB PRO 156 -11.614 12.265 2.815 1181 1HG PRO 156 1HG PRO 156 -11.616 14.147 5.234 1182 2HG PRO 156 2HG PRO 156 -12.295 14.464 3.618 1183 1HD PRO 156 1HD PRO 156 -13.906 13.573 5.674 1184 2HD PRO 156 2HD PRO 156 -14.165 12.948 4.012 1185 H VAL 157 H VAL 157 -10.100 9.476 5.127 1186 HA VAL 157 HA VAL 157 -9.073 10.086 7.864 1187 HB VAL 157 HB VAL 157 -7.945 8.277 5.649 1188 1HG1 VAL 157 3HG2 VAL 157 -6.240 8.913 7.380 1189 2HG1 VAL 157 1HG2 VAL 157 -7.354 8.414 8.679 1190 3HG1 VAL 157 2HG2 VAL 157 -6.698 7.198 7.551 1191 1HG2 VAL 157 2HG1 VAL 157 -10.265 7.625 6.376 1192 2HG2 VAL 157 3HG1 VAL 157 -9.062 6.439 6.945 1193 3HG2 VAL 157 1HG1 VAL 157 -9.741 7.633 8.081 1194 H VAL 158 H VAL 158 -6.989 10.619 8.360 1195 HA VAL 158 HA VAL 158 -5.171 11.857 6.267 1196 HB VAL 158 HB VAL 158 -6.155 13.396 8.744 1197 1HG1 VAL 158 3HG2 VAL 158 -3.703 13.713 8.282 1198 2HG1 VAL 158 1HG2 VAL 158 -4.061 14.108 6.582 1199 3HG1 VAL 158 2HG2 VAL 158 -4.611 15.195 7.885 1200 1HG2 VAL 158 2HG1 VAL 158 -7.782 13.397 6.822 1201 2HG2 VAL 158 3HG1 VAL 158 -7.039 15.007 7.020 1202 3HG2 VAL 158 1HG1 VAL 158 -6.487 13.923 5.715 1203 H ILE 159 H ILE 159 -3.417 11.017 6.480 1204 HA ILE 159 HA ILE 159 -2.640 9.314 8.734 1205 HB ILE 159 HB ILE 159 -1.017 10.406 6.373 1206 1HG1 ILE 159 1HG1 ILE 159 -2.557 7.815 7.005 1207 2HG1 ILE 159 2HG1 ILE 159 -2.993 9.017 5.785 1208 1HG2 ILE 159 3HG2 ILE 159 -0.360 8.165 8.400 1209 2HG2 ILE 159 1HG2 ILE 159 0.581 8.546 6.933 1210 3HG2 ILE 159 2HG2 ILE 159 0.488 9.727 8.263 1211 1HD1 ILE 159 2HD1 ILE 159 -0.400 7.331 5.788 1212 2HD1 ILE 159 3HD1 ILE 159 -1.826 7.041 4.751 1213 3HD1 ILE 159 1HD1 ILE 159 -0.849 8.522 4.534 1214 H LEU 160 H LEU 160 -1.521 9.524 10.318 1215 HA LEU 160 HA LEU 160 -0.934 12.270 11.435 1216 1HB LEU 160 1HB LEU 160 -0.505 9.477 12.657 1217 2HB LEU 160 2HB LEU 160 -0.329 11.019 13.508 1218 HG LEU 160 HG LEU 160 -2.899 10.000 12.154 1219 1HD1 LEU 160 2HD1 LEU 160 -2.335 8.800 14.294 1220 2HD1 LEU 160 3HD1 LEU 160 -2.185 10.361 15.141 1221 3HD1 LEU 160 1HD1 LEU 160 -3.768 9.838 14.507 1222 1HD2 LEU 160 3HD2 LEU 160 -2.683 12.502 12.038 1223 2HD2 LEU 160 1HD2 LEU 160 -3.973 12.028 13.174 1224 3HD2 LEU 160 2HD2 LEU 160 -2.391 12.567 13.796 1225 H SER 161 H SER 161 0.798 9.258 10.823 1226 HA SER 161 HA SER 161 3.282 10.692 9.920 1227 1HB SER 161 1HB SER 161 3.297 9.110 12.566 1228 2HB SER 161 2HB SER 161 4.729 9.765 11.749 1229 HG SER 161 HG SER 161 3.906 11.142 13.367 1230 H ALA 162 H ALA 162 5.130 8.869 10.385 1231 HA ALA 162 HA ALA 162 4.537 6.119 9.612 1232 1HB ALA 162 2HB ALA 162 3.585 7.202 7.540 1233 2HB ALA 162 3HB ALA 162 5.148 8.003 7.232 1234 3HB ALA 162 1HB ALA 162 5.023 6.227 7.149 1235 H LYS 163 H LYS 163 6.217 4.940 9.703 1236 HA LYS 163 HA LYS 163 8.980 5.726 9.061 1237 1HB LYS 163 1HB LYS 163 9.883 5.814 11.378 1238 2HB LYS 163 2HB LYS 163 8.731 7.128 11.080 1239 1HG LYS 163 1HG LYS 163 6.892 5.739 12.138 1240 2HG LYS 163 2HG LYS 163 8.052 4.448 12.455 1241 1HD LYS 163 1HD LYS 163 9.404 6.023 13.920 1242 2HD LYS 163 2HD LYS 163 8.239 7.314 13.602 1243 1HE LYS 163 1HE LYS 163 6.403 5.925 14.687 1244 2HE LYS 163 2HE LYS 163 7.570 4.633 15.006 1245 1HZ LYS 163 1HZ LYS 163 8.845 6.207 16.374 1246 2HZ LYS 163 2HZ LYS 163 7.745 7.405 16.087 1247 3HZ LYS 163 3HZ LYS 163 7.297 6.058 16.932 1248 H VAL 164 H VAL 164 10.195 4.092 8.830 1249 HA VAL 164 HA VAL 164 9.159 1.322 9.242 1250 HB VAL 164 HB VAL 164 11.289 0.683 8.188 1251 1HG1 VAL 164 1HG2 VAL 164 9.879 3.085 6.854 1252 2HG1 VAL 164 2HG2 VAL 164 10.896 1.896 5.995 1253 3HG1 VAL 164 3HG2 VAL 164 9.365 1.381 6.753 1254 1HG2 VAL 164 1HG1 VAL 164 11.952 3.698 8.331 1255 2HG2 VAL 164 2HG1 VAL 164 12.779 2.406 9.240 1256 3HG2 VAL 164 3HG1 VAL 164 12.919 2.476 7.463 1257 H LEU 165 H LEU 165 9.622 -0.023 10.685 1258 HA LEU 165 HA LEU 165 11.369 0.745 13.087 1259 1HB LEU 165 1HB LEU 165 9.052 -0.036 13.576 1260 2HB LEU 165 2HB LEU 165 9.369 -1.564 12.738 1261 HG LEU 165 HG LEU 165 11.244 -2.073 14.297 1262 1HD1 LEU 165 2HD1 LEU 165 11.991 0.275 14.747 1263 2HD1 LEU 165 3HD1 LEU 165 10.490 0.600 15.653 1264 3HD1 LEU 165 1HD1 LEU 165 11.672 -0.580 16.277 1265 1HD2 LEU 165 3HD2 LEU 165 8.935 -2.817 14.944 1266 2HD2 LEU 165 1HD2 LEU 165 9.887 -2.398 16.392 1267 3HD2 LEU 165 2HD2 LEU 165 8.654 -1.266 15.779 1268 HA PRO 166 HA PRO 166 14.789 -1.423 11.239 1269 1HB PRO 166 1HB PRO 166 15.352 -1.383 14.250 1270 2HB PRO 166 2HB PRO 166 16.482 -1.026 12.921 1271 1HG PRO 166 1HG PRO 166 15.371 1.053 14.265 1272 2HG PRO 166 2HG PRO 166 15.414 1.124 12.486 1273 1HD PRO 166 1HD PRO 166 13.024 0.418 14.271 1274 2HD PRO 166 2HD PRO 166 13.056 1.410 12.776 Start of MODEL 4 Raw file had 1274 H/Q atoms Start of MODEL 4 1 1H ALA 1 2H ALA 1 11.717 -13.519 17.947 2 2H ALA 1 3H ALA 1 10.684 -13.872 16.707 3 3H ALA 1 1H ALA 1 11.809 -14.983 17.186 4 HA ALA 1 HA ALA 1 13.635 -13.555 16.473 5 1HB ALA 1 1HB ALA 1 12.710 -15.242 14.857 6 2HB ALA 1 2HB ALA 1 11.488 -14.066 14.302 7 3HB ALA 1 3HB ALA 1 13.219 -13.767 13.996 8 H LYS 2 H LYS 2 13.579 -11.664 17.481 9 HA LYS 2 HA LYS 2 11.822 -9.427 17.150 10 1HB LYS 2 1HB LYS 2 13.759 -9.606 18.781 11 2HB LYS 2 2HB LYS 2 14.885 -9.339 17.446 12 1HG LYS 2 1HG LYS 2 14.433 -7.198 18.620 13 2HG LYS 2 2HG LYS 2 13.854 -7.124 16.952 14 1HD LYS 2 1HD LYS 2 11.502 -7.645 17.736 15 2HD LYS 2 2HD LYS 2 12.074 -7.737 19.406 16 1HE LYS 2 1HE LYS 2 12.802 -5.301 19.292 17 2HE LYS 2 2HE LYS 2 12.223 -5.207 17.622 18 1HZ LYS 2 2HZ LYS 2 10.523 -5.828 19.991 19 2HZ LYS 2 3HZ LYS 2 10.570 -4.388 19.182 20 3HZ LYS 2 1HZ LYS 2 9.981 -5.738 18.433 21 H GLY 3 H GLY 3 11.214 -9.721 14.976 22 1HA GLY 3 1HA GLY 3 12.732 -9.562 12.595 23 2HA GLY 3 2HA GLY 3 11.125 -8.841 12.736 24 H ASP 4 H ASP 4 11.400 -7.119 11.592 25 HA ASP 4 HA ASP 4 12.567 -4.686 12.717 26 1HB ASP 4 1HB ASP 4 14.201 -6.046 10.483 27 2HB ASP 4 2HB ASP 4 14.386 -4.353 10.954 28 HA PRO 5 HA PRO 5 11.754 -3.698 8.006 29 1HB PRO 5 1HB PRO 5 11.100 -6.596 7.247 30 2HB PRO 5 2HB PRO 5 11.815 -5.329 6.218 31 1HG PRO 5 1HG PRO 5 13.469 -7.173 7.322 32 2HG PRO 5 2HG PRO 5 13.944 -5.458 7.407 33 1HD PRO 5 1HD PRO 5 12.719 -7.171 9.633 34 2HD PRO 5 2HD PRO 5 14.018 -5.939 9.748 35 H HIS 6 H HIS 6 10.200 -2.892 9.460 36 HA HIS 6 HA HIS 6 7.358 -3.691 8.702 37 1HB HIS 6 1HB HIS 6 8.316 -3.401 11.621 38 2HB HIS 6 2HB HIS 6 6.643 -3.631 11.097 39 HD2 HIS 6 HD2 HIS 6 8.579 -5.667 8.738 40 HE1 HIS 6 HE1 HIS 6 7.928 -8.290 11.903 41 HE2 HIS 6 HE2 HIS 6 8.691 -8.228 9.446 42 H VAL 7 H VAL 7 6.610 -2.043 7.884 43 HA VAL 7 HA VAL 7 7.484 0.765 8.400 44 HB VAL 7 HB VAL 7 6.489 0.071 6.199 45 1HG1 VAL 7 1HG2 VAL 7 3.916 -0.322 7.859 46 2HG1 VAL 7 2HG2 VAL 7 4.032 -0.413 6.081 47 3HG1 VAL 7 3HG2 VAL 7 4.863 -1.624 7.094 48 1HG2 VAL 7 2HG1 VAL 7 6.352 2.455 6.967 49 2HG2 VAL 7 3HG1 VAL 7 4.914 2.011 6.009 50 3HG2 VAL 7 1HG1 VAL 7 4.807 2.112 7.787 51 H LEU 8 H LEU 8 6.595 2.256 9.610 52 HA LEU 8 HA LEU 8 3.870 1.759 10.905 53 1HB LEU 8 1HB LEU 8 6.305 2.838 12.430 54 2HB LEU 8 2HB LEU 8 4.625 3.151 12.888 55 HG LEU 8 HG LEU 8 4.246 0.572 12.620 56 1HD1 LEU 8 2HD1 LEU 8 6.472 0.087 11.569 57 2HD1 LEU 8 3HD1 LEU 8 7.307 0.664 13.035 58 3HD1 LEU 8 1HD1 LEU 8 6.289 -0.802 13.106 59 1HD2 LEU 8 3HD2 LEU 8 4.089 1.822 14.764 60 2HD2 LEU 8 1HD2 LEU 8 4.865 0.241 15.023 61 3HD2 LEU 8 2HD2 LEU 8 5.856 1.731 14.981 62 H LEU 9 H LEU 9 2.677 2.857 10.181 63 HA LEU 9 HA LEU 9 3.077 5.900 9.886 64 1HB LEU 9 1HB LEU 9 1.029 4.116 8.431 65 2HB LEU 9 2HB LEU 9 0.931 5.874 8.542 66 HG LEU 9 HG LEU 9 3.228 6.065 7.502 67 1HD1 LEU 9 2HD1 LEU 9 4.086 3.767 8.041 68 2HD1 LEU 9 3HD1 LEU 9 2.852 3.044 6.974 69 3HD1 LEU 9 1HD1 LEU 9 4.141 4.065 6.285 70 1HD2 LEU 9 3HD2 LEU 9 1.132 6.335 6.149 71 2HD2 LEU 9 1HD2 LEU 9 2.415 5.570 5.177 72 3HD2 LEU 9 2HD2 LEU 9 1.089 4.579 5.840 73 H THR 10 H THR 10 0.844 6.861 10.182 74 HA THR 10 HA THR 10 -1.016 5.514 12.073 75 HB THR 10 HB THR 10 0.664 7.902 13.084 76 HG1 THR 10 HG1 THR 10 1.325 6.358 14.616 77 1HG2 THR 10 3HG2 THR 10 -1.592 6.268 14.429 78 2HG2 THR 10 1HG2 THR 10 -0.645 7.563 15.209 79 3HG2 THR 10 2HG2 THR 10 -1.736 7.949 13.852 80 H THR 11 H THR 11 -2.583 5.929 10.943 81 HA THR 11 HA THR 11 -3.113 8.590 9.597 82 HB THR 11 HB THR 11 -5.281 7.504 8.940 83 HG1 THR 11 HG1 THR 11 -4.119 5.303 10.306 84 1HG2 THR 11 2HG2 THR 11 -3.229 7.300 7.516 85 2HG2 THR 11 3HG2 THR 11 -2.734 5.841 8.418 86 3HG2 THR 11 1HG2 THR 11 -4.217 5.817 7.420 87 H SER 12 H SER 12 -5.305 9.369 9.791 88 HA SER 12 HA SER 12 -5.874 10.668 12.277 89 1HB SER 12 1HB SER 12 -8.209 10.947 11.447 90 2HB SER 12 2HB SER 12 -7.031 11.245 10.154 91 HG SER 12 HG SER 12 -8.730 9.882 9.508 92 H ALA 13 H ALA 13 -6.991 7.560 11.071 93 HA ALA 13 HA ALA 13 -8.756 6.797 13.215 94 1HB ALA 13 2HB ALA 13 -8.560 5.507 11.078 95 2HB ALA 13 3HB ALA 13 -6.927 4.966 11.540 96 3HB ALA 13 1HB ALA 13 -8.346 4.438 12.483 97 H GLY 14 H GLY 14 -5.469 5.977 12.729 98 1HA GLY 14 1HA GLY 14 -4.383 6.417 15.356 99 2HA GLY 14 2HA GLY 14 -5.056 4.788 15.466 100 H ASN 15 H ASN 15 -2.776 4.678 16.071 101 HA ASN 15 HA ASN 15 -0.555 4.596 14.204 102 1HB ASN 15 1HB ASN 15 -0.347 4.301 16.699 103 2HB ASN 15 2HB ASN 15 -1.120 2.714 16.580 104 1HD2 ASN 15 1HD2 ASN 15 2.560 3.066 14.686 105 2HD2 ASN 15 2HD2 ASN 15 1.280 4.372 14.533 106 H ILE 16 H ILE 16 0.491 2.812 13.342 107 HA ILE 16 HA ILE 16 -0.934 0.314 12.570 108 HB ILE 16 HB ILE 16 -2.227 2.128 11.367 109 1HG1 ILE 16 1HG1 ILE 16 -0.608 0.241 9.555 110 2HG1 ILE 16 2HG1 ILE 16 -2.097 -0.179 10.418 111 1HG2 ILE 16 2HG2 ILE 16 -0.285 3.690 11.062 112 2HG2 ILE 16 3HG2 ILE 16 0.476 2.533 9.936 113 3HG2 ILE 16 1HG2 ILE 16 -1.062 3.328 9.491 114 1HD1 ILE 16 2HD1 ILE 16 -3.338 1.666 9.186 115 2HD1 ILE 16 3HD1 ILE 16 -1.842 2.090 8.320 116 3HD1 ILE 16 1HD1 ILE 16 -2.616 0.506 8.038 117 H GLU 17 H GLU 17 0.128 -0.872 10.993 118 HA GLU 17 HA GLU 17 2.920 -0.276 10.177 119 1HB GLU 17 1HB GLU 17 3.260 -0.565 12.629 120 2HB GLU 17 2HB GLU 17 2.479 -2.157 12.565 121 1HG GLU 17 1HG GLU 17 4.246 -2.934 10.905 122 2HG GLU 17 2HG GLU 17 5.028 -1.362 11.007 123 H LEU 18 H LEU 18 3.292 -1.274 8.541 124 HA LEU 18 HA LEU 18 2.204 -4.096 7.962 125 1HB LEU 18 1HB LEU 18 3.668 -2.137 6.095 126 2HB LEU 18 2HB LEU 18 3.230 -3.799 5.703 127 HG LEU 18 HG LEU 18 1.492 -2.484 4.770 128 1HD1 LEU 18 2HD1 LEU 18 0.670 -4.493 6.034 129 2HD1 LEU 18 3HD1 LEU 18 0.479 -3.504 7.506 130 3HD1 LEU 18 1HD1 LEU 18 -0.538 -3.183 6.076 131 1HD2 LEU 18 3HD2 LEU 18 1.968 -0.345 5.956 132 2HD2 LEU 18 1HD2 LEU 18 0.231 -0.733 6.018 133 3HD2 LEU 18 2HD2 LEU 18 1.253 -0.996 7.459 134 H GLU 19 H GLU 19 3.907 -5.246 6.619 135 HA GLU 19 HA GLU 19 6.753 -4.994 7.616 136 1HB GLU 19 1HB GLU 19 5.487 -6.428 9.307 137 2HB GLU 19 2HB GLU 19 5.136 -7.583 8.022 138 1HG GLU 19 1HG GLU 19 7.948 -6.696 8.959 139 2HG GLU 19 2HG GLU 19 7.171 -8.213 9.398 140 H LEU 20 H LEU 20 7.893 -5.089 6.003 141 HA LEU 20 HA LEU 20 6.777 -6.029 3.345 142 1HB LEU 20 1HB LEU 20 9.306 -4.424 4.038 143 2HB LEU 20 2HB LEU 20 8.761 -4.836 2.411 144 HG LEU 20 HG LEU 20 6.511 -3.724 2.952 145 1HD1 LEU 20 3HD1 LEU 20 8.120 -2.580 5.332 146 2HD1 LEU 20 1HD1 LEU 20 6.517 -2.012 4.799 147 3HD1 LEU 20 2HD1 LEU 20 6.704 -3.655 5.457 148 1HD2 LEU 20 3HD2 LEU 20 8.261 -2.629 1.530 149 2HD2 LEU 20 1HD2 LEU 20 7.402 -1.422 2.519 150 3HD2 LEU 20 2HD2 LEU 20 9.039 -1.951 2.985 151 H ASP 21 H ASP 21 9.062 -6.415 1.978 152 HA ASP 21 HA ASP 21 10.615 -8.750 3.100 153 1HB ASP 21 1HB ASP 21 8.395 -9.757 2.461 154 2HB ASP 21 2HB ASP 21 8.565 -9.099 0.824 155 H LYS 22 H LYS 22 12.364 -7.736 2.655 156 HA LYS 22 HA LYS 22 13.062 -6.268 0.240 157 1HB LYS 22 1HB LYS 22 14.323 -6.131 2.382 158 2HB LYS 22 2HB LYS 22 14.811 -7.827 2.226 159 1HG LYS 22 1HG LYS 22 15.884 -7.263 -0.020 160 2HG LYS 22 2HG LYS 22 15.525 -5.564 0.242 161 1HD LYS 22 1HD LYS 22 17.321 -7.310 2.062 162 2HD LYS 22 2HD LYS 22 17.907 -6.271 0.770 163 1HE LYS 22 1HE LYS 22 16.980 -4.225 1.959 164 2HE LYS 22 2HE LYS 22 16.405 -5.254 3.279 165 1HZ LYS 22 1HZ LYS 22 19.253 -4.972 2.452 166 2HZ LYS 22 2HZ LYS 22 18.558 -4.292 3.787 167 3HZ LYS 22 3HZ LYS 22 18.713 -5.933 3.682 168 H GLN 23 H GLN 23 13.594 -9.621 1.206 169 HA GLN 23 HA GLN 23 15.556 -10.432 -0.652 170 1HB GLN 23 1HB GLN 23 13.119 -12.109 0.208 171 2HB GLN 23 2HB GLN 23 14.631 -12.747 -0.450 172 1HG GLN 23 1HG GLN 23 14.357 -11.107 2.150 173 2HG GLN 23 2HG GLN 23 14.595 -12.856 2.063 174 1HE2 GLN 23 2HE2 GLN 23 18.065 -12.601 1.036 175 2HE2 GLN 23 1HE2 GLN 23 16.535 -13.598 0.861 176 H LYS 24 H LYS 24 12.124 -11.060 -1.085 177 HA LYS 24 HA LYS 24 12.410 -11.798 -3.928 178 1HB LYS 24 1HB LYS 24 9.951 -11.148 -2.219 179 2HB LYS 24 2HB LYS 24 9.873 -11.689 -3.898 180 1HG LYS 24 1HG LYS 24 11.193 -13.188 -1.546 181 2HG LYS 24 2HG LYS 24 9.693 -13.648 -2.359 182 1HD LYS 24 1HD LYS 24 11.009 -13.980 -4.539 183 2HD LYS 24 2HD LYS 24 12.476 -13.506 -3.698 184 1HE LYS 24 1HE LYS 24 12.538 -15.893 -3.811 185 2HE LYS 24 2HE LYS 24 12.215 -15.507 -2.123 186 1HZ LYS 24 3HZ LYS 24 10.168 -16.344 -4.132 187 2HZ LYS 24 1HZ LYS 24 10.790 -17.290 -2.929 188 3HZ LYS 24 2HZ LYS 24 9.843 -15.989 -2.551 189 H ALA 25 H ALA 25 12.480 -8.783 -2.576 190 HA ALA 25 HA ALA 25 12.166 -7.480 -5.270 191 1HB ALA 25 2HB ALA 25 9.775 -7.612 -4.497 192 2HB ALA 25 3HB ALA 25 10.203 -6.758 -2.990 193 3HB ALA 25 1HB ALA 25 10.334 -5.922 -4.560 194 HA PRO 26 HA PRO 26 15.454 -5.754 -2.437 195 1HB PRO 26 1HB PRO 26 16.680 -5.924 -5.227 196 2HB PRO 26 2HB PRO 26 17.454 -6.282 -3.666 197 1HG PRO 26 1HG PRO 26 16.664 -8.352 -5.241 198 2HG PRO 26 2HG PRO 26 16.306 -8.423 -3.497 199 1HD PRO 26 1HD PRO 26 14.385 -7.646 -5.766 200 2HD PRO 26 2HD PRO 26 14.079 -8.705 -4.349 201 H VAL 27 H VAL 27 14.972 -5.085 -5.869 202 HA VAL 27 HA VAL 27 15.746 -2.337 -5.958 203 HB VAL 27 HB VAL 27 13.496 -3.691 -7.559 204 1HG1 VAL 27 3HG2 VAL 27 13.457 -1.185 -7.714 205 2HG1 VAL 27 1HG2 VAL 27 15.187 -1.172 -8.143 206 3HG1 VAL 27 2HG2 VAL 27 13.997 -1.903 -9.253 207 1HG2 VAL 27 2HG1 VAL 27 15.691 -4.910 -7.682 208 2HG2 VAL 27 3HG1 VAL 27 15.323 -4.114 -9.235 209 3HG2 VAL 27 1HG1 VAL 27 16.521 -3.396 -8.125 210 H SER 28 H SER 28 12.416 -3.504 -5.946 211 HA SER 28 HA SER 28 11.011 -1.092 -5.612 212 1HB SER 28 1HB SER 28 10.378 -3.739 -4.168 213 2HB SER 28 2HB SER 28 9.227 -2.416 -4.440 214 HG SER 28 HG SER 28 9.114 -4.032 -6.034 215 H VAL 29 H VAL 29 12.056 -3.208 -2.967 216 HA VAL 29 HA VAL 29 11.205 -1.644 -0.752 217 HB VAL 29 HB VAL 29 12.985 -2.818 0.526 218 1HG1 VAL 29 3HG2 VAL 29 10.830 -3.957 -0.057 219 2HG1 VAL 29 1HG2 VAL 29 11.538 -4.543 -1.584 220 3HG1 VAL 29 2HG2 VAL 29 12.171 -5.133 -0.023 221 1HG2 VAL 29 2HG1 VAL 29 14.834 -2.685 -1.169 222 2HG2 VAL 29 3HG1 VAL 29 14.547 -4.377 -0.686 223 3HG2 VAL 29 1HG1 VAL 29 13.934 -3.779 -2.252 224 H GLN 30 H GLN 30 14.331 -1.539 -2.417 225 HA GLN 30 HA GLN 30 15.647 0.468 -0.852 226 1HB GLN 30 1HB GLN 30 16.660 -0.848 -2.769 227 2HB GLN 30 2HB GLN 30 15.800 0.180 -3.919 228 1HG GLN 30 1HG GLN 30 17.817 1.167 -1.798 229 2HG GLN 30 2HG GLN 30 18.198 0.897 -3.499 230 1HE2 GLN 30 2HE2 GLN 30 16.645 4.453 -2.450 231 2HE2 GLN 30 1HE2 GLN 30 17.290 3.190 -1.286 232 H ASN 31 H ASN 31 14.066 1.059 -3.954 233 HA ASN 31 HA ASN 31 13.885 3.879 -3.933 234 1HB ASN 31 1HB ASN 31 13.062 2.424 -5.811 235 2HB ASN 31 2HB ASN 31 11.665 1.939 -4.839 236 1HD2 ASN 31 1HD2 ASN 31 11.868 5.962 -5.880 237 2HD2 ASN 31 2HD2 ASN 31 13.352 5.043 -5.314 238 H PHE 32 H PHE 32 11.500 1.620 -2.641 239 HA PHE 32 HA PHE 32 9.567 3.345 -1.509 240 1HB PHE 32 1HB PHE 32 9.485 0.835 -1.382 241 2HB PHE 32 2HB PHE 32 10.765 0.842 -0.164 242 HD1 PHE 32 HD1 PHE 32 7.582 2.705 -0.792 243 HD2 PHE 32 HD2 PHE 32 9.971 0.659 2.019 244 HE1 PHE 32 HE1 PHE 32 5.890 3.068 0.914 245 HE2 PHE 32 HE2 PHE 32 8.277 1.025 3.723 246 HZ PHE 32 HZ PHE 32 6.236 2.229 3.171 247 H VAL 33 H VAL 33 12.335 2.037 0.258 248 HA VAL 33 HA VAL 33 12.276 3.648 2.602 249 HB VAL 33 HB VAL 33 14.778 2.836 1.005 250 1HG1 VAL 33 3HG2 VAL 33 15.229 4.580 2.756 251 2HG1 VAL 33 1HG2 VAL 33 14.400 3.584 3.980 252 3HG1 VAL 33 2HG2 VAL 33 15.919 3.009 3.241 253 1HG2 VAL 33 2HG1 VAL 33 13.260 0.904 1.540 254 2HG2 VAL 33 3HG1 VAL 33 14.749 0.824 2.518 255 3HG2 VAL 33 1HG1 VAL 33 13.226 1.391 3.254 256 H ASP 34 H ASP 34 13.538 4.468 -0.573 257 HA ASP 34 HA ASP 34 14.720 7.034 -0.142 258 1HB ASP 34 1HB ASP 34 12.724 6.202 -2.343 259 2HB ASP 34 2HB ASP 34 13.725 7.659 -2.400 260 OH TYR 35 OH TYR 35 9.383 7.652 -6.124 261 H TYR 35 H TYR 35 11.354 6.398 -0.927 262 HA TYR 35 HA TYR 35 10.322 9.067 -0.264 263 1HB TYR 35 1HB TYR 35 8.843 6.363 -0.242 264 2HB TYR 35 2HB TYR 35 8.078 7.953 -0.237 265 HD1 TYR 35 HD2 TYR 35 8.313 9.437 -2.186 266 HD2 TYR 35 HD1 TYR 35 9.882 5.519 -2.245 267 HE1 TYR 35 HE2 TYR 35 8.491 9.542 -4.609 268 HE2 TYR 35 HE1 TYR 35 10.059 5.629 -4.668 269 HH TYR 35 HH TYR 35 9.069 8.508 -6.422 270 H VAL 36 H VAL 36 9.861 5.998 1.412 271 HA VAL 36 HA VAL 36 8.810 6.763 3.904 272 HB VAL 36 HB VAL 36 11.173 4.849 3.494 273 1HG1 VAL 36 3HG2 VAL 36 10.739 5.422 5.898 274 2HG1 VAL 36 1HG2 VAL 36 9.019 4.992 5.707 275 3HG1 VAL 36 2HG2 VAL 36 10.276 3.731 5.568 276 1HG2 VAL 36 2HG1 VAL 36 9.235 4.339 1.968 277 2HG2 VAL 36 3HG1 VAL 36 9.381 3.088 3.230 278 3HG2 VAL 36 1HG1 VAL 36 8.122 4.345 3.360 279 H ASN 37 H ASN 37 12.219 6.681 3.021 280 HA ASN 37 HA ASN 37 13.563 7.436 5.322 281 1HB ASN 37 1HB ASN 37 14.655 7.149 3.088 282 2HB ASN 37 2HB ASN 37 14.040 8.726 2.566 283 1HD2 ASN 37 1HD2 ASN 37 17.533 9.153 3.936 284 2HD2 ASN 37 2HD2 ASN 37 16.740 8.124 2.640 285 H SER 38 H SER 38 11.427 9.477 3.506 286 HA SER 38 HA SER 38 10.575 11.211 5.460 287 1HB SER 38 1HB SER 38 12.132 13.146 5.616 288 2HB SER 38 2HB SER 38 12.944 11.647 6.109 289 HG SER 38 HG SER 38 14.177 12.893 4.661 290 H GLY 39 H GLY 39 9.508 12.961 4.903 291 1HA GLY 39 1HA GLY 39 8.410 14.561 3.498 292 2HA GLY 39 2HA GLY 39 9.760 14.443 2.361 293 H PHE 40 H PHE 40 6.811 12.976 3.494 294 HA PHE 40 HA PHE 40 5.622 12.548 0.915 295 1HB PHE 40 1HB PHE 40 7.547 10.966 0.548 296 2HB PHE 40 2HB PHE 40 7.040 10.015 1.950 297 HD1 PHE 40 HD2 PHE 40 4.333 11.519 0.133 298 HD2 PHE 40 HD1 PHE 40 6.883 8.161 0.217 299 HE1 PHE 40 HE2 PHE 40 2.794 10.311 -1.310 300 HE2 PHE 40 HE1 PHE 40 5.341 6.955 -1.225 301 HZ PHE 40 HZ PHE 40 3.300 8.031 -1.994 302 OH TYR 41 OH TYR 41 5.930 5.262 0.574 303 H TYR 41 H TYR 41 5.902 10.009 3.315 304 HA TYR 41 HA TYR 41 3.003 9.740 3.610 305 1HB TYR 41 1HB TYR 41 5.192 8.693 5.495 306 2HB TYR 41 2HB TYR 41 3.539 8.087 5.362 307 HD1 TYR 41 HD1 TYR 41 2.801 7.124 3.141 308 HD2 TYR 41 HD2 TYR 41 6.847 8.013 3.954 309 HE1 TYR 41 HE1 TYR 41 3.490 5.691 1.299 310 HE2 TYR 41 HE2 TYR 41 7.530 6.580 2.112 311 HH TYR 41 HH TYR 41 6.888 5.269 0.513 312 H ASN 42 H ASN 42 5.153 11.924 5.056 313 HA ASN 42 HA ASN 42 4.601 12.140 7.735 314 1HB ASN 42 1HB ASN 42 4.498 14.567 5.834 315 2HB ASN 42 2HB ASN 42 4.796 14.638 7.578 316 1HD2 ASN 42 1HD2 ASN 42 8.182 14.634 6.177 317 2HD2 ASN 42 2HD2 ASN 42 6.727 15.725 6.425 318 H ASN 43 H ASN 43 2.472 13.502 5.265 319 HA ASN 43 HA ASN 43 0.046 12.939 6.944 320 1HB ASN 43 1HB ASN 43 0.759 15.866 6.293 321 2HB ASN 43 2HB ASN 43 -0.728 15.296 7.058 322 1HD2 ASN 43 1HD2 ASN 43 1.361 16.310 9.904 323 2HD2 ASN 43 2HD2 ASN 43 0.382 17.026 8.527 324 H THR 44 H THR 44 0.674 11.803 4.713 325 HA THR 44 HA THR 44 -0.946 13.010 2.444 326 HB THR 44 HB THR 44 0.030 10.126 2.823 327 HG1 THR 44 HG1 THR 44 1.196 12.344 1.490 328 1HG2 THR 44 3HG2 THR 44 -0.802 11.772 0.340 329 2HG2 THR 44 1HG2 THR 44 -0.209 10.088 0.315 330 3HG2 THR 44 2HG2 THR 44 -1.770 10.474 1.089 331 H THR 45 H THR 45 -1.826 9.933 2.511 332 HA THR 45 HA THR 45 -3.547 9.712 4.876 333 HB THR 45 HB THR 45 -5.761 9.716 3.683 334 HG1 THR 45 HG1 THR 45 -4.887 9.512 1.592 335 1HG2 THR 45 2HG2 THR 45 -5.018 11.713 5.020 336 2HG2 THR 45 3HG2 THR 45 -4.212 12.387 3.579 337 3HG2 THR 45 1HG2 THR 45 -5.988 12.219 3.611 338 H PHE 46 H PHE 46 -5.605 8.457 3.251 339 HA PHE 46 HA PHE 46 -4.363 5.971 2.042 340 1HB PHE 46 1HB PHE 46 -5.980 5.956 4.677 341 2HB PHE 46 2HB PHE 46 -5.831 4.537 3.645 342 HD1 PHE 46 HD1 PHE 46 -2.880 5.807 2.876 343 HD2 PHE 46 HD2 PHE 46 -4.831 4.382 6.333 344 HE1 PHE 46 HE1 PHE 46 -0.731 5.214 3.848 345 HE2 PHE 46 HE2 PHE 46 -2.682 3.789 7.301 346 HZ PHE 46 HZ PHE 46 -0.631 4.207 6.060 347 H HIS 47 H HIS 47 -5.315 7.039 0.346 348 HA HIS 47 HA HIS 47 -7.529 8.120 -0.487 349 1HB HIS 47 1HB HIS 47 -7.144 5.256 -1.534 350 2HB HIS 47 2HB HIS 47 -7.824 6.635 -2.412 351 HD2 HIS 47 HD2 HIS 47 -6.127 8.269 -3.612 352 HE1 HIS 47 HE1 HIS 47 -2.566 6.685 -2.133 353 HE2 HIS 47 HE2 HIS 47 -3.476 8.397 -3.838 354 NH1 ARG 48 NH2 ARG 48 -11.931 3.271 5.025 355 NH2 ARG 48 NH1 ARG 48 -14.004 3.918 5.694 356 H ARG 48 H ARG 48 -8.052 4.669 -0.184 357 HA ARG 48 HA ARG 48 -9.834 4.780 2.058 358 1HB ARG 48 1HB ARG 48 -11.304 5.920 0.220 359 2HB ARG 48 2HB ARG 48 -11.465 4.308 -0.492 360 1HG ARG 48 1HG ARG 48 -13.337 4.745 1.105 361 2HG ARG 48 2HG ARG 48 -12.336 3.404 1.677 362 1HD ARG 48 1HD ARG 48 -11.068 5.031 3.211 363 2HD ARG 48 2HD ARG 48 -12.098 6.334 2.645 364 HE ARG 48 HE ARG 48 -14.014 5.458 3.860 365 1HH1 ARG 48 2HH2 ARG 48 -11.163 3.387 4.356 366 2HH1 ARG 48 1HH2 ARG 48 -11.960 2.625 5.822 367 1HH2 ARG 48 1HH1 ARG 48 -14.817 4.524 5.537 368 2HH2 ARG 48 2HH1 ARG 48 -13.889 3.227 6.443 369 H VAL 49 H VAL 49 -11.613 2.807 0.444 370 HA VAL 49 HA VAL 49 -9.949 0.458 -0.112 371 HB VAL 49 HB VAL 49 -9.436 0.545 2.301 372 1HG1 VAL 49 1HG2 VAL 49 -12.503 0.438 2.690 373 2HG1 VAL 49 2HG2 VAL 49 -11.291 0.345 3.997 374 3HG1 VAL 49 3HG2 VAL 49 -11.461 1.841 3.041 375 1HG2 VAL 49 2HG1 VAL 49 -9.738 -1.702 1.209 376 2HG2 VAL 49 3HG1 VAL 49 -10.270 -1.757 2.911 377 3HG2 VAL 49 1HG1 VAL 49 -11.477 -1.672 1.600 378 H ILE 50 H ILE 50 -10.951 -1.212 -0.741 379 HA ILE 50 HA ILE 50 -13.983 -1.360 -0.963 380 HB ILE 50 HB ILE 50 -11.790 -3.421 -1.591 381 1HG1 ILE 50 1HG1 ILE 50 -13.520 -1.587 -3.363 382 2HG1 ILE 50 2HG1 ILE 50 -11.779 -1.428 -3.102 383 1HG2 ILE 50 2HG2 ILE 50 -13.985 -4.452 -0.927 384 2HG2 ILE 50 3HG2 ILE 50 -14.838 -3.426 -2.108 385 3HG2 ILE 50 1HG2 ILE 50 -13.691 -4.671 -2.673 386 1HD1 ILE 50 3HD1 ILE 50 -13.168 -3.878 -4.397 387 2HD1 ILE 50 1HD1 ILE 50 -12.246 -2.625 -5.268 388 3HD1 ILE 50 2HD1 ILE 50 -11.410 -3.721 -4.136 389 HA PRO 51 HA PRO 51 -14.500 -2.565 3.255 390 1HB PRO 51 1HB PRO 51 -16.614 -4.381 2.762 391 2HB PRO 51 2HB PRO 51 -16.762 -2.616 2.896 392 1HG PRO 51 1HG PRO 51 -16.501 -4.279 0.346 393 2HG PRO 51 2HG PRO 51 -17.645 -2.955 0.673 394 1HD PRO 51 1HD PRO 51 -15.368 -2.481 -0.782 395 2HD PRO 51 2HD PRO 51 -15.882 -1.268 0.437 396 H GLY 52 H GLY 52 -15.611 -5.380 3.407 397 1HA GLY 52 1HA GLY 52 -13.251 -6.777 4.259 398 2HA GLY 52 2HA GLY 52 -14.740 -7.601 3.764 399 H PHE 53 H PHE 53 -11.835 -6.037 2.552 400 HA PHE 53 HA PHE 53 -11.349 -8.167 0.502 401 1HB PHE 53 1HB PHE 53 -13.124 -6.673 -0.560 402 2HB PHE 53 2HB PHE 53 -11.999 -5.312 -0.460 403 HD1 PHE 53 HD1 PHE 53 -10.111 -8.233 -0.863 404 HD2 PHE 53 HD2 PHE 53 -12.593 -5.615 -3.048 405 HE1 PHE 53 HE1 PHE 53 -9.100 -9.002 -2.936 406 HE2 PHE 53 HE2 PHE 53 -11.581 -6.388 -5.119 407 HZ PHE 53 HZ PHE 53 -9.835 -8.082 -5.064 408 H MET 54 H MET 54 -10.611 -4.697 0.774 409 HA MET 54 HA MET 54 -7.851 -4.986 1.734 410 1HB MET 54 1HB MET 54 -6.637 -4.796 -0.442 411 2HB MET 54 2HB MET 54 -7.565 -6.300 -0.359 412 1HG MET 54 1HG MET 54 -9.451 -5.214 -1.647 413 2HG MET 54 2HG MET 54 -8.516 -3.704 -1.736 414 1HE MET 54 2HE MET 54 -9.661 -5.303 -4.322 415 2HE MET 54 1HE MET 54 -8.741 -3.769 -4.436 416 3HE MET 54 3HE MET 54 -8.259 -5.179 -5.425 417 H ILE 55 H ILE 55 -7.153 -3.202 2.321 418 HA ILE 55 HA ILE 55 -8.249 -0.552 1.255 419 HB ILE 55 HB ILE 55 -7.061 0.505 3.081 420 1HG1 ILE 55 1HG1 ILE 55 -6.071 -2.317 3.803 421 2HG1 ILE 55 2HG1 ILE 55 -5.070 -1.012 3.151 422 1HG2 ILE 55 2HG2 ILE 55 -9.341 -0.423 3.531 423 2HG2 ILE 55 3HG2 ILE 55 -8.628 -1.981 4.024 424 3HG2 ILE 55 1HG2 ILE 55 -8.327 -0.514 4.995 425 1HD1 ILE 55 3HD1 ILE 55 -5.636 0.436 5.164 426 2HD1 ILE 55 1HD1 ILE 55 -6.645 -0.876 5.821 427 3HD1 ILE 55 2HD1 ILE 55 -4.882 -1.098 5.669 428 H GLN 56 H GLN 56 -6.560 1.144 1.203 429 HA GLN 56 HA GLN 56 -4.894 0.574 -1.128 430 1HB GLN 56 1HB GLN 56 -4.981 3.020 0.684 431 2HB GLN 56 2HB GLN 56 -4.379 2.994 -0.981 432 1HG GLN 56 1HG GLN 56 -7.278 2.392 -0.121 433 2HG GLN 56 2HG GLN 56 -6.721 3.856 -0.937 434 1HE2 GLN 56 2HE2 GLN 56 -7.220 0.368 -3.086 435 2HE2 GLN 56 1HE2 GLN 56 -7.264 0.407 -1.252 436 H GLY 57 H GLY 57 -1.523 1.223 0.890 437 1HA GLY 57 1HA GLY 57 -3.399 3.061 -0.641 438 2HA GLY 57 2HA GLY 57 -3.181 3.482 1.058 439 H GLY 58 H GLY 58 -2.080 5.174 1.061 440 1HA GLY 58 1HA GLY 58 -0.284 6.735 0.755 441 2HA GLY 58 2HA GLY 58 0.776 5.354 0.434 442 H GLY 59 H GLY 59 -0.881 7.985 -0.789 443 1HA GLY 59 1HA GLY 59 0.376 7.865 -3.452 444 2HA GLY 59 2HA GLY 59 -1.325 7.380 -3.599 445 H PHE 60 H PHE 60 -2.563 8.882 -4.160 446 HA PHE 60 HA PHE 60 -2.025 11.615 -4.577 447 1HB PHE 60 1HB PHE 60 -4.737 10.464 -3.674 448 2HB PHE 60 2HB PHE 60 -4.496 12.013 -4.492 449 HD1 PHE 60 HD1 PHE 60 -2.197 11.021 -6.286 450 HD2 PHE 60 HD2 PHE 60 -6.019 9.448 -5.444 451 HE1 PHE 60 HE1 PHE 60 -2.222 9.918 -8.452 452 HE2 PHE 60 HE2 PHE 60 -6.040 8.344 -7.610 453 HZ PHE 60 HZ PHE 60 -4.143 8.579 -9.114 454 H THR 61 H THR 61 -1.268 13.024 -3.347 455 HA THR 61 HA THR 61 -1.244 13.026 -0.422 456 HB THR 61 HB THR 61 -0.916 15.362 -2.396 457 HG1 THR 61 HG1 THR 61 1.275 14.872 -2.053 458 1HG2 THR 61 2HG2 THR 61 -1.346 16.113 -0.027 459 2HG2 THR 61 3HG2 THR 61 -0.043 15.043 0.554 460 3HG2 THR 61 1HG2 THR 61 0.345 16.431 -0.498 461 H GLU 62 H GLU 62 -3.304 12.638 0.192 462 HA GLU 62 HA GLU 62 -5.404 13.307 1.127 463 1HB GLU 62 1HB GLU 62 -4.389 16.116 0.389 464 2HB GLU 62 2HB GLU 62 -5.756 15.764 1.461 465 1HG GLU 62 1HG GLU 62 -4.214 14.448 2.988 466 2HG GLU 62 2HG GLU 62 -2.855 14.797 1.924 467 H GLN 63 H GLN 63 -5.684 16.182 -0.557 468 HA GLN 63 HA GLN 63 -8.109 15.295 -2.001 469 1HB GLN 63 1HB GLN 63 -7.827 17.581 -1.063 470 2HB GLN 63 2HB GLN 63 -6.510 17.915 -2.197 471 1HG GLN 63 1HG GLN 63 -8.645 18.837 -3.079 472 2HG GLN 63 2HG GLN 63 -8.046 17.557 -4.139 473 1HE2 GLN 63 2HE2 GLN 63 -11.488 16.507 -3.927 474 2HE2 GLN 63 1HE2 GLN 63 -10.259 17.489 -4.871 475 H MET 64 H MET 64 -6.212 13.651 -2.751 476 HA MET 64 HA MET 64 -5.023 12.753 -4.644 477 1HB MET 64 1HB MET 64 -7.468 14.068 -5.955 478 2HB MET 64 2HB MET 64 -6.460 12.827 -6.720 479 1HG MET 64 1HG MET 64 -6.929 11.258 -4.787 480 2HG MET 64 2HG MET 64 -8.021 12.471 -4.081 481 1HE MET 64 3HE MET 64 -9.825 10.345 -4.177 482 2HE MET 64 2HE MET 64 -10.334 9.584 -5.715 483 3HE MET 64 1HE MET 64 -8.675 9.327 -5.100 484 H GLN 65 H GLN 65 -4.171 15.316 -3.826 485 HA GLN 65 HA GLN 65 -3.337 16.839 -6.292 486 1HB GLN 65 1HB GLN 65 -3.519 18.008 -4.095 487 2HB GLN 65 2HB GLN 65 -2.289 16.945 -3.397 488 1HG GLN 65 1HG GLN 65 -1.255 19.092 -4.136 489 2HG GLN 65 2HG GLN 65 -0.603 17.739 -5.068 490 1HE2 GLN 65 2HE2 GLN 65 -3.268 20.330 -6.937 491 2HE2 GLN 65 1HE2 GLN 65 -3.345 20.021 -5.130 492 H GLN 66 H GLN 66 -2.635 15.229 -7.512 493 HA GLN 66 HA GLN 66 -1.258 12.956 -7.218 494 1HB GLN 66 1HB GLN 66 -0.224 15.083 -9.192 495 2HB GLN 66 2HB GLN 66 0.041 13.338 -9.317 496 1HG GLN 66 1HG GLN 66 -2.467 12.968 -9.389 497 2HG GLN 66 2HG GLN 66 -2.722 14.712 -9.296 498 1HE2 GLN 66 2HE2 GLN 66 -1.784 13.014 -12.883 499 2HE2 GLN 66 1HE2 GLN 66 -2.010 12.062 -11.331 500 H LYS 67 H LYS 67 0.442 12.058 -6.653 501 HA LYS 67 HA LYS 67 2.159 12.950 -4.612 502 1HB LYS 67 1HB LYS 67 2.990 11.099 -6.911 503 2HB LYS 67 2HB LYS 67 3.696 11.125 -5.287 504 1HG LYS 67 1HG LYS 67 1.451 10.557 -4.297 505 2HG LYS 67 2HG LYS 67 0.718 10.547 -5.891 506 1HD LYS 67 1HD LYS 67 2.950 8.630 -4.949 507 2HD LYS 67 2HD LYS 67 1.245 8.243 -4.922 508 1HE LYS 67 1HE LYS 67 2.868 8.806 -7.499 509 2HE LYS 67 2HE LYS 67 2.494 7.212 -6.856 510 1HZ LYS 67 3HZ LYS 67 0.123 7.680 -7.155 511 2HZ LYS 67 1HZ LYS 67 0.453 9.183 -7.757 512 3HZ LYS 67 2HZ LYS 67 0.938 7.838 -8.584 513 H LYS 68 H LYS 68 4.417 11.975 -6.487 514 HA LYS 68 HA LYS 68 5.389 14.337 -8.006 515 1HB LYS 68 1HB LYS 68 5.536 15.151 -5.583 516 2HB LYS 68 2HB LYS 68 6.592 13.784 -5.218 517 1HG LYS 68 1HG LYS 68 7.974 15.773 -5.667 518 2HG LYS 68 2HG LYS 68 8.253 14.563 -6.923 519 1HD LYS 68 1HD LYS 68 6.655 15.782 -8.466 520 2HD LYS 68 2HD LYS 68 6.342 16.979 -7.203 521 1HE LYS 68 1HE LYS 68 8.802 17.646 -7.227 522 2HE LYS 68 2HE LYS 68 9.105 16.461 -8.507 523 1HZ LYS 68 2HZ LYS 68 7.244 18.779 -8.726 524 2HZ LYS 68 3HZ LYS 68 8.744 18.674 -9.409 525 3HZ LYS 68 1HZ LYS 68 7.530 17.677 -9.923 526 HA PRO 69 HA PRO 69 6.917 10.018 -8.576 527 1HB PRO 69 1HB PRO 69 6.286 9.855 -11.266 528 2HB PRO 69 2HB PRO 69 5.075 9.721 -9.970 529 1HG PRO 69 1HG PRO 69 5.796 12.228 -11.585 530 2HG PRO 69 2HG PRO 69 4.172 11.548 -11.310 531 1HD PRO 69 1HD PRO 69 5.125 13.608 -9.739 532 2HD PRO 69 2HD PRO 69 4.158 12.296 -8.988 533 H ASN 70 H ASN 70 8.148 9.064 -10.398 534 HA ASN 70 HA ASN 70 10.206 10.674 -11.825 535 1HB ASN 70 1HB ASN 70 11.039 9.102 -9.299 536 2HB ASN 70 2HB ASN 70 12.161 9.768 -10.493 537 1HD2 ASN 70 1HD2 ASN 70 12.038 12.377 -7.919 538 2HD2 ASN 70 2HD2 ASN 70 12.718 10.700 -8.223 539 HA PRO 71 HA PRO 71 11.086 7.245 -14.424 540 1HB PRO 71 1HB PRO 71 13.742 7.086 -12.894 541 2HB PRO 71 2HB PRO 71 13.487 6.976 -14.655 542 1HG PRO 71 1HG PRO 71 14.308 9.346 -13.622 543 2HG PRO 71 2HG PRO 71 12.979 9.359 -14.808 544 1HD PRO 71 1HD PRO 71 12.774 9.636 -11.767 545 2HD PRO 71 2HD PRO 71 11.841 10.490 -13.038 546 HA PRO 72 HA PRO 72 9.390 4.701 -10.971 547 1HB PRO 72 1HB PRO 72 8.168 3.635 -13.570 548 2HB PRO 72 2HB PRO 72 7.370 3.862 -11.995 549 1HG PRO 72 1HG PRO 72 6.983 5.743 -13.910 550 2HG PRO 72 2HG PRO 72 7.358 6.287 -12.255 551 1HD PRO 72 1HD PRO 72 9.262 6.146 -14.653 552 2HD PRO 72 2HD PRO 72 9.137 7.414 -13.390 553 H ILE 73 H ILE 73 9.550 2.625 -10.401 554 HA ILE 73 HA ILE 73 11.990 1.196 -11.369 555 HB ILE 73 HB ILE 73 11.514 -0.364 -9.525 556 1HG1 ILE 73 1HG1 ILE 73 8.901 1.242 -9.254 557 2HG1 ILE 73 2HG1 ILE 73 9.027 -0.434 -9.800 558 1HG2 ILE 73 2HG2 ILE 73 12.641 1.823 -9.033 559 2HG2 ILE 73 3HG2 ILE 73 11.057 2.595 -8.765 560 3HG2 ILE 73 1HG2 ILE 73 11.625 1.316 -7.658 561 1HD1 ILE 73 3HD1 ILE 73 9.900 0.595 -7.010 562 2HD1 ILE 73 1HD1 ILE 73 8.424 -0.342 -7.357 563 3HD1 ILE 73 2HD1 ILE 73 10.026 -1.097 -7.561 564 H LYS 74 H LYS 74 12.070 -0.997 -11.748 565 HA LYS 74 HA LYS 74 10.504 -1.871 -14.031 566 1HB LYS 74 1HB LYS 74 12.144 -3.549 -12.054 567 2HB LYS 74 2HB LYS 74 11.655 -4.060 -13.677 568 1HG LYS 74 1HG LYS 74 12.870 -2.071 -14.666 569 2HG LYS 74 2HG LYS 74 13.357 -1.563 -13.048 570 1HD LYS 74 1HD LYS 74 14.643 -3.733 -12.752 571 2HD LYS 74 2HD LYS 74 14.157 -4.240 -14.375 572 1HE LYS 74 1HE LYS 74 15.361 -2.228 -15.365 573 2HE LYS 74 2HE LYS 74 15.847 -1.719 -13.741 574 1HZ LYS 74 1HZ LYS 74 17.061 -3.826 -13.510 575 2HZ LYS 74 2HZ LYS 74 16.609 -4.299 -15.026 576 3HZ LYS 74 3HZ LYS 74 17.591 -2.985 -14.830 577 H ASN 75 H ASN 75 9.746 -4.218 -13.984 578 HA ASN 75 HA ASN 75 7.075 -4.280 -12.944 579 1HB ASN 75 1HB ASN 75 7.092 -6.697 -13.522 580 2HB ASN 75 2HB ASN 75 7.874 -5.737 -14.783 581 1HD2 ASN 75 1HD2 ASN 75 10.751 -7.807 -14.529 582 2HD2 ASN 75 2HD2 ASN 75 9.510 -6.919 -15.549 583 H GLU 76 H GLU 76 6.534 -6.552 -11.780 584 HA GLU 76 HA GLU 76 7.801 -7.631 -9.556 585 1HB GLU 76 1HB GLU 76 8.315 -5.193 -8.974 586 2HB GLU 76 2HB GLU 76 6.597 -4.939 -8.663 587 1HG GLU 76 1HG GLU 76 8.429 -6.994 -7.249 588 2HG GLU 76 2HG GLU 76 7.916 -5.456 -6.562 589 H ALA 77 H ALA 77 6.579 -9.124 -9.028 590 HA ALA 77 HA ALA 77 3.959 -9.093 -7.889 591 1HB ALA 77 3HB ALA 77 3.810 -9.453 -10.966 592 2HB ALA 77 1HB ALA 77 2.462 -9.687 -9.825 593 3HB ALA 77 2HB ALA 77 3.157 -8.063 -10.055 594 H ASP 78 H ASP 78 5.772 -10.660 -10.476 595 HA ASP 78 HA ASP 78 4.811 -13.377 -9.976 596 1HB ASP 78 1HB ASP 78 6.591 -14.056 -11.522 597 2HB ASP 78 2HB ASP 78 5.794 -12.591 -12.117 598 H ASN 79 H ASN 79 5.985 -11.916 -7.637 599 HA ASN 79 HA ASN 79 8.401 -13.021 -6.612 600 1HB ASN 79 1HB ASN 79 7.358 -12.942 -4.351 601 2HB ASN 79 2HB ASN 79 7.024 -11.478 -5.284 602 1HD2 ASN 79 1HD2 ASN 79 3.778 -12.503 -3.792 603 2HD2 ASN 79 2HD2 ASN 79 5.427 -11.918 -3.241 604 H GLY 80 H GLY 80 5.189 -14.487 -6.662 605 1HA GLY 80 1HA GLY 80 4.557 -16.784 -6.964 606 2HA GLY 80 2HA GLY 80 6.243 -17.184 -7.304 607 H LEU 81 H LEU 81 4.103 -16.181 -4.703 608 HA LEU 81 HA LEU 81 4.891 -18.542 -3.021 609 1HB LEU 81 1HB LEU 81 5.133 -15.767 -1.727 610 2HB LEU 81 2HB LEU 81 5.471 -17.338 -1.016 611 HG LEU 81 HG LEU 81 7.287 -17.625 -2.880 612 1HD1 LEU 81 2HD1 LEU 81 6.563 -15.669 -4.310 613 2HD1 LEU 81 3HD1 LEU 81 6.913 -14.552 -2.967 614 3HD1 LEU 81 1HD1 LEU 81 8.238 -15.457 -3.742 615 1HD2 LEU 81 3HD2 LEU 81 7.801 -17.248 -0.452 616 2HD2 LEU 81 1HD2 LEU 81 8.958 -16.368 -1.483 617 3HD2 LEU 81 2HD2 LEU 81 7.635 -15.487 -0.676 618 NH1 ARG 82 NH2 ARG 82 1.774 -22.387 4.201 619 NH2 ARG 82 NH1 ARG 82 2.197 -23.747 2.429 620 H ARG 82 H ARG 82 3.768 -18.397 -0.907 621 HA ARG 82 HA ARG 82 0.806 -18.007 -1.434 622 1HB ARG 82 1HB ARG 82 0.485 -19.025 0.777 623 2HB ARG 82 2HB ARG 82 1.472 -20.051 -0.272 624 1HG ARG 82 1HG ARG 82 3.567 -19.283 0.841 625 2HG ARG 82 2HG ARG 82 2.678 -18.066 1.742 626 1HD ARG 82 1HD ARG 82 3.170 -19.876 3.274 627 2HD ARG 82 2HD ARG 82 1.426 -19.838 3.012 628 HE ARG 82 HE ARG 82 2.697 -21.771 1.159 629 1HH1 ARG 82 2HH2 ARG 82 1.732 -21.429 4.565 630 2HH1 ARG 82 1HH2 ARG 82 1.565 -23.250 4.715 631 1HH2 ARG 82 1HH1 ARG 82 2.474 -23.830 1.445 632 2HH2 ARG 82 2HH1 ARG 82 1.958 -24.515 3.066 633 H ASN 83 H ASN 83 -0.462 -16.671 -0.474 634 HA ASN 83 HA ASN 83 0.298 -14.849 1.753 635 1HB ASN 83 1HB ASN 83 0.051 -13.660 -1.081 636 2HB ASN 83 2HB ASN 83 0.118 -12.719 0.416 637 1HD2 ASN 83 1HD2 ASN 83 3.575 -14.071 1.081 638 2HD2 ASN 83 2HD2 ASN 83 1.929 -14.225 1.878 639 H THR 84 H THR 84 -1.281 -13.633 2.505 640 HA THR 84 HA THR 84 -4.124 -13.814 1.468 641 HB THR 84 HB THR 84 -2.910 -15.411 3.799 642 HG1 THR 84 HG1 THR 84 -2.891 -16.306 1.713 643 1HG2 THR 84 3HG2 THR 84 -5.879 -14.948 3.116 644 2HG2 THR 84 1HG2 THR 84 -5.261 -16.104 4.339 645 3HG2 THR 84 2HG2 THR 84 -5.029 -14.349 4.564 646 NH1 ARG 85 NH2 ARG 85 -10.711 -12.169 8.596 647 NH2 ARG 85 NH1 ARG 85 -10.066 -10.394 9.861 648 H ARG 85 H ARG 85 -5.612 -12.859 2.737 649 HA ARG 85 HA ARG 85 -5.492 -10.385 3.897 650 1HB ARG 85 1HB ARG 85 -7.557 -11.748 4.042 651 2HB ARG 85 2HB ARG 85 -6.759 -12.917 5.104 652 1HG ARG 85 1HG ARG 85 -6.420 -11.078 6.831 653 2HG ARG 85 2HG ARG 85 -7.342 -9.971 5.810 654 1HD ARG 85 1HD ARG 85 -9.375 -11.475 5.986 655 2HD ARG 85 2HD ARG 85 -8.441 -12.637 6.946 656 HE ARG 85 HE ARG 85 -8.342 -9.989 8.239 657 1HH1 ARG 85 2HH2 ARG 85 -10.552 -12.735 7.754 658 2HH1 ARG 85 1HH2 ARG 85 -11.434 -12.317 9.308 659 1HH2 ARG 85 1HH1 ARG 85 -9.419 -9.608 9.989 660 2HH2 ARG 85 2HH1 ARG 85 -10.834 -10.666 10.485 661 H GLY 86 H GLY 86 -3.693 -9.831 4.459 662 1HA GLY 86 1HA GLY 86 -2.669 -9.416 7.038 663 2HA GLY 86 2HA GLY 86 -2.122 -11.070 6.717 664 H THR 87 H THR 87 -2.256 -9.983 3.740 665 HA THR 87 HA THR 87 0.689 -9.015 3.713 666 HB THR 87 HB THR 87 0.705 -9.896 1.367 667 HG1 THR 87 HG1 THR 87 -1.558 -9.960 1.128 668 1HG2 THR 87 2HG2 THR 87 1.674 -11.158 3.298 669 2HG2 THR 87 3HG2 THR 87 0.089 -11.911 3.623 670 3HG2 THR 87 1HG2 THR 87 0.962 -12.277 2.106 671 H ILE 88 H ILE 88 1.367 -7.806 2.170 672 HA ILE 88 HA ILE 88 -0.558 -5.807 0.862 673 HB ILE 88 HB ILE 88 0.163 -4.365 2.385 674 1HG1 ILE 88 1HG1 ILE 88 2.649 -3.491 1.986 675 2HG1 ILE 88 2HG1 ILE 88 2.671 -4.645 0.699 676 1HG2 ILE 88 2HG2 ILE 88 1.151 -6.086 3.915 677 2HG2 ILE 88 3HG2 ILE 88 2.684 -6.007 3.002 678 3HG2 ILE 88 1HG2 ILE 88 2.116 -4.586 3.916 679 1HD1 ILE 88 2HD1 ILE 88 0.530 -3.457 -0.253 680 2HD1 ILE 88 3HD1 ILE 88 0.592 -2.346 1.138 681 3HD1 ILE 88 1HD1 ILE 88 1.893 -2.310 -0.076 682 H ALA 89 H ALA 89 0.282 -4.651 -0.786 683 HA ALA 89 HA ALA 89 2.559 -5.802 -2.419 684 1HB ALA 89 2HB ALA 89 0.719 -7.472 -2.823 685 2HB ALA 89 3HB ALA 89 -0.360 -6.163 -3.378 686 3HB ALA 89 1HB ALA 89 1.107 -6.566 -4.303 687 H MET 90 H MET 90 3.128 -4.779 -4.151 688 HA MET 90 HA MET 90 2.798 -1.877 -4.179 689 1HB MET 90 1HB MET 90 4.825 -3.004 -5.070 690 2HB MET 90 2HB MET 90 3.882 -3.670 -6.417 691 1HG MET 90 1HG MET 90 5.028 -1.528 -7.084 692 2HG MET 90 2HG MET 90 3.257 -1.357 -7.153 693 1HE MET 90 1HE MET 90 4.834 1.295 -7.105 694 2HE MET 90 3HE MET 90 3.055 1.244 -6.889 695 3HE MET 90 2HE MET 90 4.066 2.203 -5.768 696 H ALA 91 H ALA 91 1.389 -0.652 -4.965 697 HA ALA 91 HA ALA 91 -1.106 -1.545 -6.179 698 1HB ALA 91 2HB ALA 91 -0.889 0.615 -4.942 699 2HB ALA 91 3HB ALA 91 0.168 1.267 -6.224 700 3HB ALA 91 1HB ALA 91 -1.539 0.889 -6.577 701 NH1 ARG 92 NH2 ARG 92 -5.321 -2.188 -13.105 702 NH2 ARG 92 NH1 ARG 92 -6.555 -0.507 -12.199 703 H ARG 92 H ARG 92 -0.240 0.947 -8.136 704 HA ARG 92 HA ARG 92 1.395 -0.220 -10.217 705 1HB ARG 92 1HB ARG 92 -0.221 -0.977 -11.868 706 2HB ARG 92 2HB ARG 92 -0.509 -1.877 -10.369 707 1HG ARG 92 1HG ARG 92 -2.352 -0.277 -9.747 708 2HG ARG 92 2HG ARG 92 -2.016 0.689 -11.187 709 1HD ARG 92 1HD ARG 92 -2.629 -1.298 -12.661 710 2HD ARG 92 2HD ARG 92 -3.007 -2.247 -11.210 711 HE ARG 92 HE ARG 92 -4.576 0.181 -11.027 712 1HH1 ARG 92 2HH2 ARG 92 -4.408 -2.651 -13.172 713 2HH1 ARG 92 1HH2 ARG 92 -6.184 -2.455 -13.592 714 1HH2 ARG 92 1HH1 ARG 92 -6.587 0.309 -11.577 715 2HH2 ARG 92 2HH1 ARG 92 -7.332 -0.891 -12.749 716 H THR 93 H THR 93 -0.158 0.563 -12.430 717 HA THR 93 HA THR 93 -1.146 3.307 -12.315 718 HB THR 93 HB THR 93 1.805 3.003 -13.146 719 HG1 THR 93 HG1 THR 93 2.048 4.566 -11.513 720 1HG2 THR 93 2HG2 THR 93 0.524 4.528 -14.689 721 2HG2 THR 93 3HG2 THR 93 -0.092 5.442 -13.287 722 3HG2 THR 93 1HG2 THR 93 1.651 5.461 -13.669 723 H ALA 94 H ALA 94 1.291 2.440 -14.592 724 HA ALA 94 HA ALA 94 0.024 0.834 -16.532 725 1HB ALA 94 3HB ALA 94 -0.837 3.776 -16.965 726 2HB ALA 94 1HB ALA 94 -1.108 2.437 -18.110 727 3HB ALA 94 2HB ALA 94 -1.921 2.430 -16.526 728 H ASP 95 H ASP 95 1.634 0.299 -17.616 729 HA ASP 95 HA ASP 95 3.150 1.721 -19.509 730 1HB ASP 95 1HB ASP 95 3.731 3.316 -17.638 731 2HB ASP 95 2HB ASP 95 4.465 1.983 -16.730 732 H LYS 96 H LYS 96 4.566 0.274 -16.654 733 HA LYS 96 HA LYS 96 4.663 -2.460 -17.091 734 1HB LYS 96 1HB LYS 96 6.772 -1.180 -18.926 735 2HB LYS 96 2HB LYS 96 6.546 -2.918 -18.657 736 1HG LYS 96 1HG LYS 96 4.175 -2.740 -19.520 737 2HG LYS 96 2HG LYS 96 4.392 -1.008 -19.775 738 1HD LYS 96 1HD LYS 96 6.253 -1.484 -21.429 739 2HD LYS 96 2HD LYS 96 6.033 -3.213 -21.211 740 1HE LYS 96 1HE LYS 96 3.857 -1.285 -22.296 741 2HE LYS 96 2HE LYS 96 4.955 -2.224 -23.303 742 1HZ LYS 96 3HZ LYS 96 4.015 -4.267 -22.371 743 2HZ LYS 96 1HZ LYS 96 2.979 -3.405 -21.416 744 3HZ LYS 96 2HZ LYS 96 2.835 -3.339 -23.060 745 H ASP 97 H ASP 97 5.469 -0.111 -15.391 746 HA ASP 97 HA ASP 97 7.248 -1.477 -13.555 747 1HB ASP 97 1HB ASP 97 8.624 0.615 -15.359 748 2HB ASP 97 2HB ASP 97 9.279 0.070 -13.809 749 H SER 98 H SER 98 4.998 -0.386 -13.164 750 HA SER 98 HA SER 98 5.280 1.938 -11.342 751 1HB SER 98 1HB SER 98 5.705 3.109 -13.517 752 2HB SER 98 2HB SER 98 4.270 2.358 -14.232 753 HG SER 98 HG SER 98 3.014 3.415 -12.644 754 H ALA 99 H ALA 99 2.059 0.684 -10.461 755 HA ALA 99 HA ALA 99 3.482 1.424 -8.663 756 1HB ALA 99 2HB ALA 99 3.959 -0.991 -9.027 757 2HB ALA 99 3HB ALA 99 5.267 -0.584 -10.172 758 3HB ALA 99 1HB ALA 99 5.408 -0.138 -8.450 759 H THR 100 H THR 100 4.747 2.743 -7.950 760 HA THR 100 HA THR 100 7.272 3.645 -9.229 761 HB THR 100 HB THR 100 6.626 6.084 -9.331 762 HG1 THR 100 HG1 THR 100 4.397 6.500 -9.436 763 1HG2 THR 100 3HG2 THR 100 4.996 4.200 -11.154 764 2HG2 THR 100 1HG2 THR 100 5.392 5.902 -11.515 765 3HG2 THR 100 2HG2 THR 100 6.692 4.684 -11.415 766 H SER 101 H SER 101 4.686 4.453 -6.976 767 HA SER 101 HA SER 101 6.369 4.088 -4.587 768 1HB SER 101 1HB SER 101 6.420 6.465 -3.813 769 2HB SER 101 2HB SER 101 7.336 6.278 -5.319 770 HG SER 101 HG SER 101 4.636 7.136 -5.086 771 H GLN 102 H GLN 102 4.562 2.775 -4.420 772 HA GLN 102 HA GLN 102 2.579 3.726 -2.557 773 1HB GLN 102 1HB GLN 102 0.540 3.913 -3.841 774 2HB GLN 102 2HB GLN 102 1.710 5.026 -4.550 775 1HG GLN 102 1HG GLN 102 1.109 2.180 -5.599 776 2HG GLN 102 2HG GLN 102 0.400 3.656 -6.259 777 1HE2 GLN 102 2HE2 GLN 102 3.548 4.819 -7.696 778 2HE2 GLN 102 1HE2 GLN 102 2.080 5.406 -6.763 779 H PHE 103 H PHE 103 0.952 2.317 -2.049 780 HA PHE 103 HA PHE 103 0.844 -0.433 -3.200 781 1HB PHE 103 1HB PHE 103 1.700 -1.646 -1.279 782 2HB PHE 103 2HB PHE 103 2.953 -0.551 -1.852 783 HD1 PHE 103 HD1 PHE 103 0.786 1.655 -0.374 784 HD2 PHE 103 HD2 PHE 103 3.369 -1.499 0.704 785 HE1 PHE 103 HE1 PHE 103 0.944 2.551 1.880 786 HE2 PHE 103 HE2 PHE 103 3.524 -0.602 2.955 787 HZ PHE 103 HZ PHE 103 2.307 1.410 3.548 788 H PHE 104 H PHE 104 -0.186 -1.849 -1.260 789 HA PHE 104 HA PHE 104 -2.523 -0.428 -0.008 790 1HB PHE 104 1HB PHE 104 -4.263 -1.436 -1.380 791 2HB PHE 104 2HB PHE 104 -3.185 -0.527 -2.440 792 HD1 PHE 104 HD1 PHE 104 -1.267 -1.873 -3.549 793 HD2 PHE 104 HD2 PHE 104 -4.623 -3.715 -1.781 794 HE1 PHE 104 HE1 PHE 104 -0.854 -3.885 -4.855 795 HE2 PHE 104 HE2 PHE 104 -4.207 -5.725 -3.089 796 HZ PHE 104 HZ PHE 104 -2.327 -5.810 -4.624 797 H ILE 105 H ILE 105 -3.458 -1.426 1.428 798 HA ILE 105 HA ILE 105 -2.280 -4.113 2.333 799 HB ILE 105 HB ILE 105 -3.847 -1.977 3.873 800 1HG1 ILE 105 1HG1 ILE 105 -0.848 -2.670 3.697 801 2HG1 ILE 105 2HG1 ILE 105 -1.608 -1.221 3.030 802 1HG2 ILE 105 3HG2 ILE 105 -2.301 -4.495 4.783 803 2HG2 ILE 105 1HG2 ILE 105 -3.044 -3.290 5.868 804 3HG2 ILE 105 2HG2 ILE 105 -4.072 -4.298 4.814 805 1HD1 ILE 105 3HD1 ILE 105 -1.560 -1.980 6.031 806 2HD1 ILE 105 1HD1 ILE 105 -0.557 -0.725 5.257 807 3HD1 ILE 105 2HD1 ILE 105 -2.326 -0.514 5.358 808 H ASN 106 H ASN 106 -3.305 -5.773 1.825 809 HA ASN 106 HA ASN 106 -6.209 -5.875 1.138 810 1HB ASN 106 1HB ASN 106 -5.828 -8.286 0.864 811 2HB ASN 106 2HB ASN 106 -4.522 -7.390 0.080 812 1HD2 ASN 106 1HD2 ASN 106 -3.090 -10.147 2.266 813 2HD2 ASN 106 2HD2 ASN 106 -4.358 -10.063 0.943 814 H VAL 107 H VAL 107 -7.141 -8.081 2.148 815 HA VAL 107 HA VAL 107 -6.796 -8.360 5.108 816 HB VAL 107 HB VAL 107 -9.123 -7.753 5.694 817 1HG1 VAL 107 3HG2 VAL 107 -7.306 -6.036 5.908 818 2HG1 VAL 107 1HG2 VAL 107 -7.608 -5.491 4.238 819 3HG1 VAL 107 2HG2 VAL 107 -8.858 -5.264 5.489 820 1HG2 VAL 107 2HG1 VAL 107 -10.185 -8.177 3.459 821 2HG2 VAL 107 3HG1 VAL 107 -10.561 -6.530 4.030 822 3HG2 VAL 107 1HG1 VAL 107 -9.323 -6.778 2.769 823 H ALA 108 H ALA 108 -8.767 -8.976 2.262 824 HA ALA 108 HA ALA 108 -9.829 -11.585 3.377 825 1HB ALA 108 2HB ALA 108 -11.339 -10.092 2.044 826 2HB ALA 108 3HB ALA 108 -10.260 -10.241 0.631 827 3HB ALA 108 1HB ALA 108 -11.128 -11.671 1.248 828 H ASP 109 H ASP 109 -9.157 -13.448 2.980 829 HA ASP 109 HA ASP 109 -6.625 -14.180 1.783 830 1HB ASP 109 1HB ASP 109 -9.205 -15.861 1.916 831 2HB ASP 109 2HB ASP 109 -7.570 -16.496 1.668 832 H ASN 110 H ASN 110 -6.057 -13.708 -0.146 833 HA ASN 110 HA ASN 110 -7.529 -14.730 -2.548 834 1HB ASN 110 1HB ASN 110 -7.308 -11.685 -2.098 835 2HB ASN 110 2HB ASN 110 -7.838 -12.462 -3.595 836 1HD2 ASN 110 1HD2 ASN 110 -10.879 -13.821 -1.950 837 2HD2 ASN 110 2HD2 ASN 110 -9.433 -14.441 -2.895 838 H ALA 111 H ALA 111 -5.534 -15.787 -2.359 839 HA ALA 111 HA ALA 111 -2.942 -14.582 -3.049 840 1HB ALA 111 2HB ALA 111 -3.171 -16.965 -2.297 841 2HB ALA 111 3HB ALA 111 -4.066 -17.365 -3.788 842 3HB ALA 111 1HB ALA 111 -2.355 -16.874 -3.878 843 H PHE 112 H PHE 112 -5.814 -15.373 -4.841 844 HA PHE 112 HA PHE 112 -5.096 -15.685 -7.497 845 1HB PHE 112 1HB PHE 112 -7.176 -13.573 -6.682 846 2HB PHE 112 2HB PHE 112 -7.164 -14.541 -8.159 847 HD1 PHE 112 HD1 PHE 112 -6.289 -17.157 -6.799 848 HD2 PHE 112 HD2 PHE 112 -9.253 -14.324 -5.805 849 HE1 PHE 112 HE1 PHE 112 -7.519 -18.865 -5.581 850 HE2 PHE 112 HE2 PHE 112 -10.477 -16.034 -4.588 851 HZ PHE 112 HZ PHE 112 -9.602 -18.297 -4.458 852 H LEU 113 H LEU 113 -5.040 -12.662 -5.717 853 HA LEU 113 HA LEU 113 -4.495 -10.823 -7.870 854 1HB LEU 113 1HB LEU 113 -3.550 -10.702 -4.939 855 2HB LEU 113 2HB LEU 113 -3.414 -9.376 -6.093 856 HG LEU 113 HG LEU 113 -5.918 -9.457 -6.468 857 1HD1 LEU 113 3HD1 LEU 113 -5.866 -11.365 -4.035 858 2HD1 LEU 113 1HD1 LEU 113 -7.329 -10.629 -4.741 859 3HD1 LEU 113 2HD1 LEU 113 -6.378 -11.799 -5.688 860 1HD2 LEU 113 3HD2 LEU 113 -4.846 -7.805 -4.911 861 2HD2 LEU 113 1HD2 LEU 113 -6.446 -8.299 -4.301 862 3HD2 LEU 113 2HD2 LEU 113 -4.966 -8.973 -3.569 863 H ASP 114 H ASP 114 -2.406 -13.111 -6.301 864 HA ASP 114 HA ASP 114 0.189 -12.141 -6.487 865 1HB ASP 114 1HB ASP 114 -0.431 -14.499 -5.880 866 2HB ASP 114 2HB ASP 114 -0.725 -14.867 -7.588 867 H HIS 115 H HIS 115 -0.288 -14.353 -9.045 868 HA HIS 115 HA HIS 115 -0.402 -12.631 -11.376 869 1HB HIS 115 1HB HIS 115 1.668 -11.574 -10.763 870 2HB HIS 115 2HB HIS 115 2.412 -13.084 -10.236 871 HD2 HIS 115 HD2 HIS 115 4.437 -13.063 -11.893 872 HE1 HIS 115 HE1 HIS 115 2.314 -13.399 -15.456 873 HE2 HIS 115 HE2 HIS 115 4.702 -13.515 -14.496 874 H GLY 116 H GLY 116 -1.085 -13.825 -12.783 875 1HA GLY 116 1HA GLY 116 0.217 -16.342 -13.701 876 2HA GLY 116 2HA GLY 116 -1.274 -16.690 -12.807 877 H GLN 117 H GLN 117 -1.674 -17.622 -14.918 878 HA GLN 117 HA GLN 117 -3.084 -17.639 -16.859 879 1HB GLN 117 1HB GLN 117 -4.555 -16.001 -15.669 880 2HB GLN 117 2HB GLN 117 -3.514 -14.663 -16.181 881 1HG GLN 117 1HG GLN 117 -3.944 -15.262 -18.601 882 2HG GLN 117 2HG GLN 117 -4.987 -16.592 -18.088 883 1HE2 GLN 117 2HE2 GLN 117 -7.295 -13.804 -18.832 884 2HE2 GLN 117 1HE2 GLN 117 -6.158 -14.959 -19.693 885 NH1 ARG 118 NH2 ARG 118 3.577 -16.339 -22.037 886 NH2 ARG 118 NH1 ARG 118 4.039 -14.615 -23.444 887 H ARG 118 H ARG 118 -1.365 -14.567 -16.569 888 HA ARG 118 HA ARG 118 0.692 -15.121 -18.532 889 1HB ARG 118 1HB ARG 118 -1.354 -15.185 -20.070 890 2HB ARG 118 2HB ARG 118 -1.666 -13.494 -19.664 891 1HG ARG 118 1HG ARG 118 -0.381 -13.620 -21.776 892 2HG ARG 118 2HG ARG 118 0.583 -12.826 -20.525 893 1HD ARG 118 1HD ARG 118 1.808 -15.005 -20.073 894 2HD ARG 118 2HD ARG 118 0.827 -15.814 -21.310 895 HE ARG 118 HE ARG 118 2.126 -13.487 -22.531 896 1HH1 ARG 118 2HH2 ARG 118 2.965 -16.719 -21.306 897 2HH1 ARG 118 1HH2 ARG 118 4.399 -16.795 -22.448 898 1HH2 ARG 118 1HH1 ARG 118 3.784 -13.683 -23.788 899 2HH2 ARG 118 2HH1 ARG 118 4.829 -15.191 -23.757 900 H ASP 119 H ASP 119 -1.047 -12.235 -19.046 901 HA ASP 119 HA ASP 119 1.127 -10.514 -17.962 902 1HB ASP 119 1HB ASP 119 -0.346 -8.645 -18.632 903 2HB ASP 119 2HB ASP 119 -0.225 -9.842 -19.932 904 H PHE 120 H PHE 120 1.269 -11.104 -15.847 905 HA PHE 120 HA PHE 120 -0.788 -11.112 -13.822 906 1HB PHE 120 1HB PHE 120 1.042 -10.581 -12.210 907 2HB PHE 120 2HB PHE 120 1.482 -11.862 -13.336 908 HD1 PHE 120 HD1 PHE 120 2.852 -11.237 -15.382 909 HD2 PHE 120 HD2 PHE 120 2.359 -8.605 -12.122 910 HE1 PHE 120 HE1 PHE 120 4.833 -10.011 -16.070 911 HE2 PHE 120 HE2 PHE 120 4.341 -7.382 -12.814 912 HZ PHE 120 HZ PHE 120 5.578 -8.081 -14.789 913 H GLY 121 H GLY 121 0.210 -9.094 -12.037 914 1HA GLY 121 1HA GLY 121 -0.341 -6.386 -13.150 915 2HA GLY 121 2HA GLY 121 -1.792 -7.066 -12.393 916 OH TYR 122 OH TYR 122 -6.402 -4.482 -10.048 917 H TYR 122 H TYR 122 -1.718 -7.667 -10.220 918 HA TYR 122 HA TYR 122 -0.532 -5.476 -8.641 919 1HB TYR 122 1HB TYR 122 -2.060 -7.957 -7.656 920 2HB TYR 122 2HB TYR 122 -1.772 -6.475 -6.742 921 HD1 TYR 122 HD2 TYR 122 -2.279 -4.299 -8.372 922 HD2 TYR 122 HD1 TYR 122 -4.220 -8.045 -8.501 923 HE1 TYR 122 HE2 TYR 122 -4.235 -3.254 -9.370 924 HE2 TYR 122 HE1 TYR 122 -6.174 -6.996 -9.500 925 HH TYR 122 HH TYR 122 -7.069 -5.154 -10.209 926 H ALA 123 H ALA 123 1.235 -5.353 -7.718 927 HA ALA 123 HA ALA 123 3.212 -7.554 -7.517 928 1HB ALA 123 2HB ALA 123 3.887 -5.167 -7.831 929 2HB ALA 123 3HB ALA 123 3.223 -4.753 -6.227 930 3HB ALA 123 1HB ALA 123 4.622 -5.851 -6.360 931 H VAL 124 H VAL 124 4.235 -6.733 -4.963 932 HA VAL 124 HA VAL 124 2.631 -7.329 -2.693 933 HB VAL 124 HB VAL 124 3.639 -9.897 -4.063 934 1HG1 VAL 124 3HG2 VAL 124 4.263 -9.916 -1.638 935 2HG1 VAL 124 1HG2 VAL 124 2.583 -9.523 -1.187 936 3HG1 VAL 124 2HG2 VAL 124 2.958 -11.086 -1.962 937 1HG2 VAL 124 1HG1 VAL 124 0.840 -9.069 -3.042 938 2HG2 VAL 124 2HG1 VAL 124 1.338 -9.159 -4.752 939 3HG2 VAL 124 3HG1 VAL 124 1.255 -10.644 -3.772 940 H PHE 125 H PHE 125 3.898 -6.962 -0.970 941 HA PHE 125 HA PHE 125 6.640 -8.134 -0.770 942 1HB PHE 125 1HB PHE 125 7.905 -6.056 -0.964 943 2HB PHE 125 2HB PHE 125 6.907 -6.182 -2.419 944 HD1 PHE 125 HD2 PHE 125 4.782 -4.855 -2.533 945 HD2 PHE 125 HD1 PHE 125 7.421 -4.429 0.729 946 HE1 PHE 125 HE2 PHE 125 3.554 -2.891 -1.792 947 HE2 PHE 125 HE1 PHE 125 6.193 -2.467 1.467 948 HZ PHE 125 HZ PHE 125 4.235 -1.725 0.233 949 H GLY 126 H GLY 126 4.024 -7.690 0.832 950 1HA GLY 126 1HA GLY 126 5.448 -7.058 3.442 951 2HA GLY 126 2HA GLY 126 4.157 -5.959 2.954 952 H LYS 127 H LYS 127 3.256 -6.444 4.728 953 HA LYS 127 HA LYS 127 1.207 -8.328 5.039 954 1HB LYS 127 1HB LYS 127 2.923 -10.136 4.910 955 2HB LYS 127 2HB LYS 127 3.778 -9.444 6.302 956 1HG LYS 127 1HG LYS 127 1.690 -9.748 7.720 957 2HG LYS 127 2HG LYS 127 0.854 -10.416 6.329 958 1HD LYS 127 1HD LYS 127 1.497 -12.297 7.682 959 2HD LYS 127 2HD LYS 127 2.486 -12.342 6.241 960 1HE LYS 127 1HE LYS 127 3.901 -12.939 8.108 961 2HE LYS 127 2HE LYS 127 4.446 -11.359 7.561 962 1HZ LYS 127 3HZ LYS 127 2.672 -11.858 9.910 963 2HZ LYS 127 1HZ LYS 127 4.274 -11.458 9.969 964 3HZ LYS 127 2HZ LYS 127 3.170 -10.364 9.410 965 H VAL 128 H VAL 128 0.007 -7.749 6.590 966 HA VAL 128 HA VAL 128 0.503 -5.604 8.445 967 HB VAL 128 HB VAL 128 -1.359 -8.014 8.843 968 1HG1 VAL 128 3HG2 VAL 128 -0.941 -6.698 10.945 969 2HG1 VAL 128 1HG2 VAL 128 -1.345 -5.186 10.093 970 3HG1 VAL 128 2HG2 VAL 128 -2.602 -6.426 10.354 971 1HG2 VAL 128 2HG1 VAL 128 -1.735 -6.792 6.675 972 2HG2 VAL 128 3HG1 VAL 128 -3.074 -6.482 7.811 973 3HG2 VAL 128 1HG1 VAL 128 -1.818 -5.242 7.550 974 H VAL 129 H VAL 129 0.996 -5.466 10.515 975 HA VAL 129 HA VAL 129 2.559 -7.792 11.812 976 HB VAL 129 HB VAL 129 4.102 -6.189 10.773 977 1HG1 VAL 129 3HG2 VAL 129 2.572 -4.195 10.709 978 2HG1 VAL 129 1HG2 VAL 129 2.659 -4.059 12.485 979 3HG1 VAL 129 2HG2 VAL 129 4.119 -3.783 11.496 980 1HG2 VAL 129 2HG1 VAL 129 4.709 -7.225 12.977 981 2HG2 VAL 129 3HG1 VAL 129 5.386 -5.581 12.845 982 3HG2 VAL 129 1HG1 VAL 129 3.935 -5.871 13.840 983 H LYS 130 H LYS 130 0.967 -4.670 12.322 984 HA LYS 130 HA LYS 130 -0.580 -5.506 14.646 985 1HB LYS 130 1HB LYS 130 1.761 -5.722 15.633 986 2HB LYS 130 2HB LYS 130 2.030 -4.006 15.305 987 1HG LYS 130 1HG LYS 130 1.318 -4.264 17.639 988 2HG LYS 130 2HG LYS 130 0.073 -3.388 16.760 989 1HD LYS 130 1HD LYS 130 -0.004 -6.410 17.420 990 2HD LYS 130 2HD LYS 130 -0.788 -5.151 18.366 991 1HE LYS 130 1HE LYS 130 -2.254 -4.534 16.389 992 2HE LYS 130 2HE LYS 130 -1.482 -5.797 15.418 993 1HZ LYS 130 1HZ LYS 130 -3.009 -6.270 17.934 994 2HZ LYS 130 2HZ LYS 130 -3.544 -6.578 16.402 995 3HZ LYS 130 3HZ LYS 130 -2.286 -7.447 17.028 996 H GLY 131 H GLY 131 -1.789 -4.354 13.102 997 1HA GLY 131 1HA GLY 131 -2.399 -1.583 13.918 998 2HA GLY 131 2HA GLY 131 -1.490 -1.558 12.399 999 H MET 132 H MET 132 -2.844 -4.333 11.930 1000 HA MET 132 HA MET 132 -4.724 -3.695 9.953 1001 1HB MET 132 1HB MET 132 -3.950 -6.035 10.675 1002 2HB MET 132 2HB MET 132 -5.153 -5.982 11.971 1003 1HG MET 132 1HG MET 132 -6.087 -7.148 9.998 1004 2HG MET 132 2HG MET 132 -6.972 -5.621 10.221 1005 1HE MET 132 3HE MET 132 -7.680 -6.241 7.526 1006 2HE MET 132 2HE MET 132 -6.462 -6.264 6.216 1007 3HE MET 132 1HE MET 132 -6.478 -7.567 7.439 1008 H ASP 133 H ASP 133 -5.313 -3.974 13.413 1009 HA ASP 133 HA ASP 133 -8.116 -3.577 13.644 1010 1HB ASP 133 1HB ASP 133 -6.542 -3.827 15.580 1011 2HB ASP 133 2HB ASP 133 -5.912 -2.195 15.292 1012 H VAL 134 H VAL 134 -5.675 -1.004 13.644 1013 HA VAL 134 HA VAL 134 -7.313 1.309 13.384 1014 HB VAL 134 HB VAL 134 -4.703 0.748 11.853 1015 1HG1 VAL 134 3HG2 VAL 134 -5.996 2.699 10.937 1016 2HG1 VAL 134 1HG2 VAL 134 -6.121 3.398 12.571 1017 3HG1 VAL 134 2HG2 VAL 134 -4.528 3.258 11.781 1018 1HG2 VAL 134 2HG1 VAL 134 -4.476 0.475 14.345 1019 2HG2 VAL 134 3HG1 VAL 134 -3.629 1.941 13.786 1020 3HG2 VAL 134 1HG1 VAL 134 -5.211 2.082 14.595 1021 H ALA 135 H ALA 135 -5.923 -0.607 10.771 1022 HA ALA 135 HA ALA 135 -7.141 0.567 8.490 1023 1HB ALA 135 2HB ALA 135 -5.516 -1.345 8.359 1024 2HB ALA 135 3HB ALA 135 -6.756 -2.461 8.992 1025 3HB ALA 135 1HB ALA 135 -6.976 -1.690 7.399 1026 H ASP 136 H ASP 136 -8.439 -2.009 10.537 1027 HA ASP 136 HA ASP 136 -10.934 -2.516 9.217 1028 1HB ASP 136 1HB ASP 136 -10.419 -2.392 12.252 1029 2HB ASP 136 2HB ASP 136 -11.808 -3.175 11.479 1030 H LYS 137 H LYS 137 -10.589 -0.579 12.132 1031 HA LYS 137 HA LYS 137 -13.082 0.794 12.105 1032 1HB LYS 137 1HB LYS 137 -10.352 1.938 12.928 1033 2HB LYS 137 2HB LYS 137 -11.918 2.671 13.314 1034 1HG LYS 137 1HG LYS 137 -12.637 0.472 14.383 1035 2HG LYS 137 2HG LYS 137 -11.028 -0.178 14.123 1036 1HD LYS 137 1HD LYS 137 -11.704 2.303 15.840 1037 2HD LYS 137 2HD LYS 137 -11.501 0.691 16.485 1038 1HE LYS 137 1HE LYS 137 -9.254 2.290 15.073 1039 2HE LYS 137 2HE LYS 137 -9.501 2.209 16.814 1040 1HZ LYS 137 2HZ LYS 137 -9.131 -0.196 16.724 1041 2HZ LYS 137 3HZ LYS 137 -8.893 -0.141 15.090 1042 3HZ LYS 137 1HZ LYS 137 -7.836 0.623 16.106 1043 H ILE 138 H ILE 138 -10.068 1.702 10.481 1044 HA ILE 138 HA ILE 138 -11.011 4.162 9.209 1045 HB ILE 138 HB ILE 138 -8.978 2.106 8.162 1046 1HG1 ILE 138 1HG1 ILE 138 -8.790 4.641 9.891 1047 2HG1 ILE 138 2HG1 ILE 138 -8.328 3.002 10.363 1048 1HG2 ILE 138 2HG2 ILE 138 -9.882 3.631 6.376 1049 2HG2 ILE 138 3HG2 ILE 138 -9.521 5.050 7.395 1050 3HG2 ILE 138 1HG2 ILE 138 -8.190 4.043 6.765 1051 1HD1 ILE 138 3HD1 ILE 138 -6.987 4.677 8.123 1052 2HD1 ILE 138 1HD1 ILE 138 -6.299 4.363 9.736 1053 3HD1 ILE 138 2HD1 ILE 138 -6.504 3.021 8.576 1054 H SER 139 H SER 139 -10.568 0.944 7.816 1055 HA SER 139 HA SER 139 -12.231 1.317 5.488 1056 1HB SER 139 1HB SER 139 -12.229 -1.176 5.327 1057 2HB SER 139 2HB SER 139 -10.615 -0.532 5.683 1058 HG SER 139 HG SER 139 -11.180 -2.276 7.018 1059 H GLN 140 H GLN 140 -13.301 1.487 8.491 1060 HA GLN 140 HA GLN 140 -16.046 0.218 7.970 1061 1HB GLN 140 1HB GLN 140 -15.040 1.580 10.534 1062 2HB GLN 140 2HB GLN 140 -16.539 0.667 10.306 1063 1HG GLN 140 1HG GLN 140 -13.660 -0.374 10.289 1064 2HG GLN 140 2HG GLN 140 -15.022 -0.947 11.261 1065 1HE2 GLN 140 2HE2 GLN 140 -14.386 -2.342 7.444 1066 2HE2 GLN 140 1HE2 GLN 140 -13.260 -1.276 8.405 1067 H VAL 141 H VAL 141 -14.512 3.258 8.900 1068 HA VAL 141 HA VAL 141 -16.817 4.993 8.920 1069 HB VAL 141 HB VAL 141 -15.237 6.835 8.412 1070 1HG1 VAL 141 3HG2 VAL 141 -15.327 5.860 10.724 1071 2HG1 VAL 141 1HG2 VAL 141 -14.070 4.674 10.287 1072 3HG1 VAL 141 2HG2 VAL 141 -13.676 6.413 10.339 1073 1HG2 VAL 141 2HG1 VAL 141 -13.914 5.668 6.620 1074 2HG2 VAL 141 3HG1 VAL 141 -12.834 6.301 7.890 1075 3HG2 VAL 141 1HG1 VAL 141 -13.224 4.561 7.835 1076 HA PRO 142 HA PRO 142 -18.593 4.617 4.915 1077 1HB PRO 142 1HB PRO 142 -19.266 7.486 5.755 1078 2HB PRO 142 2HB PRO 142 -20.352 6.274 5.029 1079 1HG PRO 142 1HG PRO 142 -20.471 6.659 7.710 1080 2HG PRO 142 2HG PRO 142 -20.426 4.985 7.101 1081 1HD PRO 142 1HD PRO 142 -18.116 6.598 8.307 1082 2HD PRO 142 2HD PRO 142 -18.523 4.867 8.547 1083 H THR 143 H THR 143 -18.948 6.260 3.099 1084 HA THR 143 HA THR 143 -16.631 8.088 2.446 1085 HB THR 143 HB THR 143 -16.275 6.725 0.251 1086 HG1 THR 143 HG1 THR 143 -16.623 4.497 0.540 1087 1HG2 THR 143 2HG2 THR 143 -14.549 6.934 2.010 1088 2HG2 THR 143 3HG2 THR 143 -15.267 5.556 2.901 1089 3HG2 THR 143 1HG2 THR 143 -14.532 5.304 1.284 1090 H HIS 144 H HIS 144 -16.869 7.241 -0.215 1091 HA HIS 144 HA HIS 144 -19.495 7.269 -1.320 1092 1HB HIS 144 1HB HIS 144 -19.942 9.537 -2.088 1093 2HB HIS 144 2HB HIS 144 -19.804 9.512 -0.335 1094 HD2 HIS 144 HD2 HIS 144 -16.313 9.357 -1.751 1095 HE1 HIS 144 HE1 HIS 144 -17.080 13.425 -1.369 1096 HE2 HIS 144 HE2 HIS 144 -15.175 11.750 -1.804 1097 H ASP 145 H ASP 145 -19.664 7.070 -3.324 1098 HA ASP 145 HA ASP 145 -17.269 6.532 -5.031 1099 1HB ASP 145 1HB ASP 145 -20.250 6.850 -5.747 1100 2HB ASP 145 2HB ASP 145 -18.993 6.251 -6.843 1101 H VAL 146 H VAL 146 -16.094 8.101 -5.611 1102 HA VAL 146 HA VAL 146 -16.995 10.913 -5.591 1103 HB VAL 146 HB VAL 146 -14.364 10.164 -6.875 1104 1HG1 VAL 146 3HG2 VAL 146 -15.090 12.552 -6.473 1105 2HG1 VAL 146 1HG2 VAL 146 -15.282 12.197 -4.736 1106 3HG1 VAL 146 2HG2 VAL 146 -13.663 12.142 -5.478 1107 1HG2 VAL 146 1HG1 VAL 146 -14.923 9.822 -3.866 1108 2HG2 VAL 146 2HG1 VAL 146 -14.484 8.520 -5.007 1109 3HG2 VAL 146 3HG1 VAL 146 -13.313 9.812 -4.640 1110 H GLY 147 H GLY 147 -15.149 11.524 -7.867 1111 1HA GLY 147 1HA GLY 147 -17.108 11.754 -10.115 1112 2HA GLY 147 2HA GLY 147 -15.369 12.093 -10.213 1113 HA PRO 148 HA PRO 148 -15.004 8.165 -12.428 1114 1HB PRO 148 1HB PRO 148 -12.299 8.463 -12.832 1115 2HB PRO 148 2HB PRO 148 -13.481 9.484 -13.688 1116 1HG PRO 148 1HG PRO 148 -11.933 10.180 -11.131 1117 2HG PRO 148 2HG PRO 148 -12.052 11.152 -12.618 1118 1HD PRO 148 1HD PRO 148 -13.709 11.616 -10.434 1119 2HD PRO 148 2HD PRO 148 -14.326 11.821 -12.105 1120 OH TYR 149 OH TYR 149 -7.549 10.482 -11.711 1121 H TYR 149 H TYR 149 -12.801 9.396 -9.946 1122 HA TYR 149 HA TYR 149 -11.709 6.794 -9.149 1123 1HB TYR 149 1HB TYR 149 -11.799 9.421 -7.546 1124 2HB TYR 149 2HB TYR 149 -10.747 8.041 -7.220 1125 HD1 TYR 149 HD2 TYR 149 -9.310 7.227 -9.232 1126 HD2 TYR 149 HD1 TYR 149 -11.038 11.071 -9.006 1127 HE1 TYR 149 HE2 TYR 149 -7.685 8.053 -10.837 1128 HE2 TYR 149 HE1 TYR 149 -9.413 11.896 -10.610 1129 HH TYR 149 HH TYR 149 -7.711 11.414 -11.869 1130 H GLN 150 H GLN 150 -13.179 5.375 -8.715 1131 HA GLN 150 HA GLN 150 -15.378 5.710 -6.714 1132 1HB GLN 150 1HB GLN 150 -15.723 3.330 -6.928 1133 2HB GLN 150 2HB GLN 150 -15.483 3.985 -8.548 1134 1HG GLN 150 1HG GLN 150 -13.285 2.638 -6.842 1135 2HG GLN 150 2HG GLN 150 -14.220 1.813 -8.091 1136 1HE2 GLN 150 2HE2 GLN 150 -12.646 3.647 -10.828 1137 2HE2 GLN 150 1HE2 GLN 150 -14.277 3.044 -10.244 1138 H ASN 151 H ASN 151 -15.387 5.280 -4.678 1139 HA ASN 151 HA ASN 151 -14.663 4.541 -2.508 1140 1HB ASN 151 1HB ASN 151 -12.195 3.440 -3.976 1141 2HB ASN 151 2HB ASN 151 -12.625 3.133 -2.286 1142 1HD2 ASN 151 1HD2 ASN 151 -14.020 0.230 -4.053 1143 2HD2 ASN 151 2HD2 ASN 151 -12.421 0.932 -3.492 1144 H VAL 152 H VAL 152 -14.698 6.742 -2.239 1145 HA VAL 152 HA VAL 152 -12.023 7.628 -1.085 1146 HB VAL 152 HB VAL 152 -13.826 9.448 -2.781 1147 1HG1 VAL 152 1HG2 VAL 152 -11.334 10.080 -1.063 1148 2HG1 VAL 152 2HG2 VAL 152 -12.173 11.233 -2.134 1149 3HG1 VAL 152 3HG2 VAL 152 -13.004 10.584 -0.696 1150 1HG2 VAL 152 2HG1 VAL 152 -12.244 7.980 -4.090 1151 2HG2 VAL 152 3HG1 VAL 152 -11.718 9.684 -4.153 1152 3HG2 VAL 152 1HG1 VAL 152 -10.883 8.530 -3.079 1153 HA PRO 153 HA PRO 153 -14.693 7.548 2.369 1154 1HB PRO 153 1HB PRO 153 -12.758 8.515 4.131 1155 2HB PRO 153 2HB PRO 153 -12.738 6.869 3.457 1156 1HG PRO 153 1HG PRO 153 -11.207 9.315 2.431 1157 2HG PRO 153 2HG PRO 153 -10.551 7.694 2.775 1158 1HD PRO 153 1HD PRO 153 -11.234 8.417 0.205 1159 2HD PRO 153 2HD PRO 153 -11.599 6.754 0.775 1160 H SER 154 H SER 154 -16.210 8.941 2.010 1161 HA SER 154 HA SER 154 -16.175 11.754 1.544 1162 1HB SER 154 1HB SER 154 -18.418 11.832 2.675 1163 2HB SER 154 2HB SER 154 -18.277 10.476 1.540 1164 HG SER 154 HG SER 154 -19.157 9.867 3.542 1165 H LYS 155 H LYS 155 -16.337 10.055 4.636 1166 HA LYS 155 HA LYS 155 -15.406 12.409 6.277 1167 1HB LYS 155 1HB LYS 155 -16.878 10.293 6.974 1168 2HB LYS 155 2HB LYS 155 -15.320 9.477 7.132 1169 1HG LYS 155 1HG LYS 155 -15.948 10.460 9.310 1170 2HG LYS 155 2HG LYS 155 -14.520 11.299 8.692 1171 1HD LYS 155 1HD LYS 155 -15.984 13.170 7.818 1172 2HD LYS 155 2HD LYS 155 -17.425 12.319 8.386 1173 1HE LYS 155 1HE LYS 155 -16.575 12.482 10.782 1174 2HE LYS 155 2HE LYS 155 -15.149 13.361 10.210 1175 1HZ LYS 155 3HZ LYS 155 -17.970 14.269 9.876 1176 2HZ LYS 155 1HZ LYS 155 -16.882 14.870 10.964 1177 3HZ LYS 155 2HZ LYS 155 -16.641 15.093 9.345 1178 HA PRO 156 HA PRO 156 -11.528 11.431 4.289 1179 1HB PRO 156 1HB PRO 156 -10.327 13.874 4.820 1180 2HB PRO 156 2HB PRO 156 -11.656 13.665 3.657 1181 1HG PRO 156 1HG PRO 156 -11.872 14.568 6.579 1182 2HG PRO 156 2HG PRO 156 -12.565 15.367 5.144 1183 1HD PRO 156 1HD PRO 156 -14.100 13.677 6.689 1184 2HD PRO 156 2HD PRO 156 -14.274 13.640 4.903 1185 H VAL 157 H VAL 157 -10.134 10.170 4.968 1186 HA VAL 157 HA VAL 157 -8.866 10.133 7.694 1187 HB VAL 157 HB VAL 157 -8.068 8.813 5.034 1188 1HG1 VAL 157 3HG2 VAL 157 -6.100 9.116 6.557 1189 2HG1 VAL 157 1HG2 VAL 157 -7.002 8.364 7.898 1190 3HG1 VAL 157 2HG2 VAL 157 -6.561 7.397 6.465 1191 1HG2 VAL 157 2HG1 VAL 157 -10.250 7.978 5.975 1192 2HG2 VAL 157 3HG1 VAL 157 -8.978 6.736 6.109 1193 3HG2 VAL 157 1HG1 VAL 157 -9.459 7.671 7.546 1194 H VAL 158 H VAL 158 -6.716 10.551 8.062 1195 HA VAL 158 HA VAL 158 -4.987 11.961 6.090 1196 HB VAL 158 HB VAL 158 -6.024 13.529 8.529 1197 1HG1 VAL 158 3HG2 VAL 158 -3.573 13.881 8.091 1198 2HG1 VAL 158 1HG2 VAL 158 -3.918 14.244 6.381 1199 3HG1 VAL 158 2HG2 VAL 158 -4.503 15.340 7.661 1200 1HG2 VAL 158 2HG1 VAL 158 -7.632 13.473 6.594 1201 2HG2 VAL 158 3HG1 VAL 158 -6.916 15.098 6.771 1202 3HG2 VAL 158 1HG1 VAL 158 -6.336 14.001 5.489 1203 H ILE 159 H ILE 159 -3.211 11.178 6.341 1204 HA ILE 159 HA ILE 159 -2.388 9.566 8.661 1205 HB ILE 159 HB ILE 159 -0.800 10.627 6.262 1206 1HG1 ILE 159 1HG1 ILE 159 -2.218 7.984 6.964 1207 2HG1 ILE 159 2HG1 ILE 159 -2.713 9.134 5.717 1208 1HG2 ILE 159 3HG2 ILE 159 -0.071 8.490 8.371 1209 2HG2 ILE 159 1HG2 ILE 159 0.869 8.859 6.899 1210 3HG2 ILE 159 2HG2 ILE 159 0.713 10.081 8.187 1211 1HD1 ILE 159 3HD1 ILE 159 -0.041 7.571 5.749 1212 2HD1 ILE 159 1HD1 ILE 159 -1.446 7.211 4.709 1213 3HD1 ILE 159 2HD1 ILE 159 -0.533 8.729 4.481 1214 H LEU 160 H LEU 160 -1.158 9.855 10.195 1215 HA LEU 160 HA LEU 160 -0.600 12.703 11.134 1216 1HB LEU 160 1HB LEU 160 -0.429 10.022 12.631 1217 2HB LEU 160 2HB LEU 160 -0.222 11.628 13.345 1218 HG LEU 160 HG LEU 160 -2.745 10.616 11.903 1219 1HD1 LEU 160 2HD1 LEU 160 -2.410 9.608 14.184 1220 2HD1 LEU 160 3HD1 LEU 160 -2.223 11.236 14.887 1221 3HD1 LEU 160 1HD1 LEU 160 -3.787 10.740 14.188 1222 1HD2 LEU 160 3HD2 LEU 160 -2.376 13.077 11.559 1223 2HD2 LEU 160 1HD2 LEU 160 -3.767 12.791 12.635 1224 3HD2 LEU 160 2HD2 LEU 160 -2.203 13.310 13.318 1225 H SER 161 H SER 161 1.005 9.569 10.811 1226 HA SER 161 HA SER 161 3.657 10.798 10.144 1227 1HB SER 161 1HB SER 161 3.412 11.202 12.635 1228 2HB SER 161 2HB SER 161 3.258 9.454 12.890 1229 HG SER 161 HG SER 161 5.387 10.209 13.145 1230 H ALA 162 H ALA 162 5.398 9.240 10.202 1231 HA ALA 162 HA ALA 162 4.838 6.328 9.978 1232 1HB ALA 162 2HB ALA 162 3.694 7.132 7.875 1233 2HB ALA 162 3HB ALA 162 5.201 7.931 7.352 1234 3HB ALA 162 1HB ALA 162 5.133 6.155 7.487 1235 H LYS 163 H LYS 163 6.537 5.226 10.140 1236 HA LYS 163 HA LYS 163 9.118 5.826 8.917 1237 1HB LYS 163 1HB LYS 163 10.495 6.380 10.827 1238 2HB LYS 163 2HB LYS 163 9.186 7.562 10.747 1239 1HG LYS 163 1HG LYS 163 9.305 5.069 12.565 1240 2HG LYS 163 2HG LYS 163 9.579 6.734 13.086 1241 1HD LYS 163 1HD LYS 163 7.196 7.326 12.431 1242 2HD LYS 163 2HD LYS 163 6.923 5.654 11.925 1243 1HE LYS 163 1HE LYS 163 7.389 4.859 14.299 1244 2HE LYS 163 2HE LYS 163 7.672 6.532 14.804 1245 1HZ LYS 163 3HZ LYS 163 5.372 7.051 14.171 1246 2HZ LYS 163 1HZ LYS 163 5.107 5.489 13.700 1247 3HZ LYS 163 2HZ LYS 163 5.414 5.833 15.286 1248 H VAL 164 H VAL 164 10.615 4.299 9.128 1249 HA VAL 164 HA VAL 164 9.628 1.565 9.690 1250 HB VAL 164 HB VAL 164 11.907 0.904 9.036 1251 1HG1 VAL 164 3HG2 VAL 164 10.227 1.470 7.260 1252 2HG1 VAL 164 1HG2 VAL 164 10.754 3.173 7.289 1253 3HG1 VAL 164 2HG2 VAL 164 11.873 1.903 6.726 1254 1HG2 VAL 164 2HG1 VAL 164 13.168 2.738 10.197 1255 2HG2 VAL 164 3HG1 VAL 164 13.624 2.659 8.475 1256 3HG2 VAL 164 1HG1 VAL 164 12.513 3.932 9.048 1257 H LEU 165 H LEU 165 9.942 0.312 11.282 1258 HA LEU 165 HA LEU 165 10.880 1.311 13.938 1259 1HB LEU 165 1HB LEU 165 9.047 -0.391 13.645 1260 2HB LEU 165 2HB LEU 165 10.222 -1.564 13.045 1261 HG LEU 165 HG LEU 165 9.662 -1.784 15.510 1262 1HD1 LEU 165 2HD1 LEU 165 11.840 -2.670 14.634 1263 2HD1 LEU 165 3HD1 LEU 165 12.615 -1.093 14.940 1264 3HD1 LEU 165 1HD1 LEU 165 12.013 -2.069 16.304 1265 1HD2 LEU 165 3HD2 LEU 165 9.408 0.665 16.012 1266 2HD2 LEU 165 1HD2 LEU 165 10.598 -0.085 17.106 1267 3HD2 LEU 165 2HD2 LEU 165 11.153 0.914 15.737 1268 HA PRO 166 HA PRO 166 15.241 0.964 13.216 1269 1HB PRO 166 1HB PRO 166 14.910 0.563 16.235 1270 2HB PRO 166 2HB PRO 166 16.095 1.589 15.391 1271 1HG PRO 166 1HG PRO 166 13.898 2.769 16.461 1272 2HG PRO 166 2HG PRO 166 14.381 3.224 14.808 1273 1HD PRO 166 1HD PRO 166 12.128 1.320 15.639 1274 2HD PRO 166 2HD PRO 166 12.139 2.543 14.326 Start of MODEL 5 Raw file had 1274 H/Q atoms Start of MODEL 5 1 1H ALA 1 3H ALA 1 18.974 -1.841 13.034 2 2H ALA 1 1H ALA 1 19.849 -3.241 12.957 3 3H ALA 1 2H ALA 1 19.942 -2.281 14.299 4 HA ALA 1 HA ALA 1 20.979 -0.487 13.038 5 1HB ALA 1 3HB ALA 1 22.448 -2.170 14.188 6 2HB ALA 1 1HB ALA 1 22.384 -3.231 12.756 7 3HB ALA 1 2HB ALA 1 23.186 -1.642 12.655 8 H LYS 2 H LYS 2 19.712 0.138 11.414 9 HA LYS 2 HA LYS 2 20.099 0.713 8.981 10 1HB LYS 2 1HB LYS 2 20.425 -2.339 8.749 11 2HB LYS 2 2HB LYS 2 20.513 -1.198 7.402 12 1HG LYS 2 1HG LYS 2 22.371 -1.268 9.865 13 2HG LYS 2 2HG LYS 2 22.794 -1.809 8.239 14 1HD LYS 2 1HD LYS 2 22.437 0.580 7.376 15 2HD LYS 2 2HD LYS 2 22.024 1.082 9.008 16 1HE LYS 2 1HE LYS 2 24.301 1.752 8.666 17 2HE LYS 2 2HE LYS 2 24.360 0.409 9.804 18 1HZ LYS 2 3HZ LYS 2 24.911 0.222 6.873 19 2HZ LYS 2 1HZ LYS 2 26.042 0.198 8.077 20 3HZ LYS 2 2HZ LYS 2 24.972 -1.051 7.924 21 H GLY 3 H GLY 3 18.997 -2.081 7.786 22 1HA GLY 3 1HA GLY 3 16.480 -1.192 6.860 23 2HA GLY 3 2HA GLY 3 16.845 -2.902 7.097 24 H ASP 4 H ASP 4 14.393 -1.926 7.283 25 HA ASP 4 HA ASP 4 13.452 -2.976 9.867 26 1HB ASP 4 1HB ASP 4 13.201 0.068 9.422 27 2HB ASP 4 2HB ASP 4 12.285 -0.845 10.630 28 HA PRO 5 HA PRO 5 10.710 -3.186 6.169 29 1HB PRO 5 1HB PRO 5 10.287 -5.908 6.384 30 2HB PRO 5 2HB PRO 5 11.797 -5.227 5.736 31 1HG PRO 5 1HG PRO 5 11.275 -6.175 8.606 32 2HG PRO 5 2HG PRO 5 12.621 -6.649 7.539 33 1HD PRO 5 1HD PRO 5 12.924 -4.634 9.413 34 2HD PRO 5 2HD PRO 5 13.711 -4.490 7.807 35 H HIS 6 H HIS 6 9.764 -1.838 8.048 36 HA HIS 6 HA HIS 6 7.002 -2.950 8.590 37 1HB HIS 6 1HB HIS 6 8.816 -2.005 10.899 38 2HB HIS 6 2HB HIS 6 7.096 -2.389 11.021 39 HD2 HIS 6 HD2 HIS 6 8.553 -4.780 8.576 40 HE1 HIS 6 HE1 HIS 6 8.834 -6.773 12.219 41 HE2 HIS 6 HE2 HIS 6 9.014 -7.155 9.680 42 H VAL 7 H VAL 7 6.705 -1.441 6.973 43 HA VAL 7 HA VAL 7 7.152 1.465 7.316 44 HB VAL 7 HB VAL 7 5.137 -0.147 5.630 45 1HG1 VAL 7 1HG2 VAL 7 5.577 2.904 5.664 46 2HG1 VAL 7 2HG2 VAL 7 4.581 2.001 4.490 47 3HG1 VAL 7 3HG2 VAL 7 4.104 2.053 6.205 48 1HG2 VAL 7 2HG1 VAL 7 7.580 -0.244 4.993 49 2HG2 VAL 7 3HG1 VAL 7 6.639 0.666 3.775 50 3HG2 VAL 7 1HG1 VAL 7 7.643 1.538 4.965 51 H LEU 8 H LEU 8 6.783 1.440 9.508 52 HA LEU 8 HA LEU 8 4.085 0.853 10.622 53 1HB LEU 8 1HB LEU 8 6.265 0.459 11.813 54 2HB LEU 8 2HB LEU 8 6.462 2.206 12.018 55 HG LEU 8 HG LEU 8 3.877 0.741 12.803 56 1HD1 LEU 8 2HD1 LEU 8 5.770 -0.376 13.963 57 2HD1 LEU 8 3HD1 LEU 8 6.364 1.196 14.561 58 3HD1 LEU 8 1HD1 LEU 8 4.790 0.557 15.125 59 1HD2 LEU 8 3HD2 LEU 8 3.770 3.251 12.655 60 2HD2 LEU 8 1HD2 LEU 8 3.592 2.708 14.343 61 3HD2 LEU 8 2HD2 LEU 8 5.143 3.386 13.785 62 H LEU 9 H LEU 9 2.577 1.966 10.184 63 HA LEU 9 HA LEU 9 2.717 4.990 9.689 64 1HB LEU 9 1HB LEU 9 0.814 2.764 8.891 65 2HB LEU 9 2HB LEU 9 0.149 4.388 9.078 66 HG LEU 9 HG LEU 9 2.679 3.843 7.440 67 1HD1 LEU 9 2HD1 LEU 9 0.753 2.573 6.440 68 2HD1 LEU 9 3HD1 LEU 9 -0.247 4.050 6.460 69 3HD1 LEU 9 1HD1 LEU 9 1.194 3.961 5.411 70 1HD2 LEU 9 3HD2 LEU 9 2.332 6.205 8.236 71 2HD2 LEU 9 1HD2 LEU 9 2.109 6.104 6.470 72 3HD2 LEU 9 2HD2 LEU 9 0.690 6.213 7.542 73 H THR 10 H THR 10 0.751 6.066 10.214 74 HA THR 10 HA THR 10 -0.786 5.320 12.671 75 HB THR 10 HB THR 10 1.174 7.699 12.759 76 HG1 THR 10 HG1 THR 10 2.026 6.478 14.481 77 1HG2 THR 10 3HG2 THR 10 -0.867 6.643 14.829 78 2HG2 THR 10 1HG2 THR 10 0.285 7.979 15.099 79 3HG2 THR 10 2HG2 THR 10 -1.025 8.158 13.902 80 H THR 11 H THR 11 -2.332 5.478 11.161 81 HA THR 11 HA THR 11 -2.993 8.073 9.775 82 HB THR 11 HB THR 11 -5.159 6.852 9.221 83 HG1 THR 11 HG1 THR 11 -3.750 4.748 10.504 84 1HG2 THR 11 3HG2 THR 11 -2.495 5.441 8.572 85 2HG2 THR 11 1HG2 THR 11 -4.011 5.297 7.632 86 3HG2 THR 11 2HG2 THR 11 -3.158 6.862 7.721 87 H SER 12 H SER 12 -4.981 9.026 9.997 88 HA SER 12 HA SER 12 -5.571 10.250 12.500 89 1HB SER 12 1HB SER 12 -7.604 9.507 10.306 90 2HB SER 12 2HB SER 12 -7.875 10.702 11.589 91 HG SER 12 HG SER 12 -5.786 10.749 9.661 92 H ALA 13 H ALA 13 -7.119 7.419 11.067 93 HA ALA 13 HA ALA 13 -8.952 6.700 13.127 94 1HB ALA 13 2HB ALA 13 -8.798 5.474 10.948 95 2HB ALA 13 3HB ALA 13 -7.244 4.760 11.448 96 3HB ALA 13 1HB ALA 13 -8.743 4.341 12.319 97 H GLY 14 H GLY 14 -5.753 5.583 12.707 98 1HA GLY 14 1HA GLY 14 -4.783 5.827 15.437 99 2HA GLY 14 2HA GLY 14 -5.486 4.206 15.338 100 H ASN 15 H ASN 15 -3.211 4.037 16.031 101 HA ASN 15 HA ASN 15 -0.982 4.176 14.122 102 1HB ASN 15 1HB ASN 15 -0.683 4.040 16.604 103 2HB ASN 15 2HB ASN 15 -1.345 2.399 16.611 104 1HD2 ASN 15 1HD2 ASN 15 2.229 2.880 14.543 105 2HD2 ASN 15 2HD2 ASN 15 0.844 4.068 14.352 106 H ILE 16 H ILE 16 0.070 2.660 13.065 107 HA ILE 16 HA ILE 16 -0.678 -0.177 12.875 108 HB ILE 16 HB ILE 16 -1.429 -0.176 10.474 109 1HG1 ILE 16 1HG1 ILE 16 -1.713 2.853 10.935 110 2HG1 ILE 16 2HG1 ILE 16 -0.523 2.090 9.873 111 1HG2 ILE 16 2HG2 ILE 16 -3.022 -0.408 12.359 112 2HG2 ILE 16 3HG2 ILE 16 -3.211 1.364 12.440 113 3HG2 ILE 16 1HG2 ILE 16 -3.769 0.470 10.995 114 1HD1 ILE 16 3HD1 ILE 16 -3.595 1.832 9.563 115 2HD1 ILE 16 1HD1 ILE 16 -2.530 2.844 8.551 116 3HD1 ILE 16 2HD1 ILE 16 -2.390 1.068 8.493 117 H GLU 17 H GLU 17 0.350 -1.265 11.130 118 HA GLU 17 HA GLU 17 2.781 -0.038 9.867 119 1HB GLU 17 1HB GLU 17 4.445 -1.270 11.223 120 2HB GLU 17 2HB GLU 17 3.512 -0.147 12.229 121 1HG GLU 17 1HG GLU 17 1.968 -2.049 12.904 122 2HG GLU 17 2HG GLU 17 2.907 -3.164 11.917 123 H LEU 18 H LEU 18 2.872 -0.918 8.088 124 HA LEU 18 HA LEU 18 2.374 -3.866 7.567 125 1HB LEU 18 1HB LEU 18 3.570 -1.685 5.751 126 2HB LEU 18 2HB LEU 18 3.315 -3.371 5.300 127 HG LEU 18 HG LEU 18 1.420 -2.198 4.455 128 1HD1 LEU 18 2HD1 LEU 18 0.875 -4.374 5.591 129 2HD1 LEU 18 3HD1 LEU 18 0.592 -3.514 7.127 130 3HD1 LEU 18 1HD1 LEU 18 -0.483 -3.228 5.733 131 1HD2 LEU 18 3HD2 LEU 18 1.655 -0.101 5.786 132 2HD2 LEU 18 1HD2 LEU 18 -0.021 -0.704 5.839 133 3HD2 LEU 18 2HD2 LEU 18 1.055 -0.938 7.245 134 H GLU 19 H GLU 19 3.996 -5.090 6.593 135 HA GLU 19 HA GLU 19 6.909 -4.482 7.360 136 1HB GLU 19 1HB GLU 19 5.959 -6.063 9.049 137 2HB GLU 19 2HB GLU 19 5.423 -7.141 7.750 138 1HG GLU 19 1HG GLU 19 7.821 -7.366 6.950 139 2HG GLU 19 2HG GLU 19 8.356 -6.282 8.230 140 H LEU 20 H LEU 20 8.002 -4.420 5.730 141 HA LEU 20 HA LEU 20 6.940 -5.464 3.065 142 1HB LEU 20 1HB LEU 20 9.101 -3.379 3.732 143 2HB LEU 20 2HB LEU 20 8.631 -3.877 2.107 144 HG LEU 20 HG LEU 20 6.234 -3.208 2.618 145 1HD1 LEU 20 3HD1 LEU 20 7.506 -1.925 5.127 146 2HD1 LEU 20 1HD1 LEU 20 5.843 -1.638 4.550 147 3HD1 LEU 20 2HD1 LEU 20 6.318 -3.254 5.127 148 1HD2 LEU 20 3HD2 LEU 20 7.790 -1.711 1.339 149 2HD2 LEU 20 1HD2 LEU 20 6.677 -0.754 2.347 150 3HD2 LEU 20 2HD2 LEU 20 8.367 -0.987 2.864 151 H ASP 21 H ASP 21 7.573 -7.259 2.437 152 HA ASP 21 HA ASP 21 10.047 -8.677 3.248 153 1HB ASP 21 1HB ASP 21 8.214 -9.100 0.811 154 2HB ASP 21 2HB ASP 21 9.465 -10.228 1.362 155 H LYS 22 H LYS 22 11.769 -7.505 2.918 156 HA LYS 22 HA LYS 22 12.347 -5.877 0.541 157 1HB LYS 22 1HB LYS 22 14.281 -7.084 2.594 158 2HB LYS 22 2HB LYS 22 14.649 -5.762 1.471 159 1HG LYS 22 1HG LYS 22 12.695 -4.454 2.454 160 2HG LYS 22 2HG LYS 22 12.453 -5.714 3.650 161 1HD LYS 22 1HD LYS 22 15.038 -4.015 3.365 162 2HD LYS 22 2HD LYS 22 13.703 -3.648 4.428 163 1HE LYS 22 1HE LYS 22 15.255 -4.631 5.883 164 2HE LYS 22 2HE LYS 22 14.072 -5.910 5.634 165 1HZ LYS 22 3HZ LYS 22 16.716 -5.692 4.260 166 2HZ LYS 22 1HZ LYS 22 16.342 -6.733 5.487 167 3HZ LYS 22 2HZ LYS 22 15.626 -6.908 4.009 168 H GLN 23 H GLN 23 13.494 -9.043 1.634 169 HA GLN 23 HA GLN 23 15.605 -9.512 -0.162 170 1HB GLN 23 1HB GLN 23 14.916 -11.107 1.643 171 2HB GLN 23 2HB GLN 23 13.507 -11.600 0.691 172 1HG GLN 23 1HG GLN 23 15.038 -12.332 -1.185 173 2HG GLN 23 2HG GLN 23 16.442 -11.833 -0.238 174 1HE2 GLN 23 2HE2 GLN 23 15.262 -15.563 0.270 175 2HE2 GLN 23 1HE2 GLN 23 15.048 -14.487 -1.200 176 H LYS 24 H LYS 24 12.316 -10.662 -0.686 177 HA LYS 24 HA LYS 24 12.737 -11.336 -3.541 178 1HB LYS 24 1HB LYS 24 10.317 -11.103 -1.710 179 2HB LYS 24 2HB LYS 24 10.103 -11.272 -3.455 180 1HG LYS 24 1HG LYS 24 10.147 -13.519 -2.313 181 2HG LYS 24 2HG LYS 24 11.407 -13.337 -3.536 182 1HD LYS 24 1HD LYS 24 13.086 -12.740 -1.689 183 2HD LYS 24 2HD LYS 24 11.816 -12.981 -0.499 184 1HE LYS 24 1HE LYS 24 13.125 -14.993 -0.488 185 2HE LYS 24 2HE LYS 24 11.594 -15.422 -1.245 186 1HZ LYS 24 2HZ LYS 24 14.138 -14.830 -2.696 187 2HZ LYS 24 3HZ LYS 24 13.481 -16.327 -2.460 188 3HZ LYS 24 1HZ LYS 24 12.711 -15.230 -3.426 189 H ALA 25 H ALA 25 12.792 -8.393 -2.270 190 HA ALA 25 HA ALA 25 12.276 -7.128 -4.927 191 1HB ALA 25 2HB ALA 25 9.928 -7.212 -4.024 192 2HB ALA 25 3HB ALA 25 10.447 -6.340 -2.558 193 3HB ALA 25 1HB ALA 25 10.505 -5.532 -4.146 194 HA PRO 26 HA PRO 26 15.706 -5.468 -2.203 195 1HB PRO 26 1HB PRO 26 16.874 -5.682 -5.016 196 2HB PRO 26 2HB PRO 26 17.669 -6.050 -3.466 197 1HG PRO 26 1HG PRO 26 16.791 -8.110 -5.006 198 2HG PRO 26 2HG PRO 26 16.462 -8.154 -3.256 199 1HD PRO 26 1HD PRO 26 14.524 -7.348 -5.498 200 2HD PRO 26 2HD PRO 26 14.213 -8.379 -4.064 201 H VAL 27 H VAL 27 15.356 -4.755 -5.641 202 HA VAL 27 HA VAL 27 16.047 -1.961 -5.587 203 HB VAL 27 HB VAL 27 14.057 -3.387 -7.450 204 1HG1 VAL 27 3HG2 VAL 27 13.901 -0.883 -7.554 205 2HG1 VAL 27 1HG2 VAL 27 15.664 -0.770 -7.793 206 3HG1 VAL 27 2HG2 VAL 27 14.640 -1.530 -9.041 207 1HG2 VAL 27 2HG1 VAL 27 16.315 -4.489 -7.360 208 2HG2 VAL 27 3HG1 VAL 27 16.074 -3.672 -8.926 209 3HG2 VAL 27 1HG1 VAL 27 17.105 -2.923 -7.678 210 H SER 28 H SER 28 12.823 -3.375 -5.849 211 HA SER 28 HA SER 28 11.198 -1.085 -5.684 212 1HB SER 28 1HB SER 28 10.358 -3.439 -5.950 213 2HB SER 28 2HB SER 28 10.694 -3.759 -4.237 214 HG SER 28 HG SER 28 8.541 -3.138 -4.620 215 H VAL 29 H VAL 29 12.174 -3.069 -2.913 216 HA VAL 29 HA VAL 29 11.085 -1.452 -0.816 217 HB VAL 29 HB VAL 29 12.774 -2.561 0.636 218 1HG1 VAL 29 3HG2 VAL 29 10.673 -3.737 -0.060 219 2HG1 VAL 29 1HG2 VAL 29 11.495 -4.376 -1.506 220 3HG1 VAL 29 2HG2 VAL 29 12.012 -4.900 0.119 221 1HG2 VAL 29 2HG1 VAL 29 14.744 -2.482 -0.921 222 2HG2 VAL 29 3HG1 VAL 29 14.426 -4.156 -0.395 223 3HG2 VAL 29 1HG1 VAL 29 13.931 -3.622 -2.024 224 H GLN 30 H GLN 30 14.336 -1.391 -2.223 225 HA GLN 30 HA GLN 30 15.551 0.683 -0.689 226 1HB GLN 30 1HB GLN 30 16.651 -0.653 -2.537 227 2HB GLN 30 2HB GLN 30 15.801 0.317 -3.743 228 1HG GLN 30 1HG GLN 30 17.727 1.430 -1.599 229 2HG GLN 30 2HG GLN 30 18.175 1.095 -3.271 230 1HE2 GLN 30 2HE2 GLN 30 16.512 4.658 -2.440 231 2HE2 GLN 30 1HE2 GLN 30 17.139 3.462 -1.198 232 H ASN 31 H ASN 31 13.798 1.054 -3.733 233 HA ASN 31 HA ASN 31 13.652 3.859 -3.996 234 1HB ASN 31 1HB ASN 31 11.309 1.903 -4.433 235 2HB ASN 31 2HB ASN 31 11.434 3.530 -5.121 236 1HD2 ASN 31 1HD2 ASN 31 14.644 2.180 -6.822 237 2HD2 ASN 31 2HD2 ASN 31 14.411 3.199 -5.314 238 H PHE 32 H PHE 32 11.339 1.831 -2.246 239 HA PHE 32 HA PHE 32 9.603 3.770 -1.133 240 1HB PHE 32 1HB PHE 32 10.768 1.329 0.345 241 2HB PHE 32 2HB PHE 32 9.324 2.222 0.832 242 HD1 PHE 32 HD1 PHE 32 7.656 2.657 -1.249 243 HD2 PHE 32 HD2 PHE 32 10.347 -0.577 -0.939 244 HE1 PHE 32 HE1 PHE 32 6.281 1.363 -2.780 245 HE2 PHE 32 HE2 PHE 32 8.969 -1.867 -2.469 246 HZ PHE 32 HZ PHE 32 6.936 -0.898 -3.390 247 H VAL 33 H VAL 33 12.449 2.470 0.517 248 HA VAL 33 HA VAL 33 12.638 4.174 2.749 249 HB VAL 33 HB VAL 33 14.993 3.349 0.946 250 1HG1 VAL 33 3HG2 VAL 33 15.579 5.140 2.608 251 2HG1 VAL 33 1HG2 VAL 33 14.881 4.164 3.926 252 3HG1 VAL 33 2HG2 VAL 33 16.333 3.590 3.063 253 1HG2 VAL 33 1HG1 VAL 33 13.558 1.412 1.665 254 2HG2 VAL 33 2HG1 VAL 33 15.132 1.374 2.501 255 3HG2 VAL 33 3HG1 VAL 33 13.676 1.940 3.363 256 H ASP 34 H ASP 34 13.834 4.869 -0.495 257 HA ASP 34 HA ASP 34 14.861 7.524 -0.185 258 1HB ASP 34 1HB ASP 34 13.008 6.413 -2.389 259 2HB ASP 34 2HB ASP 34 13.886 7.942 -2.511 260 OH TYR 35 OH TYR 35 9.483 7.138 -6.248 261 H TYR 35 H TYR 35 11.568 6.599 -0.984 262 HA TYR 35 HA TYR 35 10.311 9.216 -0.586 263 1HB TYR 35 1HB TYR 35 9.080 6.409 -0.253 264 2HB TYR 35 2HB TYR 35 8.174 7.917 -0.410 265 HD1 TYR 35 HD2 TYR 35 8.809 9.393 -2.466 266 HD2 TYR 35 HD1 TYR 35 9.641 5.262 -2.211 267 HE1 TYR 35 HE2 TYR 35 8.969 9.273 -4.889 268 HE2 TYR 35 HE1 TYR 35 9.800 5.147 -4.635 269 HH TYR 35 HH TYR 35 9.684 6.235 -6.504 270 H VAL 36 H VAL 36 10.427 6.324 1.440 271 HA VAL 36 HA VAL 36 9.210 7.241 3.843 272 HB VAL 36 HB VAL 36 11.771 5.556 3.601 273 1HG1 VAL 36 3HG2 VAL 36 11.346 6.406 5.926 274 2HG1 VAL 36 1HG2 VAL 36 9.677 5.782 5.864 275 3HG1 VAL 36 2HG2 VAL 36 11.055 4.649 5.839 276 1HG2 VAL 36 2HG1 VAL 36 9.856 4.661 2.237 277 2HG2 VAL 36 3HG1 VAL 36 10.169 3.610 3.644 278 3HG2 VAL 36 1HG1 VAL 36 8.788 4.740 3.662 279 H ASN 37 H ASN 37 12.686 7.200 3.240 280 HA ASN 37 HA ASN 37 13.602 8.856 5.371 281 1HB ASN 37 1HB ASN 37 15.117 7.701 3.741 282 2HB ASN 37 2HB ASN 37 14.646 8.834 2.469 283 1HD2 ASN 37 1HD2 ASN 37 16.524 11.593 3.851 284 2HD2 ASN 37 2HD2 ASN 37 15.079 11.116 2.826 285 H SER 38 H SER 38 12.517 9.806 2.160 286 HA SER 38 HA SER 38 12.887 12.674 2.349 287 1HB SER 38 1HB SER 38 10.642 11.131 0.907 288 2HB SER 38 2HB SER 38 11.093 12.819 0.598 289 HG SER 38 HG SER 38 12.097 11.359 -0.825 290 H GLY 39 H GLY 39 9.670 12.158 1.786 291 1HA GLY 39 1HA GLY 39 8.468 12.341 4.472 292 2HA GLY 39 2HA GLY 39 8.654 13.978 3.809 293 H PHE 40 H PHE 40 7.953 10.871 2.305 294 HA PHE 40 HA PHE 40 5.785 11.946 0.568 295 1HB PHE 40 1HB PHE 40 7.218 10.062 -0.156 296 2HB PHE 40 2HB PHE 40 6.730 9.091 1.231 297 HD1 PHE 40 HD2 PHE 40 4.318 8.417 1.450 298 HD2 PHE 40 HD1 PHE 40 5.838 10.115 -2.100 299 HE1 PHE 40 HE2 PHE 40 2.461 7.470 0.201 300 HE2 PHE 40 HE1 PHE 40 3.979 9.167 -3.346 301 HZ PHE 40 HZ PHE 40 2.299 7.828 -2.200 302 OH TYR 41 OH TYR 41 6.392 4.601 0.687 303 H TYR 41 H TYR 41 5.836 9.382 2.973 304 HA TYR 41 HA TYR 41 2.948 9.158 3.184 305 1HB TYR 41 1HB TYR 41 5.005 8.262 5.279 306 2HB TYR 41 2HB TYR 41 3.394 7.594 5.017 307 HD1 TYR 41 HD1 TYR 41 2.961 6.212 3.030 308 HD2 TYR 41 HD2 TYR 41 6.795 7.838 3.719 309 HE1 TYR 41 HE1 TYR 41 3.904 4.710 1.362 310 HE2 TYR 41 HE2 TYR 41 7.732 6.335 2.053 311 HH TYR 41 HH TYR 41 5.688 4.060 0.323 312 H ASN 42 H ASN 42 5.187 11.207 4.829 313 HA ASN 42 HA ASN 42 4.306 11.541 7.395 314 1HB ASN 42 1HB ASN 42 4.781 13.939 5.514 315 2HB ASN 42 2HB ASN 42 4.872 13.986 7.278 316 1HD2 ASN 42 1HD2 ASN 42 7.916 11.962 7.403 317 2HD2 ASN 42 2HD2 ASN 42 6.288 12.175 8.223 318 H ASN 43 H ASN 43 2.587 12.844 4.616 319 HA ASN 43 HA ASN 43 0.019 12.886 6.196 320 1HB ASN 43 1HB ASN 43 0.932 15.093 6.782 321 2HB ASN 43 2HB ASN 43 1.232 15.483 5.075 322 1HD2 ASN 43 1HD2 ASN 43 -1.991 17.038 5.232 323 2HD2 ASN 43 2HD2 ASN 43 -0.170 17.246 5.144 324 H THR 44 H THR 44 0.679 11.252 4.346 325 HA THR 44 HA THR 44 -0.927 11.949 1.841 326 HB THR 44 HB THR 44 -0.747 9.500 1.378 327 HG1 THR 44 HG1 THR 44 -0.592 8.872 3.559 328 1HG2 THR 44 2HG2 THR 44 1.018 11.095 0.549 329 2HG2 THR 44 3HG2 THR 44 1.929 10.888 2.068 330 3HG2 THR 44 1HG2 THR 44 1.734 9.511 0.950 331 H THR 45 H THR 45 -2.163 9.254 2.135 332 HA THR 45 HA THR 45 -3.847 9.294 4.575 333 HB THR 45 HB THR 45 -6.029 9.709 3.389 334 HG1 THR 45 HG1 THR 45 -5.870 10.773 1.385 335 1HG2 THR 45 2HG2 THR 45 -4.911 11.545 4.695 336 2HG2 THR 45 3HG2 THR 45 -4.006 12.038 3.238 337 3HG2 THR 45 1HG2 THR 45 -5.782 12.204 3.285 338 H PHE 46 H PHE 46 -6.106 8.397 2.916 339 HA PHE 46 HA PHE 46 -5.303 5.727 1.775 340 1HB PHE 46 1HB PHE 46 -6.691 5.998 4.515 341 2HB PHE 46 2HB PHE 46 -6.882 4.562 3.517 342 HD1 PHE 46 HD1 PHE 46 -4.964 3.152 2.970 343 HD2 PHE 46 HD2 PHE 46 -4.511 6.473 5.533 344 HE1 PHE 46 HE1 PHE 46 -2.834 2.270 3.739 345 HE2 PHE 46 HE2 PHE 46 -2.382 5.585 6.299 346 HZ PHE 46 HZ PHE 46 -1.543 3.485 5.404 347 H HIS 47 H HIS 47 -6.212 7.359 0.282 348 HA HIS 47 HA HIS 47 -9.080 7.942 0.173 349 1HB HIS 47 1HB HIS 47 -8.677 8.311 -2.276 350 2HB HIS 47 2HB HIS 47 -7.493 9.141 -1.262 351 HD2 HIS 47 HD2 HIS 47 -7.208 7.842 -4.394 352 HE1 HIS 47 HE1 HIS 47 -4.058 5.791 -2.607 353 HE2 HIS 47 HE2 HIS 47 -4.988 6.470 -4.908 354 NH1 ARG 48 NH2 ARG 48 -4.638 3.251 -7.520 355 NH2 ARG 48 NH1 ARG 48 -5.392 5.223 -8.363 356 H ARG 48 H ARG 48 -7.152 5.547 -1.593 357 HA ARG 48 HA ARG 48 -9.502 4.011 -2.553 358 1HB ARG 48 1HB ARG 48 -6.537 3.225 -2.349 359 2HB ARG 48 2HB ARG 48 -7.784 2.310 -3.215 360 1HG ARG 48 1HG ARG 48 -8.298 4.362 -4.615 361 2HG ARG 48 2HG ARG 48 -7.015 5.245 -3.782 362 1HD ARG 48 1HD ARG 48 -5.299 3.581 -4.647 363 2HD ARG 48 2HD ARG 48 -6.588 2.677 -5.464 364 HE ARG 48 HE ARG 48 -6.693 5.468 -6.360 365 1HH1 ARG 48 2HH2 ARG 48 -4.658 2.577 -6.747 366 2HH1 ARG 48 1HH2 ARG 48 -4.095 3.176 -8.387 367 1HH2 ARG 48 1HH1 ARG 48 -5.985 6.051 -8.236 368 2HH2 ARG 48 2HH1 ARG 48 -4.797 5.011 -9.172 369 H VAL 49 H VAL 49 -10.727 2.938 -1.368 370 HA VAL 49 HA VAL 49 -9.688 0.931 0.665 371 HB VAL 49 HB VAL 49 -11.658 3.177 1.393 372 1HG1 VAL 49 3HG2 VAL 49 -12.187 0.970 2.470 373 2HG1 VAL 49 1HG2 VAL 49 -10.505 0.832 3.043 374 3HG1 VAL 49 2HG2 VAL 49 -11.560 2.124 3.676 375 1HG2 VAL 49 2HG1 VAL 49 -9.270 3.956 1.269 376 2HG2 VAL 49 3HG1 VAL 49 -9.826 3.898 2.962 377 3HG2 VAL 49 1HG1 VAL 49 -8.765 2.613 2.327 378 H ILE 50 H ILE 50 -11.004 -0.600 1.219 379 HA ILE 50 HA ILE 50 -13.824 -0.826 0.194 380 HB ILE 50 HB ILE 50 -12.407 -1.296 -1.818 381 1HG1 ILE 50 1HG1 ILE 50 -14.643 -2.415 -1.447 382 2HG1 ILE 50 2HG1 ILE 50 -13.541 -3.308 -2.499 383 1HG2 ILE 50 2HG2 ILE 50 -10.398 -2.205 -0.617 384 2HG2 ILE 50 3HG2 ILE 50 -11.331 -3.639 -0.117 385 3HG2 ILE 50 1HG2 ILE 50 -10.976 -3.363 -1.844 386 1HD1 ILE 50 2HD1 ILE 50 -12.879 -4.809 -0.572 387 2HD1 ILE 50 3HD1 ILE 50 -14.006 -3.929 0.494 388 3HD1 ILE 50 1HD1 ILE 50 -14.633 -4.871 -0.883 389 HA PRO 51 HA PRO 51 -14.207 -2.715 4.108 390 1HB PRO 51 1HB PRO 51 -16.323 -4.103 2.376 391 2HB PRO 51 2HB PRO 51 -16.508 -3.479 4.034 392 1HG PRO 51 1HG PRO 51 -17.410 -1.951 1.984 393 2HG PRO 51 2HG PRO 51 -16.444 -1.166 3.257 394 1HD PRO 51 1HD PRO 51 -15.529 -1.990 0.457 395 2HD PRO 51 2HD PRO 51 -15.084 -0.532 1.402 396 H GLY 52 H GLY 52 -14.199 -4.710 5.078 397 1HA GLY 52 1HA GLY 52 -12.294 -6.456 5.142 398 2HA GLY 52 2HA GLY 52 -13.875 -7.222 4.981 399 H PHE 53 H PHE 53 -11.363 -5.726 3.016 400 HA PHE 53 HA PHE 53 -11.034 -8.184 1.314 401 1HB PHE 53 1HB PHE 53 -13.048 -7.056 0.294 402 2HB PHE 53 2HB PHE 53 -12.115 -5.567 0.089 403 HD1 PHE 53 HD2 PHE 53 -10.174 -8.566 -0.235 404 HD2 PHE 53 HD1 PHE 53 -12.693 -5.938 -2.366 405 HE1 PHE 53 HE2 PHE 53 -9.305 -9.431 -2.334 406 HE2 PHE 53 HE1 PHE 53 -11.822 -6.806 -4.463 407 HZ PHE 53 HZ PHE 53 -10.128 -8.552 -4.448 408 H MET 54 H MET 54 -10.550 -4.681 1.196 409 HA MET 54 HA MET 54 -7.538 -4.941 1.202 410 1HB MET 54 1HB MET 54 -9.060 -4.009 -1.307 411 2HB MET 54 2HB MET 54 -7.302 -4.078 -1.117 412 1HG MET 54 1HG MET 54 -7.401 -6.562 -0.804 413 2HG MET 54 2HG MET 54 -9.173 -6.528 -0.880 414 1HE MET 54 2HE MET 54 -10.600 -5.908 -3.035 415 2HE MET 54 1HE MET 54 -9.792 -4.313 -3.155 416 3HE MET 54 3HE MET 54 -9.889 -5.377 -4.587 417 H ILE 55 H ILE 55 -6.443 -3.107 1.100 418 HA ILE 55 HA ILE 55 -7.660 -0.407 0.917 419 HB ILE 55 HB ILE 55 -7.129 0.372 3.184 420 1HG1 ILE 55 1HG1 ILE 55 -6.425 -2.565 3.780 421 2HG1 ILE 55 2HG1 ILE 55 -5.249 -1.259 3.586 422 1HG2 ILE 55 2HG2 ILE 55 -9.432 -0.527 2.751 423 2HG2 ILE 55 3HG2 ILE 55 -8.898 -2.160 3.225 424 3HG2 ILE 55 1HG2 ILE 55 -8.938 -0.848 4.434 425 1HD1 ILE 55 2HD1 ILE 55 -6.287 -0.009 5.531 426 2HD1 ILE 55 3HD1 ILE 55 -7.479 -1.320 5.735 427 3HD1 ILE 55 1HD1 ILE 55 -5.746 -1.634 6.023 428 H GLN 56 H GLN 56 -6.210 1.134 0.633 429 HA GLN 56 HA GLN 56 -3.244 0.331 0.394 430 1HB GLN 56 1HB GLN 56 -4.975 1.506 -1.848 431 2HB GLN 56 2HB GLN 56 -3.325 0.892 -1.990 432 1HG GLN 56 1HG GLN 56 -4.158 -1.424 -1.419 433 2HG GLN 56 2HG GLN 56 -5.797 -0.798 -1.221 434 1HE2 GLN 56 2HE2 GLN 56 -5.969 0.055 -4.863 435 2HE2 GLN 56 1HE2 GLN 56 -6.077 0.950 -3.265 436 H GLY 57 H GLY 57 -1.883 1.997 -0.373 437 1HA GLY 57 1HA GLY 57 -2.819 4.865 -0.302 438 2HA GLY 57 2HA GLY 57 -1.811 4.416 1.080 439 H GLY 58 H GLY 58 -0.466 6.001 0.376 440 1HA GLY 58 1HA GLY 58 1.579 6.781 -0.611 441 2HA GLY 58 2HA GLY 58 1.858 5.148 -1.235 442 H GLY 59 H GLY 59 0.076 8.127 -1.687 443 1HA GLY 59 1HA GLY 59 0.645 8.414 -4.526 444 2HA GLY 59 2HA GLY 59 -0.953 7.653 -4.405 445 H PHE 60 H PHE 60 -2.304 9.093 -4.897 446 HA PHE 60 HA PHE 60 -2.233 11.910 -4.810 447 1HB PHE 60 1HB PHE 60 -4.725 10.255 -4.075 448 2HB PHE 60 2HB PHE 60 -4.708 11.892 -4.731 449 HD1 PHE 60 HD1 PHE 60 -4.018 12.259 -7.076 450 HD2 PHE 60 HD2 PHE 60 -4.242 8.360 -5.483 451 HE1 PHE 60 HE1 PHE 60 -3.969 11.334 -9.323 452 HE2 PHE 60 HE2 PHE 60 -4.193 7.438 -7.729 453 HZ PHE 60 HZ PHE 60 -4.056 8.925 -9.653 454 H THR 61 H THR 61 -2.100 13.376 -3.367 455 HA THR 61 HA THR 61 -1.812 12.900 -0.498 456 HB THR 61 HB THR 61 -2.005 15.368 -0.273 457 HG1 THR 61 HG1 THR 61 -3.673 15.595 -1.797 458 1HG2 THR 61 3HG2 THR 61 -0.440 14.485 -2.790 459 2HG2 THR 61 1HG2 THR 61 -0.141 15.973 -1.852 460 3HG2 THR 61 2HG2 THR 61 0.154 14.377 -1.112 461 H GLU 62 H GLU 62 -3.423 15.140 0.329 462 HA GLU 62 HA GLU 62 -5.785 13.748 1.343 463 1HB GLU 62 1HB GLU 62 -6.521 15.874 2.197 464 2HB GLU 62 2HB GLU 62 -4.772 15.809 2.404 465 1HG GLU 62 1HG GLU 62 -6.278 17.229 0.103 466 2HG GLU 62 2HG GLU 62 -5.608 18.038 1.515 467 H GLN 63 H GLN 63 -6.186 16.763 -0.294 468 HA GLN 63 HA GLN 63 -8.657 15.878 -1.683 469 1HB GLN 63 1HB GLN 63 -7.019 18.462 -2.012 470 2HB GLN 63 2HB GLN 63 -8.666 18.193 -2.600 471 1HG GLN 63 1HG GLN 63 -9.444 17.756 -0.234 472 2HG GLN 63 2HG GLN 63 -7.799 18.019 0.356 473 1HE2 GLN 63 2HE2 GLN 63 -9.726 21.319 -1.294 474 2HE2 GLN 63 1HE2 GLN 63 -9.880 19.651 -2.043 475 H MET 64 H MET 64 -6.872 14.135 -2.422 476 HA MET 64 HA MET 64 -5.677 13.181 -4.285 477 1HB MET 64 1HB MET 64 -8.070 14.572 -5.616 478 2HB MET 64 2HB MET 64 -7.108 13.289 -6.368 479 1HG MET 64 1HG MET 64 -7.648 11.748 -4.434 480 2HG MET 64 2HG MET 64 -8.696 13.005 -3.737 481 1HE MET 64 2HE MET 64 -10.553 10.891 -3.876 482 2HE MET 64 1HE MET 64 -11.075 10.182 -5.433 483 3HE MET 64 3HE MET 64 -9.424 9.870 -4.822 484 H GLN 65 H GLN 65 -4.720 15.737 -3.522 485 HA GLN 65 HA GLN 65 -3.917 17.212 -6.017 486 1HB GLN 65 1HB GLN 65 -4.030 18.378 -3.806 487 2HB GLN 65 2HB GLN 65 -2.754 17.332 -3.169 488 1HG GLN 65 1HG GLN 65 -1.784 19.486 -3.955 489 2HG GLN 65 2HG GLN 65 -1.166 18.142 -4.922 490 1HE2 GLN 65 2HE2 GLN 65 -2.011 20.199 -7.721 491 2HE2 GLN 65 1HE2 GLN 65 -0.700 19.473 -6.662 492 H GLN 66 H GLN 66 -3.039 15.951 -7.364 493 HA GLN 66 HA GLN 66 -1.780 13.593 -7.355 494 1HB GLN 66 1HB GLN 66 -0.478 15.975 -8.813 495 2HB GLN 66 2HB GLN 66 -0.271 14.268 -9.232 496 1HG GLN 66 1HG GLN 66 -2.763 14.056 -9.605 497 2HG GLN 66 2HG GLN 66 -2.971 15.763 -9.198 498 1HE2 GLN 66 2HE2 GLN 66 -2.459 15.078 -13.000 499 2HE2 GLN 66 1HE2 GLN 66 -3.320 14.090 -11.716 500 H LYS 67 H LYS 67 -0.118 12.530 -6.924 501 HA LYS 67 HA LYS 67 1.459 13.012 -4.595 502 1HB LYS 67 1HB LYS 67 2.375 11.406 -7.042 503 2HB LYS 67 2HB LYS 67 2.854 11.136 -5.359 504 1HG LYS 67 1HG LYS 67 0.457 10.608 -4.760 505 2HG LYS 67 2HG LYS 67 -0.039 10.952 -6.417 506 1HD LYS 67 1HD LYS 67 1.467 9.034 -7.236 507 2HD LYS 67 2HD LYS 67 1.894 8.701 -5.565 508 1HE LYS 67 1HE LYS 67 0.220 7.088 -6.160 509 2HE LYS 67 2HE LYS 67 -0.562 8.205 -5.044 510 1HZ LYS 67 3HZ LYS 67 -0.829 8.259 -8.019 511 2HZ LYS 67 1HZ LYS 67 -1.967 7.714 -6.952 512 3HZ LYS 67 2HZ LYS 67 -1.570 9.317 -6.989 513 H LYS 68 H LYS 68 3.802 12.073 -6.321 514 HA LYS 68 HA LYS 68 5.021 14.317 -7.732 515 1HB LYS 68 1HB LYS 68 5.851 14.018 -4.777 516 2HB LYS 68 2HB LYS 68 6.669 15.039 -5.971 517 1HG LYS 68 1HG LYS 68 4.518 16.319 -6.346 518 2HG LYS 68 2HG LYS 68 3.705 15.306 -5.151 519 1HD LYS 68 1HD LYS 68 5.308 16.126 -3.362 520 2HD LYS 68 2HD LYS 68 6.126 17.138 -4.558 521 1HE LYS 68 1HE LYS 68 3.969 18.431 -4.943 522 2HE LYS 68 2HE LYS 68 3.148 17.418 -3.746 523 1HZ LYS 68 3HZ LYS 68 5.493 19.171 -3.186 524 2HZ LYS 68 1HZ LYS 68 3.926 19.487 -2.772 525 3HZ LYS 68 2HZ LYS 68 4.728 18.226 -2.068 526 HA PRO 69 HA PRO 69 6.647 10.051 -8.041 527 1HB PRO 69 1HB PRO 69 6.847 10.109 -10.812 528 2HB PRO 69 2HB PRO 69 5.320 9.866 -9.935 529 1HG PRO 69 1HG PRO 69 6.411 12.492 -11.080 530 2HG PRO 69 2HG PRO 69 4.786 11.801 -11.315 531 1HD PRO 69 1HD PRO 69 5.237 13.735 -9.397 532 2HD PRO 69 2HD PRO 69 4.119 12.377 -9.040 533 H ASN 70 H ASN 70 8.341 9.347 -9.821 534 HA ASN 70 HA ASN 70 10.826 11.028 -9.962 535 1HB ASN 70 1HB ASN 70 10.587 8.701 -7.939 536 2HB ASN 70 2HB ASN 70 12.103 9.492 -8.386 537 1HD2 ASN 70 1HD2 ASN 70 10.905 11.183 -5.293 538 2HD2 ASN 70 2HD2 ASN 70 11.431 9.505 -5.814 539 HA PRO 71 HA PRO 71 12.351 8.028 -12.961 540 1HB PRO 71 1HB PRO 71 14.746 7.191 -11.767 541 2HB PRO 71 2HB PRO 71 14.539 8.744 -12.611 542 1HG PRO 71 1HG PRO 71 14.345 8.222 -9.600 543 2HG PRO 71 2HG PRO 71 15.275 9.498 -10.424 544 1HD PRO 71 1HD PRO 71 12.806 10.057 -9.358 545 2HD PRO 71 2HD PRO 71 13.242 10.754 -10.951 546 HA PRO 72 HA PRO 72 9.791 4.981 -10.942 547 1HB PRO 72 1HB PRO 72 10.453 3.841 -13.710 548 2HB PRO 72 2HB PRO 72 8.878 3.842 -12.877 549 1HG PRO 72 1HG PRO 72 9.327 5.733 -14.765 550 2HG PRO 72 2HG PRO 72 8.611 6.244 -13.216 551 1HD PRO 72 1HD PRO 72 11.516 6.561 -14.127 552 2HD PRO 72 2HD PRO 72 10.500 7.704 -13.190 553 H ILE 73 H ILE 73 10.179 2.355 -12.077 554 HA ILE 73 HA ILE 73 12.881 1.367 -11.150 555 HB ILE 73 HB ILE 73 11.915 0.033 -9.294 556 1HG1 ILE 73 1HG1 ILE 73 9.370 1.660 -9.900 557 2HG1 ILE 73 2HG1 ILE 73 9.564 -0.080 -10.144 558 1HG2 ILE 73 2HG2 ILE 73 12.960 2.270 -8.846 559 2HG2 ILE 73 3HG2 ILE 73 11.385 3.069 -9.089 560 3HG2 ILE 73 1HG2 ILE 73 11.620 1.963 -7.709 561 1HD1 ILE 73 3HD1 ILE 73 9.776 1.364 -7.410 562 2HD1 ILE 73 1HD1 ILE 73 8.393 0.384 -7.964 563 3HD1 ILE 73 2HD1 ILE 73 9.969 -0.392 -7.656 564 H LYS 74 H LYS 74 10.993 -1.029 -10.439 565 HA LYS 74 HA LYS 74 10.398 -2.046 -13.266 566 1HB LYS 74 1HB LYS 74 12.217 -3.488 -11.251 567 2HB LYS 74 2HB LYS 74 11.667 -4.127 -12.810 568 1HG LYS 74 1HG LYS 74 12.763 -2.153 -13.990 569 2HG LYS 74 2HG LYS 74 13.275 -1.524 -12.434 570 1HD LYS 74 1HD LYS 74 15.201 -2.561 -13.382 571 2HD LYS 74 2HD LYS 74 14.698 -3.601 -12.056 572 1HE LYS 74 1HE LYS 74 13.605 -5.190 -13.734 573 2HE LYS 74 2HE LYS 74 14.081 -4.115 -15.056 574 1HZ LYS 74 2HZ LYS 74 16.414 -4.492 -14.439 575 2HZ LYS 74 3HZ LYS 74 15.967 -5.493 -13.203 576 3HZ LYS 74 1HZ LYS 74 15.656 -5.923 -14.768 577 H ASN 75 H ASN 75 8.822 -3.214 -13.446 578 HA ASN 75 HA ASN 75 6.810 -3.504 -11.352 579 1HB ASN 75 1HB ASN 75 6.382 -3.454 -13.853 580 2HB ASN 75 2HB ASN 75 7.048 -5.086 -13.983 581 1HD2 ASN 75 1HD2 ASN 75 3.636 -4.758 -11.636 582 2HD2 ASN 75 2HD2 ASN 75 5.058 -3.617 -11.432 583 H GLU 76 H GLU 76 5.770 -5.548 -10.859 584 HA GLU 76 HA GLU 76 7.141 -8.107 -10.778 585 1HB GLU 76 1HB GLU 76 7.989 -8.245 -8.531 586 2HB GLU 76 2HB GLU 76 8.731 -6.830 -9.276 587 1HG GLU 76 1HG GLU 76 6.277 -6.819 -7.390 588 2HG GLU 76 2HG GLU 76 7.920 -6.413 -6.907 589 H ALA 77 H ALA 77 6.265 -9.610 -9.272 590 HA ALA 77 HA ALA 77 3.816 -9.251 -7.756 591 1HB ALA 77 2HB ALA 77 2.855 -8.471 -9.950 592 2HB ALA 77 3HB ALA 77 3.322 -10.013 -10.716 593 3HB ALA 77 1HB ALA 77 2.092 -9.993 -9.427 594 H ASP 78 H ASP 78 5.657 -11.268 -9.952 595 HA ASP 78 HA ASP 78 4.490 -13.848 -9.191 596 1HB ASP 78 1HB ASP 78 6.499 -14.839 -10.250 597 2HB ASP 78 2HB ASP 78 5.775 -13.580 -11.260 598 H ASN 79 H ASN 79 7.364 -12.080 -8.118 599 HA ASN 79 HA ASN 79 8.860 -12.530 -6.286 600 1HB ASN 79 1HB ASN 79 7.609 -12.470 -4.104 601 2HB ASN 79 2HB ASN 79 7.117 -11.215 -5.246 602 1HD2 ASN 79 1HD2 ASN 79 3.975 -12.679 -3.896 603 2HD2 ASN 79 2HD2 ASN 79 5.434 -11.754 -3.277 604 H GLY 80 H GLY 80 6.574 -14.482 -4.638 605 1HA GLY 80 1HA GLY 80 7.149 -17.153 -5.539 606 2HA GLY 80 2HA GLY 80 8.468 -16.764 -4.411 607 H LEU 81 H LEU 81 7.776 -15.722 -2.387 608 HA LEU 81 HA LEU 81 6.386 -17.464 -0.694 609 1HB LEU 81 1HB LEU 81 5.916 -15.523 0.836 610 2HB LEU 81 2HB LEU 81 7.589 -15.686 0.326 611 HG LEU 81 HG LEU 81 6.700 -13.320 0.360 612 1HD1 LEU 81 2HD1 LEU 81 8.729 -13.923 -0.971 613 2HD1 LEU 81 3HD1 LEU 81 7.708 -14.294 -2.384 614 3HD1 LEU 81 1HD1 LEU 81 7.798 -12.627 -1.762 615 1HD2 LEU 81 3HD2 LEU 81 4.402 -13.774 -0.547 616 2HD2 LEU 81 1HD2 LEU 81 5.251 -12.540 -1.514 617 3HD2 LEU 81 2HD2 LEU 81 5.107 -14.207 -2.128 618 NH1 ARG 82 NH2 ARG 82 1.828 -18.512 6.202 619 NH2 ARG 82 NH1 ARG 82 2.946 -16.616 6.770 620 H ARG 82 H ARG 82 4.468 -17.386 0.418 621 HA ARG 82 HA ARG 82 2.195 -17.764 -1.320 622 1HB ARG 82 1HB ARG 82 0.870 -17.913 0.804 623 2HB ARG 82 2HB ARG 82 2.365 -18.863 0.841 624 1HG ARG 82 1HG ARG 82 3.542 -16.940 2.004 625 2HG ARG 82 2HG ARG 82 2.027 -16.032 2.023 626 1HD ARG 82 1HD ARG 82 0.951 -17.841 3.445 627 2HD ARG 82 2HD ARG 82 2.456 -18.777 3.397 628 HE ARG 82 HE ARG 82 3.056 -16.097 4.428 629 1HH1 ARG 82 2HH2 ARG 82 1.439 -19.095 5.453 630 2HH1 ARG 82 1HH2 ARG 82 1.799 -18.705 7.209 631 1HH2 ARG 82 1HH1 ARG 82 3.410 -15.756 6.459 632 2HH2 ARG 82 2HH1 ARG 82 2.839 -16.941 7.738 633 H ASN 83 H ASN 83 0.391 -16.448 0.687 634 HA ASN 83 HA ASN 83 0.331 -13.573 0.438 635 1HB ASN 83 1HB ASN 83 0.476 -14.009 -2.035 636 2HB ASN 83 2HB ASN 83 -0.976 -15.019 -1.956 637 1HD2 ASN 83 1HD2 ASN 83 -1.752 -11.126 -0.827 638 2HD2 ASN 83 2HD2 ASN 83 -0.488 -12.158 0.011 639 H THR 84 H THR 84 -1.139 -12.902 1.673 640 HA THR 84 HA THR 84 -3.906 -14.061 1.889 641 HB THR 84 HB THR 84 -1.697 -14.449 3.991 642 HG1 THR 84 HG1 THR 84 -3.566 -16.170 2.724 643 1HG2 THR 84 3HG2 THR 84 -4.748 -14.774 4.301 644 2HG2 THR 84 1HG2 THR 84 -3.523 -15.271 5.512 645 3HG2 THR 84 2HG2 THR 84 -3.737 -13.547 5.105 646 NH1 ARG 85 NH2 ARG 85 -9.789 -14.136 7.983 647 NH2 ARG 85 NH1 ARG 85 -8.252 -15.635 8.732 648 H ARG 85 H ARG 85 -5.255 -12.937 3.061 649 HA ARG 85 HA ARG 85 -5.142 -10.131 3.483 650 1HB ARG 85 1HB ARG 85 -6.861 -10.455 5.243 651 2HB ARG 85 2HB ARG 85 -7.185 -11.543 3.880 652 1HG ARG 85 1HG ARG 85 -5.978 -13.408 5.077 653 2HG ARG 85 2HG ARG 85 -5.617 -12.323 6.422 654 1HD ARG 85 1HD ARG 85 -8.106 -12.046 6.873 655 2HD ARG 85 2HD ARG 85 -8.468 -13.148 5.529 656 HE ARG 85 HE ARG 85 -6.648 -14.549 7.315 657 1HH1 ARG 85 2HH2 ARG 85 -9.989 -13.331 7.380 658 2HH1 ARG 85 1HH2 ARG 85 -10.450 -14.622 8.600 659 1HH2 ARG 85 1HH1 ARG 85 -7.284 -15.974 8.702 660 2HH2 ARG 85 2HH1 ARG 85 -9.020 -16.017 9.296 661 H GLY 86 H GLY 86 -4.056 -8.916 4.481 662 1HA GLY 86 1HA GLY 86 -2.971 -8.110 6.706 663 2HA GLY 86 2HA GLY 86 -2.320 -9.737 6.907 664 H THR 87 H THR 87 -2.001 -9.862 3.893 665 HA THR 87 HA THR 87 0.848 -8.806 3.846 666 HB THR 87 HB THR 87 0.854 -9.795 1.513 667 HG1 THR 87 HG1 THR 87 -1.613 -10.834 2.460 668 1HG2 THR 87 2HG2 THR 87 1.777 -10.982 3.509 669 2HG2 THR 87 3HG2 THR 87 0.165 -11.655 3.876 670 3HG2 THR 87 1HG2 THR 87 1.022 -12.139 2.383 671 H ILE 88 H ILE 88 1.504 -7.215 2.989 672 HA ILE 88 HA ILE 88 -0.185 -5.384 1.200 673 HB ILE 88 HB ILE 88 0.718 -3.857 2.548 674 1HG1 ILE 88 1HG1 ILE 88 3.132 -3.139 1.774 675 2HG1 ILE 88 2HG1 ILE 88 3.017 -4.486 0.682 676 1HG2 ILE 88 2HG2 ILE 88 1.800 -5.472 4.149 677 2HG2 ILE 88 3HG2 ILE 88 3.214 -5.586 3.067 678 3HG2 ILE 88 1HG2 ILE 88 2.832 -4.043 3.872 679 1HD1 ILE 88 2HD1 ILE 88 0.827 -3.373 -0.250 680 2HD1 ILE 88 3HD1 ILE 88 1.041 -2.073 0.948 681 3HD1 ILE 88 1HD1 ILE 88 2.227 -2.263 -0.365 682 H ALA 89 H ALA 89 0.821 -4.558 -0.597 683 HA ALA 89 HA ALA 89 2.939 -6.086 -2.048 684 1HB ALA 89 2HB ALA 89 1.064 -7.762 -2.182 685 2HB ALA 89 3HB ALA 89 0.014 -6.537 -2.943 686 3HB ALA 89 1HB ALA 89 1.470 -7.118 -3.792 687 H MET 90 H MET 90 3.684 -5.184 -3.716 688 HA MET 90 HA MET 90 3.198 -2.324 -4.118 689 1HB MET 90 1HB MET 90 5.385 -3.713 -4.494 690 2HB MET 90 2HB MET 90 4.740 -4.048 -6.107 691 1HG MET 90 1HG MET 90 5.211 -1.284 -4.816 692 2HG MET 90 2HG MET 90 6.159 -1.988 -6.143 693 1HE MET 90 3HE MET 90 5.469 0.656 -7.070 694 2HE MET 90 2HE MET 90 3.788 1.073 -7.521 695 3HE MET 90 1HE MET 90 4.230 0.894 -5.799 696 H ALA 91 H ALA 91 1.790 -1.358 -5.181 697 HA ALA 91 HA ALA 91 0.012 -2.690 -7.248 698 1HB ALA 91 2HB ALA 91 -0.977 -1.099 -5.584 699 2HB ALA 91 3HB ALA 91 0.074 0.209 -6.189 700 3HB ALA 91 1HB ALA 91 -1.176 -0.495 -7.247 701 NH1 ARG 92 NH2 ARG 92 0.346 -3.095 -15.178 702 NH2 ARG 92 NH1 ARG 92 -1.542 -4.292 -14.771 703 H ARG 92 H ARG 92 -0.492 -0.702 -8.916 704 HA ARG 92 HA ARG 92 1.689 0.786 -10.065 705 1HB ARG 92 1HB ARG 92 2.428 -0.563 -11.953 706 2HB ARG 92 2HB ARG 92 2.669 -1.501 -10.475 707 1HG ARG 92 1HG ARG 92 1.650 -2.920 -12.240 708 2HG ARG 92 2HG ARG 92 0.550 -2.755 -10.866 709 1HD ARG 92 1HD ARG 92 -0.746 -0.967 -12.076 710 2HD ARG 92 2HD ARG 92 0.359 -1.027 -13.440 711 HE ARG 92 HE ARG 92 -1.769 -3.060 -12.727 712 1HH1 ARG 92 2HH2 ARG 92 0.995 -2.367 -14.858 713 2HH1 ARG 92 1HH2 ARG 92 0.413 -3.640 -16.044 714 1HH2 ARG 92 1HH1 ARG 92 -2.334 -4.479 -14.146 715 2HH2 ARG 92 2HH1 ARG 92 -1.343 -4.753 -15.666 716 H THR 93 H THR 93 1.102 0.123 -12.824 717 HA THR 93 HA THR 93 -1.794 0.459 -13.342 718 HB THR 93 HB THR 93 -0.042 2.956 -13.736 719 HG1 THR 93 HG1 THR 93 -1.419 3.795 -12.137 720 1HG2 THR 93 1HG2 THR 93 -3.071 2.448 -14.118 721 2HG2 THR 93 2HG2 THR 93 -2.249 4.017 -14.335 722 3HG2 THR 93 3HG2 THR 93 -1.889 2.660 -15.435 723 H ALA 94 H ALA 94 0.027 2.484 -15.259 724 HA ALA 94 HA ALA 94 -0.508 0.852 -17.631 725 1HB ALA 94 2HB ALA 94 -0.512 3.345 -17.679 726 2HB ALA 94 3HB ALA 94 1.242 3.375 -17.357 727 3HB ALA 94 1HB ALA 94 0.626 2.690 -18.883 728 H ASP 95 H ASP 95 2.626 2.289 -17.446 729 HA ASP 95 HA ASP 95 4.039 0.324 -18.851 730 1HB ASP 95 1HB ASP 95 5.142 1.917 -16.460 731 2HB ASP 95 2HB ASP 95 6.126 1.115 -17.697 732 H LYS 96 H LYS 96 4.203 -1.673 -18.638 733 HA LYS 96 HA LYS 96 3.821 -3.204 -16.119 734 1HB LYS 96 1HB LYS 96 5.036 -4.070 -18.802 735 2HB LYS 96 2HB LYS 96 4.469 -5.153 -17.521 736 1HG LYS 96 1HG LYS 96 2.161 -4.133 -17.695 737 2HG LYS 96 2HG LYS 96 2.702 -3.083 -18.994 738 1HD LYS 96 1HD LYS 96 2.685 -6.176 -19.114 739 2HD LYS 96 2HD LYS 96 1.395 -5.143 -19.716 740 1HE LYS 96 1HE LYS 96 2.991 -4.074 -21.381 741 2HE LYS 96 2HE LYS 96 4.291 -5.129 -20.809 742 1HZ LYS 96 1HZ LYS 96 1.742 -6.071 -22.029 743 2HZ LYS 96 2HZ LYS 96 3.219 -6.038 -22.767 744 3HZ LYS 96 3HZ LYS 96 2.957 -7.053 -21.491 745 H ASP 97 H ASP 97 5.800 -1.274 -15.808 746 HA ASP 97 HA ASP 97 7.943 -2.752 -14.508 747 1HB ASP 97 1HB ASP 97 8.642 -1.586 -17.279 748 2HB ASP 97 2HB ASP 97 9.850 -1.985 -16.049 749 H SER 98 H SER 98 7.227 -1.299 -13.031 750 HA SER 98 HA SER 98 8.738 1.264 -12.919 751 1HB SER 98 1HB SER 98 5.670 1.373 -13.231 752 2HB SER 98 2HB SER 98 6.700 2.746 -12.786 753 HG SER 98 HG SER 98 6.260 2.657 -15.011 754 H ALA 99 H ALA 99 5.585 1.177 -11.634 755 HA ALA 99 HA ALA 99 4.824 1.207 -9.373 756 1HB ALA 99 3HB ALA 99 7.129 -0.813 -8.918 757 2HB ALA 99 1HB ALA 99 5.811 -0.464 -7.772 758 3HB ALA 99 2HB ALA 99 5.443 -1.228 -9.334 759 H THR 100 H THR 100 5.206 3.230 -9.071 760 HA THR 100 HA THR 100 7.893 4.397 -8.537 761 HB THR 100 HB THR 100 6.621 6.500 -8.161 762 HG1 THR 100 HG1 THR 100 4.387 4.783 -8.504 763 1HG2 THR 100 2HG2 THR 100 7.142 5.747 -10.507 764 2HG2 THR 100 3HG2 THR 100 5.613 4.832 -10.561 765 3HG2 THR 100 1HG2 THR 100 5.584 6.612 -10.450 766 H SER 101 H SER 101 5.001 3.675 -6.636 767 HA SER 101 HA SER 101 6.525 3.139 -4.173 768 1HB SER 101 1HB SER 101 5.752 5.084 -2.818 769 2HB SER 101 2HB SER 101 6.767 5.621 -4.170 770 HG SER 101 HG SER 101 3.925 5.543 -4.126 771 H GLN 102 H GLN 102 3.457 4.276 -5.482 772 HA GLN 102 HA GLN 102 1.554 3.574 -3.605 773 1HB GLN 102 1HB GLN 102 0.002 2.942 -5.430 774 2HB GLN 102 2HB GLN 102 0.966 4.352 -5.885 775 1HG GLN 102 1HG GLN 102 2.564 2.854 -7.152 776 2HG GLN 102 2HG GLN 102 1.614 1.440 -6.680 777 1HE2 GLN 102 2HE2 GLN 102 -0.355 4.139 -9.155 778 2HE2 GLN 102 1HE2 GLN 102 0.610 4.703 -7.700 779 H PHE 103 H PHE 103 0.441 1.913 -2.902 780 HA PHE 103 HA PHE 103 1.015 -0.913 -3.634 781 1HB PHE 103 1HB PHE 103 1.952 -1.659 -1.527 782 2HB PHE 103 2HB PHE 103 2.995 -0.400 -2.184 783 HD1 PHE 103 HD1 PHE 103 0.323 1.465 -1.159 784 HD2 PHE 103 HD2 PHE 103 3.376 -0.917 0.513 785 HE1 PHE 103 HE1 PHE 103 0.087 2.642 0.952 786 HE2 PHE 103 HE2 PHE 103 3.138 0.263 2.623 787 HZ PHE 103 HZ PHE 103 1.480 2.028 2.846 788 H PHE 104 H PHE 104 0.087 -2.296 -1.657 789 HA PHE 104 HA PHE 104 -2.656 -1.253 -0.929 790 1HB PHE 104 1HB PHE 104 -3.914 -2.738 -2.341 791 2HB PHE 104 2HB PHE 104 -2.851 -1.792 -3.370 792 HD1 PHE 104 HD2 PHE 104 -3.310 -5.086 -1.782 793 HD2 PHE 104 HD1 PHE 104 -1.213 -2.895 -4.707 794 HE1 PHE 104 HE2 PHE 104 -2.595 -7.166 -2.827 795 HE2 PHE 104 HE1 PHE 104 -0.497 -4.975 -5.752 796 HZ PHE 104 HZ PHE 104 -1.221 -7.112 -4.834 797 H ILE 105 H ILE 105 -3.205 -1.907 0.753 798 HA ILE 105 HA ILE 105 -2.006 -4.412 2.047 799 HB ILE 105 HB ILE 105 -3.718 -2.173 3.257 800 1HG1 ILE 105 1HG1 ILE 105 -0.684 -2.700 3.320 801 2HG1 ILE 105 2HG1 ILE 105 -1.481 -1.372 2.466 802 1HG2 ILE 105 2HG2 ILE 105 -3.882 -4.393 4.424 803 2HG2 ILE 105 3HG2 ILE 105 -2.105 -4.496 4.502 804 3HG2 ILE 105 1HG2 ILE 105 -2.964 -3.228 5.418 805 1HD1 ILE 105 3HD1 ILE 105 -1.600 -1.839 5.529 806 2HD1 ILE 105 1HD1 ILE 105 -0.622 -0.596 4.706 807 3HD1 ILE 105 2HD1 ILE 105 -2.402 -0.499 4.669 808 H ASN 106 H ASN 106 -3.027 -6.051 1.294 809 HA ASN 106 HA ASN 106 -5.986 -6.289 0.931 810 1HB ASN 106 1HB ASN 106 -3.837 -8.468 1.279 811 2HB ASN 106 2HB ASN 106 -5.512 -8.738 0.773 812 1HD2 ASN 106 1HD2 ASN 106 -3.901 -8.525 -2.469 813 2HD2 ASN 106 2HD2 ASN 106 -4.325 -9.662 -1.092 814 H VAL 107 H VAL 107 -6.923 -8.276 2.114 815 HA VAL 107 HA VAL 107 -6.161 -8.539 5.028 816 HB VAL 107 HB VAL 107 -8.395 -7.856 5.847 817 1HG1 VAL 107 3HG2 VAL 107 -6.514 -6.193 5.796 818 2HG1 VAL 107 1HG2 VAL 107 -6.983 -5.695 4.149 819 3HG1 VAL 107 2HG2 VAL 107 -8.079 -5.383 5.522 820 1HG2 VAL 107 1HG1 VAL 107 -8.891 -6.962 2.930 821 2HG2 VAL 107 2HG1 VAL 107 -9.719 -8.304 3.761 822 3HG2 VAL 107 3HG1 VAL 107 -9.968 -6.628 4.312 823 H ALA 108 H ALA 108 -8.573 -9.171 2.543 824 HA ALA 108 HA ALA 108 -9.337 -11.839 3.764 825 1HB ALA 108 2HB ALA 108 -11.099 -10.413 2.688 826 2HB ALA 108 3HB ALA 108 -10.233 -10.497 1.130 827 3HB ALA 108 1HB ALA 108 -10.931 -11.973 1.844 828 H ASP 109 H ASP 109 -8.938 -13.748 2.964 829 HA ASP 109 HA ASP 109 -6.467 -14.446 1.690 830 1HB ASP 109 1HB ASP 109 -9.171 -15.904 1.433 831 2HB ASP 109 2HB ASP 109 -7.588 -16.612 1.070 832 H ASN 110 H ASN 110 -6.258 -12.778 0.216 833 HA ASN 110 HA ASN 110 -8.109 -12.288 -1.990 834 1HB ASN 110 1HB ASN 110 -6.456 -10.625 -1.054 835 2HB ASN 110 2HB ASN 110 -5.136 -11.528 -1.815 836 1HD2 ASN 110 1HD2 ASN 110 -7.964 -10.009 -4.450 837 2HD2 ASN 110 2HD2 ASN 110 -8.443 -10.952 -2.951 838 H ALA 111 H ALA 111 -4.973 -12.591 -3.229 839 HA ALA 111 HA ALA 111 -4.032 -14.054 -4.870 840 1HB ALA 111 2HB ALA 111 -4.536 -15.929 -3.277 841 2HB ALA 111 3HB ALA 111 -6.198 -16.043 -3.916 842 3HB ALA 111 1HB ALA 111 -4.810 -16.438 -4.962 843 H PHE 112 H PHE 112 -7.351 -13.224 -4.788 844 HA PHE 112 HA PHE 112 -8.209 -14.285 -7.386 845 1HB PHE 112 1HB PHE 112 -9.345 -11.820 -5.952 846 2HB PHE 112 2HB PHE 112 -10.186 -12.889 -7.074 847 HD1 PHE 112 HD2 PHE 112 -10.297 -15.411 -6.349 848 HD2 PHE 112 HD1 PHE 112 -9.423 -12.268 -3.674 849 HE1 PHE 112 HE2 PHE 112 -10.915 -16.830 -4.473 850 HE2 PHE 112 HE1 PHE 112 -10.041 -13.688 -1.804 851 HZ PHE 112 HZ PHE 112 -10.778 -15.967 -2.198 852 H LEU 113 H LEU 113 -5.690 -12.987 -7.548 853 HA LEU 113 HA LEU 113 -5.923 -11.517 -10.020 854 1HB LEU 113 1HB LEU 113 -5.417 -9.202 -9.331 855 2HB LEU 113 2HB LEU 113 -7.005 -9.736 -8.810 856 HG LEU 113 HG LEU 113 -5.834 -8.377 -7.102 857 1HD1 LEU 113 2HD1 LEU 113 -7.552 -10.049 -6.384 858 2HD1 LEU 113 3HD1 LEU 113 -6.279 -11.280 -6.180 859 3HD1 LEU 113 1HD1 LEU 113 -6.291 -9.831 -5.144 860 1HD2 LEU 113 3HD2 LEU 113 -3.471 -9.080 -7.537 861 2HD2 LEU 113 1HD2 LEU 113 -3.901 -9.282 -5.821 862 3HD2 LEU 113 2HD2 LEU 113 -3.826 -10.705 -6.889 863 H ASP 114 H ASP 114 -4.157 -12.622 -7.349 864 HA ASP 114 HA ASP 114 -1.486 -11.672 -7.766 865 1HB ASP 114 1HB ASP 114 -0.731 -13.854 -6.864 866 2HB ASP 114 2HB ASP 114 -2.125 -13.248 -5.953 867 H HIS 115 H HIS 115 0.051 -11.982 -9.101 868 HA HIS 115 HA HIS 115 -0.081 -12.440 -11.827 869 1HB HIS 115 1HB HIS 115 2.040 -11.873 -10.704 870 2HB HIS 115 2HB HIS 115 2.114 -13.457 -9.923 871 HD2 HIS 115 HD2 HIS 115 4.494 -13.866 -11.166 872 HE1 HIS 115 HE1 HIS 115 2.917 -14.547 -14.956 873 HE2 HIS 115 HE2 HIS 115 5.082 -14.799 -13.581 874 H GLY 116 H GLY 116 -0.484 -13.881 -13.191 875 1HA GLY 116 1HA GLY 116 -0.125 -16.813 -12.848 876 2HA GLY 116 2HA GLY 116 -1.825 -16.364 -12.631 877 H GLN 117 H GLN 117 -0.997 -18.049 -14.521 878 HA GLN 117 HA GLN 117 -0.253 -17.310 -17.107 879 1HB GLN 117 1HB GLN 117 -1.759 -19.064 -17.999 880 2HB GLN 117 2HB GLN 117 -0.964 -19.616 -16.519 881 1HG GLN 117 1HG GLN 117 -3.009 -18.983 -15.178 882 2HG GLN 117 2HG GLN 117 -3.804 -18.408 -16.648 883 1HE2 GLN 117 2HE2 GLN 117 -3.965 -21.846 -18.047 884 2HE2 GLN 117 1HE2 GLN 117 -3.345 -20.186 -18.524 885 NH1 ARG 118 NH2 ARG 118 -8.614 -16.059 -21.105 886 NH2 ARG 118 NH1 ARG 118 -8.961 -15.969 -18.860 887 H ARG 118 H ARG 118 -0.699 -15.813 -18.359 888 HA ARG 118 HA ARG 118 -1.930 -14.265 -19.713 889 1HB ARG 118 1HB ARG 118 -3.517 -16.177 -20.001 890 2HB ARG 118 2HB ARG 118 -4.336 -15.739 -18.494 891 1HG ARG 118 1HG ARG 118 -4.861 -13.439 -19.473 892 2HG ARG 118 2HG ARG 118 -4.041 -13.906 -20.953 893 1HD ARG 118 1HD ARG 118 -6.388 -14.140 -21.399 894 2HD ARG 118 2HD ARG 118 -5.739 -15.780 -21.309 895 HE ARG 118 HE ARG 118 -6.769 -15.012 -18.659 896 1HH1 ARG 118 2HH2 ARG 118 -7.981 -15.873 -21.891 897 2HH1 ARG 118 1HH2 ARG 118 -9.555 -16.467 -21.157 898 1HH2 ARG 118 1HH1 ARG 118 -8.597 -15.715 -17.935 899 2HH2 ARG 118 2HH1 ARG 118 -9.877 -16.382 -19.068 900 H ASP 119 H ASP 119 -1.209 -13.833 -16.868 901 HA ASP 119 HA ASP 119 -2.201 -11.136 -16.573 902 1HB ASP 119 1HB ASP 119 -4.405 -12.275 -16.145 903 2HB ASP 119 2HB ASP 119 -3.680 -13.186 -14.808 904 H PHE 120 H PHE 120 -0.134 -10.831 -16.139 905 HA PHE 120 HA PHE 120 1.643 -12.131 -14.370 906 1HB PHE 120 1HB PHE 120 2.224 -10.121 -15.777 907 2HB PHE 120 2HB PHE 120 1.358 -9.077 -14.640 908 HD1 PHE 120 HD1 PHE 120 2.873 -11.938 -13.113 909 HD2 PHE 120 HD2 PHE 120 3.679 -8.009 -14.416 910 HE1 PHE 120 HE1 PHE 120 4.860 -11.880 -11.715 911 HE2 PHE 120 HE2 PHE 120 5.667 -7.955 -13.017 912 HZ PHE 120 HZ PHE 120 6.258 -9.890 -11.666 913 H GLY 121 H GLY 121 -0.752 -9.674 -13.569 914 1HA GLY 121 1HA GLY 121 -2.107 -9.586 -11.554 915 2HA GLY 121 2HA GLY 121 -1.096 -10.795 -10.776 916 OH TYR 122 OH TYR 122 -6.136 -5.462 -10.502 917 H TYR 122 H TYR 122 -1.779 -9.025 -9.235 918 HA TYR 122 HA TYR 122 -0.228 -6.478 -9.196 919 1HB TYR 122 1HB TYR 122 -1.857 -7.840 -6.970 920 2HB TYR 122 2HB TYR 122 -1.287 -6.170 -6.967 921 HD1 TYR 122 HD2 TYR 122 -3.462 -8.564 -8.750 922 HD2 TYR 122 HD1 TYR 122 -2.437 -4.505 -8.212 923 HE1 TYR 122 HE2 TYR 122 -5.435 -7.897 -10.005 924 HE2 TYR 122 HE1 TYR 122 -4.414 -3.842 -9.464 925 HH TYR 122 HH TYR 122 -6.170 -4.504 -10.546 926 H ALA 123 H ALA 123 1.402 -5.891 -8.015 927 HA ALA 123 HA ALA 123 3.521 -7.762 -7.355 928 1HB ALA 123 2HB ALA 123 3.911 -5.324 -7.782 929 2HB ALA 123 3HB ALA 123 3.075 -4.908 -6.262 930 3HB ALA 123 1HB ALA 123 4.609 -5.816 -6.219 931 H VAL 124 H VAL 124 4.489 -7.122 -4.980 932 HA VAL 124 HA VAL 124 2.756 -7.464 -2.662 933 HB VAL 124 HB VAL 124 3.952 -10.075 -3.776 934 1HG1 VAL 124 3HG2 VAL 124 4.299 -9.855 -1.300 935 2HG1 VAL 124 1HG2 VAL 124 2.566 -9.501 -1.076 936 3HG1 VAL 124 2HG2 VAL 124 3.081 -11.107 -1.657 937 1HG2 VAL 124 1HG1 VAL 124 1.034 -9.275 -3.147 938 2HG2 VAL 124 2HG1 VAL 124 1.726 -9.496 -4.777 939 3HG2 VAL 124 3HG1 VAL 124 1.574 -10.891 -3.678 940 H PHE 125 H PHE 125 3.866 -6.777 -1.082 941 HA PHE 125 HA PHE 125 6.567 -7.889 -0.429 942 1HB PHE 125 1HB PHE 125 7.793 -5.779 -0.528 943 2HB PHE 125 2HB PHE 125 7.053 -6.016 -2.115 944 HD1 PHE 125 HD2 PHE 125 4.750 -4.913 -2.487 945 HD2 PHE 125 HD1 PHE 125 7.226 -3.896 0.772 946 HE1 PHE 125 HE2 PHE 125 3.438 -2.899 -2.115 947 HE2 PHE 125 HE1 PHE 125 5.913 -1.885 1.140 948 HZ PHE 125 HZ PHE 125 4.002 -1.402 -0.280 949 H GLY 126 H GLY 126 3.742 -7.483 0.616 950 1HA GLY 126 1HA GLY 126 4.230 -5.706 3.064 951 2HA GLY 126 2HA GLY 126 2.681 -6.040 2.308 952 H LYS 127 H LYS 127 3.396 -6.154 4.813 953 HA LYS 127 HA LYS 127 2.021 -8.577 5.690 954 1HB LYS 127 1HB LYS 127 4.213 -9.683 5.250 955 2HB LYS 127 2HB LYS 127 5.017 -8.552 6.350 956 1HG LYS 127 1HG LYS 127 4.502 -10.714 7.522 957 2HG LYS 127 2HG LYS 127 3.719 -9.328 8.263 958 1HD LYS 127 1HD LYS 127 2.082 -11.004 8.294 959 2HD LYS 127 2HD LYS 127 1.537 -9.916 7.041 960 1HE LYS 127 1HE LYS 127 3.075 -12.566 6.498 961 2HE LYS 127 2HE LYS 127 1.323 -12.468 6.624 962 1HZ LYS 127 3HZ LYS 127 1.291 -10.952 4.727 963 2HZ LYS 127 1HZ LYS 127 2.935 -11.028 4.584 964 3HZ LYS 127 2HZ LYS 127 2.021 -12.380 4.330 965 H VAL 128 H VAL 128 0.858 -7.764 6.987 966 HA VAL 128 HA VAL 128 1.289 -5.402 8.691 967 HB VAL 128 HB VAL 128 -0.704 -7.716 9.036 968 1HG1 VAL 128 3HG2 VAL 128 -0.440 -6.309 11.100 969 2HG1 VAL 128 1HG2 VAL 128 -0.700 -4.829 10.140 970 3HG1 VAL 128 2HG2 VAL 128 -2.023 -6.011 10.335 971 1HG2 VAL 128 2HG1 VAL 128 -0.844 -6.605 6.785 972 2HG2 VAL 128 3HG1 VAL 128 -2.263 -6.190 7.781 973 3HG2 VAL 128 1HG1 VAL 128 -0.945 -5.006 7.567 974 H VAL 129 H VAL 129 1.408 -5.274 10.899 975 HA VAL 129 HA VAL 129 2.241 -7.652 12.559 976 HB VAL 129 HB VAL 129 4.430 -6.685 13.184 977 1HG1 VAL 129 3HG2 VAL 129 4.303 -8.327 11.291 978 2HG1 VAL 129 1HG2 VAL 129 4.065 -6.993 10.133 979 3HG1 VAL 129 2HG2 VAL 129 5.609 -7.144 11.014 980 1HG2 VAL 129 2HG1 VAL 129 3.867 -4.269 12.782 981 2HG2 VAL 129 3HG1 VAL 129 5.348 -4.727 11.899 982 3HG2 VAL 129 1HG1 VAL 129 3.800 -4.566 11.025 983 H LYS 130 H LYS 130 0.127 -5.628 12.475 984 HA LYS 130 HA LYS 130 -1.026 -5.391 14.770 985 1HB LYS 130 1HB LYS 130 1.650 -3.999 15.387 986 2HB LYS 130 2HB LYS 130 0.253 -4.031 16.473 987 1HG LYS 130 1HG LYS 130 1.809 -6.474 15.414 988 2HG LYS 130 2HG LYS 130 1.870 -5.843 17.064 989 1HD LYS 130 1HD LYS 130 -0.605 -6.349 17.342 990 2HD LYS 130 2HD LYS 130 -0.663 -6.971 15.688 991 1HE LYS 130 1HE LYS 130 1.019 -8.778 16.309 992 2HE LYS 130 2HE LYS 130 1.075 -8.155 17.965 993 1HZ LYS 130 3HZ LYS 130 -1.362 -9.221 16.618 994 2HZ LYS 130 1HZ LYS 130 -0.467 -10.003 17.765 995 3HZ LYS 130 2HZ LYS 130 -1.311 -8.640 18.164 996 H GLY 131 H GLY 131 -2.317 -4.402 13.392 997 1HA GLY 131 1HA GLY 131 -2.790 -1.563 13.682 998 2HA GLY 131 2HA GLY 131 -1.857 -1.741 12.186 999 H MET 132 H MET 132 -3.069 -4.452 11.772 1000 HA MET 132 HA MET 132 -4.852 -3.909 9.723 1001 1HB MET 132 1HB MET 132 -4.041 -6.222 10.462 1002 2HB MET 132 2HB MET 132 -5.336 -6.245 11.669 1003 1HG MET 132 1HG MET 132 -6.070 -7.386 9.576 1004 2HG MET 132 2HG MET 132 -7.042 -5.914 9.818 1005 1HE MET 132 3HE MET 132 -7.655 -6.147 7.120 1006 2HE MET 132 2HE MET 132 -6.401 -6.146 5.844 1007 3HE MET 132 1HE MET 132 -6.540 -7.541 6.954 1008 H ASP 133 H ASP 133 -5.830 -4.484 13.078 1009 HA ASP 133 HA ASP 133 -8.643 -4.098 12.963 1010 1HB ASP 133 1HB ASP 133 -6.718 -2.898 15.047 1011 2HB ASP 133 2HB ASP 133 -8.466 -3.093 15.264 1012 H VAL 134 H VAL 134 -6.273 -1.573 13.635 1013 HA VAL 134 HA VAL 134 -7.792 0.814 13.284 1014 HB VAL 134 HB VAL 134 -4.952 0.117 12.347 1015 1HG1 VAL 134 3HG2 VAL 134 -5.790 2.069 11.031 1016 2HG1 VAL 134 1HG2 VAL 134 -6.272 2.898 12.536 1017 3HG1 VAL 134 2HG2 VAL 134 -4.548 2.579 12.201 1018 1HG2 VAL 134 2HG1 VAL 134 -5.401 -0.021 14.818 1019 2HG2 VAL 134 3HG1 VAL 134 -4.324 1.351 14.446 1020 3HG2 VAL 134 1HG1 VAL 134 -6.047 1.640 14.802 1021 H ALA 135 H ALA 135 -5.941 -0.846 10.777 1022 HA ALA 135 HA ALA 135 -6.890 0.454 8.423 1023 1HB ALA 135 2HB ALA 135 -5.164 -1.376 8.392 1024 2HB ALA 135 3HB ALA 135 -6.417 -2.583 8.789 1025 3HB ALA 135 1HB ALA 135 -6.469 -1.721 7.230 1026 H ASP 136 H ASP 136 -8.255 -2.346 10.076 1027 HA ASP 136 HA ASP 136 -10.639 -2.770 8.496 1028 1HB ASP 136 1HB ASP 136 -10.296 -3.035 11.546 1029 2HB ASP 136 2HB ASP 136 -11.618 -3.740 10.601 1030 H LYS 137 H LYS 137 -10.460 -1.173 11.637 1031 HA LYS 137 HA LYS 137 -12.947 0.118 11.776 1032 1HB LYS 137 1HB LYS 137 -10.250 1.409 12.494 1033 2HB LYS 137 2HB LYS 137 -11.837 1.950 13.067 1034 1HG LYS 137 1HG LYS 137 -12.242 -0.362 14.067 1035 2HG LYS 137 2HG LYS 137 -10.663 -0.868 13.489 1036 1HD LYS 137 1HD LYS 137 -10.387 -0.411 15.811 1037 2HD LYS 137 2HD LYS 137 -9.556 0.889 14.964 1038 1HE LYS 137 1HE LYS 137 -11.557 2.424 15.388 1039 2HE LYS 137 2HE LYS 137 -12.399 1.097 16.200 1040 1HZ LYS 137 1HZ LYS 137 -10.599 1.045 17.849 1041 2HZ LYS 137 2HZ LYS 137 -9.812 2.282 17.088 1042 3HZ LYS 137 3HZ LYS 137 -11.288 2.544 17.781 1043 H ILE 138 H ILE 138 -10.053 1.347 10.148 1044 HA ILE 138 HA ILE 138 -11.237 3.791 9.046 1045 HB ILE 138 HB ILE 138 -8.979 2.040 7.913 1046 1HG1 ILE 138 1HG1 ILE 138 -9.120 4.450 9.815 1047 2HG1 ILE 138 2HG1 ILE 138 -8.466 2.849 10.177 1048 1HG2 ILE 138 2HG2 ILE 138 -9.998 3.575 6.197 1049 2HG2 ILE 138 3HG2 ILE 138 -9.811 4.956 7.312 1050 3HG2 ILE 138 1HG2 ILE 138 -8.370 4.132 6.664 1051 1HD1 ILE 138 2HD1 ILE 138 -6.629 3.232 8.441 1052 2HD1 ILE 138 3HD1 ILE 138 -7.309 4.846 8.104 1053 3HD1 ILE 138 1HD1 ILE 138 -6.612 4.493 9.705 1054 H SER 139 H SER 139 -10.565 0.644 7.576 1055 HA SER 139 HA SER 139 -12.096 1.134 5.139 1056 1HB SER 139 1HB SER 139 -11.783 -1.300 4.714 1057 2HB SER 139 2HB SER 139 -10.281 -0.548 5.282 1058 HG SER 139 HG SER 139 -10.764 -2.488 6.360 1059 H GLN 140 H GLN 140 -13.340 0.967 8.041 1060 HA GLN 140 HA GLN 140 -15.962 -0.437 7.210 1061 1HB GLN 140 1HB GLN 140 -14.854 0.371 9.952 1062 2HB GLN 140 2HB GLN 140 -16.574 0.081 9.681 1063 1HG GLN 140 1HG GLN 140 -15.553 -2.007 10.451 1064 2HG GLN 140 2HG GLN 140 -16.125 -2.202 8.795 1065 1HE2 GLN 140 2HE2 GLN 140 -12.836 -2.672 7.431 1066 2HE2 GLN 140 1HE2 GLN 140 -14.567 -2.190 7.071 1067 H VAL 141 H VAL 141 -14.604 2.481 8.673 1068 HA VAL 141 HA VAL 141 -16.875 4.166 8.874 1069 HB VAL 141 HB VAL 141 -15.365 6.086 8.438 1070 1HG1 VAL 141 3HG2 VAL 141 -15.271 4.899 10.649 1071 2HG1 VAL 141 1HG2 VAL 141 -14.030 3.788 10.015 1072 3HG1 VAL 141 2HG2 VAL 141 -13.662 5.524 10.202 1073 1HG2 VAL 141 2HG1 VAL 141 -14.152 5.126 6.457 1074 2HG2 VAL 141 3HG1 VAL 141 -12.994 5.658 7.706 1075 3HG2 VAL 141 1HG1 VAL 141 -13.361 3.923 7.508 1076 HA PRO 142 HA PRO 142 -18.948 4.125 4.977 1077 1HB PRO 142 1HB PRO 142 -19.490 6.917 6.119 1078 2HB PRO 142 2HB PRO 142 -20.652 5.806 5.352 1079 1HG PRO 142 1HG PRO 142 -20.594 5.929 8.060 1080 2HG PRO 142 2HG PRO 142 -20.636 4.323 7.291 1081 1HD PRO 142 1HD PRO 142 -18.215 5.748 8.510 1082 2HD PRO 142 2HD PRO 142 -18.651 4.010 8.585 1083 H THR 143 H THR 143 -19.338 5.899 3.299 1084 HA THR 143 HA THR 143 -16.996 7.713 2.684 1085 HB THR 143 HB THR 143 -16.718 6.511 0.412 1086 HG1 THR 143 HG1 THR 143 -17.172 4.296 0.498 1087 1HG2 THR 143 2HG2 THR 143 -14.971 6.488 2.160 1088 2HG2 THR 143 3HG2 THR 143 -15.734 5.064 2.935 1089 3HG2 THR 143 1HG2 THR 143 -15.030 4.932 1.288 1090 H HIS 144 H HIS 144 -17.176 7.282 0.071 1091 HA HIS 144 HA HIS 144 -19.719 7.527 -1.213 1092 1HB HIS 144 1HB HIS 144 -20.123 9.908 -1.524 1093 2HB HIS 144 2HB HIS 144 -20.062 9.566 0.201 1094 HD2 HIS 144 HD2 HIS 144 -16.565 9.682 -1.388 1095 HE1 HIS 144 HE1 HIS 144 -17.204 13.508 0.088 1096 HE2 HIS 144 HE2 HIS 144 -15.381 11.991 -0.894 1097 H ASP 145 H ASP 145 -19.721 8.527 -3.286 1098 HA ASP 145 HA ASP 145 -17.387 7.996 -5.005 1099 1HB ASP 145 1HB ASP 145 -19.691 10.010 -5.369 1100 2HB ASP 145 2HB ASP 145 -18.562 9.504 -6.637 1101 H VAL 146 H VAL 146 -17.440 10.610 -6.281 1102 HA VAL 146 HA VAL 146 -16.690 12.687 -4.357 1103 HB VAL 146 HB VAL 146 -14.288 12.130 -6.075 1104 1HG1 VAL 146 3HG2 VAL 146 -14.579 14.167 -4.606 1105 2HG1 VAL 146 1HG2 VAL 146 -14.775 13.111 -3.185 1106 3HG1 VAL 146 2HG2 VAL 146 -13.210 13.166 -4.035 1107 1HG2 VAL 146 2HG1 VAL 146 -14.675 9.854 -5.080 1108 2HG2 VAL 146 3HG1 VAL 146 -13.239 10.641 -4.379 1109 3HG2 VAL 146 1HG1 VAL 146 -14.760 10.577 -3.452 1110 H GLY 147 H GLY 147 -15.731 11.624 -7.414 1111 1HA GLY 147 1HA GLY 147 -17.520 13.365 -9.025 1112 2HA GLY 147 2HA GLY 147 -15.878 14.060 -9.005 1113 HA PRO 148 HA PRO 148 -14.648 11.112 -12.174 1114 1HB PRO 148 1HB PRO 148 -11.932 11.305 -11.751 1115 2HB PRO 148 2HB PRO 148 -12.872 12.670 -12.401 1116 1HG PRO 148 1HG PRO 148 -12.046 12.205 -9.483 1117 2HG PRO 148 2HG PRO 148 -11.808 13.681 -10.450 1118 1HD PRO 148 1HD PRO 148 -13.972 13.400 -8.729 1119 2HD PRO 148 2HD PRO 148 -14.154 14.276 -10.284 1120 OH TYR 149 OH TYR 149 -7.069 10.221 -11.100 1121 H TYR 149 H TYR 149 -12.579 10.980 -9.316 1122 HA TYR 149 HA TYR 149 -12.446 8.017 -9.257 1123 1HB TYR 149 1HB TYR 149 -11.624 10.084 -7.130 1124 2HB TYR 149 2HB TYR 149 -11.196 8.372 -7.117 1125 HD1 TYR 149 HD2 TYR 149 -9.861 7.444 -9.020 1126 HD2 TYR 149 HD1 TYR 149 -10.433 11.597 -8.524 1127 HE1 TYR 149 HE2 TYR 149 -7.955 7.880 -10.463 1128 HE2 TYR 149 HE1 TYR 149 -8.526 12.030 -9.968 1129 HH TYR 149 HH TYR 149 -6.945 11.170 -11.177 1130 H GLN 150 H GLN 150 -13.937 6.798 -8.683 1131 HA GLN 150 HA GLN 150 -15.978 7.541 -6.518 1132 1HB GLN 150 1HB GLN 150 -17.252 5.628 -7.251 1133 2HB GLN 150 2HB GLN 150 -16.879 6.612 -8.665 1134 1HG GLN 150 1HG GLN 150 -15.303 4.104 -7.789 1135 2HG GLN 150 2HG GLN 150 -16.569 4.107 -9.019 1136 1HE2 GLN 150 2HE2 GLN 150 -12.981 4.642 -10.431 1137 2HE2 GLN 150 1HE2 GLN 150 -13.555 3.640 -9.005 1138 H ASN 151 H ASN 151 -14.424 7.527 -4.941 1139 HA ASN 151 HA ASN 151 -14.204 5.197 -3.287 1140 1HB ASN 151 1HB ASN 151 -11.887 4.388 -3.711 1141 2HB ASN 151 2HB ASN 151 -12.917 4.134 -5.125 1142 1HD2 ASN 151 1HD2 ASN 151 -10.492 5.843 -7.089 1143 2HD2 ASN 151 2HD2 ASN 151 -11.580 4.390 -6.815 1144 H VAL 152 H VAL 152 -14.706 6.997 -2.085 1145 HA VAL 152 HA VAL 152 -12.305 8.035 -0.612 1146 HB VAL 152 HB VAL 152 -14.220 9.971 -2.043 1147 1HG1 VAL 152 3HG2 VAL 152 -13.636 10.719 0.284 1148 2HG1 VAL 152 1HG2 VAL 152 -11.903 10.490 -0.063 1149 3HG1 VAL 152 2HG2 VAL 152 -12.828 11.748 -0.927 1150 1HG2 VAL 152 1HG1 VAL 152 -11.179 9.465 -2.324 1151 2HG2 VAL 152 2HG1 VAL 152 -12.420 9.008 -3.519 1152 3HG2 VAL 152 3HG1 VAL 152 -12.098 10.730 -3.183 1153 HA PRO 153 HA PRO 153 -15.348 7.074 2.486 1154 1HB PRO 153 1HB PRO 153 -13.567 7.520 4.567 1155 2HB PRO 153 2HB PRO 153 -13.485 6.083 3.520 1156 1HG PRO 153 1HG PRO 153 -11.867 8.673 3.249 1157 2HG PRO 153 2HG PRO 153 -11.243 7.004 3.262 1158 1HD PRO 153 1HD PRO 153 -11.697 8.337 0.882 1159 2HD PRO 153 2HD PRO 153 -12.074 6.587 1.008 1160 H SER 154 H SER 154 -16.801 8.555 2.448 1161 HA SER 154 HA SER 154 -16.704 11.347 2.315 1162 1HB SER 154 1HB SER 154 -18.896 11.410 3.526 1163 2HB SER 154 2HB SER 154 -18.836 10.110 2.321 1164 HG SER 154 HG SER 154 -19.650 9.421 4.326 1165 H LYS 155 H LYS 155 -16.703 9.441 5.298 1166 HA LYS 155 HA LYS 155 -16.187 11.644 7.169 1167 1HB LYS 155 1HB LYS 155 -15.541 8.645 7.316 1168 2HB LYS 155 2HB LYS 155 -15.311 9.766 8.664 1169 1HG LYS 155 1HG LYS 155 -17.533 8.630 8.817 1170 2HG LYS 155 2HG LYS 155 -17.686 10.384 8.689 1171 1HD LYS 155 1HD LYS 155 -18.138 10.170 6.201 1172 2HD LYS 155 2HD LYS 155 -18.009 8.411 6.332 1173 1HE LYS 155 1HE LYS 155 -19.974 8.384 7.947 1174 2HE LYS 155 2HE LYS 155 -20.098 10.145 7.831 1175 1HZ LYS 155 1HZ LYS 155 -20.539 9.899 5.443 1176 2HZ LYS 155 2HZ LYS 155 -20.426 8.254 5.551 1177 3HZ LYS 155 3HZ LYS 155 -21.643 9.052 6.334 1178 HA PRO 156 HA PRO 156 -11.927 12.385 7.274 1179 1HB PRO 156 1HB PRO 156 -11.128 11.916 9.861 1180 2HB PRO 156 2HB PRO 156 -12.440 13.053 9.469 1181 1HG PRO 156 1HG PRO 156 -12.723 10.122 10.337 1182 2HG PRO 156 2HG PRO 156 -13.529 11.542 11.050 1183 1HD PRO 156 1HD PRO 156 -14.795 9.976 9.146 1184 2HD PRO 156 2HD PRO 156 -15.034 11.752 9.157 1185 H VAL 157 H VAL 157 -9.994 11.826 6.901 1186 HA VAL 157 HA VAL 157 -8.553 9.534 7.945 1187 HB VAL 157 HB VAL 157 -9.616 9.183 5.087 1188 1HG1 VAL 157 1HG2 VAL 157 -7.255 7.742 6.467 1189 2HG1 VAL 157 2HG2 VAL 157 -7.960 7.296 4.890 1190 3HG1 VAL 157 3HG2 VAL 157 -7.124 8.859 5.085 1191 1HG2 VAL 157 2HG1 VAL 157 -10.976 8.187 6.976 1192 2HG2 VAL 157 3HG1 VAL 157 -10.214 6.903 5.997 1193 3HG2 VAL 157 1HG1 VAL 157 -9.523 7.345 7.577 1194 H VAL 158 H VAL 158 -6.820 10.379 8.233 1195 HA VAL 158 HA VAL 158 -5.160 11.564 6.015 1196 HB VAL 158 HB VAL 158 -5.915 13.207 8.507 1197 1HG1 VAL 158 3HG2 VAL 158 -3.486 13.413 7.891 1198 2HG1 VAL 158 1HG2 VAL 158 -3.929 13.788 6.207 1199 3HG1 VAL 158 2HG2 VAL 158 -4.355 14.923 7.516 1200 1HG2 VAL 158 2HG1 VAL 158 -7.657 13.238 6.688 1201 2HG2 VAL 158 3HG1 VAL 158 -6.838 14.819 6.801 1202 3HG2 VAL 158 1HG1 VAL 158 -6.413 13.684 5.492 1203 H ILE 159 H ILE 159 -3.399 10.710 6.155 1204 HA ILE 159 HA ILE 159 -2.541 9.039 8.409 1205 HB ILE 159 HB ILE 159 -1.045 10.017 5.921 1206 1HG1 ILE 159 1HG1 ILE 159 -2.566 7.461 6.728 1207 2HG1 ILE 159 2HG1 ILE 159 -3.089 8.648 5.527 1208 1HG2 ILE 159 3HG2 ILE 159 -0.309 7.838 7.985 1209 2HG2 ILE 159 1HG2 ILE 159 0.553 8.149 6.452 1210 3HG2 ILE 159 2HG2 ILE 159 0.557 9.378 7.743 1211 1HD1 ILE 159 3HD1 ILE 159 -0.518 6.938 5.345 1212 2HD1 ILE 159 1HD1 ILE 159 -2.019 6.665 4.416 1213 3HD1 ILE 159 2HD1 ILE 159 -1.043 8.133 4.125 1214 H LEU 160 H LEU 160 -1.299 9.253 9.902 1215 HA LEU 160 HA LEU 160 -0.461 12.005 10.863 1216 1HB LEU 160 1HB LEU 160 -0.168 9.240 12.184 1217 2HB LEU 160 2HB LEU 160 0.211 10.794 12.940 1218 HG LEU 160 HG LEU 160 -2.538 9.954 11.844 1219 1HD1 LEU 160 2HD1 LEU 160 -1.920 8.819 14.002 1220 2HD1 LEU 160 3HD1 LEU 160 -1.558 10.400 14.743 1221 3HD1 LEU 160 1HD1 LEU 160 -3.228 10.002 14.262 1222 1HD2 LEU 160 3HD2 LEU 160 -2.116 12.414 11.560 1223 2HD2 LEU 160 1HD2 LEU 160 -3.344 12.126 12.820 1224 3HD2 LEU 160 2HD2 LEU 160 -1.675 12.551 13.282 1225 H SER 161 H SER 161 0.991 8.828 10.299 1226 HA SER 161 HA SER 161 3.460 9.999 9.062 1227 1HB SER 161 1HB SER 161 3.628 8.696 11.850 1228 2HB SER 161 2HB SER 161 5.017 9.144 10.843 1229 HG SER 161 HG SER 161 4.463 10.744 12.360 1230 H ALA 162 H ALA 162 5.185 8.433 8.927 1231 HA ALA 162 HA ALA 162 4.524 5.507 8.830 1232 1HB ALA 162 3HB ALA 162 4.991 7.022 6.175 1233 2HB ALA 162 1HB ALA 162 4.893 5.251 6.375 1234 3HB ALA 162 2HB ALA 162 3.458 6.259 6.683 1235 H LYS 163 H LYS 163 6.096 5.090 9.965 1236 HA LYS 163 HA LYS 163 8.976 5.845 9.121 1237 1HB LYS 163 1HB LYS 163 7.819 5.492 11.949 1238 2HB LYS 163 2HB LYS 163 9.514 5.804 11.569 1239 1HG LYS 163 1HG LYS 163 7.119 7.625 10.906 1240 2HG LYS 163 2HG LYS 163 8.272 7.920 12.199 1241 1HD LYS 163 1HD LYS 163 8.991 7.834 9.188 1242 2HD LYS 163 2HD LYS 163 8.592 9.299 10.076 1243 1HE LYS 163 1HE LYS 163 10.579 8.936 11.620 1244 2HE LYS 163 2HE LYS 163 11.015 7.481 10.712 1245 1HZ LYS 163 1HZ LYS 163 10.872 10.228 9.569 1246 2HZ LYS 163 2HZ LYS 163 12.253 9.404 9.945 1247 3HZ LYS 163 3HZ LYS 163 11.278 8.869 8.723 1248 H VAL 164 H VAL 164 10.115 4.236 8.620 1249 HA VAL 164 HA VAL 164 9.267 1.433 8.913 1250 HB VAL 164 HB VAL 164 11.502 0.915 8.052 1251 1HG1 VAL 164 3HG2 VAL 164 9.702 1.648 6.464 1252 2HG1 VAL 164 1HG2 VAL 164 10.201 3.348 6.663 1253 3HG1 VAL 164 2HG2 VAL 164 11.301 2.182 5.880 1254 1HG2 VAL 164 2HG1 VAL 164 12.809 2.631 9.339 1255 2HG2 VAL 164 3HG1 VAL 164 13.154 2.768 7.595 1256 3HG2 VAL 164 1HG1 VAL 164 12.060 3.936 8.384 1257 H LEU 165 H LEU 165 9.583 0.099 10.344 1258 HA LEU 165 HA LEU 165 11.534 0.552 12.688 1259 1HB LEU 165 1HB LEU 165 8.563 -0.221 12.959 1260 2HB LEU 165 2HB LEU 165 9.766 -0.330 14.244 1261 HG LEU 165 HG LEU 165 10.266 2.151 13.939 1262 1HD1 LEU 165 2HD1 LEU 165 9.309 2.439 11.631 1263 2HD1 LEU 165 3HD1 LEU 165 7.679 2.062 12.247 1264 3HD1 LEU 165 1HD1 LEU 165 8.518 3.541 12.785 1265 1HD2 LEU 165 3HD2 LEU 165 8.813 1.285 15.792 1266 2HD2 LEU 165 1HD2 LEU 165 8.226 2.867 15.218 1267 3HD2 LEU 165 2HD2 LEU 165 7.383 1.373 14.731 1268 HA PRO 166 HA PRO 166 13.109 -3.430 11.963 1269 1HB PRO 166 1HB PRO 166 13.060 -3.267 15.023 1270 2HB PRO 166 2HB PRO 166 14.394 -3.813 13.977 1271 1HG PRO 166 1HG PRO 166 14.495 -1.297 14.989 1272 2HG PRO 166 2HG PRO 166 14.875 -1.530 13.264 1273 1HD PRO 166 1HD PRO 166 12.260 -0.490 14.479 1274 2HD PRO 166 2HD PRO 166 13.120 0.077 13.010 Start of MODEL 6 Raw file had 1274 H/Q atoms Start of MODEL 6 1 1H ALA 1 3H ALA 1 13.845 -7.329 15.028 2 2H ALA 1 1H ALA 1 14.452 -8.472 16.054 3 3H ALA 1 2H ALA 1 13.202 -7.508 16.539 4 HA ALA 1 HA ALA 1 14.599 -5.524 16.460 5 1HB ALA 1 2HB ALA 1 14.437 -6.806 18.621 6 2HB ALA 1 3HB ALA 1 15.790 -7.853 18.118 7 3HB ALA 1 1HB ALA 1 16.068 -6.119 18.421 8 H LYS 2 H LYS 2 16.556 -8.462 16.365 9 HA LYS 2 HA LYS 2 19.033 -7.358 15.531 10 1HB LYS 2 1HB LYS 2 18.317 -9.824 16.113 11 2HB LYS 2 2HB LYS 2 18.036 -10.011 14.379 12 1HG LYS 2 1HG LYS 2 20.646 -9.118 15.768 13 2HG LYS 2 2HG LYS 2 20.364 -10.695 15.031 14 1HD LYS 2 1HD LYS 2 20.143 -9.598 12.749 15 2HD LYS 2 2HD LYS 2 20.337 -8.017 13.493 16 1HE LYS 2 1HE LYS 2 22.466 -8.572 12.521 17 2HE LYS 2 2HE LYS 2 22.678 -8.649 14.268 18 1HZ LYS 2 1HZ LYS 2 22.288 -10.999 12.465 19 2HZ LYS 2 2HZ LYS 2 23.710 -10.533 13.167 20 3HZ LYS 2 3HZ LYS 2 22.471 -11.093 14.105 21 H GLY 3 H GLY 3 16.328 -8.442 13.541 22 1HA GLY 3 1HA GLY 3 16.636 -6.401 11.480 23 2HA GLY 3 2HA GLY 3 17.466 -7.859 10.895 24 H ASP 4 H ASP 4 14.626 -6.214 11.090 25 HA ASP 4 HA ASP 4 13.065 -8.237 9.608 26 1HB ASP 4 1HB ASP 4 12.306 -7.735 12.554 27 2HB ASP 4 2HB ASP 4 11.233 -8.486 11.364 28 HA PRO 5 HA PRO 5 12.127 -3.860 8.759 29 1HB PRO 5 1HB PRO 5 11.213 -5.438 6.305 30 2HB PRO 5 2HB PRO 5 12.082 -3.884 6.350 31 1HG PRO 5 1HG PRO 5 13.495 -6.140 5.823 32 2HG PRO 5 2HG PRO 5 14.164 -4.979 6.996 33 1HD PRO 5 1HD PRO 5 12.695 -7.605 7.597 34 2HD PRO 5 2HD PRO 5 14.154 -6.928 8.390 35 H HIS 6 H HIS 6 10.443 -2.909 9.367 36 HA HIS 6 HA HIS 6 7.633 -3.865 8.732 37 1HB HIS 6 1HB HIS 6 8.604 -3.401 11.624 38 2HB HIS 6 2HB HIS 6 6.934 -3.705 11.132 39 HD2 HIS 6 HD2 HIS 6 8.656 -5.854 8.810 40 HE1 HIS 6 HE1 HIS 6 8.466 -8.253 12.205 41 HE2 HIS 6 HE2 HIS 6 8.915 -8.357 9.674 42 H VAL 7 H VAL 7 6.674 -2.307 7.964 43 HA VAL 7 HA VAL 7 7.449 0.574 8.357 44 HB VAL 7 HB VAL 7 6.498 -0.215 6.169 45 1HG1 VAL 7 1HG2 VAL 7 3.950 -0.717 7.839 46 2HG1 VAL 7 2HG2 VAL 7 4.071 -0.833 6.063 47 3HG1 VAL 7 3HG2 VAL 7 4.966 -1.979 7.096 48 1HG2 VAL 7 1HG1 VAL 7 4.706 1.758 7.724 49 2HG2 VAL 7 2HG1 VAL 7 6.230 2.171 6.898 50 3HG2 VAL 7 3HG1 VAL 7 4.820 1.633 5.947 51 H LEU 8 H LEU 8 6.607 1.956 9.660 52 HA LEU 8 HA LEU 8 3.863 1.440 10.928 53 1HB LEU 8 1HB LEU 8 6.359 2.400 12.425 54 2HB LEU 8 2HB LEU 8 4.730 2.909 12.885 55 HG LEU 8 HG LEU 8 4.043 0.405 12.754 56 1HD1 LEU 8 2HD1 LEU 8 6.136 -0.431 11.645 57 2HD1 LEU 8 3HD1 LEU 8 7.102 0.091 13.050 58 3HD1 LEU 8 1HD1 LEU 8 5.901 -1.215 13.229 59 1HD2 LEU 8 3HD2 LEU 8 4.156 1.749 14.844 60 2HD2 LEU 8 1HD2 LEU 8 4.728 0.089 15.140 61 3HD2 LEU 8 2HD2 LEU 8 5.904 1.428 14.989 62 H LEU 9 H LEU 9 2.641 2.591 10.228 63 HA LEU 9 HA LEU 9 3.099 5.625 10.023 64 1HB LEU 9 1HB LEU 9 1.064 3.962 8.417 65 2HB LEU 9 2HB LEU 9 1.026 5.717 8.596 66 HG LEU 9 HG LEU 9 3.401 5.828 7.677 67 1HD1 LEU 9 2HD1 LEU 9 4.055 3.434 8.090 68 2HD1 LEU 9 3HD1 LEU 9 2.817 2.887 6.927 69 3HD1 LEU 9 1HD1 LEU 9 4.210 3.846 6.361 70 1HD2 LEU 9 2HD2 LEU 9 1.388 6.345 6.272 71 2HD2 LEU 9 3HD2 LEU 9 2.648 5.547 5.297 72 3HD2 LEU 9 1HD2 LEU 9 1.225 4.621 5.845 73 H THR 10 H THR 10 0.811 6.578 10.228 74 HA THR 10 HA THR 10 -1.036 5.223 12.142 75 HB THR 10 HB THR 10 0.756 7.567 13.070 76 HG1 THR 10 HG1 THR 10 1.640 5.478 13.194 77 1HG2 THR 10 2HG2 THR 10 -1.613 7.836 13.862 78 2HG2 THR 10 3HG2 THR 10 -1.595 6.172 14.509 79 3HG2 THR 10 1HG2 THR 10 -0.533 7.420 15.218 80 H THR 11 H THR 11 -2.613 5.630 10.990 81 HA THR 11 HA THR 11 -3.176 8.287 9.668 82 HB THR 11 HB THR 11 -5.379 7.214 9.103 83 HG1 THR 11 HG1 THR 11 -5.526 4.994 9.578 84 1HG2 THR 11 2HG2 THR 11 -3.385 7.000 7.603 85 2HG2 THR 11 3HG2 THR 11 -2.860 5.541 8.489 86 3HG2 THR 11 1HG2 THR 11 -4.380 5.519 7.547 87 H SER 12 H SER 12 -5.269 9.168 9.937 88 HA SER 12 HA SER 12 -5.781 10.420 12.467 89 1HB SER 12 1HB SER 12 -8.100 10.821 11.645 90 2HB SER 12 2HB SER 12 -6.909 11.110 10.362 91 HG SER 12 HG SER 12 -8.661 9.839 9.673 92 H ALA 13 H ALA 13 -6.985 7.390 11.163 93 HA ALA 13 HA ALA 13 -8.793 6.604 13.263 94 1HB ALA 13 2HB ALA 13 -8.594 5.373 11.091 95 2HB ALA 13 3HB ALA 13 -6.977 4.788 11.558 96 3HB ALA 13 1HB ALA 13 -8.418 4.259 12.468 97 H GLY 14 H GLY 14 -5.532 5.676 12.779 98 1HA GLY 14 1HA GLY 14 -4.508 5.967 15.484 99 2HA GLY 14 2HA GLY 14 -5.186 4.340 15.429 100 H ASN 15 H ASN 15 -2.876 4.317 16.117 101 HA ASN 15 HA ASN 15 -0.646 4.265 14.233 102 1HB ASN 15 1HB ASN 15 -0.445 4.059 16.743 103 2HB ASN 15 2HB ASN 15 -1.132 2.429 16.659 104 1HD2 ASN 15 1HD2 ASN 15 2.500 1.857 16.604 105 2HD2 ASN 15 2HD2 ASN 15 1.147 2.345 17.744 106 H ILE 16 H ILE 16 0.392 2.492 13.348 107 HA ILE 16 HA ILE 16 -1.030 -0.040 12.654 108 HB ILE 16 HB ILE 16 -2.404 1.724 11.516 109 1HG1 ILE 16 1HG1 ILE 16 -0.778 -0.055 9.605 110 2HG1 ILE 16 2HG1 ILE 16 -2.241 -0.536 10.483 111 1HG2 ILE 16 2HG2 ILE 16 -0.548 3.376 11.188 112 2HG2 ILE 16 3HG2 ILE 16 0.220 2.287 9.999 113 3HG2 ILE 16 1HG2 ILE 16 -1.369 3.022 9.640 114 1HD1 ILE 16 2HD1 ILE 16 -3.542 1.327 9.336 115 2HD1 ILE 16 3HD1 ILE 16 -2.072 1.804 8.454 116 3HD1 ILE 16 1HD1 ILE 16 -2.824 0.216 8.136 117 H GLU 17 H GLU 17 -0.047 -1.190 10.954 118 HA GLU 17 HA GLU 17 2.845 -0.661 10.300 119 1HB GLU 17 1HB GLU 17 2.102 -2.819 12.357 120 2HB GLU 17 2HB GLU 17 3.729 -2.457 11.761 121 1HG GLU 17 1HG GLU 17 3.582 -0.131 12.736 122 2HG GLU 17 2HG GLU 17 1.932 -0.442 13.269 123 H LEU 18 H LEU 18 3.128 -1.526 8.481 124 HA LEU 18 HA LEU 18 2.046 -4.324 7.796 125 1HB LEU 18 1HB LEU 18 3.601 -2.353 6.021 126 2HB LEU 18 2HB LEU 18 3.131 -3.996 5.585 127 HG LEU 18 HG LEU 18 1.447 -2.625 4.634 128 1HD1 LEU 18 2HD1 LEU 18 0.540 -4.625 5.859 129 2HD1 LEU 18 3HD1 LEU 18 0.343 -3.645 7.335 130 3HD1 LEU 18 1HD1 LEU 18 -0.630 -3.281 5.885 131 1HD2 LEU 18 3HD2 LEU 18 1.958 -0.516 5.856 132 2HD2 LEU 18 1HD2 LEU 18 0.209 -0.852 5.876 133 3HD2 LEU 18 2HD2 LEU 18 1.193 -1.162 7.335 134 H GLU 19 H GLU 19 3.659 -5.635 6.692 135 HA GLU 19 HA GLU 19 6.508 -5.430 7.814 136 1HB GLU 19 1HB GLU 19 6.472 -7.873 8.332 137 2HB GLU 19 2HB GLU 19 5.393 -6.921 9.348 138 1HG GLU 19 1HG GLU 19 4.166 -8.912 8.709 139 2HG GLU 19 2HG GLU 19 3.425 -7.540 7.893 140 H LEU 20 H LEU 20 7.887 -5.557 6.411 141 HA LEU 20 HA LEU 20 7.081 -6.331 3.547 142 1HB LEU 20 1HB LEU 20 9.215 -4.380 4.594 143 2HB LEU 20 2HB LEU 20 8.958 -4.801 2.900 144 HG LEU 20 HG LEU 20 6.537 -4.045 3.108 145 1HD1 LEU 20 3HD1 LEU 20 7.530 -2.875 5.792 146 2HD1 LEU 20 1HD1 LEU 20 5.965 -2.509 5.019 147 3HD1 LEU 20 2HD1 LEU 20 6.303 -4.156 5.607 148 1HD2 LEU 20 3HD2 LEU 20 8.318 -2.608 2.079 149 2HD2 LEU 20 1HD2 LEU 20 7.131 -1.610 2.956 150 3HD2 LEU 20 2HD2 LEU 20 8.726 -1.942 3.682 151 H ASP 21 H ASP 21 8.149 -7.531 2.340 152 HA ASP 21 HA ASP 21 10.112 -9.555 3.189 153 1HB ASP 21 1HB ASP 21 9.588 -8.335 0.420 154 2HB ASP 21 2HB ASP 21 10.526 -9.806 0.736 155 H LYS 22 H LYS 22 11.352 -8.380 0.558 156 HA LYS 22 HA LYS 22 13.028 -6.337 0.405 157 1HB LYS 22 1HB LYS 22 13.054 -6.141 2.922 158 2HB LYS 22 2HB LYS 22 13.918 -7.680 3.032 159 1HG LYS 22 1HG LYS 22 14.884 -5.111 1.623 160 2HG LYS 22 2HG LYS 22 15.515 -5.763 3.139 161 1HD LYS 22 1HD LYS 22 16.305 -7.842 1.913 162 2HD LYS 22 2HD LYS 22 15.659 -7.195 0.400 163 1HE LYS 22 1HE LYS 22 17.242 -5.208 0.575 164 2HE LYS 22 2HE LYS 22 17.894 -5.863 2.085 165 1HZ LYS 22 1HZ LYS 22 18.000 -7.231 -0.562 166 2HZ LYS 22 2HZ LYS 22 19.261 -6.473 0.189 167 3HZ LYS 22 3HZ LYS 22 18.610 -7.842 0.846 168 H GLN 23 H GLN 23 13.539 -9.560 1.724 169 HA GLN 23 HA GLN 23 16.053 -10.288 0.591 170 1HB GLN 23 1HB GLN 23 13.537 -12.059 0.785 171 2HB GLN 23 2HB GLN 23 15.191 -12.649 0.578 172 1HG GLN 23 1HG GLN 23 14.181 -10.965 2.960 173 2HG GLN 23 2HG GLN 23 14.467 -12.709 2.991 174 1HE2 GLN 23 2HE2 GLN 23 18.086 -12.383 2.888 175 2HE2 GLN 23 1HE2 GLN 23 16.679 -13.414 2.317 176 H LYS 24 H LYS 24 12.890 -11.046 -0.808 177 HA LYS 24 HA LYS 24 14.151 -11.492 -3.536 178 1HB LYS 24 1HB LYS 24 11.277 -11.878 -2.549 179 2HB LYS 24 2HB LYS 24 11.883 -12.188 -4.177 180 1HG LYS 24 1HG LYS 24 13.683 -13.735 -3.138 181 2HG LYS 24 2HG LYS 24 12.936 -13.466 -1.573 182 1HD LYS 24 1HD LYS 24 12.132 -15.583 -2.293 183 2HD LYS 24 2HD LYS 24 10.760 -14.494 -2.461 184 1HE LYS 24 1HE LYS 24 11.213 -14.332 -4.972 185 2HE LYS 24 2HE LYS 24 12.622 -15.385 -4.783 186 1HZ LYS 24 1HZ LYS 24 11.126 -17.141 -3.983 187 2HZ LYS 24 2HZ LYS 24 9.810 -16.158 -4.165 188 3HZ LYS 24 3HZ LYS 24 10.681 -16.628 -5.489 189 H ALA 25 H ALA 25 13.586 -8.797 -2.234 190 HA ALA 25 HA ALA 25 13.038 -7.461 -4.854 191 1HB ALA 25 2HB ALA 25 10.683 -7.905 -4.089 192 2HB ALA 25 3HB ALA 25 11.002 -7.033 -2.566 193 3HB ALA 25 1HB ALA 25 11.028 -6.158 -4.118 194 HA PRO 26 HA PRO 26 15.977 -5.392 -1.818 195 1HB PRO 26 1HB PRO 26 17.535 -5.532 -4.434 196 2HB PRO 26 2HB PRO 26 18.136 -5.802 -2.782 197 1HG PRO 26 1HG PRO 26 17.705 -7.951 -4.391 198 2HG PRO 26 2HG PRO 26 17.150 -8.024 -2.700 199 1HD PRO 26 1HD PRO 26 15.455 -7.425 -5.192 200 2HD PRO 26 2HD PRO 26 15.075 -8.503 -3.810 201 H VAL 27 H VAL 27 15.891 -4.880 -5.306 202 HA VAL 27 HA VAL 27 16.427 -2.083 -5.415 203 HB VAL 27 HB VAL 27 14.526 -3.673 -7.235 204 1HG1 VAL 27 3HG2 VAL 27 14.321 -1.184 -7.502 205 2HG1 VAL 27 1HG2 VAL 27 16.088 -1.047 -7.699 206 3HG1 VAL 27 2HG2 VAL 27 15.117 -1.907 -8.925 207 1HG2 VAL 27 2HG1 VAL 27 16.802 -4.716 -7.012 208 2HG2 VAL 27 3HG1 VAL 27 16.590 -4.005 -8.633 209 3HG2 VAL 27 1HG1 VAL 27 17.569 -3.156 -7.407 210 H SER 28 H SER 28 13.234 -3.559 -5.733 211 HA SER 28 HA SER 28 11.573 -1.294 -5.712 212 1HB SER 28 1HB SER 28 10.752 -3.658 -5.889 213 2HB SER 28 2HB SER 28 11.066 -3.908 -4.160 214 HG SER 28 HG SER 28 8.912 -3.323 -4.598 215 H VAL 29 H VAL 29 12.542 -3.119 -2.824 216 HA VAL 29 HA VAL 29 11.365 -1.414 -0.837 217 HB VAL 29 HB VAL 29 13.043 -2.414 0.706 218 1HG1 VAL 29 3HG2 VAL 29 10.970 -3.655 0.040 219 2HG1 VAL 29 1HG2 VAL 29 11.822 -4.360 -1.356 220 3HG1 VAL 29 2HG2 VAL 29 12.319 -4.789 0.304 221 1HG2 VAL 29 2HG1 VAL 29 15.035 -2.381 -0.824 222 2HG2 VAL 29 3HG1 VAL 29 14.741 -4.029 -0.210 223 3HG2 VAL 29 1HG1 VAL 29 14.261 -3.598 -1.873 224 H GLN 30 H GLN 30 14.614 -1.341 -2.247 225 HA GLN 30 HA GLN 30 15.818 0.756 -0.750 226 1HB GLN 30 1HB GLN 30 16.983 -0.517 -2.570 227 2HB GLN 30 2HB GLN 30 16.027 0.329 -3.795 228 1HG GLN 30 1HG GLN 30 18.246 1.424 -3.533 229 2HG GLN 30 2HG GLN 30 16.959 2.532 -3.048 230 1HE2 GLN 30 2HE2 GLN 30 18.123 2.785 0.308 231 2HE2 GLN 30 1HE2 GLN 30 16.933 3.294 -0.993 232 H ASN 31 H ASN 31 14.392 1.322 -3.937 233 HA ASN 31 HA ASN 31 14.131 4.131 -3.893 234 1HB ASN 31 1HB ASN 31 12.003 2.161 -4.940 235 2HB ASN 31 2HB ASN 31 12.134 3.865 -5.388 236 1HD2 ASN 31 1HD2 ASN 31 14.900 1.157 -6.858 237 2HD2 ASN 31 2HD2 ASN 31 13.846 0.769 -5.406 238 H PHE 32 H PHE 32 11.842 1.769 -2.621 239 HA PHE 32 HA PHE 32 9.754 3.384 -1.598 240 1HB PHE 32 1HB PHE 32 9.874 0.879 -1.374 241 2HB PHE 32 2HB PHE 32 11.118 1.039 -0.131 242 HD1 PHE 32 HD1 PHE 32 7.721 2.361 -0.947 243 HD2 PHE 32 HD2 PHE 32 10.377 1.122 2.087 244 HE1 PHE 32 HE1 PHE 32 5.964 2.639 0.708 245 HE2 PHE 32 HE2 PHE 32 8.617 1.403 3.740 246 HZ PHE 32 HZ PHE 32 6.410 2.161 3.051 247 H VAL 33 H VAL 33 12.551 2.346 0.298 248 HA VAL 33 HA VAL 33 12.336 4.118 2.531 249 HB VAL 33 HB VAL 33 14.921 3.278 1.087 250 1HG1 VAL 33 3HG2 VAL 33 15.244 5.162 2.719 251 2HG1 VAL 33 1HG2 VAL 33 14.402 4.229 3.982 252 3HG1 VAL 33 2HG2 VAL 33 15.967 3.657 3.345 253 1HG2 VAL 33 2HG1 VAL 33 13.449 1.336 1.712 254 2HG2 VAL 33 3HG1 VAL 33 14.901 1.384 2.747 255 3HG2 VAL 33 1HG1 VAL 33 13.332 1.947 3.382 256 H ASP 34 H ASP 34 13.635 4.749 -0.671 257 HA ASP 34 HA ASP 34 14.725 7.367 -0.440 258 1HB ASP 34 1HB ASP 34 12.716 6.339 -2.540 259 2HB ASP 34 2HB ASP 34 13.685 7.808 -2.722 260 OH TYR 35 OH TYR 35 8.937 8.269 -6.342 261 H TYR 35 H TYR 35 11.354 6.632 -1.144 262 HA TYR 35 HA TYR 35 10.288 9.316 -0.520 263 1HB TYR 35 1HB TYR 35 8.895 6.566 -0.537 264 2HB TYR 35 2HB TYR 35 8.061 8.112 -0.387 265 HD1 TYR 35 HD1 TYR 35 8.242 9.785 -2.212 266 HD2 TYR 35 HD2 TYR 35 9.691 5.848 -2.679 267 HE1 TYR 35 HE1 TYR 35 8.222 10.062 -4.629 268 HE2 TYR 35 HE2 TYR 35 9.669 6.132 -5.096 269 HH TYR 35 HH TYR 35 9.248 7.459 -6.753 270 H VAL 36 H VAL 36 10.056 6.226 1.168 271 HA VAL 36 HA VAL 36 8.914 6.885 3.636 272 HB VAL 36 HB VAL 36 11.484 5.248 3.290 273 1HG1 VAL 36 3HG2 VAL 36 10.926 5.775 5.678 274 2HG1 VAL 36 1HG2 VAL 36 9.272 5.151 5.447 275 3HG1 VAL 36 2HG2 VAL 36 10.666 4.042 5.348 276 1HG2 VAL 36 2HG1 VAL 36 9.659 4.513 1.719 277 2HG2 VAL 36 3HG1 VAL 36 9.912 3.291 2.993 278 3HG2 VAL 36 1HG1 VAL 36 8.515 4.398 3.081 279 H ASN 37 H ASN 37 12.322 7.178 2.814 280 HA ASN 37 HA ASN 37 13.553 7.996 5.131 281 1HB ASN 37 1HB ASN 37 14.691 7.943 2.899 282 2HB ASN 37 2HB ASN 37 13.915 9.470 2.452 283 1HD2 ASN 37 1HD2 ASN 37 16.687 11.176 3.889 284 2HD2 ASN 37 2HD2 ASN 37 15.550 10.902 2.475 285 H SER 38 H SER 38 11.227 9.893 3.399 286 HA SER 38 HA SER 38 10.161 11.415 5.393 287 1HB SER 38 1HB SER 38 11.530 13.455 5.787 288 2HB SER 38 2HB SER 38 12.449 11.995 6.197 289 HG SER 38 HG SER 38 13.631 13.458 4.921 290 H GLY 39 H GLY 39 9.158 13.305 4.995 291 1HA GLY 39 1HA GLY 39 8.399 15.213 3.692 292 2HA GLY 39 2HA GLY 39 9.340 14.682 2.302 293 H PHE 40 H PHE 40 8.384 11.989 2.338 294 HA PHE 40 HA PHE 40 6.127 12.387 0.496 295 1HB PHE 40 1HB PHE 40 7.795 10.560 0.224 296 2HB PHE 40 2HB PHE 40 7.230 9.790 1.714 297 HD1 PHE 40 HD1 PHE 40 4.732 11.510 -0.246 298 HD2 PHE 40 HD2 PHE 40 6.690 7.810 0.267 299 HE1 PHE 40 HE1 PHE 40 2.971 10.402 -1.503 300 HE2 PHE 40 HE2 PHE 40 4.927 6.705 -0.990 301 HZ PHE 40 HZ PHE 40 3.067 8.000 -1.875 302 OH TYR 41 OH TYR 41 6.279 5.081 0.996 303 H TYR 41 H TYR 41 6.060 10.000 3.048 304 HA TYR 41 HA TYR 41 3.207 9.860 3.113 305 1HB TYR 41 1HB TYR 41 5.118 9.078 5.391 306 2HB TYR 41 2HB TYR 41 3.472 8.477 5.156 307 HD1 TYR 41 HD1 TYR 41 2.948 7.214 3.044 308 HD2 TYR 41 HD2 TYR 41 6.912 8.215 4.095 309 HE1 TYR 41 HE1 TYR 41 3.787 5.577 1.452 310 HE2 TYR 41 HE2 TYR 41 7.746 6.577 2.503 311 HH TYR 41 HH TYR 41 5.535 4.659 0.560 312 H ASN 42 H ASN 42 5.367 11.735 5.150 313 HA ASN 42 HA ASN 42 3.895 12.321 7.402 314 1HB ASN 42 1HB ASN 42 4.921 14.578 7.494 315 2HB ASN 42 2HB ASN 42 6.096 13.384 6.921 316 1HD2 ASN 42 1HD2 ASN 42 6.426 16.210 4.565 317 2HD2 ASN 42 2HD2 ASN 42 6.799 15.770 6.307 318 H ASN 43 H ASN 43 1.844 12.112 7.188 319 HA ASN 43 HA ASN 43 -0.360 12.976 7.259 320 1HB ASN 43 1HB ASN 43 0.861 15.601 6.225 321 2HB ASN 43 2HB ASN 43 -0.741 15.399 6.941 322 1HD2 ASN 43 1HD2 ASN 43 1.323 16.535 9.763 323 2HD2 ASN 43 2HD2 ASN 43 0.563 17.158 8.214 324 H THR 44 H THR 44 0.554 11.508 5.112 325 HA THR 44 HA THR 44 -0.935 12.536 2.662 326 HB THR 44 HB THR 44 -0.555 10.244 1.780 327 HG1 THR 44 HG1 THR 44 -0.507 9.207 3.812 328 1HG2 THR 44 2HG2 THR 44 1.144 12.064 1.421 329 2HG2 THR 44 3HG2 THR 44 1.955 11.622 2.947 330 3HG2 THR 44 1HG2 THR 44 1.944 10.477 1.578 331 H THR 45 H THR 45 -1.844 9.494 2.743 332 HA THR 45 HA THR 45 -3.835 9.436 4.947 333 HB THR 45 HB THR 45 -5.858 9.447 3.483 334 HG1 THR 45 HG1 THR 45 -5.588 10.330 1.403 335 1HG2 THR 45 2HG2 THR 45 -5.173 11.546 4.694 336 2HG2 THR 45 3HG2 THR 45 -4.161 12.024 3.305 337 3HG2 THR 45 1HG2 THR 45 -5.934 11.935 3.128 338 H PHE 46 H PHE 46 -5.759 8.163 3.375 339 HA PHE 46 HA PHE 46 -4.722 5.534 2.356 340 1HB PHE 46 1HB PHE 46 -5.836 5.870 5.212 341 2HB PHE 46 2HB PHE 46 -6.193 4.407 4.316 342 HD1 PHE 46 HD2 PHE 46 -3.414 6.431 5.667 343 HD2 PHE 46 HD1 PHE 46 -4.538 2.765 3.908 344 HE1 PHE 46 HE2 PHE 46 -1.269 5.468 6.289 345 HE2 PHE 46 HE1 PHE 46 -2.394 1.809 4.528 346 HZ PHE 46 HZ PHE 46 -0.757 3.160 5.719 347 H HIS 47 H HIS 47 -5.971 7.201 0.975 348 HA HIS 47 HA HIS 47 -8.634 7.888 1.118 349 1HB HIS 47 1HB HIS 47 -8.845 7.546 -1.397 350 2HB HIS 47 2HB HIS 47 -7.460 8.498 -0.860 351 HD2 HIS 47 HD2 HIS 47 -7.509 6.919 -3.667 352 HE1 HIS 47 HE1 HIS 47 -4.480 4.648 -1.949 353 HE2 HIS 47 HE2 HIS 47 -5.491 5.285 -4.223 354 NH1 ARG 48 NH2 ARG 48 -13.191 1.744 3.341 355 NH2 ARG 48 NH1 ARG 48 -14.780 1.319 1.771 356 H ARG 48 H ARG 48 -7.998 4.953 -0.769 357 HA ARG 48 HA ARG 48 -9.710 3.194 0.885 358 1HB ARG 48 1HB ARG 48 -10.922 4.603 -1.555 359 2HB ARG 48 2HB ARG 48 -11.589 3.094 -0.930 360 1HG ARG 48 1HG ARG 48 -11.135 5.620 0.776 361 2HG ARG 48 2HG ARG 48 -12.669 5.273 -0.006 362 1HD ARG 48 1HD ARG 48 -11.321 3.384 2.049 363 2HD ARG 48 2HD ARG 48 -12.495 4.629 2.484 364 HE ARG 48 HE ARG 48 -13.870 3.133 0.498 365 1HH1 ARG 48 2HH2 ARG 48 -12.390 2.317 3.628 366 2HH1 ARG 48 1HH2 ARG 48 -13.604 0.960 3.859 367 1HH2 ARG 48 1HH1 ARG 48 -15.194 1.569 0.866 368 2HH2 ARG 48 2HH1 ARG 48 -15.084 0.567 2.399 369 H VAL 49 H VAL 49 -10.984 1.944 -1.108 370 HA VAL 49 HA VAL 49 -9.807 1.441 -3.506 371 HB VAL 49 HB VAL 49 -7.755 0.582 -2.504 372 1HG1 VAL 49 3HG2 VAL 49 -8.741 -0.269 -0.360 373 2HG1 VAL 49 1HG2 VAL 49 -9.560 -1.580 -1.248 374 3HG1 VAL 49 2HG2 VAL 49 -7.778 -1.537 -1.163 375 1HG2 VAL 49 2HG1 VAL 49 -8.546 -0.366 -4.693 376 2HG2 VAL 49 3HG1 VAL 49 -7.674 -1.605 -3.752 377 3HG2 VAL 49 1HG1 VAL 49 -9.456 -1.632 -3.830 378 H ILE 50 H ILE 50 -10.905 -0.644 -0.868 379 HA ILE 50 HA ILE 50 -13.664 -0.802 -1.885 380 HB ILE 50 HB ILE 50 -12.598 -2.262 -3.597 381 1HG1 ILE 50 1HG1 ILE 50 -14.272 -3.737 -1.475 382 2HG1 ILE 50 2HG1 ILE 50 -14.911 -2.738 -2.785 383 1HG2 ILE 50 2HG2 ILE 50 -10.627 -3.014 -2.226 384 2HG2 ILE 50 3HG2 ILE 50 -11.710 -3.948 -1.161 385 3HG2 ILE 50 1HG2 ILE 50 -11.517 -4.419 -2.872 386 1HD1 ILE 50 3HD1 ILE 50 -13.239 -5.319 -3.172 387 2HD1 ILE 50 1HD1 ILE 50 -15.000 -5.177 -3.405 388 3HD1 ILE 50 2HD1 ILE 50 -13.885 -4.313 -4.495 389 HA PRO 51 HA PRO 51 -14.289 -1.312 2.366 390 1HB PRO 51 1HB PRO 51 -16.741 -2.744 1.221 391 2HB PRO 51 2HB PRO 51 -16.692 -1.524 2.518 392 1HG PRO 51 1HG PRO 51 -17.405 -0.725 0.027 393 2HG PRO 51 2HG PRO 51 -16.227 0.265 0.925 394 1HD PRO 51 1HD PRO 51 -15.657 -1.737 -1.323 395 2HD PRO 51 2HD PRO 51 -14.904 -0.136 -1.026 396 H GLY 52 H GLY 52 -14.539 -2.771 3.973 397 1HA GLY 52 1HA GLY 52 -13.351 -4.792 4.875 398 2HA GLY 52 2HA GLY 52 -15.021 -5.267 4.565 399 H PHE 53 H PHE 53 -12.212 -4.705 2.507 400 HA PHE 53 HA PHE 53 -11.866 -7.613 1.835 401 1HB PHE 53 1HB PHE 53 -13.833 -6.910 0.408 402 2HB PHE 53 2HB PHE 53 -12.846 -5.634 -0.317 403 HD1 PHE 53 HD1 PHE 53 -10.950 -8.532 0.569 404 HD2 PHE 53 HD2 PHE 53 -13.443 -6.947 -2.441 405 HE1 PHE 53 HE1 PHE 53 -10.078 -10.159 -1.013 406 HE2 PHE 53 HE2 PHE 53 -12.569 -8.575 -4.021 407 HZ PHE 53 HZ PHE 53 -10.886 -10.181 -3.308 408 H MET 54 H MET 54 -11.184 -4.251 1.075 409 HA MET 54 HA MET 54 -8.208 -4.770 0.963 410 1HB MET 54 1HB MET 54 -9.695 -3.713 -1.515 411 2HB MET 54 2HB MET 54 -7.969 -4.078 -1.382 412 1HG MET 54 1HG MET 54 -8.506 -6.516 -1.024 413 2HG MET 54 2HG MET 54 -10.245 -6.141 -1.065 414 1HE MET 54 1HE MET 54 -9.244 -8.340 -3.030 415 2HE MET 54 3HE MET 54 -10.908 -7.676 -3.092 416 3HE MET 54 2HE MET 54 -9.942 -7.810 -4.590 417 H ILE 55 H ILE 55 -7.008 -3.129 1.111 418 HA ILE 55 HA ILE 55 -7.933 -0.320 0.601 419 HB ILE 55 HB ILE 55 -7.197 0.590 2.759 420 1HG1 ILE 55 1HG1 ILE 55 -6.787 -2.349 3.582 421 2HG1 ILE 55 2HG1 ILE 55 -5.492 -1.190 3.257 422 1HG2 ILE 55 2HG2 ILE 55 -9.605 -0.072 2.503 423 2HG2 ILE 55 3HG2 ILE 55 -9.234 -1.708 3.106 424 3HG2 ILE 55 1HG2 ILE 55 -9.068 -0.299 4.188 425 1HD1 ILE 55 2HD1 ILE 55 -6.334 0.299 5.131 426 2HD1 ILE 55 3HD1 ILE 55 -7.643 -0.865 5.464 427 3HD1 ILE 55 1HD1 ILE 55 -5.943 -1.333 5.730 428 H GLN 56 H GLN 56 -6.346 0.904 -0.096 429 HA GLN 56 HA GLN 56 -4.250 -0.554 -1.348 430 1HB GLN 56 1HB GLN 56 -4.395 2.455 -0.998 431 2HB GLN 56 2HB GLN 56 -3.473 1.606 -2.248 432 1HG GLN 56 1HG GLN 56 -5.625 0.530 -3.082 433 2HG GLN 56 2HG GLN 56 -6.536 1.443 -1.879 434 1HE2 GLN 56 2HE2 GLN 56 -5.484 3.253 -5.364 435 2HE2 GLN 56 1HE2 GLN 56 -5.167 1.486 -4.987 436 H GLY 57 H GLY 57 -1.543 1.226 1.109 437 1HA GLY 57 1HA GLY 57 -3.760 2.704 -0.450 438 2HA GLY 57 2HA GLY 57 -3.344 3.222 1.183 439 H GLY 58 H GLY 58 -2.174 4.860 1.218 440 1HA GLY 58 1HA GLY 58 -0.508 6.511 0.684 441 2HA GLY 58 2HA GLY 58 0.524 5.131 0.291 442 H GLY 59 H GLY 59 -1.039 7.824 -0.820 443 1HA GLY 59 1HA GLY 59 0.110 7.766 -3.477 444 2HA GLY 59 2HA GLY 59 -1.551 7.177 -3.662 445 H PHE 60 H PHE 60 -2.768 8.592 -4.360 446 HA PHE 60 HA PHE 60 -2.353 11.314 -4.801 447 1HB PHE 60 1HB PHE 60 -5.111 10.217 -3.986 448 2HB PHE 60 2HB PHE 60 -4.789 11.599 -5.030 449 HD1 PHE 60 HD2 PHE 60 -4.439 7.933 -4.737 450 HD2 PHE 60 HD1 PHE 60 -4.316 11.240 -7.353 451 HE1 PHE 60 HE2 PHE 60 -4.441 6.427 -6.641 452 HE2 PHE 60 HE1 PHE 60 -4.319 9.730 -9.257 453 HZ PHE 60 HZ PHE 60 -4.380 7.324 -8.905 454 H THR 61 H THR 61 -2.226 13.105 -3.739 455 HA THR 61 HA THR 61 -2.524 13.417 -0.840 456 HB THR 61 HB THR 61 -2.661 15.872 -1.337 457 HG1 THR 61 HG1 THR 61 -2.681 14.934 -4.017 458 1HG2 THR 61 3HG2 THR 61 -0.583 14.324 -3.021 459 2HG2 THR 61 1HG2 THR 61 -0.429 16.020 -2.485 460 3HG2 THR 61 2HG2 THR 61 -0.437 14.701 -1.284 461 H GLU 62 H GLU 62 -4.174 13.418 0.327 462 HA GLU 62 HA GLU 62 -6.576 12.854 0.629 463 1HB GLU 62 1HB GLU 62 -7.533 14.888 1.448 464 2HB GLU 62 2HB GLU 62 -5.806 14.956 1.797 465 1HG GLU 62 1HG GLU 62 -7.233 16.303 -0.597 466 2HG GLU 62 2HG GLU 62 -6.740 17.131 0.876 467 H GLN 63 H GLN 63 -7.464 15.801 -0.696 468 HA GLN 63 HA GLN 63 -9.806 15.064 -1.963 469 1HB GLN 63 1HB GLN 63 -7.821 17.105 -3.139 470 2HB GLN 63 2HB GLN 63 -9.549 17.030 -3.504 471 1HG GLN 63 1HG GLN 63 -8.338 17.476 -0.701 472 2HG GLN 63 2HG GLN 63 -9.032 18.739 -1.725 473 1HE2 GLN 63 2HE2 GLN 63 -12.448 17.451 -1.359 474 2HE2 GLN 63 1HE2 GLN 63 -11.281 18.079 -2.628 475 H MET 64 H MET 64 -6.742 15.352 -3.717 476 HA MET 64 HA MET 64 -6.391 13.210 -5.287 477 1HB MET 64 1HB MET 64 -8.764 14.596 -6.620 478 2HB MET 64 2HB MET 64 -7.894 13.210 -7.270 479 1HG MET 64 1HG MET 64 -9.464 13.162 -4.609 480 2HG MET 64 2HG MET 64 -10.070 12.559 -6.167 481 1HE MET 64 1HE MET 64 -10.262 10.418 -4.070 482 2HE MET 64 3HE MET 64 -10.384 10.013 -5.810 483 3HE MET 64 2HE MET 64 -9.337 9.041 -4.739 484 H GLN 65 H GLN 65 -4.658 14.090 -5.568 485 HA GLN 65 HA GLN 65 -4.187 15.877 -7.916 486 1HB GLN 65 1HB GLN 65 -3.366 16.920 -5.129 487 2HB GLN 65 2HB GLN 65 -2.937 17.659 -6.678 488 1HG GLN 65 1HG GLN 65 -5.799 17.268 -5.596 489 2HG GLN 65 2HG GLN 65 -4.921 18.801 -5.659 490 1HE2 GLN 65 2HE2 GLN 65 -5.127 19.013 -9.311 491 2HE2 GLN 65 1HE2 GLN 65 -3.963 19.264 -7.915 492 H GLN 66 H GLN 66 -3.521 13.698 -8.189 493 HA GLN 66 HA GLN 66 -1.689 12.073 -7.059 494 1HB GLN 66 1HB GLN 66 -1.266 13.029 -9.952 495 2HB GLN 66 2HB GLN 66 -0.657 11.522 -9.244 496 1HG GLN 66 1HG GLN 66 -3.018 10.787 -8.749 497 2HG GLN 66 2HG GLN 66 -3.641 12.300 -9.412 498 1HE2 GLN 66 2HE2 GLN 66 -3.034 11.382 -12.849 499 2HE2 GLN 66 1HE2 GLN 66 -3.200 12.775 -11.667 500 H LYS 67 H LYS 67 0.164 11.939 -6.306 501 HA LYS 67 HA LYS 67 1.806 14.373 -5.832 502 1HB LYS 67 1HB LYS 67 1.907 11.485 -4.966 503 2HB LYS 67 2HB LYS 67 3.413 12.408 -4.900 504 1HG LYS 67 1HG LYS 67 0.737 13.274 -3.629 505 2HG LYS 67 2HG LYS 67 2.126 12.614 -2.757 506 1HD LYS 67 1HD LYS 67 3.546 14.594 -3.607 507 2HD LYS 67 2HD LYS 67 2.118 15.228 -4.406 508 1HE LYS 67 1HE LYS 67 2.362 16.481 -2.379 509 2HE LYS 67 2HE LYS 67 0.955 15.448 -2.141 510 1HZ LYS 67 1HZ LYS 67 3.697 14.911 -1.084 511 2HZ LYS 67 2HZ LYS 67 2.405 15.448 -0.206 512 3HZ LYS 67 3HZ LYS 67 2.389 13.927 -0.850 513 H LYS 68 H LYS 68 3.894 14.695 -6.330 514 HA LYS 68 HA LYS 68 4.949 14.245 -8.981 515 1HB LYS 68 1HB LYS 68 6.365 14.597 -6.276 516 2HB LYS 68 2HB LYS 68 7.227 14.643 -7.815 517 1HG LYS 68 1HG LYS 68 4.818 16.472 -7.169 518 2HG LYS 68 2HG LYS 68 6.478 16.916 -6.803 519 1HD LYS 68 1HD LYS 68 5.901 17.995 -8.866 520 2HD LYS 68 2HD LYS 68 7.117 16.775 -9.218 521 1HE LYS 68 1HE LYS 68 5.276 15.220 -10.087 522 2HE LYS 68 2HE LYS 68 4.070 16.465 -9.726 523 1HZ LYS 68 2HZ LYS 68 6.351 16.794 -11.619 524 2HZ LYS 68 3HZ LYS 68 4.775 16.539 -12.043 525 3HZ LYS 68 1HZ LYS 68 5.213 17.945 -11.294 526 HA PRO 69 HA PRO 69 5.046 9.769 -8.268 527 1HB PRO 69 1HB PRO 69 5.588 10.089 -11.261 528 2HB PRO 69 2HB PRO 69 4.493 8.934 -10.460 529 1HG PRO 69 1HG PRO 69 3.424 11.146 -11.614 530 2HG PRO 69 2HG PRO 69 2.866 10.688 -9.986 531 1HD PRO 69 1HD PRO 69 4.883 12.878 -10.721 532 2HD PRO 69 2HD PRO 69 3.568 12.927 -9.504 533 H ASN 70 H ASN 70 7.145 10.831 -10.906 534 HA ASN 70 HA ASN 70 9.577 10.728 -11.064 535 1HB ASN 70 1HB ASN 70 9.485 9.079 -8.469 536 2HB ASN 70 2HB ASN 70 10.946 9.587 -9.323 537 1HD2 ASN 70 1HD2 ASN 70 10.511 13.110 -8.482 538 2HD2 ASN 70 2HD2 ASN 70 11.013 11.990 -9.846 539 HA PRO 71 HA PRO 71 9.952 7.068 -13.386 540 1HB PRO 71 1HB PRO 71 12.679 6.580 -13.249 541 2HB PRO 71 2HB PRO 71 11.990 8.007 -14.058 542 1HG PRO 71 1HG PRO 71 13.092 7.842 -11.202 543 2HG PRO 71 2HG PRO 71 13.509 9.037 -12.455 544 1HD PRO 71 1HD PRO 71 11.622 9.610 -10.519 545 2HD PRO 71 2HD PRO 71 11.371 10.179 -12.202 546 HA PRO 72 HA PRO 72 9.034 4.053 -10.204 547 1HB PRO 72 1HB PRO 72 8.645 2.584 -12.868 548 2HB PRO 72 2HB PRO 72 7.582 2.578 -11.443 549 1HG PRO 72 1HG PRO 72 6.912 4.160 -13.539 550 2HG PRO 72 2HG PRO 72 6.818 4.847 -11.898 551 1HD PRO 72 1HD PRO 72 9.038 5.264 -13.976 552 2HD PRO 72 2HD PRO 72 8.287 6.470 -12.880 553 H ILE 73 H ILE 73 9.361 1.371 -11.112 554 HA ILE 73 HA ILE 73 12.208 0.857 -11.820 555 HB ILE 73 HB ILE 73 12.925 -0.201 -9.775 556 1HG1 ILE 73 1HG1 ILE 73 10.669 -1.048 -9.049 557 2HG1 ILE 73 2HG1 ILE 73 11.623 -0.340 -7.742 558 1HG2 ILE 73 2HG2 ILE 73 13.303 2.269 -9.955 559 2HG2 ILE 73 3HG2 ILE 73 11.744 2.580 -9.146 560 3HG2 ILE 73 1HG2 ILE 73 13.070 1.787 -8.255 561 1HD1 ILE 73 2HD1 ILE 73 10.331 1.829 -7.945 562 2HD1 ILE 73 3HD1 ILE 73 9.348 1.113 -9.251 563 3HD1 ILE 73 1HD1 ILE 73 9.255 0.450 -7.599 564 H LYS 74 H LYS 74 12.732 -1.270 -12.017 565 HA LYS 74 HA LYS 74 11.094 -2.943 -13.483 566 1HB LYS 74 1HB LYS 74 12.965 -3.926 -11.247 567 2HB LYS 74 2HB LYS 74 12.331 -4.929 -12.556 568 1HG LYS 74 1HG LYS 74 14.600 -4.139 -13.139 569 2HG LYS 74 2HG LYS 74 13.410 -3.492 -14.271 570 1HD LYS 74 1HD LYS 74 13.364 -1.312 -12.996 571 2HD LYS 74 2HD LYS 74 14.551 -1.923 -11.853 572 1HE LYS 74 1HE LYS 74 15.054 -1.580 -14.894 573 2HE LYS 74 2HE LYS 74 15.475 -0.387 -13.668 574 1HZ LYS 74 3HZ LYS 74 16.978 -2.010 -12.650 575 2HZ LYS 74 1HZ LYS 74 16.594 -3.143 -13.790 576 3HZ LYS 74 2HZ LYS 74 17.373 -1.756 -14.234 577 H ASN 75 H ASN 75 9.495 -4.208 -13.339 578 HA ASN 75 HA ASN 75 7.464 -4.114 -11.323 579 1HB ASN 75 1HB ASN 75 6.586 -6.208 -12.338 580 2HB ASN 75 2HB ASN 75 7.128 -5.083 -13.591 581 1HD2 ASN 75 1HD2 ASN 75 8.702 -8.153 -14.737 582 2HD2 ASN 75 2HD2 ASN 75 7.150 -7.174 -14.783 583 H GLU 76 H GLU 76 6.846 -6.669 -10.609 584 HA GLU 76 HA GLU 76 8.692 -8.411 -9.446 585 1HB GLU 76 1HB GLU 76 8.222 -6.103 -7.471 586 2HB GLU 76 2HB GLU 76 9.181 -7.557 -7.166 587 1HG GLU 76 1HG GLU 76 9.740 -5.388 -9.297 588 2HG GLU 76 2HG GLU 76 10.655 -5.633 -7.810 589 H ALA 77 H ALA 77 5.977 -8.253 -10.212 590 HA ALA 77 HA ALA 77 4.237 -8.857 -7.843 591 1HB ALA 77 2HB ALA 77 3.220 -8.154 -10.033 592 2HB ALA 77 3HB ALA 77 3.874 -9.618 -10.817 593 3HB ALA 77 1HB ALA 77 2.641 -9.764 -9.539 594 H ASP 78 H ASP 78 6.068 -10.625 -10.281 595 HA ASP 78 HA ASP 78 5.265 -13.311 -9.454 596 1HB ASP 78 1HB ASP 78 7.137 -14.088 -10.869 597 2HB ASP 78 2HB ASP 78 6.168 -12.857 -11.682 598 H ASN 79 H ASN 79 8.285 -11.501 -8.938 599 HA ASN 79 HA ASN 79 9.460 -13.398 -7.007 600 1HB ASN 79 1HB ASN 79 11.034 -11.589 -6.466 601 2HB ASN 79 2HB ASN 79 10.828 -11.696 -8.221 602 1HD2 ASN 79 1HD2 ASN 79 10.497 -8.087 -7.109 603 2HD2 ASN 79 2HD2 ASN 79 11.740 -9.416 -6.882 604 H GLY 80 H GLY 80 7.394 -12.816 -4.224 605 1HA GLY 80 1HA GLY 80 7.556 -14.589 -6.484 606 2HA GLY 80 2HA GLY 80 9.206 -14.567 -5.824 607 H LEU 81 H LEU 81 6.046 -14.365 -4.271 608 HA LEU 81 HA LEU 81 6.338 -17.121 -3.023 609 1HB LEU 81 1HB LEU 81 5.937 -14.604 -1.284 610 2HB LEU 81 2HB LEU 81 5.982 -16.281 -0.743 611 HG LEU 81 HG LEU 81 8.144 -15.485 -0.245 612 1HD1 LEU 81 2HD1 LEU 81 8.207 -17.672 -1.483 613 2HD1 LEU 81 3HD1 LEU 81 8.385 -16.803 -3.029 614 3HD1 LEU 81 1HD1 LEU 81 9.677 -16.717 -1.804 615 1HD2 LEU 81 3HD2 LEU 81 8.023 -13.324 -1.489 616 2HD2 LEU 81 1HD2 LEU 81 9.569 -14.151 -1.806 617 3HD2 LEU 81 2HD2 LEU 81 8.276 -14.178 -3.033 618 NH1 ARG 82 NH2 ARG 82 6.433 -18.453 -5.310 619 NH2 ARG 82 NH1 ARG 82 5.796 -17.797 -7.391 620 H ARG 82 H ARG 82 4.332 -16.397 -1.057 621 HA ARG 82 HA ARG 82 1.892 -15.366 -2.228 622 1HB ARG 82 1HB ARG 82 2.019 -18.440 -2.337 623 2HB ARG 82 2HB ARG 82 0.656 -17.414 -2.785 624 1HG ARG 82 1HG ARG 82 1.758 -18.057 -4.843 625 2HG ARG 82 2HG ARG 82 2.060 -16.334 -4.597 626 1HD ARG 82 1HD ARG 82 4.367 -16.865 -3.671 627 2HD ARG 82 2HD ARG 82 4.041 -18.598 -3.861 628 HE ARG 82 HE ARG 82 3.690 -17.148 -6.433 629 1HH1 ARG 82 2HH2 ARG 82 6.182 -18.551 -4.320 630 2HH1 ARG 82 1HH2 ARG 82 7.318 -18.723 -5.751 631 1HH2 ARG 82 1HH1 ARG 82 5.069 -17.392 -7.990 632 2HH2 ARG 82 2HH1 ARG 82 6.726 -18.111 -7.684 633 H ASN 83 H ASN 83 0.154 -15.511 -0.938 634 HA ASN 83 HA ASN 83 -0.021 -17.193 1.479 635 1HB ASN 83 1HB ASN 83 1.939 -15.713 2.080 636 2HB ASN 83 2HB ASN 83 0.872 -14.301 1.981 637 1HD2 ASN 83 1HD2 ASN 83 0.821 -15.351 5.542 638 2HD2 ASN 83 2HD2 ASN 83 1.974 -14.622 4.315 639 H THR 84 H THR 84 -0.993 -14.438 2.629 640 HA THR 84 HA THR 84 -3.820 -14.360 1.490 641 HB THR 84 HB THR 84 -2.786 -15.724 4.036 642 HG1 THR 84 HG1 THR 84 -4.447 -16.550 1.886 643 1HG2 THR 84 3HG2 THR 84 -5.708 -15.045 3.314 644 2HG2 THR 84 1HG2 THR 84 -5.200 -16.109 4.664 645 3HG2 THR 84 2HG2 THR 84 -4.776 -14.377 4.677 646 NH1 ARG 85 NH2 ARG 85 -9.569 -11.799 6.735 647 NH2 ARG 85 NH1 ARG 85 -8.803 -12.062 8.858 648 H ARG 85 H ARG 85 -5.235 -13.164 2.670 649 HA ARG 85 HA ARG 85 -4.962 -10.586 3.634 650 1HB ARG 85 1HB ARG 85 -6.625 -11.205 5.478 651 2HB ARG 85 2HB ARG 85 -7.092 -11.810 3.877 652 1HG ARG 85 1HG ARG 85 -6.072 -14.023 4.354 653 2HG ARG 85 2HG ARG 85 -5.475 -13.483 5.911 654 1HD ARG 85 1HD ARG 85 -8.491 -13.650 5.180 655 2HD ARG 85 2HD ARG 85 -7.589 -14.954 5.914 656 HE ARG 85 HE ARG 85 -7.276 -13.694 8.008 657 1HH1 ARG 85 2HH2 ARG 85 -9.502 -12.078 5.750 658 2HH1 ARG 85 1HH2 ARG 85 -10.210 -11.105 7.136 659 1HH2 ARG 85 1HH1 ARG 85 -8.154 -12.539 9.493 660 2HH2 ARG 85 2HH1 ARG 85 -9.497 -11.350 9.110 661 H GLY 86 H GLY 86 -3.450 -9.798 4.396 662 1HA GLY 86 1HA GLY 86 -2.385 -9.383 6.917 663 2HA GLY 86 2HA GLY 86 -1.735 -11.001 6.608 664 H THR 87 H THR 87 -1.768 -10.322 3.663 665 HA THR 87 HA THR 87 1.075 -9.182 3.603 666 HB THR 87 HB THR 87 1.047 -9.992 1.231 667 HG1 THR 87 HG1 THR 87 -1.440 -11.078 2.064 668 1HG2 THR 87 2HG2 THR 87 1.936 -11.404 3.099 669 2HG2 THR 87 3HG2 THR 87 0.307 -12.075 3.386 670 3HG2 THR 87 1HG2 THR 87 1.161 -12.418 1.853 671 H ILE 88 H ILE 88 1.677 -7.579 2.599 672 HA ILE 88 HA ILE 88 -0.272 -5.757 1.063 673 HB ILE 88 HB ILE 88 0.547 -4.217 2.438 674 1HG1 ILE 88 1HG1 ILE 88 2.914 -3.312 1.581 675 2HG1 ILE 88 2HG1 ILE 88 2.743 -4.566 0.394 676 1HG2 ILE 88 2HG2 ILE 88 1.806 -5.739 3.953 677 2HG2 ILE 88 3HG2 ILE 88 3.190 -5.740 2.824 678 3HG2 ILE 88 1HG2 ILE 88 2.724 -4.240 3.668 679 1HD1 ILE 88 2HD1 ILE 88 0.436 -3.541 -0.253 680 2HD1 ILE 88 3HD1 ILE 88 0.669 -2.311 1.013 681 3HD1 ILE 88 1HD1 ILE 88 1.744 -2.329 -0.407 682 H ALA 89 H ALA 89 0.589 -4.748 -0.723 683 HA ALA 89 HA ALA 89 2.768 -6.098 -2.308 684 1HB ALA 89 1HB ALA 89 0.873 -7.731 -2.602 685 2HB ALA 89 2HB ALA 89 -0.166 -6.423 -3.231 686 3HB ALA 89 3HB ALA 89 1.283 -6.930 -4.137 687 H MET 90 H MET 90 3.534 -5.032 -3.855 688 HA MET 90 HA MET 90 3.136 -2.169 -4.098 689 1HB MET 90 1HB MET 90 5.227 -3.343 -4.795 690 2HB MET 90 2HB MET 90 4.376 -4.054 -6.180 691 1HG MET 90 1HG MET 90 5.575 -1.931 -6.834 692 2HG MET 90 2HG MET 90 3.814 -1.769 -7.039 693 1HE MET 90 1HE MET 90 5.314 0.905 -6.976 694 2HE MET 90 3HE MET 90 3.528 0.825 -6.847 695 3HE MET 90 2HE MET 90 4.462 1.836 -5.707 696 H ALA 91 H ALA 91 2.084 -0.912 -5.339 697 HA ALA 91 HA ALA 91 -0.118 -2.058 -7.168 698 1HB ALA 91 3HB ALA 91 0.022 0.642 -5.680 699 2HB ALA 91 1HB ALA 91 -1.326 0.067 -6.695 700 3HB ALA 91 2HB ALA 91 -0.936 -0.775 -5.174 701 NH1 ARG 92 NH2 ARG 92 1.424 4.678 -12.609 702 NH2 ARG 92 NH1 ARG 92 2.638 4.497 -14.523 703 H ARG 92 H ARG 92 -0.051 -1.726 -9.145 704 HA ARG 92 HA ARG 92 0.566 0.748 -10.482 705 1HB ARG 92 1HB ARG 92 2.915 0.242 -9.711 706 2HB ARG 92 2HB ARG 92 2.891 -1.257 -10.650 707 1HG ARG 92 1HG ARG 92 3.965 0.598 -11.945 708 2HG ARG 92 2HG ARG 92 2.518 -0.012 -12.758 709 1HD ARG 92 1HD ARG 92 1.155 1.902 -11.796 710 2HD ARG 92 2HD ARG 92 2.603 2.524 -10.981 711 HE ARG 92 HE ARG 92 3.249 2.286 -13.808 712 1HH1 ARG 92 2HH2 ARG 92 1.114 4.237 -11.736 713 2HH1 ARG 92 1HH2 ARG 92 1.181 5.617 -12.943 714 1HH2 ARG 92 1HH1 ARG 92 3.253 3.923 -15.109 715 2HH2 ARG 92 2HH1 ARG 92 2.311 5.449 -14.722 716 H THR 93 H THR 93 1.121 0.434 -12.819 717 HA THR 93 HA THR 93 0.296 -2.067 -14.192 718 HB THR 93 HB THR 93 -1.708 0.268 -14.086 719 HG1 THR 93 HG1 THR 93 -1.712 -1.155 -12.309 720 1HG2 THR 93 1HG2 THR 93 -1.770 -2.409 -15.634 721 2HG2 THR 93 2HG2 THR 93 -3.093 -1.213 -15.580 722 3HG2 THR 93 3HG2 THR 93 -1.546 -0.797 -16.364 723 H ALA 94 H ALA 94 1.513 -2.047 -15.768 724 HA ALA 94 HA ALA 94 1.456 -0.406 -18.070 725 1HB ALA 94 3HB ALA 94 3.579 0.685 -16.095 726 2HB ALA 94 1HB ALA 94 3.392 1.181 -17.797 727 3HB ALA 94 2HB ALA 94 2.108 1.549 -16.620 728 H ASP 95 H ASP 95 3.845 -1.598 -15.771 729 HA ASP 95 HA ASP 95 5.438 -3.344 -15.948 730 1HB ASP 95 1HB ASP 95 5.257 -5.039 -17.622 731 2HB ASP 95 2HB ASP 95 3.611 -4.568 -17.182 732 H LYS 96 H LYS 96 7.057 -4.254 -17.658 733 HA LYS 96 HA LYS 96 9.015 -3.725 -19.002 734 1HB LYS 96 1HB LYS 96 7.426 -2.048 -20.207 735 2HB LYS 96 2HB LYS 96 7.973 -0.834 -19.047 736 1HG LYS 96 1HG LYS 96 9.372 -0.632 -21.029 737 2HG LYS 96 2HG LYS 96 10.384 -1.276 -19.743 738 1HD LYS 96 1HD LYS 96 9.051 -2.937 -21.988 739 2HD LYS 96 2HD LYS 96 10.715 -2.369 -22.005 740 1HE LYS 96 1HE LYS 96 11.252 -3.767 -19.961 741 2HE LYS 96 2HE LYS 96 9.580 -4.344 -19.908 742 1HZ LYS 96 1HZ LYS 96 9.901 -5.314 -22.124 743 2HZ LYS 96 2HZ LYS 96 11.463 -4.780 -22.176 744 3HZ LYS 96 3HZ LYS 96 11.012 -5.909 -21.057 745 H ASP 97 H ASP 97 7.828 -1.220 -16.846 746 HA ASP 97 HA ASP 97 9.918 -1.709 -14.795 747 1HB ASP 97 1HB ASP 97 9.956 0.975 -16.321 748 2HB ASP 97 2HB ASP 97 10.868 0.628 -14.841 749 H SER 98 H SER 98 7.537 -2.141 -14.434 750 HA SER 98 HA SER 98 5.677 0.084 -14.072 751 1HB SER 98 1HB SER 98 5.129 -2.323 -14.616 752 2HB SER 98 2HB SER 98 5.551 -2.780 -12.957 753 HG SER 98 HG SER 98 3.331 -2.370 -13.240 754 H ALA 99 H ALA 99 4.375 0.212 -12.121 755 HA ALA 99 HA ALA 99 4.124 1.034 -9.905 756 1HB ALA 99 2HB ALA 99 4.883 -1.242 -9.207 757 2HB ALA 99 3HB ALA 99 6.588 -0.723 -9.294 758 3HB ALA 99 1HB ALA 99 5.490 -0.002 -8.088 759 H THR 100 H THR 100 5.235 2.170 -8.150 760 HA THR 100 HA THR 100 7.581 3.910 -9.015 761 HB THR 100 HB THR 100 6.235 5.979 -8.721 762 HG1 THR 100 HG1 THR 100 3.977 5.730 -8.641 763 1HG2 THR 100 2HG2 THR 100 6.467 4.983 -11.026 764 2HG2 THR 100 3HG2 THR 100 5.002 4.001 -10.754 765 3HG2 THR 100 1HG2 THR 100 4.882 5.779 -10.834 766 H SER 101 H SER 101 4.964 3.461 -6.668 767 HA SER 101 HA SER 101 6.816 3.237 -4.375 768 1HB SER 101 1HB SER 101 6.234 5.397 -3.254 769 2HB SER 101 2HB SER 101 7.111 5.661 -4.772 770 HG SER 101 HG SER 101 5.280 6.986 -4.571 771 H GLN 102 H GLN 102 3.615 4.467 -5.250 772 HA GLN 102 HA GLN 102 2.120 3.886 -2.950 773 1HB GLN 102 1HB GLN 102 0.140 3.547 -4.397 774 2HB GLN 102 2HB GLN 102 1.128 4.888 -4.989 775 1HG GLN 102 1HG GLN 102 2.224 3.348 -6.667 776 2HG GLN 102 2HG GLN 102 1.257 1.997 -6.068 777 1HE2 GLN 102 2HE2 GLN 102 -1.784 3.093 -7.654 778 2HE2 GLN 102 1HE2 GLN 102 -1.044 2.083 -6.312 779 H PHE 103 H PHE 103 0.803 2.291 -2.263 780 HA PHE 103 HA PHE 103 0.925 -0.474 -3.294 781 1HB PHE 103 1HB PHE 103 2.048 -1.605 -1.515 782 2HB PHE 103 2HB PHE 103 3.143 -0.342 -2.071 783 HD1 PHE 103 HD1 PHE 103 1.108 1.752 -0.536 784 HD2 PHE 103 HD2 PHE 103 3.434 -1.598 0.543 785 HE1 PHE 103 HE1 PHE 103 1.221 2.562 1.754 786 HE2 PHE 103 HE2 PHE 103 3.543 -0.786 2.829 787 HZ PHE 103 HZ PHE 103 2.431 1.284 3.441 788 H PHE 104 H PHE 104 -0.092 -1.997 -1.697 789 HA PHE 104 HA PHE 104 -2.454 -0.694 -0.289 790 1HB PHE 104 1HB PHE 104 -4.137 -1.645 -1.709 791 2HB PHE 104 2HB PHE 104 -3.053 -0.716 -2.738 792 HD1 PHE 104 HD2 PHE 104 -1.093 -2.086 -3.822 793 HD2 PHE 104 HD1 PHE 104 -4.581 -3.860 -2.251 794 HE1 PHE 104 HE2 PHE 104 -0.735 -4.041 -5.226 795 HE2 PHE 104 HE1 PHE 104 -4.221 -5.812 -3.655 796 HZ PHE 104 HZ PHE 104 -2.310 -5.900 -5.153 797 H ILE 105 H ILE 105 -3.339 -1.696 1.073 798 HA ILE 105 HA ILE 105 -2.110 -4.319 2.051 799 HB ILE 105 HB ILE 105 -3.931 -2.252 3.399 800 1HG1 ILE 105 1HG1 ILE 105 -0.924 -2.898 3.580 801 2HG1 ILE 105 2HG1 ILE 105 -1.625 -1.467 2.817 802 1HG2 ILE 105 3HG2 ILE 105 -2.478 -4.725 4.546 803 2HG2 ILE 105 1HG2 ILE 105 -3.364 -3.504 5.500 804 3HG2 ILE 105 2HG2 ILE 105 -4.243 -4.551 4.355 805 1HD1 ILE 105 3HD1 ILE 105 -1.901 -2.199 5.813 806 2HD1 ILE 105 1HD1 ILE 105 -0.836 -0.936 5.142 807 3HD1 ILE 105 2HD1 ILE 105 -2.608 -0.752 5.043 808 H ASN 106 H ASN 106 -2.972 -6.082 1.554 809 HA ASN 106 HA ASN 106 -5.721 -6.467 0.526 810 1HB ASN 106 1HB ASN 106 -3.739 -8.521 1.687 811 2HB ASN 106 2HB ASN 106 -5.202 -8.906 0.768 812 1HD2 ASN 106 1HD2 ASN 106 -3.691 -7.065 -2.192 813 2HD2 ASN 106 2HD2 ASN 106 -5.087 -6.735 -1.048 814 H VAL 107 H VAL 107 -7.444 -6.314 1.613 815 HA VAL 107 HA VAL 107 -7.460 -6.470 4.649 816 HB VAL 107 HB VAL 107 -9.644 -5.662 2.659 817 1HG1 VAL 107 3HG2 VAL 107 -10.509 -6.418 4.896 818 2HG1 VAL 107 1HG2 VAL 107 -9.379 -5.313 5.720 819 3HG1 VAL 107 2HG2 VAL 107 -10.696 -4.654 4.713 820 1HG2 VAL 107 2HG1 VAL 107 -7.615 -4.188 2.552 821 2HG2 VAL 107 3HG1 VAL 107 -8.975 -3.327 3.323 822 3HG2 VAL 107 1HG1 VAL 107 -7.649 -3.988 4.322 823 H ALA 108 H ALA 108 -7.315 -8.820 2.719 824 HA ALA 108 HA ALA 108 -8.639 -10.794 4.319 825 1HB ALA 108 2HB ALA 108 -10.791 -9.654 3.685 826 2HB ALA 108 3HB ALA 108 -10.438 -9.923 1.958 827 3HB ALA 108 1HB ALA 108 -10.735 -11.311 3.036 828 H ASP 109 H ASP 109 -9.185 -12.795 3.188 829 HA ASP 109 HA ASP 109 -6.987 -14.036 1.968 830 1HB ASP 109 1HB ASP 109 -9.934 -14.550 1.248 831 2HB ASP 109 2HB ASP 109 -8.599 -15.675 0.952 832 H ASN 110 H ASN 110 -6.181 -14.400 0.060 833 HA ASN 110 HA ASN 110 -7.310 -13.498 -2.516 834 1HB ASN 110 1HB ASN 110 -6.771 -11.257 -1.493 835 2HB ASN 110 2HB ASN 110 -5.084 -11.748 -1.294 836 1HD2 ASN 110 1HD2 ASN 110 -6.554 -10.974 -5.097 837 2HD2 ASN 110 2HD2 ASN 110 -7.668 -11.387 -3.699 838 H ALA 111 H ALA 111 -6.063 -13.793 -4.239 839 HA ALA 111 HA ALA 111 -3.338 -14.743 -4.382 840 1HB ALA 111 3HB ALA 111 -5.396 -17.044 -4.182 841 2HB ALA 111 1HB ALA 111 -3.671 -17.219 -4.606 842 3HB ALA 111 2HB ALA 111 -4.132 -16.672 -2.973 843 H PHE 112 H PHE 112 -6.584 -15.557 -5.487 844 HA PHE 112 HA PHE 112 -5.998 -15.587 -8.403 845 1HB PHE 112 1HB PHE 112 -8.499 -15.222 -8.595 846 2HB PHE 112 2HB PHE 112 -8.051 -16.617 -7.616 847 HD1 PHE 112 HD2 PHE 112 -8.590 -12.936 -7.101 848 HD2 PHE 112 HD1 PHE 112 -9.143 -16.838 -5.592 849 HE1 PHE 112 HE2 PHE 112 -9.853 -12.039 -5.231 850 HE2 PHE 112 HE1 PHE 112 -10.408 -15.935 -3.727 851 HZ PHE 112 HZ PHE 112 -10.765 -13.536 -3.544 852 H LEU 113 H LEU 113 -4.458 -13.843 -7.956 853 HA LEU 113 HA LEU 113 -5.317 -11.241 -8.996 854 1HB LEU 113 1HB LEU 113 -6.415 -11.158 -6.682 855 2HB LEU 113 2HB LEU 113 -4.810 -11.336 -5.954 856 HG LEU 113 HG LEU 113 -4.052 -9.296 -7.314 857 1HD1 LEU 113 2HD1 LEU 113 -5.848 -9.432 -9.071 858 2HD1 LEU 113 3HD1 LEU 113 -7.088 -9.056 -7.848 859 3HD1 LEU 113 1HD1 LEU 113 -5.862 -7.834 -8.278 860 1HD2 LEU 113 3HD2 LEU 113 -4.676 -9.076 -4.897 861 2HD2 LEU 113 1HD2 LEU 113 -5.162 -7.626 -5.808 862 3HD2 LEU 113 2HD2 LEU 113 -6.386 -8.837 -5.343 863 H ASP 114 H ASP 114 -3.124 -13.021 -6.904 864 HA ASP 114 HA ASP 114 -0.918 -11.409 -6.559 865 1HB ASP 114 1HB ASP 114 -0.744 -14.287 -7.640 866 2HB ASP 114 2HB ASP 114 0.561 -13.425 -6.809 867 H HIS 115 H HIS 115 -1.209 -13.475 -9.417 868 HA HIS 115 HA HIS 115 -0.463 -11.500 -11.426 869 1HB HIS 115 1HB HIS 115 1.690 -11.262 -10.347 870 2HB HIS 115 2HB HIS 115 1.857 -12.997 -10.073 871 HD2 HIS 115 HD2 HIS 115 4.173 -13.042 -11.389 872 HE1 HIS 115 HE1 HIS 115 2.596 -12.539 -15.206 873 HE2 HIS 115 HE2 HIS 115 4.759 -13.207 -13.969 874 H GLY 116 H GLY 116 -2.112 -12.606 -12.255 875 1HA GLY 116 1HA GLY 116 -1.513 -14.525 -14.315 876 2HA GLY 116 2HA GLY 116 -2.066 -15.498 -12.934 877 H GLN 117 H GLN 117 -2.887 -13.432 -15.478 878 HA GLN 117 HA GLN 117 -5.669 -14.155 -15.588 879 1HB GLN 117 1HB GLN 117 -5.883 -12.927 -13.422 880 2HB GLN 117 2HB GLN 117 -5.212 -11.464 -14.159 881 1HG GLN 117 1HG GLN 117 -7.110 -11.464 -15.846 882 2HG GLN 117 2HG GLN 117 -7.789 -12.897 -15.072 883 1HE2 GLN 117 2HE2 GLN 117 -8.542 -9.240 -13.470 884 2HE2 GLN 117 1HE2 GLN 117 -7.655 -9.516 -15.052 885 NH1 ARG 118 NH2 ARG 118 -9.421 -9.524 -20.079 886 NH2 ARG 118 NH1 ARG 118 -8.579 -7.677 -21.103 887 H ARG 118 H ARG 118 -4.897 -10.774 -15.761 888 HA ARG 118 HA ARG 118 -5.590 -10.622 -18.622 889 1HB ARG 118 1HB ARG 118 -4.196 -8.588 -16.792 890 2HB ARG 118 2HB ARG 118 -4.800 -8.240 -18.416 891 1HG ARG 118 1HG ARG 118 -6.446 -9.210 -16.005 892 2HG ARG 118 2HG ARG 118 -6.503 -7.593 -16.691 893 1HD ARG 118 1HD ARG 118 -7.352 -10.184 -18.173 894 2HD ARG 118 2HD ARG 118 -8.459 -9.112 -17.312 895 HE ARG 118 HE ARG 118 -7.074 -7.454 -19.246 896 1HH1 ARG 118 2HH2 ARG 118 -9.387 -10.157 -19.272 897 2HH1 ARG 118 1HH2 ARG 118 -10.050 -9.591 -20.887 898 1HH2 ARG 118 1HH1 ARG 118 -7.905 -6.903 -21.082 899 2HH2 ARG 118 2HH1 ARG 118 -9.266 -7.873 -21.840 900 H ASP 119 H ASP 119 -2.547 -10.344 -16.826 901 HA ASP 119 HA ASP 119 -0.899 -11.448 -19.030 902 1HB ASP 119 1HB ASP 119 -1.517 -9.213 -20.000 903 2HB ASP 119 2HB ASP 119 -0.857 -8.402 -18.569 904 H PHE 120 H PHE 120 -0.894 -9.153 -16.332 905 HA PHE 120 HA PHE 120 0.946 -10.696 -14.652 906 1HB PHE 120 1HB PHE 120 2.457 -10.059 -16.635 907 2HB PHE 120 2HB PHE 120 2.269 -8.366 -16.182 908 HD1 PHE 120 HD2 PHE 120 2.510 -8.202 -13.382 909 HD2 PHE 120 HD1 PHE 120 4.465 -10.935 -15.936 910 HE1 PHE 120 HE2 PHE 120 4.309 -8.435 -11.766 911 HE2 PHE 120 HE1 PHE 120 6.255 -11.168 -14.315 912 HZ PHE 120 HZ PHE 120 6.180 -9.919 -12.229 913 H GLY 121 H GLY 121 -0.703 -10.138 -13.382 914 1HA GLY 121 1HA GLY 121 -1.772 -7.466 -13.021 915 2HA GLY 121 2HA GLY 121 -2.084 -8.831 -11.955 916 OH TYR 122 OH TYR 122 -6.317 -4.776 -10.117 917 H TYR 122 H TYR 122 -1.884 -8.237 -10.078 918 HA TYR 122 HA TYR 122 -0.354 -5.862 -9.241 919 1HB TYR 122 1HB TYR 122 -1.859 -7.919 -7.525 920 2HB TYR 122 2HB TYR 122 -1.360 -6.305 -7.017 921 HD1 TYR 122 HD2 TYR 122 -3.569 -8.178 -9.274 922 HD2 TYR 122 HD1 TYR 122 -2.520 -4.355 -7.825 923 HE1 TYR 122 HE2 TYR 122 -5.597 -7.252 -10.244 924 HE2 TYR 122 HE1 TYR 122 -4.550 -3.432 -8.797 925 HH TYR 122 HH TYR 122 -6.802 -5.479 -10.555 926 H ALA 123 H ALA 123 1.138 -5.590 -7.789 927 HA ALA 123 HA ALA 123 3.286 -7.691 -7.554 928 1HB ALA 123 2HB ALA 123 3.861 -5.298 -8.019 929 2HB ALA 123 3HB ALA 123 3.142 -4.808 -6.461 930 3HB ALA 123 1HB ALA 123 4.590 -5.848 -6.491 931 H VAL 124 H VAL 124 4.362 -6.951 -5.178 932 HA VAL 124 HA VAL 124 2.753 -7.228 -2.789 933 HB VAL 124 HB VAL 124 3.755 -9.916 -3.923 934 1HG1 VAL 124 3HG2 VAL 124 4.231 -9.674 -1.473 935 2HG1 VAL 124 1HG2 VAL 124 2.529 -9.241 -1.171 936 3HG1 VAL 124 2HG2 VAL 124 2.945 -10.877 -1.749 937 1HG2 VAL 124 1HG1 VAL 124 0.906 -8.985 -3.175 938 2HG2 VAL 124 2HG1 VAL 124 1.512 -9.262 -4.829 939 3HG2 VAL 124 3HG1 VAL 124 1.356 -10.631 -3.699 940 H PHE 125 H PHE 125 4.052 -6.962 -1.060 941 HA PHE 125 HA PHE 125 6.822 -8.082 -1.005 942 1HB PHE 125 1HB PHE 125 8.061 -6.014 -1.071 943 2HB PHE 125 2HB PHE 125 7.042 -6.050 -2.509 944 HD1 PHE 125 HD2 PHE 125 4.648 -4.972 -2.162 945 HD2 PHE 125 HD1 PHE 125 7.974 -4.124 0.289 946 HE1 PHE 125 HE2 PHE 125 3.598 -2.895 -1.452 947 HE2 PHE 125 HE1 PHE 125 6.923 -2.050 0.995 948 HZ PHE 125 HZ PHE 125 4.734 -1.437 0.130 949 H GLY 126 H GLY 126 4.213 -7.702 0.710 950 1HA GLY 126 1HA GLY 126 5.807 -8.022 3.214 951 2HA GLY 126 2HA GLY 126 4.926 -6.492 3.181 952 H LYS 127 H LYS 127 3.350 -6.561 4.251 953 HA LYS 127 HA LYS 127 1.133 -8.307 4.430 954 1HB LYS 127 1HB LYS 127 3.309 -9.192 6.420 955 2HB LYS 127 2HB LYS 127 1.643 -9.795 6.378 956 1HG LYS 127 1HG LYS 127 1.989 -10.662 4.039 957 2HG LYS 127 2HG LYS 127 3.587 -9.940 4.000 958 1HD LYS 127 1HD LYS 127 3.952 -12.245 4.329 959 2HD LYS 127 2HD LYS 127 4.359 -11.510 5.860 960 1HE LYS 127 1HE LYS 127 1.628 -12.880 5.278 961 2HE LYS 127 2HE LYS 127 3.037 -13.750 5.874 962 1HZ LYS 127 1HZ LYS 127 3.040 -12.350 7.857 963 2HZ LYS 127 2HZ LYS 127 1.716 -11.517 7.325 964 3HZ LYS 127 3HZ LYS 127 1.592 -13.125 7.685 965 H VAL 128 H VAL 128 1.550 -8.613 7.434 966 HA VAL 128 HA VAL 128 1.382 -5.740 8.425 967 HB VAL 128 HB VAL 128 -0.969 -7.717 8.578 968 1HG1 VAL 128 3HG2 VAL 128 -0.702 -6.293 10.631 969 2HG1 VAL 128 1HG2 VAL 128 -0.640 -4.826 9.620 970 3HG1 VAL 128 2HG2 VAL 128 -2.138 -5.793 9.700 971 1HG2 VAL 128 2HG1 VAL 128 -0.692 -6.682 6.304 972 2HG2 VAL 128 3HG1 VAL 128 -2.132 -6.024 7.125 973 3HG2 VAL 128 1HG1 VAL 128 -0.634 -5.058 7.037 974 H VAL 129 H VAL 129 2.342 -5.572 10.128 975 HA VAL 129 HA VAL 129 3.100 -7.847 11.943 976 HB VAL 129 HB VAL 129 4.627 -5.947 11.679 977 1HG1 VAL 129 3HG2 VAL 129 2.925 -4.161 11.193 978 2HG1 VAL 129 1HG2 VAL 129 2.355 -4.233 12.880 979 3HG1 VAL 129 2HG2 VAL 129 4.007 -3.665 12.521 980 1HG2 VAL 129 2HG1 VAL 129 4.560 -7.168 13.868 981 2HG2 VAL 129 3HG1 VAL 129 4.965 -5.449 14.117 982 3HG2 VAL 129 1HG1 VAL 129 3.320 -6.039 14.474 983 H LYS 130 H LYS 130 1.004 -5.026 11.960 984 HA LYS 130 HA LYS 130 -1.203 -6.434 13.312 985 1HB LYS 130 1HB LYS 130 0.279 -4.280 14.942 986 2HB LYS 130 2HB LYS 130 -1.295 -4.977 15.357 987 1HG LYS 130 1HG LYS 130 -0.236 -7.293 15.427 988 2HG LYS 130 2HG LYS 130 1.313 -6.580 15.008 989 1HD LYS 130 1HD LYS 130 1.387 -6.965 17.362 990 2HD LYS 130 2HD LYS 130 1.277 -5.221 17.160 991 1HE LYS 130 1HE LYS 130 -1.224 -5.335 17.699 992 2HE LYS 130 2HE LYS 130 -1.099 -7.091 17.871 993 1HZ LYS 130 3HZ LYS 130 0.480 -6.735 19.701 994 2HZ LYS 130 1HZ LYS 130 0.362 -5.095 19.535 995 3HZ LYS 130 2HZ LYS 130 -0.954 -5.975 20.007 996 H GLY 131 H GLY 131 -1.761 -3.716 14.601 997 1HA GLY 131 1HA GLY 131 -2.969 -1.734 14.031 998 2HA GLY 131 2HA GLY 131 -2.000 -1.663 12.562 999 H MET 132 H MET 132 -3.203 -4.509 12.026 1000 HA MET 132 HA MET 132 -4.977 -3.933 9.950 1001 1HB MET 132 1HB MET 132 -4.169 -6.252 10.743 1002 2HB MET 132 2HB MET 132 -5.505 -6.252 11.902 1003 1HG MET 132 1HG MET 132 -6.178 -7.426 9.827 1004 2HG MET 132 2HG MET 132 -7.136 -5.933 9.965 1005 1HE MET 132 3HE MET 132 -7.492 -6.601 7.186 1006 2HE MET 132 2HE MET 132 -6.128 -6.535 6.031 1007 3HE MET 132 1HE MET 132 -6.208 -7.850 7.238 1008 H ASP 133 H ASP 133 -5.783 -4.238 13.358 1009 HA ASP 133 HA ASP 133 -8.613 -3.825 13.402 1010 1HB ASP 133 1HB ASP 133 -6.511 -2.479 15.207 1011 2HB ASP 133 2HB ASP 133 -8.233 -2.620 15.575 1012 H VAL 134 H VAL 134 -6.074 -1.347 13.485 1013 HA VAL 134 HA VAL 134 -7.649 1.018 13.184 1014 HB VAL 134 HB VAL 134 -4.974 0.436 11.781 1015 1HG1 VAL 134 3HG2 VAL 134 -6.186 2.454 10.888 1016 2HG1 VAL 134 1HG2 VAL 134 -6.371 3.088 12.543 1017 3HG1 VAL 134 2HG2 VAL 134 -4.747 2.945 11.820 1018 1HG2 VAL 134 2HG1 VAL 134 -4.869 0.066 14.269 1019 2HG2 VAL 134 3HG1 VAL 134 -3.969 1.535 13.807 1020 3HG2 VAL 134 1HG1 VAL 134 -5.585 1.677 14.546 1021 H ALA 135 H ALA 135 -6.154 -0.898 10.617 1022 HA ALA 135 HA ALA 135 -7.294 0.279 8.288 1023 1HB ALA 135 2HB ALA 135 -5.684 -1.652 8.202 1024 2HB ALA 135 3HB ALA 135 -6.947 -2.751 8.817 1025 3HB ALA 135 1HB ALA 135 -7.128 -1.989 7.216 1026 H ASP 136 H ASP 136 -8.633 -2.314 10.278 1027 HA ASP 136 HA ASP 136 -11.244 -2.597 9.032 1028 1HB ASP 136 1HB ASP 136 -10.483 -2.786 12.013 1029 2HB ASP 136 2HB ASP 136 -11.998 -3.376 11.311 1030 H LYS 137 H LYS 137 -10.427 -0.896 12.002 1031 HA LYS 137 HA LYS 137 -12.698 0.671 12.491 1032 1HB LYS 137 1HB LYS 137 -10.599 0.729 13.861 1033 2HB LYS 137 2HB LYS 137 -9.782 1.646 12.590 1034 1HG LYS 137 1HG LYS 137 -10.606 3.189 14.351 1035 2HG LYS 137 2HG LYS 137 -11.401 3.517 12.808 1036 1HD LYS 137 1HD LYS 137 -13.415 2.168 13.552 1037 2HD LYS 137 2HD LYS 137 -12.621 1.831 15.095 1038 1HE LYS 137 1HE LYS 137 -12.563 4.324 15.610 1039 2HE LYS 137 2HE LYS 137 -13.364 4.659 14.068 1040 1HZ LYS 137 1HZ LYS 137 -15.267 3.336 14.837 1041 2HZ LYS 137 2HZ LYS 137 -14.518 3.024 16.277 1042 3HZ LYS 137 3HZ LYS 137 -14.948 4.571 15.888 1043 H ILE 138 H ILE 138 -9.996 1.594 10.391 1044 HA ILE 138 HA ILE 138 -11.175 4.077 9.377 1045 HB ILE 138 HB ILE 138 -9.160 2.201 8.008 1046 1HG1 ILE 138 1HG1 ILE 138 -8.896 4.606 9.905 1047 2HG1 ILE 138 2HG1 ILE 138 -8.355 2.954 10.216 1048 1HG2 ILE 138 2HG2 ILE 138 -10.279 3.820 6.441 1049 2HG2 ILE 138 3HG2 ILE 138 -9.881 5.169 7.540 1050 3HG2 ILE 138 1HG2 ILE 138 -8.575 4.277 6.715 1051 1HD1 ILE 138 3HD1 ILE 138 -7.248 4.820 7.999 1052 2HD1 ILE 138 1HD1 ILE 138 -6.421 4.417 9.524 1053 3HD1 ILE 138 2HD1 ILE 138 -6.688 3.153 8.294 1054 H SER 139 H SER 139 -10.818 0.899 7.871 1055 HA SER 139 HA SER 139 -12.436 1.384 5.551 1056 1HB SER 139 1HB SER 139 -12.590 -1.102 5.354 1057 2HB SER 139 2HB SER 139 -10.945 -0.567 5.748 1058 HG SER 139 HG SER 139 -11.652 -2.289 7.051 1059 H GLN 140 H GLN 140 -13.507 1.356 8.611 1060 HA GLN 140 HA GLN 140 -16.348 0.397 7.928 1061 1HB GLN 140 1HB GLN 140 -15.229 1.192 10.676 1062 2HB GLN 140 2HB GLN 140 -16.806 0.475 10.314 1063 1HG GLN 140 1HG GLN 140 -14.036 -0.807 10.038 1064 2HG GLN 140 2HG GLN 140 -15.421 -1.402 10.962 1065 1HE2 GLN 140 2HE2 GLN 140 -15.034 -2.220 6.947 1066 2HE2 GLN 140 1HE2 GLN 140 -13.792 -1.383 7.993 1067 H VAL 141 H VAL 141 -14.509 3.118 9.207 1068 HA VAL 141 HA VAL 141 -16.634 5.011 9.671 1069 HB VAL 141 HB VAL 141 -14.284 5.456 10.278 1070 1HG1 VAL 141 3HG2 VAL 141 -13.198 4.447 8.243 1071 2HG1 VAL 141 1HG2 VAL 141 -13.848 5.763 7.231 1072 3HG1 VAL 141 2HG2 VAL 141 -12.636 6.122 8.489 1073 1HG2 VAL 141 2HG1 VAL 141 -15.887 7.369 10.006 1074 2HG2 VAL 141 3HG1 VAL 141 -14.237 7.863 9.542 1075 3HG2 VAL 141 1HG1 VAL 141 -15.451 7.507 8.284 1076 HA PRO 142 HA PRO 142 -18.774 5.488 5.914 1077 1HB PRO 142 1HB PRO 142 -18.920 8.310 7.090 1078 2HB PRO 142 2HB PRO 142 -20.247 7.337 6.407 1079 1HG PRO 142 1HG PRO 142 -20.002 7.456 9.105 1080 2HG PRO 142 2HG PRO 142 -20.271 5.863 8.354 1081 1HD PRO 142 1HD PRO 142 -17.622 7.023 9.374 1082 2HD PRO 142 2HD PRO 142 -18.247 5.350 9.540 1083 H THR 143 H THR 143 -18.979 7.027 4.164 1084 HA THR 143 HA THR 143 -16.647 8.806 3.440 1085 HB THR 143 HB THR 143 -16.368 7.424 1.249 1086 HG1 THR 143 HG1 THR 143 -16.747 5.209 1.550 1087 1HG2 THR 143 2HG2 THR 143 -14.600 7.615 2.965 1088 2HG2 THR 143 3HG2 THR 143 -15.311 6.246 3.879 1089 3HG2 THR 143 1HG2 THR 143 -14.622 5.982 2.242 1090 H HIS 144 H HIS 144 -16.997 7.925 0.789 1091 HA HIS 144 HA HIS 144 -19.657 7.991 -0.208 1092 1HB HIS 144 1HB HIS 144 -20.182 10.226 -0.908 1093 2HB HIS 144 2HB HIS 144 -19.800 10.291 0.808 1094 HD2 HIS 144 HD2 HIS 144 -16.488 10.022 -0.918 1095 HE1 HIS 144 HE1 HIS 144 -17.265 14.100 -0.974 1096 HE2 HIS 144 HE2 HIS 144 -15.391 12.386 -1.359 1097 H ASP 145 H ASP 145 -19.995 8.263 -2.318 1098 HA ASP 145 HA ASP 145 -17.955 7.468 -4.268 1099 1HB ASP 145 1HB ASP 145 -20.489 7.410 -4.551 1100 2HB ASP 145 2HB ASP 145 -20.487 9.170 -4.673 1101 H VAL 146 H VAL 146 -17.645 9.103 -6.190 1102 HA VAL 146 HA VAL 146 -17.079 11.935 -5.370 1103 HB VAL 146 HB VAL 146 -14.581 10.523 -6.275 1104 1HG1 VAL 146 3HG2 VAL 146 -14.761 13.008 -5.873 1105 2HG1 VAL 146 1HG2 VAL 146 -15.235 12.695 -4.183 1106 3HG1 VAL 146 2HG2 VAL 146 -13.600 12.258 -4.736 1107 1HG2 VAL 146 1HG1 VAL 146 -15.535 10.281 -3.359 1108 2HG2 VAL 146 2HG1 VAL 146 -15.311 8.929 -4.505 1109 3HG2 VAL 146 3HG1 VAL 146 -13.905 9.884 -3.973 1110 H GLY 147 H GLY 147 -14.861 11.873 -7.390 1111 1HA GLY 147 1HA GLY 147 -16.421 12.474 -9.874 1112 2HA GLY 147 2HA GLY 147 -14.656 12.341 -9.759 1113 HA PRO 148 HA PRO 148 -15.089 8.332 -11.778 1114 1HB PRO 148 1HB PRO 148 -12.381 7.857 -11.831 1115 2HB PRO 148 2HB PRO 148 -13.118 9.128 -12.838 1116 1HG PRO 148 1HG PRO 148 -11.766 9.476 -10.104 1117 2HG PRO 148 2HG PRO 148 -11.421 10.379 -11.601 1118 1HD PRO 148 1HD PRO 148 -13.141 11.378 -9.659 1119 2HD PRO 148 2HD PRO 148 -13.464 11.671 -11.399 1120 OH TYR 149 OH TYR 149 -7.261 7.895 -9.983 1121 H TYR 149 H TYR 149 -12.935 9.004 -9.050 1122 HA TYR 149 HA TYR 149 -12.717 6.237 -8.107 1123 1HB TYR 149 1HB TYR 149 -12.200 8.892 -6.643 1124 2HB TYR 149 2HB TYR 149 -11.771 7.299 -6.015 1125 HD1 TYR 149 HD2 TYR 149 -11.339 9.422 -9.041 1126 HD2 TYR 149 HD1 TYR 149 -9.753 6.335 -6.638 1127 HE1 TYR 149 HE2 TYR 149 -9.304 9.435 -10.366 1128 HE2 TYR 149 HE1 TYR 149 -7.719 6.350 -7.962 1129 HH TYR 149 HH TYR 149 -6.662 7.227 -9.641 1130 H GLN 150 H GLN 150 -14.311 5.146 -7.564 1131 HA GLN 150 HA GLN 150 -16.552 6.148 -5.756 1132 1HB GLN 150 1HB GLN 150 -15.988 3.343 -6.897 1133 2HB GLN 150 2HB GLN 150 -17.438 3.839 -6.015 1134 1HG GLN 150 1HG GLN 150 -16.470 5.025 -8.696 1135 2HG GLN 150 2HG GLN 150 -17.797 3.874 -8.503 1136 1HE2 GLN 150 2HE2 GLN 150 -20.017 6.636 -8.233 1137 2HE2 GLN 150 1HE2 GLN 150 -19.558 5.030 -8.998 1138 H ASN 151 H ASN 151 -14.558 6.738 -4.448 1139 HA ASN 151 HA ASN 151 -14.285 5.007 -2.086 1140 1HB ASN 151 1HB ASN 151 -11.987 4.157 -2.451 1141 2HB ASN 151 2HB ASN 151 -13.091 3.521 -3.679 1142 1HD2 ASN 151 1HD2 ASN 151 -10.364 4.589 -5.815 1143 2HD2 ASN 151 2HD2 ASN 151 -11.028 3.198 -4.820 1144 H VAL 152 H VAL 152 -14.841 7.199 -1.552 1145 HA VAL 152 HA VAL 152 -12.353 8.517 -0.466 1146 HB VAL 152 HB VAL 152 -14.354 10.049 -2.222 1147 1HG1 VAL 152 3HG2 VAL 152 -13.659 11.344 -0.185 1148 2HG1 VAL 152 1HG2 VAL 152 -11.944 11.029 -0.553 1149 3HG1 VAL 152 2HG2 VAL 152 -12.921 12.040 -1.651 1150 1HG2 VAL 152 2HG1 VAL 152 -12.621 8.741 -3.504 1151 2HG2 VAL 152 3HG1 VAL 152 -12.302 10.491 -3.625 1152 3HG2 VAL 152 1HG1 VAL 152 -11.326 9.479 -2.527 1153 HA PRO 153 HA PRO 153 -15.179 8.364 2.925 1154 1HB PRO 153 1HB PRO 153 -13.287 9.253 4.745 1155 2HB PRO 153 2HB PRO 153 -13.229 7.626 4.024 1156 1HG PRO 153 1HG PRO 153 -11.700 10.120 3.104 1157 2HG PRO 153 2HG PRO 153 -11.029 8.505 3.441 1158 1HD PRO 153 1HD PRO 153 -11.656 9.279 0.860 1159 2HD PRO 153 2HD PRO 153 -11.971 7.592 1.386 1160 H SER 154 H SER 154 -16.660 9.803 2.762 1161 HA SER 154 HA SER 154 -16.583 12.604 2.205 1162 1HB SER 154 1HB SER 154 -18.702 11.332 2.464 1163 2HB SER 154 2HB SER 154 -18.383 11.084 4.189 1164 HG SER 154 HG SER 154 -18.685 13.584 2.867 1165 H LYS 155 H LYS 155 -16.795 11.121 5.402 1166 HA LYS 155 HA LYS 155 -15.478 13.376 6.872 1167 1HB LYS 155 1HB LYS 155 -15.949 10.444 7.656 1168 2HB LYS 155 2HB LYS 155 -15.331 11.709 8.735 1169 1HG LYS 155 1HG LYS 155 -17.395 13.106 8.245 1170 2HG LYS 155 2HG LYS 155 -18.026 11.811 7.230 1171 1HD LYS 155 1HD LYS 155 -18.049 10.253 9.224 1172 2HD LYS 155 2HD LYS 155 -17.423 11.527 10.259 1173 1HE LYS 155 1HE LYS 155 -20.130 11.659 8.749 1174 2HE LYS 155 2HE LYS 155 -19.939 11.132 10.419 1175 1HZ LYS 155 2HZ LYS 155 -19.077 13.339 10.984 1176 2HZ LYS 155 3HZ LYS 155 -19.248 13.851 9.423 1177 3HZ LYS 155 1HZ LYS 155 -20.581 13.449 10.311 1178 HA PRO 156 HA PRO 156 -11.574 12.659 5.351 1179 1HB PRO 156 1HB PRO 156 -10.254 14.501 6.911 1180 2HB PRO 156 2HB PRO 156 -11.586 14.953 5.821 1181 1HG PRO 156 1HG PRO 156 -11.771 14.377 8.830 1182 2HG PRO 156 2HG PRO 156 -12.362 15.822 7.970 1183 1HD PRO 156 1HD PRO 156 -14.062 13.723 8.541 1184 2HD PRO 156 2HD PRO 156 -14.207 14.584 6.975 1185 H VAL 157 H VAL 157 -10.543 10.918 5.502 1186 HA VAL 157 HA VAL 157 -8.937 10.072 7.956 1187 HB VAL 157 HB VAL 157 -8.954 9.110 5.042 1188 1HG1 VAL 157 3HG2 VAL 157 -6.604 9.134 5.924 1189 2HG1 VAL 157 1HG2 VAL 157 -7.126 8.246 7.378 1190 3HG1 VAL 157 2HG2 VAL 157 -7.203 7.461 5.778 1191 1HG2 VAL 157 2HG1 VAL 157 -10.811 8.233 6.519 1192 2HG2 VAL 157 3HG1 VAL 157 -9.649 6.942 6.113 1193 3HG2 VAL 157 1HG1 VAL 157 -9.602 7.702 7.720 1194 H VAL 158 H VAL 158 -6.845 10.408 8.123 1195 HA VAL 158 HA VAL 158 -5.157 11.723 6.077 1196 HB VAL 158 HB VAL 158 -5.961 13.394 8.533 1197 1HG1 VAL 158 3HG2 VAL 158 -3.506 13.542 8.002 1198 2HG1 VAL 158 1HG2 VAL 158 -3.883 13.913 6.301 1199 3HG1 VAL 158 2HG2 VAL 158 -4.330 15.067 7.586 1200 1HG2 VAL 158 2HG1 VAL 158 -7.634 13.455 6.652 1201 2HG2 VAL 158 3HG1 VAL 158 -6.778 15.015 6.784 1202 3HG2 VAL 158 1HG1 VAL 158 -6.337 13.860 5.498 1203 H ILE 159 H ILE 159 -3.370 10.912 6.267 1204 HA ILE 159 HA ILE 159 -2.544 9.249 8.553 1205 HB ILE 159 HB ILE 159 -0.967 10.275 6.132 1206 1HG1 ILE 159 1HG1 ILE 159 -2.468 7.692 6.879 1207 2HG1 ILE 159 2HG1 ILE 159 -2.882 8.815 5.577 1208 1HG2 ILE 159 3HG2 ILE 159 -0.252 8.136 8.246 1209 2HG2 ILE 159 1HG2 ILE 159 0.679 8.482 6.762 1210 3HG2 ILE 159 2HG2 ILE 159 0.558 9.712 8.047 1211 1HD1 ILE 159 3HD1 ILE 159 -0.282 7.143 5.750 1212 2HD1 ILE 159 1HD1 ILE 159 -1.666 6.805 4.676 1213 3HD1 ILE 159 2HD1 ILE 159 -0.679 8.274 4.427 1214 H LEU 160 H LEU 160 -1.466 9.575 10.142 1215 HA LEU 160 HA LEU 160 -0.883 12.394 11.073 1216 1HB LEU 160 1HB LEU 160 -0.559 9.697 12.517 1217 2HB LEU 160 2HB LEU 160 -0.358 11.294 13.252 1218 HG LEU 160 HG LEU 160 -2.918 10.246 11.906 1219 1HD1 LEU 160 2HD1 LEU 160 -2.465 9.223 14.159 1220 2HD1 LEU 160 3HD1 LEU 160 -2.279 10.848 14.871 1221 3HD1 LEU 160 1HD1 LEU 160 -3.862 10.328 14.236 1222 1HD2 LEU 160 3HD2 LEU 160 -2.618 12.717 11.571 1223 2HD2 LEU 160 1HD2 LEU 160 -3.951 12.393 12.708 1224 3HD2 LEU 160 2HD2 LEU 160 -2.369 12.938 13.323 1225 H SER 161 H SER 161 0.838 9.333 10.660 1226 HA SER 161 HA SER 161 3.418 10.722 9.934 1227 1HB SER 161 1HB SER 161 3.085 9.176 12.584 1228 2HB SER 161 2HB SER 161 4.636 9.723 11.920 1229 HG SER 161 HG SER 161 3.745 11.189 13.408 1230 H ALA 162 H ALA 162 5.186 8.951 10.521 1231 HA ALA 162 HA ALA 162 4.692 6.168 9.758 1232 1HB ALA 162 2HB ALA 162 3.926 7.204 7.588 1233 2HB ALA 162 3HB ALA 162 5.494 8.039 7.423 1234 3HB ALA 162 1HB ALA 162 5.418 6.260 7.351 1235 H LYS 163 H LYS 163 6.410 5.000 9.887 1236 HA LYS 163 HA LYS 163 9.212 5.962 9.727 1237 1HB LYS 163 1HB LYS 163 9.703 5.886 12.164 1238 2HB LYS 163 2HB LYS 163 8.526 7.155 11.784 1239 1HG LYS 163 1HG LYS 163 6.647 5.537 12.341 1240 2HG LYS 163 2HG LYS 163 7.823 4.323 12.816 1241 1HD LYS 163 1HD LYS 163 7.495 7.095 14.154 1242 2HD LYS 163 2HD LYS 163 6.741 5.611 14.722 1243 1HE LYS 163 1HE LYS 163 9.028 4.570 15.113 1244 2HE LYS 163 2HE LYS 163 9.799 6.069 14.577 1245 1HZ LYS 163 2HZ LYS 163 7.959 5.834 16.909 1246 2HZ LYS 163 3HZ LYS 163 9.602 5.991 16.980 1247 3HZ LYS 163 1HZ LYS 163 8.678 7.234 16.405 1248 H VAL 164 H VAL 164 10.357 4.395 9.251 1249 HA VAL 164 HA VAL 164 9.576 1.527 9.593 1250 HB VAL 164 HB VAL 164 11.776 1.124 8.539 1251 1HG1 VAL 164 3HG2 VAL 164 9.797 1.687 7.102 1252 2HG1 VAL 164 1HG2 VAL 164 10.192 3.421 7.221 1253 3HG1 VAL 164 2HG2 VAL 164 11.302 2.310 6.374 1254 1HG2 VAL 164 2HG1 VAL 164 13.062 2.955 9.676 1255 2HG2 VAL 164 3HG1 VAL 164 13.244 3.064 7.906 1256 3HG2 VAL 164 1HG1 VAL 164 12.146 4.180 8.762 1257 H LEU 165 H LEU 165 10.426 0.090 10.902 1258 HA LEU 165 HA LEU 165 11.314 0.860 13.563 1259 1HB LEU 165 1HB LEU 165 10.266 -1.338 13.121 1260 2HB LEU 165 2HB LEU 165 11.649 -1.841 12.139 1261 HG LEU 165 HG LEU 165 13.178 -1.567 14.092 1262 1HD1 LEU 165 2HD1 LEU 165 11.934 0.280 15.252 1263 2HD1 LEU 165 3HD1 LEU 165 10.612 -0.846 15.655 1264 3HD1 LEU 165 1HD1 LEU 165 12.230 -1.079 16.366 1265 1HD2 LEU 165 3HD2 LEU 165 12.065 -3.791 13.725 1266 2HD2 LEU 165 1HD2 LEU 165 12.309 -3.485 15.464 1267 3HD2 LEU 165 2HD2 LEU 165 10.691 -3.284 14.742 1268 HA PRO 166 HA PRO 166 15.830 -0.646 12.051 1269 1HB PRO 166 1HB PRO 166 15.238 0.198 9.166 1270 2HB PRO 166 2HB PRO 166 16.393 -1.035 9.732 1271 1HG PRO 166 1HG PRO 166 13.990 -1.863 8.784 1272 2HG PRO 166 2HG PRO 166 14.588 -2.575 10.304 1273 1HD PRO 166 1HD PRO 166 12.478 -0.377 9.971 1274 2HD PRO 166 2HD PRO 166 12.486 -1.763 11.110 Start of MODEL 7 Raw file had 1274 H/Q atoms Start of MODEL 7 1 1H ALA 1 3H ALA 1 21.258 -9.540 8.602 2 2H ALA 1 1H ALA 1 21.183 -9.731 6.963 3 3H ALA 1 2H ALA 1 22.442 -8.903 7.641 4 HA ALA 1 HA ALA 1 20.968 -7.142 8.417 5 1HB ALA 1 2HB ALA 1 22.051 -6.912 6.160 6 2HB ALA 1 3HB ALA 1 20.690 -7.783 5.402 7 3HB ALA 1 1HB ALA 1 20.423 -6.188 6.154 8 H LYS 2 H LYS 2 19.197 -6.904 9.335 9 HA LYS 2 HA LYS 2 16.576 -6.918 8.481 10 1HB LYS 2 1HB LYS 2 15.645 -9.197 8.739 11 2HB LYS 2 2HB LYS 2 16.903 -9.162 7.492 12 1HG LYS 2 1HG LYS 2 18.600 -9.968 9.189 13 2HG LYS 2 2HG LYS 2 17.345 -10.005 10.429 14 1HD LYS 2 1HD LYS 2 16.062 -11.733 9.082 15 2HD LYS 2 2HD LYS 2 17.319 -11.696 7.840 16 1HE LYS 2 1HE LYS 2 19.029 -12.502 9.544 17 2HE LYS 2 2HE LYS 2 17.770 -12.541 10.788 18 1HZ LYS 2 2HZ LYS 2 16.573 -14.189 9.441 19 2HZ LYS 2 3HZ LYS 2 17.749 -14.154 8.281 20 3HZ LYS 2 1HZ LYS 2 18.099 -14.717 9.794 21 H GLY 3 H GLY 3 14.925 -7.303 9.992 22 1HA GLY 3 1HA GLY 3 15.486 -7.887 12.865 23 2HA GLY 3 2HA GLY 3 15.384 -6.138 12.566 24 H ASP 4 H ASP 4 13.519 -5.472 11.214 25 HA ASP 4 HA ASP 4 11.015 -7.060 11.182 26 1HB ASP 4 1HB ASP 4 11.348 -4.908 13.368 27 2HB ASP 4 2HB ASP 4 9.798 -5.612 12.883 28 HA PRO 5 HA PRO 5 11.053 -3.523 8.208 29 1HB PRO 5 1HB PRO 5 9.871 -5.078 6.250 30 2HB PRO 5 2HB PRO 5 11.616 -5.152 6.595 31 1HG PRO 5 1HG PRO 5 9.432 -7.027 7.657 32 2HG PRO 5 2HG PRO 5 10.957 -7.487 6.859 33 1HD PRO 5 1HD PRO 5 10.737 -7.452 9.618 34 2HD PRO 5 2HD PRO 5 12.262 -6.926 8.834 35 H HIS 6 H HIS 6 9.577 -2.191 8.694 36 HA HIS 6 HA HIS 6 6.621 -2.831 8.612 37 1HB HIS 6 1HB HIS 6 8.021 -2.000 11.224 38 2HB HIS 6 2HB HIS 6 6.272 -2.047 10.972 39 HD2 HIS 6 HD2 HIS 6 8.509 -4.801 9.405 40 HE1 HIS 6 HE1 HIS 6 6.398 -6.595 12.511 41 HE2 HIS 6 HE2 HIS 6 7.976 -7.140 10.551 42 H VAL 7 H VAL 7 6.364 -1.415 7.107 43 HA VAL 7 HA VAL 7 7.048 1.489 7.307 44 HB VAL 7 HB VAL 7 4.738 0.089 5.818 45 1HG1 VAL 7 1HG2 VAL 7 5.851 2.964 5.645 46 2HG1 VAL 7 2HG2 VAL 7 4.586 2.273 4.593 47 3HG1 VAL 7 3HG2 VAL 7 4.274 2.499 6.335 48 1HG2 VAL 7 1HG1 VAL 7 7.497 1.128 4.879 49 2HG2 VAL 7 2HG1 VAL 7 7.039 -0.587 5.038 50 3HG2 VAL 7 3HG1 VAL 7 6.234 0.441 3.822 51 H LEU 8 H LEU 8 6.795 1.608 9.493 52 HA LEU 8 HA LEU 8 4.226 0.930 10.827 53 1HB LEU 8 1HB LEU 8 6.531 0.689 11.837 54 2HB LEU 8 2HB LEU 8 6.626 2.450 11.999 55 HG LEU 8 HG LEU 8 4.240 0.801 13.015 56 1HD1 LEU 8 2HD1 LEU 8 6.308 -0.074 14.070 57 2HD1 LEU 8 3HD1 LEU 8 6.781 1.573 14.571 58 3HD1 LEU 8 1HD1 LEU 8 5.319 0.806 15.266 59 1HD2 LEU 8 3HD2 LEU 8 3.856 3.268 12.784 60 2HD2 LEU 8 1HD2 LEU 8 3.857 2.787 14.499 61 3HD2 LEU 8 2HD2 LEU 8 5.284 3.600 13.800 62 H LEU 9 H LEU 9 2.613 1.988 10.531 63 HA LEU 9 HA LEU 9 2.671 5.014 9.955 64 1HB LEU 9 1HB LEU 9 0.908 2.728 9.026 65 2HB LEU 9 2HB LEU 9 0.200 4.343 9.147 66 HG LEU 9 HG LEU 9 2.880 3.835 7.755 67 1HD1 LEU 9 2HD1 LEU 9 1.078 2.551 6.567 68 2HD1 LEU 9 3HD1 LEU 9 0.066 4.019 6.491 69 3HD1 LEU 9 1HD1 LEU 9 1.605 3.947 5.592 70 1HD2 LEU 9 3HD2 LEU 9 2.438 6.189 8.524 71 2HD2 LEU 9 1HD2 LEU 9 2.396 6.094 6.745 72 3HD2 LEU 9 2HD2 LEU 9 0.874 6.190 7.668 73 H THR 10 H THR 10 0.757 6.083 10.376 74 HA THR 10 HA THR 10 -0.891 5.417 12.792 75 HB THR 10 HB THR 10 1.167 7.710 12.900 76 HG1 THR 10 HG1 THR 10 1.970 6.462 14.621 77 1HG2 THR 10 3HG2 THR 10 -0.922 6.720 14.954 78 2HG2 THR 10 1HG2 THR 10 0.272 8.016 15.234 79 3HG2 THR 10 2HG2 THR 10 -1.023 8.241 14.028 80 H THR 11 H THR 11 -2.277 5.609 11.054 81 HA THR 11 HA THR 11 -2.748 8.216 9.659 82 HB THR 11 HB THR 11 -4.904 7.104 8.940 83 HG1 THR 11 HG1 THR 11 -5.036 4.893 9.438 84 1HG2 THR 11 2HG2 THR 11 -2.780 6.929 7.624 85 2HG2 THR 11 3HG2 THR 11 -2.296 5.496 8.572 86 3HG2 THR 11 1HG2 THR 11 -3.728 5.422 7.503 87 H SER 12 H SER 12 -4.801 9.159 9.662 88 HA SER 12 HA SER 12 -5.444 10.589 12.027 89 1HB SER 12 1HB SER 12 -7.673 11.069 11.007 90 2HB SER 12 2HB SER 12 -6.366 11.202 9.816 91 HG SER 12 HG SER 12 -8.136 10.002 9.055 92 H ALA 13 H ALA 13 -6.998 7.649 10.828 93 HA ALA 13 HA ALA 13 -8.860 7.218 12.988 94 1HB ALA 13 2HB ALA 13 -8.907 5.874 10.875 95 2HB ALA 13 3HB ALA 13 -7.382 5.075 11.338 96 3HB ALA 13 1HB ALA 13 -8.860 4.812 12.302 97 H GLY 14 H GLY 14 -5.732 5.950 12.488 98 1HA GLY 14 1HA GLY 14 -4.608 6.240 15.123 99 2HA GLY 14 2HA GLY 14 -5.434 4.676 15.192 100 H ASN 15 H ASN 15 -3.097 4.447 15.761 101 HA ASN 15 HA ASN 15 -0.975 4.263 13.791 102 1HB ASN 15 1HB ASN 15 -0.643 4.097 16.273 103 2HB ASN 15 2HB ASN 15 -1.450 2.523 16.288 104 1HD2 ASN 15 1HD2 ASN 15 2.134 2.704 14.188 105 2HD2 ASN 15 2HD2 ASN 15 0.867 4.022 14.033 106 H ILE 16 H ILE 16 -0.007 2.486 12.900 107 HA ILE 16 HA ILE 16 -1.354 -0.146 12.609 108 HB ILE 16 HB ILE 16 -1.733 -0.001 10.141 109 1HG1 ILE 16 1HG1 ILE 16 -1.148 2.985 10.606 110 2HG1 ILE 16 2HG1 ILE 16 -0.167 1.876 9.640 111 1HG2 ILE 16 2HG2 ILE 16 -3.596 0.307 11.756 112 2HG2 ILE 16 3HG2 ILE 16 -3.271 2.060 11.821 113 3HG2 ILE 16 1HG2 ILE 16 -3.842 1.311 10.302 114 1HD1 ILE 16 3HD1 ILE 16 -3.121 2.610 9.057 115 2HD1 ILE 16 1HD1 ILE 16 -1.705 3.220 8.162 116 3HD1 ILE 16 2HD1 ILE 16 -2.136 1.491 8.078 117 H GLU 17 H GLU 17 -0.353 -1.158 10.472 118 HA GLU 17 HA GLU 17 2.663 -0.773 10.383 119 1HB GLU 17 1HB GLU 17 1.403 -3.313 11.570 120 2HB GLU 17 2HB GLU 17 3.124 -2.931 11.475 121 1HG GLU 17 1HG GLU 17 0.986 -1.426 13.129 122 2HG GLU 17 2HG GLU 17 2.206 -2.519 13.782 123 H LEU 18 H LEU 18 3.325 -1.264 8.517 124 HA LEU 18 HA LEU 18 2.240 -3.767 7.066 125 1HB LEU 18 1HB LEU 18 3.662 -1.341 5.813 126 2HB LEU 18 2HB LEU 18 3.311 -2.868 5.002 127 HG LEU 18 HG LEU 18 1.529 -1.433 4.368 128 1HD1 LEU 18 2HD1 LEU 18 0.773 -3.726 5.077 129 2HD1 LEU 18 3HD1 LEU 18 0.513 -3.136 6.740 130 3HD1 LEU 18 1HD1 LEU 18 -0.491 -2.512 5.405 131 1HD2 LEU 18 3HD2 LEU 18 1.891 0.356 6.061 132 2HD2 LEU 18 1HD2 LEU 18 0.171 -0.102 5.983 133 3HD2 LEU 18 2HD2 LEU 18 1.186 -0.678 7.336 134 H GLU 19 H GLU 19 3.398 -5.332 7.535 135 HA GLU 19 HA GLU 19 6.396 -5.202 8.003 136 1HB GLU 19 1HB GLU 19 6.223 -7.658 8.183 137 2HB GLU 19 2HB GLU 19 5.068 -6.856 9.260 138 1HG GLU 19 1HG GLU 19 3.244 -7.156 7.519 139 2HG GLU 19 2HG GLU 19 4.393 -7.950 6.446 140 H LEU 20 H LEU 20 7.539 -4.805 6.358 141 HA LEU 20 HA LEU 20 6.750 -5.778 3.545 142 1HB LEU 20 1HB LEU 20 8.546 -3.455 4.460 143 2HB LEU 20 2HB LEU 20 8.367 -3.994 2.789 144 HG LEU 20 HG LEU 20 5.866 -3.643 2.948 145 1HD1 LEU 20 3HD1 LEU 20 6.584 -2.268 5.622 146 2HD1 LEU 20 1HD1 LEU 20 4.994 -2.200 4.816 147 3HD1 LEU 20 2HD1 LEU 20 5.608 -3.750 5.444 148 1HD2 LEU 20 3HD2 LEU 20 7.387 -1.930 1.920 149 2HD2 LEU 20 1HD2 LEU 20 6.022 -1.145 2.755 150 3HD2 LEU 20 2HD2 LEU 20 7.635 -1.174 3.516 151 H ASP 21 H ASP 21 7.828 -7.108 2.540 152 HA ASP 21 HA ASP 21 10.197 -8.591 3.472 153 1HB ASP 21 1HB ASP 21 9.166 -8.098 0.619 154 2HB ASP 21 2HB ASP 21 10.370 -9.313 1.082 155 H LYS 22 H LYS 22 11.025 -7.947 0.546 156 HA LYS 22 HA LYS 22 12.237 -5.569 -0.066 157 1HB LYS 22 1HB LYS 22 14.281 -5.279 1.310 158 2HB LYS 22 2HB LYS 22 12.827 -5.216 2.321 159 1HG LYS 22 1HG LYS 22 13.108 -7.672 2.857 160 2HG LYS 22 2HG LYS 22 14.577 -7.733 1.898 161 1HD LYS 22 1HD LYS 22 14.182 -5.968 4.410 162 2HD LYS 22 2HD LYS 22 14.911 -7.569 4.415 163 1HE LYS 22 1HE LYS 22 16.772 -6.754 2.886 164 2HE LYS 22 2HE LYS 22 16.069 -5.130 2.900 165 1HZ LYS 22 3HZ LYS 22 17.047 -6.589 5.307 166 2HZ LYS 22 1HZ LYS 22 17.822 -5.346 4.543 167 3HZ LYS 22 2HZ LYS 22 16.389 -5.074 5.318 168 H GLN 23 H GLN 23 13.535 -8.595 1.194 169 HA GLN 23 HA GLN 23 15.717 -9.004 -0.641 170 1HB GLN 23 1HB GLN 23 15.491 -11.426 -0.143 171 2HB GLN 23 2HB GLN 23 15.365 -10.451 1.325 172 1HG GLN 23 1HG GLN 23 12.841 -10.575 1.195 173 2HG GLN 23 2HG GLN 23 12.965 -11.541 -0.279 174 1HE2 GLN 23 2HE2 GLN 23 14.492 -13.342 3.143 175 2HE2 GLN 23 1HE2 GLN 23 14.873 -11.595 2.729 176 H LYS 24 H LYS 24 12.306 -9.878 -0.913 177 HA LYS 24 HA LYS 24 12.518 -11.214 -3.525 178 1HB LYS 24 1HB LYS 24 10.630 -11.546 -1.933 179 2HB LYS 24 2HB LYS 24 10.108 -9.873 -2.178 180 1HG LYS 24 1HG LYS 24 8.802 -11.424 -3.618 181 2HG LYS 24 2HG LYS 24 9.708 -10.277 -4.595 182 1HD LYS 24 1HD LYS 24 10.596 -13.182 -4.006 183 2HD LYS 24 2HD LYS 24 9.727 -12.669 -5.448 184 1HE LYS 24 1HE LYS 24 11.648 -11.140 -6.097 185 2HE LYS 24 2HE LYS 24 12.545 -11.654 -4.661 186 1HZ LYS 24 1HZ LYS 24 11.662 -13.460 -6.861 187 2HZ LYS 24 2HZ LYS 24 13.202 -12.916 -6.610 188 3HZ LYS 24 3HZ LYS 24 12.499 -13.938 -5.519 189 H ALA 25 H ALA 25 12.561 -7.903 -2.657 190 HA ALA 25 HA ALA 25 12.756 -7.064 -5.519 191 1HB ALA 25 2HB ALA 25 10.252 -7.180 -5.264 192 2HB ALA 25 3HB ALA 25 10.334 -6.089 -3.856 193 3HB ALA 25 1HB ALA 25 10.795 -5.496 -5.473 194 HA PRO 26 HA PRO 26 15.334 -4.933 -2.294 195 1HB PRO 26 1HB PRO 26 17.105 -5.256 -4.764 196 2HB PRO 26 2HB PRO 26 17.561 -5.445 -3.054 197 1HG PRO 26 1HG PRO 26 17.142 -7.678 -4.541 198 2HG PRO 26 2HG PRO 26 16.432 -7.601 -2.909 199 1HD PRO 26 1HD PRO 26 15.011 -7.125 -5.587 200 2HD PRO 26 2HD PRO 26 14.429 -8.033 -4.154 201 H VAL 27 H VAL 27 15.780 -4.387 -5.761 202 HA VAL 27 HA VAL 27 16.389 -1.588 -5.656 203 HB VAL 27 HB VAL 27 14.918 -3.097 -7.894 204 1HG1 VAL 27 3HG2 VAL 27 14.782 -0.596 -8.109 205 2HG1 VAL 27 1HG2 VAL 27 16.549 -0.471 -7.912 206 3HG1 VAL 27 2HG2 VAL 27 15.866 -1.277 -9.351 207 1HG2 VAL 27 2HG1 VAL 27 17.091 -4.166 -7.217 208 2HG2 VAL 27 3HG1 VAL 27 17.239 -3.399 -8.820 209 3HG2 VAL 27 1HG1 VAL 27 17.926 -2.600 -7.381 210 H SER 28 H SER 28 13.335 -2.948 -6.793 211 HA SER 28 HA SER 28 11.731 -0.611 -6.875 212 1HB SER 28 1HB SER 28 10.849 -3.385 -5.858 213 2HB SER 28 2HB SER 28 9.760 -2.106 -6.429 214 HG SER 28 HG SER 28 10.291 -3.608 -8.051 215 H VAL 29 H VAL 29 11.829 -2.899 -4.189 216 HA VAL 29 HA VAL 29 10.379 -1.402 -2.230 217 HB VAL 29 HB VAL 29 12.839 -3.167 -1.702 218 1HG1 VAL 29 3HG2 VAL 29 12.087 -1.786 0.264 219 2HG1 VAL 29 1HG2 VAL 29 10.419 -2.380 0.055 220 3HG1 VAL 29 2HG2 VAL 29 11.714 -3.512 0.527 221 1HG2 VAL 29 2HG1 VAL 29 11.116 -4.319 -3.128 222 2HG2 VAL 29 3HG1 VAL 29 11.141 -5.014 -1.487 223 3HG2 VAL 29 1HG1 VAL 29 9.842 -3.886 -1.959 224 H GLN 30 H GLN 30 13.874 -1.494 -2.769 225 HA GLN 30 HA GLN 30 14.849 0.354 -0.875 226 1HB GLN 30 1HB GLN 30 16.294 -0.796 -2.566 227 2HB GLN 30 2HB GLN 30 15.642 0.230 -3.851 228 1HG GLN 30 1HG GLN 30 17.818 1.134 -3.045 229 2HG GLN 30 2HG GLN 30 16.516 2.279 -2.707 230 1HE2 GLN 30 2HE2 GLN 30 16.939 2.104 0.827 231 2HE2 GLN 30 1HE2 GLN 30 16.038 2.788 -0.617 232 H ASN 31 H ASN 31 13.872 1.237 -4.158 233 HA ASN 31 HA ASN 31 13.826 4.070 -3.990 234 1HB ASN 31 1HB ASN 31 11.668 2.309 -5.319 235 2HB ASN 31 2HB ASN 31 11.956 4.018 -5.663 236 1HD2 ASN 31 1HD2 ASN 31 14.630 1.181 -7.052 237 2HD2 ASN 31 2HD2 ASN 31 13.423 0.804 -5.722 238 H PHE 32 H PHE 32 11.226 1.833 -3.163 239 HA PHE 32 HA PHE 32 9.204 3.506 -2.113 240 1HB PHE 32 1HB PHE 32 9.140 0.988 -2.150 241 2HB PHE 32 2HB PHE 32 10.296 0.928 -0.820 242 HD1 PHE 32 HD2 PHE 32 7.009 2.439 -1.726 243 HD2 PHE 32 HD1 PHE 32 9.451 0.932 1.367 244 HE1 PHE 32 HE2 PHE 32 5.158 2.637 -0.163 245 HE2 PHE 32 HE1 PHE 32 7.599 1.138 2.927 246 HZ PHE 32 HZ PHE 32 5.452 1.989 2.163 247 H VAL 33 H VAL 33 11.907 2.155 -0.291 248 HA VAL 33 HA VAL 33 11.634 3.648 2.162 249 HB VAL 33 HB VAL 33 14.230 2.785 0.757 250 1HG1 VAL 33 3HG2 VAL 33 14.584 4.438 2.617 251 2HG1 VAL 33 1HG2 VAL 33 13.606 3.431 3.715 252 3HG1 VAL 33 2HG2 VAL 33 15.163 2.820 3.095 253 1HG2 VAL 33 2HG1 VAL 33 12.593 0.901 1.068 254 2HG2 VAL 33 3HG1 VAL 33 13.980 0.718 2.173 255 3HG2 VAL 33 1HG1 VAL 33 12.419 1.321 2.791 256 H ASP 34 H ASP 34 13.163 4.545 -0.884 257 HA ASP 34 HA ASP 34 14.526 6.940 -0.171 258 1HB ASP 34 1HB ASP 34 14.250 7.671 -2.448 259 2HB ASP 34 2HB ASP 34 14.328 5.906 -2.454 260 OH TYR 35 OH TYR 35 10.274 8.269 -6.349 261 H TYR 35 H TYR 35 11.261 6.637 -1.214 262 HA TYR 35 HA TYR 35 10.294 9.280 -0.298 263 1HB TYR 35 1HB TYR 35 8.624 6.730 -0.736 264 2HB TYR 35 2HB TYR 35 8.024 8.392 -0.726 265 HD1 TYR 35 HD1 TYR 35 9.374 10.012 -2.349 266 HD2 TYR 35 HD2 TYR 35 9.176 5.819 -2.796 267 HE1 TYR 35 HE1 TYR 35 9.982 10.230 -4.694 268 HE2 TYR 35 HE2 TYR 35 9.784 6.042 -5.139 269 HH TYR 35 HH TYR 35 10.313 7.395 -6.745 270 H VAL 36 H VAL 36 9.816 6.007 0.916 271 HA VAL 36 HA VAL 36 8.440 6.327 3.345 272 HB VAL 36 HB VAL 36 11.035 4.735 2.958 273 1HG1 VAL 36 3HG2 VAL 36 10.324 4.931 5.356 274 2HG1 VAL 36 1HG2 VAL 36 8.691 4.354 4.936 275 3HG1 VAL 36 2HG2 VAL 36 10.092 3.262 4.771 276 1HG2 VAL 36 2HG1 VAL 36 9.313 4.242 1.188 277 2HG2 VAL 36 3HG1 VAL 36 9.487 2.852 2.292 278 3HG2 VAL 36 1HG1 VAL 36 8.085 3.946 2.446 279 H ASN 37 H ASN 37 11.913 6.643 2.881 280 HA ASN 37 HA ASN 37 12.942 7.170 5.367 281 1HB ASN 37 1HB ASN 37 14.593 8.734 4.373 282 2HB ASN 37 2HB ASN 37 14.290 7.370 3.286 283 1HD2 ASN 37 1HD2 ASN 37 14.081 10.289 1.061 284 2HD2 ASN 37 2HD2 ASN 37 15.302 9.256 1.960 285 H SER 38 H SER 38 10.838 9.324 3.640 286 HA SER 38 HA SER 38 9.419 10.557 5.513 287 1HB SER 38 1HB SER 38 10.642 12.358 6.697 288 2HB SER 38 2HB SER 38 11.403 10.785 7.008 289 HG SER 38 HG SER 38 12.902 12.403 6.454 290 H GLY 39 H GLY 39 8.246 12.054 4.866 291 1HA GLY 39 1HA GLY 39 8.209 14.473 3.840 292 2HA GLY 39 2HA GLY 39 9.025 13.787 2.426 293 H PHE 40 H PHE 40 7.937 11.553 1.899 294 HA PHE 40 HA PHE 40 5.472 12.282 0.519 295 1HB PHE 40 1HB PHE 40 7.097 10.542 -0.270 296 2HB PHE 40 2HB PHE 40 6.654 9.494 1.079 297 HD1 PHE 40 HD2 PHE 40 4.412 8.483 1.156 298 HD2 PHE 40 HD1 PHE 40 5.572 10.879 -2.117 299 HE1 PHE 40 HE2 PHE 40 2.583 7.574 -0.161 300 HE2 PHE 40 HE1 PHE 40 3.742 9.967 -3.430 301 HZ PHE 40 HZ PHE 40 2.255 8.306 -2.458 302 OH TYR 41 OH TYR 41 5.603 5.037 -0.243 303 H TYR 41 H TYR 41 5.810 9.547 2.700 304 HA TYR 41 HA TYR 41 2.959 9.336 3.216 305 1HB TYR 41 1HB TYR 41 5.244 8.180 4.914 306 2HB TYR 41 2HB TYR 41 3.576 7.603 4.858 307 HD1 TYR 41 HD2 TYR 41 2.682 6.760 2.645 308 HD2 TYR 41 HD1 TYR 41 6.786 7.553 3.236 309 HE1 TYR 41 HE2 TYR 41 3.225 5.438 0.676 310 HE2 TYR 41 HE1 TYR 41 7.323 6.231 1.268 311 HH TYR 41 HH TYR 41 4.789 4.700 -0.626 312 H ASN 42 H ASN 42 5.443 11.122 4.841 313 HA ASN 42 HA ASN 42 4.740 11.309 7.489 314 1HB ASN 42 1HB ASN 42 5.253 13.789 5.733 315 2HB ASN 42 2HB ASN 42 5.419 13.729 7.490 316 1HD2 ASN 42 1HD2 ASN 42 8.562 12.032 7.419 317 2HD2 ASN 42 2HD2 ASN 42 7.141 12.637 8.410 318 H ASN 43 H ASN 43 2.899 12.784 4.887 319 HA ASN 43 HA ASN 43 0.441 12.872 6.602 320 1HB ASN 43 1HB ASN 43 1.524 14.956 7.339 321 2HB ASN 43 2HB ASN 43 1.757 15.494 5.664 322 1HD2 ASN 43 1HD2 ASN 43 -2.247 15.104 6.507 323 2HD2 ASN 43 2HD2 ASN 43 -1.073 13.695 6.571 324 H THR 44 H THR 44 0.993 11.420 4.507 325 HA THR 44 HA THR 44 -0.641 12.475 2.156 326 HB THR 44 HB THR 44 -0.498 10.114 1.352 327 HG1 THR 44 HG1 THR 44 -0.316 9.174 3.421 328 1HG2 THR 44 2HG2 THR 44 1.267 11.798 0.735 329 2HG2 THR 44 3HG2 THR 44 2.197 11.372 2.196 330 3HG2 THR 44 1HG2 THR 44 1.976 10.169 0.896 331 H THR 45 H THR 45 -1.731 9.577 2.342 332 HA THR 45 HA THR 45 -3.477 9.543 4.736 333 HB THR 45 HB THR 45 -5.654 9.737 3.539 334 HG1 THR 45 HG1 THR 45 -4.828 9.213 1.490 335 1HG2 THR 45 2HG2 THR 45 -4.683 11.773 4.658 336 2HG2 THR 45 3HG2 THR 45 -3.826 12.199 3.153 337 3HG2 THR 45 1HG2 THR 45 -5.609 12.227 3.203 338 H PHE 46 H PHE 46 -5.613 8.281 3.537 339 HA PHE 46 HA PHE 46 -4.579 5.777 2.140 340 1HB PHE 46 1HB PHE 46 -6.080 5.761 4.836 341 2HB PHE 46 2HB PHE 46 -5.997 4.366 3.757 342 HD1 PHE 46 HD1 PHE 46 -3.049 5.673 2.951 343 HD2 PHE 46 HD2 PHE 46 -4.909 4.028 6.360 344 HE1 PHE 46 HE1 PHE 46 -0.877 5.010 3.817 345 HE2 PHE 46 HE2 PHE 46 -2.736 3.359 7.220 346 HZ PHE 46 HZ PHE 46 -0.720 3.851 5.951 347 H HIS 47 H HIS 47 -5.599 7.452 0.760 348 HA HIS 47 HA HIS 47 -8.383 8.088 0.665 349 1HB HIS 47 1HB HIS 47 -8.019 8.244 -1.857 350 2HB HIS 47 2HB HIS 47 -6.793 9.087 -0.896 351 HD2 HIS 47 HD2 HIS 47 -6.480 7.546 -3.905 352 HE1 HIS 47 HE1 HIS 47 -3.631 5.321 -1.820 353 HE2 HIS 47 HE2 HIS 47 -4.392 5.917 -4.216 354 NH1 ARG 48 NH2 ARG 48 -5.153 3.703 -7.429 355 NH2 ARG 48 NH1 ARG 48 -3.445 3.856 -5.936 356 H ARG 48 H ARG 48 -6.908 5.592 -1.379 357 HA ARG 48 HA ARG 48 -9.547 4.393 -2.010 358 1HB ARG 48 1HB ARG 48 -6.700 3.383 -2.556 359 2HB ARG 48 2HB ARG 48 -8.185 2.714 -3.259 360 1HG ARG 48 1HG ARG 48 -8.768 5.007 -4.162 361 2HG ARG 48 2HG ARG 48 -7.262 5.655 -3.540 362 1HD ARG 48 1HD ARG 48 -7.471 3.398 -5.658 363 2HD ARG 48 2HD ARG 48 -7.282 5.112 -6.034 364 HE ARG 48 HE ARG 48 -5.088 4.370 -4.261 365 1HH1 ARG 48 2HH2 ARG 48 -6.164 3.765 -7.597 366 2HH1 ARG 48 1HH2 ARG 48 -4.428 3.487 -8.122 367 1HH2 ARG 48 1HH1 ARG 48 -3.151 4.034 -4.970 368 2HH2 ARG 48 2HH1 ARG 48 -2.839 3.630 -6.732 369 H VAL 49 H VAL 49 -10.577 2.924 -1.119 370 HA VAL 49 HA VAL 49 -9.358 0.714 0.518 371 HB VAL 49 HB VAL 49 -9.413 2.623 2.129 372 1HG1 VAL 49 3HG2 VAL 49 -11.327 3.884 1.095 373 2HG1 VAL 49 1HG2 VAL 49 -12.453 2.587 1.571 374 3HG1 VAL 49 2HG2 VAL 49 -11.642 3.568 2.821 375 1HG2 VAL 49 2HG1 VAL 49 -9.763 0.270 2.929 376 2HG2 VAL 49 3HG1 VAL 49 -10.703 1.420 3.916 377 3HG2 VAL 49 1HG1 VAL 49 -11.520 0.432 2.675 378 H ILE 50 H ILE 50 -10.762 -0.799 1.206 379 HA ILE 50 HA ILE 50 -13.605 -0.876 0.163 380 HB ILE 50 HB ILE 50 -12.212 -1.401 -1.841 381 1HG1 ILE 50 1HG1 ILE 50 -13.652 -3.818 -0.591 382 2HG1 ILE 50 2HG1 ILE 50 -14.423 -2.514 -1.504 383 1HG2 ILE 50 2HG2 ILE 50 -10.189 -2.277 -0.632 384 2HG2 ILE 50 3HG2 ILE 50 -11.114 -3.702 -0.092 385 3HG2 ILE 50 1HG2 ILE 50 -10.771 -3.466 -1.827 386 1HD1 ILE 50 3HD1 ILE 50 -12.266 -4.437 -2.629 387 2HD1 ILE 50 1HD1 ILE 50 -14.012 -4.511 -2.986 388 3HD1 ILE 50 2HD1 ILE 50 -13.045 -3.123 -3.550 389 HA PRO 51 HA PRO 51 -14.271 -2.996 3.924 390 1HB PRO 51 1HB PRO 51 -16.275 -4.263 1.981 391 2HB PRO 51 2HB PRO 51 -16.569 -3.715 3.651 392 1HG PRO 51 1HG PRO 51 -17.322 -2.089 1.615 393 2HG PRO 51 2HG PRO 51 -16.442 -1.370 2.987 394 1HD PRO 51 1HD PRO 51 -15.334 -2.084 0.224 395 2HD PRO 51 2HD PRO 51 -14.962 -0.662 1.251 396 H GLY 52 H GLY 52 -14.158 -4.984 4.797 397 1HA GLY 52 1HA GLY 52 -12.301 -6.767 4.789 398 2HA GLY 52 2HA GLY 52 -13.888 -7.506 4.572 399 H PHE 53 H PHE 53 -11.384 -5.903 2.682 400 HA PHE 53 HA PHE 53 -11.027 -8.273 0.858 401 1HB PHE 53 1HB PHE 53 -13.049 -7.120 -0.108 402 2HB PHE 53 2HB PHE 53 -12.143 -5.603 -0.211 403 HD1 PHE 53 HD2 PHE 53 -10.813 -9.008 -0.815 404 HD2 PHE 53 HD1 PHE 53 -12.017 -5.371 -2.580 405 HE1 PHE 53 HE2 PHE 53 -9.904 -9.739 -2.948 406 HE2 PHE 53 HE1 PHE 53 -11.105 -6.105 -4.710 407 HZ PHE 53 HZ PHE 53 -10.049 -8.288 -4.895 408 H MET 54 H MET 54 -10.547 -4.779 1.115 409 HA MET 54 HA MET 54 -7.568 -5.014 1.224 410 1HB MET 54 1HB MET 54 -7.955 -5.492 -1.196 411 2HB MET 54 2HB MET 54 -8.937 -4.028 -1.357 412 1HG MET 54 1HG MET 54 -6.944 -2.619 -0.668 413 2HG MET 54 2HG MET 54 -5.960 -4.090 -0.545 414 1HE MET 54 3HE MET 54 -8.155 -1.806 -2.943 415 2HE MET 54 2HE MET 54 -7.930 -2.605 -4.527 416 3HE MET 54 1HE MET 54 -8.877 -3.417 -3.248 417 H ILE 55 H ILE 55 -6.556 -2.910 0.714 418 HA ILE 55 HA ILE 55 -7.766 -0.332 0.876 419 HB ILE 55 HB ILE 55 -8.919 -0.798 2.854 420 1HG1 ILE 55 1HG1 ILE 55 -7.387 1.304 2.829 421 2HG1 ILE 55 2HG1 ILE 55 -8.096 0.816 4.370 422 1HG2 ILE 55 2HG2 ILE 55 -7.837 -2.952 3.485 423 2HG2 ILE 55 3HG2 ILE 55 -6.383 -2.083 4.048 424 3HG2 ILE 55 1HG2 ILE 55 -7.938 -1.868 4.893 425 1HD1 ILE 55 2HD1 ILE 55 -5.972 -0.365 5.030 426 2HD1 ILE 55 3HD1 ILE 55 -5.220 0.114 3.486 427 3HD1 ILE 55 1HD1 ILE 55 -5.674 1.357 4.685 428 H GLN 56 H GLN 56 -6.320 0.772 0.134 429 HA GLN 56 HA GLN 56 -3.433 -0.176 0.268 430 1HB GLN 56 1HB GLN 56 -4.711 1.944 -1.536 431 2HB GLN 56 2HB GLN 56 -3.183 1.099 -1.795 432 1HG GLN 56 1HG GLN 56 -4.462 -1.092 -1.969 433 2HG GLN 56 2HG GLN 56 -5.979 -0.215 -1.752 434 1HE2 GLN 56 2HE2 GLN 56 -4.815 -0.631 -5.473 435 2HE2 GLN 56 1HE2 GLN 56 -4.544 -1.737 -4.033 436 H GLY 57 H GLY 57 -1.948 1.769 -0.372 437 1HA GLY 57 1HA GLY 57 -2.594 4.397 0.974 438 2HA GLY 57 2HA GLY 57 -1.267 3.508 1.716 439 H GLY 58 H GLY 58 -0.481 5.640 1.094 440 1HA GLY 58 1HA GLY 58 1.306 6.727 -0.282 441 2HA GLY 58 2HA GLY 58 0.852 5.738 -1.681 442 H GLY 59 H GLY 59 -1.659 5.845 -1.952 443 1HA GLY 59 1HA GLY 59 -3.450 7.214 -2.847 444 2HA GLY 59 2HA GLY 59 -3.429 7.781 -1.177 445 H PHE 60 H PHE 60 -4.081 8.944 -3.747 446 HA PHE 60 HA PHE 60 -2.369 11.050 -4.679 447 1HB PHE 60 1HB PHE 60 -5.386 11.270 -4.121 448 2HB PHE 60 2HB PHE 60 -4.451 12.269 -5.241 449 HD1 PHE 60 HD2 PHE 60 -2.642 9.780 -6.017 450 HD2 PHE 60 HD1 PHE 60 -6.806 10.442 -5.938 451 HE1 PHE 60 HE2 PHE 60 -2.946 8.085 -7.731 452 HE2 PHE 60 HE1 PHE 60 -7.106 8.753 -7.660 453 HZ PHE 60 HZ PHE 60 -5.176 7.571 -8.555 454 H THR 61 H THR 61 -2.093 13.139 -4.136 455 HA THR 61 HA THR 61 -1.389 13.616 -1.375 456 HB THR 61 HB THR 61 -1.943 15.672 -3.595 457 HG1 THR 61 HG1 THR 61 0.408 14.343 -2.718 458 1HG2 THR 61 3HG2 THR 61 -0.269 15.860 -1.000 459 2HG2 THR 61 1HG2 THR 61 -0.377 17.121 -2.257 460 3HG2 THR 61 2HG2 THR 61 -1.817 16.696 -1.295 461 H GLU 62 H GLU 62 -3.218 13.008 -0.263 462 HA GLU 62 HA GLU 62 -5.233 13.439 0.983 463 1HB GLU 62 1HB GLU 62 -4.046 16.267 0.687 464 2HB GLU 62 2HB GLU 62 -5.369 15.852 1.774 465 1HG GLU 62 1HG GLU 62 -3.306 15.811 3.078 466 2HG GLU 62 2HG GLU 62 -3.935 14.171 2.963 467 H GLN 63 H GLN 63 -7.101 13.229 0.257 468 HA GLN 63 HA GLN 63 -9.176 13.648 -0.787 469 1HB GLN 63 1HB GLN 63 -9.885 15.885 -1.302 470 2HB GLN 63 2HB GLN 63 -8.947 15.949 0.190 471 1HG GLN 63 1HG GLN 63 -6.924 16.713 -1.128 472 2HG GLN 63 2HG GLN 63 -7.863 16.628 -2.623 473 1HE2 GLN 63 2HE2 GLN 63 -10.086 19.397 -1.471 474 2HE2 GLN 63 1HE2 GLN 63 -10.253 17.650 -2.008 475 H MET 64 H MET 64 -6.447 15.057 -2.536 476 HA MET 64 HA MET 64 -6.217 13.421 -4.695 477 1HB MET 64 1HB MET 64 -8.500 15.319 -5.420 478 2HB MET 64 2HB MET 64 -7.705 14.204 -6.538 479 1HG MET 64 1HG MET 64 -9.257 13.371 -4.000 480 2HG MET 64 2HG MET 64 -9.808 13.161 -5.680 481 1HE MET 64 1HE MET 64 -9.579 10.674 -3.595 482 2HE MET 64 3HE MET 64 -10.102 10.475 -5.299 483 3HE MET 64 2HE MET 64 -8.804 9.442 -4.632 484 H GLN 65 H GLN 65 -4.463 14.099 -4.684 485 HA GLN 65 HA GLN 65 -3.703 16.490 -6.362 486 1HB GLN 65 1HB GLN 65 -3.660 17.479 -4.053 487 2HB GLN 65 2HB GLN 65 -2.595 16.180 -3.495 488 1HG GLN 65 1HG GLN 65 -0.865 16.859 -5.207 489 2HG GLN 65 2HG GLN 65 -1.932 18.140 -5.786 490 1HE2 GLN 65 2HE2 GLN 65 -0.872 20.409 -3.269 491 2HE2 GLN 65 1HE2 GLN 65 -1.720 20.081 -4.861 492 H GLN 66 H GLN 66 -3.479 14.747 -7.627 493 HA GLN 66 HA GLN 66 -2.557 12.289 -7.442 494 1HB GLN 66 1HB GLN 66 -1.391 12.304 -9.613 495 2HB GLN 66 2HB GLN 66 -2.891 13.204 -9.671 496 1HG GLN 66 1HG GLN 66 -0.098 14.471 -9.269 497 2HG GLN 66 2HG GLN 66 -0.901 14.335 -10.835 498 1HE2 GLN 66 2HE2 GLN 66 -3.576 16.697 -9.814 499 2HE2 GLN 66 1HE2 GLN 66 -3.429 14.983 -10.454 500 H LYS 67 H LYS 67 -0.643 11.322 -8.334 501 HA LYS 67 HA LYS 67 1.128 10.835 -6.179 502 1HB LYS 67 1HB LYS 67 2.075 10.598 -9.084 503 2HB LYS 67 2HB LYS 67 2.527 9.584 -7.710 504 1HG LYS 67 1HG LYS 67 0.864 8.393 -9.104 505 2HG LYS 67 2HG LYS 67 0.166 8.748 -7.520 506 1HD LYS 67 1HD LYS 67 -1.012 10.789 -8.498 507 2HD LYS 67 2HD LYS 67 -0.270 10.459 -10.055 508 1HE LYS 67 1HE LYS 67 -2.513 9.646 -10.220 509 2HE LYS 67 2HE LYS 67 -1.488 8.215 -10.164 510 1HZ LYS 67 3HZ LYS 67 -3.010 9.346 -7.856 511 2HZ LYS 67 1HZ LYS 67 -3.418 7.998 -8.718 512 3HZ LYS 67 2HZ LYS 67 -2.056 8.000 -7.783 513 H LYS 68 H LYS 68 3.553 10.895 -7.867 514 HA LYS 68 HA LYS 68 4.549 13.572 -8.338 515 1HB LYS 68 1HB LYS 68 4.106 13.869 -5.881 516 2HB LYS 68 2HB LYS 68 5.154 12.486 -5.521 517 1HG LYS 68 1HG LYS 68 7.098 13.665 -6.642 518 2HG LYS 68 2HG LYS 68 6.039 14.997 -7.071 519 1HD LYS 68 1HD LYS 68 7.303 15.745 -5.193 520 2HD LYS 68 2HD LYS 68 5.660 15.509 -4.613 521 1HE LYS 68 1HE LYS 68 6.360 13.273 -3.587 522 2HE LYS 68 2HE LYS 68 8.001 13.509 -4.206 523 1HZ LYS 68 2HZ LYS 68 8.159 15.527 -2.840 524 2HZ LYS 68 3HZ LYS 68 6.626 15.307 -2.265 525 3HZ LYS 68 1HZ LYS 68 7.810 14.212 -1.903 526 HA PRO 69 HA PRO 69 8.332 10.498 -7.822 527 1HB PRO 69 1HB PRO 69 7.823 8.221 -6.323 528 2HB PRO 69 2HB PRO 69 8.304 9.767 -5.588 529 1HG PRO 69 1HG PRO 69 5.459 8.669 -5.914 530 2HG PRO 69 2HG PRO 69 6.212 9.298 -4.427 531 1HD PRO 69 1HD PRO 69 4.594 10.903 -5.988 532 2HD PRO 69 2HD PRO 69 6.057 11.597 -5.216 533 H ASN 70 H ASN 70 8.707 9.388 -9.494 534 HA ASN 70 HA ASN 70 7.271 6.968 -10.366 535 1HB ASN 70 1HB ASN 70 6.794 9.531 -12.023 536 2HB ASN 70 2HB ASN 70 6.425 7.892 -12.574 537 1HD2 ASN 70 1HD2 ASN 70 3.323 9.406 -11.051 538 2HD2 ASN 70 2HD2 ASN 70 4.516 9.895 -12.356 539 HA PRO 71 HA PRO 71 11.756 7.791 -11.184 540 1HB PRO 71 1HB PRO 71 11.546 4.805 -10.633 541 2HB PRO 71 2HB PRO 71 12.838 5.928 -10.138 542 1HG PRO 71 1HG PRO 71 10.944 5.246 -8.314 543 2HG PRO 71 2HG PRO 71 11.398 6.962 -8.460 544 1HD PRO 71 1HD PRO 71 8.904 5.586 -9.594 545 2HD PRO 71 2HD PRO 71 9.046 7.202 -8.828 546 HA PRO 72 HA PRO 72 9.534 4.817 -11.401 547 1HB PRO 72 1HB PRO 72 9.510 2.649 -13.551 548 2HB PRO 72 2HB PRO 72 8.143 3.270 -12.598 549 1HG PRO 72 1HG PRO 72 8.341 4.031 -15.176 550 2HG PRO 72 2HG PRO 72 8.034 5.310 -13.965 551 1HD PRO 72 1HD PRO 72 10.777 4.481 -15.141 552 2HD PRO 72 2HD PRO 72 10.056 6.121 -15.072 553 H ILE 73 H ILE 73 9.776 1.850 -11.831 554 HA ILE 73 HA ILE 73 12.662 1.138 -11.726 555 HB ILE 73 HB ILE 73 12.802 0.289 -9.486 556 1HG1 ILE 73 1HG1 ILE 73 10.402 -0.424 -9.257 557 2HG1 ILE 73 2HG1 ILE 73 11.039 0.398 -7.830 558 1HG2 ILE 73 2HG2 ILE 73 13.333 2.718 -9.802 559 2HG2 ILE 73 3HG2 ILE 73 11.644 3.149 -9.432 560 3HG2 ILE 73 1HG2 ILE 73 12.675 2.421 -8.171 561 1HD1 ILE 73 2HD1 ILE 73 9.946 2.561 -8.562 562 2HD1 ILE 73 3HD1 ILE 73 9.283 1.733 -9.997 563 3HD1 ILE 73 1HD1 ILE 73 8.751 1.253 -8.364 564 H LYS 74 H LYS 74 13.105 -0.926 -11.764 565 HA LYS 74 HA LYS 74 11.827 -2.642 -13.448 566 1HB LYS 74 1HB LYS 74 12.968 -3.635 -10.773 567 2HB LYS 74 2HB LYS 74 12.816 -4.584 -12.258 568 1HG LYS 74 1HG LYS 74 14.524 -2.047 -11.851 569 2HG LYS 74 2HG LYS 74 15.139 -3.696 -12.002 570 1HD LYS 74 1HD LYS 74 14.208 -3.823 -14.363 571 2HD LYS 74 2HD LYS 74 13.584 -2.176 -14.204 572 1HE LYS 74 1HE LYS 74 15.956 -1.309 -13.873 573 2HE LYS 74 2HE LYS 74 16.579 -2.957 -14.037 574 1HZ LYS 74 1HZ LYS 74 15.064 -1.483 -16.140 575 2HZ LYS 74 2HZ LYS 74 16.694 -1.754 -16.128 576 3HZ LYS 74 3HZ LYS 74 15.647 -3.021 -16.294 577 H ASN 75 H ASN 75 10.355 -4.131 -13.578 578 HA ASN 75 HA ASN 75 7.790 -3.835 -12.449 579 1HB ASN 75 1HB ASN 75 9.076 -6.513 -13.265 580 2HB ASN 75 2HB ASN 75 7.343 -6.201 -13.132 581 1HD2 ASN 75 1HD2 ASN 75 9.409 -4.830 -16.408 582 2HD2 ASN 75 2HD2 ASN 75 10.240 -5.601 -14.965 583 H GLU 76 H GLU 76 6.855 -6.087 -11.420 584 HA GLU 76 HA GLU 76 7.940 -7.377 -9.167 585 1HB GLU 76 1HB GLU 76 7.358 -5.769 -7.252 586 2HB GLU 76 2HB GLU 76 8.773 -5.352 -8.219 587 1HG GLU 76 1HG GLU 76 7.445 -3.314 -7.863 588 2HG GLU 76 2HG GLU 76 7.464 -3.725 -9.574 589 H ALA 77 H ALA 77 6.584 -8.785 -8.883 590 HA ALA 77 HA ALA 77 3.922 -8.508 -7.817 591 1HB ALA 77 3HB ALA 77 3.916 -8.874 -10.893 592 2HB ALA 77 1HB ALA 77 2.489 -8.981 -9.830 593 3HB ALA 77 2HB ALA 77 3.340 -7.428 -10.020 594 H ASP 78 H ASP 78 5.658 -10.282 -10.332 595 HA ASP 78 HA ASP 78 4.659 -12.961 -9.554 596 1HB ASP 78 1HB ASP 78 6.376 -13.796 -11.106 597 2HB ASP 78 2HB ASP 78 5.501 -12.429 -11.820 598 H ASN 79 H ASN 79 5.648 -11.472 -7.363 599 HA ASN 79 HA ASN 79 8.185 -12.001 -6.285 600 1HB ASN 79 1HB ASN 79 7.132 -12.219 -4.052 601 2HB ASN 79 2HB ASN 79 6.366 -10.927 -4.978 602 1HD2 ASN 79 1HD2 ASN 79 3.239 -12.695 -5.385 603 2HD2 ASN 79 2HD2 ASN 79 4.361 -11.438 -6.110 604 H GLY 80 H GLY 80 5.534 -14.291 -6.632 605 1HA GLY 80 1HA GLY 80 5.511 -16.693 -6.656 606 2HA GLY 80 2HA GLY 80 7.252 -16.652 -6.985 607 H LEU 81 H LEU 81 4.857 -16.102 -4.480 608 HA LEU 81 HA LEU 81 6.232 -17.854 -2.496 609 1HB LEU 81 1HB LEU 81 6.067 -14.843 -1.873 610 2HB LEU 81 2HB LEU 81 6.657 -16.104 -0.791 611 HG LEU 81 HG LEU 81 7.906 -15.364 -3.503 612 1HD1 LEU 81 2HD1 LEU 81 8.261 -13.610 -1.739 613 2HD1 LEU 81 3HD1 LEU 81 8.889 -14.846 -0.618 614 3HD1 LEU 81 1HD1 LEU 81 9.788 -14.453 -2.107 615 1HD2 LEU 81 3HD2 LEU 81 8.194 -17.794 -2.930 616 2HD2 LEU 81 1HD2 LEU 81 9.748 -16.928 -2.812 617 3HD2 LEU 81 2HD2 LEU 81 8.848 -17.352 -1.332 618 NH1 ARG 82 NH2 ARG 82 1.456 -22.215 -1.303 619 NH2 ARG 82 NH1 ARG 82 3.170 -23.648 -0.882 620 H ARG 82 H ARG 82 5.285 -17.335 -0.284 621 HA ARG 82 HA ARG 82 2.320 -17.801 -0.447 622 1HB ARG 82 1HB ARG 82 4.167 -17.409 1.977 623 2HB ARG 82 2HB ARG 82 2.483 -17.948 2.039 624 1HG ARG 82 1HG ARG 82 4.826 -19.367 0.623 625 2HG ARG 82 2HG ARG 82 4.027 -19.907 2.106 626 1HD ARG 82 1HD ARG 82 1.851 -20.209 0.822 627 2HD ARG 82 2HD ARG 82 2.647 -19.646 -0.659 628 HE ARG 82 HE ARG 82 4.187 -21.895 0.407 629 1HH1 ARG 82 2HH2 ARG 82 1.055 -21.281 -1.163 630 2HH1 ARG 82 1HH2 ARG 82 1.048 -22.984 -1.847 631 1HH2 ARG 82 1HH1 ARG 82 4.074 -23.810 -0.424 632 2HH2 ARG 82 2HH1 ARG 82 2.643 -24.317 -1.455 633 H ASN 83 H ASN 83 0.786 -16.489 -0.019 634 HA ASN 83 HA ASN 83 1.183 -13.748 1.195 635 1HB ASN 83 1HB ASN 83 0.249 -14.095 -1.724 636 2HB ASN 83 2HB ASN 83 0.255 -12.576 -0.818 637 1HD2 ASN 83 1HD2 ASN 83 4.016 -12.788 -0.564 638 2HD2 ASN 83 2HD2 ASN 83 2.616 -12.866 0.619 639 H THR 84 H THR 84 -0.393 -13.184 2.276 640 HA THR 84 HA THR 84 -3.267 -13.949 1.760 641 HB THR 84 HB THR 84 -1.460 -15.153 3.938 642 HG1 THR 84 HG1 THR 84 -3.229 -16.237 2.000 643 1HG2 THR 84 3HG2 THR 84 -4.537 -15.204 3.744 644 2HG2 THR 84 1HG2 THR 84 -3.550 -16.139 4.911 645 3HG2 THR 84 2HG2 THR 84 -3.579 -14.356 4.987 646 NH1 ARG 85 NH2 ARG 85 -10.305 -11.621 8.234 647 NH2 ARG 85 NH1 ARG 85 -9.655 -9.840 9.488 648 H ARG 85 H ARG 85 -4.676 -13.073 3.103 649 HA ARG 85 HA ARG 85 -4.487 -10.465 4.240 650 1HB ARG 85 1HB ARG 85 -6.606 -11.813 4.174 651 2HB ARG 85 2HB ARG 85 -5.935 -12.948 5.357 652 1HG ARG 85 1HG ARG 85 -5.690 -11.049 7.021 653 2HG ARG 85 2HG ARG 85 -6.416 -9.940 5.854 654 1HD ARG 85 1HD ARG 85 -8.554 -11.314 5.866 655 2HD ARG 85 2HD ARG 85 -7.819 -12.449 7.014 656 HE ARG 85 HE ARG 85 -7.663 -9.750 8.149 657 1HH1 ARG 85 2HH2 ARG 85 -10.088 -12.261 7.462 658 2HH1 ARG 85 1HH2 ARG 85 -11.144 -11.634 8.825 659 1HH2 ARG 85 1HH1 ARG 85 -8.946 -9.123 9.675 660 2HH2 ARG 85 2HH1 ARG 85 -10.539 -9.977 9.991 661 H GLY 86 H GLY 86 -2.242 -10.369 6.746 662 1HA GLY 86 1HA GLY 86 -3.650 -9.566 4.126 663 2HA GLY 86 2HA GLY 86 -3.715 -8.492 5.531 664 H THR 87 H THR 87 -1.601 -10.195 3.349 665 HA THR 87 HA THR 87 0.906 -8.682 3.798 666 HB THR 87 HB THR 87 1.477 -9.424 1.481 667 HG1 THR 87 HG1 THR 87 -0.643 -9.288 0.673 668 1HG2 THR 87 2HG2 THR 87 1.843 -10.954 3.436 669 2HG2 THR 87 3HG2 THR 87 0.190 -11.599 3.255 670 3HG2 THR 87 1HG2 THR 87 1.406 -11.882 1.978 671 H ILE 88 H ILE 88 1.628 -6.973 3.042 672 HA ILE 88 HA ILE 88 -0.038 -5.066 1.325 673 HB ILE 88 HB ILE 88 0.928 -3.604 2.700 674 1HG1 ILE 88 1HG1 ILE 88 3.330 -2.909 1.838 675 2HG1 ILE 88 2HG1 ILE 88 3.115 -4.220 0.713 676 1HG2 ILE 88 2HG2 ILE 88 2.046 -5.245 4.223 677 2HG2 ILE 88 3HG2 ILE 88 3.402 -5.406 3.070 678 3HG2 ILE 88 1HG2 ILE 88 3.118 -3.857 3.905 679 1HD1 ILE 88 2HD1 ILE 88 0.922 -3.046 -0.080 680 2HD1 ILE 88 3HD1 ILE 88 1.210 -1.777 1.135 681 3HD1 ILE 88 1HD1 ILE 88 2.331 -1.955 -0.237 682 H ALA 89 H ALA 89 0.870 -4.244 -0.470 683 HA ALA 89 HA ALA 89 2.992 -5.684 -2.003 684 1HB ALA 89 2HB ALA 89 1.141 -7.384 -2.180 685 2HB ALA 89 3HB ALA 89 0.059 -6.146 -2.872 686 3HB ALA 89 1HB ALA 89 1.509 -6.666 -3.768 687 H MET 90 H MET 90 3.851 -4.485 -3.327 688 HA MET 90 HA MET 90 3.125 -1.697 -3.691 689 1HB MET 90 1HB MET 90 5.447 -2.887 -3.982 690 2HB MET 90 2HB MET 90 4.934 -3.189 -5.647 691 1HG MET 90 1HG MET 90 5.133 -0.465 -4.207 692 2HG MET 90 2HG MET 90 6.182 -1.040 -5.521 693 1HE MET 90 3HE MET 90 5.566 1.407 -6.667 694 2HE MET 90 2HE MET 90 3.892 1.887 -7.079 695 3HE MET 90 1HE MET 90 4.391 1.779 -5.366 696 H ALA 91 H ALA 91 1.699 -0.799 -4.819 697 HA ALA 91 HA ALA 91 -0.171 -2.049 -6.650 698 1HB ALA 91 2HB ALA 91 -0.556 0.194 -5.589 699 2HB ALA 91 3HB ALA 91 0.749 0.901 -6.578 700 3HB ALA 91 1HB ALA 91 -0.733 0.290 -7.359 701 NH1 ARG 92 NH2 ARG 92 4.754 -6.593 -11.330 702 NH2 ARG 92 NH1 ARG 92 5.424 -5.302 -13.078 703 H ARG 92 H ARG 92 -0.375 -0.802 -8.880 704 HA ARG 92 HA ARG 92 1.947 -0.364 -10.556 705 1HB ARG 92 1HB ARG 92 0.831 -3.231 -10.707 706 2HB ARG 92 2HB ARG 92 1.964 -2.513 -11.862 707 1HG ARG 92 1HG ARG 92 3.597 -2.072 -9.940 708 2HG ARG 92 2HG ARG 92 2.461 -2.830 -8.838 709 1HD ARG 92 1HD ARG 92 4.133 -4.490 -9.315 710 2HD ARG 92 2HD ARG 92 2.662 -5.022 -10.134 711 HE ARG 92 HE ARG 92 4.323 -3.457 -12.008 712 1HH1 ARG 92 2HH2 ARG 92 4.252 -6.647 -10.437 713 2HH1 ARG 92 1HH2 ARG 92 5.233 -7.361 -11.814 714 1HH2 ARG 92 1HH1 ARG 92 5.435 -4.375 -13.518 715 2HH2 ARG 92 2HH1 ARG 92 5.857 -6.159 -13.439 716 H THR 93 H THR 93 0.957 1.061 -11.622 717 HA THR 93 HA THR 93 -1.799 1.210 -12.422 718 HB THR 93 HB THR 93 0.672 2.273 -13.911 719 HG1 THR 93 HG1 THR 93 0.438 2.905 -11.737 720 1HG2 THR 93 2HG2 THR 93 -2.298 3.132 -13.998 721 2HG2 THR 93 3HG2 THR 93 -0.955 3.962 -14.832 722 3HG2 THR 93 1HG2 THR 93 -1.420 2.308 -15.314 723 H ALA 94 H ALA 94 0.567 1.025 -14.937 724 HA ALA 94 HA ALA 94 -0.726 -1.463 -16.193 725 1HB ALA 94 3HB ALA 94 -0.263 1.245 -17.619 726 2HB ALA 94 1HB ALA 94 -0.846 -0.256 -18.384 727 3HB ALA 94 2HB ALA 94 -1.852 0.572 -17.170 728 H ASP 95 H ASP 95 1.560 1.025 -17.205 729 HA ASP 95 HA ASP 95 3.484 -0.629 -18.502 730 1HB ASP 95 1HB ASP 95 4.057 1.833 -16.743 731 2HB ASP 95 2HB ASP 95 5.180 1.137 -17.925 732 H LYS 96 H LYS 96 4.773 -2.105 -17.952 733 HA LYS 96 HA LYS 96 4.900 -3.532 -15.527 734 1HB LYS 96 1HB LYS 96 7.287 -2.979 -17.386 735 2HB LYS 96 2HB LYS 96 7.156 -4.326 -16.242 736 1HG LYS 96 1HG LYS 96 5.106 -5.173 -17.439 737 2HG LYS 96 2HG LYS 96 5.132 -3.768 -18.488 738 1HD LYS 96 1HD LYS 96 5.970 -5.533 -19.801 739 2HD LYS 96 2HD LYS 96 7.363 -4.531 -19.475 740 1HE LYS 96 1HE LYS 96 6.697 -7.130 -17.901 741 2HE LYS 96 2HE LYS 96 7.650 -7.112 -19.380 742 1HZ LYS 96 3HZ LYS 96 9.285 -5.688 -18.286 743 2HZ LYS 96 1HZ LYS 96 8.411 -5.689 -16.884 744 3HZ LYS 96 2HZ LYS 96 9.072 -7.095 -17.446 745 H ASP 97 H ASP 97 8.010 -2.390 -16.109 746 HA ASP 97 HA ASP 97 8.619 -1.512 -13.404 747 1HB ASP 97 1HB ASP 97 9.869 -0.572 -16.059 748 2HB ASP 97 2HB ASP 97 10.583 -0.347 -14.452 749 H SER 98 H SER 98 7.651 -0.017 -12.376 750 HA SER 98 HA SER 98 7.533 2.801 -13.241 751 1HB SER 98 1HB SER 98 5.757 1.844 -14.743 752 2HB SER 98 2HB SER 98 4.896 1.205 -13.329 753 HG SER 98 HG SER 98 5.546 3.930 -13.823 754 H ALA 99 H ALA 99 5.936 0.315 -11.293 755 HA ALA 99 HA ALA 99 4.720 1.693 -9.225 756 1HB ALA 99 2HB ALA 99 4.966 -0.801 -9.204 757 2HB ALA 99 3HB ALA 99 6.687 -0.649 -8.757 758 3HB ALA 99 1HB ALA 99 5.418 -0.115 -7.628 759 H THR 100 H THR 100 5.379 3.632 -8.859 760 HA THR 100 HA THR 100 8.192 4.382 -8.256 761 HB THR 100 HB THR 100 7.276 6.642 -7.912 762 HG1 THR 100 HG1 THR 100 5.372 5.963 -6.867 763 1HG2 THR 100 2HG2 THR 100 7.621 5.812 -10.264 764 2HG2 THR 100 3HG2 THR 100 5.960 5.162 -10.286 765 3HG2 THR 100 1HG2 THR 100 6.227 6.923 -10.180 766 H SER 101 H SER 101 5.240 3.907 -6.380 767 HA SER 101 HA SER 101 6.725 3.432 -3.858 768 1HB SER 101 1HB SER 101 5.928 5.451 -2.626 769 2HB SER 101 2HB SER 101 6.992 5.905 -3.970 770 HG SER 101 HG SER 101 5.097 7.149 -3.887 771 H GLN 102 H GLN 102 3.668 4.621 -5.186 772 HA GLN 102 HA GLN 102 1.773 3.928 -3.281 773 1HB GLN 102 1HB GLN 102 0.181 3.377 -5.098 774 2HB GLN 102 2HB GLN 102 1.172 4.773 -5.540 775 1HG GLN 102 1HG GLN 102 2.714 3.267 -6.862 776 2HG GLN 102 2HG GLN 102 1.748 1.863 -6.395 777 1HE2 GLN 102 2HE2 GLN 102 -0.236 4.624 -8.783 778 2HE2 GLN 102 1HE2 GLN 102 0.747 5.151 -7.326 779 H PHE 103 H PHE 103 0.537 2.242 -2.704 780 HA PHE 103 HA PHE 103 1.130 -0.562 -3.549 781 1HB PHE 103 1HB PHE 103 1.896 -1.384 -1.365 782 2HB PHE 103 2HB PHE 103 3.012 -0.157 -1.959 783 HD1 PHE 103 HD1 PHE 103 -0.014 -0.535 0.183 784 HD2 PHE 103 HD2 PHE 103 3.508 1.667 -0.556 785 HE1 PHE 103 HE1 PHE 103 -0.348 0.694 2.250 786 HE2 PHE 103 HE2 PHE 103 3.169 2.894 1.515 787 HZ PHE 103 HZ PHE 103 1.244 2.396 2.922 788 H PHE 104 H PHE 104 0.150 -1.894 -1.399 789 HA PHE 104 HA PHE 104 -2.557 -0.847 -0.706 790 1HB PHE 104 1HB PHE 104 -3.902 -2.354 -2.047 791 2HB PHE 104 2HB PHE 104 -2.888 -1.403 -3.126 792 HD1 PHE 104 HD1 PHE 104 -3.168 -4.681 -1.441 793 HD2 PHE 104 HD2 PHE 104 -1.351 -2.511 -4.565 794 HE1 PHE 104 HE1 PHE 104 -2.405 -6.764 -2.444 795 HE2 PHE 104 HE2 PHE 104 -0.588 -4.594 -5.567 796 HZ PHE 104 HZ PHE 104 -1.135 -6.722 -4.517 797 H ILE 105 H ILE 105 -3.000 -1.470 1.028 798 HA ILE 105 HA ILE 105 -1.812 -3.984 2.290 799 HB ILE 105 HB ILE 105 -3.546 -1.755 3.494 800 1HG1 ILE 105 1HG1 ILE 105 -0.501 -2.211 3.560 801 2HG1 ILE 105 2HG1 ILE 105 -1.324 -0.951 2.631 802 1HG2 ILE 105 2HG2 ILE 105 -3.648 -3.949 4.714 803 2HG2 ILE 105 3HG2 ILE 105 -1.868 -4.014 4.769 804 3HG2 ILE 105 1HG2 ILE 105 -2.741 -2.742 5.665 805 1HD1 ILE 105 2HD1 ILE 105 -2.274 0.027 4.772 806 2HD1 ILE 105 3HD1 ILE 105 -1.444 -1.242 5.713 807 3HD1 ILE 105 1HD1 ILE 105 -0.492 -0.028 4.818 808 H ASN 106 H ASN 106 -2.845 -5.685 1.649 809 HA ASN 106 HA ASN 106 -5.740 -5.868 1.056 810 1HB ASN 106 1HB ASN 106 -5.407 -8.282 1.010 811 2HB ASN 106 2HB ASN 106 -4.050 -7.511 0.187 812 1HD2 ASN 106 1HD2 ASN 106 -3.420 -9.653 3.630 813 2HD2 ASN 106 2HD2 ASN 106 -5.087 -9.345 2.928 814 H VAL 107 H VAL 107 -7.311 -6.849 2.208 815 HA VAL 107 HA VAL 107 -6.920 -7.403 5.179 816 HB VAL 107 HB VAL 107 -8.831 -5.997 5.810 817 1HG1 VAL 107 3HG2 VAL 107 -6.525 -5.007 5.866 818 2HG1 VAL 107 1HG2 VAL 107 -6.711 -4.447 4.184 819 3HG1 VAL 107 2HG2 VAL 107 -7.736 -3.759 5.471 820 1HG2 VAL 107 2HG1 VAL 107 -10.088 -6.112 3.639 821 2HG2 VAL 107 3HG1 VAL 107 -9.859 -4.417 4.145 822 3HG2 VAL 107 1HG1 VAL 107 -8.842 -5.108 2.852 823 H ALA 108 H ALA 108 -7.104 -9.129 3.168 824 HA ALA 108 HA ALA 108 -9.004 -11.010 4.184 825 1HB ALA 108 2HB ALA 108 -10.791 -9.456 3.316 826 2HB ALA 108 3HB ALA 108 -10.107 -9.570 1.673 827 3HB ALA 108 1HB ALA 108 -10.825 -11.008 2.444 828 H ASP 109 H ASP 109 -8.750 -12.909 3.436 829 HA ASP 109 HA ASP 109 -6.505 -13.909 2.216 830 1HB ASP 109 1HB ASP 109 -9.339 -14.902 1.544 831 2HB ASP 109 2HB ASP 109 -7.848 -15.834 1.322 832 H ASN 110 H ASN 110 -5.555 -14.139 0.406 833 HA ASN 110 HA ASN 110 -6.799 -13.526 -2.265 834 1HB ASN 110 1HB ASN 110 -4.598 -11.699 -1.111 835 2HB ASN 110 2HB ASN 110 -5.219 -11.651 -2.770 836 1HD2 ASN 110 1HD2 ASN 110 -7.221 -9.065 -1.149 837 2HD2 ASN 110 2HD2 ASN 110 -5.565 -9.385 -1.873 838 H ALA 111 H ALA 111 -5.524 -13.836 -3.970 839 HA ALA 111 HA ALA 111 -2.817 -14.809 -4.106 840 1HB ALA 111 3HB ALA 111 -4.871 -17.090 -3.688 841 2HB ALA 111 1HB ALA 111 -3.159 -17.304 -4.141 842 3HB ALA 111 2HB ALA 111 -3.579 -16.637 -2.543 843 H PHE 112 H PHE 112 -6.036 -15.892 -5.061 844 HA PHE 112 HA PHE 112 -5.776 -16.354 -7.865 845 1HB PHE 112 1HB PHE 112 -8.114 -15.466 -8.061 846 2HB PHE 112 2HB PHE 112 -7.932 -16.564 -6.694 847 HD1 PHE 112 HD2 PHE 112 -7.626 -15.589 -4.388 848 HD2 PHE 112 HD1 PHE 112 -8.686 -13.173 -7.681 849 HE1 PHE 112 HE2 PHE 112 -8.405 -13.860 -2.872 850 HE2 PHE 112 HE1 PHE 112 -9.464 -11.446 -6.160 851 HZ PHE 112 HZ PHE 112 -9.325 -11.788 -3.755 852 H LEU 113 H LEU 113 -5.994 -13.313 -6.106 853 HA LEU 113 HA LEU 113 -5.852 -11.454 -8.364 854 1HB LEU 113 1HB LEU 113 -6.380 -10.730 -6.021 855 2HB LEU 113 2HB LEU 113 -4.749 -11.175 -5.498 856 HG LEU 113 HG LEU 113 -3.778 -9.560 -7.176 857 1HD1 LEU 113 2HD1 LEU 113 -5.687 -9.578 -8.810 858 2HD1 LEU 113 3HD1 LEU 113 -6.730 -8.757 -7.618 859 3HD1 LEU 113 1HD1 LEU 113 -5.312 -7.913 -8.294 860 1HD2 LEU 113 3HD2 LEU 113 -4.160 -8.835 -4.804 861 2HD2 LEU 113 1HD2 LEU 113 -4.409 -7.475 -5.927 862 3HD2 LEU 113 2HD2 LEU 113 -5.814 -8.311 -5.215 863 H ASP 114 H ASP 114 -3.383 -12.809 -6.214 864 HA ASP 114 HA ASP 114 -1.035 -11.578 -7.097 865 1HB ASP 114 1HB ASP 114 0.207 -13.617 -6.505 866 2HB ASP 114 2HB ASP 114 -1.104 -13.349 -5.344 867 H HIS 115 H HIS 115 0.272 -11.544 -8.678 868 HA HIS 115 HA HIS 115 -0.324 -11.936 -11.389 869 1HB HIS 115 1HB HIS 115 1.773 -10.866 -10.717 870 2HB HIS 115 2HB HIS 115 2.376 -12.350 -9.970 871 HD2 HIS 115 HD2 HIS 115 4.440 -12.780 -11.501 872 HE1 HIS 115 HE1 HIS 115 2.475 -13.173 -15.148 873 HE2 HIS 115 HE2 HIS 115 4.780 -13.479 -14.041 874 H GLY 116 H GLY 116 -1.157 -13.483 -12.350 875 1HA GLY 116 1HA GLY 116 0.100 -16.118 -12.744 876 2HA GLY 116 2HA GLY 116 -1.236 -16.286 -11.582 877 H GLN 117 H GLN 117 -3.265 -16.083 -12.199 878 HA GLN 117 HA GLN 117 -4.099 -16.854 -14.822 879 1HB GLN 117 1HB GLN 117 -5.605 -16.917 -12.834 880 2HB GLN 117 2HB GLN 117 -5.665 -15.149 -12.790 881 1HG GLN 117 1HG GLN 117 -7.667 -16.042 -13.960 882 2HG GLN 117 2HG GLN 117 -6.680 -15.091 -15.077 883 1HE2 GLN 117 2HE2 GLN 117 -7.664 -18.432 -16.634 884 2HE2 GLN 117 1HE2 GLN 117 -8.584 -17.124 -15.733 885 NH1 ARG 118 NH2 ARG 118 -9.424 -10.640 -15.785 886 NH2 ARG 118 NH1 ARG 118 -10.652 -12.519 -16.144 887 H ARG 118 H ARG 118 -3.601 -15.963 -16.569 888 HA ARG 118 HA ARG 118 -3.901 -14.282 -18.332 889 1HB ARG 118 1HB ARG 118 -4.258 -12.344 -15.967 890 2HB ARG 118 2HB ARG 118 -4.447 -11.925 -17.678 891 1HG ARG 118 1HG ARG 118 -6.277 -13.653 -17.900 892 2HG ARG 118 2HG ARG 118 -6.079 -14.087 -16.200 893 1HD ARG 118 1HD ARG 118 -6.734 -11.725 -15.516 894 2HD ARG 118 2HD ARG 118 -6.940 -11.292 -17.224 895 HE ARG 118 HE ARG 118 -8.602 -13.630 -16.716 896 1HH1 ARG 118 2HH2 ARG 118 -8.497 -10.200 -15.783 897 2HH1 ARG 118 1HH2 ARG 118 -10.316 -10.194 -15.546 898 1HH2 ARG 118 1HH1 ARG 118 -10.666 -13.508 -16.415 899 2HH2 ARG 118 2HH1 ARG 118 -11.459 -11.943 -15.880 900 H ASP 119 H ASP 119 -2.588 -12.508 -15.603 901 HA ASP 119 HA ASP 119 0.237 -12.981 -16.056 902 1HB ASP 119 1HB ASP 119 0.913 -10.937 -17.275 903 2HB ASP 119 2HB ASP 119 -0.189 -11.908 -18.266 904 H PHE 120 H PHE 120 1.508 -10.858 -15.488 905 HA PHE 120 HA PHE 120 1.309 -10.453 -12.685 906 1HB PHE 120 1HB PHE 120 2.265 -8.370 -14.743 907 2HB PHE 120 2HB PHE 120 2.646 -8.361 -13.020 908 HD1 PHE 120 HD1 PHE 120 3.095 -10.250 -16.159 909 HD2 PHE 120 HD2 PHE 120 4.271 -9.886 -12.124 910 HE1 PHE 120 HE1 PHE 120 4.949 -11.769 -16.560 911 HE2 PHE 120 HE2 PHE 120 6.124 -11.405 -12.529 912 HZ PHE 120 HZ PHE 120 6.464 -12.347 -14.746 913 H GLY 121 H GLY 121 0.996 -8.349 -11.618 914 1HA GLY 121 1HA GLY 121 -1.076 -6.439 -12.487 915 2HA GLY 121 2HA GLY 121 -1.828 -7.687 -11.471 916 OH TYR 122 OH TYR 122 -6.500 -4.047 -9.428 917 H TYR 122 H TYR 122 -1.799 -7.456 -9.440 918 HA TYR 122 HA TYR 122 -0.580 -5.031 -8.184 919 1HB TYR 122 1HB TYR 122 -2.126 -7.355 -6.887 920 2HB TYR 122 2HB TYR 122 -1.754 -5.804 -6.135 921 HD1 TYR 122 HD2 TYR 122 -2.778 -3.740 -7.000 922 HD2 TYR 122 HD1 TYR 122 -3.826 -7.508 -8.588 923 HE1 TYR 122 HE2 TYR 122 -4.761 -2.764 -8.015 924 HE2 TYR 122 HE1 TYR 122 -5.808 -6.528 -9.600 925 HH TYR 122 HH TYR 122 -6.529 -3.110 -9.218 926 H ALA 123 H ALA 123 1.345 -4.925 -7.614 927 HA ALA 123 HA ALA 123 3.303 -7.005 -7.342 928 1HB ALA 123 2HB ALA 123 3.867 -4.566 -7.474 929 2HB ALA 123 3HB ALA 123 3.215 -4.311 -5.832 930 3HB ALA 123 1HB ALA 123 4.661 -5.326 -6.074 931 H VAL 124 H VAL 124 4.412 -6.457 -4.815 932 HA VAL 124 HA VAL 124 2.816 -7.217 -2.532 933 HB VAL 124 HB VAL 124 3.940 -9.606 -4.116 934 1HG1 VAL 124 3HG2 VAL 124 4.605 -9.786 -1.706 935 2HG1 VAL 124 1HG2 VAL 124 2.915 -9.520 -1.204 936 3HG1 VAL 124 2HG2 VAL 124 3.359 -10.994 -2.107 937 1HG2 VAL 124 1HG1 VAL 124 1.122 -9.000 -2.996 938 2HG2 VAL 124 2HG1 VAL 124 1.595 -8.924 -4.713 939 3HG2 VAL 124 3HG1 VAL 124 1.596 -10.488 -3.860 940 H PHE 125 H PHE 125 4.033 -6.515 -1.021 941 HA PHE 125 HA PHE 125 6.784 -7.594 -0.584 942 1HB PHE 125 1HB PHE 125 8.038 -5.582 -0.888 943 2HB PHE 125 2HB PHE 125 7.055 -5.710 -2.349 944 HD1 PHE 125 HD1 PHE 125 4.460 -4.773 -1.594 945 HD2 PHE 125 HD2 PHE 125 8.187 -3.370 -0.203 946 HE1 PHE 125 HE1 PHE 125 3.422 -2.683 -0.920 947 HE2 PHE 125 HE2 PHE 125 7.146 -1.279 0.463 948 HZ PHE 125 HZ PHE 125 4.750 -0.959 0.157 949 H GLY 126 H GLY 126 4.112 -7.291 0.762 950 1HA GLY 126 1HA GLY 126 5.195 -6.329 3.443 951 2HA GLY 126 2HA GLY 126 3.752 -5.541 2.792 952 H LYS 127 H LYS 127 3.029 -6.228 4.693 953 HA LYS 127 HA LYS 127 1.238 -8.419 4.836 954 1HB LYS 127 1HB LYS 127 3.874 -9.168 6.236 955 2HB LYS 127 2HB LYS 127 2.382 -10.123 6.266 956 1HG LYS 127 1HG LYS 127 2.454 -10.315 3.753 957 2HG LYS 127 2HG LYS 127 3.934 -9.373 3.696 958 1HD LYS 127 1HD LYS 127 3.619 -12.108 5.101 959 2HD LYS 127 2HD LYS 127 4.234 -11.905 3.478 960 1HE LYS 127 1HE LYS 127 5.612 -10.783 6.014 961 2HE LYS 127 2HE LYS 127 6.027 -12.293 5.214 962 1HZ LYS 127 2HZ LYS 127 6.623 -11.036 3.216 963 2HZ LYS 127 3HZ LYS 127 6.235 -9.607 3.948 964 3HZ LYS 127 1HZ LYS 127 7.492 -10.513 4.520 965 H VAL 128 H VAL 128 0.007 -7.131 5.915 966 HA VAL 128 HA VAL 128 0.493 -5.257 7.952 967 HB VAL 128 HB VAL 128 -1.842 -7.254 7.916 968 1HG1 VAL 128 3HG2 VAL 128 -1.607 -6.023 10.095 969 2HG1 VAL 128 1HG2 VAL 128 -1.537 -4.470 9.223 970 3HG1 VAL 128 2HG2 VAL 128 -3.033 -5.442 9.195 971 1HG2 VAL 128 2HG1 VAL 128 -1.543 -6.010 5.751 972 2HG2 VAL 128 3HG1 VAL 128 -2.995 -5.434 6.611 973 3HG2 VAL 128 1HG1 VAL 128 -1.499 -4.462 6.633 974 H VAL 129 H VAL 129 1.605 -5.317 9.629 975 HA VAL 129 HA VAL 129 2.636 -7.680 10.968 976 HB VAL 129 HB VAL 129 2.258 -4.847 12.102 977 1HG1 VAL 129 3HG2 VAL 129 2.673 -6.587 13.867 978 2HG1 VAL 129 1HG2 VAL 129 4.094 -7.177 12.968 979 3HG1 VAL 129 2HG2 VAL 129 4.101 -5.537 13.670 980 1HG2 VAL 129 2HG1 VAL 129 3.579 -4.911 9.963 981 2HG2 VAL 129 3HG1 VAL 129 4.639 -4.540 11.348 982 3HG2 VAL 129 1HG1 VAL 129 4.635 -6.178 10.640 983 H LYS 130 H LYS 130 0.088 -5.410 11.896 984 HA LYS 130 HA LYS 130 -1.943 -7.168 12.713 985 1HB LYS 130 1HB LYS 130 -1.588 -7.590 15.130 986 2HB LYS 130 2HB LYS 130 -0.266 -8.294 14.190 987 1HG LYS 130 1HG LYS 130 0.628 -7.068 16.168 988 2HG LYS 130 2HG LYS 130 1.193 -6.341 14.659 989 1HD LYS 130 1HD LYS 130 -0.623 -4.579 14.819 990 2HD LYS 130 2HD LYS 130 -1.193 -5.302 16.328 991 1HE LYS 130 1HE LYS 130 1.061 -4.828 17.409 992 2HE LYS 130 2HE LYS 130 1.633 -4.104 15.898 993 1HZ LYS 130 3HZ LYS 130 -0.679 -3.117 17.502 994 2HZ LYS 130 1HZ LYS 130 0.820 -2.425 17.433 995 3HZ LYS 130 2HZ LYS 130 -0.145 -2.441 16.092 996 H GLY 131 H GLY 131 -2.793 -5.285 11.919 997 1HA GLY 131 1HA GLY 131 -3.765 -3.409 14.033 998 2HA GLY 131 2HA GLY 131 -2.641 -2.615 12.920 999 H MET 132 H MET 132 -4.600 -5.201 11.702 1000 HA MET 132 HA MET 132 -6.051 -3.612 9.728 1001 1HB MET 132 1HB MET 132 -6.670 -6.340 10.992 1002 2HB MET 132 2HB MET 132 -7.685 -5.604 9.741 1003 1HG MET 132 1HG MET 132 -4.665 -6.144 9.443 1004 2HG MET 132 2HG MET 132 -5.975 -7.096 8.700 1005 1HE MET 132 2HE MET 132 -3.664 -5.779 6.889 1006 2HE MET 132 1HE MET 132 -5.055 -6.673 6.195 1007 3HE MET 132 3HE MET 132 -4.629 -5.053 5.571 1008 H ASP 133 H ASP 133 -6.501 -4.033 13.124 1009 HA ASP 133 HA ASP 133 -9.270 -3.303 13.533 1010 1HB ASP 133 1HB ASP 133 -7.645 -3.802 15.381 1011 2HB ASP 133 2HB ASP 133 -6.767 -2.303 15.029 1012 H VAL 134 H VAL 134 -6.432 -1.202 13.378 1013 HA VAL 134 HA VAL 134 -7.897 1.309 12.934 1014 HB VAL 134 HB VAL 134 -5.008 0.527 12.237 1015 1HG1 VAL 134 1HG2 VAL 134 -6.360 3.299 12.366 1016 2HG1 VAL 134 2HG2 VAL 134 -4.617 3.002 12.124 1017 3HG1 VAL 134 3HG2 VAL 134 -5.788 2.480 10.888 1018 1HG2 VAL 134 2HG1 VAL 134 -5.589 0.380 14.683 1019 2HG2 VAL 134 3HG1 VAL 134 -4.495 1.755 14.375 1020 3HG2 VAL 134 1HG1 VAL 134 -6.236 2.040 14.638 1021 H ALA 135 H ALA 135 -5.692 -0.258 10.675 1022 HA ALA 135 HA ALA 135 -6.455 0.939 8.260 1023 1HB ALA 135 2HB ALA 135 -4.664 -0.816 8.418 1024 2HB ALA 135 3HB ALA 135 -5.906 -2.083 8.621 1025 3HB ALA 135 1HB ALA 135 -5.792 -1.181 7.086 1026 H ASP 136 H ASP 136 -7.915 -1.924 9.681 1027 HA ASP 136 HA ASP 136 -10.149 -2.232 7.774 1028 1HB ASP 136 1HB ASP 136 -9.919 -3.050 10.736 1029 2HB ASP 136 2HB ASP 136 -11.189 -3.589 9.624 1030 H LYS 137 H LYS 137 -10.156 -1.228 11.165 1031 HA LYS 137 HA LYS 137 -12.641 -0.018 11.497 1032 1HB LYS 137 1HB LYS 137 -10.847 0.002 13.222 1033 2HB LYS 137 2HB LYS 137 -9.954 1.236 12.316 1034 1HG LYS 137 1HG LYS 137 -11.931 2.787 12.468 1035 2HG LYS 137 2HG LYS 137 -12.843 1.586 13.363 1036 1HD LYS 137 1HD LYS 137 -10.210 2.892 14.319 1037 2HD LYS 137 2HD LYS 137 -11.801 3.459 14.768 1038 1HE LYS 137 1HE LYS 137 -10.678 0.669 15.507 1039 2HE LYS 137 2HE LYS 137 -10.657 2.084 16.552 1040 1HZ LYS 137 1HZ LYS 137 -13.092 2.113 16.510 1041 2HZ LYS 137 2HZ LYS 137 -13.132 0.786 15.527 1042 3HZ LYS 137 3HZ LYS 137 -12.530 0.660 17.060 1043 H ILE 138 H ILE 138 -9.837 1.481 10.001 1044 HA ILE 138 HA ILE 138 -11.194 3.891 8.908 1045 HB ILE 138 HB ILE 138 -8.759 2.330 7.854 1046 1HG1 ILE 138 1HG1 ILE 138 -9.010 4.728 9.766 1047 2HG1 ILE 138 2HG1 ILE 138 -8.446 3.109 10.197 1048 1HG2 ILE 138 2HG2 ILE 138 -9.820 3.859 6.162 1049 2HG2 ILE 138 3HG2 ILE 138 -9.756 5.208 7.327 1050 3HG2 ILE 138 1HG2 ILE 138 -8.245 4.503 6.696 1051 1HD1 ILE 138 3HD1 ILE 138 -7.068 4.991 8.155 1052 2HD1 ILE 138 1HD1 ILE 138 -6.496 4.656 9.809 1053 3HD1 ILE 138 2HD1 ILE 138 -6.494 3.359 8.585 1054 H SER 139 H SER 139 -10.106 0.802 7.636 1055 HA SER 139 HA SER 139 -11.387 0.972 5.056 1056 1HB SER 139 1HB SER 139 -10.551 -1.540 6.640 1057 2HB SER 139 2HB SER 139 -10.803 -1.467 4.893 1058 HG SER 139 HG SER 139 -8.958 0.078 6.399 1059 H GLN 140 H GLN 140 -12.964 0.811 7.810 1060 HA GLN 140 HA GLN 140 -15.389 -0.721 6.653 1061 1HB GLN 140 1HB GLN 140 -14.641 -0.134 9.575 1062 2HB GLN 140 2HB GLN 140 -16.269 -0.578 9.058 1063 1HG GLN 140 1HG GLN 140 -15.149 -2.622 9.746 1064 2HG GLN 140 2HG GLN 140 -15.406 -2.688 8.003 1065 1HE2 GLN 140 2HE2 GLN 140 -11.914 -2.820 7.255 1066 2HE2 GLN 140 1HE2 GLN 140 -13.629 -2.653 6.628 1067 H VAL 141 H VAL 141 -14.245 2.112 8.412 1068 HA VAL 141 HA VAL 141 -16.593 3.665 8.728 1069 HB VAL 141 HB VAL 141 -15.180 5.682 8.432 1070 1HG1 VAL 141 3HG2 VAL 141 -15.017 4.345 10.551 1071 2HG1 VAL 141 1HG2 VAL 141 -13.727 3.345 9.836 1072 3HG1 VAL 141 2HG2 VAL 141 -13.442 5.078 10.148 1073 1HG2 VAL 141 2HG1 VAL 141 -13.932 4.930 6.384 1074 2HG2 VAL 141 3HG1 VAL 141 -12.795 5.426 7.667 1075 3HG2 VAL 141 1HG1 VAL 141 -13.078 3.694 7.344 1076 HA PRO 142 HA PRO 142 -18.724 3.971 4.880 1077 1HB PRO 142 1HB PRO 142 -19.123 6.719 6.178 1078 2HB PRO 142 2HB PRO 142 -20.346 5.702 5.374 1079 1HG PRO 142 1HG PRO 142 -20.239 5.679 8.084 1080 2HG PRO 142 2HG PRO 142 -20.365 4.120 7.233 1081 1HD PRO 142 1HD PRO 142 -17.864 5.372 8.480 1082 2HD PRO 142 2HD PRO 142 -18.375 3.653 8.473 1083 H THR 143 H THR 143 -19.017 5.733 3.238 1084 HA THR 143 HA THR 143 -16.647 7.539 2.705 1085 HB THR 143 HB THR 143 -16.308 6.379 0.430 1086 HG1 THR 143 HG1 THR 143 -17.575 4.278 1.854 1087 1HG2 THR 143 2HG2 THR 143 -14.641 6.236 2.248 1088 2HG2 THR 143 3HG2 THR 143 -15.490 4.820 2.945 1089 3HG2 THR 143 1HG2 THR 143 -14.721 4.709 1.326 1090 H HIS 144 H HIS 144 -16.767 7.195 0.074 1091 HA HIS 144 HA HIS 144 -19.291 7.352 -1.245 1092 1HB HIS 144 1HB HIS 144 -19.801 9.708 -1.560 1093 2HB HIS 144 2HB HIS 144 -19.747 9.367 0.166 1094 HD2 HIS 144 HD2 HIS 144 -16.216 9.625 -1.266 1095 HE1 HIS 144 HE1 HIS 144 -17.103 13.464 0.040 1096 HE2 HIS 144 HE2 HIS 144 -15.163 12.002 -0.792 1097 H ASP 145 H ASP 145 -19.314 8.290 -3.321 1098 HA ASP 145 HA ASP 145 -16.942 7.834 -4.994 1099 1HB ASP 145 1HB ASP 145 -19.407 8.022 -5.714 1100 2HB ASP 145 2HB ASP 145 -19.272 9.775 -5.522 1101 H VAL 146 H VAL 146 -17.071 10.443 -6.343 1102 HA VAL 146 HA VAL 146 -16.459 12.577 -4.414 1103 HB VAL 146 HB VAL 146 -13.993 12.112 -6.068 1104 1HG1 VAL 146 3HG2 VAL 146 -14.389 14.109 -4.575 1105 2HG1 VAL 146 1HG2 VAL 146 -14.578 13.021 -3.177 1106 3HG1 VAL 146 2HG2 VAL 146 -12.999 13.143 -3.991 1107 1HG2 VAL 146 2HG1 VAL 146 -14.307 9.809 -5.140 1108 2HG2 VAL 146 3HG1 VAL 146 -12.921 10.643 -4.392 1109 3HG2 VAL 146 1HG1 VAL 146 -14.455 10.489 -3.496 1110 H GLY 147 H GLY 147 -14.553 13.721 -6.442 1111 1HA GLY 147 1HA GLY 147 -16.490 15.001 -8.362 1112 2HA GLY 147 2HA GLY 147 -14.722 15.160 -8.392 1113 HA PRO 148 HA PRO 148 -14.715 12.143 -11.725 1114 1HB PRO 148 1HB PRO 148 -11.985 12.130 -12.016 1115 2HB PRO 148 2HB PRO 148 -12.942 13.581 -12.400 1116 1HG PRO 148 1HG PRO 148 -11.440 12.983 -9.791 1117 2HG PRO 148 2HG PRO 148 -11.322 14.453 -10.791 1118 1HD PRO 148 1HD PRO 148 -13.002 14.314 -8.573 1119 2HD PRO 148 2HD PRO 148 -13.476 15.255 -10.024 1120 OH TYR 149 OH TYR 149 -7.055 12.589 -11.113 1121 H TYR 149 H TYR 149 -12.282 11.976 -9.162 1122 HA TYR 149 HA TYR 149 -11.784 9.106 -9.410 1123 1HB TYR 149 1HB TYR 149 -11.198 10.955 -7.022 1124 2HB TYR 149 2HB TYR 149 -10.465 9.377 -7.319 1125 HD1 TYR 149 HD2 TYR 149 -9.497 9.110 -9.783 1126 HD2 TYR 149 HD1 TYR 149 -10.025 12.799 -7.801 1127 HE1 TYR 149 HE2 TYR 149 -7.820 10.124 -11.219 1128 HE2 TYR 149 HE1 TYR 149 -8.349 13.811 -9.239 1129 HH TYR 149 HH TYR 149 -6.953 13.513 -10.872 1130 H GLN 150 H GLN 150 -12.880 7.530 -8.853 1131 HA GLN 150 HA GLN 150 -15.131 7.558 -6.853 1132 1HB GLN 150 1HB GLN 150 -13.712 5.210 -8.247 1133 2HB GLN 150 2HB GLN 150 -15.210 5.110 -7.314 1134 1HG GLN 150 1HG GLN 150 -14.793 6.789 -9.867 1135 2HG GLN 150 2HG GLN 150 -15.666 5.255 -9.776 1136 1HE2 GLN 150 2HE2 GLN 150 -18.389 7.676 -9.629 1137 2HE2 GLN 150 1HE2 GLN 150 -17.241 6.833 -10.786 1138 H ASN 151 H ASN 151 -15.003 5.507 -5.401 1139 HA ASN 151 HA ASN 151 -14.171 4.750 -3.265 1140 1HB ASN 151 1HB ASN 151 -11.620 4.593 -4.986 1141 2HB ASN 151 2HB ASN 151 -11.881 3.740 -3.456 1142 1HD2 ASN 151 1HD2 ASN 151 -14.868 2.099 -5.313 1143 2HD2 ASN 151 2HD2 ASN 151 -14.807 3.514 -4.146 1144 H VAL 152 H VAL 152 -14.530 6.650 -2.245 1145 HA VAL 152 HA VAL 152 -12.092 7.719 -0.887 1146 HB VAL 152 HB VAL 152 -13.855 9.616 -2.544 1147 1HG1 VAL 152 3HG2 VAL 152 -13.193 10.562 -0.316 1148 2HG1 VAL 152 1HG2 VAL 152 -11.485 10.165 -0.637 1149 3HG1 VAL 152 2HG2 VAL 152 -12.318 11.391 -1.631 1150 1HG2 VAL 152 1HG1 VAL 152 -10.862 8.846 -2.774 1151 2HG2 VAL 152 2HG1 VAL 152 -12.145 8.366 -3.914 1152 3HG2 VAL 152 3HG1 VAL 152 -11.684 10.082 -3.763 1153 HA PRO 153 HA PRO 153 -15.249 6.948 2.156 1154 1HB PRO 153 1HB PRO 153 -12.882 8.240 3.611 1155 2HB PRO 153 2HB PRO 153 -13.849 6.837 4.129 1156 1HG PRO 153 1HG PRO 153 -11.426 6.384 2.996 1157 2HG PRO 153 2HG PRO 153 -12.809 5.401 2.453 1158 1HD PRO 153 1HD PRO 153 -11.546 7.800 1.024 1159 2HD PRO 153 2HD PRO 153 -12.157 6.267 0.320 1160 H SER 154 H SER 154 -16.679 8.153 3.104 1161 HA SER 154 HA SER 154 -16.867 11.095 2.502 1162 1HB SER 154 1HB SER 154 -19.033 10.943 3.714 1163 2HB SER 154 2HB SER 154 -18.900 9.673 2.482 1164 HG SER 154 HG SER 154 -19.628 8.892 4.490 1165 H LYS 155 H LYS 155 -14.643 10.362 3.881 1166 HA LYS 155 HA LYS 155 -14.600 12.150 6.263 1167 1HB LYS 155 1HB LYS 155 -15.800 10.269 7.322 1168 2HB LYS 155 2HB LYS 155 -14.707 9.090 6.590 1169 1HG LYS 155 1HG LYS 155 -14.072 9.470 8.973 1170 2HG LYS 155 2HG LYS 155 -12.787 9.919 7.862 1171 1HD LYS 155 1HD LYS 155 -12.824 11.628 9.510 1172 2HD LYS 155 2HD LYS 155 -13.468 12.364 8.048 1173 1HE LYS 155 1HE LYS 155 -15.836 12.091 8.969 1174 2HE LYS 155 2HE LYS 155 -15.181 11.308 10.415 1175 1HZ LYS 155 2HZ LYS 155 -13.965 13.366 10.907 1176 2HZ LYS 155 3HZ LYS 155 -14.576 14.098 9.558 1177 3HZ LYS 155 1HZ LYS 155 -15.587 13.658 10.789 1178 HA PRO 156 HA PRO 156 -10.878 11.353 3.567 1179 1HB PRO 156 1HB PRO 156 -10.642 14.197 4.686 1180 2HB PRO 156 2HB PRO 156 -10.191 13.619 3.063 1181 1HG PRO 156 1HG PRO 156 -12.560 14.909 3.359 1182 2HG PRO 156 2HG PRO 156 -12.531 13.406 2.404 1183 1HD PRO 156 1HD PRO 156 -13.496 13.769 5.288 1184 2HD PRO 156 2HD PRO 156 -14.201 12.757 3.985 1185 H VAL 157 H VAL 157 -9.687 10.021 4.576 1186 HA VAL 157 HA VAL 157 -8.657 10.282 7.357 1187 HB VAL 157 HB VAL 157 -7.688 8.545 5.016 1188 1HG1 VAL 157 3HG2 VAL 157 -5.962 8.840 6.817 1189 2HG1 VAL 157 1HG2 VAL 157 -7.155 8.371 8.055 1190 3HG1 VAL 157 2HG2 VAL 157 -6.617 7.181 6.839 1191 1HG2 VAL 157 2HG1 VAL 157 -10.087 8.132 5.654 1192 2HG2 VAL 157 3HG1 VAL 157 -9.056 6.762 6.148 1193 3HG2 VAL 157 1HG1 VAL 157 -9.610 7.945 7.362 1194 H VAL 158 H VAL 158 -6.604 10.600 7.985 1195 HA VAL 158 HA VAL 158 -4.591 11.896 6.093 1196 HB VAL 158 HB VAL 158 -5.628 13.184 8.689 1197 1HG1 VAL 158 3HG2 VAL 158 -3.133 13.374 8.447 1198 2HG1 VAL 158 1HG2 VAL 158 -3.329 14.005 6.792 1199 3HG1 VAL 158 2HG2 VAL 158 -3.911 14.957 8.184 1200 1HG2 VAL 158 2HG1 VAL 158 -7.095 13.542 6.673 1201 2HG2 VAL 158 3HG1 VAL 158 -6.268 15.056 7.128 1202 3HG2 VAL 158 1HG1 VAL 158 -5.686 14.103 5.737 1203 H ILE 159 H ILE 159 -2.938 10.885 6.236 1204 HA ILE 159 HA ILE 159 -2.249 8.993 8.391 1205 HB ILE 159 HB ILE 159 -0.610 10.121 6.058 1206 1HG1 ILE 159 1HG1 ILE 159 -2.229 7.553 6.586 1207 2HG1 ILE 159 2HG1 ILE 159 -2.638 8.830 5.433 1208 1HG2 ILE 159 3HG2 ILE 159 -0.009 7.769 7.970 1209 2HG2 ILE 159 1HG2 ILE 159 0.927 8.187 6.510 1210 3HG2 ILE 159 2HG2 ILE 159 0.892 9.306 7.896 1211 1HD1 ILE 159 3HD1 ILE 159 -0.105 7.055 5.316 1212 2HD1 ILE 159 1HD1 ILE 159 -1.542 6.891 4.269 1213 3HD1 ILE 159 2HD1 ILE 159 -0.507 8.342 4.144 1214 H LEU 160 H LEU 160 -1.043 9.074 9.951 1215 HA LEU 160 HA LEU 160 -0.173 11.760 11.093 1216 1HB LEU 160 1HB LEU 160 -0.181 8.949 12.342 1217 2HB LEU 160 2HB LEU 160 0.229 10.454 13.179 1218 HG LEU 160 HG LEU 160 -2.456 9.838 11.806 1219 1HD1 LEU 160 2HD1 LEU 160 -2.130 8.602 13.972 1220 2HD1 LEU 160 3HD1 LEU 160 -1.732 10.131 14.798 1221 3HD1 LEU 160 1HD1 LEU 160 -3.372 9.867 14.148 1222 1HD2 LEU 160 3HD2 LEU 160 -1.844 12.269 11.649 1223 2HD2 LEU 160 1HD2 LEU 160 -3.202 12.032 12.778 1224 3HD2 LEU 160 2HD2 LEU 160 -1.561 12.324 13.409 1225 H SER 161 H SER 161 1.128 8.527 10.493 1226 HA SER 161 HA SER 161 3.737 9.555 9.483 1227 1HB SER 161 1HB SER 161 3.937 10.016 11.953 1228 2HB SER 161 2HB SER 161 3.652 8.299 12.297 1229 HG SER 161 HG SER 161 5.488 7.830 11.007 1230 H ALA 162 H ALA 162 5.263 8.014 9.053 1231 HA ALA 162 HA ALA 162 4.365 5.086 8.915 1232 1HB ALA 162 3HB ALA 162 5.401 6.725 6.517 1233 2HB ALA 162 1HB ALA 162 5.049 4.971 6.531 1234 3HB ALA 162 2HB ALA 162 3.721 6.147 6.738 1235 H LYS 163 H LYS 163 5.765 5.641 10.704 1236 HA LYS 163 HA LYS 163 8.741 5.762 10.324 1237 1HB LYS 163 1HB LYS 163 7.073 4.745 12.701 1238 2HB LYS 163 2HB LYS 163 8.812 5.055 12.729 1239 1HG LYS 163 1HG LYS 163 6.591 7.124 12.178 1240 2HG LYS 163 2HG LYS 163 7.520 6.983 13.673 1241 1HD LYS 163 1HD LYS 163 9.651 7.483 12.385 1242 2HD LYS 163 2HD LYS 163 8.729 7.667 10.900 1243 1HE LYS 163 1HE LYS 163 8.361 9.420 13.433 1244 2HE LYS 163 2HE LYS 163 9.381 9.844 12.062 1245 1HZ LYS 163 2HZ LYS 163 7.410 9.842 10.633 1246 2HZ LYS 163 3HZ LYS 163 6.436 9.443 11.906 1247 3HZ LYS 163 1HZ LYS 163 7.223 10.895 11.892 1248 H VAL 164 H VAL 164 9.186 4.225 8.818 1249 HA VAL 164 HA VAL 164 8.475 1.354 9.113 1250 HB VAL 164 HB VAL 164 10.171 1.027 7.363 1251 1HG1 VAL 164 3HG2 VAL 164 7.839 1.732 6.763 1252 2HG1 VAL 164 1HG2 VAL 164 8.315 3.446 6.877 1253 3HG1 VAL 164 2HG2 VAL 164 9.013 2.410 5.604 1254 1HG2 VAL 164 2HG1 VAL 164 11.841 2.740 8.127 1255 2HG2 VAL 164 3HG1 VAL 164 11.405 3.013 6.419 1256 3HG2 VAL 164 1HG1 VAL 164 10.712 4.050 7.694 1257 H LEU 165 H LEU 165 9.405 -0.122 10.115 1258 HA LEU 165 HA LEU 165 11.561 0.463 12.152 1259 1HB LEU 165 1HB LEU 165 10.005 -2.113 11.502 1260 2HB LEU 165 2HB LEU 165 11.247 -1.978 12.748 1261 HG LEU 165 HG LEU 165 9.101 -1.687 13.824 1262 1HD1 LEU 165 2HD1 LEU 165 10.980 -0.238 14.650 1263 2HD1 LEU 165 3HD1 LEU 165 10.498 1.053 13.517 1264 3HD1 LEU 165 1HD1 LEU 165 9.412 0.585 14.851 1265 1HD2 LEU 165 3HD2 LEU 165 7.750 -0.980 11.831 1266 2HD2 LEU 165 1HD2 LEU 165 7.498 0.126 13.206 1267 3HD2 LEU 165 2HD2 LEU 165 8.543 0.618 11.849 1268 HA PRO 166 HA PRO 166 14.866 -0.649 9.337 1269 1HB PRO 166 1HB PRO 166 16.823 -0.341 11.269 1270 2HB PRO 166 2HB PRO 166 15.979 1.044 10.536 1271 1HG PRO 166 1HG PRO 166 15.324 -0.334 13.197 1272 2HG PRO 166 2HG PRO 166 15.562 1.408 12.912 1273 1HD PRO 166 1HD PRO 166 13.026 0.303 12.972 1274 2HD PRO 166 2HD PRO 166 13.404 1.611 11.805 Start of MODEL 8 Raw file had 1274 H/Q atoms Start of MODEL 8 1 1H ALA 1 1H ALA 1 6.300 -12.433 16.561 2 2H ALA 1 2H ALA 1 5.293 -12.676 15.274 3 3H ALA 1 3H ALA 1 5.479 -13.858 16.413 4 HA ALA 1 HA ALA 1 7.807 -14.175 15.819 5 1HB ALA 1 3HB ALA 1 6.054 -15.582 14.695 6 2HB ALA 1 1HB ALA 1 5.840 -14.339 13.434 7 3HB ALA 1 2HB ALA 1 7.384 -15.222 13.566 8 H LYS 2 H LYS 2 8.207 -11.801 16.205 9 HA LYS 2 HA LYS 2 8.392 -9.768 14.226 10 1HB LYS 2 1HB LYS 2 10.563 -10.519 16.266 11 2HB LYS 2 2HB LYS 2 10.404 -8.951 15.455 12 1HG LYS 2 1HG LYS 2 8.082 -8.690 16.430 13 2HG LYS 2 2HG LYS 2 8.245 -10.248 17.241 14 1HD LYS 2 1HD LYS 2 10.223 -9.356 18.560 15 2HD LYS 2 2HD LYS 2 10.058 -7.794 17.748 16 1HE LYS 2 1HE LYS 2 7.721 -7.533 18.723 17 2HE LYS 2 2HE LYS 2 7.888 -9.095 19.538 18 1HZ LYS 2 3HZ LYS 2 9.792 -8.185 20.766 19 2HZ LYS 2 1HZ LYS 2 9.636 -6.726 20.006 20 3HZ LYS 2 2HZ LYS 2 8.442 -7.265 21.013 21 H GLY 3 H GLY 3 9.935 -9.056 12.869 22 1HA GLY 3 1HA GLY 3 12.372 -10.518 12.085 23 2HA GLY 3 2HA GLY 3 11.062 -10.942 10.965 24 H ASP 4 H ASP 4 11.323 -9.933 9.225 25 HA ASP 4 HA ASP 4 12.893 -7.654 8.622 26 1HB ASP 4 1HB ASP 4 10.244 -8.438 7.270 27 2HB ASP 4 2HB ASP 4 11.470 -7.363 6.579 28 HA PRO 5 HA PRO 5 11.396 -3.835 10.079 29 1HB PRO 5 1HB PRO 5 11.388 -3.218 7.079 30 2HB PRO 5 2HB PRO 5 12.043 -2.218 8.400 31 1HG PRO 5 1HG PRO 5 13.774 -3.710 6.941 32 2HG PRO 5 2HG PRO 5 13.932 -3.730 8.715 33 1HD PRO 5 1HD PRO 5 12.659 -5.868 6.927 34 2HD PRO 5 2HD PRO 5 13.694 -6.085 8.376 35 H HIS 6 H HIS 6 9.774 -2.176 9.610 36 HA HIS 6 HA HIS 6 7.181 -3.092 8.324 37 1HB HIS 6 1HB HIS 6 7.409 -2.545 11.352 38 2HB HIS 6 2HB HIS 6 5.925 -2.920 10.467 39 HD2 HIS 6 HD2 HIS 6 9.209 -4.788 9.597 40 HE1 HIS 6 HE1 HIS 6 6.824 -7.513 11.649 41 HE2 HIS 6 HE2 HIS 6 9.024 -7.339 10.324 42 H VAL 7 H VAL 7 6.363 -1.552 7.387 43 HA VAL 7 HA VAL 7 7.176 1.307 7.794 44 HB VAL 7 HB VAL 7 6.566 0.455 5.505 45 1HG1 VAL 7 3HG2 VAL 7 4.834 -1.214 6.222 46 2HG1 VAL 7 1HG2 VAL 7 3.753 0.113 6.721 47 3HG1 VAL 7 2HG2 VAL 7 4.179 -0.092 5.001 48 1HG2 VAL 7 2HG1 VAL 7 6.274 2.882 6.077 49 2HG2 VAL 7 3HG1 VAL 7 5.026 2.344 4.922 50 3HG2 VAL 7 1HG1 VAL 7 4.616 2.556 6.645 51 H LEU 8 H LEU 8 6.457 2.425 9.383 52 HA LEU 8 HA LEU 8 3.730 1.972 10.634 53 1HB LEU 8 1HB LEU 8 5.873 4.082 11.239 54 2HB LEU 8 2HB LEU 8 4.265 4.017 11.976 55 HG LEU 8 HG LEU 8 4.766 1.493 12.452 56 1HD1 LEU 8 2HD1 LEU 8 6.844 1.348 11.058 57 2HD1 LEU 8 3HD1 LEU 8 7.642 2.556 12.099 58 3HD1 LEU 8 1HD1 LEU 8 7.195 0.961 12.763 59 1HD2 LEU 8 3HD2 LEU 8 4.519 3.233 14.208 60 2HD2 LEU 8 1HD2 LEU 8 5.812 2.088 14.639 61 3HD2 LEU 8 2HD2 LEU 8 6.227 3.711 14.013 62 H LEU 9 H LEU 9 2.188 3.328 10.676 63 HA LEU 9 HA LEU 9 1.997 5.799 9.028 64 1HB LEU 9 1HB LEU 9 0.952 3.171 7.914 65 2HB LEU 9 2HB LEU 9 -0.023 4.629 7.656 66 HG LEU 9 HG LEU 9 2.985 4.730 7.245 67 1HD1 LEU 9 2HD1 LEU 9 2.172 2.807 5.826 68 2HD1 LEU 9 3HD1 LEU 9 0.913 3.851 5.113 69 3HD1 LEU 9 1HD1 LEU 9 2.636 4.186 4.797 70 1HD2 LEU 9 3HD2 LEU 9 1.696 6.875 7.294 71 2HD2 LEU 9 1HD2 LEU 9 2.361 6.587 5.666 72 3HD2 LEU 9 2HD2 LEU 9 0.633 6.289 5.988 73 H THR 10 H THR 10 1.441 6.738 10.587 74 HA THR 10 HA THR 10 -0.918 5.935 12.366 75 HB THR 10 HB THR 10 0.910 8.412 12.417 76 HG1 THR 10 HG1 THR 10 1.918 6.436 12.912 77 1HG2 THR 10 3HG2 THR 10 -1.163 7.337 14.446 78 2HG2 THR 10 1HG2 THR 10 -0.101 8.749 14.699 79 3HG2 THR 10 2HG2 THR 10 -1.362 8.795 13.438 80 H THR 11 H THR 11 -2.312 5.967 10.603 81 HA THR 11 HA THR 11 -2.963 8.504 9.136 82 HB THR 11 HB THR 11 -5.023 7.239 8.435 83 HG1 THR 11 HG1 THR 11 -3.764 5.199 9.956 84 1HG2 THR 11 2HG2 THR 11 -2.884 7.157 7.134 85 2HG2 THR 11 3HG2 THR 11 -2.322 5.779 8.120 86 3HG2 THR 11 1HG2 THR 11 -3.739 5.593 7.045 87 H SER 12 H SER 12 -5.144 9.229 9.138 88 HA SER 12 HA SER 12 -5.839 10.727 11.429 89 1HB SER 12 1HB SER 12 -8.156 10.884 10.517 90 2HB SER 12 2HB SER 12 -6.944 11.047 9.233 91 HG SER 12 HG SER 12 -8.614 9.605 8.695 92 H ALA 13 H ALA 13 -7.010 7.514 10.565 93 HA ALA 13 HA ALA 13 -8.742 7.104 12.861 94 1HB ALA 13 2HB ALA 13 -8.853 5.669 10.824 95 2HB ALA 13 3HB ALA 13 -7.251 4.987 11.192 96 3HB ALA 13 1HB ALA 13 -8.630 4.673 12.279 97 H GLY 14 H GLY 14 -5.546 6.035 12.234 98 1HA GLY 14 1HA GLY 14 -4.345 6.633 14.796 99 2HA GLY 14 2HA GLY 14 -4.983 4.995 14.988 100 H ASN 15 H ASN 15 -2.547 5.281 15.446 101 HA ASN 15 HA ASN 15 -0.581 4.909 13.281 102 1HB ASN 15 1HB ASN 15 0.062 5.442 15.634 103 2HB ASN 15 2HB ASN 15 -0.566 3.882 16.183 104 1HD2 ASN 15 1HD2 ASN 15 2.624 3.559 13.560 105 2HD2 ASN 15 2HD2 ASN 15 1.162 4.599 13.173 106 H ILE 16 H ILE 16 0.124 3.244 12.288 107 HA ILE 16 HA ILE 16 -0.794 0.411 12.955 108 HB ILE 16 HB ILE 16 -1.384 0.023 10.546 109 1HG1 ILE 16 1HG1 ILE 16 -1.039 3.079 10.424 110 2HG1 ILE 16 2HG1 ILE 16 -0.132 1.882 9.491 111 1HG2 ILE 16 2HG2 ILE 16 -3.091 0.455 12.304 112 2HG2 ILE 16 3HG2 ILE 16 -2.964 2.211 12.022 113 3HG2 ILE 16 1HG2 ILE 16 -3.608 1.143 10.741 114 1HD1 ILE 16 3HD1 ILE 16 -3.188 2.368 9.297 115 2HD1 ILE 16 1HD1 ILE 16 -1.977 2.897 8.101 116 3HD1 ILE 16 2HD1 ILE 16 -2.290 1.156 8.346 117 H GLU 17 H GLU 17 0.133 -1.021 11.162 118 HA GLU 17 HA GLU 17 3.128 -0.503 10.797 119 1HB GLU 17 1HB GLU 17 2.028 -2.695 12.640 120 2HB GLU 17 2HB GLU 17 3.719 -2.239 12.418 121 1HG GLU 17 1HG GLU 17 1.484 -0.492 13.654 122 2HG GLU 17 2HG GLU 17 2.763 -1.304 14.555 123 H LEU 18 H LEU 18 3.121 -1.137 8.749 124 HA LEU 18 HA LEU 18 2.333 -3.998 8.000 125 1HB LEU 18 1HB LEU 18 3.782 -1.887 6.298 126 2HB LEU 18 2HB LEU 18 3.316 -3.511 5.795 127 HG LEU 18 HG LEU 18 1.579 -2.158 4.954 128 1HD1 LEU 18 2HD1 LEU 18 0.708 -4.157 6.210 129 2HD1 LEU 18 3HD1 LEU 18 0.584 -3.180 7.697 130 3HD1 LEU 18 1HD1 LEU 18 -0.448 -2.803 6.292 131 1HD2 LEU 18 3HD2 LEU 18 2.165 -0.061 6.159 132 2HD2 LEU 18 1HD2 LEU 18 0.416 -0.379 6.258 133 3HD2 LEU 18 2HD2 LEU 18 1.462 -0.706 7.669 134 H GLU 19 H GLU 19 3.865 -5.362 7.156 135 HA GLU 19 HA GLU 19 6.792 -4.939 8.010 136 1HB GLU 19 1HB GLU 19 6.930 -7.317 8.663 137 2HB GLU 19 2HB GLU 19 5.798 -6.414 9.662 138 1HG GLU 19 1HG GLU 19 4.703 -8.500 9.172 139 2HG GLU 19 2HG GLU 19 3.863 -7.262 8.245 140 H LEU 20 H LEU 20 7.808 -4.678 6.345 141 HA LEU 20 HA LEU 20 6.880 -5.612 3.658 142 1HB LEU 20 1HB LEU 20 9.425 -4.108 4.513 143 2HB LEU 20 2HB LEU 20 8.953 -4.451 2.848 144 HG LEU 20 HG LEU 20 8.209 -2.220 3.306 145 1HD1 LEU 20 2HD1 LEU 20 6.589 -3.649 2.021 146 2HD1 LEU 20 3HD1 LEU 20 5.783 -4.119 3.541 147 3HD1 LEU 20 1HD1 LEU 20 5.727 -2.425 2.988 148 1HD2 LEU 20 3HD2 LEU 20 8.229 -2.290 5.813 149 2HD2 LEU 20 1HD2 LEU 20 6.703 -1.607 5.197 150 3HD2 LEU 20 2HD2 LEU 20 6.745 -3.281 5.806 151 H ASP 21 H ASP 21 8.988 -6.111 2.251 152 HA ASP 21 HA ASP 21 10.739 -8.296 3.301 153 1HB ASP 21 1HB ASP 21 8.385 -8.994 1.434 154 2HB ASP 21 2HB ASP 21 9.726 -10.080 1.830 155 H LYS 22 H LYS 22 12.200 -6.935 2.461 156 HA LYS 22 HA LYS 22 12.354 -5.931 -0.258 157 1HB LYS 22 1HB LYS 22 14.760 -5.674 0.170 158 2HB LYS 22 2HB LYS 22 13.834 -5.186 1.599 159 1HG LYS 22 1HG LYS 22 14.215 -7.457 2.640 160 2HG LYS 22 2HG LYS 22 15.027 -7.994 1.180 161 1HD LYS 22 1HD LYS 22 16.752 -7.543 2.764 162 2HD LYS 22 2HD LYS 22 16.861 -6.282 1.542 163 1HE LYS 22 1HE LYS 22 15.657 -4.670 3.119 164 2HE LYS 22 2HE LYS 22 15.523 -5.957 4.326 165 1HZ LYS 22 1HZ LYS 22 18.085 -4.864 3.264 166 2HZ LYS 22 2HZ LYS 22 17.433 -4.538 4.746 167 3HZ LYS 22 3HZ LYS 22 17.962 -6.062 4.394 168 H GLN 23 H GLN 23 13.166 -9.039 1.128 169 HA GLN 23 HA GLN 23 15.113 -10.110 -0.585 170 1HB GLN 23 1HB GLN 23 14.085 -11.371 1.317 171 2HB GLN 23 2HB GLN 23 12.584 -11.568 0.400 172 1HG GLN 23 1HG GLN 23 13.963 -13.617 0.180 173 2HG GLN 23 2HG GLN 23 13.818 -12.825 -1.393 174 1HE2 GLN 23 2HE2 GLN 23 17.452 -12.588 0.620 175 2HE2 GLN 23 1HE2 GLN 23 15.862 -12.709 1.528 176 H LYS 24 H LYS 24 11.661 -10.569 -1.077 177 HA LYS 24 HA LYS 24 11.969 -11.628 -3.819 178 1HB LYS 24 1HB LYS 24 9.510 -10.606 -2.301 179 2HB LYS 24 2HB LYS 24 9.456 -11.356 -3.898 180 1HG LYS 24 1HG LYS 24 10.583 -12.618 -1.318 181 2HG LYS 24 2HG LYS 24 9.077 -13.076 -2.122 182 1HD LYS 24 1HD LYS 24 10.395 -13.790 -4.174 183 2HD LYS 24 2HD LYS 24 11.898 -13.318 -3.373 184 1HE LYS 24 1HE LYS 24 11.471 -15.045 -1.553 185 2HE LYS 24 2HE LYS 24 9.969 -15.522 -2.361 186 1HZ LYS 24 2HZ LYS 24 12.693 -15.709 -3.560 187 2HZ LYS 24 3HZ LYS 24 11.803 -16.971 -2.972 188 3HZ LYS 24 1HZ LYS 24 11.293 -16.154 -4.314 189 H ALA 25 H ALA 25 12.115 -8.478 -2.708 190 HA ALA 25 HA ALA 25 12.102 -7.400 -5.514 191 1HB ALA 25 2HB ALA 25 9.643 -7.386 -4.969 192 2HB ALA 25 3HB ALA 25 9.964 -6.429 -3.498 193 3HB ALA 25 1HB ALA 25 10.276 -5.727 -5.106 194 HA PRO 26 HA PRO 26 15.203 -5.651 -2.510 195 1HB PRO 26 1HB PRO 26 16.605 -5.932 -5.210 196 2HB PRO 26 2HB PRO 26 17.270 -6.252 -3.590 197 1HG PRO 26 1HG PRO 26 16.520 -8.359 -5.133 198 2HG PRO 26 2HG PRO 26 16.045 -8.351 -3.417 199 1HD PRO 26 1HD PRO 26 14.304 -7.624 -5.839 200 2HD PRO 26 2HD PRO 26 13.870 -8.600 -4.396 201 H VAL 27 H VAL 27 15.222 -4.975 -5.978 202 HA VAL 27 HA VAL 27 15.898 -2.200 -5.896 203 HB VAL 27 HB VAL 27 14.726 -2.041 -8.138 204 1HG1 VAL 27 3HG2 VAL 27 17.111 -2.775 -7.861 205 2HG1 VAL 27 1HG2 VAL 27 16.580 -4.463 -7.650 206 3HG1 VAL 27 2HG2 VAL 27 16.341 -3.642 -9.215 207 1HG2 VAL 27 1HG1 VAL 27 14.043 -5.001 -7.571 208 2HG2 VAL 27 2HG1 VAL 27 12.863 -3.675 -7.733 209 3HG2 VAL 27 3HG1 VAL 27 13.840 -4.174 -9.138 210 H SER 28 H SER 28 12.649 -3.483 -6.407 211 HA SER 28 HA SER 28 11.087 -1.172 -6.283 212 1HB SER 28 1HB SER 28 10.161 -3.489 -6.544 213 2HB SER 28 2HB SER 28 10.446 -3.809 -4.821 214 HG SER 28 HG SER 28 8.326 -3.112 -5.259 215 H VAL 29 H VAL 29 11.979 -3.121 -3.461 216 HA VAL 29 HA VAL 29 10.915 -1.480 -1.375 217 HB VAL 29 HB VAL 29 12.646 -2.511 0.065 218 1HG1 VAL 29 3HG2 VAL 29 10.607 -3.808 -0.602 219 2HG1 VAL 29 1HG2 VAL 29 11.456 -4.423 -2.044 220 3HG1 VAL 29 2HG2 VAL 29 12.009 -4.895 -0.415 221 1HG2 VAL 29 2HG1 VAL 29 14.598 -2.343 -1.504 222 2HG2 VAL 29 3HG1 VAL 29 14.378 -4.025 -0.953 223 3HG2 VAL 29 1HG1 VAL 29 13.844 -3.543 -2.586 224 H GLN 30 H GLN 30 14.055 -1.319 -2.992 225 HA GLN 30 HA GLN 30 15.354 0.781 -1.577 226 1HB GLN 30 1HB GLN 30 16.348 -0.408 -3.550 227 2HB GLN 30 2HB GLN 30 15.227 0.422 -4.637 228 1HG GLN 30 1HG GLN 30 17.416 1.598 -4.617 229 2HG GLN 30 2HG GLN 30 16.162 2.647 -3.947 230 1HE2 GLN 30 2HE2 GLN 30 17.555 2.675 -0.642 231 2HE2 GLN 30 1HE2 GLN 30 16.101 3.023 -1.706 232 H ASN 31 H ASN 31 13.372 1.197 -4.468 233 HA ASN 31 HA ASN 31 13.013 4.032 -4.459 234 1HB ASN 31 1HB ASN 31 10.899 1.892 -5.147 235 2HB ASN 31 2HB ASN 31 10.841 3.584 -5.661 236 1HD2 ASN 31 1HD2 ASN 31 14.200 2.790 -7.426 237 2HD2 ASN 31 2HD2 ASN 31 13.841 3.609 -5.824 238 H PHE 32 H PHE 32 10.783 1.634 -3.151 239 HA PHE 32 HA PHE 32 8.971 3.249 -1.676 240 1HB PHE 32 1HB PHE 32 8.828 0.749 -1.832 241 2HB PHE 32 2HB PHE 32 10.237 0.583 -0.778 242 HD1 PHE 32 HD2 PHE 32 7.229 2.797 -0.679 243 HD2 PHE 32 HD1 PHE 32 9.519 -0.125 1.325 244 HE1 PHE 32 HE2 PHE 32 5.752 2.953 1.244 245 HE2 PHE 32 HE1 PHE 32 8.041 0.038 3.247 246 HZ PHE 32 HZ PHE 32 6.156 1.576 3.207 247 H VAL 33 H VAL 33 11.836 1.687 -0.338 248 HA VAL 33 HA VAL 33 12.056 3.125 2.138 249 HB VAL 33 HB VAL 33 14.339 2.157 0.318 250 1HG1 VAL 33 3HG2 VAL 33 15.096 3.743 2.114 251 2HG1 VAL 33 1HG2 VAL 33 14.255 2.768 3.347 252 3HG1 VAL 33 2HG2 VAL 33 15.648 2.085 2.466 253 1HG2 VAL 33 2HG1 VAL 33 12.667 0.362 0.872 254 2HG2 VAL 33 3HG1 VAL 33 14.206 0.076 1.727 255 3HG2 VAL 33 1HG1 VAL 33 12.807 0.751 2.606 256 H ASP 34 H ASP 34 12.956 4.077 -1.102 257 HA ASP 34 HA ASP 34 14.610 6.366 -0.671 258 1HB ASP 34 1HB ASP 34 12.207 6.078 -2.585 259 2HB ASP 34 2HB ASP 34 13.422 7.358 -2.697 260 OH TYR 35 OH TYR 35 8.457 8.874 -5.539 261 H TYR 35 H TYR 35 11.099 6.371 -0.967 262 HA TYR 35 HA TYR 35 10.673 9.097 0.066 263 1HB TYR 35 1HB TYR 35 8.783 6.659 0.072 264 2HB TYR 35 2HB TYR 35 8.299 8.309 0.470 265 HD1 TYR 35 HD2 TYR 35 10.070 6.414 -2.186 266 HD2 TYR 35 HD1 TYR 35 7.559 9.664 -1.242 267 HE1 TYR 35 HE2 TYR 35 9.853 6.934 -4.562 268 HE2 TYR 35 HE1 TYR 35 7.330 10.179 -3.616 269 HH TYR 35 HH TYR 35 8.971 8.242 -6.046 270 H VAL 36 H VAL 36 10.007 5.950 1.481 271 HA VAL 36 HA VAL 36 9.369 6.596 4.120 272 HB VAL 36 HB VAL 36 11.290 4.355 3.268 273 1HG1 VAL 36 3HG2 VAL 36 11.247 4.745 5.747 274 2HG1 VAL 36 1HG2 VAL 36 9.467 4.648 5.747 275 3HG1 VAL 36 2HG2 VAL 36 10.439 3.207 5.343 276 1HG2 VAL 36 2HG1 VAL 36 9.132 4.363 1.972 277 2HG2 VAL 36 3HG1 VAL 36 9.180 2.979 3.096 278 3HG2 VAL 36 1HG1 VAL 36 8.204 4.419 3.493 279 H ASN 37 H ASN 37 12.616 5.996 2.870 280 HA ASN 37 HA ASN 37 14.281 6.388 5.111 281 1HB ASN 37 1HB ASN 37 15.106 5.898 2.792 282 2HB ASN 37 2HB ASN 37 14.740 7.559 2.297 283 1HD2 ASN 37 1HD2 ASN 37 17.480 7.598 5.353 284 2HD2 ASN 37 2HD2 ASN 37 15.774 6.952 5.546 285 H SER 38 H SER 38 12.488 8.784 3.343 286 HA SER 38 HA SER 38 12.528 10.744 5.513 287 1HB SER 38 1HB SER 38 13.967 12.504 4.516 288 2HB SER 38 2HB SER 38 14.916 11.040 4.845 289 HG SER 38 HG SER 38 15.289 11.882 2.769 290 H GLY 39 H GLY 39 11.072 12.135 5.320 291 1HA GLY 39 1HA GLY 39 9.022 13.090 4.500 292 2HA GLY 39 2HA GLY 39 9.969 13.496 3.061 293 H PHE 40 H PHE 40 9.098 10.354 4.424 294 HA PHE 40 HA PHE 40 8.294 9.149 1.872 295 1HB PHE 40 1HB PHE 40 9.009 7.792 3.811 296 2HB PHE 40 2HB PHE 40 7.646 8.371 4.760 297 HD1 PHE 40 HD2 PHE 40 8.185 6.848 1.390 298 HD2 PHE 40 HD1 PHE 40 5.872 6.898 4.916 299 HE1 PHE 40 HE2 PHE 40 6.872 4.980 0.558 300 HE2 PHE 40 HE1 PHE 40 4.559 5.033 4.080 301 HZ PHE 40 HZ PHE 40 5.055 4.076 1.893 302 OH TYR 41 OH TYR 41 5.252 6.776 -1.711 303 H TYR 41 H TYR 41 5.945 8.991 4.405 304 HA TYR 41 HA TYR 41 3.924 10.669 2.791 305 1HB TYR 41 1HB TYR 41 3.476 7.850 3.932 306 2HB TYR 41 2HB TYR 41 2.249 8.858 3.159 307 HD1 TYR 41 HD2 TYR 41 4.397 10.054 1.181 308 HD2 TYR 41 HD1 TYR 41 3.245 6.130 2.213 309 HE1 TYR 41 HE2 TYR 41 5.309 9.234 -0.918 310 HE2 TYR 41 HE1 TYR 41 4.128 5.317 0.099 311 HH TYR 41 HH TYR 41 5.116 5.827 -1.760 312 H ASN 42 H ASN 42 5.097 11.865 4.630 313 HA ASN 42 HA ASN 42 3.722 11.671 7.304 314 1HB ASN 42 1HB ASN 42 4.922 13.764 7.816 315 2HB ASN 42 2HB ASN 42 6.038 12.568 7.141 316 1HD2 ASN 42 1HD2 ASN 42 6.701 15.768 5.346 317 2HD2 ASN 42 2HD2 ASN 42 6.818 15.098 7.050 318 H ASN 43 H ASN 43 1.697 11.999 7.318 319 HA ASN 43 HA ASN 43 -0.394 13.137 7.185 320 1HB ASN 43 1HB ASN 43 0.799 15.078 8.064 321 2HB ASN 43 2HB ASN 43 1.471 15.478 6.472 322 1HD2 ASN 43 1HD2 ASN 43 -2.622 15.814 6.413 323 2HD2 ASN 43 2HD2 ASN 43 -1.758 14.230 6.749 324 H THR 44 H THR 44 -0.102 11.507 5.400 325 HA THR 44 HA THR 44 -1.006 12.771 2.731 326 HB THR 44 HB THR 44 -0.721 10.448 1.816 327 HG1 THR 44 HG1 THR 44 -0.813 9.394 3.833 328 1HG2 THR 44 2HG2 THR 44 1.063 12.206 1.562 329 2HG2 THR 44 3HG2 THR 44 1.779 11.716 3.120 330 3HG2 THR 44 1HG2 THR 44 1.791 10.587 1.738 331 H THR 45 H THR 45 -2.056 9.810 2.586 332 HA THR 45 HA THR 45 -4.389 9.824 4.448 333 HB THR 45 HB THR 45 -6.129 10.015 2.665 334 HG1 THR 45 HG1 THR 45 -4.748 9.477 0.945 335 1HG2 THR 45 2HG2 THR 45 -5.499 12.030 4.031 336 2HG2 THR 45 3HG2 THR 45 -4.231 12.445 2.847 337 3HG2 THR 45 1HG2 THR 45 -5.950 12.502 2.371 338 H PHE 46 H PHE 46 -6.135 8.423 3.509 339 HA PHE 46 HA PHE 46 -5.003 5.844 2.260 340 1HB PHE 46 1HB PHE 46 -6.700 6.146 4.806 341 2HB PHE 46 2HB PHE 46 -6.761 4.682 3.824 342 HD1 PHE 46 HD2 PHE 46 -3.596 5.950 3.279 343 HD2 PHE 46 HD1 PHE 46 -5.852 3.984 6.251 344 HE1 PHE 46 HE2 PHE 46 -1.551 5.057 4.244 345 HE2 PHE 46 HE1 PHE 46 -3.806 3.091 7.212 346 HZ PHE 46 HZ PHE 46 -1.655 3.627 6.209 347 H HIS 47 H HIS 47 -5.735 7.131 0.509 348 HA HIS 47 HA HIS 47 -8.511 7.783 -0.059 349 1HB HIS 47 1HB HIS 47 -7.757 7.579 -2.491 350 2HB HIS 47 2HB HIS 47 -6.725 8.612 -1.490 351 HD2 HIS 47 HD2 HIS 47 -6.236 6.188 -4.058 352 HE1 HIS 47 HE1 HIS 47 -3.189 5.148 -1.406 353 HE2 HIS 47 HE2 HIS 47 -3.969 4.801 -3.842 354 NH1 ARG 48 NH2 ARG 48 -8.140 2.279 -7.247 355 NH2 ARG 48 NH1 ARG 48 -8.262 4.327 -8.225 356 H ARG 48 H ARG 48 -6.701 5.091 -1.477 357 HA ARG 48 HA ARG 48 -9.143 3.607 -2.229 358 1HB ARG 48 1HB ARG 48 -6.191 2.771 -2.091 359 2HB ARG 48 2HB ARG 48 -7.478 1.734 -2.718 360 1HG ARG 48 1HG ARG 48 -6.703 4.521 -3.785 361 2HG ARG 48 2HG ARG 48 -6.382 2.974 -4.577 362 1HD ARG 48 1HD ARG 48 -8.937 2.565 -4.695 363 2HD ARG 48 2HD ARG 48 -9.183 4.149 -3.980 364 HE ARG 48 HE ARG 48 -8.512 5.256 -6.029 365 1HH1 ARG 48 2HH2 ARG 48 -8.153 1.733 -6.379 366 2HH1 ARG 48 1HH2 ARG 48 -8.036 1.915 -8.201 367 1HH2 ARG 48 1HH1 ARG 48 -8.368 5.341 -8.107 368 2HH2 ARG 48 2HH1 ARG 48 -8.150 3.819 -9.109 369 H VAL 49 H VAL 49 -10.347 2.481 -1.107 370 HA VAL 49 HA VAL 49 -9.412 0.521 0.951 371 HB VAL 49 HB VAL 49 -11.121 2.930 1.816 372 1HG1 VAL 49 3HG2 VAL 49 -11.844 0.762 2.859 373 2HG1 VAL 49 1HG2 VAL 49 -10.167 0.433 3.366 374 3HG1 VAL 49 2HG2 VAL 49 -11.057 1.811 4.068 375 1HG2 VAL 49 2HG1 VAL 49 -8.670 3.461 1.630 376 2HG2 VAL 49 3HG1 VAL 49 -9.174 3.410 3.340 377 3HG2 VAL 49 1HG1 VAL 49 -8.274 2.041 2.632 378 H ILE 50 H ILE 50 -10.712 -1.028 1.247 379 HA ILE 50 HA ILE 50 -13.654 -0.912 0.584 380 HB ILE 50 HB ILE 50 -12.590 -1.261 -1.653 381 1HG1 ILE 50 1HG1 ILE 50 -13.990 -3.724 -0.450 382 2HG1 ILE 50 2HG1 ILE 50 -14.797 -2.289 -1.092 383 1HG2 ILE 50 2HG2 ILE 50 -10.476 -2.368 -0.859 384 2HG2 ILE 50 3HG2 ILE 50 -11.406 -3.795 -0.334 385 3HG2 ILE 50 1HG2 ILE 50 -11.302 -3.385 -2.068 386 1HD1 ILE 50 2HD1 ILE 50 -13.792 -2.738 -3.381 387 2HD1 ILE 50 3HD1 ILE 50 -12.976 -4.186 -2.733 388 3HD1 ILE 50 1HD1 ILE 50 -14.757 -4.126 -2.813 389 HA PRO 51 HA PRO 51 -13.845 -3.343 4.178 390 1HB PRO 51 1HB PRO 51 -16.173 -4.393 2.478 391 2HB PRO 51 2HB PRO 51 -16.188 -3.977 4.210 392 1HG PRO 51 1HG PRO 51 -17.172 -2.167 2.446 393 2HG PRO 51 2HG PRO 51 -16.069 -1.589 3.719 394 1HD PRO 51 1HD PRO 51 -15.421 -2.095 0.772 395 2HD PRO 51 2HD PRO 51 -14.835 -0.781 1.842 396 H GLY 52 H GLY 52 -14.134 -5.553 4.795 397 1HA GLY 52 1HA GLY 52 -12.375 -7.423 4.600 398 2HA GLY 52 2HA GLY 52 -13.982 -8.016 4.179 399 H PHE 53 H PHE 53 -11.267 -6.307 2.710 400 HA PHE 53 HA PHE 53 -10.884 -8.427 0.623 401 1HB PHE 53 1HB PHE 53 -12.795 -7.026 -0.303 402 2HB PHE 53 2HB PHE 53 -11.749 -5.598 -0.251 403 HD1 PHE 53 HD1 PHE 53 -9.905 -8.582 -0.836 404 HD2 PHE 53 HD2 PHE 53 -12.295 -5.707 -2.790 405 HE1 PHE 53 HE1 PHE 53 -8.973 -9.259 -2.977 406 HE2 PHE 53 HE2 PHE 53 -11.360 -6.387 -4.929 407 HZ PHE 53 HZ PHE 53 -9.700 -8.163 -5.023 408 H MET 54 H MET 54 -10.315 -4.967 1.090 409 HA MET 54 HA MET 54 -7.478 -5.296 1.827 410 1HB MET 54 1HB MET 54 -6.448 -4.381 -0.262 411 2HB MET 54 2HB MET 54 -7.221 -5.948 -0.516 412 1HG MET 54 1HG MET 54 -7.841 -4.508 -2.385 413 2HG MET 54 2HG MET 54 -9.297 -4.757 -1.398 414 1HE MET 54 1HE MET 54 -10.434 -2.598 -2.560 415 2HE MET 54 3HE MET 54 -9.653 -0.991 -2.626 416 3HE MET 54 2HE MET 54 -8.960 -2.356 -3.549 417 H ILE 55 H ILE 55 -6.290 -3.156 1.214 418 HA ILE 55 HA ILE 55 -7.583 -0.583 1.281 419 HB ILE 55 HB ILE 55 -8.818 -1.110 3.188 420 1HG1 ILE 55 1HG1 ILE 55 -7.386 1.034 3.338 421 2HG1 ILE 55 2HG1 ILE 55 -8.107 0.436 4.835 422 1HG2 ILE 55 2HG2 ILE 55 -7.725 -3.254 3.821 423 2HG2 ILE 55 3HG2 ILE 55 -6.326 -2.370 4.489 424 3HG2 ILE 55 1HG2 ILE 55 -7.933 -2.210 5.249 425 1HD1 ILE 55 2HD1 ILE 55 -5.937 -0.679 5.483 426 2HD1 ILE 55 3HD1 ILE 55 -5.179 -0.080 3.987 427 3HD1 ILE 55 1HD1 ILE 55 -5.719 1.072 5.238 428 H GLN 56 H GLN 56 -6.140 0.531 0.584 429 HA GLN 56 HA GLN 56 -3.227 -0.240 0.909 430 1HB GLN 56 1HB GLN 56 -4.176 2.009 -0.892 431 2HB GLN 56 2HB GLN 56 -2.856 0.874 -1.112 432 1HG GLN 56 1HG GLN 56 -4.486 0.202 -2.710 433 2HG GLN 56 2HG GLN 56 -4.687 -0.972 -1.408 434 1HE2 GLN 56 2HE2 GLN 56 -8.113 0.087 -2.299 435 2HE2 GLN 56 1HE2 GLN 56 -6.712 -0.893 -2.965 436 H GLY 57 H GLY 57 -1.698 1.711 0.606 437 1HA GLY 57 1HA GLY 57 -2.685 4.399 1.463 438 2HA GLY 57 2HA GLY 57 -1.655 3.665 2.691 439 H GLY 58 H GLY 58 -0.815 5.838 1.952 440 1HA GLY 58 1HA GLY 58 1.058 7.047 1.067 441 2HA GLY 58 2HA GLY 58 1.822 5.485 0.738 442 H GLY 59 H GLY 59 0.280 8.199 -0.484 443 1HA GLY 59 1HA GLY 59 0.975 7.680 -3.274 444 2HA GLY 59 2HA GLY 59 -0.743 7.290 -3.081 445 H PHE 60 H PHE 60 -1.842 8.763 -3.875 446 HA PHE 60 HA PHE 60 -1.088 11.398 -4.594 447 1HB PHE 60 1HB PHE 60 -3.941 10.568 -3.794 448 2HB PHE 60 2HB PHE 60 -3.494 11.884 -4.887 449 HD1 PHE 60 HD2 PHE 60 -1.132 10.270 -6.140 450 HD2 PHE 60 HD1 PHE 60 -5.193 9.353 -5.462 451 HE1 PHE 60 HE2 PHE 60 -1.080 8.675 -7.973 452 HE2 PHE 60 HE1 PHE 60 -5.138 7.759 -7.294 453 HZ PHE 60 HZ PHE 60 -3.084 7.423 -8.556 454 H THR 61 H THR 61 -1.104 13.326 -3.795 455 HA THR 61 HA THR 61 -1.090 13.858 -0.886 456 HB THR 61 HB THR 61 -1.459 15.777 -3.257 457 HG1 THR 61 HG1 THR 61 0.804 14.972 -1.743 458 1HG2 THR 61 3HG2 THR 61 -0.616 16.260 -0.320 459 2HG2 THR 61 1HG2 THR 61 -0.653 17.500 -1.603 460 3HG2 THR 61 2HG2 THR 61 -2.171 16.749 -1.042 461 H GLU 62 H GLU 62 -2.570 14.619 0.388 462 HA GLU 62 HA GLU 62 -5.181 13.862 0.512 463 1HB GLU 62 1HB GLU 62 -5.759 15.878 1.812 464 2HB GLU 62 2HB GLU 62 -4.132 15.309 2.224 465 1HG GLU 62 1HG GLU 62 -3.138 16.995 0.608 466 2HG GLU 62 2HG GLU 62 -4.754 17.557 0.192 467 H GLN 63 H GLN 63 -6.496 13.637 -1.029 468 HA GLN 63 HA GLN 63 -8.378 14.345 -2.339 469 1HB GLN 63 1HB GLN 63 -7.127 17.152 -2.322 470 2HB GLN 63 2HB GLN 63 -8.731 16.727 -2.933 471 1HG GLN 63 1HG GLN 63 -9.384 15.880 -0.640 472 2HG GLN 63 2HG GLN 63 -7.781 16.302 -0.029 473 1HE2 GLN 63 2HE2 GLN 63 -10.130 19.504 -1.265 474 2HE2 GLN 63 1HE2 GLN 63 -10.008 17.968 -2.261 475 H MET 64 H MET 64 -6.139 13.075 -3.230 476 HA MET 64 HA MET 64 -5.255 12.337 -5.303 477 1HB MET 64 1HB MET 64 -7.555 14.055 -6.426 478 2HB MET 64 2HB MET 64 -6.667 12.822 -7.331 479 1HG MET 64 1HG MET 64 -8.293 12.283 -4.762 480 2HG MET 64 2HG MET 64 -8.839 11.950 -6.421 481 1HE MET 64 1HE MET 64 -8.916 9.579 -4.408 482 2HE MET 64 3HE MET 64 -9.217 9.360 -6.161 483 3HE MET 64 2HE MET 64 -8.081 8.277 -5.306 484 H GLN 65 H GLN 65 -4.656 15.145 -4.175 485 HA GLN 65 HA GLN 65 -3.573 16.616 -6.593 486 1HB GLN 65 1HB GLN 65 -3.196 17.140 -3.582 487 2HB GLN 65 2HB GLN 65 -2.653 18.197 -4.894 488 1HG GLN 65 1HG GLN 65 -5.037 18.383 -5.727 489 2HG GLN 65 2HG GLN 65 -5.579 17.354 -4.398 490 1HE2 GLN 65 2HE2 GLN 65 -6.113 20.887 -3.327 491 2HE2 GLN 65 1HE2 GLN 65 -6.698 19.751 -4.644 492 H GLN 66 H GLN 66 -2.679 14.426 -7.053 493 HA GLN 66 HA GLN 66 -0.632 13.032 -5.777 494 1HB GLN 66 1HB GLN 66 -0.514 13.855 -8.741 495 2HB GLN 66 2HB GLN 66 0.365 12.511 -7.994 496 1HG GLN 66 1HG GLN 66 -1.822 11.446 -7.317 497 2HG GLN 66 2HG GLN 66 -2.707 12.798 -8.032 498 1HE2 GLN 66 2HE2 GLN 66 -0.560 10.509 -10.754 499 2HE2 GLN 66 1HE2 GLN 66 0.197 11.098 -9.189 500 H LYS 67 H LYS 67 1.288 13.229 -5.166 501 HA LYS 67 HA LYS 67 2.613 15.832 -4.831 502 1HB LYS 67 1HB LYS 67 3.807 13.011 -4.684 503 2HB LYS 67 2HB LYS 67 4.585 14.500 -4.116 504 1HG LYS 67 1HG LYS 67 2.552 14.928 -2.605 505 2HG LYS 67 2HG LYS 67 1.867 13.408 -3.153 506 1HD LYS 67 1HD LYS 67 2.814 12.946 -1.021 507 2HD LYS 67 2HD LYS 67 3.880 12.165 -2.182 508 1HE LYS 67 1HE LYS 67 5.523 14.111 -1.964 509 2HE LYS 67 2HE LYS 67 4.420 14.913 -0.837 510 1HZ LYS 67 3HZ LYS 67 4.668 13.009 0.669 511 2HZ LYS 67 1HZ LYS 67 5.698 12.259 -0.384 512 3HZ LYS 67 2HZ LYS 67 6.137 13.684 0.329 513 H LYS 68 H LYS 68 4.807 13.673 -5.803 514 HA LYS 68 HA LYS 68 4.751 14.135 -8.792 515 1HB LYS 68 1HB LYS 68 7.016 15.138 -8.883 516 2HB LYS 68 2HB LYS 68 5.901 16.182 -7.985 517 1HG LYS 68 1HG LYS 68 6.724 15.184 -5.809 518 2HG LYS 68 2HG LYS 68 7.839 14.149 -6.703 519 1HD LYS 68 1HD LYS 68 9.021 16.204 -7.612 520 2HD LYS 68 2HD LYS 68 7.902 17.242 -6.721 521 1HE LYS 68 1HE LYS 68 8.715 16.237 -4.528 522 2HE LYS 68 2HE LYS 68 9.835 15.198 -5.420 523 1HZ LYS 68 2HZ LYS 68 9.881 18.178 -5.442 524 2HZ LYS 68 3HZ LYS 68 10.927 17.198 -4.622 525 3HZ LYS 68 1HZ LYS 68 10.928 17.208 -6.274 526 HA PRO 69 HA PRO 69 6.493 10.119 -7.090 527 1HB PRO 69 1HB PRO 69 4.265 9.077 -8.870 528 2HB PRO 69 2HB PRO 69 4.699 8.554 -7.228 529 1HG PRO 69 1HG PRO 69 2.484 10.090 -7.586 530 2HG PRO 69 2HG PRO 69 3.582 10.471 -6.235 531 1HD PRO 69 1HD PRO 69 3.467 11.848 -8.986 532 2HD PRO 69 2HD PRO 69 3.545 12.602 -7.360 533 H ASN 70 H ASN 70 6.102 8.009 -8.904 534 HA ASN 70 HA ASN 70 6.910 6.995 -10.866 535 1HB ASN 70 1HB ASN 70 6.616 8.173 -12.948 536 2HB ASN 70 2HB ASN 70 5.301 8.662 -11.873 537 1HD2 ASN 70 1HD2 ASN 70 6.426 11.863 -13.242 538 2HD2 ASN 70 2HD2 ASN 70 5.399 10.391 -13.624 539 HA PRO 71 HA PRO 71 11.283 8.107 -9.881 540 1HB PRO 71 1HB PRO 71 11.183 5.099 -10.284 541 2HB PRO 71 2HB PRO 71 12.098 6.018 -9.065 542 1HG PRO 71 1HG PRO 71 9.803 4.755 -8.316 543 2HG PRO 71 2HG PRO 71 10.094 6.416 -7.744 544 1HD PRO 71 1HD PRO 71 8.280 5.532 -10.059 545 2HD PRO 71 2HD PRO 71 7.961 6.757 -8.787 546 HA PRO 72 HA PRO 72 9.262 5.465 -11.391 547 1HB PRO 72 1HB PRO 72 9.705 3.862 -13.948 548 2HB PRO 72 2HB PRO 72 8.171 4.388 -13.225 549 1HG PRO 72 1HG PRO 72 9.053 5.691 -15.419 550 2HG PRO 72 2HG PRO 72 8.470 6.674 -14.046 551 1HD PRO 72 1HD PRO 72 11.406 5.929 -14.684 552 2HD PRO 72 2HD PRO 72 10.720 7.558 -14.384 553 H ILE 73 H ILE 73 9.210 2.772 -11.901 554 HA ILE 73 HA ILE 73 11.870 1.482 -11.851 555 HB ILE 73 HB ILE 73 11.691 0.546 -9.512 556 1HG1 ILE 73 1HG1 ILE 73 10.388 1.971 -7.863 557 2HG1 ILE 73 2HG1 ILE 73 9.628 2.818 -9.215 558 1HG2 ILE 73 2HG2 ILE 73 13.266 2.369 -10.193 559 2HG2 ILE 73 3HG2 ILE 73 12.020 3.596 -9.844 560 3HG2 ILE 73 1HG2 ILE 73 12.703 2.615 -8.519 561 1HD1 ILE 73 3HD1 ILE 73 9.411 -0.222 -8.661 562 2HD1 ILE 73 1HD1 ILE 73 8.139 0.988 -8.350 563 3HD1 ILE 73 2HD1 ILE 73 8.633 0.627 -10.026 564 H LYS 74 H LYS 74 11.931 -0.533 -12.056 565 HA LYS 74 HA LYS 74 10.059 -1.760 -13.706 566 1HB LYS 74 1HB LYS 74 11.789 -3.281 -11.680 567 2HB LYS 74 2HB LYS 74 11.145 -3.918 -13.204 568 1HG LYS 74 1HG LYS 74 12.403 -2.094 -14.470 569 2HG LYS 74 2HG LYS 74 13.011 -1.478 -12.944 570 1HD LYS 74 1HD LYS 74 14.818 -2.742 -13.873 571 2HD LYS 74 2HD LYS 74 14.213 -3.672 -12.522 572 1HE LYS 74 1HE LYS 74 14.698 -5.234 -14.297 573 2HE LYS 74 2HE LYS 74 12.944 -5.191 -14.160 574 1HZ LYS 74 3HZ LYS 74 14.556 -3.726 -16.203 575 2HZ LYS 74 1HZ LYS 74 13.665 -5.092 -16.467 576 3HZ LYS 74 2HZ LYS 74 12.909 -3.672 -16.091 577 H ASN 75 H ASN 75 8.805 -3.571 -13.571 578 HA ASN 75 HA ASN 75 6.604 -3.302 -11.595 579 1HB ASN 75 1HB ASN 75 5.528 -5.071 -12.940 580 2HB ASN 75 2HB ASN 75 6.224 -3.835 -13.997 581 1HD2 ASN 75 1HD2 ASN 75 7.324 -7.032 -15.481 582 2HD2 ASN 75 2HD2 ASN 75 5.811 -6.017 -15.267 583 H GLU 76 H GLU 76 5.742 -5.889 -11.426 584 HA GLU 76 HA GLU 76 7.058 -8.056 -10.439 585 1HB GLU 76 1HB GLU 76 8.717 -6.531 -9.326 586 2HB GLU 76 2HB GLU 76 7.430 -5.849 -8.324 587 1HG GLU 76 1HG GLU 76 8.663 -7.631 -7.072 588 2HG GLU 76 2HG GLU 76 6.968 -8.064 -7.291 589 H ALA 77 H ALA 77 5.639 -9.362 -9.722 590 HA ALA 77 HA ALA 77 3.431 -8.602 -7.811 591 1HB ALA 77 2HB ALA 77 2.581 -7.731 -10.027 592 2HB ALA 77 3HB ALA 77 2.798 -9.348 -10.749 593 3HB ALA 77 1HB ALA 77 1.600 -9.103 -9.453 594 H ASP 78 H ASP 78 4.813 -10.940 -10.036 595 HA ASP 78 HA ASP 78 3.095 -13.159 -9.336 596 1HB ASP 78 1HB ASP 78 4.759 -14.579 -10.476 597 2HB ASP 78 2HB ASP 78 4.478 -13.086 -11.388 598 H ASN 79 H ASN 79 6.193 -12.127 -8.000 599 HA ASN 79 HA ASN 79 7.508 -13.047 -6.216 600 1HB ASN 79 1HB ASN 79 6.215 -13.227 -4.102 601 2HB ASN 79 2HB ASN 79 5.778 -11.784 -5.022 602 1HD2 ASN 79 1HD2 ASN 79 2.824 -14.272 -4.015 603 2HD2 ASN 79 2HD2 ASN 79 4.489 -14.181 -3.249 604 H GLY 80 H GLY 80 5.421 -15.042 -4.638 605 1HA GLY 80 1HA GLY 80 5.206 -17.507 -6.033 606 2HA GLY 80 2HA GLY 80 6.887 -17.527 -5.460 607 H LEU 81 H LEU 81 6.914 -16.441 -3.137 608 HA LEU 81 HA LEU 81 6.359 -18.417 -1.264 609 1HB LEU 81 1HB LEU 81 5.909 -15.448 -0.615 610 2HB LEU 81 2HB LEU 81 6.410 -16.711 0.508 611 HG LEU 81 HG LEU 81 8.014 -15.786 -1.951 612 1HD1 LEU 81 2HD1 LEU 81 7.930 -14.052 -0.138 613 2HD1 LEU 81 3HD1 LEU 81 8.473 -15.256 1.059 614 3HD1 LEU 81 1HD1 LEU 81 9.562 -14.755 -0.261 615 1HD2 LEU 81 3HD2 LEU 81 8.408 -18.197 -1.368 616 2HD2 LEU 81 1HD2 LEU 81 9.846 -17.212 -0.992 617 3HD2 LEU 81 2HD2 LEU 81 8.761 -17.743 0.320 618 NH1 ARG 82 NH2 ARG 82 0.252 -22.697 -0.406 619 NH2 ARG 82 NH1 ARG 82 1.746 -24.325 0.125 620 H ARG 82 H ARG 82 4.966 -18.059 0.681 621 HA ARG 82 HA ARG 82 2.046 -18.370 0.005 622 1HB ARG 82 1HB ARG 82 3.554 -18.131 2.673 623 2HB ARG 82 2HB ARG 82 1.814 -18.408 2.537 624 1HG ARG 82 1HG ARG 82 4.030 -20.218 1.382 625 2HG ARG 82 2HG ARG 82 3.083 -20.556 2.835 626 1HD ARG 82 1HD ARG 82 0.954 -20.589 1.437 627 2HD ARG 82 2HD ARG 82 1.912 -20.269 -0.021 628 HE ARG 82 HE ARG 82 3.049 -22.633 1.224 629 1HH1 ARG 82 2HH2 ARG 82 -0.003 -21.705 -0.349 630 2HH1 ARG 82 1HH2 ARG 82 -0.282 -23.443 -0.865 631 1HH2 ARG 82 1HH1 ARG 82 2.628 -24.578 0.584 632 2HH2 ARG 82 2HH1 ARG 82 1.108 -24.958 -0.372 633 H ASN 83 H ASN 83 0.473 -17.011 0.528 634 HA ASN 83 HA ASN 83 0.991 -14.238 1.609 635 1HB ASN 83 1HB ASN 83 0.084 -14.671 -1.307 636 2HB ASN 83 2HB ASN 83 0.153 -13.114 -0.470 637 1HD2 ASN 83 1HD2 ASN 83 3.892 -13.491 -0.141 638 2HD2 ASN 83 2HD2 ASN 83 2.468 -13.429 1.014 639 H THR 84 H THR 84 -0.529 -13.644 2.719 640 HA THR 84 HA THR 84 -3.446 -14.132 2.170 641 HB THR 84 HB THR 84 -1.783 -15.636 4.273 642 HG1 THR 84 HG1 THR 84 -2.061 -16.539 2.206 643 1HG2 THR 84 3HG2 THR 84 -4.845 -15.335 4.088 644 2HG2 THR 84 1HG2 THR 84 -3.977 -16.453 5.190 645 3HG2 THR 84 2HG2 THR 84 -3.801 -14.687 5.379 646 NH1 ARG 85 NH2 ARG 85 -8.943 -12.748 10.227 647 NH2 ARG 85 NH1 ARG 85 -8.200 -10.920 11.357 648 H ARG 85 H ARG 85 -4.781 -13.238 3.621 649 HA ARG 85 HA ARG 85 -4.598 -10.754 4.767 650 1HB ARG 85 1HB ARG 85 -6.597 -12.166 5.185 651 2HB ARG 85 2HB ARG 85 -5.631 -13.326 6.110 652 1HG ARG 85 1HG ARG 85 -5.078 -11.475 7.779 653 2HG ARG 85 2HG ARG 85 -6.189 -10.403 6.924 654 1HD ARG 85 1HD ARG 85 -8.111 -11.989 7.412 655 2HD ARG 85 2HD ARG 85 -6.990 -13.108 8.209 656 HE ARG 85 HE ARG 85 -6.807 -10.438 9.461 657 1HH1 ARG 85 2HH2 ARG 85 -8.897 -13.316 9.374 658 2HH1 ARG 85 1HH2 ARG 85 -9.523 -12.927 11.054 659 1HH2 ARG 85 1HH1 ARG 85 -7.590 -10.096 11.367 660 2HH2 ARG 85 2HH1 ARG 85 -8.832 -11.226 12.105 661 H GLY 86 H GLY 86 -2.882 -10.033 5.211 662 1HA GLY 86 1HA GLY 86 -1.632 -9.582 7.665 663 2HA GLY 86 2HA GLY 86 -0.967 -11.173 7.263 664 H THR 87 H THR 87 -1.430 -10.179 4.331 665 HA THR 87 HA THR 87 1.425 -9.041 4.062 666 HB THR 87 HB THR 87 1.280 -9.928 1.725 667 HG1 THR 87 HG1 THR 87 -0.992 -9.970 1.633 668 1HG2 THR 87 2HG2 THR 87 2.362 -11.223 3.576 669 2HG2 THR 87 3HG2 THR 87 0.794 -11.963 3.995 670 3HG2 THR 87 1HG2 THR 87 1.563 -12.320 2.421 671 H ILE 88 H ILE 88 1.935 -7.494 2.932 672 HA ILE 88 HA ILE 88 -0.161 -5.740 1.520 673 HB ILE 88 HB ILE 88 0.632 -4.137 2.818 674 1HG1 ILE 88 1HG1 ILE 88 3.081 -3.279 2.116 675 2HG1 ILE 88 2HG1 ILE 88 2.947 -4.512 0.901 676 1HG2 ILE 88 2HG2 ILE 88 1.805 -5.681 4.396 677 2HG2 ILE 88 3HG2 ILE 88 3.255 -5.630 3.354 678 3HG2 ILE 88 1HG2 ILE 88 2.702 -4.152 4.184 679 1HD1 ILE 88 2HD1 ILE 88 0.719 -3.388 0.133 680 2HD1 ILE 88 3HD1 ILE 88 0.922 -2.192 1.438 681 3HD1 ILE 88 1HD1 ILE 88 2.081 -2.230 0.088 682 H ALA 89 H ALA 89 0.617 -4.610 -0.274 683 HA ALA 89 HA ALA 89 2.747 -5.828 -2.004 684 1HB ALA 89 2HB ALA 89 0.962 -7.600 -2.122 685 2HB ALA 89 3HB ALA 89 -0.225 -6.382 -2.663 686 3HB ALA 89 1HB ALA 89 1.167 -6.794 -3.697 687 H MET 90 H MET 90 3.298 -4.711 -3.630 688 HA MET 90 HA MET 90 2.732 -1.887 -3.714 689 1HB MET 90 1HB MET 90 4.813 -2.733 -4.590 690 2HB MET 90 2HB MET 90 4.004 -3.671 -5.857 691 1HG MET 90 1HG MET 90 3.502 -1.774 -7.145 692 2HG MET 90 2HG MET 90 3.301 -0.723 -5.734 693 1HE MET 90 1HE MET 90 5.608 -0.488 -3.967 694 2HE MET 90 3HE MET 90 6.790 0.547 -4.826 695 3HE MET 90 2HE MET 90 5.045 0.929 -4.906 696 H ALA 91 H ALA 91 1.520 -0.606 -4.734 697 HA ALA 91 HA ALA 91 -1.058 -1.630 -5.801 698 1HB ALA 91 2HB ALA 91 -0.925 0.457 -4.423 699 2HB ALA 91 3HB ALA 91 0.036 1.254 -5.696 700 3HB ALA 91 1HB ALA 91 -1.654 0.785 -6.014 701 NH1 ARG 92 NH2 ARG 92 0.022 4.581 -11.944 702 NH2 ARG 92 NH1 ARG 92 -1.562 2.958 -11.782 703 H ARG 92 H ARG 92 1.390 0.538 -7.154 704 HA ARG 92 HA ARG 92 0.501 1.140 -9.641 705 1HB ARG 92 1HB ARG 92 2.841 1.567 -8.740 706 2HB ARG 92 2HB ARG 92 3.302 -0.055 -9.272 707 1HG ARG 92 1HG ARG 92 3.941 1.537 -11.014 708 2HG ARG 92 2HG ARG 92 2.657 0.520 -11.647 709 1HD ARG 92 1HD ARG 92 2.269 3.381 -10.513 710 2HD ARG 92 2HD ARG 92 2.456 2.989 -12.224 711 HE ARG 92 HE ARG 92 0.205 1.427 -11.235 712 1HH1 ARG 92 2HH2 ARG 92 1.015 4.830 -11.879 713 2HH1 ARG 92 1HH2 ARG 92 -0.756 5.209 -12.176 714 1HH2 ARG 92 1HH1 ARG 92 -1.779 1.973 -11.594 715 2HH2 ARG 92 2HH1 ARG 92 -2.229 3.699 -12.024 716 H THR 93 H THR 93 1.107 0.419 -11.786 717 HA THR 93 HA THR 93 1.554 -2.205 -12.748 718 HB THR 93 HB THR 93 -0.229 -2.909 -11.142 719 HG1 THR 93 HG1 THR 93 0.096 -3.988 -13.117 720 1HG2 THR 93 2HG2 THR 93 -1.624 -0.810 -11.232 721 2HG2 THR 93 3HG2 THR 93 -2.063 -1.167 -12.923 722 3HG2 THR 93 1HG2 THR 93 -2.613 -2.245 -11.612 723 H ALA 94 H ALA 94 0.691 -2.701 -14.785 724 HA ALA 94 HA ALA 94 -0.166 -2.187 -16.970 725 1HB ALA 94 2HB ALA 94 -2.058 -0.910 -15.920 726 2HB ALA 94 3HB ALA 94 -1.014 0.528 -15.764 727 3HB ALA 94 1HB ALA 94 -1.456 -0.083 -17.379 728 H ASP 95 H ASP 95 0.975 -1.758 -18.581 729 HA ASP 95 HA ASP 95 2.403 -0.296 -20.009 730 1HB ASP 95 1HB ASP 95 3.324 0.798 -17.278 731 2HB ASP 95 2HB ASP 95 3.965 1.321 -18.844 732 H LYS 96 H LYS 96 3.738 -1.202 -16.876 733 HA LYS 96 HA LYS 96 5.124 -3.509 -17.087 734 1HB LYS 96 1HB LYS 96 6.683 -1.528 -18.854 735 2HB LYS 96 2HB LYS 96 7.223 -3.157 -18.412 736 1HG LYS 96 1HG LYS 96 5.103 -4.099 -19.449 737 2HG LYS 96 2HG LYS 96 4.642 -2.493 -19.985 738 1HD LYS 96 1HD LYS 96 7.215 -3.981 -20.890 739 2HD LYS 96 2HD LYS 96 5.683 -4.023 -21.728 740 1HE LYS 96 1HE LYS 96 6.898 -2.447 -22.966 741 2HE LYS 96 2HE LYS 96 5.795 -1.455 -22.021 742 1HZ LYS 96 3HZ LYS 96 8.669 -1.958 -21.379 743 2HZ LYS 96 1HZ LYS 96 8.044 -0.566 -22.013 744 3HZ LYS 96 2HZ LYS 96 7.656 -1.019 -20.472 745 H ASP 97 H ASP 97 7.357 -0.963 -17.581 746 HA ASP 97 HA ASP 97 8.420 -0.954 -14.814 747 1HB ASP 97 1HB ASP 97 9.766 -0.279 -16.821 748 2HB ASP 97 2HB ASP 97 8.691 1.104 -17.090 749 H SER 98 H SER 98 7.029 -0.491 -13.320 750 HA SER 98 HA SER 98 6.127 2.287 -12.884 751 1HB SER 98 1HB SER 98 4.570 1.469 -14.736 752 2HB SER 98 2HB SER 98 3.947 0.234 -13.628 753 HG SER 98 HG SER 98 3.945 3.049 -13.211 754 H ALA 99 H ALA 99 4.282 2.276 -11.216 755 HA ALA 99 HA ALA 99 3.618 1.739 -8.965 756 1HB ALA 99 2HB ALA 99 3.614 -0.717 -9.486 757 2HB ALA 99 3HB ALA 99 5.385 -0.781 -9.273 758 3HB ALA 99 1HB ALA 99 4.330 -0.410 -7.886 759 H THR 100 H THR 100 4.576 3.579 -8.606 760 HA THR 100 HA THR 100 7.497 3.936 -8.432 761 HB THR 100 HB THR 100 6.929 6.269 -7.857 762 HG1 THR 100 HG1 THR 100 4.725 6.773 -7.632 763 1HG2 THR 100 2HG2 THR 100 6.730 5.523 -10.259 764 2HG2 THR 100 3HG2 THR 100 5.030 5.060 -9.980 765 3HG2 THR 100 1HG2 THR 100 5.516 6.774 -9.879 766 H SER 101 H SER 101 4.901 3.816 -6.048 767 HA SER 101 HA SER 101 6.862 3.353 -3.770 768 1HB SER 101 1HB SER 101 5.029 5.826 -3.924 769 2HB SER 101 2HB SER 101 6.048 5.369 -2.545 770 HG SER 101 HG SER 101 7.035 6.890 -3.919 771 H GLN 102 H GLN 102 3.692 4.798 -4.005 772 HA GLN 102 HA GLN 102 2.421 3.637 -1.835 773 1HB GLN 102 1HB GLN 102 0.230 3.798 -3.135 774 2HB GLN 102 2HB GLN 102 1.228 5.251 -3.125 775 1HG GLN 102 1HG GLN 102 0.380 4.885 -5.399 776 2HG GLN 102 2HG GLN 102 2.137 4.711 -5.388 777 1HE2 GLN 102 2HE2 GLN 102 0.677 1.879 -7.372 778 2HE2 GLN 102 1HE2 GLN 102 0.624 3.712 -7.421 779 H PHE 103 H PHE 103 0.733 2.136 -1.649 780 HA PHE 103 HA PHE 103 1.036 -0.519 -3.043 781 1HB PHE 103 1HB PHE 103 1.816 -1.677 -1.009 782 2HB PHE 103 2HB PHE 103 2.990 -0.473 -1.528 783 HD1 PHE 103 HD2 PHE 103 0.264 1.273 -0.128 784 HD2 PHE 103 HD1 PHE 103 3.603 -1.060 0.967 785 HE1 PHE 103 HE2 PHE 103 0.209 2.237 2.097 786 HE2 PHE 103 HE1 PHE 103 3.544 -0.092 3.193 787 HZ PHE 103 HZ PHE 103 1.843 1.551 3.757 788 H PHE 104 H PHE 104 0.035 -2.090 -1.064 789 HA PHE 104 HA PHE 104 -2.580 -0.945 -0.098 790 1HB PHE 104 1HB PHE 104 -4.015 -2.341 -1.485 791 2HB PHE 104 2HB PHE 104 -3.022 -1.329 -2.529 792 HD1 PHE 104 HD1 PHE 104 -3.499 -4.713 -1.215 793 HD2 PHE 104 HD2 PHE 104 -1.326 -2.342 -3.936 794 HE1 PHE 104 HE1 PHE 104 -2.789 -6.724 -2.395 795 HE2 PHE 104 HE2 PHE 104 -0.614 -4.351 -5.117 796 HZ PHE 104 HZ PHE 104 -1.365 -6.540 -4.358 797 H ILE 105 H ILE 105 -2.911 -1.640 1.636 798 HA ILE 105 HA ILE 105 -1.746 -4.227 2.712 799 HB ILE 105 HB ILE 105 -3.496 -2.074 4.029 800 1HG1 ILE 105 1HG1 ILE 105 -0.460 -2.593 4.081 801 2HG1 ILE 105 2HG1 ILE 105 -1.256 -1.264 3.232 802 1HG2 ILE 105 2HG2 ILE 105 -3.652 -4.318 5.143 803 2HG2 ILE 105 3HG2 ILE 105 -1.874 -4.420 5.217 804 3HG2 ILE 105 1HG2 ILE 105 -2.736 -3.174 6.160 805 1HD1 ILE 105 2HD1 ILE 105 -2.178 -0.394 5.430 806 2HD1 ILE 105 3HD1 ILE 105 -1.376 -1.737 6.290 807 3HD1 ILE 105 1HD1 ILE 105 -0.398 -0.494 5.466 808 H ASN 106 H ASN 106 -2.714 -5.974 2.212 809 HA ASN 106 HA ASN 106 -5.527 -6.275 1.400 810 1HB ASN 106 1HB ASN 106 -3.581 -8.374 2.537 811 2HB ASN 106 2HB ASN 106 -5.109 -8.724 1.713 812 1HD2 ASN 106 1HD2 ASN 106 -3.496 -6.872 -1.288 813 2HD2 ASN 106 2HD2 ASN 106 -4.685 -6.297 -0.014 814 H VAL 107 H VAL 107 -7.037 -7.642 2.471 815 HA VAL 107 HA VAL 107 -6.937 -7.955 5.450 816 HB VAL 107 HB VAL 107 -8.945 -6.620 5.930 817 1HG1 VAL 107 3HG2 VAL 107 -6.696 -5.521 6.122 818 2HG1 VAL 107 1HG2 VAL 107 -6.794 -4.996 4.421 819 3HG1 VAL 107 2HG2 VAL 107 -7.935 -4.338 5.624 820 1HG2 VAL 107 2HG1 VAL 107 -10.046 -6.829 3.684 821 2HG2 VAL 107 3HG1 VAL 107 -9.928 -5.117 4.170 822 3HG2 VAL 107 1HG1 VAL 107 -8.797 -5.782 2.961 823 H ALA 108 H ALA 108 -6.997 -9.644 3.291 824 HA ALA 108 HA ALA 108 -8.898 -11.626 4.239 825 1HB ALA 108 2HB ALA 108 -10.637 -10.085 3.266 826 2HB ALA 108 3HB ALA 108 -9.834 -10.168 1.674 827 3HB ALA 108 1HB ALA 108 -10.583 -11.627 2.375 828 H ASP 109 H ASP 109 -8.460 -13.516 3.526 829 HA ASP 109 HA ASP 109 -6.076 -14.287 2.256 830 1HB ASP 109 1HB ASP 109 -8.805 -15.668 1.884 831 2HB ASP 109 2HB ASP 109 -7.229 -16.421 1.589 832 H ASN 110 H ASN 110 -5.759 -12.630 0.795 833 HA ASN 110 HA ASN 110 -7.490 -12.136 -1.513 834 1HB ASN 110 1HB ASN 110 -5.887 -10.489 -0.425 835 2HB ASN 110 2HB ASN 110 -4.541 -11.340 -1.198 836 1HD2 ASN 110 1HD2 ASN 110 -7.356 -9.471 -3.637 837 2HD2 ASN 110 2HD2 ASN 110 -7.834 -10.286 -2.064 838 H ALA 111 H ALA 111 -4.514 -12.167 -2.869 839 HA ALA 111 HA ALA 111 -3.411 -13.593 -4.448 840 1HB ALA 111 2HB ALA 111 -3.699 -15.513 -2.859 841 2HB ALA 111 3HB ALA 111 -5.354 -15.785 -3.479 842 3HB ALA 111 1HB ALA 111 -3.949 -16.029 -4.548 843 H PHE 112 H PHE 112 -6.898 -13.584 -4.232 844 HA PHE 112 HA PHE 112 -7.836 -14.661 -6.610 845 1HB PHE 112 1HB PHE 112 -8.631 -11.841 -5.653 846 2HB PHE 112 2HB PHE 112 -9.605 -12.909 -6.670 847 HD1 PHE 112 HD2 PHE 112 -8.644 -15.469 -5.135 848 HD2 PHE 112 HD1 PHE 112 -10.295 -11.796 -3.880 849 HE1 PHE 112 HE2 PHE 112 -9.520 -16.543 -3.138 850 HE2 PHE 112 HE1 PHE 112 -11.167 -12.873 -1.883 851 HZ PHE 112 HZ PHE 112 -10.774 -15.243 -1.507 852 H LEU 113 H LEU 113 -6.484 -11.429 -6.271 853 HA LEU 113 HA LEU 113 -6.237 -11.066 -9.273 854 1HB LEU 113 1HB LEU 113 -5.471 -8.808 -8.778 855 2HB LEU 113 2HB LEU 113 -7.029 -9.146 -8.046 856 HG LEU 113 HG LEU 113 -5.560 -7.819 -6.571 857 1HD1 LEU 113 2HD1 LEU 113 -7.285 -9.310 -5.538 858 2HD1 LEU 113 3HD1 LEU 113 -6.083 -10.622 -5.411 859 3HD1 LEU 113 1HD1 LEU 113 -5.862 -9.119 -4.482 860 1HD2 LEU 113 3HD2 LEU 113 -3.334 -8.727 -7.260 861 2HD2 LEU 113 1HD2 LEU 113 -3.542 -8.802 -5.493 862 3HD2 LEU 113 2HD2 LEU 113 -3.713 -10.282 -6.470 863 H ASP 114 H ASP 114 -4.806 -13.204 -8.052 864 HA ASP 114 HA ASP 114 -2.097 -13.010 -7.608 865 1HB ASP 114 1HB ASP 114 -1.746 -15.029 -9.070 866 2HB ASP 114 2HB ASP 114 -3.129 -15.169 -7.976 867 H HIS 115 H HIS 115 -1.812 -14.079 -10.705 868 HA HIS 115 HA HIS 115 -1.556 -11.705 -12.315 869 1HB HIS 115 1HB HIS 115 1.189 -12.482 -11.171 870 2HB HIS 115 2HB HIS 115 0.783 -11.078 -12.167 871 HD2 HIS 115 HD2 HIS 115 1.876 -11.532 -8.914 872 HE1 HIS 115 HE1 HIS 115 -1.448 -9.176 -8.080 873 HE2 HIS 115 HE2 HIS 115 0.733 -10.057 -7.031 874 H GLY 116 H GLY 116 -1.982 -12.643 -14.061 875 1HA GLY 116 1HA GLY 116 -0.119 -14.198 -15.631 876 2HA GLY 116 2HA GLY 116 -1.177 -15.385 -14.839 877 H GLN 117 H GLN 117 -0.737 -13.341 -17.399 878 HA GLN 117 HA GLN 117 -2.881 -14.245 -19.002 879 1HB GLN 117 1HB GLN 117 -4.441 -13.267 -17.291 880 2HB GLN 117 2HB GLN 117 -3.717 -11.670 -17.524 881 1HG GLN 117 1HG GLN 117 -5.795 -11.882 -18.883 882 2HG GLN 117 2HG GLN 117 -4.389 -11.678 -19.934 883 1HE2 GLN 117 2HE2 GLN 117 -5.456 -14.556 -21.727 884 2HE2 GLN 117 1HE2 GLN 117 -4.944 -12.794 -21.713 885 NH1 ARG 118 NH2 ARG 118 2.356 -12.755 -23.808 886 NH2 ARG 118 NH1 ARG 118 1.139 -14.541 -24.514 887 H ARG 118 H ARG 118 -1.718 -11.049 -18.035 888 HA ARG 118 HA ARG 118 0.172 -10.456 -20.055 889 1HB ARG 118 1HB ARG 118 -2.705 -9.957 -21.042 890 2HB ARG 118 2HB ARG 118 -1.267 -9.309 -21.832 891 1HG ARG 118 1HG ARG 118 -1.865 -12.304 -21.383 892 2HG ARG 118 2HG ARG 118 -2.124 -11.434 -22.899 893 1HD ARG 118 1HD ARG 118 0.365 -10.891 -23.005 894 2HD ARG 118 2HD ARG 118 0.622 -11.818 -21.514 895 HE ARG 118 HE ARG 118 -0.728 -13.615 -23.323 896 1HH1 ARG 118 2HH2 ARG 118 2.376 -11.879 -23.274 897 2HH1 ARG 118 1HH2 ARG 118 3.133 -13.175 -24.329 898 1HH2 ARG 118 1HH1 ARG 118 0.237 -15.028 -24.521 899 2HH2 ARG 118 2HH1 ARG 118 2.001 -14.837 -24.986 900 H ASP 119 H ASP 119 0.111 -9.558 -17.715 901 HA ASP 119 HA ASP 119 0.097 -6.651 -17.901 902 1HB ASP 119 1HB ASP 119 -2.347 -7.885 -16.491 903 2HB ASP 119 2HB ASP 119 -1.793 -6.230 -16.206 904 H PHE 120 H PHE 120 -0.791 -9.145 -15.555 905 HA PHE 120 HA PHE 120 0.308 -9.763 -13.484 906 1HB PHE 120 1HB PHE 120 2.279 -7.516 -14.226 907 2HB PHE 120 2HB PHE 120 2.338 -8.407 -12.705 908 HD1 PHE 120 HD1 PHE 120 1.899 -9.270 -16.325 909 HD2 PHE 120 HD2 PHE 120 3.827 -10.160 -12.679 910 HE1 PHE 120 HE1 PHE 120 3.126 -11.066 -17.407 911 HE2 PHE 120 HE2 PHE 120 5.051 -11.952 -13.762 912 HZ PHE 120 HZ PHE 120 4.702 -12.410 -16.130 913 H GLY 121 H GLY 121 -1.289 -9.365 -12.298 914 1HA GLY 121 1HA GLY 121 -2.630 -6.825 -11.831 915 2HA GLY 121 2HA GLY 121 -2.781 -8.247 -10.795 916 OH TYR 122 OH TYR 122 -6.851 -3.921 -8.359 917 H TYR 122 H TYR 122 -2.541 -7.666 -8.885 918 HA TYR 122 HA TYR 122 -0.889 -5.348 -7.993 919 1HB TYR 122 1HB TYR 122 -2.397 -7.459 -6.340 920 2HB TYR 122 2HB TYR 122 -1.779 -5.916 -5.747 921 HD1 TYR 122 HD1 TYR 122 -4.177 -7.470 -8.071 922 HD2 TYR 122 HD2 TYR 122 -2.940 -3.881 -6.227 923 HE1 TYR 122 HE1 TYR 122 -6.217 -6.381 -8.820 924 HE2 TYR 122 HE2 TYR 122 -4.982 -2.794 -6.978 925 HH TYR 122 HH TYR 122 -6.848 -3.009 -8.060 926 H ALA 123 H ALA 123 0.948 -5.278 -7.120 927 HA ALA 123 HA ALA 123 2.836 -7.544 -7.198 928 1HB ALA 123 2HB ALA 123 3.543 -5.169 -7.535 929 2HB ALA 123 3HB ALA 123 3.119 -4.787 -5.844 930 3HB ALA 123 1HB ALA 123 4.447 -5.923 -6.201 931 H VAL 124 H VAL 124 4.140 -6.681 -4.698 932 HA VAL 124 HA VAL 124 2.724 -7.433 -2.307 933 HB VAL 124 HB VAL 124 3.863 -9.826 -3.869 934 1HG1 VAL 124 3HG2 VAL 124 4.750 -9.905 -1.529 935 2HG1 VAL 124 1HG2 VAL 124 3.102 -9.710 -0.879 936 3HG1 VAL 124 2HG2 VAL 124 3.538 -11.182 -1.787 937 1HG2 VAL 124 2HG1 VAL 124 1.443 -9.270 -4.273 938 2HG2 VAL 124 3HG1 VAL 124 1.599 -10.810 -3.388 939 3HG2 VAL 124 1HG1 VAL 124 1.127 -9.325 -2.519 940 H PHE 125 H PHE 125 4.043 -6.904 -0.687 941 HA PHE 125 HA PHE 125 6.902 -7.754 -0.633 942 1HB PHE 125 1HB PHE 125 7.905 -5.543 -0.940 943 2HB PHE 125 2HB PHE 125 6.888 -5.879 -2.346 944 HD1 PHE 125 HD1 PHE 125 4.482 -4.984 -2.277 945 HD2 PHE 125 HD2 PHE 125 7.422 -3.700 0.460 946 HE1 PHE 125 HE1 PHE 125 3.098 -3.076 -1.682 947 HE2 PHE 125 HE2 PHE 125 6.039 -1.791 1.049 948 HZ PHE 125 HZ PHE 125 3.865 -1.495 0.000 949 H GLY 126 H GLY 126 4.377 -7.539 1.144 950 1HA GLY 126 1HA GLY 126 6.019 -7.108 3.624 951 2HA GLY 126 2HA GLY 126 4.785 -5.868 3.371 952 H LYS 127 H LYS 127 3.615 -6.231 4.887 953 HA LYS 127 HA LYS 127 1.742 -8.415 5.215 954 1HB LYS 127 1HB LYS 127 4.100 -8.547 7.190 955 2HB LYS 127 2HB LYS 127 2.640 -9.548 7.255 956 1HG LYS 127 1HG LYS 127 3.182 -10.507 4.982 957 2HG LYS 127 2HG LYS 127 4.571 -9.441 4.857 958 1HD LYS 127 1HD LYS 127 5.436 -11.612 5.438 959 2HD LYS 127 2HD LYS 127 5.666 -10.567 6.820 960 1HE LYS 127 1HE LYS 127 4.976 -12.725 7.658 961 2HE LYS 127 2HE LYS 127 3.633 -11.628 7.957 962 1HZ LYS 127 2HZ LYS 127 3.811 -13.566 5.692 963 2HZ LYS 127 3HZ LYS 127 2.880 -13.737 7.046 964 3HZ LYS 127 1HZ LYS 127 2.541 -12.543 5.956 965 H VAL 128 H VAL 128 2.012 -8.443 8.145 966 HA VAL 128 HA VAL 128 1.347 -5.622 9.029 967 HB VAL 128 HB VAL 128 -0.761 -7.860 8.947 968 1HG1 VAL 128 1HG2 VAL 128 -0.922 -4.937 9.941 969 2HG1 VAL 128 2HG2 VAL 128 -2.294 -6.073 9.838 970 3HG1 VAL 128 3HG2 VAL 128 -0.957 -6.390 10.973 971 1HG2 VAL 128 2HG1 VAL 128 -0.330 -6.823 6.697 972 2HG2 VAL 128 3HG1 VAL 128 -1.928 -6.336 7.321 973 3HG2 VAL 128 1HG1 VAL 128 -0.557 -5.197 7.391 974 H VAL 129 H VAL 129 0.857 -5.411 11.158 975 HA VAL 129 HA VAL 129 1.445 -7.670 13.094 976 HB VAL 129 HB VAL 129 3.204 -5.151 12.916 977 1HG1 VAL 129 3HG2 VAL 129 2.772 -5.949 15.260 978 2HG1 VAL 129 1HG2 VAL 129 3.275 -7.597 14.805 979 3HG1 VAL 129 2HG2 VAL 129 4.463 -6.265 14.789 980 1HG2 VAL 129 2HG1 VAL 129 3.714 -6.822 11.110 981 2HG2 VAL 129 3HG1 VAL 129 5.023 -6.784 12.321 982 3HG2 VAL 129 1HG1 VAL 129 3.838 -8.119 12.328 983 H LYS 130 H LYS 130 0.962 -4.212 12.590 984 HA LYS 130 HA LYS 130 -1.316 -4.094 14.495 985 1HB LYS 130 1HB LYS 130 1.336 -2.749 15.302 986 2HB LYS 130 2HB LYS 130 -0.212 -2.519 16.119 987 1HG LYS 130 1HG LYS 130 1.338 -5.161 15.807 988 2HG LYS 130 2HG LYS 130 1.195 -4.243 17.299 989 1HD LYS 130 1HD LYS 130 -1.174 -5.555 15.797 990 2HD LYS 130 2HD LYS 130 -0.288 -6.307 17.117 991 1HE LYS 130 1HE LYS 130 -0.990 -4.436 18.689 992 2HE LYS 130 2HE LYS 130 -1.916 -3.688 17.380 993 1HZ LYS 130 1HZ LYS 130 -2.403 -6.416 18.473 994 2HZ LYS 130 2HZ LYS 130 -3.318 -5.074 18.769 995 3HZ LYS 130 3HZ LYS 130 -3.264 -5.718 17.248 996 H GLY 131 H GLY 131 -2.048 -1.451 12.335 997 1HA GLY 131 1HA GLY 131 -2.351 -4.351 12.722 998 2HA GLY 131 2HA GLY 131 -2.995 -3.536 14.159 999 H MET 132 H MET 132 -4.080 -5.106 11.911 1000 HA MET 132 HA MET 132 -5.853 -3.651 10.189 1001 1HB MET 132 1HB MET 132 -6.293 -6.305 11.672 1002 2HB MET 132 2HB MET 132 -7.431 -5.657 10.480 1003 1HG MET 132 1HG MET 132 -4.445 -6.197 9.932 1004 2HG MET 132 2HG MET 132 -5.806 -7.207 9.383 1005 1HE MET 132 1HE MET 132 -3.677 -5.982 7.297 1006 2HE MET 132 3HE MET 132 -5.100 -6.947 6.788 1007 3HE MET 132 2HE MET 132 -4.766 -5.368 6.019 1008 H ASP 133 H ASP 133 -5.952 -4.014 13.651 1009 HA ASP 133 HA ASP 133 -8.686 -3.357 14.269 1010 1HB ASP 133 1HB ASP 133 -7.798 -2.255 16.332 1011 2HB ASP 133 2HB ASP 133 -7.106 -3.857 16.049 1012 H VAL 134 H VAL 134 -5.960 -1.161 13.735 1013 HA VAL 134 HA VAL 134 -7.548 1.318 13.507 1014 HB VAL 134 HB VAL 134 -4.781 0.511 12.451 1015 1HG1 VAL 134 1HG2 VAL 134 -6.134 3.285 12.412 1016 2HG1 VAL 134 2HG2 VAL 134 -4.432 2.948 11.991 1017 3HG1 VAL 134 3HG2 VAL 134 -5.744 2.290 10.982 1018 1HG2 VAL 134 2HG1 VAL 134 -5.047 0.675 14.952 1019 2HG2 VAL 134 3HG1 VAL 134 -4.021 1.998 14.334 1020 3HG2 VAL 134 1HG1 VAL 134 -5.718 2.318 14.778 1021 H ALA 135 H ALA 135 -5.778 -0.458 11.022 1022 HA ALA 135 HA ALA 135 -6.822 0.738 8.693 1023 1HB ALA 135 2HB ALA 135 -5.057 -1.038 8.653 1024 2HB ALA 135 3HB ALA 135 -6.275 -2.282 9.048 1025 3HB ALA 135 1HB ALA 135 -6.357 -1.411 7.493 1026 H ASP 136 H ASP 136 -8.220 -1.944 10.497 1027 HA ASP 136 HA ASP 136 -10.500 -2.574 8.853 1028 1HB ASP 136 1HB ASP 136 -10.344 -2.482 11.929 1029 2HB ASP 136 2HB ASP 136 -11.606 -3.305 10.995 1030 H LYS 137 H LYS 137 -10.640 -0.693 11.828 1031 HA LYS 137 HA LYS 137 -13.183 0.505 11.524 1032 1HB LYS 137 1HB LYS 137 -10.675 1.865 12.662 1033 2HB LYS 137 2HB LYS 137 -12.332 2.465 12.845 1034 1HG LYS 137 1HG LYS 137 -12.978 0.163 13.789 1035 2HG LYS 137 2HG LYS 137 -11.279 -0.277 13.811 1036 1HD LYS 137 1HD LYS 137 -12.542 2.092 15.356 1037 2HD LYS 137 2HD LYS 137 -12.232 0.498 16.032 1038 1HE LYS 137 1HE LYS 137 -9.739 0.791 15.656 1039 2HE LYS 137 2HE LYS 137 -10.029 2.404 14.987 1040 1HZ LYS 137 1HZ LYS 137 -10.734 1.552 17.754 1041 2HZ LYS 137 2HZ LYS 137 -9.457 2.510 17.331 1042 3HZ LYS 137 3HZ LYS 137 -11.003 3.056 17.126 1043 H ILE 138 H ILE 138 -10.115 1.603 10.149 1044 HA ILE 138 HA ILE 138 -11.155 3.979 8.749 1045 HB ILE 138 HB ILE 138 -8.849 2.115 7.940 1046 1HG1 ILE 138 1HG1 ILE 138 -9.088 4.681 9.611 1047 2HG1 ILE 138 2HG1 ILE 138 -8.464 3.119 10.150 1048 1HG2 ILE 138 3HG2 ILE 138 -9.641 4.968 7.046 1049 2HG2 ILE 138 1HG2 ILE 138 -8.166 4.098 6.545 1050 3HG2 ILE 138 2HG2 ILE 138 -9.770 3.497 6.045 1051 1HD1 ILE 138 3HD1 ILE 138 -7.175 4.927 7.985 1052 2HD1 ILE 138 1HD1 ILE 138 -6.579 4.718 9.651 1053 3HD1 ILE 138 2HD1 ILE 138 -6.524 3.349 8.505 1054 H SER 139 H SER 139 -10.301 0.749 7.636 1055 HA SER 139 HA SER 139 -11.847 0.861 5.122 1056 1HB SER 139 1HB SER 139 -11.237 -1.547 4.944 1057 2HB SER 139 2HB SER 139 -9.842 -0.569 5.419 1058 HG SER 139 HG SER 139 -10.094 -2.432 6.692 1059 H GLN 140 H GLN 140 -13.173 1.155 7.874 1060 HA GLN 140 HA GLN 140 -15.558 -0.725 7.307 1061 1HB GLN 140 1HB GLN 140 -14.865 0.599 9.993 1062 2HB GLN 140 2HB GLN 140 -16.155 -0.562 9.650 1063 1HG GLN 140 1HG GLN 140 -13.130 -1.032 9.675 1064 2HG GLN 140 2HG GLN 140 -14.373 -1.901 10.583 1065 1HE2 GLN 140 2HE2 GLN 140 -13.238 -3.201 6.925 1066 2HE2 GLN 140 1HE2 GLN 140 -12.311 -2.173 8.117 1067 H VAL 141 H VAL 141 -14.531 2.449 8.442 1068 HA VAL 141 HA VAL 141 -17.070 3.813 8.571 1069 HB VAL 141 HB VAL 141 -15.798 5.891 8.098 1070 1HG1 VAL 141 3HG2 VAL 141 -15.671 4.840 10.375 1071 2HG1 VAL 141 1HG2 VAL 141 -14.265 3.871 9.864 1072 3HG1 VAL 141 2HG2 VAL 141 -14.134 5.647 9.969 1073 1HG2 VAL 141 2HG1 VAL 141 -14.366 5.002 6.234 1074 2HG2 VAL 141 3HG1 VAL 141 -13.356 5.744 7.504 1075 3HG2 VAL 141 1HG1 VAL 141 -13.485 3.968 7.388 1076 HA PRO 142 HA PRO 142 -18.946 3.460 4.588 1077 1HB PRO 142 1HB PRO 142 -19.677 6.288 5.518 1078 2HB PRO 142 2HB PRO 142 -20.745 5.072 4.774 1079 1HG PRO 142 1HG PRO 142 -20.827 5.374 7.467 1080 2HG PRO 142 2HG PRO 142 -20.755 3.721 6.808 1081 1HD PRO 142 1HD PRO 142 -18.466 5.346 8.035 1082 2HD PRO 142 2HD PRO 142 -18.824 3.597 8.213 1083 H THR 143 H THR 143 -19.265 4.974 2.724 1084 HA THR 143 HA THR 143 -17.038 6.935 2.124 1085 HB THR 143 HB THR 143 -16.422 5.547 0.040 1086 HG1 THR 143 HG1 THR 143 -16.735 3.320 0.298 1087 1HG2 THR 143 2HG2 THR 143 -14.886 5.813 1.957 1088 2HG2 THR 143 3HG2 THR 143 -15.634 4.409 2.782 1089 3HG2 THR 143 1HG2 THR 143 -14.744 4.183 1.241 1090 H HIS 144 H HIS 144 -16.920 6.219 -0.437 1091 HA HIS 144 HA HIS 144 -19.353 6.083 -1.951 1092 1HB HIS 144 1HB HIS 144 -19.895 8.369 -2.586 1093 2HB HIS 144 2HB HIS 144 -19.959 8.247 -0.830 1094 HD2 HIS 144 HD2 HIS 144 -16.347 8.423 -2.096 1095 HE1 HIS 144 HE1 HIS 144 -17.373 12.358 -1.267 1096 HE2 HIS 144 HE2 HIS 144 -15.367 10.863 -1.838 1097 H ASP 145 H ASP 145 -19.211 6.758 -4.142 1098 HA ASP 145 HA ASP 145 -16.696 6.179 -5.538 1099 1HB ASP 145 1HB ASP 145 -19.049 7.970 -6.406 1100 2HB ASP 145 2HB ASP 145 -17.776 7.360 -7.478 1101 H VAL 146 H VAL 146 -16.793 8.605 -7.183 1102 HA VAL 146 HA VAL 146 -16.356 10.957 -5.485 1103 HB VAL 146 HB VAL 146 -13.772 10.401 -6.917 1104 1HG1 VAL 146 3HG2 VAL 146 -14.340 12.549 -5.717 1105 2HG1 VAL 146 1HG2 VAL 146 -14.588 11.636 -4.207 1106 3HG1 VAL 146 2HG2 VAL 146 -12.961 11.725 -4.927 1107 1HG2 VAL 146 2HG1 VAL 146 -14.071 8.220 -5.727 1108 2HG2 VAL 146 3HG1 VAL 146 -12.767 9.198 -5.007 1109 3HG2 VAL 146 1HG1 VAL 146 -14.352 9.093 -4.193 1110 H GLY 147 H GLY 147 -14.415 12.062 -7.388 1111 1HA GLY 147 1HA GLY 147 -16.234 13.064 -9.561 1112 2HA GLY 147 2HA GLY 147 -14.485 13.351 -9.445 1113 HA PRO 148 HA PRO 148 -13.899 10.159 -12.555 1114 1HB PRO 148 1HB PRO 148 -11.154 10.145 -12.379 1115 2HB PRO 148 2HB PRO 148 -12.032 11.557 -13.017 1116 1HG PRO 148 1HG PRO 148 -10.987 11.152 -10.160 1117 2HG PRO 148 2HG PRO 148 -10.712 12.556 -11.221 1118 1HD PRO 148 1HD PRO 148 -12.733 12.540 -9.308 1119 2HD PRO 148 2HD PRO 148 -12.969 13.370 -10.880 1120 OH TYR 149 OH TYR 149 -6.193 9.452 -11.396 1121 H TYR 149 H TYR 149 -11.731 10.084 -9.763 1122 HA TYR 149 HA TYR 149 -11.532 7.151 -9.655 1123 1HB TYR 149 1HB TYR 149 -10.834 9.255 -7.521 1124 2HB TYR 149 2HB TYR 149 -10.352 7.558 -7.478 1125 HD1 TYR 149 HD1 TYR 149 -9.154 6.659 -9.586 1126 HD2 TYR 149 HD2 TYR 149 -9.452 10.766 -8.657 1127 HE1 TYR 149 HE1 TYR 149 -7.229 7.118 -10.995 1128 HE2 TYR 149 HE2 TYR 149 -7.527 11.224 -10.067 1129 HH TYR 149 HH TYR 149 -6.008 10.393 -11.375 1130 H GLN 150 H GLN 150 -12.888 5.820 -9.029 1131 HA GLN 150 HA GLN 150 -15.173 6.320 -7.145 1132 1HB GLN 150 1HB GLN 150 -13.911 3.681 -8.106 1133 2HB GLN 150 2HB GLN 150 -15.455 3.849 -7.262 1134 1HG GLN 150 1HG GLN 150 -14.764 5.084 -10.004 1135 2HG GLN 150 2HG GLN 150 -15.772 3.657 -9.747 1136 1HE2 GLN 150 2HE2 GLN 150 -18.676 5.647 -9.309 1137 2HE2 GLN 150 1HE2 GLN 150 -17.881 4.058 -9.767 1138 H ASN 151 H ASN 151 -14.883 3.986 -5.619 1139 HA ASN 151 HA ASN 151 -14.155 3.599 -3.321 1140 1HB ASN 151 1HB ASN 151 -11.594 3.341 -5.013 1141 2HB ASN 151 2HB ASN 151 -11.842 2.624 -3.413 1142 1HD2 ASN 151 1HD2 ASN 151 -14.793 0.763 -5.105 1143 2HD2 ASN 151 2HD2 ASN 151 -14.758 2.275 -4.067 1144 H VAL 152 H VAL 152 -14.527 5.493 -2.388 1145 HA VAL 152 HA VAL 152 -12.144 6.718 -1.103 1146 HB VAL 152 HB VAL 152 -13.855 8.443 -2.988 1147 1HG1 VAL 152 3HG2 VAL 152 -13.413 9.594 -0.801 1148 2HG1 VAL 152 1HG2 VAL 152 -11.672 9.241 -0.950 1149 3HG1 VAL 152 2HG2 VAL 152 -12.461 10.346 -2.108 1150 1HG2 VAL 152 1HG1 VAL 152 -10.828 7.779 -2.905 1151 2HG2 VAL 152 2HG1 VAL 152 -11.989 7.157 -4.104 1152 3HG2 VAL 152 3HG1 VAL 152 -11.602 8.897 -4.058 1153 HA PRO 153 HA PRO 153 -15.317 6.450 1.942 1154 1HB PRO 153 1HB PRO 153 -13.642 7.231 4.018 1155 2HB PRO 153 2HB PRO 153 -13.525 5.644 3.226 1156 1HG PRO 153 1HG PRO 153 -11.865 8.150 2.619 1157 2HG PRO 153 2HG PRO 153 -11.263 6.503 2.937 1158 1HD PRO 153 1HD PRO 153 -11.571 7.421 0.351 1159 2HD PRO 153 2HD PRO 153 -11.988 5.720 0.741 1160 H SER 154 H SER 154 -16.792 7.879 1.762 1161 HA SER 154 HA SER 154 -16.715 10.669 1.278 1162 1HB SER 154 1HB SER 154 -18.919 10.821 2.468 1163 2HB SER 154 2HB SER 154 -18.840 9.427 1.375 1164 HG SER 154 HG SER 154 -19.666 8.895 3.419 1165 H LYS 155 H LYS 155 -16.775 9.044 4.413 1166 HA LYS 155 HA LYS 155 -15.923 11.406 6.027 1167 1HB LYS 155 1HB LYS 155 -15.676 8.403 6.625 1168 2HB LYS 155 2HB LYS 155 -15.513 9.724 7.796 1169 1HG LYS 155 1HG LYS 155 -17.884 10.473 7.274 1170 2HG LYS 155 2HG LYS 155 -18.001 9.214 6.059 1171 1HD LYS 155 1HD LYS 155 -19.207 8.361 7.870 1172 2HD LYS 155 2HD LYS 155 -17.726 7.436 7.908 1173 1HE LYS 155 1HE LYS 155 -18.292 9.902 9.718 1174 2HE LYS 155 2HE LYS 155 -18.708 8.251 10.163 1175 1HZ LYS 155 2HZ LYS 155 -16.358 7.649 10.050 1176 2HZ LYS 155 3HZ LYS 155 -15.939 9.192 9.633 1177 3HZ LYS 155 1HZ LYS 155 -16.600 8.889 11.116 1178 HA PRO 156 HA PRO 156 -11.811 11.495 4.528 1179 1HB PRO 156 1HB PRO 156 -10.866 13.366 6.346 1180 2HB PRO 156 2HB PRO 156 -12.055 13.745 5.077 1181 1HG PRO 156 1HG PRO 156 -12.627 13.061 8.010 1182 2HG PRO 156 2HG PRO 156 -13.237 14.455 7.084 1183 1HD PRO 156 1HD PRO 156 -14.771 12.180 7.394 1184 2HD PRO 156 2HD PRO 156 -14.785 13.054 5.827 1185 H VAL 157 H VAL 157 -9.719 11.166 5.035 1186 HA VAL 157 HA VAL 157 -8.845 10.022 7.685 1187 HB VAL 157 HB VAL 157 -8.815 8.347 5.102 1188 1HG1 VAL 157 3HG2 VAL 157 -6.595 8.260 6.268 1189 2HG1 VAL 157 1HG2 VAL 157 -7.401 7.854 7.804 1190 3HG1 VAL 157 2HG2 VAL 157 -7.454 6.707 6.437 1191 1HG2 VAL 157 2HG1 VAL 157 -10.932 8.179 6.461 1192 2HG2 VAL 157 3HG1 VAL 157 -9.997 6.662 6.545 1193 3HG2 VAL 157 1HG1 VAL 157 -9.969 7.798 7.917 1194 H VAL 158 H VAL 158 -7.581 11.666 7.843 1195 HA VAL 158 HA VAL 158 -5.452 12.284 5.750 1196 HB VAL 158 HB VAL 158 -6.060 13.528 8.490 1197 1HG1 VAL 158 3HG2 VAL 158 -3.626 13.663 7.877 1198 2HG1 VAL 158 1HG2 VAL 158 -4.051 14.326 6.280 1199 3HG1 VAL 158 2HG2 VAL 158 -4.392 15.268 7.756 1200 1HG2 VAL 158 2HG1 VAL 158 -7.803 13.957 6.723 1201 2HG2 VAL 158 3HG1 VAL 158 -6.877 15.443 7.070 1202 3HG2 VAL 158 1HG1 VAL 158 -6.535 14.501 5.594 1203 H ILE 159 H ILE 159 -3.732 11.250 5.697 1204 HA ILE 159 HA ILE 159 -2.735 9.430 7.837 1205 HB ILE 159 HB ILE 159 -1.544 10.414 5.198 1206 1HG1 ILE 159 1HG1 ILE 159 -2.757 7.833 6.355 1207 2HG1 ILE 159 2HG1 ILE 159 -3.429 8.830 5.060 1208 1HG2 ILE 159 3HG2 ILE 159 -0.328 8.449 7.251 1209 2HG2 ILE 159 1HG2 ILE 159 0.292 8.755 5.605 1210 3HG2 ILE 159 2HG2 ILE 159 0.332 10.052 6.824 1211 1HD1 ILE 159 3HD1 ILE 159 -0.756 7.273 4.923 1212 2HD1 ILE 159 1HD1 ILE 159 -2.283 6.784 4.139 1213 3HD1 ILE 159 2HD1 ILE 159 -1.434 8.260 3.598 1214 H LEU 160 H LEU 160 -1.635 9.771 9.372 1215 HA LEU 160 HA LEU 160 -0.907 12.576 10.217 1216 1HB LEU 160 1HB LEU 160 -0.587 9.894 11.693 1217 2HB LEU 160 2HB LEU 160 -0.336 11.500 12.394 1218 HG LEU 160 HG LEU 160 -2.958 10.474 11.153 1219 1HD1 LEU 160 2HD1 LEU 160 -2.440 9.463 13.397 1220 2HD1 LEU 160 3HD1 LEU 160 -2.207 11.091 14.088 1221 3HD1 LEU 160 1HD1 LEU 160 -3.818 10.588 13.513 1222 1HD2 LEU 160 3HD2 LEU 160 -2.632 12.938 10.785 1223 2HD2 LEU 160 1HD2 LEU 160 -3.931 12.642 11.969 1224 3HD2 LEU 160 2HD2 LEU 160 -2.321 13.169 12.526 1225 H SER 161 H SER 161 0.713 9.453 9.907 1226 HA SER 161 HA SER 161 3.291 10.742 8.984 1227 1HB SER 161 1HB SER 161 3.118 9.220 11.658 1228 2HB SER 161 2HB SER 161 4.610 9.797 10.892 1229 HG SER 161 HG SER 161 3.790 11.242 12.445 1230 H ALA 162 H ALA 162 5.052 9.138 9.031 1231 HA ALA 162 HA ALA 162 4.471 6.274 8.541 1232 1HB ALA 162 3HB ALA 162 4.838 8.088 6.055 1233 2HB ALA 162 1HB ALA 162 4.772 6.306 6.043 1234 3HB ALA 162 2HB ALA 162 3.333 7.246 6.507 1235 H LYS 163 H LYS 163 6.151 5.361 9.103 1236 HA LYS 163 HA LYS 163 8.872 5.936 8.069 1237 1HB LYS 163 1HB LYS 163 9.857 6.711 10.225 1238 2HB LYS 163 2HB LYS 163 8.661 7.858 9.598 1239 1HG LYS 163 1HG LYS 163 6.893 6.740 11.060 1240 2HG LYS 163 2HG LYS 163 8.132 5.720 11.772 1241 1HD LYS 163 1HD LYS 163 8.072 8.813 11.911 1242 2HD LYS 163 2HD LYS 163 7.447 7.739 13.155 1243 1HE LYS 163 1HE LYS 163 9.767 6.771 13.524 1244 2HE LYS 163 2HE LYS 163 10.417 7.863 12.293 1245 1HZ LYS 163 1HZ LYS 163 9.066 8.732 14.802 1246 2HZ LYS 163 2HZ LYS 163 10.692 8.773 14.511 1247 3HZ LYS 163 3HZ LYS 163 9.673 9.748 13.651 1248 H VAL 164 H VAL 164 10.003 4.259 8.133 1249 HA VAL 164 HA VAL 164 9.065 1.718 9.295 1250 HB VAL 164 HB VAL 164 11.248 0.866 8.482 1251 1HG1 VAL 164 3HG2 VAL 164 9.335 1.142 6.888 1252 2HG1 VAL 164 1HG2 VAL 164 9.857 2.808 6.532 1253 3HG1 VAL 164 2HG2 VAL 164 10.888 1.431 6.061 1254 1HG2 VAL 164 2HG1 VAL 164 12.661 2.845 9.108 1255 2HG2 VAL 164 3HG1 VAL 164 12.871 2.441 7.383 1256 3HG2 VAL 164 1HG1 VAL 164 11.855 3.828 7.859 1257 H LEU 165 H LEU 165 9.655 0.660 10.966 1258 HA LEU 165 HA LEU 165 10.642 1.964 13.377 1259 1HB LEU 165 1HB LEU 165 9.319 -0.145 13.445 1260 2HB LEU 165 2HB LEU 165 10.640 -1.033 12.669 1261 HG LEU 165 HG LEU 165 12.171 -0.461 14.561 1262 1HD1 LEU 165 2HD1 LEU 165 11.127 1.731 15.206 1263 2HD1 LEU 165 3HD1 LEU 165 9.679 0.879 15.805 1264 3HD1 LEU 165 1HD1 LEU 165 11.250 0.650 16.617 1265 1HD2 LEU 165 3HD2 LEU 165 10.820 -2.577 14.678 1266 2HD2 LEU 165 1HD2 LEU 165 11.069 -1.895 16.306 1267 3HD2 LEU 165 2HD2 LEU 165 9.496 -1.701 15.489 1268 HA PRO 166 HA PRO 166 14.919 2.647 12.520 1269 1HB PRO 166 1HB PRO 166 14.799 2.333 15.565 1270 2HB PRO 166 2HB PRO 166 15.656 3.580 14.626 1271 1HG PRO 166 1HG PRO 166 13.267 4.219 15.742 1272 2HG PRO 166 2HG PRO 166 13.565 4.697 14.052 1273 1HD PRO 166 1HD PRO 166 11.897 2.332 15.060 1274 2HD PRO 166 2HD PRO 166 11.556 3.447 13.697 Start of MODEL 9 Raw file had 1274 H/Q atoms Start of MODEL 9 1 1H ALA 1 2H ALA 1 12.361 -16.737 8.007 2 2H ALA 1 3H ALA 1 12.143 -15.118 7.765 3 3H ALA 1 1H ALA 1 12.325 -16.128 6.471 4 HA ALA 1 HA ALA 1 14.609 -16.653 7.104 5 1HB ALA 1 1HB ALA 1 14.197 -14.730 5.532 6 2HB ALA 1 2HB ALA 1 14.009 -13.621 6.917 7 3HB ALA 1 3HB ALA 1 15.586 -14.387 6.594 8 H LYS 2 H LYS 2 13.408 -13.825 8.847 9 HA LYS 2 HA LYS 2 13.493 -14.302 11.498 10 1HB LYS 2 1HB LYS 2 15.516 -15.791 11.093 11 2HB LYS 2 2HB LYS 2 16.446 -14.368 10.629 12 1HG LYS 2 1HG LYS 2 16.888 -14.884 13.017 13 2HG LYS 2 2HG LYS 2 16.101 -13.325 12.837 14 1HD LYS 2 1HD LYS 2 15.035 -14.283 14.686 15 2HD LYS 2 2HD LYS 2 13.841 -14.429 13.419 16 1HE LYS 2 1HE LYS 2 15.730 -16.735 14.311 17 2HE LYS 2 2HE LYS 2 14.157 -16.433 15.037 18 1HZ LYS 2 3HZ LYS 2 13.110 -16.818 12.880 19 2HZ LYS 2 1HZ LYS 2 14.574 -17.104 12.171 20 3HZ LYS 2 2HZ LYS 2 14.009 -18.125 13.340 21 H GLY 3 H GLY 3 12.942 -12.262 9.728 22 1HA GLY 3 1HA GLY 3 13.245 -9.845 11.137 23 2HA GLY 3 2HA GLY 3 14.767 -9.907 10.227 24 H ASP 4 H ASP 4 11.970 -8.528 10.216 25 HA ASP 4 HA ASP 4 11.994 -7.849 7.313 26 1HB ASP 4 1HB ASP 4 9.611 -9.436 8.460 27 2HB ASP 4 2HB ASP 4 9.613 -8.598 6.900 28 HA PRO 5 HA PRO 5 10.988 -4.206 9.751 29 1HB PRO 5 1HB PRO 5 11.021 -3.386 6.801 30 2HB PRO 5 2HB PRO 5 11.705 -2.505 8.191 31 1HG PRO 5 1HG PRO 5 13.388 -3.947 6.628 32 2HG PRO 5 2HG PRO 5 13.542 -4.097 8.396 33 1HD PRO 5 1HD PRO 5 12.194 -6.058 6.465 34 2HD PRO 5 2HD PRO 5 13.229 -6.414 7.886 35 H HIS 6 H HIS 6 9.455 -2.402 9.206 36 HA HIS 6 HA HIS 6 6.831 -3.218 7.919 37 1HB HIS 6 1HB HIS 6 7.031 -2.601 10.934 38 2HB HIS 6 2HB HIS 6 5.563 -2.992 10.033 39 HD2 HIS 6 HD2 HIS 6 8.191 -5.179 8.615 40 HE1 HIS 6 HE1 HIS 6 6.697 -7.408 11.799 41 HE2 HIS 6 HE2 HIS 6 8.180 -7.609 9.698 42 H VAL 7 H VAL 7 6.252 -1.570 6.857 43 HA VAL 7 HA VAL 7 7.187 1.204 7.382 44 HB VAL 7 HB VAL 7 5.700 1.779 5.502 45 1HG1 VAL 7 3HG2 VAL 7 7.931 0.758 4.983 46 2HG1 VAL 7 1HG2 VAL 7 7.202 -0.871 5.014 47 3HG1 VAL 7 2HG2 VAL 7 6.723 0.299 3.755 48 1HG2 VAL 7 2HG1 VAL 7 3.760 0.332 6.108 49 2HG2 VAL 7 3HG1 VAL 7 4.256 0.035 4.422 50 3HG2 VAL 7 1HG1 VAL 7 4.699 -1.128 5.704 51 H LEU 8 H LEU 8 6.518 2.162 9.098 52 HA LEU 8 HA LEU 8 3.771 1.771 10.275 53 1HB LEU 8 1HB LEU 8 6.059 3.660 11.066 54 2HB LEU 8 2HB LEU 8 4.471 3.621 11.845 55 HG LEU 8 HG LEU 8 4.759 1.085 12.134 56 1HD1 LEU 8 2HD1 LEU 8 6.624 0.766 10.495 57 2HD1 LEU 8 3HD1 LEU 8 7.695 1.787 11.490 58 3HD1 LEU 8 1HD1 LEU 8 7.114 0.220 12.120 59 1HD2 LEU 8 3HD2 LEU 8 4.968 2.710 14.007 60 2HD2 LEU 8 1HD2 LEU 8 6.130 1.373 14.204 61 3HD2 LEU 8 2HD2 LEU 8 6.691 2.968 13.622 62 H LEU 9 H LEU 9 2.168 2.811 10.017 63 HA LEU 9 HA LEU 9 2.095 5.638 8.905 64 1HB LEU 9 1HB LEU 9 0.598 3.306 7.560 65 2HB LEU 9 2HB LEU 9 0.064 4.988 7.464 66 HG LEU 9 HG LEU 9 2.411 5.637 6.704 67 1HD1 LEU 9 2HD1 LEU 9 3.607 3.539 7.413 68 2HD1 LEU 9 3HD1 LEU 9 2.651 2.588 6.245 69 3HD1 LEU 9 1HD1 LEU 9 3.805 3.816 5.663 70 1HD2 LEU 9 3HD2 LEU 9 0.461 5.474 5.121 71 2HD2 LEU 9 1HD2 LEU 9 1.961 4.943 4.321 72 3HD2 LEU 9 2HD2 LEU 9 0.779 3.735 4.888 73 H THR 10 H THR 10 1.608 6.368 10.664 74 HA THR 10 HA THR 10 -0.651 5.291 12.398 75 HB THR 10 HB THR 10 1.139 7.779 12.690 76 HG1 THR 10 HG1 THR 10 2.208 5.778 12.819 77 1HG2 THR 10 3HG2 THR 10 -0.768 6.371 14.676 78 2HG2 THR 10 1HG2 THR 10 0.289 7.757 15.060 79 3HG2 THR 10 2HG2 THR 10 -1.059 7.955 13.909 80 H THR 11 H THR 11 -2.203 5.554 10.810 81 HA THR 11 HA THR 11 -3.033 8.266 9.816 82 HB THR 11 HB THR 11 -5.164 7.070 9.193 83 HG1 THR 11 HG1 THR 11 -5.078 4.807 9.388 84 1HG2 THR 11 2HG2 THR 11 -3.216 7.254 7.634 85 2HG2 THR 11 3HG2 THR 11 -2.516 5.758 8.311 86 3HG2 THR 11 1HG2 THR 11 -4.060 5.698 7.410 87 H SER 12 H SER 12 -5.157 8.988 10.200 88 HA SER 12 HA SER 12 -5.654 9.995 12.805 89 1HB SER 12 1HB SER 12 -8.035 10.295 12.128 90 2HB SER 12 2HB SER 12 -6.934 10.732 10.808 91 HG SER 12 HG SER 12 -8.642 9.397 10.130 92 H ALA 13 H ALA 13 -6.802 6.982 11.393 93 HA ALA 13 HA ALA 13 -8.396 5.979 13.579 94 1HB ALA 13 2HB ALA 13 -8.317 4.877 11.332 95 2HB ALA 13 3HB ALA 13 -6.637 4.363 11.631 96 3HB ALA 13 1HB ALA 13 -7.964 3.705 12.625 97 H GLY 14 H GLY 14 -5.168 5.193 12.764 98 1HA GLY 14 1HA GLY 14 -3.925 5.497 15.399 99 2HA GLY 14 2HA GLY 14 -4.461 3.815 15.292 100 H ASN 15 H ASN 15 -2.073 4.033 15.764 101 HA ASN 15 HA ASN 15 -0.205 4.266 13.431 102 1HB ASN 15 1HB ASN 15 0.517 4.844 15.738 103 2HB ASN 15 2HB ASN 15 0.194 3.194 16.287 104 1HD2 ASN 15 1HD2 ASN 15 3.048 2.950 13.389 105 2HD2 ASN 15 2HD2 ASN 15 1.299 3.401 13.064 106 H ILE 16 H ILE 16 -1.057 2.907 11.984 107 HA ILE 16 HA ILE 16 -1.107 -0.087 12.430 108 HB ILE 16 HB ILE 16 -1.456 -0.164 9.947 109 1HG1 ILE 16 1HG1 ILE 16 -1.360 2.892 10.291 110 2HG1 ILE 16 2HG1 ILE 16 -0.300 1.917 9.264 111 1HG2 ILE 16 2HG2 ILE 16 -3.305 -0.140 11.594 112 2HG2 ILE 16 3HG2 ILE 16 -3.319 1.643 11.578 113 3HG2 ILE 16 1HG2 ILE 16 -3.767 0.732 10.108 114 1HD1 ILE 16 2HD1 ILE 16 -2.320 1.197 7.886 115 2HD1 ILE 16 3HD1 ILE 16 -3.370 2.190 8.931 116 3HD1 ILE 16 1HD1 ILE 16 -2.143 2.975 7.902 117 H GLU 17 H GLU 17 0.039 -1.322 10.736 118 HA GLU 17 HA GLU 17 2.973 -0.552 10.385 119 1HB GLU 17 1HB GLU 17 2.105 -2.889 12.171 120 2HB GLU 17 2HB GLU 17 3.740 -2.259 11.957 121 1HG GLU 17 1HG GLU 17 1.351 -0.784 13.261 122 2HG GLU 17 2HG GLU 17 2.702 -1.505 14.132 123 H LEU 18 H LEU 18 2.943 -1.104 8.319 124 HA LEU 18 HA LEU 18 2.279 -3.942 7.425 125 1HB LEU 18 1HB LEU 18 3.616 -1.637 5.886 126 2HB LEU 18 2HB LEU 18 3.356 -3.268 5.267 127 HG LEU 18 HG LEU 18 1.508 -2.079 4.432 128 1HD1 LEU 18 2HD1 LEU 18 0.843 -4.243 5.528 129 2HD1 LEU 18 3HD1 LEU 18 0.543 -3.385 7.062 130 3HD1 LEU 18 1HD1 LEU 18 -0.473 -3.047 5.637 131 1HD2 LEU 18 3HD2 LEU 18 1.779 -0.006 5.779 132 2HD2 LEU 18 1HD2 LEU 18 0.082 -0.546 5.778 133 3HD2 LEU 18 2HD2 LEU 18 1.103 -0.826 7.217 134 H GLU 19 H GLU 19 3.835 -5.147 6.395 135 HA GLU 19 HA GLU 19 6.762 -4.794 7.265 136 1HB GLU 19 1HB GLU 19 5.682 -6.503 8.740 137 2HB GLU 19 2HB GLU 19 5.120 -7.388 7.312 138 1HG GLU 19 1HG GLU 19 7.523 -7.652 6.535 139 2HG GLU 19 2HG GLU 19 8.081 -6.766 7.950 140 H LEU 20 H LEU 20 8.048 -4.897 5.745 141 HA LEU 20 HA LEU 20 7.081 -5.678 2.921 142 1HB LEU 20 1HB LEU 20 9.013 -3.468 3.847 143 2HB LEU 20 2HB LEU 20 8.710 -3.915 2.168 144 HG LEU 20 HG LEU 20 6.245 -3.448 2.492 145 1HD1 LEU 20 3HD1 LEU 20 7.168 -2.264 5.195 146 2HD1 LEU 20 1HD1 LEU 20 5.548 -2.059 4.476 147 3HD1 LEU 20 2HD1 LEU 20 6.097 -3.674 4.985 148 1HD2 LEU 20 3HD2 LEU 20 7.786 -1.749 1.473 149 2HD2 LEU 20 1HD2 LEU 20 6.510 -0.953 2.428 150 3HD2 LEU 20 2HD2 LEU 20 8.158 -1.097 3.091 151 H ASP 21 H ASP 21 7.892 -7.340 2.204 152 HA ASP 21 HA ASP 21 10.364 -8.661 3.182 153 1HB ASP 21 1HB ASP 21 8.423 -9.897 2.189 154 2HB ASP 21 2HB ASP 21 8.711 -9.112 0.627 155 H LYS 22 H LYS 22 12.133 -7.608 2.951 156 HA LYS 22 HA LYS 22 12.899 -5.888 0.676 157 1HB LYS 22 1HB LYS 22 13.895 -5.669 2.940 158 2HB LYS 22 2HB LYS 22 14.585 -7.298 2.820 159 1HG LYS 22 1HG LYS 22 15.796 -6.573 0.698 160 2HG LYS 22 2HG LYS 22 15.232 -4.929 0.938 161 1HD LYS 22 1HD LYS 22 17.048 -6.482 2.924 162 2HD LYS 22 2HD LYS 22 17.620 -5.435 1.650 163 1HE LYS 22 1HE LYS 22 17.772 -4.068 3.550 164 2HE LYS 22 2HE LYS 22 16.343 -3.460 2.722 165 1HZ LYS 22 3HZ LYS 22 16.341 -5.314 5.065 166 2HZ LYS 22 1HZ LYS 22 15.978 -3.703 5.101 167 3HZ LYS 22 2HZ LYS 22 14.982 -4.756 4.309 168 H GLN 23 H GLN 23 13.640 -9.207 1.633 169 HA GLN 23 HA GLN 23 15.850 -9.764 -0.064 170 1HB GLN 23 1HB GLN 23 14.979 -11.352 1.657 171 2HB GLN 23 2HB GLN 23 13.550 -11.678 0.665 172 1HG GLN 23 1HG GLN 23 15.049 -12.485 -1.211 173 2HG GLN 23 2HG GLN 23 16.469 -12.184 -0.203 174 1HE2 GLN 23 2HE2 GLN 23 14.936 -15.788 0.092 175 2HE2 GLN 23 1HE2 GLN 23 14.946 -14.643 -1.341 176 H LYS 24 H LYS 24 12.573 -10.832 -0.756 177 HA LYS 24 HA LYS 24 13.155 -11.343 -3.621 178 1HB LYS 24 1HB LYS 24 10.576 -11.301 -1.979 179 2HB LYS 24 2HB LYS 24 10.612 -11.593 -3.724 180 1HG LYS 24 1HG LYS 24 12.324 -13.438 -3.369 181 2HG LYS 24 2HG LYS 24 12.237 -13.178 -1.628 182 1HD LYS 24 1HD LYS 24 9.777 -13.834 -1.649 183 2HD LYS 24 2HD LYS 24 9.847 -14.018 -3.395 184 1HE LYS 24 1HE LYS 24 9.970 -16.237 -2.492 185 2HE LYS 24 2HE LYS 24 11.570 -15.884 -3.139 186 1HZ LYS 24 1HZ LYS 24 10.794 -15.728 -0.259 187 2HZ LYS 24 2HZ LYS 24 11.694 -16.923 -0.959 188 3HZ LYS 24 3HZ LYS 24 12.301 -15.391 -0.845 189 H ALA 25 H ALA 25 13.021 -8.493 -2.280 190 HA ALA 25 HA ALA 25 12.441 -7.165 -4.900 191 1HB ALA 25 2HB ALA 25 10.109 -7.363 -3.974 192 2HB ALA 25 3HB ALA 25 10.614 -6.515 -2.488 193 3HB ALA 25 1HB ALA 25 10.622 -5.659 -4.052 194 HA PRO 26 HA PRO 26 15.795 -5.452 -2.133 195 1HB PRO 26 1HB PRO 26 17.079 -5.636 -4.892 196 2HB PRO 26 2HB PRO 26 17.804 -6.026 -3.314 197 1HG PRO 26 1HG PRO 26 17.002 -8.061 -4.930 198 2HG PRO 26 2HG PRO 26 16.602 -8.139 -3.195 199 1HD PRO 26 1HD PRO 26 14.755 -7.287 -5.499 200 2HD PRO 26 2HD PRO 26 14.392 -8.362 -4.109 201 H VAL 27 H VAL 27 15.598 -4.731 -5.580 202 HA VAL 27 HA VAL 27 16.302 -1.947 -5.465 203 HB VAL 27 HB VAL 27 14.428 -3.335 -7.468 204 1HG1 VAL 27 3HG2 VAL 27 14.319 -0.827 -7.565 205 2HG1 VAL 27 1HG2 VAL 27 16.095 -0.742 -7.678 206 3HG1 VAL 27 2HG2 VAL 27 15.151 -1.477 -9.001 207 1HG2 VAL 27 2HG1 VAL 27 16.657 -4.473 -7.226 208 2HG2 VAL 27 3HG1 VAL 27 16.541 -3.643 -8.800 209 3HG2 VAL 27 1HG1 VAL 27 17.491 -2.917 -7.476 210 H SER 28 H SER 28 13.076 -3.299 -5.972 211 HA SER 28 HA SER 28 11.478 -0.992 -5.894 212 1HB SER 28 1HB SER 28 10.598 -3.322 -6.197 213 2HB SER 28 2HB SER 28 10.856 -3.655 -4.473 214 HG SER 28 HG SER 28 8.733 -2.991 -4.940 215 H VAL 29 H VAL 29 12.278 -2.976 -3.070 216 HA VAL 29 HA VAL 29 11.146 -1.312 -1.024 217 HB VAL 29 HB VAL 29 12.752 -2.451 0.494 218 1HG1 VAL 29 3HG2 VAL 29 10.653 -3.589 -0.271 219 2HG1 VAL 29 1HG2 VAL 29 11.513 -4.255 -1.682 220 3HG1 VAL 29 2HG2 VAL 29 11.960 -4.779 -0.036 221 1HG2 VAL 29 2HG1 VAL 29 14.776 -2.418 -0.993 222 2HG2 VAL 29 3HG1 VAL 29 14.411 -4.082 -0.466 223 3HG2 VAL 29 1HG1 VAL 29 13.982 -3.553 -2.115 224 H GLN 30 H GLN 30 14.411 -1.320 -2.396 225 HA GLN 30 HA GLN 30 15.654 0.712 -0.818 226 1HB GLN 30 1HB GLN 30 16.761 -0.644 -2.647 227 2HB GLN 30 2HB GLN 30 15.963 0.354 -3.866 228 1HG GLN 30 1HG GLN 30 17.869 1.403 -1.671 229 2HG GLN 30 2HG GLN 30 18.341 1.077 -3.339 230 1HE2 GLN 30 2HE2 GLN 30 16.597 4.628 -2.465 231 2HE2 GLN 30 1HE2 GLN 30 17.078 3.375 -1.213 232 H ASN 31 H ASN 31 14.325 1.298 -4.036 233 HA ASN 31 HA ASN 31 14.046 4.132 -3.954 234 1HB ASN 31 1HB ASN 31 12.042 2.139 -5.190 235 2HB ASN 31 2HB ASN 31 12.159 3.857 -5.586 236 1HD2 ASN 31 1HD2 ASN 31 15.072 1.250 -6.947 237 2HD2 ASN 31 2HD2 ASN 31 13.935 0.800 -5.580 238 H PHE 32 H PHE 32 11.685 1.686 -3.007 239 HA PHE 32 HA PHE 32 9.532 3.229 -2.009 240 1HB PHE 32 1HB PHE 32 9.668 0.704 -1.984 241 2HB PHE 32 2HB PHE 32 10.784 0.777 -0.618 242 HD1 PHE 32 HD1 PHE 32 7.410 1.917 -1.702 243 HD2 PHE 32 HD2 PHE 32 9.884 0.896 1.560 244 HE1 PHE 32 HE1 PHE 32 5.497 2.041 -0.208 245 HE2 PHE 32 HE2 PHE 32 7.968 1.024 3.049 246 HZ PHE 32 HZ PHE 32 5.774 1.594 2.167 247 H VAL 33 H VAL 33 12.286 2.099 -0.104 248 HA VAL 33 HA VAL 33 11.932 3.661 2.281 249 HB VAL 33 HB VAL 33 14.579 2.988 0.863 250 1HG1 VAL 33 3HG2 VAL 33 14.810 4.741 2.649 251 2HG1 VAL 33 1HG2 VAL 33 13.948 3.694 3.806 252 3HG1 VAL 33 2HG2 VAL 33 15.544 3.205 3.178 253 1HG2 VAL 33 2HG1 VAL 33 13.129 0.976 1.282 254 2HG2 VAL 33 3HG1 VAL 33 14.546 0.967 2.365 255 3HG2 VAL 33 1HG1 VAL 33 12.946 1.450 2.991 256 H ASP 34 H ASP 34 13.304 4.577 -0.820 257 HA ASP 34 HA ASP 34 14.346 7.192 -0.325 258 1HB ASP 34 1HB ASP 34 12.450 6.304 -2.590 259 2HB ASP 34 2HB ASP 34 13.398 7.792 -2.606 260 OH TYR 35 OH TYR 35 9.243 7.759 -6.455 261 H TYR 35 H TYR 35 11.046 6.409 -1.240 262 HA TYR 35 HA TYR 35 9.841 8.989 -0.491 263 1HB TYR 35 1HB TYR 35 8.515 6.212 -0.652 264 2HB TYR 35 2HB TYR 35 7.670 7.762 -0.631 265 HD1 TYR 35 HD1 TYR 35 8.515 9.495 -2.418 266 HD2 TYR 35 HD2 TYR 35 9.079 5.323 -2.729 267 HE1 TYR 35 HE1 TYR 35 8.792 9.710 -4.824 268 HE2 TYR 35 HE2 TYR 35 9.356 5.543 -5.135 269 HH TYR 35 HH TYR 35 9.158 8.684 -6.697 270 H VAL 36 H VAL 36 9.651 5.796 0.996 271 HA VAL 36 HA VAL 36 8.394 6.265 3.458 272 HB VAL 36 HB VAL 36 11.020 4.721 3.096 273 1HG1 VAL 36 3HG2 VAL 36 10.376 5.081 5.495 274 2HG1 VAL 36 1HG2 VAL 36 8.748 4.433 5.172 275 3HG1 VAL 36 2HG2 VAL 36 10.173 3.366 5.048 276 1HG2 VAL 36 2HG1 VAL 36 9.261 4.043 1.426 277 2HG2 VAL 36 3HG1 VAL 36 9.510 2.750 2.628 278 3HG2 VAL 36 1HG1 VAL 36 8.082 3.813 2.743 279 H ASN 37 H ASN 37 11.815 6.696 2.773 280 HA ASN 37 HA ASN 37 12.943 7.506 5.162 281 1HB ASN 37 1HB ASN 37 14.149 7.541 2.963 282 2HB ASN 37 2HB ASN 37 13.312 9.036 2.513 283 1HD2 ASN 37 1HD2 ASN 37 15.501 9.657 5.929 284 2HD2 ASN 37 2HD2 ASN 37 14.095 8.482 5.839 285 H SER 38 H SER 38 10.615 9.334 3.350 286 HA SER 38 HA SER 38 9.297 10.726 5.229 287 1HB SER 38 1HB SER 38 10.535 12.750 5.974 288 2HB SER 38 2HB SER 38 11.428 11.276 6.398 289 HG SER 38 HG SER 38 12.737 12.860 5.425 290 H GLY 39 H GLY 39 8.423 12.750 4.876 291 1HA GLY 39 1HA GLY 39 7.803 14.705 3.555 292 2HA GLY 39 2HA GLY 39 8.849 14.186 2.235 293 H PHE 40 H PHE 40 7.932 11.525 2.097 294 HA PHE 40 HA PHE 40 5.692 11.912 0.204 295 1HB PHE 40 1HB PHE 40 7.435 10.141 -0.085 296 2HB PHE 40 2HB PHE 40 6.865 9.317 1.369 297 HD1 PHE 40 HD2 PHE 40 4.450 8.529 1.419 298 HD2 PHE 40 HD1 PHE 40 6.296 9.835 -2.143 299 HE1 PHE 40 HE2 PHE 40 2.749 7.384 0.114 300 HE2 PHE 40 HE1 PHE 40 4.593 8.689 -3.443 301 HZ PHE 40 HZ PHE 40 2.820 7.463 -2.316 302 OH TYR 41 OH TYR 41 6.206 4.413 1.256 303 H TYR 41 H TYR 41 5.819 9.598 2.844 304 HA TYR 41 HA TYR 41 2.957 9.297 3.073 305 1HB TYR 41 1HB TYR 41 5.048 8.780 5.267 306 2HB TYR 41 2HB TYR 41 3.430 8.080 5.179 307 HD1 TYR 41 HD1 TYR 41 2.870 6.558 3.283 308 HD2 TYR 41 HD2 TYR 41 6.809 7.947 3.897 309 HE1 TYR 41 HE1 TYR 41 3.720 4.796 1.838 310 HE2 TYR 41 HE2 TYR 41 7.654 6.184 2.452 311 HH TYR 41 HH TYR 41 7.162 4.487 1.202 312 H ASN 42 H ASN 42 5.131 11.536 4.618 313 HA ASN 42 HA ASN 42 4.015 12.170 7.036 314 1HB ASN 42 1HB ASN 42 4.798 14.326 4.975 315 2HB ASN 42 2HB ASN 42 4.676 14.571 6.725 316 1HD2 ASN 42 1HD2 ASN 42 8.243 13.865 6.241 317 2HD2 ASN 42 2HD2 ASN 42 6.995 15.189 6.003 318 H ASN 43 H ASN 43 2.112 12.009 7.552 319 HA ASN 43 HA ASN 43 -0.259 12.309 7.647 320 1HB ASN 43 1HB ASN 43 0.631 15.214 7.158 321 2HB ASN 43 2HB ASN 43 -0.871 14.696 7.933 322 1HD2 ASN 43 1HD2 ASN 43 1.483 15.404 10.711 323 2HD2 ASN 43 2HD2 ASN 43 0.606 16.302 9.373 324 H THR 44 H THR 44 0.356 11.328 5.258 325 HA THR 44 HA THR 44 -1.190 12.825 3.121 326 HB THR 44 HB THR 44 -0.316 9.887 3.179 327 HG1 THR 44 HG1 THR 44 0.934 12.207 2.129 328 1HG2 THR 44 3HG2 THR 44 -1.061 11.832 0.895 329 2HG2 THR 44 1HG2 THR 44 -0.524 10.142 0.685 330 3HG2 THR 44 2HG2 THR 44 -2.082 10.491 1.483 331 H THR 45 H THR 45 -2.147 9.754 2.879 332 HA THR 45 HA THR 45 -4.045 9.450 5.111 333 HB THR 45 HB THR 45 -6.153 9.626 3.768 334 HG1 THR 45 HG1 THR 45 -5.143 9.460 1.739 335 1HG2 THR 45 2HG2 THR 45 -5.418 11.534 5.237 336 2HG2 THR 45 3HG2 THR 45 -4.486 12.226 3.883 337 3HG2 THR 45 1HG2 THR 45 -6.265 12.138 3.788 338 H PHE 46 H PHE 46 -6.046 8.358 3.388 339 HA PHE 46 HA PHE 46 -4.909 6.010 1.922 340 1HB PHE 46 1HB PHE 46 -6.221 5.638 4.691 341 2HB PHE 46 2HB PHE 46 -6.151 4.351 3.490 342 HD1 PHE 46 HD2 PHE 46 -4.036 3.377 2.818 343 HD2 PHE 46 HD1 PHE 46 -4.133 6.419 5.740 344 HE1 PHE 46 HE2 PHE 46 -1.772 2.807 3.489 345 HE2 PHE 46 HE1 PHE 46 -1.868 5.844 6.408 346 HZ PHE 46 HZ PHE 46 -0.688 4.038 5.286 347 H HIS 47 H HIS 47 -6.119 7.623 0.690 348 HA HIS 47 HA HIS 47 -8.937 8.074 0.790 349 1HB HIS 47 1HB HIS 47 -8.807 8.420 -1.693 350 2HB HIS 47 2HB HIS 47 -7.483 9.220 -0.837 351 HD2 HIS 47 HD2 HIS 47 -7.546 7.939 -3.962 352 HE1 HIS 47 HE1 HIS 47 -4.434 5.598 -2.485 353 HE2 HIS 47 HE2 HIS 47 -5.505 6.392 -4.689 354 NH1 ARG 48 NH2 ARG 48 -6.212 3.993 -7.838 355 NH2 ARG 48 NH1 ARG 48 -7.087 6.036 -8.317 356 H ARG 48 H ARG 48 -7.382 5.722 -1.357 357 HA ARG 48 HA ARG 48 -9.918 4.269 -1.898 358 1HB ARG 48 1HB ARG 48 -6.997 3.469 -2.420 359 2HB ARG 48 2HB ARG 48 -8.424 2.642 -3.070 360 1HG ARG 48 1HG ARG 48 -9.177 4.814 -4.141 361 2HG ARG 48 2HG ARG 48 -7.729 5.615 -3.525 362 1HD ARG 48 1HD ARG 48 -6.271 4.031 -4.882 363 2HD ARG 48 2HD ARG 48 -7.726 3.218 -5.490 364 HE ARG 48 HE ARG 48 -7.953 6.080 -6.078 365 1HH1 ARG 48 2HH2 ARG 48 -6.088 3.246 -7.146 366 2HH1 ARG 48 1HH2 ARG 48 -5.856 4.005 -8.801 367 1HH2 ARG 48 1HH1 ARG 48 -7.628 6.846 -7.994 368 2HH2 ARG 48 2HH1 ARG 48 -6.671 5.906 -9.246 369 H VAL 49 H VAL 49 -10.842 2.912 -0.724 370 HA VAL 49 HA VAL 49 -9.378 0.805 0.861 371 HB VAL 49 HB VAL 49 -10.396 1.443 3.028 372 1HG1 VAL 49 3HG2 VAL 49 -8.089 2.257 2.464 373 2HG1 VAL 49 1HG2 VAL 49 -8.775 3.728 1.727 374 3HG1 VAL 49 2HG2 VAL 49 -8.946 3.446 3.480 375 1HG2 VAL 49 2HG1 VAL 49 -12.402 2.654 2.122 376 2HG2 VAL 49 3HG1 VAL 49 -11.513 3.685 3.275 377 3HG2 VAL 49 1HG1 VAL 49 -11.355 3.964 1.520 378 H ILE 50 H ILE 50 -10.322 -0.624 -0.299 379 HA ILE 50 HA ILE 50 -13.318 -0.830 -0.613 380 HB ILE 50 HB ILE 50 -11.075 -2.844 -1.198 381 1HG1 ILE 50 1HG1 ILE 50 -12.653 -0.888 -2.980 382 2HG1 ILE 50 2HG1 ILE 50 -10.942 -0.752 -2.558 383 1HG2 ILE 50 2HG2 ILE 50 -13.312 -3.917 -0.797 384 2HG2 ILE 50 3HG2 ILE 50 -14.069 -2.808 -1.969 385 3HG2 ILE 50 1HG2 ILE 50 -12.872 -4.009 -2.523 386 1HD1 ILE 50 3HD1 ILE 50 -12.203 -3.108 -4.127 387 2HD1 ILE 50 1HD1 ILE 50 -11.216 -1.801 -4.832 388 3HD1 ILE 50 2HD1 ILE 50 -10.476 -2.970 -3.706 389 HA PRO 51 HA PRO 51 -14.199 -2.381 3.467 390 1HB PRO 51 1HB PRO 51 -16.209 -3.755 1.606 391 2HB PRO 51 2HB PRO 51 -16.524 -3.000 3.188 392 1HG PRO 51 1HG PRO 51 -17.135 -1.595 0.949 393 2HG PRO 51 2HG PRO 51 -16.265 -0.758 2.259 394 1HD PRO 51 1HD PRO 51 -15.101 -1.857 -0.354 395 2HD PRO 51 2HD PRO 51 -14.706 -0.328 0.497 396 H GLY 52 H GLY 52 -13.837 -4.165 4.546 397 1HA GLY 52 1HA GLY 52 -12.224 -6.075 4.750 398 2HA GLY 52 2HA GLY 52 -13.811 -6.786 4.445 399 H PHE 53 H PHE 53 -11.415 -5.139 2.448 400 HA PHE 53 HA PHE 53 -10.984 -7.650 0.735 401 1HB PHE 53 1HB PHE 53 -12.778 -6.222 -0.322 402 2HB PHE 53 2HB PHE 53 -11.678 -4.837 -0.319 403 HD1 PHE 53 HD1 PHE 53 -10.035 -7.992 -0.761 404 HD2 PHE 53 HD2 PHE 53 -12.088 -4.946 -2.835 405 HE1 PHE 53 HE1 PHE 53 -9.084 -8.774 -2.857 406 HE2 PHE 53 HE2 PHE 53 -11.136 -5.732 -4.929 407 HZ PHE 53 HZ PHE 53 -9.633 -7.645 -4.941 408 H MET 54 H MET 54 -10.126 -4.208 0.812 409 HA MET 54 HA MET 54 -7.314 -4.591 1.544 410 1HB MET 54 1HB MET 54 -6.250 -4.348 -0.691 411 2HB MET 54 2HB MET 54 -7.209 -5.832 -0.606 412 1HG MET 54 1HG MET 54 -9.138 -4.655 -1.741 413 2HG MET 54 2HG MET 54 -8.173 -3.163 -1.827 414 1HE MET 54 3HE MET 54 -8.512 -3.096 -4.503 415 2HE MET 54 2HE MET 54 -8.127 -4.473 -5.578 416 3HE MET 54 1HE MET 54 -9.481 -4.601 -4.416 417 H ILE 55 H ILE 55 -6.992 -2.865 2.472 418 HA ILE 55 HA ILE 55 -7.750 -0.119 1.364 419 HB ILE 55 HB ILE 55 -6.674 0.745 3.402 420 1HG1 ILE 55 1HG1 ILE 55 -6.098 -2.221 3.994 421 2HG1 ILE 55 2HG1 ILE 55 -4.888 -1.001 3.583 422 1HG2 ILE 55 2HG2 ILE 55 -9.086 0.053 3.484 423 2HG2 ILE 55 3HG2 ILE 55 -8.610 -1.599 3.957 424 3HG2 ILE 55 1HG2 ILE 55 -8.297 -0.230 5.058 425 1HD1 ILE 55 3HD1 ILE 55 -6.737 -0.899 6.068 426 2HD1 ILE 55 1HD1 ILE 55 -5.006 -1.325 6.077 427 3HD1 ILE 55 2HD1 ILE 55 -5.513 0.331 5.653 428 H GLN 56 H GLN 56 -6.122 1.415 0.990 429 HA GLN 56 HA GLN 56 -3.294 0.449 0.375 430 1HB GLN 56 1HB GLN 56 -5.174 1.554 -1.787 431 2HB GLN 56 2HB GLN 56 -3.536 0.936 -2.023 432 1HG GLN 56 1HG GLN 56 -4.319 -1.354 -1.274 433 2HG GLN 56 2HG GLN 56 -5.948 -0.719 -1.025 434 1HE2 GLN 56 2HE2 GLN 56 -6.279 -0.048 -4.703 435 2HE2 GLN 56 1HE2 GLN 56 -6.293 0.940 -3.157 436 H GLY 57 H GLY 57 -1.902 2.025 -0.394 437 1HA GLY 57 1HA GLY 57 -2.745 4.933 -0.411 438 2HA GLY 57 2HA GLY 57 -1.698 4.479 0.941 439 H GLY 58 H GLY 58 -0.225 5.882 0.224 440 1HA GLY 58 1HA GLY 58 1.817 6.520 -0.870 441 2HA GLY 58 2HA GLY 58 1.906 4.898 -1.574 442 H GLY 59 H GLY 59 0.229 7.979 -1.753 443 1HA GLY 59 1HA GLY 59 0.636 8.401 -4.618 444 2HA GLY 59 2HA GLY 59 -0.987 7.712 -4.407 445 H PHE 60 H PHE 60 -2.451 9.115 -4.387 446 HA PHE 60 HA PHE 60 -2.280 11.950 -4.272 447 1HB PHE 60 1HB PHE 60 -4.593 10.239 -3.167 448 2HB PHE 60 2HB PHE 60 -4.696 11.943 -3.619 449 HD1 PHE 60 HD2 PHE 60 -3.790 12.483 -6.045 450 HD2 PHE 60 HD1 PHE 60 -5.108 8.667 -4.821 451 HE1 PHE 60 HE2 PHE 60 -4.195 11.877 -8.363 452 HE2 PHE 60 HE1 PHE 60 -5.511 8.065 -7.141 453 HZ PHE 60 HZ PHE 60 -5.055 9.669 -8.913 454 H THR 61 H THR 61 -1.991 13.402 -2.851 455 HA THR 61 HA THR 61 -0.895 12.885 -0.210 456 HB THR 61 HB THR 61 -2.246 15.411 -1.335 457 HG1 THR 61 HG1 THR 61 -0.463 14.597 -2.487 458 1HG2 THR 61 3HG2 THR 61 -0.302 15.046 1.042 459 2HG2 THR 61 1HG2 THR 61 -0.888 16.609 0.409 460 3HG2 THR 61 2HG2 THR 61 -2.030 15.472 1.172 461 H GLU 62 H GLU 62 -4.001 14.333 -1.098 462 HA GLU 62 HA GLU 62 -5.552 12.832 0.945 463 1HB GLU 62 1HB GLU 62 -4.198 14.526 2.316 464 2HB GLU 62 2HB GLU 62 -5.043 15.827 1.477 465 1HG GLU 62 1HG GLU 62 -6.342 13.590 3.173 466 2HG GLU 62 2HG GLU 62 -6.108 15.255 3.698 467 H GLN 63 H GLN 63 -5.733 16.197 -0.068 468 HA GLN 63 HA GLN 63 -8.457 15.867 -1.274 469 1HB GLN 63 1HB GLN 63 -6.490 18.232 -1.377 470 2HB GLN 63 2HB GLN 63 -8.146 18.249 -1.987 471 1HG GLN 63 1HG GLN 63 -8.252 19.220 0.216 472 2HG GLN 63 2HG GLN 63 -8.989 17.624 0.338 473 1HE2 GLN 63 2HE2 GLN 63 -5.242 18.250 2.039 474 2HE2 GLN 63 1HE2 GLN 63 -5.797 19.205 0.571 475 H MET 64 H MET 64 -6.802 14.032 -2.306 476 HA MET 64 HA MET 64 -5.749 13.227 -4.305 477 1HB MET 64 1HB MET 64 -8.152 14.798 -5.387 478 2HB MET 64 2HB MET 64 -7.273 13.548 -6.291 479 1HG MET 64 1HG MET 64 -7.746 11.886 -4.432 480 2HG MET 64 2HG MET 64 -8.720 13.115 -3.597 481 1HE MET 64 2HE MET 64 -10.666 11.133 -3.710 482 2HE MET 64 1HE MET 64 -11.296 10.487 -5.255 483 3HE MET 64 3HE MET 64 -9.630 10.096 -4.738 484 H GLN 65 H GLN 65 -4.655 15.611 -3.335 485 HA GLN 65 HA GLN 65 -3.832 17.295 -5.700 486 1HB GLN 65 1HB GLN 65 -2.600 17.070 -2.886 487 2HB GLN 65 2HB GLN 65 -2.175 18.273 -4.113 488 1HG GLN 65 1HG GLN 65 -4.586 19.067 -4.153 489 2HG GLN 65 2HG GLN 65 -4.989 17.884 -2.904 490 1HE2 GLN 65 2HE2 GLN 65 -2.443 21.000 -1.834 491 2HE2 GLN 65 1HE2 GLN 65 -2.354 20.224 -3.493 492 H GLN 66 H GLN 66 -3.311 15.755 -7.087 493 HA GLN 66 HA GLN 66 -2.059 13.371 -7.008 494 1HB GLN 66 1HB GLN 66 -1.114 15.561 -8.961 495 2HB GLN 66 2HB GLN 66 -0.921 13.819 -9.198 496 1HG GLN 66 1HG GLN 66 -3.426 13.517 -9.084 497 2HG GLN 66 2HG GLN 66 -3.630 15.253 -8.840 498 1HE2 GLN 66 2HE2 GLN 66 -3.120 16.077 -12.286 499 2HE2 GLN 66 1HE2 GLN 66 -3.278 16.667 -10.556 500 H LYS 67 H LYS 67 -0.255 12.384 -6.980 501 HA LYS 67 HA LYS 67 1.645 13.051 -4.940 502 1HB LYS 67 1HB LYS 67 2.129 11.264 -7.387 503 2HB LYS 67 2HB LYS 67 2.943 11.130 -5.820 504 1HG LYS 67 1HG LYS 67 0.756 10.658 -4.696 505 2HG LYS 67 2HG LYS 67 -0.116 10.869 -6.205 506 1HD LYS 67 1HD LYS 67 1.996 8.663 -5.702 507 2HD LYS 67 2HD LYS 67 0.264 8.458 -5.471 508 1HE LYS 67 1HE LYS 67 -0.149 8.952 -7.932 509 2HE LYS 67 2HE LYS 67 1.593 9.119 -8.188 510 1HZ LYS 67 3HZ LYS 67 0.239 6.649 -7.221 511 2HZ LYS 67 1HZ LYS 67 0.834 6.901 -8.741 512 3HZ LYS 67 2HZ LYS 67 1.867 6.808 -7.456 513 H LYS 68 H LYS 68 3.751 11.996 -6.831 514 HA LYS 68 HA LYS 68 4.766 14.079 -8.601 515 1HB LYS 68 1HB LYS 68 5.797 14.156 -5.693 516 2HB LYS 68 2HB LYS 68 6.617 14.938 -7.048 517 1HG LYS 68 1HG LYS 68 3.738 15.513 -6.099 518 2HG LYS 68 2HG LYS 68 5.141 16.542 -5.798 519 1HD LYS 68 1HD LYS 68 5.445 16.849 -8.300 520 2HD LYS 68 2HD LYS 68 4.027 15.861 -8.612 521 1HE LYS 68 1HE LYS 68 4.003 18.523 -7.017 522 2HE LYS 68 2HE LYS 68 3.665 18.386 -8.740 523 1HZ LYS 68 2HZ LYS 68 1.758 16.964 -8.224 524 2HZ LYS 68 3HZ LYS 68 2.058 17.078 -6.603 525 3HZ LYS 68 1HZ LYS 68 1.627 18.423 -7.460 526 HA PRO 69 HA PRO 69 6.388 9.779 -8.429 527 1HB PRO 69 1HB PRO 69 6.141 9.341 -11.165 528 2HB PRO 69 2HB PRO 69 4.786 9.251 -10.017 529 1HG PRO 69 1HG PRO 69 5.587 11.634 -11.773 530 2HG PRO 69 2HG PRO 69 3.969 10.908 -11.605 531 1HD PRO 69 1HD PRO 69 4.666 13.156 -10.164 532 2HD PRO 69 2HD PRO 69 3.670 11.881 -9.387 533 H ASN 70 H ASN 70 7.768 8.782 -10.372 534 HA ASN 70 HA ASN 70 10.177 10.385 -11.164 535 1HB ASN 70 1HB ASN 70 10.290 8.424 -8.775 536 2HB ASN 70 2HB ASN 70 11.706 9.118 -9.572 537 1HD2 ASN 70 1HD2 ASN 70 10.584 11.241 -6.582 538 2HD2 ASN 70 2HD2 ASN 70 10.772 9.432 -6.824 539 HA PRO 71 HA PRO 71 11.253 6.930 -13.844 540 1HB PRO 71 1HB PRO 71 13.803 6.232 -12.905 541 2HB PRO 71 2HB PRO 71 13.467 7.635 -13.945 542 1HG PRO 71 1HG PRO 71 13.738 7.602 -10.896 543 2HG PRO 71 2HG PRO 71 14.524 8.713 -12.045 544 1HD PRO 71 1HD PRO 71 12.247 9.483 -10.718 545 2HD PRO 71 2HD PRO 71 12.427 9.909 -12.450 546 HA PRO 72 HA PRO 72 9.038 4.237 -11.053 547 1HB PRO 72 1HB PRO 72 9.331 2.701 -13.689 548 2HB PRO 72 2HB PRO 72 7.886 2.829 -12.655 549 1HG PRO 72 1HG PRO 72 8.037 4.422 -14.842 550 2HG PRO 72 2HG PRO 72 7.533 5.157 -13.300 551 1HD PRO 72 1HD PRO 72 10.279 5.326 -14.643 552 2HD PRO 72 2HD PRO 72 9.383 6.598 -13.751 553 H ILE 73 H ILE 73 9.339 1.457 -11.873 554 HA ILE 73 HA ILE 73 12.159 0.635 -11.224 555 HB ILE 73 HB ILE 73 11.560 -0.427 -9.064 556 1HG1 ILE 73 1HG1 ILE 73 8.860 0.988 -9.493 557 2HG1 ILE 73 2HG1 ILE 73 9.128 -0.758 -9.535 558 1HG2 ILE 73 2HG2 ILE 73 12.519 1.892 -9.069 559 2HG2 ILE 73 3HG2 ILE 73 10.879 2.584 -9.171 560 3HG2 ILE 73 1HG2 ILE 73 11.380 1.685 -7.713 561 1HD1 ILE 73 3HD1 ILE 73 9.626 1.059 -7.074 562 2HD1 ILE 73 1HD1 ILE 73 8.245 -0.050 -7.285 563 3HD1 ILE 73 2HD1 ILE 73 9.895 -0.704 -7.113 564 H LYS 74 H LYS 74 12.600 -1.305 -11.647 565 HA LYS 74 HA LYS 74 11.404 -2.810 -13.630 566 1HB LYS 74 1HB LYS 74 12.675 -4.060 -11.132 567 2HB LYS 74 2HB LYS 74 12.544 -4.821 -12.726 568 1HG LYS 74 1HG LYS 74 13.905 -2.928 -13.735 569 2HG LYS 74 2HG LYS 74 13.984 -2.155 -12.162 570 1HD LYS 74 1HD LYS 74 16.111 -3.224 -12.469 571 2HD LYS 74 2HD LYS 74 15.267 -4.121 -11.230 572 1HE LYS 74 1HE LYS 74 16.387 -5.731 -12.638 573 2HE LYS 74 2HE LYS 74 14.666 -5.921 -12.954 574 1HZ LYS 74 1HZ LYS 74 16.585 -4.413 -14.675 575 2HZ LYS 74 2HZ LYS 74 15.955 -5.905 -15.000 576 3HZ LYS 74 3HZ LYS 74 14.971 -4.578 -14.989 577 H ASN 75 H ASN 75 10.321 -4.719 -13.777 578 HA ASN 75 HA ASN 75 7.646 -4.787 -12.881 579 1HB ASN 75 1HB ASN 75 8.693 -6.252 -14.672 580 2HB ASN 75 2HB ASN 75 9.395 -7.268 -13.407 581 1HD2 ASN 75 1HD2 ASN 75 5.241 -7.159 -13.502 582 2HD2 ASN 75 2HD2 ASN 75 6.248 -5.628 -13.597 583 H GLU 76 H GLU 76 6.590 -6.469 -11.614 584 HA GLU 76 HA GLU 76 7.690 -7.843 -9.343 585 1HB GLU 76 1HB GLU 76 6.772 -4.986 -8.651 586 2HB GLU 76 2HB GLU 76 7.218 -6.231 -7.477 587 1HG GLU 76 1HG GLU 76 9.052 -5.014 -9.647 588 2HG GLU 76 2HG GLU 76 9.146 -4.685 -7.917 589 H ALA 77 H ALA 77 6.265 -9.118 -8.669 590 HA ALA 77 HA ALA 77 3.555 -8.570 -7.852 591 1HB ALA 77 2HB ALA 77 3.143 -7.972 -10.268 592 2HB ALA 77 3HB ALA 77 3.703 -9.591 -10.771 593 3HB ALA 77 1HB ALA 77 2.219 -9.422 -9.800 594 H ASP 78 H ASP 78 5.610 -10.850 -9.565 595 HA ASP 78 HA ASP 78 4.140 -13.263 -8.851 596 1HB ASP 78 1HB ASP 78 6.163 -14.472 -9.601 597 2HB ASP 78 2HB ASP 78 5.745 -13.167 -10.717 598 H ASN 79 H ASN 79 6.956 -11.684 -7.400 599 HA ASN 79 HA ASN 79 7.528 -13.540 -5.256 600 1HB ASN 79 1HB ASN 79 8.469 -11.582 -4.044 601 2HB ASN 79 2HB ASN 79 8.959 -11.576 -5.741 602 1HD2 ASN 79 1HD2 ASN 79 7.533 -8.370 -6.280 603 2HD2 ASN 79 2HD2 ASN 79 8.720 -9.689 -6.747 604 H GLY 80 H GLY 80 6.593 -14.104 -3.529 605 1HA GLY 80 1HA GLY 80 4.655 -12.504 -1.948 606 2HA GLY 80 2HA GLY 80 3.801 -13.712 -2.933 607 H LEU 81 H LEU 81 5.019 -15.876 -2.934 608 HA LEU 81 HA LEU 81 5.874 -17.744 -1.754 609 1HB LEU 81 1HB LEU 81 6.485 -15.714 0.476 610 2HB LEU 81 2HB LEU 81 6.885 -17.429 0.558 611 HG LEU 81 HG LEU 81 8.225 -17.214 -1.577 612 1HD1 LEU 81 3HD1 LEU 81 7.787 -14.186 -1.139 613 2HD1 LEU 81 1HD1 LEU 81 8.918 -14.910 -2.311 614 3HD1 LEU 81 2HD1 LEU 81 7.164 -15.139 -2.512 615 1HD2 LEU 81 3HD2 LEU 81 9.306 -17.160 0.688 616 2HD2 LEU 81 1HD2 LEU 81 10.171 -16.096 -0.450 617 3HD2 LEU 81 2HD2 LEU 81 9.077 -15.394 0.770 618 NH1 ARG 82 NH2 ARG 82 5.378 -18.753 6.488 619 NH2 ARG 82 NH1 ARG 82 6.474 -20.000 4.935 620 H ARG 82 H ARG 82 3.679 -15.644 -0.315 621 HA ARG 82 HA ARG 82 1.665 -17.623 0.289 622 1HB ARG 82 1HB ARG 82 1.843 -17.860 2.767 623 2HB ARG 82 2HB ARG 82 3.250 -18.541 1.934 624 1HG ARG 82 1HG ARG 82 4.526 -16.376 2.335 625 2HG ARG 82 2HG ARG 82 3.117 -15.711 3.142 626 1HD ARG 82 1HD ARG 82 4.625 -16.393 4.884 627 2HD ARG 82 2HD ARG 82 3.270 -17.523 4.928 628 HE ARG 82 HE ARG 82 5.404 -18.663 3.252 629 1HH1 ARG 82 2HH2 ARG 82 4.726 -17.983 6.676 630 2HH1 ARG 82 1HH2 ARG 82 5.851 -19.342 7.183 631 1HH2 ARG 82 1HH1 ARG 82 6.659 -20.183 3.943 632 2HH2 ARG 82 2HH1 ARG 82 6.870 -20.502 5.737 633 H ASN 83 H ASN 83 0.926 -15.709 -0.764 634 HA ASN 83 HA ASN 83 0.404 -13.210 0.779 635 1HB ASN 83 1HB ASN 83 -1.094 -12.647 -1.125 636 2HB ASN 83 2HB ASN 83 0.493 -13.180 -1.684 637 1HD2 ASN 83 1HD2 ASN 83 -2.795 -15.638 -2.292 638 2HD2 ASN 83 2HD2 ASN 83 -2.793 -14.344 -0.991 639 H THR 84 H THR 84 -1.254 -12.622 1.900 640 HA THR 84 HA THR 84 -3.914 -13.972 1.913 641 HB THR 84 HB THR 84 -1.911 -14.305 4.226 642 HG1 THR 84 HG1 THR 84 -3.429 -16.113 2.647 643 1HG2 THR 84 3HG2 THR 84 -4.930 -14.919 4.078 644 2HG2 THR 84 1HG2 THR 84 -3.848 -15.357 5.438 645 3HG2 THR 84 2HG2 THR 84 -4.172 -13.640 5.062 646 NH1 ARG 85 NH2 ARG 85 -8.183 -12.588 8.705 647 NH2 ARG 85 NH1 ARG 85 -8.397 -14.850 8.745 648 H ARG 85 H ARG 85 -5.416 -12.886 2.939 649 HA ARG 85 HA ARG 85 -5.353 -10.070 3.210 650 1HB ARG 85 1HB ARG 85 -7.319 -10.275 4.734 651 2HB ARG 85 2HB ARG 85 -7.457 -11.424 3.391 652 1HG ARG 85 1HG ARG 85 -6.472 -13.242 4.841 653 2HG ARG 85 2HG ARG 85 -6.307 -12.099 6.175 654 1HD ARG 85 1HD ARG 85 -8.854 -11.781 6.201 655 2HD ARG 85 2HD ARG 85 -8.991 -12.930 4.880 656 HE ARG 85 HE ARG 85 -8.523 -14.785 6.352 657 1HH1 ARG 85 2HH2 ARG 85 -8.131 -11.734 8.139 658 2HH1 ARG 85 1HH2 ARG 85 -8.130 -12.652 9.728 659 1HH2 ARG 85 1HH1 ARG 85 -8.510 -15.721 8.213 660 2HH2 ARG 85 2HH1 ARG 85 -8.330 -14.756 9.764 661 H GLY 86 H GLY 86 -3.811 -9.187 3.931 662 1HA GLY 86 1HA GLY 86 -3.112 -8.274 6.474 663 2HA GLY 86 2HA GLY 86 -2.445 -9.916 6.530 664 H THR 87 H THR 87 -2.109 -9.761 3.529 665 HA THR 87 HA THR 87 0.760 -8.707 3.651 666 HB THR 87 HB THR 87 0.914 -9.649 1.317 667 HG1 THR 87 HG1 THR 87 -1.328 -9.682 0.939 668 1HG2 THR 87 2HG2 THR 87 1.744 -10.872 3.332 669 2HG2 THR 87 3HG2 THR 87 0.129 -11.588 3.587 670 3HG2 THR 87 1HG2 THR 87 1.081 -12.012 2.133 671 H ILE 88 H ILE 88 1.394 -7.070 2.872 672 HA ILE 88 HA ILE 88 -0.289 -5.237 1.087 673 HB ILE 88 HB ILE 88 0.577 -3.698 2.426 674 1HG1 ILE 88 1HG1 ILE 88 3.023 -2.987 1.761 675 2HG1 ILE 88 2HG1 ILE 88 2.955 -4.336 0.662 676 1HG2 ILE 88 2HG2 ILE 88 1.587 -5.306 4.077 677 2HG2 ILE 88 3HG2 ILE 88 3.043 -5.435 3.052 678 3HG2 ILE 88 1HG2 ILE 88 2.639 -3.885 3.834 679 1HD1 ILE 88 2HD1 ILE 88 0.813 -3.231 -0.370 680 2HD1 ILE 88 3HD1 ILE 88 0.968 -1.924 0.830 681 3HD1 ILE 88 1HD1 ILE 88 2.214 -2.119 -0.428 682 H ALA 89 H ALA 89 0.606 -4.430 -0.706 683 HA ALA 89 HA ALA 89 2.800 -5.774 -2.199 684 1HB ALA 89 2HB ALA 89 1.113 -7.656 -2.242 685 2HB ALA 89 3HB ALA 89 -0.091 -6.566 -2.979 686 3HB ALA 89 1HB ALA 89 1.385 -6.999 -3.875 687 H MET 90 H MET 90 3.516 -4.536 -3.594 688 HA MET 90 HA MET 90 2.390 -1.926 -4.268 689 1HB MET 90 1HB MET 90 4.775 -2.290 -4.433 690 2HB MET 90 2HB MET 90 4.582 -3.556 -5.659 691 1HG MET 90 1HG MET 90 3.773 -1.995 -7.320 692 2HG MET 90 2HG MET 90 3.411 -0.749 -6.113 693 1HE MET 90 3HE MET 90 5.642 -0.201 -4.243 694 2HE MET 90 2HE MET 90 6.783 0.823 -5.167 695 3HE MET 90 1HE MET 90 5.021 1.072 -5.338 696 H ALA 91 H ALA 91 2.213 -1.214 -6.504 697 HA ALA 91 HA ALA 91 0.881 -2.985 -8.510 698 1HB ALA 91 2HB ALA 91 -0.935 -2.812 -6.767 699 2HB ALA 91 3HB ALA 91 -0.865 -1.032 -6.861 700 3HB ALA 91 1HB ALA 91 -1.407 -1.981 -8.270 701 NH1 ARG 92 NH2 ARG 92 3.964 4.042 -13.464 702 NH2 ARG 92 NH1 ARG 92 3.126 3.171 -15.389 703 H ARG 92 H ARG 92 -0.057 -1.879 -10.228 704 HA ARG 92 HA ARG 92 0.282 0.959 -10.821 705 1HB ARG 92 1HB ARG 92 2.743 -0.591 -10.819 706 2HB ARG 92 2HB ARG 92 2.371 -0.177 -12.494 707 1HG ARG 92 1HG ARG 92 2.530 1.759 -10.105 708 2HG ARG 92 2HG ARG 92 3.717 1.643 -11.395 709 1HD ARG 92 1HD ARG 92 0.766 2.502 -11.777 710 2HD ARG 92 2HD ARG 92 2.081 3.629 -11.549 711 HE ARG 92 HE ARG 92 1.466 2.071 -14.057 712 1HH1 ARG 92 2HH2 ARG 92 3.892 4.111 -12.443 713 2HH1 ARG 92 1HH2 ARG 92 4.660 4.498 -14.064 714 1HH2 ARG 92 1HH1 ARG 92 2.419 2.579 -15.838 715 2HH2 ARG 92 2HH1 ARG 92 3.881 3.687 -15.854 716 H THR 93 H THR 93 -1.146 1.221 -12.234 717 HA THR 93 HA THR 93 -2.627 -0.619 -13.750 718 HB THR 93 HB THR 93 -1.690 2.145 -14.720 719 HG1 THR 93 HG1 THR 93 -3.964 1.260 -13.269 720 1HG2 THR 93 3HG2 THR 93 -4.136 0.421 -15.504 721 2HG2 THR 93 1HG2 THR 93 -3.813 2.081 -16.074 722 3HG2 THR 93 2HG2 THR 93 -2.725 0.748 -16.545 723 H ALA 94 H ALA 94 -1.585 -2.281 -14.509 724 HA ALA 94 HA ALA 94 -0.528 -3.586 -16.214 725 1HB ALA 94 2HB ALA 94 -1.556 -1.992 -17.866 726 2HB ALA 94 3HB ALA 94 -0.190 -0.865 -17.650 727 3HB ALA 94 1HB ALA 94 0.081 -2.467 -18.384 728 H ASP 95 H ASP 95 1.153 -0.482 -16.271 729 HA ASP 95 HA ASP 95 3.405 0.110 -15.708 730 1HB ASP 95 1HB ASP 95 3.291 -2.568 -14.189 731 2HB ASP 95 2HB ASP 95 4.608 -1.390 -14.059 732 H LYS 96 H LYS 96 3.911 -3.323 -15.527 733 HA LYS 96 HA LYS 96 4.985 -4.785 -17.239 734 1HB LYS 96 1HB LYS 96 4.457 -3.133 -19.045 735 2HB LYS 96 2HB LYS 96 5.750 -2.068 -18.468 736 1HG LYS 96 1HG LYS 96 7.441 -3.907 -18.863 737 2HG LYS 96 2HG LYS 96 6.155 -4.972 -19.434 738 1HD LYS 96 1HD LYS 96 5.657 -3.359 -21.330 739 2HD LYS 96 2HD LYS 96 6.943 -2.290 -20.758 740 1HE LYS 96 1HE LYS 96 8.653 -4.134 -21.147 741 2HE LYS 96 2HE LYS 96 7.365 -5.207 -21.719 742 1HZ LYS 96 2HZ LYS 96 8.117 -2.612 -22.981 743 2HZ LYS 96 3HZ LYS 96 8.490 -4.115 -23.556 744 3HZ LYS 96 1HZ LYS 96 6.917 -3.615 -23.515 745 H ASP 97 H ASP 97 6.424 -1.717 -16.296 746 HA ASP 97 HA ASP 97 8.416 -2.961 -14.477 747 1HB ASP 97 1HB ASP 97 9.418 -1.673 -17.099 748 2HB ASP 97 2HB ASP 97 10.444 -2.101 -15.721 749 H SER 98 H SER 98 7.135 -1.573 -13.271 750 HA SER 98 HA SER 98 8.261 1.199 -12.997 751 1HB SER 98 1HB SER 98 5.310 0.789 -13.798 752 2HB SER 98 2HB SER 98 6.039 2.330 -13.306 753 HG SER 98 HG SER 98 7.499 2.100 -15.054 754 H ALA 99 H ALA 99 5.147 1.298 -12.106 755 HA ALA 99 HA ALA 99 4.180 1.550 -9.943 756 1HB ALA 99 2HB ALA 99 4.184 -0.962 -9.886 757 2HB ALA 99 3HB ALA 99 5.859 -0.962 -9.269 758 3HB ALA 99 1HB ALA 99 4.540 -0.295 -8.275 759 H THR 100 H THR 100 4.941 3.399 -9.435 760 HA THR 100 HA THR 100 7.783 3.958 -8.849 761 HB THR 100 HB THR 100 6.975 6.272 -8.423 762 HG1 THR 100 HG1 THR 100 4.737 6.616 -8.599 763 1HG2 THR 100 3HG2 THR 100 5.574 4.897 -10.810 764 2HG2 THR 100 1HG2 THR 100 5.912 6.644 -10.671 765 3HG2 THR 100 2HG2 THR 100 7.259 5.481 -10.797 766 H SER 101 H SER 101 4.892 3.573 -6.903 767 HA SER 101 HA SER 101 6.417 3.001 -4.429 768 1HB SER 101 1HB SER 101 5.726 5.014 -3.135 769 2HB SER 101 2HB SER 101 6.751 5.475 -4.508 770 HG SER 101 HG SER 101 4.833 5.912 -5.681 771 H GLN 102 H GLN 102 3.412 4.149 -5.851 772 HA GLN 102 HA GLN 102 1.417 3.534 -4.012 773 1HB GLN 102 1HB GLN 102 1.394 2.578 -6.940 774 2HB GLN 102 2HB GLN 102 -0.029 2.771 -5.908 775 1HG GLN 102 1HG GLN 102 0.527 5.221 -5.598 776 2HG GLN 102 2HG GLN 102 1.939 5.034 -6.645 777 1HE2 GLN 102 2HE2 GLN 102 -0.302 4.251 -9.557 778 2HE2 GLN 102 1HE2 GLN 102 1.026 3.397 -8.621 779 H PHE 103 H PHE 103 0.682 2.009 -2.941 780 HA PHE 103 HA PHE 103 1.108 -0.898 -3.642 781 1HB PHE 103 1HB PHE 103 2.019 -1.547 -1.513 782 2HB PHE 103 2HB PHE 103 3.080 -0.323 -2.205 783 HD1 PHE 103 HD2 PHE 103 0.504 1.680 -1.327 784 HD2 PHE 103 HD1 PHE 103 3.333 -0.818 0.556 785 HE1 PHE 103 HE2 PHE 103 0.272 2.960 0.724 786 HE2 PHE 103 HE1 PHE 103 3.098 0.464 2.606 787 HZ PHE 103 HZ PHE 103 1.561 2.345 2.691 788 H PHE 104 H PHE 104 0.089 -2.187 -1.711 789 HA PHE 104 HA PHE 104 -2.576 -0.999 -0.897 790 1HB PHE 104 1HB PHE 104 -3.926 -2.430 -2.304 791 2HB PHE 104 2HB PHE 104 -2.833 -1.530 -3.348 792 HD1 PHE 104 HD1 PHE 104 -3.594 -4.798 -1.905 793 HD2 PHE 104 HD2 PHE 104 -1.005 -2.693 -4.480 794 HE1 PHE 104 HE1 PHE 104 -2.854 -6.903 -2.880 795 HE2 PHE 104 HE2 PHE 104 -0.265 -4.799 -5.455 796 HZ PHE 104 HZ PHE 104 -1.207 -6.903 -4.665 797 H ILE 105 H ILE 105 -3.121 -1.665 0.812 798 HA ILE 105 HA ILE 105 -1.947 -4.196 2.057 799 HB ILE 105 HB ILE 105 -3.668 -1.985 3.303 800 1HG1 ILE 105 1HG1 ILE 105 -0.627 -2.478 3.330 801 2HG1 ILE 105 2HG1 ILE 105 -1.446 -1.162 2.478 802 1HG2 ILE 105 2HG2 ILE 105 -3.788 -4.220 4.449 803 2HG2 ILE 105 3HG2 ILE 105 -2.009 -4.302 4.501 804 3HG2 ILE 105 1HG2 ILE 105 -2.872 -3.054 5.443 805 1HD1 ILE 105 2HD1 ILE 105 -2.351 -0.284 4.683 806 2HD1 ILE 105 3HD1 ILE 105 -1.525 -1.612 5.543 807 3HD1 ILE 105 1HD1 ILE 105 -0.570 -0.366 4.698 808 H ASN 106 H ASN 106 -2.957 -5.829 1.281 809 HA ASN 106 HA ASN 106 -5.887 -6.019 0.778 810 1HB ASN 106 1HB ASN 106 -5.463 -8.418 0.449 811 2HB ASN 106 2HB ASN 106 -4.233 -7.474 -0.395 812 1HD2 ASN 106 1HD2 ASN 106 -2.965 -10.196 2.223 813 2HD2 ASN 106 2HD2 ASN 106 -4.594 -10.138 1.382 814 H VAL 107 H VAL 107 -6.828 -8.130 1.784 815 HA VAL 107 HA VAL 107 -6.292 -8.567 4.703 816 HB VAL 107 HB VAL 107 -8.549 -7.888 5.460 817 1HG1 VAL 107 3HG2 VAL 107 -6.655 -6.248 5.616 818 2HG1 VAL 107 1HG2 VAL 107 -7.039 -5.632 3.988 819 3HG1 VAL 107 2HG2 VAL 107 -8.198 -5.404 5.325 820 1HG2 VAL 107 2HG1 VAL 107 -9.764 -8.188 3.283 821 2HG2 VAL 107 3HG1 VAL 107 -10.038 -6.552 3.935 822 3HG2 VAL 107 1HG1 VAL 107 -8.891 -6.796 2.591 823 H ALA 108 H ALA 108 -8.424 -8.972 1.948 824 HA ALA 108 HA ALA 108 -9.655 -11.512 2.940 825 1HB ALA 108 2HB ALA 108 -10.886 -9.993 1.366 826 2HB ALA 108 3HB ALA 108 -9.648 -10.269 0.111 827 3HB ALA 108 1HB ALA 108 -10.680 -11.616 0.660 828 H ASP 109 H ASP 109 -9.186 -13.470 2.532 829 HA ASP 109 HA ASP 109 -6.600 -14.499 2.009 830 1HB ASP 109 1HB ASP 109 -9.272 -15.754 1.128 831 2HB ASP 109 2HB ASP 109 -7.740 -16.628 1.295 832 H ASN 110 H ASN 110 -5.558 -13.410 0.511 833 HA ASN 110 HA ASN 110 -6.474 -12.885 -2.219 834 1HB ASN 110 1HB ASN 110 -4.632 -11.618 -1.073 835 2HB ASN 110 2HB ASN 110 -3.591 -13.044 -1.151 836 1HD2 ASN 110 1HD2 ASN 110 -3.041 -12.775 -4.712 837 2HD2 ASN 110 2HD2 ASN 110 -3.087 -13.912 -3.272 838 H ALA 111 H ALA 111 -6.171 -13.794 -4.031 839 HA ALA 111 HA ALA 111 -4.517 -15.964 -4.877 840 1HB ALA 111 3HB ALA 111 -7.189 -16.999 -3.707 841 2HB ALA 111 1HB ALA 111 -6.015 -17.968 -4.637 842 3HB ALA 111 2HB ALA 111 -5.566 -17.326 -3.036 843 H PHE 112 H PHE 112 -7.929 -15.111 -4.740 844 HA PHE 112 HA PHE 112 -8.437 -15.246 -7.686 845 1HB PHE 112 1HB PHE 112 -10.514 -13.995 -7.093 846 2HB PHE 112 2HB PHE 112 -10.301 -15.401 -6.048 847 HD1 PHE 112 HD1 PHE 112 -9.991 -11.730 -6.219 848 HD2 PHE 112 HD2 PHE 112 -9.753 -15.106 -3.698 849 HE1 PHE 112 HE1 PHE 112 -10.019 -10.281 -4.271 850 HE2 PHE 112 HE2 PHE 112 -9.781 -13.653 -1.754 851 HZ PHE 112 HZ PHE 112 -9.917 -11.240 -2.038 852 H LEU 113 H LEU 113 -6.173 -14.246 -7.680 853 HA LEU 113 HA LEU 113 -6.232 -11.505 -8.709 854 1HB LEU 113 1HB LEU 113 -6.684 -10.985 -6.279 855 2HB LEU 113 2HB LEU 113 -5.190 -11.819 -5.823 856 HG LEU 113 HG LEU 113 -3.876 -10.259 -7.310 857 1HD1 LEU 113 2HD1 LEU 113 -5.721 -9.721 -8.930 858 2HD1 LEU 113 3HD1 LEU 113 -6.597 -8.834 -7.655 859 3HD1 LEU 113 1HD1 LEU 113 -5.027 -8.228 -8.245 860 1HD2 LEU 113 3HD2 LEU 113 -4.149 -9.719 -4.872 861 2HD2 LEU 113 1HD2 LEU 113 -4.095 -8.230 -5.847 862 3HD2 LEU 113 2HD2 LEU 113 -5.654 -8.829 -5.224 863 H ASP 114 H ASP 114 -4.484 -14.164 -7.267 864 HA ASP 114 HA ASP 114 -1.795 -13.570 -7.462 865 1HB ASP 114 1HB ASP 114 -2.690 -15.849 -6.960 866 2HB ASP 114 2HB ASP 114 -3.073 -16.088 -8.678 867 H HIS 115 H HIS 115 -0.493 -12.809 -8.748 868 HA HIS 115 HA HIS 115 -1.034 -11.589 -11.222 869 1HB HIS 115 1HB HIS 115 1.693 -12.851 -10.543 870 2HB HIS 115 2HB HIS 115 1.385 -11.472 -11.602 871 HD2 HIS 115 HD2 HIS 115 3.265 -10.836 -9.285 872 HE1 HIS 115 HE1 HIS 115 0.045 -9.417 -7.063 873 HE2 HIS 115 HE2 HIS 115 2.618 -9.368 -7.164 874 H GLY 116 H GLY 116 -1.984 -12.389 -12.802 875 1HA GLY 116 1HA GLY 116 -2.568 -14.920 -13.664 876 2HA GLY 116 2HA GLY 116 -2.228 -13.667 -14.865 877 H GLN 117 H GLN 117 -0.067 -13.365 -15.545 878 HA GLN 117 HA GLN 117 2.141 -15.212 -15.123 879 1HB GLN 117 1HB GLN 117 0.532 -16.932 -15.987 880 2HB GLN 117 2HB GLN 117 0.262 -15.972 -17.451 881 1HG GLN 117 1HG GLN 117 2.726 -16.131 -18.003 882 2HG GLN 117 2HG GLN 117 2.990 -17.097 -16.548 883 1HE2 GLN 117 2HE2 GLN 117 2.669 -19.576 -19.261 884 2HE2 GLN 117 1HE2 GLN 117 3.824 -18.286 -18.651 885 NH1 ARG 118 NH2 ARG 118 -0.169 -17.467 -19.472 886 NH2 ARG 118 NH1 ARG 118 2.071 -17.437 -19.084 887 H ARG 118 H ARG 118 0.418 -14.059 -17.989 888 HA ARG 118 HA ARG 118 2.681 -13.041 -19.472 889 1HB ARG 118 1HB ARG 118 -0.239 -12.092 -19.327 890 2HB ARG 118 2HB ARG 118 0.946 -11.317 -20.371 891 1HG ARG 118 1HG ARG 118 -0.298 -12.942 -21.668 892 2HG ARG 118 2HG ARG 118 1.384 -13.423 -21.605 893 1HD ARG 118 1HD ARG 118 -0.784 -14.621 -19.736 894 2HD ARG 118 2HD ARG 118 -0.453 -15.252 -21.350 895 HE ARG 118 HE ARG 118 2.091 -15.195 -19.946 896 1HH1 ARG 118 2HH2 ARG 118 -0.994 -16.962 -19.815 897 2HH1 ARG 118 1HH2 ARG 118 -0.143 -18.422 -19.100 898 1HH2 ARG 118 1HH1 ARG 118 2.953 -16.915 -19.129 899 2HH2 ARG 118 2HH1 ARG 118 1.940 -18.394 -18.739 900 H ASP 119 H ASP 119 0.481 -10.594 -18.713 901 HA ASP 119 HA ASP 119 2.522 -8.638 -17.914 902 1HB ASP 119 1HB ASP 119 0.324 -8.043 -18.959 903 2HB ASP 119 2HB ASP 119 -0.530 -8.612 -17.513 904 H PHE 120 H PHE 120 -0.141 -10.124 -16.127 905 HA PHE 120 HA PHE 120 -0.512 -10.435 -13.806 906 1HB PHE 120 1HB PHE 120 1.355 -11.213 -12.426 907 2HB PHE 120 2HB PHE 120 1.373 -12.015 -13.990 908 HD1 PHE 120 HD2 PHE 120 2.875 -9.165 -12.133 909 HD2 PHE 120 HD1 PHE 120 3.312 -11.902 -15.314 910 HE1 PHE 120 HE2 PHE 120 5.187 -8.471 -12.417 911 HE2 PHE 120 HE1 PHE 120 5.623 -11.205 -15.594 912 HZ PHE 120 HZ PHE 120 6.559 -9.485 -14.149 913 H GLY 121 H GLY 121 -1.348 -8.867 -12.961 914 1HA GLY 121 1HA GLY 121 -0.392 -6.128 -13.184 915 2HA GLY 121 2HA GLY 121 -1.814 -6.639 -12.283 916 OH TYR 122 OH TYR 122 -6.317 -4.791 -9.923 917 H TYR 122 H TYR 122 -1.569 -7.406 -10.168 918 HA TYR 122 HA TYR 122 -0.235 -5.246 -8.739 919 1HB TYR 122 1HB TYR 122 -1.607 -7.677 -7.459 920 2HB TYR 122 2HB TYR 122 -1.354 -6.092 -6.741 921 HD1 TYR 122 HD1 TYR 122 -2.448 -4.088 -7.830 922 HD2 TYR 122 HD2 TYR 122 -3.462 -8.048 -8.884 923 HE1 TYR 122 HE1 TYR 122 -4.533 -3.298 -8.801 924 HE2 TYR 122 HE2 TYR 122 -5.546 -7.254 -9.853 925 HH TYR 122 HH TYR 122 -6.366 -3.838 -9.823 926 H ALA 123 H ALA 123 1.481 -5.064 -7.744 927 HA ALA 123 HA ALA 123 3.566 -7.168 -7.530 928 1HB ALA 123 2HB ALA 123 4.124 -4.734 -7.752 929 2HB ALA 123 3HB ALA 123 3.369 -4.402 -6.170 930 3HB ALA 123 1HB ALA 123 4.831 -5.417 -6.268 931 H VAL 124 H VAL 124 4.509 -6.491 -4.987 932 HA VAL 124 HA VAL 124 2.787 -7.083 -2.752 933 HB VAL 124 HB VAL 124 4.016 -9.606 -4.025 934 1HG1 VAL 124 3HG2 VAL 124 4.404 -9.542 -1.547 935 2HG1 VAL 124 1HG2 VAL 124 2.672 -9.230 -1.270 936 3HG1 VAL 124 2HG2 VAL 124 3.198 -10.787 -1.963 937 1HG2 VAL 124 1HG1 VAL 124 1.097 -8.902 -3.290 938 2HG2 VAL 124 2HG1 VAL 124 1.758 -9.001 -4.943 939 3HG2 VAL 124 3HG1 VAL 124 1.653 -10.469 -3.938 940 H PHE 125 H PHE 125 3.899 -6.594 -1.044 941 HA PHE 125 HA PHE 125 6.665 -7.582 -0.541 942 1HB PHE 125 1HB PHE 125 7.828 -5.434 -0.735 943 2HB PHE 125 2HB PHE 125 7.005 -5.720 -2.274 944 HD1 PHE 125 HD1 PHE 125 4.704 -4.648 -2.588 945 HD2 PHE 125 HD2 PHE 125 7.215 -3.603 0.636 946 HE1 PHE 125 HE1 PHE 125 3.327 -2.693 -2.144 947 HE2 PHE 125 HE2 PHE 125 5.836 -1.652 1.076 948 HZ PHE 125 HZ PHE 125 3.871 -1.218 -0.286 949 H GLY 126 H GLY 126 3.942 -7.312 0.734 950 1HA GLY 126 1HA GLY 126 4.767 -5.858 3.319 951 2HA GLY 126 2HA GLY 126 3.227 -5.551 2.522 952 H LYS 127 H LYS 127 3.092 -6.039 4.775 953 HA LYS 127 HA LYS 127 1.394 -8.281 5.258 954 1HB LYS 127 1HB LYS 127 3.417 -9.710 4.983 955 2HB LYS 127 2HB LYS 127 4.234 -8.831 6.292 956 1HG LYS 127 1HG LYS 127 2.386 -9.500 7.885 957 2HG LYS 127 2HG LYS 127 1.582 -10.380 6.586 958 1HD LYS 127 1HD LYS 127 3.618 -11.915 6.377 959 2HD LYS 127 2HD LYS 127 4.411 -11.008 7.656 960 1HE LYS 127 1HE LYS 127 3.561 -12.998 8.688 961 2HE LYS 127 2HE LYS 127 2.558 -11.678 9.283 962 1HZ LYS 127 3HZ LYS 127 1.811 -13.569 7.095 963 2HZ LYS 127 1HZ LYS 127 1.230 -13.596 8.641 964 3HZ LYS 127 2HZ LYS 127 0.855 -12.337 7.640 965 H VAL 128 H VAL 128 0.201 -7.678 6.693 966 HA VAL 128 HA VAL 128 0.655 -5.447 8.549 967 HB VAL 128 HB VAL 128 -1.435 -7.694 8.682 968 1HG1 VAL 128 3HG2 VAL 128 -1.189 -6.416 10.831 969 2HG1 VAL 128 1HG2 VAL 128 -1.356 -4.876 9.950 970 3HG1 VAL 128 2HG2 VAL 128 -2.731 -6.010 10.032 971 1HG2 VAL 128 2HG1 VAL 128 -1.444 -6.452 6.495 972 2HG2 VAL 128 3HG1 VAL 128 -2.883 -6.034 7.462 973 3HG2 VAL 128 1HG1 VAL 128 -1.511 -4.897 7.365 974 H VAL 129 H VAL 129 0.723 -5.431 10.739 975 HA VAL 129 HA VAL 129 1.911 -7.904 12.144 976 HB VAL 129 HB VAL 129 2.867 -4.997 12.374 977 1HG1 VAL 129 3HG2 VAL 129 3.038 -6.324 14.503 978 2HG1 VAL 129 1HG2 VAL 129 3.877 -7.633 13.630 979 3HG1 VAL 129 2HG2 VAL 129 4.654 -6.036 13.805 980 1HG2 VAL 129 2HG1 VAL 129 3.487 -6.069 10.189 981 2HG2 VAL 129 3HG1 VAL 129 4.922 -5.886 11.232 982 3HG2 VAL 129 1HG1 VAL 129 4.143 -7.482 11.056 983 H LYS 130 H LYS 130 0.468 -4.687 12.575 984 HA LYS 130 HA LYS 130 -1.655 -5.519 14.314 985 1HB LYS 130 1HB LYS 130 0.527 -6.169 15.668 986 2HB LYS 130 2HB LYS 130 0.660 -4.445 16.008 987 1HG LYS 130 1HG LYS 130 -1.648 -6.357 16.747 988 2HG LYS 130 2HG LYS 130 -0.524 -5.571 17.837 989 1HD LYS 130 1HD LYS 130 -2.479 -4.292 18.121 990 2HD LYS 130 2HD LYS 130 -1.500 -3.290 17.078 991 1HE LYS 130 1HE LYS 130 -3.749 -3.176 16.223 992 2HE LYS 130 2HE LYS 130 -2.860 -4.150 15.055 993 1HZ LYS 130 1HZ LYS 130 -4.644 -5.221 17.197 994 2HZ LYS 130 2HZ LYS 130 -5.007 -5.127 15.588 995 3HZ LYS 130 3HZ LYS 130 -3.819 -6.150 16.109 996 H GLY 131 H GLY 131 -1.980 -2.087 13.167 997 1HA GLY 131 1HA GLY 131 -1.338 -4.046 11.413 998 2HA GLY 131 2HA GLY 131 -2.075 -5.112 12.614 999 H MET 132 H MET 132 -3.576 -5.825 11.440 1000 HA MET 132 HA MET 132 -5.226 -4.408 9.559 1001 1HB MET 132 1HB MET 132 -4.882 -6.986 9.924 1002 2HB MET 132 2HB MET 132 -6.238 -6.879 11.056 1003 1HG MET 132 1HG MET 132 -7.028 -7.428 8.745 1004 2HG MET 132 2HG MET 132 -7.642 -5.821 9.207 1005 1HE MET 132 3HE MET 132 -7.958 -5.680 6.367 1006 2HE MET 132 2HE MET 132 -6.547 -5.703 5.266 1007 3HE MET 132 1HE MET 132 -7.032 -7.196 6.121 1008 H ASP 133 H ASP 133 -5.570 -4.829 13.004 1009 HA ASP 133 HA ASP 133 -8.336 -4.262 13.476 1010 1HB ASP 133 1HB ASP 133 -6.657 -4.754 15.271 1011 2HB ASP 133 2HB ASP 133 -5.895 -3.176 15.009 1012 H VAL 134 H VAL 134 -5.749 -1.878 13.671 1013 HA VAL 134 HA VAL 134 -7.344 0.517 13.498 1014 HB VAL 134 HB VAL 134 -4.514 0.007 12.409 1015 1HG1 VAL 134 1HG2 VAL 134 -6.003 2.657 12.953 1016 2HG1 VAL 134 2HG2 VAL 134 -4.278 2.503 12.519 1017 3HG1 VAL 134 3HG2 VAL 134 -5.533 2.020 11.352 1018 1HG2 VAL 134 2HG1 VAL 134 -4.808 -0.403 14.880 1019 2HG2 VAL 134 3HG1 VAL 134 -3.834 1.065 14.591 1020 3HG2 VAL 134 1HG1 VAL 134 -5.548 1.209 15.065 1021 H ALA 135 H ALA 135 -5.528 -1.067 10.901 1022 HA ALA 135 HA ALA 135 -6.454 0.395 8.646 1023 1HB ALA 135 2HB ALA 135 -4.773 -1.463 8.480 1024 2HB ALA 135 3HB ALA 135 -6.055 -2.669 8.779 1025 3HB ALA 135 1HB ALA 135 -6.082 -1.685 7.292 1026 H ASP 136 H ASP 136 -7.921 -2.443 10.126 1027 HA ASP 136 HA ASP 136 -10.272 -2.730 8.466 1028 1HB ASP 136 1HB ASP 136 -10.015 -3.177 11.504 1029 2HB ASP 136 2HB ASP 136 -11.321 -3.804 10.483 1030 H LYS 137 H LYS 137 -10.236 -1.392 11.726 1031 HA LYS 137 HA LYS 137 -12.694 -0.056 11.830 1032 1HB LYS 137 1HB LYS 137 -10.021 1.103 12.810 1033 2HB LYS 137 2HB LYS 137 -11.626 1.666 13.306 1034 1HG LYS 137 1HG LYS 137 -12.181 -0.697 14.099 1035 2HG LYS 137 2HG LYS 137 -10.572 -1.212 13.626 1036 1HD LYS 137 1HD LYS 137 -10.490 -0.900 16.007 1037 2HD LYS 137 2HD LYS 137 -9.547 0.388 15.295 1038 1HE LYS 137 1HE LYS 137 -10.809 1.339 17.126 1039 2HE LYS 137 2HE LYS 137 -11.496 2.007 15.652 1040 1HZ LYS 137 1HZ LYS 137 -12.647 -0.256 17.223 1041 2HZ LYS 137 2HZ LYS 137 -13.215 1.295 17.194 1042 3HZ LYS 137 3HZ LYS 137 -13.306 0.357 15.838 1043 H ILE 138 H ILE 138 -9.730 1.146 10.332 1044 HA ILE 138 HA ILE 138 -10.749 3.715 9.351 1045 HB ILE 138 HB ILE 138 -8.704 1.828 8.039 1046 1HG1 ILE 138 1HG1 ILE 138 -8.461 4.154 10.039 1047 2HG1 ILE 138 2HG1 ILE 138 -8.051 2.462 10.344 1048 1HG2 ILE 138 2HG2 ILE 138 -9.662 3.556 6.481 1049 2HG2 ILE 138 3HG2 ILE 138 -9.296 4.839 7.663 1050 3HG2 ILE 138 1HG2 ILE 138 -7.967 3.941 6.883 1051 1HD1 ILE 138 3HD1 ILE 138 -6.667 4.291 8.258 1052 2HD1 ILE 138 1HD1 ILE 138 -5.981 3.805 9.830 1053 3HD1 ILE 138 2HD1 ILE 138 -6.242 2.584 8.555 1054 H SER 139 H SER 139 -10.352 0.576 7.778 1055 HA SER 139 HA SER 139 -11.955 1.183 5.419 1056 1HB SER 139 1HB SER 139 -11.879 -1.274 5.003 1057 2HB SER 139 2HB SER 139 -10.290 -0.645 5.479 1058 HG SER 139 HG SER 139 -10.762 -1.300 7.619 1059 H GLN 140 H GLN 140 -13.037 1.109 8.396 1060 HA GLN 140 HA GLN 140 -15.837 0.008 7.718 1061 1HB GLN 140 1HB GLN 140 -14.544 0.816 10.384 1062 2HB GLN 140 2HB GLN 140 -16.286 0.613 10.182 1063 1HG GLN 140 1HG GLN 140 -15.364 -1.500 10.997 1064 2HG GLN 140 2HG GLN 140 -15.982 -1.725 9.362 1065 1HE2 GLN 140 2HE2 GLN 140 -12.762 -2.455 7.963 1066 2HE2 GLN 140 1HE2 GLN 140 -14.482 -1.926 7.624 1067 H VAL 141 H VAL 141 -14.112 2.788 9.059 1068 HA VAL 141 HA VAL 141 -16.141 4.729 9.310 1069 HB VAL 141 HB VAL 141 -14.452 6.450 8.727 1070 1HG1 VAL 141 3HG2 VAL 141 -14.350 5.308 10.960 1071 2HG1 VAL 141 1HG2 VAL 141 -13.288 4.048 10.282 1072 3HG1 VAL 141 2HG2 VAL 141 -12.712 5.733 10.396 1073 1HG2 VAL 141 2HG1 VAL 141 -13.490 5.316 6.701 1074 2HG2 VAL 141 3HG1 VAL 141 -12.200 5.736 7.859 1075 3HG2 VAL 141 1HG1 VAL 141 -12.774 4.051 7.734 1076 HA PRO 142 HA PRO 142 -18.446 4.878 5.564 1077 1HB PRO 142 1HB PRO 142 -18.588 7.740 6.648 1078 2HB PRO 142 2HB PRO 142 -19.919 6.748 6.003 1079 1HG PRO 142 1HG PRO 142 -19.651 6.939 8.694 1080 2HG PRO 142 2HG PRO 142 -19.930 5.328 7.988 1081 1HD PRO 142 1HD PRO 142 -17.280 6.500 8.981 1082 2HD PRO 142 2HD PRO 142 -17.904 4.827 9.154 1083 H THR 143 H THR 143 -18.748 6.565 3.842 1084 HA THR 143 HA THR 143 -16.329 8.178 3.018 1085 HB THR 143 HB THR 143 -16.260 6.869 0.786 1086 HG1 THR 143 HG1 THR 143 -16.877 4.697 0.992 1087 1HG2 THR 143 2HG2 THR 143 -14.433 6.774 2.446 1088 2HG2 THR 143 3HG2 THR 143 -15.266 5.448 3.318 1089 3HG2 THR 143 1HG2 THR 143 -14.658 5.193 1.647 1090 H HIS 144 H HIS 144 -16.794 7.574 0.384 1091 HA HIS 144 HA HIS 144 -19.483 7.798 -0.562 1092 1HB HIS 144 1HB HIS 144 -19.806 10.170 -1.143 1093 2HB HIS 144 2HB HIS 144 -19.640 9.963 0.599 1094 HD2 HIS 144 HD2 HIS 144 -16.294 9.728 -1.211 1095 HE1 HIS 144 HE1 HIS 144 -16.547 13.670 0.086 1096 HE2 HIS 144 HE2 HIS 144 -14.902 11.970 -0.924 1097 H ASP 145 H ASP 145 -19.751 7.713 -2.557 1098 HA ASP 145 HA ASP 145 -17.454 7.395 -4.469 1099 1HB ASP 145 1HB ASP 145 -19.564 6.101 -4.754 1100 2HB ASP 145 2HB ASP 145 -20.483 7.615 -4.926 1101 H VAL 146 H VAL 146 -16.428 8.989 -4.969 1102 HA VAL 146 HA VAL 146 -17.352 11.785 -4.549 1103 HB VAL 146 HB VAL 146 -14.739 11.073 -5.939 1104 1HG1 VAL 146 3HG2 VAL 146 -15.395 13.487 -5.572 1105 2HG1 VAL 146 1HG2 VAL 146 -15.600 13.164 -3.829 1106 3HG1 VAL 146 2HG2 VAL 146 -13.982 13.050 -4.568 1107 1HG2 VAL 146 1HG1 VAL 146 -15.327 10.802 -2.926 1108 2HG2 VAL 146 2HG1 VAL 146 -14.922 9.464 -4.038 1109 3HG2 VAL 146 3HG1 VAL 146 -13.711 10.724 -3.684 1110 H GLY 147 H GLY 147 -15.639 12.784 -6.702 1111 1HA GLY 147 1HA GLY 147 -17.627 13.255 -8.877 1112 2HA GLY 147 2HA GLY 147 -15.900 13.665 -8.944 1113 HA PRO 148 HA PRO 148 -15.308 10.107 -11.631 1114 1HB PRO 148 1HB PRO 148 -12.561 10.288 -11.659 1115 2HB PRO 148 2HB PRO 148 -13.579 11.528 -12.430 1116 1HG PRO 148 1HG PRO 148 -12.331 11.629 -9.628 1117 2HG PRO 148 2HG PRO 148 -12.221 12.867 -10.904 1118 1HD PRO 148 1HD PRO 148 -14.113 13.028 -8.873 1119 2HD PRO 148 2HD PRO 148 -14.510 13.581 -10.532 1120 OH TYR 149 OH TYR 149 -7.745 11.026 -10.542 1121 H TYR 149 H TYR 149 -13.108 10.642 -8.909 1122 HA TYR 149 HA TYR 149 -12.540 7.795 -8.437 1123 1HB TYR 149 1HB TYR 149 -12.167 10.175 -6.519 1124 2HB TYR 149 2HB TYR 149 -11.391 8.596 -6.385 1125 HD1 TYR 149 HD1 TYR 149 -9.742 7.896 -8.079 1126 HD2 TYR 149 HD2 TYR 149 -11.447 11.756 -8.175 1127 HE1 TYR 149 HE1 TYR 149 -7.977 8.641 -9.576 1128 HE2 TYR 149 HE2 TYR 149 -9.681 12.498 -9.671 1129 HH TYR 149 HH TYR 149 -7.886 11.951 -10.755 1130 H GLN 150 H GLN 150 -14.150 6.565 -8.064 1131 HA GLN 150 HA GLN 150 -16.330 7.207 -6.052 1132 1HB GLN 150 1HB GLN 150 -15.824 4.686 -7.740 1133 2HB GLN 150 2HB GLN 150 -17.265 5.021 -6.770 1134 1HG GLN 150 1HG GLN 150 -17.700 7.107 -8.138 1135 2HG GLN 150 2HG GLN 150 -16.263 6.767 -9.108 1136 1HE2 GLN 150 2HE2 GLN 150 -19.356 4.003 -9.427 1137 2HE2 GLN 150 1HE2 GLN 150 -18.845 4.681 -7.801 1138 H ASN 151 H ASN 151 -14.097 7.398 -4.783 1139 HA ASN 151 HA ASN 151 -14.224 5.379 -2.641 1140 1HB ASN 151 1HB ASN 151 -11.787 5.192 -4.519 1141 2HB ASN 151 2HB ASN 151 -11.869 4.484 -2.903 1142 1HD2 ASN 151 1HD2 ASN 151 -12.861 1.760 -5.198 1143 2HD2 ASN 151 2HD2 ASN 151 -11.384 2.774 -4.805 1144 H VAL 152 H VAL 152 -14.610 7.430 -1.780 1145 HA VAL 152 HA VAL 152 -12.084 8.451 -0.480 1146 HB VAL 152 HB VAL 152 -13.976 10.346 -1.983 1147 1HG1 VAL 152 3HG2 VAL 152 -13.079 11.273 0.172 1148 2HG1 VAL 152 1HG2 VAL 152 -11.417 10.863 -0.326 1149 3HG1 VAL 152 2HG2 VAL 152 -12.337 12.102 -1.222 1150 1HG2 VAL 152 2HG1 VAL 152 -12.438 9.086 -3.526 1151 2HG2 VAL 152 3HG1 VAL 152 -11.955 10.799 -3.424 1152 3HG2 VAL 152 1HG1 VAL 152 -11.034 9.558 -2.533 1153 HA PRO 153 HA PRO 153 -15.138 7.673 2.698 1154 1HB PRO 153 1HB PRO 153 -12.597 8.676 4.086 1155 2HB PRO 153 2HB PRO 153 -13.642 7.315 4.564 1156 1HG PRO 153 1HG PRO 153 -11.315 6.772 3.274 1157 2HG PRO 153 2HG PRO 153 -12.791 5.924 2.751 1158 1HD PRO 153 1HD PRO 153 -11.443 8.328 1.406 1159 2HD PRO 153 2HD PRO 153 -12.179 6.880 0.643 1160 H SER 154 H SER 154 -16.543 9.231 2.354 1161 HA SER 154 HA SER 154 -16.422 12.003 2.102 1162 1HB SER 154 1HB SER 154 -18.562 10.757 2.182 1163 2HB SER 154 2HB SER 154 -18.354 10.432 3.910 1164 HG SER 154 HG SER 154 -19.682 12.234 3.499 1165 H LYS 155 H LYS 155 -16.528 10.286 5.168 1166 HA LYS 155 HA LYS 155 -15.152 12.562 6.688 1167 1HB LYS 155 1HB LYS 155 -15.986 9.733 7.569 1168 2HB LYS 155 2HB LYS 155 -15.292 10.974 8.616 1169 1HG LYS 155 1HG LYS 155 -17.951 11.125 7.070 1170 2HG LYS 155 2HG LYS 155 -17.800 10.929 8.810 1171 1HD LYS 155 1HD LYS 155 -16.848 13.410 7.218 1172 2HD LYS 155 2HD LYS 155 -18.417 13.267 8.000 1173 1HE LYS 155 1HE LYS 155 -17.294 13.022 10.267 1174 2HE LYS 155 2HE LYS 155 -15.709 13.197 9.500 1175 1HZ LYS 155 2HZ LYS 155 -17.868 15.249 9.447 1176 2HZ LYS 155 3HZ LYS 155 -16.502 15.301 10.374 1177 3HZ LYS 155 1HZ LYS 155 -16.389 15.410 8.729 1178 HA PRO 156 HA PRO 156 -11.884 10.153 4.530 1179 1HB PRO 156 1HB PRO 156 -10.324 12.338 3.879 1180 2HB PRO 156 2HB PRO 156 -11.850 11.962 3.044 1181 1HG PRO 156 1HG PRO 156 -11.437 13.934 5.358 1182 2HG PRO 156 2HG PRO 156 -12.242 14.248 3.799 1183 1HD PRO 156 1HD PRO 156 -13.708 13.596 6.050 1184 2HD PRO 156 2HD PRO 156 -14.199 12.954 4.449 1185 H VAL 157 H VAL 157 -10.146 9.298 5.182 1186 HA VAL 157 HA VAL 157 -8.980 9.775 7.883 1187 HB VAL 157 HB VAL 157 -7.917 8.157 5.495 1188 1HG1 VAL 157 3HG2 VAL 157 -6.137 8.752 7.162 1189 2HG1 VAL 157 1HG2 VAL 157 -7.151 8.126 8.488 1190 3HG1 VAL 157 2HG2 VAL 157 -6.520 7.012 7.245 1191 1HG2 VAL 157 2HG1 VAL 157 -10.164 7.368 6.305 1192 2HG2 VAL 157 3HG1 VAL 157 -8.888 6.198 6.730 1193 3HG2 VAL 157 1HG1 VAL 157 -9.544 7.292 7.976 1194 H VAL 158 H VAL 158 -6.952 10.399 8.344 1195 HA VAL 158 HA VAL 158 -5.225 11.790 6.268 1196 HB VAL 158 HB VAL 158 -6.193 13.169 8.844 1197 1HG1 VAL 158 3HG2 VAL 158 -3.766 13.590 8.338 1198 2HG1 VAL 158 1HG2 VAL 158 -4.182 14.064 6.672 1199 3HG1 VAL 158 2HG2 VAL 158 -4.730 15.060 8.046 1200 1HG2 VAL 158 2HG1 VAL 158 -7.873 13.221 6.970 1201 2HG2 VAL 158 3HG1 VAL 158 -7.173 14.841 7.233 1202 3HG2 VAL 158 1HG1 VAL 158 -6.627 13.844 5.858 1203 H ILE 159 H ILE 159 -3.446 10.993 6.403 1204 HA ILE 159 HA ILE 159 -2.588 9.190 8.543 1205 HB ILE 159 HB ILE 159 -1.035 10.444 6.216 1206 1HG1 ILE 159 1HG1 ILE 159 -2.497 7.780 6.723 1207 2HG1 ILE 159 2HG1 ILE 159 -2.977 9.038 5.577 1208 1HG2 ILE 159 3HG2 ILE 159 -0.286 8.114 8.104 1209 2HG2 ILE 159 1HG2 ILE 159 0.620 8.602 6.645 1210 3HG2 ILE 159 2HG2 ILE 159 0.519 9.704 8.042 1211 1HD1 ILE 159 3HD1 ILE 159 -0.347 7.412 5.456 1212 2HD1 ILE 159 1HD1 ILE 159 -1.768 7.173 4.403 1213 3HD1 ILE 159 2HD1 ILE 159 -0.816 8.682 4.290 1214 H LEU 160 H LEU 160 -1.428 9.335 10.111 1215 HA LEU 160 HA LEU 160 -0.714 12.010 11.335 1216 1HB LEU 160 1HB LEU 160 -0.264 9.144 12.367 1217 2HB LEU 160 2HB LEU 160 0.023 10.631 13.282 1218 HG LEU 160 HG LEU 160 -2.674 9.750 12.093 1219 1HD1 LEU 160 2HD1 LEU 160 -1.980 8.421 14.114 1220 2HD1 LEU 160 3HD1 LEU 160 -1.710 9.929 15.026 1221 3HD1 LEU 160 1HD1 LEU 160 -3.355 9.487 14.500 1222 1HD2 LEU 160 3HD2 LEU 160 -2.399 12.247 12.086 1223 2HD2 LEU 160 1HD2 LEU 160 -3.602 11.749 13.303 1224 3HD2 LEU 160 2HD2 LEU 160 -1.959 12.216 13.814 1225 H SER 161 H SER 161 0.884 8.978 10.483 1226 HA SER 161 HA SER 161 3.262 10.366 9.311 1227 1HB SER 161 1HB SER 161 3.581 8.797 11.946 1228 2HB SER 161 2HB SER 161 4.912 9.415 10.949 1229 HG SER 161 HG SER 161 4.343 10.824 12.638 1230 H ALA 162 H ALA 162 5.116 8.543 9.544 1231 HA ALA 162 HA ALA 162 4.451 5.774 8.902 1232 1HB ALA 162 3HB ALA 162 4.696 7.624 6.433 1233 2HB ALA 162 1HB ALA 162 4.617 5.843 6.396 1234 3HB ALA 162 2HB ALA 162 3.212 6.785 6.956 1235 H LYS 163 H LYS 163 6.168 4.843 9.356 1236 HA LYS 163 HA LYS 163 8.872 5.594 8.279 1237 1HB LYS 163 1HB LYS 163 8.254 5.841 11.285 1238 2HB LYS 163 2HB LYS 163 9.855 5.998 10.543 1239 1HG LYS 163 1HG LYS 163 9.025 7.939 9.156 1240 2HG LYS 163 2HG LYS 163 7.423 7.780 9.878 1241 1HD LYS 163 1HD LYS 163 8.397 8.256 12.164 1242 2HD LYS 163 2HD LYS 163 10.002 8.428 11.474 1243 1HE LYS 163 1HE LYS 163 7.580 10.224 10.748 1244 2HE LYS 163 2HE LYS 163 8.780 10.613 11.977 1245 1HZ LYS 163 1HZ LYS 163 10.501 10.609 10.256 1246 2HZ LYS 163 2HZ LYS 163 9.391 10.246 9.087 1247 3HZ LYS 163 3HZ LYS 163 9.305 11.688 9.889 1248 H VAL 164 H VAL 164 9.903 3.902 7.946 1249 HA VAL 164 HA VAL 164 9.054 1.226 8.812 1250 HB VAL 164 HB VAL 164 11.142 0.501 7.706 1251 1HG1 VAL 164 3HG2 VAL 164 9.138 1.074 6.309 1252 2HG1 VAL 164 1HG2 VAL 164 9.686 2.767 6.197 1253 3HG1 VAL 164 2HG2 VAL 164 10.644 1.467 5.437 1254 1HG2 VAL 164 2HG1 VAL 164 12.645 2.328 8.547 1255 2HG2 VAL 164 3HG1 VAL 164 12.731 2.214 6.769 1256 3HG2 VAL 164 1HG1 VAL 164 11.784 3.517 7.536 1257 H LEU 165 H LEU 165 9.716 -0.026 10.303 1258 HA LEU 165 HA LEU 165 12.117 0.514 12.059 1259 1HB LEU 165 1HB LEU 165 10.361 2.041 13.010 1260 2HB LEU 165 2HB LEU 165 9.250 0.674 13.184 1261 HG LEU 165 HG LEU 165 10.887 -0.487 14.684 1262 1HD1 LEU 165 2HD1 LEU 165 12.992 0.494 13.725 1263 2HD1 LEU 165 3HD1 LEU 165 12.557 2.096 14.377 1264 3HD1 LEU 165 1HD1 LEU 165 12.922 0.750 15.488 1265 1HD2 LEU 165 3HD2 LEU 165 9.148 1.023 15.694 1266 2HD2 LEU 165 1HD2 LEU 165 10.652 1.063 16.650 1267 3HD2 LEU 165 2HD2 LEU 165 10.257 2.412 15.553 1268 HA PRO 166 HA PRO 166 12.294 -3.861 11.769 1269 1HB PRO 166 1HB PRO 166 13.877 -3.159 14.296 1270 2HB PRO 166 2HB PRO 166 14.341 -4.276 12.988 1271 1HG PRO 166 1HG PRO 166 15.422 -1.787 13.005 1272 2HG PRO 166 2HG PRO 166 14.796 -2.426 11.464 1273 1HD PRO 166 1HD PRO 166 13.446 -0.412 13.337 1274 2HD PRO 166 2HD PRO 166 13.502 -0.416 11.544 Start of MODEL 10 Raw file had 1274 H/Q atoms Start of MODEL 10 1 1H ALA 1 3H ALA 1 22.119 -11.331 11.812 2 2H ALA 1 1H ALA 1 21.577 -11.636 13.343 3 3H ALA 1 2H ALA 1 22.309 -12.834 12.471 4 HA ALA 1 HA ALA 1 20.505 -12.861 10.848 5 1HB ALA 1 1HB ALA 1 20.375 -14.402 12.833 6 2HB ALA 1 2HB ALA 1 19.573 -13.127 13.789 7 3HB ALA 1 3HB ALA 1 18.751 -13.834 12.373 8 H LYS 2 H LYS 2 19.442 -11.186 13.768 9 HA LYS 2 HA LYS 2 18.496 -8.955 13.953 10 1HB LYS 2 1HB LYS 2 19.671 -8.360 11.831 11 2HB LYS 2 2HB LYS 2 18.382 -9.122 10.884 12 1HG LYS 2 1HG LYS 2 16.693 -7.573 11.932 13 2HG LYS 2 2HG LYS 2 17.950 -6.800 12.882 14 1HD LYS 2 1HD LYS 2 17.810 -6.818 9.794 15 2HD LYS 2 2HD LYS 2 17.205 -5.519 10.796 16 1HE LYS 2 1HE LYS 2 20.182 -6.361 10.642 17 2HE LYS 2 2HE LYS 2 19.449 -5.040 9.742 18 1HZ LYS 2 2HZ LYS 2 18.917 -3.940 11.849 19 2HZ LYS 2 3HZ LYS 2 19.600 -5.171 12.712 20 3HZ LYS 2 1HZ LYS 2 20.539 -4.232 11.730 21 H GLY 3 H GLY 3 16.671 -9.028 11.186 22 1HA GLY 3 1HA GLY 3 14.445 -10.827 11.933 23 2HA GLY 3 2HA GLY 3 14.098 -9.184 12.509 24 H ASP 4 H ASP 4 13.004 -8.024 11.246 25 HA ASP 4 HA ASP 4 13.419 -7.771 8.302 26 1HB ASP 4 1HB ASP 4 10.923 -9.245 9.352 27 2HB ASP 4 2HB ASP 4 11.106 -8.624 7.704 28 HA PRO 5 HA PRO 5 12.034 -3.773 9.288 29 1HB PRO 5 1HB PRO 5 11.333 -3.991 6.318 30 2HB PRO 5 2HB PRO 5 12.185 -2.666 7.149 31 1HG PRO 5 1HG PRO 5 13.656 -4.471 5.758 32 2HG PRO 5 2HG PRO 5 14.206 -4.013 7.389 33 1HD PRO 5 1HD PRO 5 12.719 -6.565 6.566 34 2HD PRO 5 2HD PRO 5 14.077 -6.380 7.723 35 H HIS 6 H HIS 6 10.292 -2.515 9.407 36 HA HIS 6 HA HIS 6 7.544 -3.445 8.535 37 1HB HIS 6 1HB HIS 6 8.281 -3.101 11.512 38 2HB HIS 6 2HB HIS 6 6.656 -3.380 10.877 39 HD2 HIS 6 HD2 HIS 6 8.996 -5.383 8.786 40 HE1 HIS 6 HE1 HIS 6 7.880 -8.003 11.821 41 HE2 HIS 6 HE2 HIS 6 9.048 -7.936 9.528 42 H VAL 7 H VAL 7 6.684 -1.845 7.734 43 HA VAL 7 HA VAL 7 7.403 0.997 8.221 44 HB VAL 7 HB VAL 7 6.354 0.225 6.062 45 1HG1 VAL 7 1HG2 VAL 7 3.870 -0.257 7.831 46 2HG1 VAL 7 2HG2 VAL 7 3.918 -0.370 6.051 47 3HG1 VAL 7 3HG2 VAL 7 4.842 -1.527 7.044 48 1HG2 VAL 7 1HG1 VAL 7 4.646 2.212 7.690 49 2HG2 VAL 7 2HG1 VAL 7 6.140 2.611 6.804 50 3HG2 VAL 7 3HG1 VAL 7 4.687 2.090 5.911 51 H LEU 8 H LEU 8 6.559 2.418 9.505 52 HA LEU 8 HA LEU 8 3.890 1.836 10.926 53 1HB LEU 8 1HB LEU 8 6.315 3.304 12.104 54 2HB LEU 8 2HB LEU 8 4.655 3.522 12.673 55 HG LEU 8 HG LEU 8 4.490 0.925 12.756 56 1HD1 LEU 8 2HD1 LEU 8 6.622 0.451 11.527 57 2HD1 LEU 8 3HD1 LEU 8 7.558 1.257 12.814 58 3HD1 LEU 8 1HD1 LEU 8 6.666 -0.249 13.167 59 1HD2 LEU 8 3HD2 LEU 8 4.458 2.407 14.751 60 2HD2 LEU 8 1HD2 LEU 8 5.379 0.923 15.092 61 3HD2 LEU 8 2HD2 LEU 8 6.240 2.458 14.778 62 H LEU 9 H LEU 9 2.459 2.989 10.633 63 HA LEU 9 HA LEU 9 2.782 5.953 9.932 64 1HB LEU 9 1HB LEU 9 0.731 4.049 8.644 65 2HB LEU 9 2HB LEU 9 0.573 5.806 8.669 66 HG LEU 9 HG LEU 9 2.826 6.029 7.553 67 1HD1 LEU 9 2HD1 LEU 9 3.792 3.803 8.204 68 2HD1 LEU 9 3HD1 LEU 9 2.568 2.970 7.206 69 3HD1 LEU 9 1HD1 LEU 9 3.798 4.004 6.432 70 1HD2 LEU 9 3HD2 LEU 9 0.687 6.128 6.241 71 2HD2 LEU 9 1HD2 LEU 9 1.981 5.366 5.282 72 3HD2 LEU 9 2HD2 LEU 9 0.717 4.357 6.033 73 H THR 10 H THR 10 0.524 6.905 10.181 74 HA THR 10 HA THR 10 -1.152 5.816 12.405 75 HB THR 10 HB THR 10 0.613 8.303 12.878 76 HG1 THR 10 HG1 THR 10 1.641 6.293 13.134 77 1HG2 THR 10 3HG2 THR 10 -1.508 6.932 14.664 78 2HG2 THR 10 1HG2 THR 10 -0.482 8.311 15.144 79 3HG2 THR 10 2HG2 THR 10 -1.700 8.511 13.857 80 H THR 11 H THR 11 -2.669 6.002 10.995 81 HA THR 11 HA THR 11 -3.444 8.623 9.695 82 HB THR 11 HB THR 11 -5.519 7.337 9.048 83 HG1 THR 11 HG1 THR 11 -5.404 5.096 9.419 84 1HG2 THR 11 3HG2 THR 11 -2.808 6.010 8.407 85 2HG2 THR 11 1HG2 THR 11 -4.303 5.850 7.438 86 3HG2 THR 11 2HG2 THR 11 -3.494 7.435 7.580 87 H SER 12 H SER 12 -5.637 9.273 9.926 88 HA SER 12 HA SER 12 -6.264 10.475 12.426 89 1HB SER 12 1HB SER 12 -8.626 10.624 11.641 90 2HB SER 12 2HB SER 12 -7.492 10.998 10.329 91 HG SER 12 HG SER 12 -9.121 9.544 9.703 92 H ALA 13 H ALA 13 -7.216 7.310 11.222 93 HA ALA 13 HA ALA 13 -8.861 6.455 13.452 94 1HB ALA 13 2HB ALA 13 -8.781 5.225 11.276 95 2HB ALA 13 3HB ALA 13 -7.104 4.720 11.607 96 3HB ALA 13 1HB ALA 13 -8.438 4.130 12.635 97 H GLY 14 H GLY 14 -5.593 5.722 12.720 98 1HA GLY 14 1HA GLY 14 -4.356 6.162 15.287 99 2HA GLY 14 2HA GLY 14 -4.963 4.510 15.398 100 H ASN 15 H ASN 15 -2.600 4.665 15.869 101 HA ASN 15 HA ASN 15 -0.575 4.422 13.725 102 1HB ASN 15 1HB ASN 15 -0.024 4.723 16.147 103 2HB ASN 15 2HB ASN 15 -0.689 3.122 16.512 104 1HD2 ASN 15 1HD2 ASN 15 2.973 2.655 16.023 105 2HD2 ASN 15 2HD2 ASN 15 1.834 3.516 17.177 106 H ILE 16 H ILE 16 0.329 2.643 12.886 107 HA ILE 16 HA ILE 16 -0.721 -0.107 13.247 108 HB ILE 16 HB ILE 16 -1.582 -0.390 10.903 109 1HG1 ILE 16 1HG1 ILE 16 -1.399 2.684 10.903 110 2HG1 ILE 16 2HG1 ILE 16 -0.473 1.589 9.867 111 1HG2 ILE 16 2HG2 ILE 16 -3.093 -0.100 12.865 112 2HG2 ILE 16 3HG2 ILE 16 -3.047 1.671 12.658 113 3HG2 ILE 16 1HG2 ILE 16 -3.799 0.643 11.404 114 1HD1 ILE 16 3HD1 ILE 16 -3.562 1.837 9.887 115 2HD1 ILE 16 1HD1 ILE 16 -2.476 2.500 8.636 116 3HD1 ILE 16 2HD1 ILE 16 -2.633 0.733 8.838 117 H GLU 17 H GLU 17 0.029 -1.561 11.638 118 HA GLU 17 HA GLU 17 2.984 -0.991 10.942 119 1HB GLU 17 1HB GLU 17 2.014 -3.365 12.604 120 2HB GLU 17 2HB GLU 17 3.662 -2.753 12.443 121 1HG GLU 17 1HG GLU 17 1.283 -1.353 13.844 122 2HG GLU 17 2HG GLU 17 2.643 -2.124 14.657 123 H LEU 18 H LEU 18 3.215 -1.599 8.980 124 HA LEU 18 HA LEU 18 2.221 -4.350 8.022 125 1HB LEU 18 1HB LEU 18 3.642 -2.120 6.447 126 2HB LEU 18 2HB LEU 18 3.260 -3.731 5.839 127 HG LEU 18 HG LEU 18 1.464 -2.400 5.071 128 1HD1 LEU 18 1HD1 LEU 18 0.723 -4.555 6.144 129 2HD1 LEU 18 2HD1 LEU 18 0.513 -3.715 7.703 130 3HD1 LEU 18 3HD1 LEU 18 -0.526 -3.295 6.316 131 1HD2 LEU 18 3HD2 LEU 18 1.897 -0.381 6.465 132 2HD2 LEU 18 1HD2 LEU 18 0.171 -0.819 6.507 133 3HD2 LEU 18 2HD2 LEU 18 1.223 -1.201 7.901 134 H GLU 19 H GLU 19 3.551 -5.868 7.503 135 HA GLU 19 HA GLU 19 6.549 -5.608 8.207 136 1HB GLU 19 1HB GLU 19 6.517 -8.074 8.549 137 2HB GLU 19 2HB GLU 19 5.527 -7.183 9.701 138 1HG GLU 19 1HG GLU 19 4.220 -9.105 9.032 139 2HG GLU 19 2HG GLU 19 3.453 -7.682 8.336 140 H LEU 20 H LEU 20 7.613 -5.286 6.557 141 HA LEU 20 HA LEU 20 6.531 -5.856 3.807 142 1HB LEU 20 1HB LEU 20 9.074 -4.407 4.744 143 2HB LEU 20 2HB LEU 20 8.567 -4.590 3.063 144 HG LEU 20 HG LEU 20 6.315 -3.543 3.678 145 1HD1 LEU 20 3HD1 LEU 20 7.828 -2.770 6.261 146 2HD1 LEU 20 1HD1 LEU 20 6.248 -2.117 5.753 147 3HD1 LEU 20 2HD1 LEU 20 6.405 -3.840 6.170 148 1HD2 LEU 20 3HD2 LEU 20 8.117 -2.262 2.499 149 2HD2 LEU 20 1HD2 LEU 20 7.218 -1.208 3.619 150 3HD2 LEU 20 2HD2 LEU 20 8.837 -1.805 4.067 151 H ASP 21 H ASP 21 8.937 -6.056 2.456 152 HA ASP 21 HA ASP 21 10.433 -8.524 3.118 153 1HB ASP 21 1HB ASP 21 8.139 -9.500 2.805 154 2HB ASP 21 2HB ASP 21 8.029 -8.754 1.201 155 H LYS 22 H LYS 22 12.173 -7.953 2.302 156 HA LYS 22 HA LYS 22 12.399 -6.542 -0.397 157 1HB LYS 22 1HB LYS 22 13.592 -5.627 1.568 158 2HB LYS 22 2HB LYS 22 14.404 -7.178 1.833 159 1HG LYS 22 1HG LYS 22 15.471 -7.026 -0.453 160 2HG LYS 22 2HG LYS 22 14.610 -5.527 -0.759 161 1HD LYS 22 1HD LYS 22 16.868 -4.908 -0.185 162 2HD LYS 22 2HD LYS 22 15.832 -4.393 1.125 163 1HE LYS 22 1HE LYS 22 17.851 -5.278 2.112 164 2HE LYS 22 2HE LYS 22 16.571 -6.419 2.503 165 1HZ LYS 22 2HZ LYS 22 18.572 -6.750 0.312 166 2HZ LYS 22 3HZ LYS 22 18.574 -7.546 1.759 167 3HZ LYS 22 1HZ LYS 22 17.374 -7.833 0.661 168 H GLN 23 H GLN 23 13.313 -9.476 1.290 169 HA GLN 23 HA GLN 23 15.421 -10.479 -0.227 170 1HB GLN 23 1HB GLN 23 14.758 -12.761 0.396 171 2HB GLN 23 2HB GLN 23 14.521 -11.636 1.730 172 1HG GLN 23 1HG GLN 23 12.548 -12.986 1.727 173 2HG GLN 23 2HG GLN 23 12.038 -11.449 1.022 174 1HE2 GLN 23 2HE2 GLN 23 12.687 -14.544 -1.684 175 2HE2 GLN 23 1HE2 GLN 23 13.893 -14.164 -0.355 176 H LYS 24 H LYS 24 12.075 -10.408 -1.224 177 HA LYS 24 HA LYS 24 12.803 -11.683 -3.931 178 1HB LYS 24 1HB LYS 24 10.961 -12.738 -2.594 179 2HB LYS 24 2HB LYS 24 10.068 -11.214 -2.634 180 1HG LYS 24 1HG LYS 24 9.304 -12.736 -4.478 181 2HG LYS 24 2HG LYS 24 9.987 -11.238 -5.096 182 1HD LYS 24 1HD LYS 24 10.836 -12.966 -6.502 183 2HD LYS 24 2HD LYS 24 12.197 -12.408 -5.537 184 1HE LYS 24 1HE LYS 24 11.925 -14.444 -4.009 185 2HE LYS 24 2HE LYS 24 10.542 -14.976 -4.975 186 1HZ LYS 24 3HZ LYS 24 12.033 -15.145 -6.902 187 2HZ LYS 24 1HZ LYS 24 13.323 -14.646 -5.998 188 3HZ LYS 24 2HZ LYS 24 12.578 -16.081 -5.655 189 H ALA 25 H ALA 25 12.782 -8.701 -2.699 190 HA ALA 25 HA ALA 25 12.368 -7.474 -5.399 191 1HB ALA 25 2HB ALA 25 9.989 -7.611 -4.588 192 2HB ALA 25 3HB ALA 25 10.430 -6.713 -3.111 193 3HB ALA 25 1HB ALA 25 10.529 -5.917 -4.703 194 HA PRO 26 HA PRO 26 15.622 -5.645 -2.582 195 1HB PRO 26 1HB PRO 26 16.955 -5.939 -5.311 196 2HB PRO 26 2HB PRO 26 17.662 -6.242 -3.706 197 1HG PRO 26 1HG PRO 26 16.913 -8.365 -5.230 198 2HG PRO 26 2HG PRO 26 16.485 -8.363 -3.501 199 1HD PRO 26 1HD PRO 26 14.665 -7.656 -5.873 200 2HD PRO 26 2HD PRO 26 14.292 -8.660 -4.434 201 H VAL 27 H VAL 27 15.274 -5.104 -6.057 202 HA VAL 27 HA VAL 27 16.101 -2.355 -6.157 203 HB VAL 27 HB VAL 27 14.020 -3.770 -7.924 204 1HG1 VAL 27 3HG2 VAL 27 13.996 -1.271 -8.166 205 2HG1 VAL 27 1HG2 VAL 27 15.760 -1.266 -8.425 206 3HG1 VAL 27 2HG2 VAL 27 14.685 -2.039 -9.620 207 1HG2 VAL 27 2HG1 VAL 27 16.214 -4.987 -7.791 208 2HG2 VAL 27 3HG1 VAL 27 16.001 -4.245 -9.398 209 3HG2 VAL 27 1HG1 VAL 27 17.085 -3.486 -8.201 210 H SER 28 H SER 28 12.781 -3.453 -6.559 211 HA SER 28 HA SER 28 11.471 -0.960 -6.364 212 1HB SER 28 1HB SER 28 9.423 -2.210 -5.655 213 2HB SER 28 2HB SER 28 10.278 -3.016 -6.982 214 HG SER 28 HG SER 28 9.686 -4.442 -5.319 215 H VAL 29 H VAL 29 11.974 -3.225 -3.683 216 HA VAL 29 HA VAL 29 10.787 -1.621 -1.609 217 HB VAL 29 HB VAL 29 13.186 -3.473 -1.174 218 1HG1 VAL 29 3HG2 VAL 29 12.380 -2.103 0.792 219 2HG1 VAL 29 1HG2 VAL 29 10.720 -2.698 0.528 220 3HG1 VAL 29 2HG2 VAL 29 12.000 -3.833 1.029 221 1HG2 VAL 29 1HG1 VAL 29 10.194 -4.191 -1.486 222 2HG2 VAL 29 2HG1 VAL 29 11.490 -4.629 -2.628 223 3HG2 VAL 29 3HG1 VAL 29 11.482 -5.319 -0.985 224 H GLN 30 H GLN 30 14.137 -1.771 -2.714 225 HA GLN 30 HA GLN 30 15.437 0.039 -0.931 226 1HB GLN 30 1HB GLN 30 16.598 -1.121 -2.822 227 2HB GLN 30 2HB GLN 30 15.747 -0.108 -3.996 228 1HG GLN 30 1HG GLN 30 18.020 0.807 -3.562 229 2HG GLN 30 2HG GLN 30 16.785 1.952 -3.027 230 1HE2 GLN 30 2HE2 GLN 30 18.098 2.000 0.267 231 2HE2 GLN 30 1HE2 GLN 30 17.165 2.802 -1.094 232 H ASN 31 H ASN 31 14.013 0.927 -4.045 233 HA ASN 31 HA ASN 31 13.951 3.759 -3.842 234 1HB ASN 31 1HB ASN 31 11.681 1.970 -4.919 235 2HB ASN 31 2HB ASN 31 11.885 3.690 -5.268 236 1HD2 ASN 31 1HD2 ASN 31 14.450 0.943 -7.007 237 2HD2 ASN 31 2HD2 ASN 31 13.437 0.521 -5.537 238 H PHE 32 H PHE 32 11.589 1.443 -2.626 239 HA PHE 32 HA PHE 32 9.630 3.031 -1.347 240 1HB PHE 32 1HB PHE 32 9.609 0.565 -1.224 241 2HB PHE 32 2HB PHE 32 11.099 0.544 -0.277 242 HD1 PHE 32 HD1 PHE 32 8.069 2.705 0.018 243 HD2 PHE 32 HD2 PHE 32 10.526 -0.194 1.850 244 HE1 PHE 32 HE1 PHE 32 6.774 2.896 2.067 245 HE2 PHE 32 HE2 PHE 32 9.234 0.007 3.898 246 HZ PHE 32 HZ PHE 32 7.357 1.551 4.008 247 H VAL 33 H VAL 33 12.426 1.777 0.388 248 HA VAL 33 HA VAL 33 12.379 3.431 2.695 249 HB VAL 33 HB VAL 33 14.896 2.584 1.137 250 1HG1 VAL 33 3HG2 VAL 33 15.314 4.264 2.956 251 2HG1 VAL 33 1HG2 VAL 33 14.433 3.240 4.120 252 3HG1 VAL 33 2HG2 VAL 33 15.967 2.667 3.410 253 1HG2 VAL 33 2HG1 VAL 33 13.337 0.659 1.556 254 2HG2 VAL 33 3HG1 VAL 33 14.791 0.523 2.579 255 3HG2 VAL 33 1HG1 VAL 33 13.251 1.086 3.284 256 H ASP 34 H ASP 34 13.693 4.193 -0.471 257 HA ASP 34 HA ASP 34 14.949 6.718 -0.042 258 1HB ASP 34 1HB ASP 34 12.945 5.943 -2.257 259 2HB ASP 34 2HB ASP 34 13.992 7.361 -2.319 260 OH TYR 35 OH TYR 35 9.537 7.545 -6.049 261 H TYR 35 H TYR 35 11.562 6.203 -0.845 262 HA TYR 35 HA TYR 35 10.627 8.917 -0.268 263 1HB TYR 35 1HB TYR 35 9.078 6.255 -0.151 264 2HB TYR 35 2HB TYR 35 8.344 7.862 -0.140 265 HD1 TYR 35 HD2 TYR 35 8.728 9.389 -2.075 266 HD2 TYR 35 HD1 TYR 35 9.898 5.334 -2.198 267 HE1 TYR 35 HE2 TYR 35 8.867 9.500 -4.500 268 HE2 TYR 35 HE1 TYR 35 10.035 5.450 -4.623 269 HH TYR 35 HH TYR 35 9.306 8.433 -6.333 270 H VAL 36 H VAL 36 10.369 5.914 1.584 271 HA VAL 36 HA VAL 36 9.301 6.831 4.058 272 HB VAL 36 HB VAL 36 11.649 4.880 3.669 273 1HG1 VAL 36 3HG2 VAL 36 11.388 5.658 6.042 274 2HG1 VAL 36 1HG2 VAL 36 9.657 5.232 6.006 275 3HG1 VAL 36 2HG2 VAL 36 10.894 3.952 5.883 276 1HG2 VAL 36 2HG1 VAL 36 9.606 4.282 2.327 277 2HG2 VAL 36 3HG1 VAL 36 9.836 3.132 3.670 278 3HG2 VAL 36 1HG1 VAL 36 8.595 4.409 3.790 279 H ASN 37 H ASN 37 12.739 6.447 3.366 280 HA ASN 37 HA ASN 37 13.856 7.981 5.518 281 1HB ASN 37 1HB ASN 37 14.866 7.878 2.606 282 2HB ASN 37 2HB ASN 37 15.816 8.390 4.010 283 1HD2 ASN 37 1HD2 ASN 37 16.718 4.853 3.648 284 2HD2 ASN 37 2HD2 ASN 37 17.016 6.496 2.888 285 H SER 38 H SER 38 12.846 9.030 2.309 286 HA SER 38 HA SER 38 13.589 11.821 2.484 287 1HB SER 38 1HB SER 38 11.192 10.577 1.003 288 2HB SER 38 2HB SER 38 11.875 12.184 0.688 289 HG SER 38 HG SER 38 13.257 9.704 0.525 290 H GLY 39 H GLY 39 10.451 11.988 1.757 291 1HA GLY 39 1HA GLY 39 9.131 12.403 4.393 292 2HA GLY 39 2HA GLY 39 9.689 13.949 3.709 293 H PHE 40 H PHE 40 7.933 11.023 3.043 294 HA PHE 40 HA PHE 40 6.313 12.321 0.771 295 1HB PHE 40 1HB PHE 40 7.634 10.319 0.175 296 2HB PHE 40 2HB PHE 40 6.968 9.411 1.530 297 HD1 PHE 40 HD2 PHE 40 4.487 8.964 1.580 298 HD2 PHE 40 HD1 PHE 40 6.432 10.406 -1.875 299 HE1 PHE 40 HE2 PHE 40 2.671 8.122 0.204 300 HE2 PHE 40 HE1 PHE 40 4.612 9.561 -3.248 301 HZ PHE 40 HZ PHE 40 2.741 8.398 -2.210 302 OH TYR 41 OH TYR 41 7.026 5.025 2.033 303 H TYR 41 H TYR 41 6.007 9.932 3.338 304 HA TYR 41 HA TYR 41 3.173 9.621 3.197 305 1HB TYR 41 1HB TYR 41 4.866 9.291 5.741 306 2HB TYR 41 2HB TYR 41 3.332 8.492 5.381 307 HD1 TYR 41 HD1 TYR 41 3.241 6.973 3.345 308 HD2 TYR 41 HD2 TYR 41 6.890 8.464 4.856 309 HE1 TYR 41 HE1 TYR 41 4.460 5.294 2.071 310 HE2 TYR 41 HE2 TYR 41 8.102 6.786 3.582 311 HH TYR 41 HH TYR 41 6.399 4.494 1.538 312 H ASN 42 H ASN 42 5.066 11.800 5.211 313 HA ASN 42 HA ASN 42 3.314 12.657 7.164 314 1HB ASN 42 1HB ASN 42 4.338 14.913 7.092 315 2HB ASN 42 2HB ASN 42 5.564 13.660 6.850 316 1HD2 ASN 42 1HD2 ASN 42 6.253 16.148 4.210 317 2HD2 ASN 42 2HD2 ASN 42 6.371 15.950 6.030 318 H ASN 43 H ASN 43 1.357 12.967 7.182 319 HA ASN 43 HA ASN 43 -0.827 13.753 6.705 320 1HB ASN 43 1HB ASN 43 0.205 15.893 7.229 321 2HB ASN 43 2HB ASN 43 0.833 16.082 5.582 322 1HD2 ASN 43 1HD2 ASN 43 -2.284 17.228 4.260 323 2HD2 ASN 43 2HD2 ASN 43 -0.559 16.686 3.945 324 H THR 44 H THR 44 0.306 11.973 4.896 325 HA THR 44 HA THR 44 -1.061 12.571 2.228 326 HB THR 44 HB THR 44 -0.595 10.175 1.753 327 HG1 THR 44 HG1 THR 44 0.665 9.060 3.281 328 1HG2 THR 44 2HG2 THR 44 1.160 11.910 1.248 329 2HG2 THR 44 3HG2 THR 44 1.837 11.712 2.886 330 3HG2 THR 44 1HG2 THR 44 1.914 10.364 1.720 331 H THR 45 H THR 45 -2.073 9.812 2.269 332 HA THR 45 HA THR 45 -3.928 9.489 4.540 333 HB THR 45 HB THR 45 -6.059 9.713 3.299 334 HG1 THR 45 HG1 THR 45 -5.979 10.815 1.306 335 1HG2 THR 45 2HG2 THR 45 -5.215 11.664 4.650 336 2HG2 THR 45 3HG2 THR 45 -4.340 12.281 3.224 337 3HG2 THR 45 1HG2 THR 45 -6.123 12.227 3.222 338 H PHE 46 H PHE 46 -5.980 8.290 3.130 339 HA PHE 46 HA PHE 46 -4.749 5.812 1.796 340 1HB PHE 46 1HB PHE 46 -6.617 5.894 4.249 341 2HB PHE 46 2HB PHE 46 -6.543 4.499 3.183 342 HD1 PHE 46 HD1 PHE 46 -3.420 6.268 3.477 343 HD2 PHE 46 HD2 PHE 46 -5.820 3.274 5.226 344 HE1 PHE 46 HE1 PHE 46 -1.480 5.398 4.655 345 HE2 PHE 46 HE2 PHE 46 -3.880 2.404 6.398 346 HZ PHE 46 HZ PHE 46 -1.708 3.466 6.116 347 H HIS 47 H HIS 47 -5.579 7.541 0.228 348 HA HIS 47 HA HIS 47 -8.405 7.874 -0.345 349 1HB HIS 47 1HB HIS 47 -7.749 8.253 -2.696 350 2HB HIS 47 2HB HIS 47 -6.655 9.106 -1.607 351 HD2 HIS 47 HD2 HIS 47 -6.517 7.119 -4.621 352 HE1 HIS 47 HE1 HIS 47 -2.944 6.091 -2.756 353 HE2 HIS 47 HE2 HIS 47 -4.152 5.973 -5.023 354 NH1 ARG 48 NH2 ARG 48 -7.474 3.290 -7.376 355 NH2 ARG 48 NH1 ARG 48 -6.775 1.133 -7.200 356 H ARG 48 H ARG 48 -6.087 5.433 -1.400 357 HA ARG 48 HA ARG 48 -8.035 3.677 -2.783 358 1HB ARG 48 1HB ARG 48 -5.321 3.022 -1.486 359 2HB ARG 48 2HB ARG 48 -6.176 1.991 -2.637 360 1HG ARG 48 1HG ARG 48 -5.184 4.862 -3.161 361 2HG ARG 48 2HG ARG 48 -4.351 3.419 -3.712 362 1HD ARG 48 1HD ARG 48 -7.220 4.217 -4.581 363 2HD ARG 48 2HD ARG 48 -5.754 4.635 -5.472 364 HE ARG 48 HE ARG 48 -5.770 1.734 -5.105 365 1HH1 ARG 48 2HH2 ARG 48 -7.501 4.227 -6.959 366 2HH1 ARG 48 1HH2 ARG 48 -7.891 3.002 -8.268 367 1HH2 ARG 48 1HH1 ARG 48 -6.271 0.427 -6.653 368 2HH2 ARG 48 2HH1 ARG 48 -7.241 0.994 -8.104 369 H VAL 49 H VAL 49 -9.692 3.027 -1.663 370 HA VAL 49 HA VAL 49 -9.267 1.190 0.722 371 HB VAL 49 HB VAL 49 -11.070 3.680 0.812 372 1HG1 VAL 49 3HG2 VAL 49 -12.048 1.677 1.971 373 2HG1 VAL 49 1HG2 VAL 49 -10.534 1.451 2.885 374 3HG1 VAL 49 2HG2 VAL 49 -11.534 2.903 3.159 375 1HG2 VAL 49 2HG1 VAL 49 -8.628 4.209 1.098 376 2HG2 VAL 49 3HG1 VAL 49 -9.501 4.409 2.640 377 3HG2 VAL 49 1HG1 VAL 49 -8.495 2.962 2.365 378 H ILE 50 H ILE 50 -10.494 -0.385 0.764 379 HA ILE 50 HA ILE 50 -13.243 -0.391 -0.545 380 HB ILE 50 HB ILE 50 -11.558 -1.062 -2.297 381 1HG1 ILE 50 1HG1 ILE 50 -13.927 -1.907 -2.285 382 2HG1 ILE 50 2HG1 ILE 50 -12.784 -2.991 -3.083 383 1HG2 ILE 50 2HG2 ILE 50 -9.880 -2.126 -0.761 384 2HG2 ILE 50 3HG2 ILE 50 -11.036 -3.428 -0.380 385 3HG2 ILE 50 1HG2 ILE 50 -10.385 -3.270 -2.033 386 1HD1 ILE 50 2HD1 ILE 50 -12.652 -4.422 -0.997 387 2HD1 ILE 50 3HD1 ILE 50 -13.826 -3.345 -0.193 388 3HD1 ILE 50 1HD1 ILE 50 -14.322 -4.303 -1.612 389 HA PRO 51 HA PRO 51 -14.306 -2.023 3.373 390 1HB PRO 51 1HB PRO 51 -16.267 -3.310 1.396 391 2HB PRO 51 2HB PRO 51 -16.631 -2.609 2.993 392 1HG PRO 51 1HG PRO 51 -17.107 -1.097 0.793 393 2HG PRO 51 2HG PRO 51 -16.268 -0.341 2.170 394 1HD PRO 51 1HD PRO 51 -15.041 -1.337 -0.448 395 2HD PRO 51 2HD PRO 51 -14.611 0.113 0.515 396 H GLY 52 H GLY 52 -14.326 -3.883 4.453 397 1HA GLY 52 1HA GLY 52 -12.659 -5.788 4.772 398 2HA GLY 52 2HA GLY 52 -14.261 -6.452 4.445 399 H PHE 53 H PHE 53 -11.548 -5.095 2.636 400 HA PHE 53 HA PHE 53 -11.185 -7.658 1.055 401 1HB PHE 53 1HB PHE 53 -12.974 -6.331 -0.154 402 2HB PHE 53 2HB PHE 53 -11.847 -4.976 -0.310 403 HD1 PHE 53 HD1 PHE 53 -10.911 -8.547 -0.440 404 HD2 PHE 53 HD2 PHE 53 -11.601 -5.054 -2.702 405 HE1 PHE 53 HE1 PHE 53 -9.974 -9.631 -2.403 406 HE2 PHE 53 HE2 PHE 53 -10.661 -6.141 -4.663 407 HZ PHE 53 HZ PHE 53 -9.848 -8.429 -4.515 408 H MET 54 H MET 54 -10.233 -4.273 1.512 409 HA MET 54 HA MET 54 -7.392 -4.865 1.872 410 1HB MET 54 1HB MET 54 -6.552 -4.124 -0.402 411 2HB MET 54 2HB MET 54 -7.482 -5.629 -0.467 412 1HG MET 54 1HG MET 54 -9.561 -4.314 -1.078 413 2HG MET 54 2HG MET 54 -8.602 -2.817 -1.078 414 1HE MET 54 3HE MET 54 -9.538 -2.483 -3.634 415 2HE MET 54 2HE MET 54 -9.255 -3.674 -4.939 416 3HE MET 54 1HE MET 54 -10.355 -4.077 -3.588 417 H ILE 55 H ILE 55 -6.016 -3.022 1.737 418 HA ILE 55 HA ILE 55 -7.103 -0.257 1.408 419 HB ILE 55 HB ILE 55 -6.860 0.411 3.780 420 1HG1 ILE 55 1HG1 ILE 55 -6.488 -2.592 4.348 421 2HG1 ILE 55 2HG1 ILE 55 -5.163 -1.427 4.285 422 1HG2 ILE 55 2HG2 ILE 55 -9.125 -0.306 2.965 423 2HG2 ILE 55 3HG2 ILE 55 -8.773 -1.989 3.436 424 3HG2 ILE 55 1HG2 ILE 55 -8.905 -0.723 4.685 425 1HD1 ILE 55 2HD1 ILE 55 -6.220 -0.077 6.140 426 2HD1 ILE 55 3HD1 ILE 55 -7.562 -1.251 6.227 427 3HD1 ILE 55 1HD1 ILE 55 -5.903 -1.755 6.648 428 H GLN 56 H GLN 56 -5.632 1.009 0.896 429 HA GLN 56 HA GLN 56 -3.321 1.540 2.466 430 1HB GLN 56 1HB GLN 56 -2.666 -0.355 0.219 431 2HB GLN 56 2HB GLN 56 -1.534 0.962 0.559 432 1HG GLN 56 1HG GLN 56 -2.614 -1.007 2.660 433 2HG GLN 56 2HG GLN 56 -0.988 -1.021 1.965 434 1HE2 GLN 56 2HE2 GLN 56 -2.023 1.934 4.690 435 2HE2 GLN 56 1HE2 GLN 56 -3.294 1.003 3.750 436 H GLY 57 H GLY 57 -1.502 2.580 0.754 437 1HA GLY 57 1HA GLY 57 -2.638 4.351 -1.297 438 2HA GLY 57 2HA GLY 57 -2.672 5.214 0.248 439 H GLY 58 H GLY 58 -1.320 6.682 -0.279 440 1HA GLY 58 1HA GLY 58 1.216 7.131 0.296 441 2HA GLY 58 2HA GLY 58 1.604 5.989 -1.000 442 H GLY 59 H GLY 59 0.038 6.459 -2.967 443 1HA GLY 59 1HA GLY 59 1.181 8.547 -4.459 444 2HA GLY 59 2HA GLY 59 -0.441 7.938 -4.811 445 H PHE 60 H PHE 60 -1.929 9.311 -4.856 446 HA PHE 60 HA PHE 60 -1.781 12.082 -4.601 447 1HB PHE 60 1HB PHE 60 -4.248 10.430 -3.779 448 2HB PHE 60 2HB PHE 60 -4.256 12.129 -4.270 449 HD1 PHE 60 HD1 PHE 60 -1.976 11.688 -6.366 450 HD2 PHE 60 HD2 PHE 60 -5.650 9.744 -5.649 451 HE1 PHE 60 HE1 PHE 60 -2.079 11.019 -8.700 452 HE2 PHE 60 HE2 PHE 60 -5.750 9.076 -7.984 453 HZ PHE 60 HZ PHE 60 -3.966 9.715 -9.511 454 H THR 61 H THR 61 -1.495 13.492 -3.174 455 HA THR 61 HA THR 61 -0.760 12.911 -0.447 456 HB THR 61 HB THR 61 -0.094 14.943 -1.746 457 HG1 THR 61 HG1 THR 61 0.020 14.841 0.523 458 1HG2 THR 61 2HG2 THR 61 -2.348 15.494 -2.726 459 2HG2 THR 61 3HG2 THR 61 -2.965 15.882 -1.098 460 3HG2 THR 61 1HG2 THR 61 -1.683 16.887 -1.827 461 H GLU 62 H GLU 62 -3.805 14.050 -1.812 462 HA GLU 62 HA GLU 62 -5.542 12.993 0.259 463 1HB GLU 62 1HB GLU 62 -4.132 14.636 1.618 464 2HB GLU 62 2HB GLU 62 -4.804 15.959 0.667 465 1HG GLU 62 1HG GLU 62 -6.410 13.944 2.383 466 2HG GLU 62 2HG GLU 62 -6.015 15.591 2.865 467 H GLN 63 H GLN 63 -7.321 12.842 -0.678 468 HA GLN 63 HA GLN 63 -9.263 13.364 -2.013 469 1HB GLN 63 1HB GLN 63 -7.855 16.064 -2.492 470 2HB GLN 63 2HB GLN 63 -9.448 15.632 -3.126 471 1HG GLN 63 1HG GLN 63 -8.681 15.719 -0.141 472 2HG GLN 63 2HG GLN 63 -9.638 16.938 -0.991 473 1HE2 GLN 63 2HE2 GLN 63 -12.534 14.734 -1.363 474 2HE2 GLN 63 1HE2 GLN 63 -11.533 15.977 -2.267 475 H MET 64 H MET 64 -6.336 14.826 -3.369 476 HA MET 64 HA MET 64 -5.239 13.128 -5.075 477 1HB MET 64 1HB MET 64 -7.749 13.896 -6.636 478 2HB MET 64 2HB MET 64 -6.442 12.851 -7.202 479 1HG MET 64 1HG MET 64 -6.930 11.216 -5.329 480 2HG MET 64 2HG MET 64 -8.279 12.243 -4.792 481 1HE MET 64 2HE MET 64 -9.874 10.037 -5.050 482 2HE MET 64 1HE MET 64 -10.033 9.122 -6.578 483 3HE MET 64 3HE MET 64 -8.492 9.082 -5.672 484 H GLN 65 H GLN 65 -3.812 14.413 -5.099 485 HA GLN 65 HA GLN 65 -3.666 16.568 -7.194 486 1HB GLN 65 1HB GLN 65 -3.176 17.300 -4.235 487 2HB GLN 65 2HB GLN 65 -2.865 18.348 -5.628 488 1HG GLN 65 1HG GLN 65 -5.315 18.187 -6.280 489 2HG GLN 65 2HG GLN 65 -5.617 17.175 -4.866 490 1HE2 GLN 65 2HE2 GLN 65 -4.930 21.232 -4.375 491 2HE2 GLN 65 1HE2 GLN 65 -4.456 20.349 -5.911 492 H GLN 66 H GLN 66 -2.481 14.908 -7.934 493 HA GLN 66 HA GLN 66 -0.543 13.283 -7.106 494 1HB GLN 66 1HB GLN 66 0.109 15.253 -9.379 495 2HB GLN 66 2HB GLN 66 0.840 13.660 -9.134 496 1HG GLN 66 1HG GLN 66 -1.424 12.572 -9.374 497 2HG GLN 66 2HG GLN 66 -2.175 14.157 -9.575 498 1HE2 GLN 66 2HE2 GLN 66 -0.501 12.367 -12.803 499 2HE2 GLN 66 1HE2 GLN 66 -0.700 11.572 -11.161 500 H LYS 67 H LYS 67 1.213 13.087 -6.168 501 HA LYS 67 HA LYS 67 2.465 15.239 -4.567 502 1HB LYS 67 1HB LYS 67 3.407 12.421 -5.333 503 2HB LYS 67 2HB LYS 67 4.250 13.464 -4.180 504 1HG LYS 67 1HG LYS 67 1.308 12.538 -3.942 505 2HG LYS 67 2HG LYS 67 2.666 11.854 -3.058 506 1HD LYS 67 1HD LYS 67 1.537 13.350 -1.553 507 2HD LYS 67 2HD LYS 67 3.092 14.076 -1.936 508 1HE LYS 67 1HE LYS 67 1.924 15.626 -3.616 509 2HE LYS 67 2HE LYS 67 0.373 14.883 -3.201 510 1HZ LYS 67 2HZ LYS 67 2.146 16.334 -1.292 511 2HZ LYS 67 3HZ LYS 67 0.750 16.920 -1.953 512 3HZ LYS 67 1HZ LYS 67 0.696 15.646 -0.901 513 H LYS 68 H LYS 68 4.863 13.498 -5.620 514 HA LYS 68 HA LYS 68 5.714 15.002 -8.117 515 1HB LYS 68 1HB LYS 68 7.190 15.244 -5.420 516 2HB LYS 68 2HB LYS 68 7.835 15.795 -6.969 517 1HG LYS 68 1HG LYS 68 5.244 16.797 -5.623 518 2HG LYS 68 2HG LYS 68 6.780 17.667 -5.673 519 1HD LYS 68 1HD LYS 68 6.636 17.713 -8.239 520 2HD LYS 68 2HD LYS 68 5.099 16.869 -8.139 521 1HE LYS 68 1HE LYS 68 4.565 19.182 -8.483 522 2HE LYS 68 2HE LYS 68 4.115 18.828 -6.817 523 1HZ LYS 68 2HZ LYS 68 6.628 20.196 -7.678 524 2HZ LYS 68 3HZ LYS 68 5.310 20.926 -7.001 525 3HZ LYS 68 1HZ LYS 68 6.221 19.876 -6.109 526 HA PRO 69 HA PRO 69 6.730 10.471 -7.698 527 1HB PRO 69 1HB PRO 69 6.467 11.105 -10.679 528 2HB PRO 69 2HB PRO 69 5.933 9.641 -9.819 529 1HG PRO 69 1HG PRO 69 4.079 11.524 -10.439 530 2HG PRO 69 2HG PRO 69 4.059 10.820 -8.803 531 1HD PRO 69 1HD PRO 69 5.168 13.547 -9.649 532 2HD PRO 69 2HD PRO 69 4.242 13.120 -8.174 533 H ASN 70 H ASN 70 8.163 9.393 -9.616 534 HA ASN 70 HA ASN 70 10.544 10.879 -10.522 535 1HB ASN 70 1HB ASN 70 10.857 9.178 -7.966 536 2HB ASN 70 2HB ASN 70 12.205 9.742 -8.963 537 1HD2 ASN 70 1HD2 ASN 70 11.805 12.268 -6.272 538 2HD2 ASN 70 2HD2 ASN 70 12.227 10.490 -6.432 539 HA PRO 71 HA PRO 71 11.574 7.583 -13.169 540 1HB PRO 71 1HB PRO 71 14.086 7.335 -11.425 541 2HB PRO 71 2HB PRO 71 13.986 7.344 -13.204 542 1HG PRO 71 1HG PRO 71 14.705 9.636 -11.945 543 2HG PRO 71 2HG PRO 71 13.488 9.733 -13.242 544 1HD PRO 71 1HD PRO 71 13.005 9.795 -10.217 545 2HD PRO 71 2HD PRO 71 12.197 10.748 -11.504 546 HA PRO 72 HA PRO 72 9.523 4.655 -10.294 547 1HB PRO 72 1HB PRO 72 9.142 3.653 -13.165 548 2HB PRO 72 2HB PRO 72 7.950 3.654 -11.842 549 1HG PRO 72 1HG PRO 72 7.795 5.615 -13.706 550 2HG PRO 72 2HG PRO 72 7.674 6.077 -11.989 551 1HD PRO 72 1HD PRO 72 10.110 6.343 -13.829 552 2HD PRO 72 2HD PRO 72 9.510 7.489 -12.585 553 H ILE 73 H ILE 73 9.411 2.075 -11.531 554 HA ILE 73 HA ILE 73 12.179 1.089 -12.036 555 HB ILE 73 HB ILE 73 12.454 -0.298 -10.089 556 1HG1 ILE 73 1HG1 ILE 73 10.020 -0.779 -9.688 557 2HG1 ILE 73 2HG1 ILE 73 10.924 -0.404 -8.219 558 1HG2 ILE 73 2HG2 ILE 73 13.280 2.062 -9.923 559 2HG2 ILE 73 3HG2 ILE 73 11.722 2.571 -9.224 560 3HG2 ILE 73 1HG2 ILE 73 12.780 1.451 -8.325 561 1HD1 ILE 73 2HD1 ILE 73 10.060 1.976 -8.271 562 2HD1 ILE 73 3HD1 ILE 73 9.127 1.598 -9.744 563 3HD1 ILE 73 1HD1 ILE 73 8.729 0.792 -8.205 564 H LYS 74 H LYS 74 12.335 -1.190 -12.054 565 HA LYS 74 HA LYS 74 10.699 -2.323 -14.057 566 1HB LYS 74 1HB LYS 74 12.038 -3.906 -11.801 567 2HB LYS 74 2HB LYS 74 11.701 -4.487 -13.439 568 1HG LYS 74 1HG LYS 74 13.206 -2.657 -14.379 569 2HG LYS 74 2HG LYS 74 13.488 -2.071 -12.750 570 1HD LYS 74 1HD LYS 74 15.447 -3.325 -13.301 571 2HD LYS 74 2HD LYS 74 14.571 -4.281 -12.129 572 1HE LYS 74 1HE LYS 74 15.412 -5.811 -13.791 573 2HE LYS 74 2HE LYS 74 13.670 -5.754 -14.035 574 1HZ LYS 74 2HZ LYS 74 15.694 -4.261 -15.647 575 2HZ LYS 74 3HZ LYS 74 14.875 -5.612 -16.129 576 3HZ LYS 74 1HZ LYS 74 14.062 -4.193 -15.893 577 H ASN 75 H ASN 75 9.856 -4.689 -13.543 578 HA ASN 75 HA ASN 75 7.116 -4.396 -12.673 579 1HB ASN 75 1HB ASN 75 7.023 -6.875 -12.795 580 2HB ASN 75 2HB ASN 75 7.891 -6.204 -14.177 581 1HD2 ASN 75 1HD2 ASN 75 11.016 -7.703 -13.290 582 2HD2 ASN 75 2HD2 ASN 75 10.103 -6.527 -14.362 583 H GLU 76 H GLU 76 6.970 -6.836 -11.072 584 HA GLU 76 HA GLU 76 8.285 -6.693 -8.523 585 1HB GLU 76 1HB GLU 76 7.316 -4.336 -8.588 586 2HB GLU 76 2HB GLU 76 5.693 -5.025 -8.569 587 1HG GLU 76 1HG GLU 76 7.875 -5.442 -6.414 588 2HG GLU 76 2HG GLU 76 6.514 -4.335 -6.271 589 H ALA 77 H ALA 77 4.880 -6.607 -9.494 590 HA ALA 77 HA ALA 77 3.695 -8.451 -7.810 591 1HB ALA 77 2HB ALA 77 2.460 -7.386 -9.722 592 2HB ALA 77 3HB ALA 77 3.269 -8.482 -10.874 593 3HB ALA 77 1HB ALA 77 2.144 -9.136 -9.659 594 H ASP 78 H ASP 78 5.781 -9.265 -10.518 595 HA ASP 78 HA ASP 78 5.244 -12.126 -10.589 596 1HB ASP 78 1HB ASP 78 7.230 -12.255 -12.026 597 2HB ASP 78 2HB ASP 78 6.258 -10.839 -12.445 598 H ASN 79 H ASN 79 5.933 -11.086 -7.914 599 HA ASN 79 HA ASN 79 8.461 -12.141 -6.931 600 1HB ASN 79 1HB ASN 79 7.252 -12.444 -4.742 601 2HB ASN 79 2HB ASN 79 7.074 -10.836 -5.453 602 1HD2 ASN 79 1HD2 ASN 79 3.655 -11.681 -4.428 603 2HD2 ASN 79 2HD2 ASN 79 5.278 -11.195 -3.724 604 H GLY 80 H GLY 80 5.823 -13.951 -5.704 605 1HA GLY 80 1HA GLY 80 5.497 -16.210 -7.345 606 2HA GLY 80 2HA GLY 80 7.053 -16.569 -6.570 607 H LEU 81 H LEU 81 7.125 -16.232 -4.238 608 HA LEU 81 HA LEU 81 5.686 -18.202 -2.908 609 1HB LEU 81 1HB LEU 81 6.290 -17.268 -0.786 610 2HB LEU 81 2HB LEU 81 7.618 -16.937 -1.899 611 HG LEU 81 HG LEU 81 5.375 -14.948 -1.183 612 1HD1 LEU 81 2HD1 LEU 81 6.853 -15.455 0.782 613 2HD1 LEU 81 3HD1 LEU 81 8.298 -15.082 -0.192 614 3HD1 LEU 81 1HD1 LEU 81 7.128 -13.794 0.198 615 1HD2 LEU 81 2HD2 LEU 81 8.023 -14.522 -2.719 616 2HD2 LEU 81 3HD2 LEU 81 6.390 -14.497 -3.433 617 3HD2 LEU 81 1HD2 LEU 81 6.870 -13.239 -2.268 618 NH1 ARG 82 NH2 ARG 82 0.849 -24.042 -3.182 619 NH2 ARG 82 NH1 ARG 82 1.587 -23.771 -5.315 620 H ARG 82 H ARG 82 3.904 -18.595 -2.098 621 HA ARG 82 HA ARG 82 1.485 -16.966 -2.620 622 1HB ARG 82 1HB ARG 82 1.883 -19.355 -0.734 623 2HB ARG 82 2HB ARG 82 0.334 -18.779 -1.381 624 1HG ARG 82 1HG ARG 82 1.131 -19.200 -3.724 625 2HG ARG 82 2HG ARG 82 2.721 -19.669 -3.120 626 1HD ARG 82 1HD ARG 82 1.681 -21.640 -1.895 627 2HD ARG 82 2HD ARG 82 0.086 -21.189 -2.530 628 HE ARG 82 HE ARG 82 1.799 -21.428 -4.838 629 1HH1 ARG 82 2HH2 ARG 82 0.625 -23.604 -2.281 630 2HH1 ARG 82 1HH2 ARG 82 0.772 -25.038 -3.417 631 1HH2 ARG 82 1HH1 ARG 82 1.926 -23.129 -6.041 632 2HH2 ARG 82 2HH1 ARG 82 1.459 -24.785 -5.402 633 H ASN 83 H ASN 83 -0.063 -16.501 -0.936 634 HA ASN 83 HA ASN 83 0.792 -15.888 1.841 635 1HB ASN 83 1HB ASN 83 0.558 -13.541 -0.143 636 2HB ASN 83 2HB ASN 83 0.639 -13.371 1.615 637 1HD2 ASN 83 1HD2 ASN 83 4.067 -14.951 1.577 638 2HD2 ASN 83 2HD2 ASN 83 2.415 -15.431 2.215 639 H THR 84 H THR 84 -0.744 -13.986 2.621 640 HA THR 84 HA THR 84 -3.627 -14.330 1.808 641 HB THR 84 HB THR 84 -2.270 -15.727 4.184 642 HG1 THR 84 HG1 THR 84 -3.382 -17.481 3.256 643 1HG2 THR 84 3HG2 THR 84 -5.276 -15.269 3.687 644 2HG2 THR 84 1HG2 THR 84 -4.585 -16.339 4.950 645 3HG2 THR 84 2HG2 THR 84 -4.311 -14.576 5.015 646 NH1 ARG 85 NH2 ARG 85 -9.701 -14.472 8.138 647 NH2 ARG 85 NH1 ARG 85 -9.072 -12.741 9.470 648 H ARG 85 H ARG 85 -5.049 -13.283 3.083 649 HA ARG 85 HA ARG 85 -4.811 -10.681 3.984 650 1HB ARG 85 1HB ARG 85 -6.506 -11.211 5.788 651 2HB ARG 85 2HB ARG 85 -6.919 -11.995 4.251 652 1HG ARG 85 1HG ARG 85 -5.783 -14.101 4.996 653 2HG ARG 85 2HG ARG 85 -5.323 -13.367 6.520 654 1HD ARG 85 1HD ARG 85 -8.259 -13.799 5.614 655 2HD ARG 85 2HD ARG 85 -7.337 -14.947 6.588 656 HE ARG 85 HE ARG 85 -7.272 -12.341 7.932 657 1HH1 ARG 85 2HH2 ARG 85 -9.519 -15.023 7.291 658 2HH1 ARG 85 1HH2 ARG 85 -10.458 -14.618 8.815 659 1HH2 ARG 85 1HH1 ARG 85 -8.414 -11.973 9.642 660 2HH2 ARG 85 2HH1 ARG 85 -9.872 -13.008 10.054 661 H GLY 86 H GLY 86 -3.126 -10.011 4.563 662 1HA GLY 86 1HA GLY 86 -2.130 -9.515 7.159 663 2HA GLY 86 2HA GLY 86 -1.439 -11.109 6.798 664 H THR 87 H THR 87 -1.564 -10.290 3.864 665 HA THR 87 HA THR 87 1.272 -9.101 3.825 666 HB THR 87 HB THR 87 1.291 -9.893 1.451 667 HG1 THR 87 HG1 THR 87 -0.968 -9.886 1.188 668 1HG2 THR 87 2HG2 THR 87 2.207 -11.292 3.317 669 2HG2 THR 87 3HG2 THR 87 0.598 -12.018 3.581 670 3HG2 THR 87 1HG2 THR 87 1.477 -12.319 2.055 671 H ILE 88 H ILE 88 1.782 -7.386 2.994 672 HA ILE 88 HA ILE 88 -0.228 -5.558 1.562 673 HB ILE 88 HB ILE 88 0.650 -4.046 2.914 674 1HG1 ILE 88 1HG1 ILE 88 3.042 -3.176 2.077 675 2HG1 ILE 88 2HG1 ILE 88 2.816 -4.371 0.834 676 1HG2 ILE 88 2HG2 ILE 88 1.896 -5.631 4.373 677 2HG2 ILE 88 3HG2 ILE 88 3.271 -5.618 3.231 678 3HG2 ILE 88 1HG2 ILE 88 2.832 -4.136 4.120 679 1HD1 ILE 88 2HD1 ILE 88 0.533 -3.252 0.268 680 2HD1 ILE 88 3HD1 ILE 88 0.822 -2.082 1.577 681 3HD1 ILE 88 1HD1 ILE 88 1.876 -2.076 0.139 682 H ALA 89 H ALA 89 0.569 -4.427 -0.226 683 HA ALA 89 HA ALA 89 2.669 -5.605 -1.981 684 1HB ALA 89 2HB ALA 89 0.925 -7.414 -2.174 685 2HB ALA 89 3HB ALA 89 -0.273 -6.211 -2.726 686 3HB ALA 89 1HB ALA 89 1.159 -6.572 -3.723 687 H MET 90 H MET 90 3.153 -4.527 -3.669 688 HA MET 90 HA MET 90 2.320 -1.693 -3.864 689 1HB MET 90 1HB MET 90 4.600 -2.281 -4.367 690 2HB MET 90 2HB MET 90 4.124 -3.398 -5.657 691 1HG MET 90 1HG MET 90 3.397 -1.640 -7.103 692 2HG MET 90 2HG MET 90 3.148 -0.499 -5.771 693 1HE MET 90 3HE MET 90 5.351 0.135 -4.075 694 2HE MET 90 2HE MET 90 6.537 1.064 -5.043 695 3HE MET 90 1HE MET 90 4.786 1.362 -5.250 696 H ALA 91 H ALA 91 1.094 -0.679 -5.108 697 HA ALA 91 HA ALA 91 -1.140 -2.088 -6.431 698 1HB ALA 91 2HB ALA 91 -1.454 0.075 -5.232 699 2HB ALA 91 3HB ALA 91 -0.424 0.911 -6.424 700 3HB ALA 91 1HB ALA 91 -1.983 0.209 -6.927 701 NH1 ARG 92 NH2 ARG 92 -5.227 -1.694 -13.189 702 NH2 ARG 92 NH1 ARG 92 -4.092 -0.657 -14.864 703 H ARG 92 H ARG 92 -0.011 0.650 -8.149 704 HA ARG 92 HA ARG 92 1.497 -0.613 -10.329 705 1HB ARG 92 1HB ARG 92 -0.354 -0.801 -12.001 706 2HB ARG 92 2HB ARG 92 -0.589 -1.912 -10.640 707 1HG ARG 92 1HG ARG 92 -2.088 -0.232 -9.519 708 2HG ARG 92 2HG ARG 92 -1.885 0.891 -10.851 709 1HD ARG 92 1HD ARG 92 -3.156 -1.927 -11.115 710 2HD ARG 92 2HD ARG 92 -4.069 -0.442 -10.835 711 HE ARG 92 HE ARG 92 -2.453 -0.023 -13.227 712 1HH1 ARG 92 2HH2 ARG 92 -5.270 -1.932 -12.191 713 2HH1 ARG 92 1HH2 ARG 92 -5.910 -1.947 -13.911 714 1HH2 ARG 92 1HH1 ARG 92 -3.275 -0.105 -15.147 715 2HH2 ARG 92 2HH1 ARG 92 -4.854 -0.982 -15.470 716 H THR 93 H THR 93 -0.324 0.716 -12.281 717 HA THR 93 HA THR 93 -0.968 3.327 -12.248 718 HB THR 93 HB THR 93 1.135 4.724 -12.568 719 HG1 THR 93 HG1 THR 93 3.004 3.851 -11.635 720 1HG2 THR 93 1HG2 THR 93 -0.180 4.820 -10.444 721 2HG2 THR 93 2HG2 THR 93 0.754 3.450 -9.787 722 3HG2 THR 93 3HG2 THR 93 1.564 5.005 -10.122 723 H ALA 94 H ALA 94 -1.746 2.243 -14.009 724 HA ALA 94 HA ALA 94 -1.833 1.656 -16.336 725 1HB ALA 94 2HB ALA 94 -2.023 4.150 -16.334 726 2HB ALA 94 3HB ALA 94 -0.249 4.306 -16.427 727 3HB ALA 94 1HB ALA 94 -1.155 3.591 -17.786 728 H ASP 95 H ASP 95 1.158 3.318 -16.857 729 HA ASP 95 HA ASP 95 2.374 1.329 -18.494 730 1HB ASP 95 1HB ASP 95 3.805 3.284 -16.596 731 2HB ASP 95 2HB ASP 95 4.568 2.427 -17.945 732 H LYS 96 H LYS 96 3.146 -0.516 -18.228 733 HA LYS 96 HA LYS 96 3.180 -2.188 -15.929 734 1HB LYS 96 1HB LYS 96 5.259 -3.282 -17.161 735 2HB LYS 96 2HB LYS 96 3.667 -3.292 -17.930 736 1HG LYS 96 1HG LYS 96 5.394 -2.555 -19.557 737 2HG LYS 96 2HG LYS 96 4.176 -1.311 -19.277 738 1HD LYS 96 1HD LYS 96 5.745 -0.175 -17.620 739 2HD LYS 96 2HD LYS 96 6.989 -1.362 -17.983 740 1HE LYS 96 1HE LYS 96 5.727 0.578 -20.051 741 2HE LYS 96 2HE LYS 96 7.234 0.871 -19.190 742 1HZ LYS 96 1HZ LYS 96 8.190 -1.100 -20.249 743 2HZ LYS 96 2HZ LYS 96 6.781 -1.403 -21.057 744 3HZ LYS 96 3HZ LYS 96 7.642 -0.034 -21.386 745 H ASP 97 H ASP 97 6.371 -1.882 -16.974 746 HA ASP 97 HA ASP 97 7.664 -1.733 -14.448 747 1HB ASP 97 1HB ASP 97 8.552 -0.309 -17.031 748 2HB ASP 97 2HB ASP 97 9.599 -0.677 -15.654 749 H SER 98 H SER 98 6.749 -0.484 -12.986 750 HA SER 98 HA SER 98 7.507 2.363 -12.871 751 1HB SER 98 1HB SER 98 5.565 2.399 -14.532 752 2HB SER 98 2HB SER 98 4.501 1.805 -13.243 753 HG SER 98 HG SER 98 6.097 4.162 -13.182 754 H ALA 99 H ALA 99 4.488 2.079 -11.565 755 HA ALA 99 HA ALA 99 3.877 2.344 -9.276 756 1HB ALA 99 2HB ALA 99 3.764 -0.159 -9.438 757 2HB ALA 99 3HB ALA 99 5.491 -0.280 -9.000 758 3HB ALA 99 1HB ALA 99 4.311 0.348 -7.823 759 H THR 100 H THR 100 4.986 4.191 -9.144 760 HA THR 100 HA THR 100 7.868 4.331 -8.449 761 HB THR 100 HB THR 100 7.455 6.782 -8.328 762 HG1 THR 100 HG1 THR 100 4.759 5.985 -8.715 763 1HG2 THR 100 3HG2 THR 100 5.998 5.390 -10.672 764 2HG2 THR 100 1HG2 THR 100 6.631 7.059 -10.687 765 3HG2 THR 100 2HG2 THR 100 7.755 5.679 -10.573 766 H SER 101 H SER 101 4.847 4.983 -6.738 767 HA SER 101 HA SER 101 5.950 4.242 -4.088 768 1HB SER 101 1HB SER 101 5.887 6.517 -3.064 769 2HB SER 101 2HB SER 101 7.096 6.450 -4.361 770 HG SER 101 HG SER 101 5.754 8.279 -4.494 771 H GLN 102 H GLN 102 4.241 3.019 -4.052 772 HA GLN 102 HA GLN 102 1.844 3.974 -2.769 773 1HB GLN 102 1HB GLN 102 1.377 5.116 -4.950 774 2HB GLN 102 2HB GLN 102 1.477 3.567 -5.804 775 1HG GLN 102 1HG GLN 102 -0.411 2.665 -4.387 776 2HG GLN 102 2HG GLN 102 -0.510 4.205 -3.527 777 1HE2 GLN 102 2HE2 GLN 102 -1.592 5.933 -6.674 778 2HE2 GLN 102 1HE2 GLN 102 -0.195 6.049 -5.489 779 H PHE 103 H PHE 103 0.986 2.416 -1.839 780 HA PHE 103 HA PHE 103 0.967 -0.415 -2.963 781 1HB PHE 103 1HB PHE 103 2.078 -1.378 -1.069 782 2HB PHE 103 2HB PHE 103 3.135 -0.108 -1.681 783 HD1 PHE 103 HD1 PHE 103 0.948 1.988 -0.367 784 HD2 PHE 103 HD2 PHE 103 3.393 -1.151 1.032 785 HE1 PHE 103 HE1 PHE 103 0.938 2.970 1.852 786 HE2 PHE 103 HE2 PHE 103 3.379 -0.165 3.253 787 HZ PHE 103 HZ PHE 103 2.143 1.887 3.664 788 H PHE 104 H PHE 104 0.099 -1.872 -1.119 789 HA PHE 104 HA PHE 104 -2.095 -0.642 0.539 790 1HB PHE 104 1HB PHE 104 -3.960 -1.731 -0.646 791 2HB PHE 104 2HB PHE 104 -3.134 -0.597 -1.711 792 HD1 PHE 104 HD2 PHE 104 -3.120 -4.199 -0.754 793 HD2 PHE 104 HD1 PHE 104 -2.385 -1.371 -3.796 794 HE1 PHE 104 HE2 PHE 104 -2.793 -6.001 -2.353 795 HE2 PHE 104 HE1 PHE 104 -2.060 -3.175 -5.392 796 HZ PHE 104 HZ PHE 104 -2.273 -5.491 -4.674 797 H ILE 105 H ILE 105 -3.524 -2.196 1.396 798 HA ILE 105 HA ILE 105 -1.991 -4.668 2.435 799 HB ILE 105 HB ILE 105 -3.666 -2.546 3.902 800 1HG1 ILE 105 1HG1 ILE 105 -0.697 -3.324 4.154 801 2HG1 ILE 105 2HG1 ILE 105 -1.293 -1.901 3.292 802 1HG2 ILE 105 2HG2 ILE 105 -4.069 -4.835 4.826 803 2HG2 ILE 105 3HG2 ILE 105 -2.310 -5.099 4.978 804 3HG2 ILE 105 1HG2 ILE 105 -3.115 -3.850 5.968 805 1HD1 ILE 105 3HD1 ILE 105 -1.788 -2.472 6.297 806 2HD1 ILE 105 1HD1 ILE 105 -0.619 -1.292 5.646 807 3HD1 ILE 105 2HD1 ILE 105 -2.369 -1.035 5.417 808 H ASN 106 H ASN 106 -2.962 -6.332 1.811 809 HA ASN 106 HA ASN 106 -5.847 -6.607 1.189 810 1HB ASN 106 1HB ASN 106 -5.410 -9.025 1.164 811 2HB ASN 106 2HB ASN 106 -4.117 -8.183 0.297 812 1HD2 ASN 106 1HD2 ASN 106 -2.655 -10.669 2.784 813 2HD2 ASN 106 2HD2 ASN 106 -3.925 -10.757 1.462 814 H VAL 107 H VAL 107 -7.401 -7.536 2.311 815 HA VAL 107 HA VAL 107 -7.007 -8.251 5.255 816 HB VAL 107 HB VAL 107 -9.012 -6.995 5.910 817 1HG1 VAL 107 3HG2 VAL 107 -6.772 -5.870 6.059 818 2HG1 VAL 107 1HG2 VAL 107 -6.959 -5.250 4.398 819 3HG1 VAL 107 2HG2 VAL 107 -8.050 -4.682 5.691 820 1HG2 VAL 107 2HG1 VAL 107 -10.214 -7.091 3.708 821 2HG2 VAL 107 3HG1 VAL 107 -10.100 -5.408 4.288 822 3HG2 VAL 107 1HG1 VAL 107 -9.016 -5.981 2.991 823 H ALA 108 H ALA 108 -7.557 -9.481 2.531 824 HA ALA 108 HA ALA 108 -9.229 -11.692 3.686 825 1HB ALA 108 2HB ALA 108 -11.013 -10.110 2.861 826 2HB ALA 108 3HB ALA 108 -10.284 -10.124 1.233 827 3HB ALA 108 1HB ALA 108 -10.998 -11.613 1.906 828 H ASP 109 H ASP 109 -8.815 -13.515 2.943 829 HA ASP 109 HA ASP 109 -6.471 -14.282 1.681 830 1HB ASP 109 1HB ASP 109 -9.193 -15.630 1.180 831 2HB ASP 109 2HB ASP 109 -7.616 -16.387 0.927 832 H ASN 110 H ASN 110 -5.785 -12.987 0.159 833 HA ASN 110 HA ASN 110 -7.246 -12.316 -2.330 834 1HB ASN 110 1HB ASN 110 -5.431 -10.879 -1.430 835 2HB ASN 110 2HB ASN 110 -4.249 -12.180 -1.652 836 1HD2 ASN 110 1HD2 ASN 110 -3.629 -10.808 -4.879 837 2HD2 ASN 110 2HD2 ASN 110 -3.008 -11.263 -3.213 838 H ALA 111 H ALA 111 -4.077 -13.628 -2.679 839 HA ALA 111 HA ALA 111 -3.229 -15.489 -3.896 840 1HB ALA 111 2HB ALA 111 -4.483 -16.838 -2.202 841 2HB ALA 111 3HB ALA 111 -5.965 -16.735 -3.195 842 3HB ALA 111 1HB ALA 111 -4.541 -17.622 -3.803 843 H PHE 112 H PHE 112 -6.628 -15.951 -4.689 844 HA PHE 112 HA PHE 112 -6.378 -16.481 -7.443 845 1HB PHE 112 1HB PHE 112 -8.702 -15.607 -7.745 846 2HB PHE 112 2HB PHE 112 -8.540 -16.650 -6.335 847 HD1 PHE 112 HD1 PHE 112 -8.947 -13.168 -7.437 848 HD2 PHE 112 HD2 PHE 112 -8.706 -15.740 -4.102 849 HE1 PHE 112 HE1 PHE 112 -9.819 -11.404 -6.010 850 HE2 PHE 112 HE2 PHE 112 -9.580 -13.975 -2.680 851 HZ PHE 112 HZ PHE 112 -10.137 -11.807 -3.632 852 H LEU 113 H LEU 113 -6.464 -13.332 -5.887 853 HA LEU 113 HA LEU 113 -6.369 -11.641 -8.273 854 1HB LEU 113 1HB LEU 113 -6.761 -10.741 -5.971 855 2HB LEU 113 2HB LEU 113 -5.116 -11.189 -5.496 856 HG LEU 113 HG LEU 113 -4.189 -9.724 -7.321 857 1HD1 LEU 113 2HD1 LEU 113 -6.154 -9.835 -8.881 858 2HD1 LEU 113 3HD1 LEU 113 -7.140 -8.902 -7.725 859 3HD1 LEU 113 1HD1 LEU 113 -5.734 -8.142 -8.515 860 1HD2 LEU 113 3HD2 LEU 113 -4.475 -8.803 -5.002 861 2HD2 LEU 113 1HD2 LEU 113 -4.740 -7.533 -6.222 862 3HD2 LEU 113 2HD2 LEU 113 -6.134 -8.281 -5.399 863 H ASP 114 H ASP 114 -3.911 -13.343 -6.403 864 HA ASP 114 HA ASP 114 -1.479 -12.221 -7.222 865 1HB ASP 114 1HB ASP 114 -1.699 -14.258 -5.785 866 2HB ASP 114 2HB ASP 114 -2.139 -15.225 -7.205 867 H HIS 115 H HIS 115 -0.428 -11.860 -8.899 868 HA HIS 115 HA HIS 115 -1.276 -11.955 -11.609 869 1HB HIS 115 1HB HIS 115 0.758 -10.755 -11.020 870 2HB HIS 115 2HB HIS 115 1.560 -12.223 -10.450 871 HD2 HIS 115 HD2 HIS 115 3.505 -12.420 -12.158 872 HE1 HIS 115 HE1 HIS 115 1.291 -12.625 -15.674 873 HE2 HIS 115 HE2 HIS 115 3.687 -12.880 -14.767 874 H GLY 116 H GLY 116 -1.400 -13.301 -13.163 875 1HA GLY 116 1HA GLY 116 -0.049 -15.953 -13.299 876 2HA GLY 116 2HA GLY 116 -1.748 -16.131 -12.826 877 H GLN 117 H GLN 117 -2.303 -17.176 -14.580 878 HA GLN 117 HA GLN 117 -1.638 -16.733 -17.305 879 1HB GLN 117 1HB GLN 117 -3.725 -17.905 -17.905 880 2HB GLN 117 2HB GLN 117 -2.960 -18.688 -16.516 881 1HG GLN 117 1HG GLN 117 -4.499 -17.416 -14.956 882 2HG GLN 117 2HG GLN 117 -5.252 -16.625 -16.346 883 1HE2 GLN 117 2HE2 GLN 117 -5.828 -20.734 -15.991 884 2HE2 GLN 117 1HE2 GLN 117 -4.215 -19.958 -15.589 885 NH1 ARG 118 NH2 ARG 118 -9.615 -15.239 -19.932 886 NH2 ARG 118 NH1 ARG 118 -9.361 -13.537 -21.417 887 H ARG 118 H ARG 118 -1.844 -15.230 -18.618 888 HA ARG 118 HA ARG 118 -2.895 -13.501 -19.932 889 1HB ARG 118 1HB ARG 118 -5.107 -13.630 -17.798 890 2HB ARG 118 2HB ARG 118 -5.209 -12.784 -19.352 891 1HG ARG 118 1HG ARG 118 -4.817 -14.993 -20.562 892 2HG ARG 118 2HG ARG 118 -4.682 -15.801 -19.011 893 1HD ARG 118 1HD ARG 118 -6.884 -16.294 -19.804 894 2HD ARG 118 2HD ARG 118 -7.097 -15.162 -18.466 895 HE ARG 118 HE ARG 118 -7.003 -13.635 -20.974 896 1HH1 ARG 118 2HH2 ARG 118 -9.167 -15.892 -19.279 897 2HH1 ARG 118 1HH2 ARG 118 -10.617 -15.173 -20.144 898 1HH2 ARG 118 1HH1 ARG 118 -8.723 -12.894 -21.899 899 2HH2 ARG 118 2HH1 ARG 118 -10.380 -13.589 -21.526 900 H ASP 119 H ASP 119 -4.721 -11.899 -17.824 901 HA ASP 119 HA ASP 119 -3.191 -9.506 -17.622 902 1HB ASP 119 1HB ASP 119 -5.129 -10.641 -15.518 903 2HB ASP 119 2HB ASP 119 -4.603 -8.951 -15.615 904 H PHE 120 H PHE 120 -1.483 -8.929 -16.692 905 HA PHE 120 HA PHE 120 0.395 -10.606 -15.440 906 1HB PHE 120 1HB PHE 120 0.768 -8.240 -16.306 907 2HB PHE 120 2HB PHE 120 0.111 -7.616 -14.789 908 HD1 PHE 120 HD1 PHE 120 1.466 -10.425 -13.575 909 HD2 PHE 120 HD2 PHE 120 2.798 -6.920 -15.507 910 HE1 PHE 120 HE1 PHE 120 3.661 -10.702 -12.569 911 HE2 PHE 120 HE2 PHE 120 4.992 -7.203 -14.504 912 HZ PHE 120 HZ PHE 120 5.425 -9.091 -13.033 913 H GLY 121 H GLY 121 -0.288 -8.104 -13.197 914 1HA GLY 121 1HA GLY 121 -2.088 -9.238 -11.296 915 2HA GLY 121 2HA GLY 121 -0.558 -10.054 -10.939 916 OH TYR 122 OH TYR 122 -6.564 -4.866 -10.152 917 H TYR 122 H TYR 122 -1.901 -8.550 -9.186 918 HA TYR 122 HA TYR 122 -0.687 -5.817 -8.880 919 1HB TYR 122 1HB TYR 122 -2.256 -7.572 -6.897 920 2HB TYR 122 2HB TYR 122 -1.782 -5.896 -6.621 921 HD1 TYR 122 HD2 TYR 122 -3.818 -8.092 -8.773 922 HD2 TYR 122 HD1 TYR 122 -2.930 -4.109 -7.690 923 HE1 TYR 122 HE2 TYR 122 -5.793 -7.324 -9.966 924 HE2 TYR 122 HE1 TYR 122 -4.906 -3.346 -8.884 925 HH TYR 122 HH TYR 122 -7.013 -5.625 -10.533 926 H ALA 123 H ALA 123 0.961 -5.249 -7.811 927 HA ALA 123 HA ALA 123 3.155 -7.035 -7.207 928 1HB ALA 123 2HB ALA 123 3.438 -4.583 -7.620 929 2HB ALA 123 3HB ALA 123 2.638 -4.213 -6.068 930 3HB ALA 123 1HB ALA 123 4.206 -5.064 -6.087 931 H VAL 124 H VAL 124 4.165 -6.338 -4.860 932 HA VAL 124 HA VAL 124 2.673 -6.840 -2.453 933 HB VAL 124 HB VAL 124 3.720 -9.435 -3.754 934 1HG1 VAL 124 3HG2 VAL 124 4.255 -9.296 -1.307 935 2HG1 VAL 124 1HG2 VAL 124 2.548 -8.935 -0.941 936 3HG1 VAL 124 2HG2 VAL 124 3.000 -10.526 -1.610 937 1HG2 VAL 124 1HG1 VAL 124 0.861 -8.647 -2.887 938 2HG2 VAL 124 2HG1 VAL 124 1.429 -8.826 -4.568 939 3HG2 VAL 124 3HG1 VAL 124 1.356 -10.248 -3.499 940 H PHE 125 H PHE 125 4.028 -6.738 -0.719 941 HA PHE 125 HA PHE 125 6.733 -7.909 -0.782 942 1HB PHE 125 1HB PHE 125 8.136 -5.984 -0.888 943 2HB PHE 125 2HB PHE 125 7.018 -5.809 -2.242 944 HD1 PHE 125 HD1 PHE 125 4.683 -4.658 -1.400 945 HD2 PHE 125 HD2 PHE 125 8.461 -4.065 0.381 946 HE1 PHE 125 HE1 PHE 125 3.890 -2.586 -0.404 947 HE2 PHE 125 HE2 PHE 125 7.666 -1.996 1.373 948 HZ PHE 125 HZ PHE 125 5.373 -1.267 1.000 949 H GLY 126 H GLY 126 4.228 -7.489 0.980 950 1HA GLY 126 1HA GLY 126 5.855 -7.751 3.493 951 2HA GLY 126 2HA GLY 126 4.886 -6.274 3.438 952 H LYS 127 H LYS 127 3.376 -6.474 4.631 953 HA LYS 127 HA LYS 127 1.233 -8.321 4.770 954 1HB LYS 127 1HB LYS 127 2.947 -10.093 5.192 955 2HB LYS 127 2HB LYS 127 3.555 -9.193 6.590 956 1HG LYS 127 1HG LYS 127 1.257 -9.357 7.677 957 2HG LYS 127 2HG LYS 127 0.673 -10.235 6.274 958 1HD LYS 127 1HD LYS 127 1.081 -11.884 7.948 959 2HD LYS 127 2HD LYS 127 2.343 -12.100 6.742 960 1HE LYS 127 1HE LYS 127 3.980 -10.841 8.256 961 2HE LYS 127 2HE LYS 127 2.690 -10.609 9.445 962 1HZ LYS 127 1HZ LYS 127 2.531 -13.038 9.651 963 2HZ LYS 127 2HZ LYS 127 3.736 -13.250 8.541 964 3HZ LYS 127 3HZ LYS 127 4.063 -12.519 9.986 965 H VAL 128 H VAL 128 1.666 -8.777 7.725 966 HA VAL 128 HA VAL 128 1.331 -5.983 8.894 967 HB VAL 128 HB VAL 128 -0.888 -8.113 8.936 968 1HG1 VAL 128 1HG2 VAL 128 -0.768 -5.241 10.072 969 2HG1 VAL 128 2HG2 VAL 128 -2.204 -6.300 10.086 970 3HG1 VAL 128 3HG2 VAL 128 -0.761 -6.741 11.035 971 1HG2 VAL 128 2HG1 VAL 128 -0.664 -6.987 6.700 972 2HG2 VAL 128 3HG1 VAL 128 -2.150 -6.452 7.528 973 3HG2 VAL 128 1HG1 VAL 128 -0.719 -5.388 7.486 974 H VAL 129 H VAL 129 1.061 -5.942 11.108 975 HA VAL 129 HA VAL 129 1.991 -8.380 12.693 976 HB VAL 129 HB VAL 129 3.894 -7.128 13.626 977 1HG1 VAL 129 3HG2 VAL 129 4.246 -8.536 11.578 978 2HG1 VAL 129 1HG2 VAL 129 3.869 -7.139 10.537 979 3HG1 VAL 129 2HG2 VAL 129 5.329 -7.119 11.563 980 1HG2 VAL 129 2HG1 VAL 129 2.936 -4.816 13.402 981 2HG2 VAL 129 3HG1 VAL 129 4.549 -4.907 12.647 982 3HG2 VAL 129 1HG1 VAL 129 3.085 -4.914 11.628 983 H LYS 130 H LYS 130 -0.213 -6.021 12.504 984 HA LYS 130 HA LYS 130 -1.247 -6.554 15.131 985 1HB LYS 130 1HB LYS 130 0.803 -5.369 15.928 986 2HB LYS 130 2HB LYS 130 0.348 -3.929 15.000 987 1HG LYS 130 1HG LYS 130 -1.848 -3.834 16.257 988 2HG LYS 130 2HG LYS 130 -1.377 -5.223 17.221 989 1HD LYS 130 1HD LYS 130 0.122 -2.515 17.172 990 2HD LYS 130 2HD LYS 130 -1.109 -2.958 18.347 991 1HE LYS 130 1HE LYS 130 0.327 -4.897 19.154 992 2HE LYS 130 2HE LYS 130 1.590 -4.434 18.004 993 1HZ LYS 130 1HZ LYS 130 1.740 -2.272 19.127 994 2HZ LYS 130 2HZ LYS 130 0.564 -2.705 20.203 995 3HZ LYS 130 3HZ LYS 130 2.009 -3.507 20.191 996 H GLY 131 H GLY 131 -0.904 -3.261 14.202 997 1HA GLY 131 1HA GLY 131 -3.547 -2.547 14.674 998 2HA GLY 131 2HA GLY 131 -2.531 -1.615 13.580 999 H MET 132 H MET 132 -4.270 -4.710 13.484 1000 HA MET 132 HA MET 132 -5.425 -4.180 10.738 1001 1HB MET 132 1HB MET 132 -5.609 -6.457 12.734 1002 2HB MET 132 2HB MET 132 -6.985 -6.191 11.655 1003 1HG MET 132 1HG MET 132 -4.072 -6.472 10.697 1004 2HG MET 132 2HG MET 132 -5.342 -7.716 10.572 1005 1HE MET 132 1HE MET 132 -3.832 -6.753 7.920 1006 2HE MET 132 3HE MET 132 -5.216 -7.894 7.885 1007 3HE MET 132 2HE MET 132 -5.205 -6.466 6.811 1008 H ASP 133 H ASP 133 -6.515 -4.372 14.111 1009 HA ASP 133 HA ASP 133 -9.226 -3.627 13.953 1010 1HB ASP 133 1HB ASP 133 -7.149 -2.389 15.860 1011 2HB ASP 133 2HB ASP 133 -8.899 -2.362 16.103 1012 H VAL 134 H VAL 134 -6.490 -1.392 14.062 1013 HA VAL 134 HA VAL 134 -7.875 1.081 13.451 1014 HB VAL 134 HB VAL 134 -5.055 0.136 12.671 1015 1HG1 VAL 134 3HG2 VAL 134 -5.814 2.011 11.187 1016 2HG1 VAL 134 1HG2 VAL 134 -6.271 2.975 12.616 1017 3HG1 VAL 134 2HG2 VAL 134 -4.558 2.570 12.322 1018 1HG2 VAL 134 2HG1 VAL 134 -5.530 0.242 15.144 1019 2HG2 VAL 134 3HG1 VAL 134 -4.395 1.532 14.663 1020 3HG2 VAL 134 1HG1 VAL 134 -6.108 1.920 14.968 1021 H ALA 135 H ALA 135 -6.002 -0.930 11.221 1022 HA ALA 135 HA ALA 135 -6.797 0.166 8.733 1023 1HB ALA 135 2HB ALA 135 -5.160 -1.739 8.950 1024 2HB ALA 135 3HB ALA 135 -6.491 -2.853 9.365 1025 3HB ALA 135 1HB ALA 135 -6.415 -2.116 7.745 1026 H ASP 136 H ASP 136 -8.406 -2.392 10.534 1027 HA ASP 136 HA ASP 136 -10.716 -2.756 8.745 1028 1HB ASP 136 1HB ASP 136 -10.484 -3.189 11.788 1029 2HB ASP 136 2HB ASP 136 -11.800 -3.786 10.768 1030 H LYS 137 H LYS 137 -10.531 -1.331 11.957 1031 HA LYS 137 HA LYS 137 -12.927 0.064 12.206 1032 1HB LYS 137 1HB LYS 137 -10.989 0.136 13.840 1033 2HB LYS 137 2HB LYS 137 -10.177 1.312 12.797 1034 1HG LYS 137 1HG LYS 137 -12.909 1.625 14.189 1035 2HG LYS 137 2HG LYS 137 -11.423 2.488 14.598 1036 1HD LYS 137 1HD LYS 137 -11.436 3.595 12.324 1037 2HD LYS 137 2HD LYS 137 -12.907 2.740 11.885 1038 1HE LYS 137 1HE LYS 137 -12.680 4.746 14.240 1039 2HE LYS 137 2HE LYS 137 -13.227 5.164 12.619 1040 1HZ LYS 137 1HZ LYS 137 -15.088 3.615 12.880 1041 2HZ LYS 137 2HZ LYS 137 -14.591 3.209 14.402 1042 3HZ LYS 137 3HZ LYS 137 -15.094 4.750 14.081 1043 H ILE 138 H ILE 138 -10.063 1.213 10.475 1044 HA ILE 138 HA ILE 138 -11.216 3.705 9.425 1045 HB ILE 138 HB ILE 138 -9.043 1.901 8.212 1046 1HG1 ILE 138 1HG1 ILE 138 -9.068 4.326 10.097 1047 2HG1 ILE 138 2HG1 ILE 138 -8.398 2.726 10.432 1048 1HG2 ILE 138 2HG2 ILE 138 -10.126 3.430 6.531 1049 2HG2 ILE 138 3HG2 ILE 138 -9.865 4.820 7.619 1050 3HG2 ILE 138 1HG2 ILE 138 -8.468 3.970 6.908 1051 1HD1 ILE 138 2HD1 ILE 138 -6.656 3.098 8.598 1052 2HD1 ILE 138 3HD1 ILE 138 -7.350 4.711 8.290 1053 3HD1 ILE 138 1HD1 ILE 138 -6.569 4.366 9.853 1054 H SER 139 H SER 139 -10.700 0.518 7.973 1055 HA SER 139 HA SER 139 -12.234 1.010 5.558 1056 1HB SER 139 1HB SER 139 -12.150 -1.458 5.235 1057 2HB SER 139 2HB SER 139 -10.576 -0.809 5.731 1058 HG SER 139 HG SER 139 -11.115 -1.384 7.883 1059 H GLN 140 H GLN 140 -13.445 1.042 8.483 1060 HA GLN 140 HA GLN 140 -16.203 -0.109 7.731 1061 1HB GLN 140 1HB GLN 140 -15.064 0.917 10.393 1062 2HB GLN 140 2HB GLN 140 -16.788 0.659 10.114 1063 1HG GLN 140 1HG GLN 140 -15.872 -1.368 11.130 1064 2HG GLN 140 2HG GLN 140 -16.388 -1.727 9.483 1065 1HE2 GLN 140 2HE2 GLN 140 -13.071 -2.463 8.326 1066 2HE2 GLN 140 1HE2 GLN 140 -14.784 -2.019 7.853 1067 H VAL 141 H VAL 141 -14.596 2.779 8.992 1068 HA VAL 141 HA VAL 141 -16.709 4.700 8.802 1069 HB VAL 141 HB VAL 141 -14.946 6.410 8.459 1070 1HG1 VAL 141 3HG2 VAL 141 -15.304 5.415 10.736 1071 2HG1 VAL 141 1HG2 VAL 141 -14.119 4.133 10.377 1072 3HG1 VAL 141 2HG2 VAL 141 -13.587 5.833 10.496 1073 1HG2 VAL 141 2HG1 VAL 141 -13.583 5.162 6.755 1074 2HG2 VAL 141 3HG1 VAL 141 -12.560 5.680 8.121 1075 3HG2 VAL 141 1HG1 VAL 141 -13.091 3.981 7.996 1076 HA PRO 142 HA PRO 142 -18.174 4.432 4.718 1077 1HB PRO 142 1HB PRO 142 -18.825 7.333 5.452 1078 2HB PRO 142 2HB PRO 142 -19.895 6.128 4.694 1079 1HG PRO 142 1HG PRO 142 -20.155 6.584 7.354 1080 2HG PRO 142 2HG PRO 142 -20.122 4.895 6.788 1081 1HD PRO 142 1HD PRO 142 -17.842 6.475 8.090 1082 2HD PRO 142 2HD PRO 142 -18.308 4.760 8.339 1083 H THR 143 H THR 143 -18.408 5.981 2.861 1084 HA THR 143 HA THR 143 -16.125 7.836 2.226 1085 HB THR 143 HB THR 143 -15.853 6.230 0.036 1086 HG1 THR 143 HG1 THR 143 -15.578 4.112 0.806 1087 1HG2 THR 143 2HG2 THR 143 -14.023 7.218 1.374 1088 2HG2 THR 143 3HG2 THR 143 -14.238 5.970 2.636 1089 3HG2 THR 143 1HG2 THR 143 -13.682 5.508 0.996 1090 H HIS 144 H HIS 144 -16.301 6.918 -0.493 1091 HA HIS 144 HA HIS 144 -19.004 6.744 -1.466 1092 1HB HIS 144 1HB HIS 144 -19.508 8.958 -2.374 1093 2HB HIS 144 2HB HIS 144 -19.337 9.026 -0.624 1094 HD2 HIS 144 HD2 HIS 144 -15.896 8.858 -2.196 1095 HE1 HIS 144 HE1 HIS 144 -16.676 12.921 -1.794 1096 HE2 HIS 144 HE2 HIS 144 -14.783 11.260 -2.320 1097 H ASP 145 H ASP 145 -19.245 6.318 -3.374 1098 HA ASP 145 HA ASP 145 -16.951 5.867 -5.256 1099 1HB ASP 145 1HB ASP 145 -18.962 4.406 -5.300 1100 2HB ASP 145 2HB ASP 145 -19.997 5.811 -5.648 1101 H VAL 146 H VAL 146 -16.040 7.431 -6.012 1102 HA VAL 146 HA VAL 146 -17.165 10.186 -6.036 1103 HB VAL 146 HB VAL 146 -14.511 9.501 -7.341 1104 1HG1 VAL 146 3HG2 VAL 146 -15.391 11.870 -7.251 1105 2HG1 VAL 146 1HG2 VAL 146 -15.546 11.741 -5.479 1106 3HG1 VAL 146 2HG2 VAL 146 -13.931 11.692 -6.233 1107 1HG2 VAL 146 1HG1 VAL 146 -15.035 9.537 -4.303 1108 2HG2 VAL 146 2HG1 VAL 146 -14.518 8.121 -5.262 1109 3HG2 VAL 146 3HG1 VAL 146 -13.429 9.521 -5.087 1110 H GLY 147 H GLY 147 -15.445 10.811 -8.411 1111 1HA GLY 147 1HA GLY 147 -17.497 10.802 -10.587 1112 2HA GLY 147 2HA GLY 147 -15.788 11.244 -10.772 1113 HA PRO 148 HA PRO 148 -15.181 7.236 -12.769 1114 1HB PRO 148 1HB PRO 148 -12.472 7.602 -13.092 1115 2HB PRO 148 2HB PRO 148 -13.653 8.550 -14.029 1116 1HG PRO 148 1HG PRO 148 -12.220 9.395 -11.450 1117 2HG PRO 148 2HG PRO 148 -12.315 10.304 -12.979 1118 1HD PRO 148 1HD PRO 148 -14.062 10.805 -10.878 1119 2HD PRO 148 2HD PRO 148 -14.628 10.916 -12.576 1120 OH TYR 149 OH TYR 149 -7.619 9.133 -12.173 1121 H TYR 149 H TYR 149 -12.993 8.606 -10.345 1122 HA TYR 149 HA TYR 149 -12.001 6.031 -9.324 1123 1HB TYR 149 1HB TYR 149 -11.976 8.805 -7.989 1124 2HB TYR 149 2HB TYR 149 -11.012 7.411 -7.492 1125 HD1 TYR 149 HD1 TYR 149 -9.565 6.312 -9.328 1126 HD2 TYR 149 HD2 TYR 149 -11.125 10.221 -9.649 1127 HE1 TYR 149 HE1 TYR 149 -7.876 6.851 -10.989 1128 HE2 TYR 149 HE2 TYR 149 -9.436 10.758 -11.309 1129 HH TYR 149 HH TYR 149 -7.070 8.360 -12.322 1130 H GLN 150 H GLN 150 -13.867 4.897 -9.073 1131 HA GLN 150 HA GLN 150 -15.921 5.545 -7.003 1132 1HB GLN 150 1HB GLN 150 -15.202 2.854 -8.329 1133 2HB GLN 150 2HB GLN 150 -16.599 3.155 -7.295 1134 1HG GLN 150 1HG GLN 150 -17.391 3.322 -9.574 1135 2HG GLN 150 2HG GLN 150 -17.385 4.959 -8.913 1136 1HE2 GLN 150 2HE2 GLN 150 -14.286 4.006 -11.524 1137 2HE2 GLN 150 1HE2 GLN 150 -14.833 2.836 -10.220 1138 H ASN 151 H ASN 151 -14.030 6.227 -5.658 1139 HA ASN 151 HA ASN 151 -13.694 4.566 -3.325 1140 1HB ASN 151 1HB ASN 151 -11.416 3.632 -3.617 1141 2HB ASN 151 2HB ASN 151 -12.522 2.966 -4.828 1142 1HD2 ASN 151 1HD2 ASN 151 -9.617 3.889 -6.854 1143 2HD2 ASN 151 2HD2 ASN 151 -10.236 2.597 -5.707 1144 H VAL 152 H VAL 152 -14.064 6.628 -2.596 1145 HA VAL 152 HA VAL 152 -11.456 7.933 -1.797 1146 HB VAL 152 HB VAL 152 -13.680 9.472 -3.251 1147 1HG1 VAL 152 1HG2 VAL 152 -11.130 10.481 -1.819 1148 2HG1 VAL 152 2HG2 VAL 152 -12.242 11.490 -2.783 1149 3HG1 VAL 152 3HG2 VAL 152 -12.804 10.741 -1.266 1150 1HG2 VAL 152 2HG1 VAL 152 -12.053 8.243 -4.739 1151 2HG2 VAL 152 3HG1 VAL 152 -11.789 10.004 -4.846 1152 3HG2 VAL 152 1HG1 VAL 152 -10.683 8.992 -3.879 1153 HA PRO 153 HA PRO 153 -13.505 7.520 2.074 1154 1HB PRO 153 1HB PRO 153 -11.233 9.526 2.516 1155 2HB PRO 153 2HB PRO 153 -11.681 8.137 3.537 1156 1HG PRO 153 1HG PRO 153 -9.566 7.878 1.855 1157 2HG PRO 153 2HG PRO 153 -10.757 6.556 1.926 1158 1HD PRO 153 1HD PRO 153 -10.507 8.733 -0.219 1159 2HD PRO 153 2HD PRO 153 -10.864 6.987 -0.427 1160 H SER 154 H SER 154 -15.303 8.468 2.307 1161 HA SER 154 HA SER 154 -16.310 10.890 1.315 1162 1HB SER 154 1HB SER 154 -17.960 10.873 3.181 1163 2HB SER 154 2HB SER 154 -17.693 9.233 2.557 1164 HG SER 154 HG SER 154 -17.622 9.347 4.828 1165 H LYS 155 H LYS 155 -14.362 10.428 4.208 1166 HA LYS 155 HA LYS 155 -13.299 13.173 4.205 1167 1HB LYS 155 1HB LYS 155 -15.446 12.517 6.312 1168 2HB LYS 155 2HB LYS 155 -14.422 13.961 6.312 1169 1HG LYS 155 1HG LYS 155 -15.349 14.645 4.068 1170 2HG LYS 155 2HG LYS 155 -16.288 13.164 3.996 1171 1HD LYS 155 1HD LYS 155 -17.824 14.916 4.616 1172 2HD LYS 155 2HD LYS 155 -17.632 13.864 5.999 1173 1HE LYS 155 1HE LYS 155 -17.695 16.131 6.827 1174 2HE LYS 155 2HE LYS 155 -16.048 15.564 7.071 1175 1HZ LYS 155 1HZ LYS 155 -16.961 17.313 4.830 1176 2HZ LYS 155 2HZ LYS 155 -16.096 17.798 6.151 1177 3HZ LYS 155 3HZ LYS 155 -15.408 16.789 5.039 1178 HA PRO 156 HA PRO 156 -12.322 11.448 8.606 1179 1HB PRO 156 1HB PRO 156 -13.828 8.797 8.300 1180 2HB PRO 156 2HB PRO 156 -13.558 9.737 9.789 1181 1HG PRO 156 1HG PRO 156 -15.953 9.970 8.539 1182 2HG PRO 156 2HG PRO 156 -15.136 11.459 9.078 1183 1HD PRO 156 1HD PRO 156 -15.271 10.327 6.236 1184 2HD PRO 156 2HD PRO 156 -15.369 12.034 6.773 1185 H VAL 157 H VAL 157 -10.581 11.481 7.001 1186 HA VAL 157 HA VAL 157 -8.748 9.396 7.764 1187 HB VAL 157 HB VAL 157 -9.749 9.118 4.883 1188 1HG1 VAL 157 1HG2 VAL 157 -7.177 7.980 6.167 1189 2HG1 VAL 157 2HG2 VAL 157 -7.804 7.552 4.552 1190 3HG1 VAL 157 3HG2 VAL 157 -7.237 9.211 4.880 1191 1HG2 VAL 157 2HG1 VAL 157 -10.917 7.762 6.678 1192 2HG2 VAL 157 3HG1 VAL 157 -9.958 6.703 5.608 1193 3HG2 VAL 157 1HG1 VAL 157 -9.342 7.128 7.223 1194 H VAL 158 H VAL 158 -6.991 10.193 7.938 1195 HA VAL 158 HA VAL 158 -5.518 11.672 5.884 1196 HB VAL 158 HB VAL 158 -6.542 13.340 8.261 1197 1HG1 VAL 158 3HG2 VAL 158 -4.093 13.714 7.831 1198 2HG1 VAL 158 1HG2 VAL 158 -4.425 13.994 6.104 1199 3HG1 VAL 158 2HG2 VAL 158 -5.040 15.137 7.328 1200 1HG2 VAL 158 2HG1 VAL 158 -8.127 13.179 6.311 1201 2HG2 VAL 158 3HG1 VAL 158 -7.434 14.820 6.426 1202 3HG2 VAL 158 1HG1 VAL 158 -6.823 13.676 5.200 1203 H ILE 159 H ILE 159 -3.706 10.911 6.110 1204 HA ILE 159 HA ILE 159 -2.806 9.447 8.486 1205 HB ILE 159 HB ILE 159 -1.233 10.379 6.025 1206 1HG1 ILE 159 1HG1 ILE 159 -2.762 7.826 6.820 1207 2HG1 ILE 159 2HG1 ILE 159 -3.170 8.928 5.499 1208 1HG2 ILE 159 3HG2 ILE 159 -0.583 8.289 8.207 1209 2HG2 ILE 159 1HG2 ILE 159 0.377 8.579 6.730 1210 3HG2 ILE 159 2HG2 ILE 159 0.255 9.847 7.979 1211 1HD1 ILE 159 3HD1 ILE 159 -0.576 7.252 5.700 1212 2HD1 ILE 159 1HD1 ILE 159 -1.964 6.897 4.634 1213 3HD1 ILE 159 2HD1 ILE 159 -0.974 8.360 4.357 1214 H LEU 160 H LEU 160 -1.678 9.856 10.021 1215 HA LEU 160 HA LEU 160 -1.196 12.734 10.831 1216 1HB LEU 160 1HB LEU 160 -0.757 10.111 12.380 1217 2HB LEU 160 2HB LEU 160 -0.621 11.744 13.049 1218 HG LEU 160 HG LEU 160 -3.142 10.539 11.761 1219 1HD1 LEU 160 2HD1 LEU 160 -2.630 9.607 14.041 1220 2HD1 LEU 160 3HD1 LEU 160 -2.510 11.259 14.701 1221 3HD1 LEU 160 1HD1 LEU 160 -4.073 10.652 14.095 1222 1HD2 LEU 160 3HD2 LEU 160 -2.950 13.009 11.348 1223 2HD2 LEU 160 1HD2 LEU 160 -4.262 12.663 12.504 1224 3HD2 LEU 160 2HD2 LEU 160 -2.700 13.295 13.090 1225 H SER 161 H SER 161 0.621 9.719 10.573 1226 HA SER 161 HA SER 161 3.124 11.087 9.658 1227 1HB SER 161 1HB SER 161 2.997 11.660 12.124 1228 2HB SER 161 2HB SER 161 3.005 9.930 12.513 1229 HG SER 161 HG SER 161 5.075 10.872 12.569 1230 H ALA 162 H ALA 162 4.978 9.688 9.715 1231 HA ALA 162 HA ALA 162 4.479 6.702 9.551 1232 1HB ALA 162 2HB ALA 162 3.744 7.554 7.288 1233 2HB ALA 162 3HB ALA 162 5.324 8.354 7.073 1234 3HB ALA 162 1HB ALA 162 5.228 6.578 7.161 1235 H LYS 163 H LYS 163 6.098 5.574 9.934 1236 HA LYS 163 HA LYS 163 8.918 6.281 9.431 1237 1HB LYS 163 1HB LYS 163 7.934 6.442 12.343 1238 2HB LYS 163 2HB LYS 163 9.630 6.437 11.835 1239 1HG LYS 163 1HG LYS 163 9.168 8.477 10.387 1240 2HG LYS 163 2HG LYS 163 7.524 8.540 10.997 1241 1HD LYS 163 1HD LYS 163 10.081 8.804 12.714 1242 2HD LYS 163 2HD LYS 163 9.174 10.163 12.097 1243 1HE LYS 163 1HE LYS 163 8.047 8.094 14.108 1244 2HE LYS 163 2HE LYS 163 8.751 9.648 14.539 1245 1HZ LYS 163 1HZ LYS 163 6.997 10.761 13.269 1246 2HZ LYS 163 2HZ LYS 163 6.318 9.312 12.857 1247 3HZ LYS 163 3HZ LYS 163 6.352 9.789 14.439 1248 H VAL 164 H VAL 164 10.114 4.633 9.411 1249 HA VAL 164 HA VAL 164 9.037 1.908 9.766 1250 HB VAL 164 HB VAL 164 11.345 1.233 9.195 1251 1HG1 VAL 164 3HG2 VAL 164 9.793 1.975 7.368 1252 2HG1 VAL 164 1HG2 VAL 164 10.354 3.656 7.560 1253 3HG1 VAL 164 2HG2 VAL 164 11.480 2.401 6.975 1254 1HG2 VAL 164 2HG1 VAL 164 12.564 2.941 10.573 1255 2HG2 VAL 164 3HG1 VAL 164 13.128 2.977 8.882 1256 3HG2 VAL 164 1HG1 VAL 164 12.011 4.234 9.479 1257 H LEU 165 H LEU 165 10.322 0.308 10.903 1258 HA LEU 165 HA LEU 165 11.598 1.179 13.543 1259 1HB LEU 165 1HB LEU 165 9.102 0.745 13.888 1260 2HB LEU 165 2HB LEU 165 9.359 -0.932 13.398 1261 HG LEU 165 HG LEU 165 10.844 0.483 15.698 1262 1HD1 LEU 165 2HD1 LEU 165 8.394 0.239 16.184 1263 2HD1 LEU 165 3HD1 LEU 165 8.479 -1.501 15.806 1264 3HD1 LEU 165 1HD1 LEU 165 9.354 -0.851 17.216 1265 1HD2 LEU 165 2HD2 LEU 165 10.713 -2.508 14.929 1266 2HD2 LEU 165 3HD2 LEU 165 12.134 -1.447 14.744 1267 3HD2 LEU 165 1HD2 LEU 165 11.527 -1.844 16.370 1268 HA PRO 166 HA PRO 166 14.773 -1.466 12.058 1269 1HB PRO 166 1HB PRO 166 15.133 -1.406 15.101 1270 2HB PRO 166 2HB PRO 166 16.385 -1.230 13.847 1271 1HG PRO 166 1HG PRO 166 15.450 1.010 15.060 1272 2HG PRO 166 2HG PRO 166 15.622 1.017 13.287 1273 1HD PRO 166 1HD PRO 166 13.049 0.668 14.914 1274 2HD PRO 166 2HD PRO 166 13.303 1.595 13.399 Start of MODEL 11 Raw file had 1274 H/Q atoms Start of MODEL 11 1 1H ALA 1 2H ALA 1 13.571 -8.763 20.841 2 2H ALA 1 3H ALA 1 14.730 -9.092 21.971 3 3H ALA 1 1H ALA 1 13.639 -7.880 22.236 4 HA ALA 1 HA ALA 1 14.518 -6.576 20.392 5 1HB ALA 1 1HB ALA 1 15.463 -6.222 22.697 6 2HB ALA 1 2HB ALA 1 16.667 -7.507 22.415 7 3HB ALA 1 3HB ALA 1 16.723 -6.003 21.458 8 H LYS 2 H LYS 2 15.461 -6.531 18.580 9 HA LYS 2 HA LYS 2 17.818 -7.954 17.710 10 1HB LYS 2 1HB LYS 2 16.339 -9.979 18.077 11 2HB LYS 2 2HB LYS 2 15.197 -9.347 16.888 12 1HG LYS 2 1HG LYS 2 16.746 -10.991 15.813 13 2HG LYS 2 2HG LYS 2 16.906 -9.389 15.109 14 1HD LYS 2 1HD LYS 2 19.145 -10.226 15.352 15 2HD LYS 2 2HD LYS 2 18.948 -8.938 16.517 16 1HE LYS 2 1HE LYS 2 20.209 -10.695 17.595 17 2HE LYS 2 2HE LYS 2 18.631 -10.676 18.373 18 1HZ LYS 2 2HZ LYS 2 19.489 -12.592 16.250 19 2HZ LYS 2 3HZ LYS 2 19.349 -12.927 17.862 20 3HZ LYS 2 1HZ LYS 2 18.001 -12.590 16.968 21 H GLY 3 H GLY 3 15.055 -8.278 15.692 22 1HA GLY 3 1HA GLY 3 14.963 -5.631 14.434 23 2HA GLY 3 2HA GLY 3 16.136 -6.615 13.541 24 H ASP 4 H ASP 4 13.565 -5.463 12.874 25 HA ASP 4 HA ASP 4 12.487 -7.663 11.217 26 1HB ASP 4 1HB ASP 4 10.792 -6.708 13.609 27 2HB ASP 4 2HB ASP 4 10.153 -7.626 12.237 28 HA PRO 5 HA PRO 5 11.625 -3.894 9.019 29 1HB PRO 5 1HB PRO 5 10.836 -5.199 6.708 30 2HB PRO 5 2HB PRO 5 12.529 -5.149 7.254 31 1HG PRO 5 1HG PRO 5 10.495 -7.396 7.718 32 2HG PRO 5 2HG PRO 5 12.143 -7.548 7.061 33 1HD PRO 5 1HD PRO 5 11.624 -8.015 9.738 34 2HD PRO 5 2HD PRO 5 13.144 -7.196 9.251 35 H HIS 6 H HIS 6 10.009 -2.793 9.547 36 HA HIS 6 HA HIS 6 7.135 -3.648 9.000 37 1HB HIS 6 1HB HIS 6 8.141 -2.820 11.787 38 2HB HIS 6 2HB HIS 6 6.459 -3.132 11.333 39 HD2 HIS 6 HD2 HIS 6 8.682 -5.518 9.490 40 HE1 HIS 6 HE1 HIS 6 7.562 -7.611 12.906 41 HE2 HIS 6 HE2 HIS 6 8.688 -7.926 10.615 42 H VAL 7 H VAL 7 6.743 -2.174 7.629 43 HA VAL 7 HA VAL 7 7.453 0.706 7.835 44 HB VAL 7 HB VAL 7 6.628 -0.223 5.646 45 1HG1 VAL 7 1HG2 VAL 7 3.991 -0.670 7.185 46 2HG1 VAL 7 2HG2 VAL 7 4.227 -0.910 5.433 47 3HG1 VAL 7 3HG2 VAL 7 5.079 -1.955 6.600 48 1HG2 VAL 7 1HG1 VAL 7 4.697 1.808 6.936 49 2HG2 VAL 7 2HG1 VAL 7 6.263 2.202 6.183 50 3HG2 VAL 7 3HG1 VAL 7 4.931 1.562 5.184 51 H LEU 8 H LEU 8 6.996 1.684 9.580 52 HA LEU 8 HA LEU 8 4.323 1.177 11.025 53 1HB LEU 8 1HB LEU 8 6.595 0.382 12.007 54 2HB LEU 8 2HB LEU 8 6.917 2.084 12.362 55 HG LEU 8 HG LEU 8 4.298 0.642 13.108 56 1HD1 LEU 8 2HD1 LEU 8 6.225 -0.541 14.145 57 2HD1 LEU 8 3HD1 LEU 8 6.839 0.992 14.818 58 3HD1 LEU 8 1HD1 LEU 8 5.281 0.319 15.389 59 1HD2 LEU 8 3HD2 LEU 8 4.182 3.152 13.110 60 2HD2 LEU 8 1HD2 LEU 8 4.053 2.509 14.767 61 3HD2 LEU 8 2HD2 LEU 8 5.586 3.228 14.208 62 H LEU 9 H LEU 9 3.043 2.575 10.851 63 HA LEU 9 HA LEU 9 3.764 5.567 10.937 64 1HB LEU 9 1HB LEU 9 1.619 4.303 9.115 65 2HB LEU 9 2HB LEU 9 1.938 6.023 9.332 66 HG LEU 9 HG LEU 9 4.357 5.578 8.540 67 1HD1 LEU 9 2HD1 LEU 9 4.340 3.070 8.799 68 2HD1 LEU 9 3HD1 LEU 9 3.046 2.947 7.578 69 3HD1 LEU 9 1HD1 LEU 9 4.663 3.529 7.106 70 1HD2 LEU 9 3HD2 LEU 9 2.608 6.684 7.118 71 2HD2 LEU 9 1HD2 LEU 9 3.653 5.637 6.125 72 3HD2 LEU 9 2HD2 LEU 9 2.017 5.091 6.579 73 H THR 10 H THR 10 1.338 6.575 10.834 74 HA THR 10 HA THR 10 -0.616 5.234 12.630 75 HB THR 10 HB THR 10 0.986 7.669 13.656 76 HG1 THR 10 HG1 THR 10 1.522 6.193 15.298 77 1HG2 THR 10 2HG2 THR 10 -1.453 7.791 14.260 78 2HG2 THR 10 3HG2 THR 10 -1.379 6.137 14.925 79 3HG2 THR 10 1HG2 THR 10 -0.458 7.454 15.702 80 H THR 11 H THR 11 -2.155 5.625 11.343 81 HA THR 11 HA THR 11 -2.686 8.275 10.018 82 HB THR 11 HB THR 11 -4.909 7.202 9.450 83 HG1 THR 11 HG1 THR 11 -5.009 4.971 9.868 84 1HG2 THR 11 2HG2 THR 11 -2.910 7.081 7.948 85 2HG2 THR 11 3HG2 THR 11 -2.352 5.608 8.786 86 3HG2 THR 11 1HG2 THR 11 -3.873 5.582 7.844 87 H SER 12 H SER 12 -4.697 9.265 10.233 88 HA SER 12 HA SER 12 -5.170 10.563 12.715 89 1HB SER 12 1HB SER 12 -7.453 11.109 11.872 90 2HB SER 12 2HB SER 12 -6.235 11.288 10.596 91 HG SER 12 HG SER 12 -8.070 10.135 9.915 92 H ALA 13 H ALA 13 -6.709 7.643 11.470 93 HA ALA 13 HA ALA 13 -8.515 7.067 13.628 94 1HB ALA 13 2HB ALA 13 -8.475 5.746 11.496 95 2HB ALA 13 3HB ALA 13 -6.908 5.032 11.959 96 3HB ALA 13 1HB ALA 13 -8.372 4.673 12.912 97 H GLY 14 H GLY 14 -5.359 5.873 13.105 98 1HA GLY 14 1HA GLY 14 -4.222 6.221 15.748 99 2HA GLY 14 2HA GLY 14 -4.996 4.632 15.803 100 H ASN 15 H ASN 15 -2.740 4.296 16.372 101 HA ASN 15 HA ASN 15 -0.513 4.261 14.542 102 1HB ASN 15 1HB ASN 15 -0.391 3.695 16.998 103 2HB ASN 15 2HB ASN 15 -1.200 2.155 16.681 104 1HD2 ASN 15 1HD2 ASN 15 2.516 2.620 14.884 105 2HD2 ASN 15 2HD2 ASN 15 1.254 3.951 14.836 106 H ILE 16 H ILE 16 0.470 2.486 13.523 107 HA ILE 16 HA ILE 16 -1.044 0.136 12.532 108 HB ILE 16 HB ILE 16 -0.913 2.666 10.803 109 1HG1 ILE 16 1HG1 ILE 16 -3.087 0.723 11.787 110 2HG1 ILE 16 2HG1 ILE 16 -2.926 2.434 12.200 111 1HG2 ILE 16 3HG2 ILE 16 -1.470 -0.229 9.915 112 2HG2 ILE 16 1HG2 ILE 16 -1.667 1.234 8.905 113 3HG2 ILE 16 2HG2 ILE 16 -0.043 0.748 9.465 114 1HD1 ILE 16 2HD1 ILE 16 -3.342 3.042 9.757 115 2HD1 ILE 16 3HD1 ILE 16 -3.512 1.308 9.374 116 3HD1 ILE 16 1HD1 ILE 16 -4.698 2.100 10.443 117 H GLU 17 H GLU 17 -0.015 -1.071 11.032 118 HA GLU 17 HA GLU 17 2.876 -0.607 10.363 119 1HB GLU 17 1HB GLU 17 2.152 -2.659 12.531 120 2HB GLU 17 2HB GLU 17 3.777 -2.309 11.919 121 1HG GLU 17 1HG GLU 17 3.594 0.067 12.756 122 2HG GLU 17 2HG GLU 17 1.945 -0.232 13.296 123 H LEU 18 H LEU 18 2.840 -1.382 8.454 124 HA LEU 18 HA LEU 18 1.832 -4.191 7.819 125 1HB LEU 18 1HB LEU 18 3.479 -2.303 6.041 126 2HB LEU 18 2HB LEU 18 2.804 -3.868 5.593 127 HG LEU 18 HG LEU 18 1.260 -2.290 4.733 128 1HD1 LEU 18 2HD1 LEU 18 0.150 -4.168 5.980 129 2HD1 LEU 18 3HD1 LEU 18 0.143 -3.189 7.471 130 3HD1 LEU 18 1HD1 LEU 18 -0.832 -2.683 6.066 131 1HD2 LEU 18 3HD2 LEU 18 2.106 -0.286 5.946 132 2HD2 LEU 18 1HD2 LEU 18 0.329 -0.379 6.041 133 3HD2 LEU 18 2HD2 LEU 18 1.325 -0.840 7.452 134 H GLU 19 H GLU 19 3.174 -5.823 7.337 135 HA GLU 19 HA GLU 19 6.129 -5.614 8.226 136 1HB GLU 19 1HB GLU 19 5.977 -8.054 8.711 137 2HB GLU 19 2HB GLU 19 4.964 -7.047 9.740 138 1HG GLU 19 1HG GLU 19 3.633 -8.981 9.099 139 2HG GLU 19 2HG GLU 19 2.945 -7.559 8.323 140 H LEU 20 H LEU 20 7.498 -5.753 6.801 141 HA LEU 20 HA LEU 20 6.721 -6.587 3.954 142 1HB LEU 20 1HB LEU 20 9.050 -4.865 4.975 143 2HB LEU 20 2HB LEU 20 8.633 -5.171 3.283 144 HG LEU 20 HG LEU 20 6.834 -3.806 5.371 145 1HD1 LEU 20 2HD1 LEU 20 8.704 -2.360 4.508 146 2HD1 LEU 20 3HD1 LEU 20 8.213 -2.709 2.830 147 3HD1 LEU 20 1HD1 LEU 20 7.129 -1.786 3.903 148 1HD2 LEU 20 3HD2 LEU 20 5.497 -5.205 3.771 149 2HD2 LEU 20 1HD2 LEU 20 5.232 -3.470 3.464 150 3HD2 LEU 20 2HD2 LEU 20 6.296 -4.412 2.389 151 H ASP 21 H ASP 21 8.920 -6.876 2.741 152 HA ASP 21 HA ASP 21 10.876 -8.782 3.953 153 1HB ASP 21 1HB ASP 21 8.773 -9.834 1.955 154 2HB ASP 21 2HB ASP 21 10.218 -10.717 2.476 155 H LYS 22 H LYS 22 11.730 -6.756 3.074 156 HA LYS 22 HA LYS 22 11.937 -5.975 0.363 157 1HB LYS 22 1HB LYS 22 14.136 -5.027 0.927 158 2HB LYS 22 2HB LYS 22 13.016 -4.797 2.276 159 1HG LYS 22 1HG LYS 22 15.222 -5.609 3.108 160 2HG LYS 22 2HG LYS 22 13.941 -6.772 3.463 161 1HD LYS 22 1HD LYS 22 14.615 -8.130 1.403 162 2HD LYS 22 2HD LYS 22 15.877 -6.955 1.065 163 1HE LYS 22 1HE LYS 22 16.971 -8.810 2.114 164 2HE LYS 22 2HE LYS 22 16.990 -7.509 3.300 165 1HZ LYS 22 2HZ LYS 22 15.074 -9.800 3.274 166 2HZ LYS 22 3HZ LYS 22 16.360 -9.623 4.295 167 3HZ LYS 22 1HZ LYS 22 15.075 -8.589 4.397 168 H GLN 23 H GLN 23 13.279 -8.814 1.838 169 HA GLN 23 HA GLN 23 15.603 -9.406 0.362 170 1HB GLN 23 1HB GLN 23 14.647 -10.920 2.116 171 2HB GLN 23 2HB GLN 23 13.348 -11.402 1.013 172 1HG GLN 23 1HG GLN 23 15.081 -12.234 -0.643 173 2HG GLN 23 2HG GLN 23 16.366 -11.771 0.475 174 1HE2 GLN 23 2HE2 GLN 23 14.514 -15.337 0.992 175 2HE2 GLN 23 1HE2 GLN 23 14.259 -14.227 -0.447 176 H LYS 24 H LYS 24 12.380 -10.517 -0.535 177 HA LYS 24 HA LYS 24 13.231 -11.158 -3.345 178 1HB LYS 24 1HB LYS 24 11.585 -12.527 -2.080 179 2HB LYS 24 2HB LYS 24 10.444 -11.171 -2.076 180 1HG LYS 24 1HG LYS 24 10.490 -11.100 -4.581 181 2HG LYS 24 2HG LYS 24 11.683 -12.384 -4.637 182 1HD LYS 24 1HD LYS 24 8.818 -12.681 -3.521 183 2HD LYS 24 2HD LYS 24 9.280 -13.093 -5.156 184 1HE LYS 24 1HE LYS 24 10.388 -14.492 -2.625 185 2HE LYS 24 2HE LYS 24 9.070 -15.087 -3.627 186 1HZ LYS 24 3HZ LYS 24 10.613 -15.251 -5.505 187 2HZ LYS 24 1HZ LYS 24 11.862 -14.691 -4.581 188 3HZ LYS 24 2HZ LYS 24 11.153 -16.138 -4.221 189 H ALA 25 H ALA 25 13.044 -8.291 -2.155 190 HA ALA 25 HA ALA 25 12.280 -7.032 -4.745 191 1HB ALA 25 2HB ALA 25 9.990 -7.319 -3.735 192 2HB ALA 25 3HB ALA 25 10.514 -6.444 -2.271 193 3HB ALA 25 1HB ALA 25 10.430 -5.596 -3.838 194 HA PRO 26 HA PRO 26 15.590 -5.060 -2.120 195 1HB PRO 26 1HB PRO 26 17.553 -5.300 -4.054 196 2HB PRO 26 2HB PRO 26 17.091 -6.654 -2.996 197 1HG PRO 26 1HG PRO 26 16.098 -6.101 -5.845 198 2HG PRO 26 2HG PRO 26 16.775 -7.622 -5.213 199 1HD PRO 26 1HD PRO 26 14.039 -7.222 -5.353 200 2HD PRO 26 2HD PRO 26 14.744 -8.109 -3.962 201 H VAL 27 H VAL 27 15.443 -4.781 -5.651 202 HA VAL 27 HA VAL 27 16.228 -2.050 -5.924 203 HB VAL 27 HB VAL 27 14.892 -2.066 -8.076 204 1HG1 VAL 27 3HG2 VAL 27 17.255 -2.895 -7.897 205 2HG1 VAL 27 1HG2 VAL 27 16.666 -4.520 -7.466 206 3HG1 VAL 27 2HG2 VAL 27 16.342 -3.855 -9.090 207 1HG2 VAL 27 1HG1 VAL 27 14.123 -4.909 -7.141 208 2HG2 VAL 27 2HG1 VAL 27 12.994 -3.548 -7.362 209 3HG2 VAL 27 3HG1 VAL 27 13.835 -4.243 -8.771 210 H SER 28 H SER 28 12.900 -3.208 -6.067 211 HA SER 28 HA SER 28 11.509 -0.745 -5.945 212 1HB SER 28 1HB SER 28 10.415 -2.988 -6.204 213 2HB SER 28 2HB SER 28 10.734 -3.354 -4.498 214 HG SER 28 HG SER 28 8.654 -2.503 -4.853 215 H VAL 29 H VAL 29 12.241 -2.818 -3.155 216 HA VAL 29 HA VAL 29 11.301 -1.199 -1.052 217 HB VAL 29 HB VAL 29 12.989 -2.327 0.372 218 1HG1 VAL 29 3HG2 VAL 29 10.909 -3.525 -0.351 219 2HG1 VAL 29 1HG2 VAL 29 11.747 -4.126 -1.805 220 3HG1 VAL 29 2HG2 VAL 29 12.268 -4.668 -0.187 221 1HG2 VAL 29 2HG1 VAL 29 14.964 -2.197 -1.172 222 2HG2 VAL 29 3HG1 VAL 29 14.664 -3.884 -0.681 223 3HG2 VAL 29 1HG1 VAL 29 14.170 -3.325 -2.301 224 H GLN 30 H GLN 30 14.523 -1.114 -2.515 225 HA GLN 30 HA GLN 30 15.735 0.961 -0.956 226 1HB GLN 30 1HB GLN 30 16.939 -0.322 -2.737 227 2HB GLN 30 2HB GLN 30 15.996 0.491 -3.993 228 1HG GLN 30 1HG GLN 30 18.210 1.601 -3.718 229 2HG GLN 30 2HG GLN 30 16.904 2.712 -3.293 230 1HE2 GLN 30 2HE2 GLN 30 18.192 3.205 -0.024 231 2HE2 GLN 30 1HE2 GLN 30 17.154 3.759 -1.432 232 H ASN 31 H ASN 31 13.997 1.296 -4.015 233 HA ASN 31 HA ASN 31 13.971 4.133 -4.249 234 1HB ASN 31 1HB ASN 31 13.110 2.570 -6.002 235 2HB ASN 31 2HB ASN 31 11.704 2.186 -5.002 236 1HD2 ASN 31 1HD2 ASN 31 10.065 5.336 -5.602 237 2HD2 ASN 31 2HD2 ASN 31 10.225 3.896 -4.476 238 H PHE 32 H PHE 32 11.324 2.159 -2.936 239 HA PHE 32 HA PHE 32 9.706 4.388 -2.126 240 1HB PHE 32 1HB PHE 32 8.341 2.912 -0.847 241 2HB PHE 32 2HB PHE 32 8.851 2.053 -2.292 242 HD1 PHE 32 HD1 PHE 32 9.462 2.431 1.330 243 HD2 PHE 32 HD2 PHE 32 10.135 0.045 -2.083 244 HE1 PHE 32 HE1 PHE 32 10.205 0.605 2.751 245 HE2 PHE 32 HE2 PHE 32 10.868 -1.781 -0.658 246 HZ PHE 32 HZ PHE 32 10.890 -1.508 1.758 247 H VAL 33 H VAL 33 12.109 2.574 -0.271 248 HA VAL 33 HA VAL 33 11.873 3.954 2.278 249 HB VAL 33 HB VAL 33 13.368 1.990 1.913 250 1HG1 VAL 33 3HG2 VAL 33 14.239 2.634 -0.358 251 2HG1 VAL 33 1HG2 VAL 33 15.116 4.011 0.357 252 3HG1 VAL 33 2HG2 VAL 33 15.586 2.341 0.773 253 1HG2 VAL 33 2HG1 VAL 33 13.731 3.533 3.861 254 2HG2 VAL 33 3HG1 VAL 33 15.285 2.877 3.281 255 3HG2 VAL 33 1HG1 VAL 33 14.813 4.548 2.872 256 H ASP 34 H ASP 34 13.506 4.809 -0.714 257 HA ASP 34 HA ASP 34 14.828 7.267 -0.016 258 1HB ASP 34 1HB ASP 34 13.072 6.623 -2.469 259 2HB ASP 34 2HB ASP 34 14.137 8.030 -2.352 260 OH TYR 35 OH TYR 35 9.589 8.667 -6.439 261 H TYR 35 H TYR 35 11.544 6.846 -1.210 262 HA TYR 35 HA TYR 35 10.531 9.509 -0.587 263 1HB TYR 35 1HB TYR 35 9.038 6.817 -0.694 264 2HB TYR 35 2HB TYR 35 8.248 8.393 -0.576 265 HD1 TYR 35 HD1 TYR 35 9.077 10.185 -2.284 266 HD2 TYR 35 HD2 TYR 35 9.503 6.024 -2.855 267 HE1 TYR 35 HE1 TYR 35 9.263 10.531 -4.683 268 HE2 TYR 35 HE2 TYR 35 9.688 6.376 -5.254 269 HH TYR 35 HH TYR 35 9.705 7.818 -6.871 270 H VAL 36 H VAL 36 10.208 6.460 1.183 271 HA VAL 36 HA VAL 36 8.951 7.355 3.590 272 HB VAL 36 HB VAL 36 11.283 5.369 3.335 273 1HG1 VAL 36 3HG2 VAL 36 10.838 6.092 5.699 274 2HG1 VAL 36 1HG2 VAL 36 9.109 5.700 5.509 275 3HG1 VAL 36 2HG2 VAL 36 10.330 4.399 5.457 276 1HG2 VAL 36 2HG1 VAL 36 9.349 4.834 1.816 277 2HG2 VAL 36 3HG1 VAL 36 9.445 3.651 3.146 278 3HG2 VAL 36 1HG1 VAL 36 8.221 4.948 3.191 279 H ASN 37 H ASN 37 12.410 6.842 3.207 280 HA ASN 37 HA ASN 37 13.412 8.130 5.507 281 1HB ASN 37 1HB ASN 37 14.848 6.961 3.820 282 2HB ASN 37 2HB ASN 37 14.630 8.292 2.679 283 1HD2 ASN 37 1HD2 ASN 37 16.805 10.548 4.467 284 2HD2 ASN 37 2HD2 ASN 37 15.384 10.415 3.315 285 H SER 38 H SER 38 12.677 9.624 2.402 286 HA SER 38 HA SER 38 13.526 12.339 3.091 287 1HB SER 38 1HB SER 38 12.082 13.049 1.140 288 2HB SER 38 2HB SER 38 13.252 11.772 0.770 289 HG SER 38 HG SER 38 11.578 10.250 1.064 290 H GLY 39 H GLY 39 10.319 12.443 2.086 291 1HA GLY 39 1HA GLY 39 9.013 12.696 4.783 292 2HA GLY 39 2HA GLY 39 9.326 14.265 4.011 293 H PHE 40 H PHE 40 8.280 11.044 3.061 294 HA PHE 40 HA PHE 40 6.248 12.107 1.074 295 1HB PHE 40 1HB PHE 40 7.683 10.186 0.458 296 2HB PHE 40 2HB PHE 40 7.161 9.280 1.876 297 HD1 PHE 40 HD2 PHE 40 4.699 8.708 2.091 298 HD2 PHE 40 HD1 PHE 40 6.377 10.100 -1.520 299 HE1 PHE 40 HE2 PHE 40 2.857 7.721 0.852 300 HE2 PHE 40 HE1 PHE 40 4.533 9.111 -2.756 301 HZ PHE 40 HZ PHE 40 2.781 7.903 -1.573 302 OH TYR 41 OH TYR 41 6.547 5.042 0.889 303 H TYR 41 H TYR 41 6.263 9.662 3.601 304 HA TYR 41 HA TYR 41 3.334 9.535 3.749 305 1HB TYR 41 1HB TYR 41 5.348 8.396 5.764 306 2HB TYR 41 2HB TYR 41 3.705 7.831 5.462 307 HD1 TYR 41 HD2 TYR 41 7.112 8.008 4.162 308 HD2 TYR 41 HD1 TYR 41 3.205 6.611 3.384 309 HE1 TYR 41 HE2 TYR 41 7.971 6.602 2.374 310 HE2 TYR 41 HE1 TYR 41 4.072 5.205 1.594 311 HH TYR 41 HH TYR 41 7.497 5.166 0.824 312 H ASN 42 H ASN 42 5.564 11.570 5.320 313 HA ASN 42 HA ASN 42 4.902 11.777 7.968 314 1HB ASN 42 1HB ASN 42 5.355 14.218 7.914 315 2HB ASN 42 2HB ASN 42 6.477 13.352 6.854 316 1HD2 ASN 42 1HD2 ASN 42 5.235 16.231 4.864 317 2HD2 ASN 42 2HD2 ASN 42 6.258 15.908 6.353 318 H ASN 43 H ASN 43 2.876 13.099 5.402 319 HA ASN 43 HA ASN 43 0.453 12.876 7.173 320 1HB ASN 43 1HB ASN 43 1.249 15.644 6.087 321 2HB ASN 43 2HB ASN 43 -0.210 15.247 6.999 322 1HD2 ASN 43 1HD2 ASN 43 2.117 16.594 9.526 323 2HD2 ASN 43 2HD2 ASN 43 1.130 17.151 8.083 324 H THR 44 H THR 44 1.120 11.480 5.021 325 HA THR 44 HA THR 44 -0.631 12.399 2.707 326 HB THR 44 HB THR 44 -0.273 10.100 1.853 327 HG1 THR 44 HG1 THR 44 1.186 8.796 3.019 328 1HG2 THR 44 2HG2 THR 44 1.410 11.900 1.344 329 2HG2 THR 44 3HG2 THR 44 2.313 11.487 2.825 330 3HG2 THR 44 1HG2 THR 44 2.208 10.311 1.488 331 H THR 45 H THR 45 -1.580 9.518 2.707 332 HA THR 45 HA THR 45 -3.229 9.165 5.142 333 HB THR 45 HB THR 45 -5.450 9.385 4.059 334 HG1 THR 45 HG1 THR 45 -4.702 9.127 1.933 335 1HG2 THR 45 2HG2 THR 45 -4.518 11.332 5.357 336 2HG2 THR 45 3HG2 THR 45 -3.750 11.959 3.874 337 3HG2 THR 45 1HG2 THR 45 -5.528 11.898 4.000 338 H PHE 46 H PHE 46 -5.379 7.978 3.920 339 HA PHE 46 HA PHE 46 -4.273 5.498 2.476 340 1HB PHE 46 1HB PHE 46 -6.197 5.573 4.890 341 2HB PHE 46 2HB PHE 46 -5.935 4.153 3.876 342 HD1 PHE 46 HD2 PHE 46 -2.884 5.548 3.645 343 HD2 PHE 46 HD1 PHE 46 -5.326 3.792 6.601 344 HE1 PHE 46 HE2 PHE 46 -0.906 4.950 4.925 345 HE2 PHE 46 HE1 PHE 46 -3.346 3.188 7.876 346 HZ PHE 46 HZ PHE 46 -1.136 3.770 7.040 347 H HIS 47 H HIS 47 -4.911 6.571 0.702 348 HA HIS 47 HA HIS 47 -7.337 7.971 0.271 349 1HB HIS 47 1HB HIS 47 -6.960 7.591 -2.191 350 2HB HIS 47 2HB HIS 47 -5.539 8.170 -1.320 351 HD2 HIS 47 HD2 HIS 47 -6.694 5.384 -3.551 352 HE1 HIS 47 HE1 HIS 47 -3.009 4.125 -2.078 353 HE2 HIS 47 HE2 HIS 47 -4.770 3.574 -3.875 354 NH1 ARG 48 NH2 ARG 48 -9.285 -0.026 -5.474 355 NH2 ARG 48 NH1 ARG 48 -11.398 0.166 -6.293 356 H ARG 48 H ARG 48 -6.759 4.710 -1.048 357 HA ARG 48 HA ARG 48 -9.691 3.962 -0.742 358 1HB ARG 48 1HB ARG 48 -9.621 5.660 -2.514 359 2HB ARG 48 2HB ARG 48 -8.307 4.833 -3.344 360 1HG ARG 48 1HG ARG 48 -11.129 3.668 -2.886 361 2HG ARG 48 2HG ARG 48 -10.580 4.444 -4.375 362 1HD ARG 48 1HD ARG 48 -8.738 2.667 -4.587 363 2HD ARG 48 2HD ARG 48 -9.403 1.850 -3.159 364 HE ARG 48 HE ARG 48 -11.594 2.200 -5.039 365 1HH1 ARG 48 2HH2 ARG 48 -8.548 0.372 -4.882 366 2HH1 ARG 48 1HH2 ARG 48 -9.233 -0.891 -6.024 367 1HH2 ARG 48 1HH1 ARG 48 -12.269 0.708 -6.329 368 2HH2 ARG 48 2HH1 ARG 48 -11.200 -0.711 -6.788 369 H VAL 49 H VAL 49 -10.359 2.203 -1.703 370 HA VAL 49 HA VAL 49 -8.946 0.432 -3.371 371 HB VAL 49 HB VAL 49 -8.673 -0.441 -0.441 372 1HG1 VAL 49 1HG2 VAL 49 -8.333 -2.094 -3.033 373 2HG1 VAL 49 2HG2 VAL 49 -7.917 -2.651 -1.389 374 3HG1 VAL 49 3HG2 VAL 49 -9.616 -2.322 -1.817 375 1HG2 VAL 49 1HG1 VAL 49 -6.685 -0.135 -2.796 376 2HG2 VAL 49 2HG1 VAL 49 -6.814 0.964 -1.398 377 3HG2 VAL 49 3HG1 VAL 49 -6.263 -0.717 -1.163 378 H ILE 50 H ILE 50 -10.582 -0.532 -0.441 379 HA ILE 50 HA ILE 50 -13.334 -0.372 -1.243 380 HB ILE 50 HB ILE 50 -12.679 -1.826 -3.154 381 1HG1 ILE 50 1HG1 ILE 50 -14.384 -3.214 -1.000 382 2HG1 ILE 50 2HG1 ILE 50 -14.958 -1.985 -2.133 383 1HG2 ILE 50 2HG2 ILE 50 -10.751 -3.004 -2.048 384 2HG2 ILE 50 3HG2 ILE 50 -11.879 -3.843 -0.951 385 3HG2 ILE 50 1HG2 ILE 50 -11.918 -4.184 -2.702 386 1HD1 ILE 50 3HD1 ILE 50 -13.806 -4.745 -2.943 387 2HD1 ILE 50 1HD1 ILE 50 -15.530 -4.290 -2.965 388 3HD1 ILE 50 2HD1 ILE 50 -14.387 -3.504 -4.085 389 HA PRO 51 HA PRO 51 -14.019 -1.255 2.956 390 1HB PRO 51 1HB PRO 51 -16.229 -2.923 1.636 391 2HB PRO 51 2HB PRO 51 -16.369 -1.855 3.056 392 1HG PRO 51 1HG PRO 51 -17.161 -0.891 0.648 393 2HG PRO 51 2HG PRO 51 -16.139 0.145 1.675 394 1HD PRO 51 1HD PRO 51 -15.291 -1.476 -0.776 395 2HD PRO 51 2HD PRO 51 -14.738 0.149 -0.256 396 H GLY 52 H GLY 52 -14.265 -2.950 4.430 397 1HA GLY 52 1HA GLY 52 -12.470 -4.704 5.062 398 2HA GLY 52 2HA GLY 52 -14.086 -5.411 5.005 399 H PHE 53 H PHE 53 -11.376 -4.613 2.897 400 HA PHE 53 HA PHE 53 -11.133 -7.448 1.928 401 1HB PHE 53 1HB PHE 53 -13.003 -6.484 0.508 402 2HB PHE 53 2HB PHE 53 -11.906 -5.215 -0.053 403 HD1 PHE 53 HD1 PHE 53 -11.004 -8.730 0.684 404 HD2 PHE 53 HD2 PHE 53 -11.709 -5.878 -2.343 405 HE1 PHE 53 HE1 PHE 53 -10.163 -10.287 -0.982 406 HE2 PHE 53 HE2 PHE 53 -10.863 -7.437 -4.006 407 HZ PHE 53 HZ PHE 53 -10.091 -9.642 -3.326 408 H MET 54 H MET 54 -10.346 -4.095 1.109 409 HA MET 54 HA MET 54 -7.387 -4.555 1.409 410 1HB MET 54 1HB MET 54 -6.901 -4.160 -1.020 411 2HB MET 54 2HB MET 54 -7.797 -5.660 -0.754 412 1HG MET 54 1HG MET 54 -9.965 -4.451 -1.280 413 2HG MET 54 2HG MET 54 -9.042 -2.970 -1.612 414 1HE MET 54 3HE MET 54 -10.163 -2.913 -4.071 415 2HE MET 54 2HE MET 54 -10.055 -4.263 -5.238 416 3HE MET 54 1HE MET 54 -11.034 -4.445 -3.753 417 H ILE 55 H ILE 55 -6.145 -2.856 1.142 418 HA ILE 55 HA ILE 55 -7.186 -0.090 0.576 419 HB ILE 55 HB ILE 55 -6.717 0.766 2.854 420 1HG1 ILE 55 1HG1 ILE 55 -6.289 -2.190 3.608 421 2HG1 ILE 55 2HG1 ILE 55 -4.991 -1.013 3.390 422 1HG2 ILE 55 2HG2 ILE 55 -9.056 0.018 2.325 423 2HG2 ILE 55 3HG2 ILE 55 -8.670 -1.629 2.884 424 3HG2 ILE 55 1HG2 ILE 55 -8.678 -0.274 4.043 425 1HD1 ILE 55 2HD1 ILE 55 -5.942 0.421 5.243 426 2HD1 ILE 55 3HD1 ILE 55 -7.261 -0.759 5.477 427 3HD1 ILE 55 1HD1 ILE 55 -5.573 -1.224 5.818 428 H GLN 56 H GLN 56 -5.655 0.919 -0.350 429 HA GLN 56 HA GLN 56 -2.707 0.110 0.134 430 1HB GLN 56 1HB GLN 56 -4.134 1.042 -2.413 431 2HB GLN 56 2HB GLN 56 -2.397 0.726 -2.279 432 1HG GLN 56 1HG GLN 56 -2.875 -1.657 -1.629 433 2HG GLN 56 2HG GLN 56 -4.613 -1.342 -1.692 434 1HE2 GLN 56 2HE2 GLN 56 -4.599 -0.917 -5.349 435 2HE2 GLN 56 1HE2 GLN 56 -5.226 -0.107 -3.827 436 H GLY 57 H GLY 57 -1.385 1.513 0.734 437 1HA GLY 57 1HA GLY 57 -2.255 4.425 1.090 438 2HA GLY 57 2HA GLY 57 -0.938 3.617 1.925 439 H GLY 58 H GLY 58 0.097 5.541 1.409 440 1HA GLY 58 1HA GLY 58 1.644 6.886 0.138 441 2HA GLY 58 2HA GLY 58 2.264 5.308 -0.372 442 H GLY 59 H GLY 59 0.437 8.075 -1.149 443 1HA GLY 59 1HA GLY 59 0.840 7.928 -4.006 444 2HA GLY 59 2HA GLY 59 -0.767 7.232 -3.722 445 H PHE 60 H PHE 60 -2.278 8.516 -3.981 446 HA PHE 60 HA PHE 60 -2.210 11.287 -4.535 447 1HB PHE 60 1HB PHE 60 -4.510 9.831 -3.096 448 2HB PHE 60 2HB PHE 60 -4.645 11.334 -4.017 449 HD1 PHE 60 HD1 PHE 60 -2.907 10.825 -6.307 450 HD2 PHE 60 HD2 PHE 60 -5.605 8.206 -4.395 451 HE1 PHE 60 HE1 PHE 60 -3.149 9.563 -8.371 452 HE2 PHE 60 HE2 PHE 60 -5.843 6.947 -6.459 453 HZ PHE 60 HZ PHE 60 -4.617 7.625 -8.449 454 H THR 61 H THR 61 -2.408 13.115 -3.540 455 HA THR 61 HA THR 61 -1.297 13.547 -0.920 456 HB THR 61 HB THR 61 -3.261 15.285 -2.529 457 HG1 THR 61 HG1 THR 61 -0.432 15.236 -2.298 458 1HG2 THR 61 3HG2 THR 61 -1.333 16.036 -0.234 459 2HG2 THR 61 1HG2 THR 61 -2.306 17.185 -1.193 460 3HG2 THR 61 2HG2 THR 61 -3.113 16.007 -0.124 461 H GLU 62 H GLU 62 -4.672 13.381 -1.969 462 HA GLU 62 HA GLU 62 -5.654 12.354 0.630 463 1HB GLU 62 1HB GLU 62 -6.944 14.350 1.327 464 2HB GLU 62 2HB GLU 62 -5.209 14.713 1.306 465 1HG GLU 62 1HG GLU 62 -5.453 15.714 -1.014 466 2HG GLU 62 2HG GLU 62 -7.175 15.350 -0.995 467 H GLN 63 H GLN 63 -7.543 14.763 -0.817 468 HA GLN 63 HA GLN 63 -9.787 13.160 -1.543 469 1HB GLN 63 1HB GLN 63 -9.818 15.661 -1.557 470 2HB GLN 63 2HB GLN 63 -8.759 15.690 -2.974 471 1HG GLN 63 1HG GLN 63 -11.125 15.959 -3.685 472 2HG GLN 63 2HG GLN 63 -10.472 14.443 -4.316 473 1HE2 GLN 63 2HE2 GLN 63 -13.284 14.322 -1.262 474 2HE2 GLN 63 1HE2 GLN 63 -12.233 15.799 -1.540 475 H MET 64 H MET 64 -7.250 14.359 -3.680 476 HA MET 64 HA MET 64 -6.520 12.024 -5.073 477 1HB MET 64 1HB MET 64 -9.055 13.236 -6.326 478 2HB MET 64 2HB MET 64 -8.016 12.060 -7.142 479 1HG MET 64 1HG MET 64 -9.422 11.560 -4.442 480 2HG MET 64 2HG MET 64 -9.959 10.944 -6.023 481 1HE MET 64 3HE MET 64 -9.553 8.793 -3.829 482 2HE MET 64 2HE MET 64 -9.819 8.356 -5.546 483 3HE MET 64 1HE MET 64 -8.489 7.597 -4.626 484 H GLN 65 H GLN 65 -5.848 14.816 -4.408 485 HA GLN 65 HA GLN 65 -5.162 16.142 -7.024 486 1HB GLN 65 1HB GLN 65 -4.200 16.726 -4.158 487 2HB GLN 65 2HB GLN 65 -3.880 17.730 -5.581 488 1HG GLN 65 1HG GLN 65 -6.369 18.000 -5.949 489 2HG GLN 65 2HG GLN 65 -6.686 17.006 -4.524 490 1HE2 GLN 65 2HE2 GLN 65 -6.873 20.147 -2.817 491 2HE2 GLN 65 1HE2 GLN 65 -7.763 18.697 -3.505 492 H GLN 66 H GLN 66 -4.228 14.430 -8.004 493 HA GLN 66 HA GLN 66 -2.267 12.619 -7.242 494 1HB GLN 66 1HB GLN 66 -2.107 14.232 -9.859 495 2HB GLN 66 2HB GLN 66 -1.359 12.656 -9.551 496 1HG GLN 66 1HG GLN 66 -3.638 11.650 -9.130 497 2HG GLN 66 2HG GLN 66 -4.391 13.224 -9.401 498 1HE2 GLN 66 2HE2 GLN 66 -3.193 10.966 -12.614 499 2HE2 GLN 66 1HE2 GLN 66 -2.854 10.484 -10.876 500 H LYS 67 H LYS 67 -0.332 12.497 -6.678 501 HA LYS 67 HA LYS 67 1.215 14.837 -5.720 502 1HB LYS 67 1HB LYS 67 1.968 11.896 -6.150 503 2HB LYS 67 2HB LYS 67 3.071 13.095 -5.466 504 1HG LYS 67 1HG LYS 67 0.313 12.291 -4.365 505 2HG LYS 67 2HG LYS 67 1.861 11.891 -3.633 506 1HD LYS 67 1HD LYS 67 0.745 14.758 -3.989 507 2HD LYS 67 2HD LYS 67 0.588 13.796 -2.525 508 1HE LYS 67 1HE LYS 67 3.111 13.738 -2.254 509 2HE LYS 67 2HE LYS 67 3.293 14.716 -3.718 510 1HZ LYS 67 2HZ LYS 67 2.017 16.487 -2.631 511 2HZ LYS 67 3HZ LYS 67 1.852 15.580 -1.259 512 3HZ LYS 67 1HZ LYS 67 3.349 16.087 -1.739 513 H LYS 68 H LYS 68 3.405 12.941 -6.922 514 HA LYS 68 HA LYS 68 3.691 13.770 -9.775 515 1HB LYS 68 1HB LYS 68 4.118 15.949 -8.592 516 2HB LYS 68 2HB LYS 68 5.374 15.176 -7.610 517 1HG LYS 68 1HG LYS 68 6.599 14.528 -9.739 518 2HG LYS 68 2HG LYS 68 5.397 15.374 -10.697 519 1HD LYS 68 1HD LYS 68 7.248 16.670 -8.589 520 2HD LYS 68 2HD LYS 68 7.571 16.655 -10.307 521 1HE LYS 68 1HE LYS 68 5.151 18.082 -9.001 522 2HE LYS 68 2HE LYS 68 6.668 18.852 -9.447 523 1HZ LYS 68 1HZ LYS 68 6.244 18.271 -11.773 524 2HZ LYS 68 2HZ LYS 68 4.816 17.541 -11.374 525 3HZ LYS 68 3HZ LYS 68 5.002 19.168 -11.155 526 HA PRO 69 HA PRO 69 5.700 9.824 -8.486 527 1HB PRO 69 1HB PRO 69 5.353 9.795 -11.525 528 2HB PRO 69 2HB PRO 69 5.119 8.451 -10.382 529 1HG PRO 69 1HG PRO 69 2.926 9.759 -11.299 530 2HG PRO 69 2HG PRO 69 3.034 9.406 -9.556 531 1HD PRO 69 1HD PRO 69 3.573 12.077 -10.958 532 2HD PRO 69 2HD PRO 69 2.739 11.774 -9.398 533 H ASN 70 H ASN 70 7.262 8.799 -10.539 534 HA ASN 70 HA ASN 70 9.425 10.676 -11.370 535 1HB ASN 70 1HB ASN 70 9.903 8.811 -8.953 536 2HB ASN 70 2HB ASN 70 11.179 9.648 -9.842 537 1HD2 ASN 70 1HD2 ASN 70 10.792 12.513 -7.803 538 2HD2 ASN 70 2HD2 ASN 70 11.858 11.346 -8.734 539 HA PRO 71 HA PRO 71 10.837 7.382 -14.049 540 1HB PRO 71 1HB PRO 71 13.557 7.279 -13.413 541 2HB PRO 71 2HB PRO 71 12.818 8.572 -14.388 542 1HG PRO 71 1HG PRO 71 13.419 8.621 -11.384 543 2HG PRO 71 2HG PRO 71 13.839 9.857 -12.596 544 1HD PRO 71 1HD PRO 71 11.598 10.148 -11.026 545 2HD PRO 71 2HD PRO 71 11.520 10.609 -12.757 546 HA PRO 72 HA PRO 72 9.651 4.711 -10.528 547 1HB PRO 72 1HB PRO 72 8.961 3.217 -13.114 548 2HB PRO 72 2HB PRO 72 8.001 3.310 -11.617 549 1HG PRO 72 1HG PRO 72 7.305 4.918 -13.682 550 2HG PRO 72 2HG PRO 72 7.399 5.636 -12.055 551 1HD PRO 72 1HD PRO 72 9.458 5.847 -14.314 552 2HD PRO 72 2HD PRO 72 8.925 7.110 -13.158 553 H ILE 73 H ILE 73 9.635 2.000 -11.246 554 HA ILE 73 HA ILE 73 12.436 1.152 -11.979 555 HB ILE 73 HB ILE 73 12.967 0.098 -9.886 556 1HG1 ILE 73 1HG1 ILE 73 10.636 -0.568 -9.247 557 2HG1 ILE 73 2HG1 ILE 73 11.563 0.114 -7.909 558 1HG2 ILE 73 2HG2 ILE 73 13.544 2.531 -10.082 559 2HG2 ILE 73 3HG2 ILE 73 11.980 2.973 -9.351 560 3HG2 ILE 73 1HG2 ILE 73 13.199 2.096 -8.388 561 1HD1 ILE 73 2HD1 ILE 73 10.423 2.354 -8.240 562 2HD1 ILE 73 3HD1 ILE 73 9.466 1.660 -9.577 563 3HD1 ILE 73 1HD1 ILE 73 9.247 1.054 -7.915 564 H LYS 74 H LYS 74 12.691 -0.907 -12.371 565 HA LYS 74 HA LYS 74 10.882 -2.330 -13.846 566 1HB LYS 74 1HB LYS 74 12.631 -3.713 -11.740 567 2HB LYS 74 2HB LYS 74 11.984 -4.451 -13.217 568 1HG LYS 74 1HG LYS 74 13.225 -2.750 -14.614 569 2HG LYS 74 2HG LYS 74 13.847 -1.989 -13.148 570 1HD LYS 74 1HD LYS 74 15.051 -4.141 -12.541 571 2HD LYS 74 2HD LYS 74 14.435 -4.899 -14.014 572 1HE LYS 74 1HE LYS 74 15.661 -3.168 -15.419 573 2HE LYS 74 2HE LYS 74 16.272 -2.403 -13.945 574 1HZ LYS 74 1HZ LYS 74 16.837 -5.209 -14.775 575 2HZ LYS 74 2HZ LYS 74 17.886 -3.937 -14.878 576 3HZ LYS 74 3HZ LYS 74 17.407 -4.494 -13.399 577 H ASN 75 H ASN 75 9.174 -3.398 -13.758 578 HA ASN 75 HA ASN 75 7.344 -3.259 -11.458 579 1HB ASN 75 1HB ASN 75 6.638 -3.345 -13.879 580 2HB ASN 75 2HB ASN 75 7.174 -5.026 -13.974 581 1HD2 ASN 75 1HD2 ASN 75 4.098 -6.194 -12.636 582 2HD2 ASN 75 2HD2 ASN 75 5.623 -6.477 -13.617 583 H GLU 76 H GLU 76 6.213 -5.093 -10.620 584 HA GLU 76 HA GLU 76 7.411 -7.780 -10.485 585 1HB GLU 76 1HB GLU 76 8.159 -7.724 -8.097 586 2HB GLU 76 2HB GLU 76 9.134 -6.714 -9.162 587 1HG GLU 76 1HG GLU 76 8.712 -5.439 -7.125 588 2HG GLU 76 2HG GLU 76 7.863 -4.664 -8.458 589 H ALA 77 H ALA 77 6.368 -9.207 -9.228 590 HA ALA 77 HA ALA 77 3.927 -8.730 -7.670 591 1HB ALA 77 2HB ALA 77 3.116 -7.734 -9.843 592 2HB ALA 77 3HB ALA 77 3.486 -9.259 -10.691 593 3HB ALA 77 1HB ALA 77 2.213 -9.217 -9.446 594 H ASP 78 H ASP 78 5.761 -10.738 -9.864 595 HA ASP 78 HA ASP 78 4.335 -13.259 -9.421 596 1HB ASP 78 1HB ASP 78 6.358 -14.338 -10.361 597 2HB ASP 78 2HB ASP 78 5.826 -12.961 -11.334 598 H ASN 79 H ASN 79 7.288 -11.891 -8.009 599 HA ASN 79 HA ASN 79 8.535 -12.594 -6.068 600 1HB ASN 79 1HB ASN 79 7.118 -12.372 -4.006 601 2HB ASN 79 2HB ASN 79 6.924 -11.043 -5.152 602 1HD2 ASN 79 1HD2 ASN 79 3.521 -12.262 -4.008 603 2HD2 ASN 79 2HD2 ASN 79 5.068 -11.761 -3.157 604 H GLY 80 H GLY 80 5.485 -14.291 -5.509 605 1HA GLY 80 1HA GLY 80 5.086 -16.702 -5.443 606 2HA GLY 80 2HA GLY 80 6.804 -17.027 -5.702 607 H LEU 81 H LEU 81 4.308 -16.190 -3.510 608 HA LEU 81 HA LEU 81 5.710 -17.376 -1.143 609 1HB LEU 81 1HB LEU 81 5.025 -14.369 -1.140 610 2HB LEU 81 2HB LEU 81 5.641 -15.293 0.234 611 HG LEU 81 HG LEU 81 7.101 -14.884 -2.442 612 1HD1 LEU 81 2HD1 LEU 81 7.008 -12.802 -1.039 613 2HD1 LEU 81 3HD1 LEU 81 7.661 -13.699 0.357 614 3HD1 LEU 81 1HD1 LEU 81 8.665 -13.454 -1.096 615 1HD2 LEU 81 3HD2 LEU 81 7.650 -17.092 -1.378 616 2HD2 LEU 81 1HD2 LEU 81 9.044 -15.984 -1.295 617 3HD2 LEU 81 2HD2 LEU 81 8.045 -16.268 0.154 618 NH1 ARG 82 NH2 ARG 82 4.621 -20.143 2.272 619 NH2 ARG 82 NH1 ARG 82 6.037 -20.150 4.050 620 H ARG 82 H ARG 82 4.186 -16.057 0.790 621 HA ARG 82 HA ARG 82 1.692 -17.595 0.773 622 1HB ARG 82 1HB ARG 82 2.470 -15.067 2.342 623 2HB ARG 82 2HB ARG 82 1.039 -16.052 2.674 624 1HG ARG 82 1HG ARG 82 2.930 -16.711 4.161 625 2HG ARG 82 2HG ARG 82 2.406 -18.047 3.132 626 1HD ARG 82 1HD ARG 82 4.330 -17.548 1.514 627 2HD ARG 82 2HD ARG 82 4.842 -16.232 2.560 628 HE ARG 82 HE ARG 82 5.720 -17.778 4.191 629 1HH1 ARG 82 2HH2 ARG 82 4.022 -19.595 1.646 630 2HH1 ARG 82 1HH2 ARG 82 4.778 -21.156 2.242 631 1HH2 ARG 82 1HH1 ARG 82 6.518 -19.611 4.779 632 2HH2 ARG 82 2HH1 ARG 82 6.095 -21.162 3.895 633 H ASN 83 H ASN 83 -0.218 -15.915 1.578 634 HA ASN 83 HA ASN 83 -0.909 -13.592 0.107 635 1HB ASN 83 1HB ASN 83 -0.442 -14.910 -1.980 636 2HB ASN 83 2HB ASN 83 -1.649 -16.116 -1.506 637 1HD2 ASN 83 1HD2 ASN 83 -3.500 -12.484 -1.865 638 2HD2 ASN 83 2HD2 ASN 83 -2.239 -12.856 -0.585 639 H THR 84 H THR 84 -2.020 -13.153 1.812 640 HA THR 84 HA THR 84 -4.838 -14.126 2.033 641 HB THR 84 HB THR 84 -2.676 -14.815 4.115 642 HG1 THR 84 HG1 THR 84 -4.589 -16.341 2.674 643 1HG2 THR 84 3HG2 THR 84 -5.748 -15.017 4.296 644 2HG2 THR 84 1HG2 THR 84 -4.590 -15.643 5.512 645 3HG2 THR 84 2HG2 THR 84 -4.719 -13.886 5.216 646 NH1 ARG 85 NH2 ARG 85 -6.543 -13.045 9.081 647 NH2 ARG 85 NH1 ARG 85 -7.840 -14.873 8.698 648 H ARG 85 H ARG 85 -6.027 -12.636 2.792 649 HA ARG 85 HA ARG 85 -5.358 -9.959 3.315 650 1HB ARG 85 1HB ARG 85 -7.430 -9.825 4.773 651 2HB ARG 85 2HB ARG 85 -7.696 -10.646 3.233 652 1HG ARG 85 1HG ARG 85 -8.777 -11.943 5.010 653 2HG ARG 85 2HG ARG 85 -7.455 -12.876 4.303 654 1HD ARG 85 1HD ARG 85 -5.949 -12.222 6.248 655 2HD ARG 85 2HD ARG 85 -7.279 -11.278 6.950 656 HE ARG 85 HE ARG 85 -8.178 -14.045 6.472 657 1HH1 ARG 85 2HH2 ARG 85 -6.142 -12.177 8.710 658 2HH1 ARG 85 1HH2 ARG 85 -6.420 -13.426 10.025 659 1HH2 ARG 85 1HH1 ARG 85 -8.425 -15.399 8.040 660 2HH2 ARG 85 2HH1 ARG 85 -7.627 -15.127 9.669 661 H GLY 86 H GLY 86 -3.679 -9.553 4.127 662 1HA GLY 86 1HA GLY 86 -3.089 -9.053 6.890 663 2HA GLY 86 2HA GLY 86 -2.549 -10.720 6.609 664 H THR 87 H THR 87 -2.148 -9.863 3.701 665 HA THR 87 HA THR 87 0.763 -8.889 4.045 666 HB THR 87 HB THR 87 1.045 -9.740 1.717 667 HG1 THR 87 HG1 THR 87 -1.149 -9.579 1.145 668 1HG2 THR 87 2HG2 THR 87 1.594 -11.179 3.696 669 2HG2 THR 87 3HG2 THR 87 -0.085 -11.783 3.738 670 3HG2 THR 87 1HG2 THR 87 0.970 -12.166 2.349 671 H ILE 88 H ILE 88 1.575 -7.386 2.929 672 HA ILE 88 HA ILE 88 -0.226 -5.443 1.366 673 HB ILE 88 HB ILE 88 0.737 -3.948 2.683 674 1HG1 ILE 88 1HG1 ILE 88 3.171 -3.273 1.815 675 2HG1 ILE 88 2HG1 ILE 88 2.902 -4.545 0.658 676 1HG2 ILE 88 2HG2 ILE 88 1.847 -5.528 4.243 677 2HG2 ILE 88 3HG2 ILE 88 3.226 -5.697 3.119 678 3HG2 ILE 88 1HG2 ILE 88 2.903 -4.133 3.913 679 1HD1 ILE 88 2HD1 ILE 88 0.707 -3.339 -0.042 680 2HD1 ILE 88 3HD1 ILE 88 1.035 -2.102 1.192 681 3HD1 ILE 88 1HD1 ILE 88 2.120 -2.254 -0.213 682 H ALA 89 H ALA 89 0.610 -4.553 -0.423 683 HA ALA 89 HA ALA 89 2.653 -6.098 -2.062 684 1HB ALA 89 2HB ALA 89 0.493 -7.292 -2.578 685 2HB ALA 89 3HB ALA 89 -0.253 -5.744 -3.063 686 3HB ALA 89 1HB ALA 89 1.107 -6.414 -3.997 687 H MET 90 H MET 90 2.748 -5.157 -4.284 688 HA MET 90 HA MET 90 3.022 -2.112 -4.004 689 1HB MET 90 1HB MET 90 5.095 -3.430 -4.500 690 2HB MET 90 2HB MET 90 4.364 -4.000 -6.013 691 1HG MET 90 1HG MET 90 5.770 -1.939 -6.396 692 2HG MET 90 2HG MET 90 4.059 -1.629 -6.779 693 1HE MET 90 1HE MET 90 5.766 0.905 -6.359 694 2HE MET 90 3HE MET 90 3.977 0.977 -6.453 695 3HE MET 90 2HE MET 90 4.840 1.831 -5.140 696 H ALA 91 H ALA 91 1.901 -0.822 -5.054 697 HA ALA 91 HA ALA 91 -0.362 -1.600 -6.766 698 1HB ALA 91 2HB ALA 91 -0.332 0.490 -5.384 699 2HB ALA 91 3HB ALA 91 0.979 1.157 -6.393 700 3HB ALA 91 1HB ALA 91 -0.632 0.866 -7.098 701 NH1 ARG 92 NH2 ARG 92 0.389 -4.552 -15.188 702 NH2 ARG 92 NH1 ARG 92 1.892 -5.624 -13.862 703 H ARG 92 H ARG 92 0.144 0.665 -8.631 704 HA ARG 92 HA ARG 92 2.407 0.108 -10.389 705 1HB ARG 92 1HB ARG 92 1.287 -2.087 -10.743 706 2HB ARG 92 2HB ARG 92 -0.237 -1.271 -11.141 707 1HG ARG 92 1HG ARG 92 0.952 -0.039 -13.020 708 2HG ARG 92 2HG ARG 92 2.419 -0.944 -12.698 709 1HD ARG 92 1HD ARG 92 -0.286 -2.207 -13.546 710 2HD ARG 92 2HD ARG 92 1.010 -1.771 -14.661 711 HE ARG 92 HE ARG 92 2.149 -3.562 -12.656 712 1HH1 ARG 92 2HH2 ARG 92 -0.108 -3.681 -15.403 713 2HH1 ARG 92 1HH2 ARG 92 0.303 -5.446 -15.683 714 1HH2 ARG 92 1HH1 ARG 92 2.540 -5.574 -13.068 715 2HH2 ARG 92 2HH1 ARG 92 1.701 -6.443 -14.449 716 H THR 93 H THR 93 1.422 0.425 -12.805 717 HA THR 93 HA THR 93 -0.552 2.465 -13.329 718 HB THR 93 HB THR 93 0.995 4.450 -13.713 719 HG1 THR 93 HG1 THR 93 2.687 2.899 -12.047 720 1HG2 THR 93 1HG2 THR 93 -0.525 4.378 -11.716 721 2HG2 THR 93 2HG2 THR 93 0.735 3.531 -10.780 722 3HG2 THR 93 3HG2 THR 93 1.008 5.206 -11.330 723 H ALA 94 H ALA 94 -0.937 1.997 -15.249 724 HA ALA 94 HA ALA 94 0.031 0.425 -17.149 725 1HB ALA 94 2HB ALA 94 -1.765 2.094 -17.665 726 2HB ALA 94 3HB ALA 94 -0.540 3.375 -17.865 727 3HB ALA 94 1HB ALA 94 -0.589 2.000 -18.998 728 H ASP 95 H ASP 95 1.775 -0.229 -17.869 729 HA ASP 95 HA ASP 95 3.799 0.740 -19.400 730 1HB ASP 95 1HB ASP 95 3.866 2.808 -17.959 731 2HB ASP 95 2HB ASP 95 4.349 1.825 -16.569 732 H LYS 96 H LYS 96 5.387 -0.593 -19.623 733 HA LYS 96 HA LYS 96 5.495 -3.202 -18.536 734 1HB LYS 96 1HB LYS 96 6.878 -2.223 -20.472 735 2HB LYS 96 2HB LYS 96 7.976 -1.537 -19.271 736 1HG LYS 96 1HG LYS 96 8.861 -3.711 -20.041 737 2HG LYS 96 2HG LYS 96 8.425 -3.821 -18.332 738 1HD LYS 96 1HD LYS 96 6.221 -4.902 -18.954 739 2HD LYS 96 2HD LYS 96 6.632 -4.768 -20.668 740 1HE LYS 96 1HE LYS 96 8.656 -6.270 -20.300 741 2HE LYS 96 2HE LYS 96 8.227 -6.420 -18.589 742 1HZ LYS 96 3HZ LYS 96 6.505 -7.278 -20.867 743 2HZ LYS 96 1HZ LYS 96 7.380 -8.277 -19.885 744 3HZ LYS 96 2HZ LYS 96 6.106 -7.423 -19.271 745 H ASP 97 H ASP 97 8.260 -1.266 -17.815 746 HA ASP 97 HA ASP 97 8.440 -2.043 -14.925 747 1HB ASP 97 1HB ASP 97 9.823 0.204 -16.513 748 2HB ASP 97 2HB ASP 97 10.242 -0.297 -14.865 749 H SER 98 H SER 98 7.120 -1.322 -13.528 750 HA SER 98 HA SER 98 6.181 1.583 -13.478 751 1HB SER 98 1HB SER 98 4.629 0.218 -14.956 752 2HB SER 98 2HB SER 98 4.284 -0.842 -13.577 753 HG SER 98 HG SER 98 3.902 1.974 -13.687 754 H ALA 99 H ALA 99 4.735 1.988 -11.710 755 HA ALA 99 HA ALA 99 4.223 1.920 -9.344 756 1HB ALA 99 2HB ALA 99 4.285 -0.595 -9.319 757 2HB ALA 99 3HB ALA 99 6.066 -0.558 -9.218 758 3HB ALA 99 1HB ALA 99 5.082 0.083 -7.878 759 H THR 100 H THR 100 5.055 3.140 -7.893 760 HA THR 100 HA THR 100 8.039 3.551 -7.588 761 HB THR 100 HB THR 100 6.216 5.826 -8.569 762 HG1 THR 100 HG1 THR 100 7.464 5.589 -10.448 763 1HG2 THR 100 3HG2 THR 100 9.273 5.602 -8.156 764 2HG2 THR 100 1HG2 THR 100 8.416 7.023 -8.809 765 3HG2 THR 100 2HG2 THR 100 8.156 6.525 -7.115 766 H SER 101 H SER 101 5.080 3.385 -6.189 767 HA SER 101 HA SER 101 6.131 4.206 -3.593 768 1HB SER 101 1HB SER 101 4.636 6.205 -3.172 769 2HB SER 101 2HB SER 101 5.921 6.497 -4.356 770 HG SER 101 HG SER 101 3.904 7.254 -5.052 771 H GLN 102 H GLN 102 2.875 4.727 -4.860 772 HA GLN 102 HA GLN 102 1.379 3.736 -2.758 773 1HB GLN 102 1HB GLN 102 0.773 3.062 -5.705 774 2HB GLN 102 2HB GLN 102 -0.372 2.933 -4.368 775 1HG GLN 102 1HG GLN 102 -0.807 5.064 -5.412 776 2HG GLN 102 2HG GLN 102 -0.030 5.410 -3.864 777 1HE2 GLN 102 2HE2 GLN 102 2.393 5.755 -7.230 778 2HE2 GLN 102 1HE2 GLN 102 1.272 4.321 -6.998 779 H PHE 103 H PHE 103 0.335 1.850 -2.207 780 HA PHE 103 HA PHE 103 1.136 -0.787 -3.259 781 1HB PHE 103 1HB PHE 103 2.312 -1.667 -1.289 782 2HB PHE 103 2HB PHE 103 3.204 -0.341 -2.024 783 HD1 PHE 103 HD2 PHE 103 0.357 -0.472 0.420 784 HD2 PHE 103 HD1 PHE 103 4.283 0.854 -0.371 785 HE1 PHE 103 HE2 PHE 103 0.452 0.560 2.615 786 HE2 PHE 103 HE1 PHE 103 4.374 1.882 1.828 787 HZ PHE 103 HZ PHE 103 2.465 1.714 3.330 788 H PHE 104 H PHE 104 0.447 -2.537 -1.863 789 HA PHE 104 HA PHE 104 -2.498 -2.066 -1.258 790 1HB PHE 104 1HB PHE 104 -0.783 -4.612 -1.508 791 2HB PHE 104 2HB PHE 104 -2.471 -4.622 -1.015 792 HD1 PHE 104 HD1 PHE 104 -0.237 -3.670 -3.811 793 HD2 PHE 104 HD2 PHE 104 -4.201 -4.398 -2.572 794 HE1 PHE 104 HE1 PHE 104 -0.939 -3.824 -6.137 795 HE2 PHE 104 HE2 PHE 104 -4.901 -4.549 -4.896 796 HZ PHE 104 HZ PHE 104 -3.268 -4.299 -6.675 797 H ILE 105 H ILE 105 -3.439 -2.505 0.510 798 HA ILE 105 HA ILE 105 -2.051 -4.108 2.675 799 HB ILE 105 HB ILE 105 -3.553 -1.518 3.369 800 1HG1 ILE 105 1HG1 ILE 105 -0.601 -2.374 3.572 801 2HG1 ILE 105 2HG1 ILE 105 -1.244 -1.042 2.603 802 1HG2 ILE 105 2HG2 ILE 105 -3.994 -3.469 4.895 803 2HG2 ILE 105 3HG2 ILE 105 -2.241 -3.739 5.072 804 3HG2 ILE 105 1HG2 ILE 105 -2.982 -2.247 5.718 805 1HD1 ILE 105 3HD1 ILE 105 -1.366 -1.230 5.697 806 2HD1 ILE 105 1HD1 ILE 105 -0.261 -0.185 4.767 807 3HD1 ILE 105 2HD1 ILE 105 -2.020 0.121 4.736 808 H ASN 106 H ASN 106 -3.106 -5.746 2.107 809 HA ASN 106 HA ASN 106 -6.037 -5.844 1.558 810 1HB ASN 106 1HB ASN 106 -4.058 -8.102 2.238 811 2HB ASN 106 2HB ASN 106 -5.700 -8.319 1.611 812 1HD2 ASN 106 1HD2 ASN 106 -3.466 -8.414 -1.355 813 2HD2 ASN 106 2HD2 ASN 106 -3.797 -9.395 0.160 814 H VAL 107 H VAL 107 -7.106 -7.758 2.799 815 HA VAL 107 HA VAL 107 -6.647 -7.801 5.772 816 HB VAL 107 HB VAL 107 -8.910 -6.951 6.332 817 1HG1 VAL 107 3HG2 VAL 107 -6.935 -5.401 6.358 818 2HG1 VAL 107 1HG2 VAL 107 -7.218 -4.991 4.647 819 3HG1 VAL 107 2HG2 VAL 107 -8.416 -4.526 5.885 820 1HG2 VAL 107 1HG1 VAL 107 -9.078 -6.236 3.330 821 2HG2 VAL 107 2HG1 VAL 107 -10.056 -7.474 4.160 822 3HG2 VAL 107 3HG1 VAL 107 -10.260 -5.753 4.576 823 H ALA 108 H ALA 108 -8.850 -8.488 3.114 824 HA ALA 108 HA ALA 108 -9.626 -11.174 4.389 825 1HB ALA 108 2HB ALA 108 -11.519 -9.671 3.707 826 2HB ALA 108 3HB ALA 108 -10.902 -9.639 2.034 827 3HB ALA 108 1HB ALA 108 -11.495 -11.166 2.739 828 H ASP 109 H ASP 109 -9.518 -12.999 3.328 829 HA ASP 109 HA ASP 109 -7.243 -13.800 1.899 830 1HB ASP 109 1HB ASP 109 -10.101 -14.810 1.359 831 2HB ASP 109 2HB ASP 109 -8.611 -15.661 0.919 832 H ASN 110 H ASN 110 -6.454 -13.760 -0.008 833 HA ASN 110 HA ASN 110 -7.981 -12.886 -2.457 834 1HB ASN 110 1HB ASN 110 -5.695 -11.147 -1.334 835 2HB ASN 110 2HB ASN 110 -6.534 -10.896 -2.869 836 1HD2 ASN 110 1HD2 ASN 110 -8.227 -9.505 0.549 837 2HD2 ASN 110 2HD2 ASN 110 -6.560 -10.267 0.457 838 H ALA 111 H ALA 111 -6.607 -12.555 -4.260 839 HA ALA 111 HA ALA 111 -4.075 -13.524 -4.932 840 1HB ALA 111 3HB ALA 111 -5.909 -15.968 -4.453 841 2HB ALA 111 1HB ALA 111 -4.300 -16.015 -5.222 842 3HB ALA 111 2HB ALA 111 -4.452 -15.558 -3.507 843 H PHE 112 H PHE 112 -7.484 -13.828 -5.459 844 HA PHE 112 HA PHE 112 -7.849 -14.820 -8.046 845 1HB PHE 112 1HB PHE 112 -9.066 -12.148 -7.117 846 2HB PHE 112 2HB PHE 112 -9.771 -13.292 -8.265 847 HD1 PHE 112 HD1 PHE 112 -8.881 -15.798 -6.677 848 HD2 PHE 112 HD2 PHE 112 -10.809 -12.241 -5.483 849 HE1 PHE 112 HE1 PHE 112 -9.899 -16.974 -4.808 850 HE2 PHE 112 HE2 PHE 112 -11.825 -13.421 -3.617 851 HZ PHE 112 HZ PHE 112 -11.363 -15.783 -3.272 852 H LEU 113 H LEU 113 -6.989 -11.508 -7.229 853 HA LEU 113 HA LEU 113 -6.496 -10.610 -10.020 854 1HB LEU 113 1HB LEU 113 -5.339 -8.652 -8.889 855 2HB LEU 113 2HB LEU 113 -7.035 -8.893 -8.484 856 HG LEU 113 HG LEU 113 -6.479 -9.943 -6.341 857 1HD1 LEU 113 2HD1 LEU 113 -4.386 -11.140 -7.001 858 2HD1 LEU 113 3HD1 LEU 113 -3.519 -9.587 -7.144 859 3HD1 LEU 113 1HD1 LEU 113 -4.106 -10.143 -5.552 860 1HD2 LEU 113 3HD2 LEU 113 -6.575 -7.426 -6.435 861 2HD2 LEU 113 1HD2 LEU 113 -5.394 -7.969 -5.215 862 3HD2 LEU 113 2HD2 LEU 113 -4.831 -7.364 -6.792 863 H ASP 114 H ASP 114 -4.810 -12.661 -7.992 864 HA ASP 114 HA ASP 114 -2.070 -12.086 -8.173 865 1HB ASP 114 1HB ASP 114 -1.647 -14.527 -8.206 866 2HB ASP 114 2HB ASP 114 -2.982 -14.136 -7.108 867 H HIS 115 H HIS 115 -0.705 -11.703 -9.582 868 HA HIS 115 HA HIS 115 -0.834 -11.408 -12.379 869 1HB HIS 115 1HB HIS 115 1.262 -10.861 -11.378 870 2HB HIS 115 2HB HIS 115 1.398 -12.414 -10.547 871 HD2 HIS 115 HD2 HIS 115 3.794 -12.866 -11.609 872 HE1 HIS 115 HE1 HIS 115 2.445 -13.782 -15.436 873 HE2 HIS 115 HE2 HIS 115 4.516 -13.966 -13.909 874 H GLY 116 H GLY 116 -1.262 -12.520 -13.992 875 1HA GLY 116 1HA GLY 116 -0.410 -15.283 -14.528 876 2HA GLY 116 2HA GLY 116 -2.104 -15.309 -13.993 877 H GLN 117 H GLN 117 -3.533 -15.145 -15.426 878 HA GLN 117 HA GLN 117 -3.077 -15.064 -18.237 879 1HB GLN 117 1HB GLN 117 -5.216 -15.834 -17.193 880 2HB GLN 117 2HB GLN 117 -5.627 -14.165 -16.765 881 1HG GLN 117 1HG GLN 117 -5.520 -13.523 -19.217 882 2HG GLN 117 2HG GLN 117 -5.124 -15.191 -19.634 883 1HE2 GLN 117 2HE2 GLN 117 -9.005 -14.180 -18.702 884 2HE2 GLN 117 1HE2 GLN 117 -7.601 -13.020 -18.477 885 NH1 ARG 118 NH2 ARG 118 -3.267 -5.684 -19.175 886 NH2 ARG 118 NH1 ARG 118 -4.407 -4.913 -20.984 887 H ARG 118 H ARG 118 -2.466 -13.684 -19.545 888 HA ARG 118 HA ARG 118 -2.859 -11.608 -20.802 889 1HB ARG 118 1HB ARG 118 -4.630 -11.010 -19.076 890 2HB ARG 118 2HB ARG 118 -3.355 -10.321 -18.055 891 1HG ARG 118 1HG ARG 118 -2.689 -8.771 -19.939 892 2HG ARG 118 2HG ARG 118 -3.913 -9.501 -20.979 893 1HD ARG 118 1HD ARG 118 -5.729 -8.724 -19.360 894 2HD ARG 118 2HD ARG 118 -4.515 -7.947 -18.357 895 HE ARG 118 HE ARG 118 -5.520 -7.033 -21.067 896 1HH1 ARG 118 2HH2 ARG 118 -3.100 -6.459 -18.523 897 2HH1 ARG 118 1HH2 ARG 118 -2.809 -4.766 -19.169 898 1HH2 ARG 118 1HH1 ARG 118 -5.108 -5.096 -21.710 899 2HH2 ARG 118 2HH1 ARG 118 -3.870 -4.049 -20.852 900 H ASP 119 H ASP 119 -1.705 -10.385 -17.726 901 HA ASP 119 HA ASP 119 1.181 -10.615 -18.218 902 1HB ASP 119 1HB ASP 119 -0.141 -7.938 -18.990 903 2HB ASP 119 2HB ASP 119 1.590 -8.132 -18.684 904 H PHE 120 H PHE 120 1.409 -11.029 -16.197 905 HA PHE 120 HA PHE 120 1.415 -10.711 -13.806 906 1HB PHE 120 1HB PHE 120 2.241 -7.939 -14.867 907 2HB PHE 120 2HB PHE 120 2.503 -8.503 -13.213 908 HD1 PHE 120 HD1 PHE 120 3.204 -11.306 -13.596 909 HD2 PHE 120 HD2 PHE 120 4.400 -7.929 -15.823 910 HE1 PHE 120 HE1 PHE 120 5.250 -12.449 -14.233 911 HE2 PHE 120 HE2 PHE 120 6.447 -9.075 -16.457 912 HZ PHE 120 HZ PHE 120 6.873 -11.336 -15.665 913 H GLY 121 H GLY 121 1.075 -8.571 -12.250 914 1HA GLY 121 1HA GLY 121 -1.502 -7.150 -12.604 915 2HA GLY 121 2HA GLY 121 -1.735 -8.581 -11.582 916 OH TYR 122 OH TYR 122 -6.300 -4.023 -10.278 917 H TYR 122 H TYR 122 -1.979 -7.864 -9.689 918 HA TYR 122 HA TYR 122 -0.621 -5.435 -8.600 919 1HB TYR 122 1HB TYR 122 -2.415 -7.501 -7.198 920 2HB TYR 122 2HB TYR 122 -1.948 -5.923 -6.558 921 HD1 TYR 122 HD1 TYR 122 -2.298 -3.944 -8.323 922 HD2 TYR 122 HD2 TYR 122 -4.454 -7.573 -8.319 923 HE1 TYR 122 HE1 TYR 122 -4.111 -2.871 -9.538 924 HE2 TYR 122 HE2 TYR 122 -6.264 -6.496 -9.535 925 HH TYR 122 HH TYR 122 -6.997 -4.665 -10.432 926 H ALA 123 H ALA 123 1.250 -5.387 -7.893 927 HA ALA 123 HA ALA 123 3.011 -7.622 -7.323 928 1HB ALA 123 2HB ALA 123 3.819 -5.307 -7.841 929 2HB ALA 123 3HB ALA 123 3.189 -4.721 -6.278 930 3HB ALA 123 1HB ALA 123 4.525 -5.901 -6.318 931 H VAL 124 H VAL 124 4.208 -6.922 -4.960 932 HA VAL 124 HA VAL 124 2.590 -7.036 -2.554 933 HB VAL 124 HB VAL 124 3.430 -9.803 -3.629 934 1HG1 VAL 124 3HG2 VAL 124 3.889 -9.532 -1.178 935 2HG1 VAL 124 1HG2 VAL 124 2.212 -8.991 -0.910 936 3HG1 VAL 124 2HG2 VAL 124 2.537 -10.662 -1.445 937 1HG2 VAL 124 1HG1 VAL 124 0.633 -8.683 -2.944 938 2HG2 VAL 124 2HG1 VAL 124 1.244 -9.044 -4.582 939 3HG2 VAL 124 3HG1 VAL 124 0.991 -10.367 -3.417 940 H PHE 125 H PHE 125 3.867 -7.035 -0.761 941 HA PHE 125 HA PHE 125 6.515 -8.332 -0.693 942 1HB PHE 125 1HB PHE 125 7.999 -6.467 -0.840 943 2HB PHE 125 2HB PHE 125 6.930 -6.316 -2.233 944 HD1 PHE 125 HD2 PHE 125 4.943 -4.714 -2.018 945 HD2 PHE 125 HD1 PHE 125 8.043 -4.819 0.842 946 HE1 PHE 125 HE2 PHE 125 4.261 -2.531 -1.192 947 HE2 PHE 125 HE1 PHE 125 7.359 -2.638 1.662 948 HZ PHE 125 HZ PHE 125 5.466 -1.497 0.656 949 H GLY 126 H GLY 126 3.980 -7.735 0.979 950 1HA GLY 126 1HA GLY 126 5.523 -7.939 3.546 951 2HA GLY 126 2HA GLY 126 4.610 -6.432 3.396 952 H LYS 127 H LYS 127 3.058 -6.529 4.543 953 HA LYS 127 HA LYS 127 0.838 -8.295 4.658 954 1HB LYS 127 1HB LYS 127 2.937 -9.117 6.754 955 2HB LYS 127 2HB LYS 127 1.321 -9.817 6.568 956 1HG LYS 127 1HG LYS 127 1.922 -10.601 4.244 957 2HG LYS 127 2HG LYS 127 3.515 -9.855 4.395 958 1HD LYS 127 1HD LYS 127 4.043 -11.382 6.358 959 2HD LYS 127 2HD LYS 127 2.457 -12.142 6.188 960 1HE LYS 127 1HE LYS 127 3.075 -12.916 3.846 961 2HE LYS 127 2HE LYS 127 4.659 -12.141 4.006 962 1HZ LYS 127 3HZ LYS 127 5.125 -13.615 5.895 963 2HZ LYS 127 1HZ LYS 127 3.647 -14.339 5.747 964 3HZ LYS 127 2HZ LYS 127 4.768 -14.493 4.543 965 H VAL 128 H VAL 128 1.162 -8.642 7.641 966 HA VAL 128 HA VAL 128 1.166 -5.865 8.789 967 HB VAL 128 HB VAL 128 -1.454 -7.466 8.613 968 1HG1 VAL 128 3HG2 VAL 128 -1.155 -6.265 10.799 969 2HG1 VAL 128 1HG2 VAL 128 -0.792 -4.750 9.931 970 3HG1 VAL 128 2HG2 VAL 128 -2.418 -5.477 9.817 971 1HG2 VAL 128 2HG1 VAL 128 -0.854 -6.304 6.466 972 2HG2 VAL 128 3HG1 VAL 128 -2.240 -5.501 7.249 973 3HG2 VAL 128 1HG1 VAL 128 -0.614 -4.773 7.348 974 H VAL 129 H VAL 129 1.051 -5.758 10.915 975 HA VAL 129 HA VAL 129 1.208 -8.364 12.543 976 HB VAL 129 HB VAL 129 3.215 -7.509 13.672 977 1HG1 VAL 129 3HG2 VAL 129 3.480 -8.950 11.633 978 2HG1 VAL 129 1HG2 VAL 129 3.484 -7.502 10.594 979 3HG1 VAL 129 2HG2 VAL 129 4.815 -7.773 11.751 980 1HG2 VAL 129 2HG1 VAL 129 2.748 -5.054 13.413 981 2HG2 VAL 129 3HG1 VAL 129 4.378 -5.451 12.808 982 3HG2 VAL 129 1HG1 VAL 129 3.042 -5.170 11.659 983 H LYS 130 H LYS 130 0.536 -4.952 12.376 984 HA LYS 130 HA LYS 130 -1.306 -5.050 14.697 985 1HB LYS 130 1HB LYS 130 1.002 -5.084 15.813 986 2HB LYS 130 2HB LYS 130 1.357 -3.537 15.040 987 1HG LYS 130 1HG LYS 130 0.553 -3.124 17.331 988 2HG LYS 130 2HG LYS 130 -0.614 -2.478 16.173 989 1HD LYS 130 1HD LYS 130 -2.042 -4.553 16.442 990 2HD LYS 130 2HD LYS 130 -0.863 -5.224 17.575 991 1HE LYS 130 1HE LYS 130 -1.261 -3.262 19.151 992 2HE LYS 130 2HE LYS 130 -2.459 -2.607 18.024 993 1HZ LYS 130 3HZ LYS 130 -2.641 -5.264 19.366 994 2HZ LYS 130 1HZ LYS 130 -3.501 -3.913 19.770 995 3HZ LYS 130 2HZ LYS 130 -3.762 -4.653 18.317 996 H GLY 131 H GLY 131 -2.564 -4.259 13.103 997 1HA GLY 131 1HA GLY 131 -2.622 -1.275 12.803 998 2HA GLY 131 2HA GLY 131 -2.167 -2.102 11.300 999 H MET 132 H MET 132 -3.680 -4.374 11.447 1000 HA MET 132 HA MET 132 -6.119 -3.743 10.214 1001 1HB MET 132 1HB MET 132 -5.535 -6.108 12.089 1002 2HB MET 132 2HB MET 132 -7.026 -5.963 11.144 1003 1HG MET 132 1HG MET 132 -4.184 -5.914 9.949 1004 2HG MET 132 2HG MET 132 -5.322 -7.283 9.880 1005 1HE MET 132 1HE MET 132 -4.040 -5.955 7.217 1006 2HE MET 132 3HE MET 132 -5.211 -7.312 7.169 1007 3HE MET 132 2HE MET 132 -5.483 -5.857 6.165 1008 H ASP 133 H ASP 133 -5.522 -3.893 13.681 1009 HA ASP 133 HA ASP 133 -8.169 -3.409 14.739 1010 1HB ASP 133 1HB ASP 133 -6.110 -3.696 16.148 1011 2HB ASP 133 2HB ASP 133 -5.500 -2.127 15.593 1012 H VAL 134 H VAL 134 -5.671 -1.074 13.850 1013 HA VAL 134 HA VAL 134 -7.366 1.312 13.766 1014 HB VAL 134 HB VAL 134 -4.871 0.708 12.071 1015 1HG1 VAL 134 3HG2 VAL 134 -6.222 2.695 11.326 1016 2HG1 VAL 134 1HG2 VAL 134 -6.185 3.353 12.982 1017 3HG1 VAL 134 2HG2 VAL 134 -4.674 3.218 12.043 1018 1HG2 VAL 134 2HG1 VAL 134 -4.422 0.357 14.514 1019 2HG2 VAL 134 3HG1 VAL 134 -3.606 1.828 13.924 1020 3HG2 VAL 134 1HG1 VAL 134 -5.104 1.964 14.883 1021 H ALA 135 H ALA 135 -5.969 -0.568 11.132 1022 HA ALA 135 HA ALA 135 -7.273 0.474 8.888 1023 1HB ALA 135 2HB ALA 135 -5.626 -1.422 8.766 1024 2HB ALA 135 3HB ALA 135 -6.849 -2.544 9.419 1025 3HB ALA 135 1HB ALA 135 -7.089 -1.793 7.820 1026 H ASP 136 H ASP 136 -8.532 -2.059 10.996 1027 HA ASP 136 HA ASP 136 -11.033 -2.620 9.666 1028 1HB ASP 136 1HB ASP 136 -10.473 -2.508 12.694 1029 2HB ASP 136 2HB ASP 136 -11.867 -3.299 11.940 1030 H LYS 137 H LYS 137 -10.743 -0.770 12.634 1031 HA LYS 137 HA LYS 137 -13.230 0.593 12.611 1032 1HB LYS 137 1HB LYS 137 -11.584 0.736 14.470 1033 2HB LYS 137 2HB LYS 137 -10.521 1.753 13.479 1034 1HG LYS 137 1HG LYS 137 -12.305 3.500 13.280 1035 2HG LYS 137 2HG LYS 137 -13.457 2.437 14.066 1036 1HD LYS 137 1HD LYS 137 -12.873 4.041 15.692 1037 2HD LYS 137 2HD LYS 137 -12.122 2.561 16.236 1038 1HE LYS 137 1HE LYS 137 -10.609 4.804 14.702 1039 2HE LYS 137 2HE LYS 137 -10.780 4.776 16.454 1040 1HZ LYS 137 3HZ LYS 137 -9.604 2.652 16.514 1041 2HZ LYS 137 1HZ LYS 137 -9.425 2.655 14.872 1042 3HZ LYS 137 2HZ LYS 137 -8.684 3.815 15.786 1043 H ILE 138 H ILE 138 -10.214 1.536 11.041 1044 HA ILE 138 HA ILE 138 -11.107 4.072 9.883 1045 HB ILE 138 HB ILE 138 -9.091 2.040 8.762 1046 1HG1 ILE 138 1HG1 ILE 138 -8.818 4.472 10.630 1047 2HG1 ILE 138 2HG1 ILE 138 -8.539 2.783 11.069 1048 1HG2 ILE 138 2HG2 ILE 138 -9.895 3.715 7.065 1049 2HG2 ILE 138 3HG2 ILE 138 -9.528 5.047 8.192 1050 3HG2 ILE 138 1HG2 ILE 138 -8.206 4.050 7.531 1051 1HD1 ILE 138 2HD1 ILE 138 -6.925 4.366 8.947 1052 2HD1 ILE 138 3HD1 ILE 138 -6.358 3.951 10.586 1053 3HD1 ILE 138 1HD1 ILE 138 -6.635 2.661 9.384 1054 H SER 139 H SER 139 -10.717 0.889 8.408 1055 HA SER 139 HA SER 139 -12.179 1.524 5.973 1056 1HB SER 139 1HB SER 139 -12.018 -0.895 5.483 1057 2HB SER 139 2HB SER 139 -10.488 -0.294 6.149 1058 HG SER 139 HG SER 139 -11.181 -2.222 7.127 1059 H GLN 140 H GLN 140 -13.462 1.342 8.882 1060 HA GLN 140 HA GLN 140 -16.142 0.097 8.039 1061 1HB GLN 140 1HB GLN 140 -15.033 1.040 10.731 1062 2HB GLN 140 2HB GLN 140 -16.766 0.831 10.466 1063 1HG GLN 140 1HG GLN 140 -15.846 -1.261 11.371 1064 2HG GLN 140 2HG GLN 140 -16.456 -1.522 9.738 1065 1HE2 GLN 140 2HE2 GLN 140 -13.201 -2.189 8.340 1066 2HE2 GLN 140 1HE2 GLN 140 -14.890 -1.584 7.974 1067 H VAL 141 H VAL 141 -14.755 3.091 9.331 1068 HA VAL 141 HA VAL 141 -16.955 4.837 9.361 1069 HB VAL 141 HB VAL 141 -14.652 5.556 9.901 1070 1HG1 VAL 141 3HG2 VAL 141 -13.472 4.397 8.004 1071 2HG1 VAL 141 1HG2 VAL 141 -14.226 5.515 6.838 1072 3HG1 VAL 141 2HG2 VAL 141 -13.056 6.131 8.036 1073 1HG2 VAL 141 2HG1 VAL 141 -16.410 7.278 9.401 1074 2HG2 VAL 141 3HG1 VAL 141 -14.805 7.847 8.870 1075 3HG2 VAL 141 1HG1 VAL 141 -15.978 7.236 7.672 1076 HA PRO 142 HA PRO 142 -19.153 4.833 5.608 1077 1HB PRO 142 1HB PRO 142 -19.168 7.812 6.319 1078 2HB PRO 142 2HB PRO 142 -20.542 6.803 5.801 1079 1HG PRO 142 1HG PRO 142 -20.263 7.326 8.446 1080 2HG PRO 142 2HG PRO 142 -20.607 5.650 7.952 1081 1HD PRO 142 1HD PRO 142 -17.906 6.835 8.784 1082 2HD PRO 142 2HD PRO 142 -18.596 5.230 9.187 1083 H THR 143 H THR 143 -19.283 5.945 3.595 1084 HA THR 143 HA THR 143 -16.923 7.537 2.571 1085 HB THR 143 HB THR 143 -16.583 5.760 0.723 1086 HG1 THR 143 HG1 THR 143 -17.760 4.156 2.745 1087 1HG2 THR 143 2HG2 THR 143 -14.889 6.228 2.459 1088 2HG2 THR 143 3HG2 THR 143 -15.679 5.067 3.573 1089 3HG2 THR 143 1HG2 THR 143 -14.926 4.491 2.047 1090 H HIS 144 H HIS 144 -17.037 6.427 0.144 1091 HA HIS 144 HA HIS 144 -19.598 6.208 -1.141 1092 1HB HIS 144 1HB HIS 144 -20.035 8.389 -2.141 1093 2HB HIS 144 2HB HIS 144 -19.976 8.568 -0.390 1094 HD2 HIS 144 HD2 HIS 144 -16.465 8.250 -1.892 1095 HE1 HIS 144 HE1 HIS 144 -17.164 12.336 -1.663 1096 HE2 HIS 144 HE2 HIS 144 -15.308 10.617 -2.104 1097 H ASP 145 H ASP 145 -19.624 6.344 -3.368 1098 HA ASP 145 HA ASP 145 -17.251 5.489 -4.881 1099 1HB ASP 145 1HB ASP 145 -19.718 7.076 -5.824 1100 2HB ASP 145 2HB ASP 145 -18.548 6.274 -6.885 1101 H VAL 146 H VAL 146 -17.304 7.398 -6.961 1102 HA VAL 146 HA VAL 146 -16.798 10.117 -5.917 1103 HB VAL 146 HB VAL 146 -14.257 9.076 -7.145 1104 1HG1 VAL 146 3HG2 VAL 146 -14.676 11.484 -6.507 1105 2HG1 VAL 146 1HG2 VAL 146 -14.962 10.981 -4.821 1106 3HG1 VAL 146 2HG2 VAL 146 -13.343 10.788 -5.536 1107 1HG2 VAL 146 2HG1 VAL 146 -14.667 7.278 -5.452 1108 2HG2 VAL 146 3HG1 VAL 146 -13.305 8.329 -4.987 1109 3HG2 VAL 146 1HG1 VAL 146 -14.886 8.517 -4.184 1110 H GLY 147 H GLY 147 -14.776 10.466 -8.107 1111 1HA GLY 147 1HA GLY 147 -16.603 10.934 -10.464 1112 2HA GLY 147 2HA GLY 147 -14.839 11.131 -10.447 1113 HA PRO 148 HA PRO 148 -14.595 7.094 -12.492 1114 1HB PRO 148 1HB PRO 148 -11.856 7.174 -12.685 1115 2HB PRO 148 2HB PRO 148 -12.876 8.260 -13.660 1116 1HG PRO 148 1HG PRO 148 -11.491 8.906 -10.998 1117 2HG PRO 148 2HG PRO 148 -11.403 9.839 -12.513 1118 1HD PRO 148 1HD PRO 148 -13.194 10.498 -10.487 1119 2HD PRO 148 2HD PRO 148 -13.642 10.714 -12.209 1120 OH TYR 149 OH TYR 149 -6.990 8.436 -11.564 1121 H TYR 149 H TYR 149 -12.440 8.258 -9.939 1122 HA TYR 149 HA TYR 149 -11.663 5.615 -8.935 1123 1HB TYR 149 1HB TYR 149 -11.515 8.356 -7.550 1124 2HB TYR 149 2HB TYR 149 -10.669 6.895 -7.035 1125 HD1 TYR 149 HD2 TYR 149 -9.071 5.801 -8.637 1126 HD2 TYR 149 HD1 TYR 149 -10.662 9.645 -9.352 1127 HE1 TYR 149 HE2 TYR 149 -7.289 6.245 -10.228 1128 HE2 TYR 149 HE1 TYR 149 -8.879 10.086 -10.942 1129 HH TYR 149 HH TYR 149 -7.105 9.318 -11.926 1130 H GLN 150 H GLN 150 -13.508 4.513 -8.689 1131 HA GLN 150 HA GLN 150 -15.525 5.124 -6.543 1132 1HB GLN 150 1HB GLN 150 -16.244 2.778 -6.888 1133 2HB GLN 150 2HB GLN 150 -16.137 3.644 -8.424 1134 1HG GLN 150 1HG GLN 150 -13.832 2.669 -8.812 1135 2HG GLN 150 2HG GLN 150 -13.945 1.792 -7.283 1136 1HE2 GLN 150 2HE2 GLN 150 -16.473 -0.527 -8.515 1137 2HE2 GLN 150 1HE2 GLN 150 -15.955 0.427 -7.037 1138 H ASN 151 H ASN 151 -15.549 4.422 -4.553 1139 HA ASN 151 HA ASN 151 -14.755 3.410 -2.491 1140 1HB ASN 151 1HB ASN 151 -12.365 2.428 -4.154 1141 2HB ASN 151 2HB ASN 151 -12.697 2.014 -2.465 1142 1HD2 ASN 151 1HD2 ASN 151 -15.992 0.521 -3.889 1143 2HD2 ASN 151 2HD2 ASN 151 -15.652 2.143 -3.099 1144 H VAL 152 H VAL 152 -14.749 5.415 -1.830 1145 HA VAL 152 HA VAL 152 -12.073 6.523 -1.038 1146 HB VAL 152 HB VAL 152 -13.970 8.115 -2.866 1147 1HG1 VAL 152 3HG2 VAL 152 -13.012 9.512 -1.011 1148 2HG1 VAL 152 1HG2 VAL 152 -11.369 8.949 -1.414 1149 3HG1 VAL 152 2HG2 VAL 152 -12.276 9.958 -2.572 1150 1HG2 VAL 152 1HG1 VAL 152 -11.051 7.132 -3.225 1151 2HG2 VAL 152 2HG1 VAL 152 -12.477 6.479 -4.074 1152 3HG2 VAL 152 3HG1 VAL 152 -11.942 8.152 -4.387 1153 HA PRO 153 HA PRO 153 -14.978 6.593 2.392 1154 1HB PRO 153 1HB PRO 153 -12.270 7.570 3.440 1155 2HB PRO 153 2HB PRO 153 -13.401 6.440 4.222 1156 1HG PRO 153 1HG PRO 153 -11.239 5.420 2.939 1157 2HG PRO 153 2HG PRO 153 -12.823 4.658 2.660 1158 1HD PRO 153 1HD PRO 153 -11.339 6.608 0.820 1159 2HD PRO 153 2HD PRO 153 -12.277 5.143 0.382 1160 H SER 154 H SER 154 -16.310 8.170 2.112 1161 HA SER 154 HA SER 154 -15.969 10.809 1.223 1162 1HB SER 154 1HB SER 154 -18.027 11.428 2.523 1163 2HB SER 154 2HB SER 154 -18.199 9.886 1.664 1164 HG SER 154 HG SER 154 -17.642 8.829 3.613 1165 H LYS 155 H LYS 155 -16.014 9.813 4.613 1166 HA LYS 155 HA LYS 155 -14.630 12.323 5.585 1167 1HB LYS 155 1HB LYS 155 -15.255 9.676 7.017 1168 2HB LYS 155 2HB LYS 155 -14.710 11.178 7.786 1169 1HG LYS 155 1HG LYS 155 -16.750 12.373 6.872 1170 2HG LYS 155 2HG LYS 155 -17.289 10.875 6.113 1171 1HD LYS 155 1HD LYS 155 -17.435 9.777 8.398 1172 2HD LYS 155 2HD LYS 155 -16.941 11.277 9.168 1173 1HE LYS 155 1HE LYS 155 -19.503 10.935 7.451 1174 2HE LYS 155 2HE LYS 155 -19.447 10.803 9.207 1175 1HZ LYS 155 3HZ LYS 155 -18.710 13.121 9.326 1176 2HZ LYS 155 1HZ LYS 155 -18.753 13.263 7.681 1177 3HZ LYS 155 2HZ LYS 155 -20.149 13.003 8.524 1178 HA PRO 156 HA PRO 156 -11.004 10.064 4.016 1179 1HB PRO 156 1HB PRO 156 -9.561 12.352 3.440 1180 2HB PRO 156 2HB PRO 156 -10.942 11.810 2.457 1181 1HG PRO 156 1HG PRO 156 -10.970 13.901 4.702 1182 2HG PRO 156 2HG PRO 156 -11.609 14.081 3.049 1183 1HD PRO 156 1HD PRO 156 -13.271 13.393 5.148 1184 2HD PRO 156 2HD PRO 156 -13.515 12.644 3.536 1185 H VAL 157 H VAL 157 -9.490 9.247 5.070 1186 HA VAL 157 HA VAL 157 -8.603 10.092 7.788 1187 HB VAL 157 HB VAL 157 -7.316 8.123 5.810 1188 1HG1 VAL 157 1HG2 VAL 157 -7.060 8.436 8.874 1189 2HG1 VAL 157 2HG2 VAL 157 -6.312 7.142 7.900 1190 3HG1 VAL 157 3HG2 VAL 157 -5.799 8.834 7.679 1191 1HG2 VAL 157 2HG1 VAL 157 -9.706 7.528 6.302 1192 2HG2 VAL 157 3HG1 VAL 157 -8.591 6.373 7.077 1193 3HG2 VAL 157 1HG1 VAL 157 -9.384 7.637 8.054 1194 H VAL 158 H VAL 158 -6.438 10.527 8.318 1195 HA VAL 158 HA VAL 158 -4.562 11.623 6.216 1196 HB VAL 158 HB VAL 158 -5.570 13.370 8.534 1197 1HG1 VAL 158 3HG2 VAL 158 -3.101 13.593 8.094 1198 2HG1 VAL 158 1HG2 VAL 158 -3.420 13.853 6.361 1199 3HG1 VAL 158 2HG2 VAL 158 -3.965 15.059 7.558 1200 1HG2 VAL 158 2HG1 VAL 158 -7.158 13.244 6.580 1201 2HG2 VAL 158 3HG1 VAL 158 -6.384 14.850 6.655 1202 3HG2 VAL 158 1HG1 VAL 158 -5.829 13.645 5.462 1203 H ILE 159 H ILE 159 -2.831 10.798 6.533 1204 HA ILE 159 HA ILE 159 -2.075 9.309 8.958 1205 HB ILE 159 HB ILE 159 -0.486 10.138 6.472 1206 1HG1 ILE 159 1HG1 ILE 159 -1.953 7.607 7.439 1207 2HG1 ILE 159 2HG1 ILE 159 -2.437 8.647 6.095 1208 1HG2 ILE 159 3HG2 ILE 159 0.255 8.178 8.743 1209 2HG2 ILE 159 1HG2 ILE 159 1.163 8.400 7.222 1210 3HG2 ILE 159 2HG2 ILE 159 1.062 9.731 8.401 1211 1HD1 ILE 159 3HD1 ILE 159 0.188 7.015 6.239 1212 2HD1 ILE 159 1HD1 ILE 159 -1.245 6.600 5.259 1213 3HD1 ILE 159 2HD1 ILE 159 -0.292 8.061 4.873 1214 H LEU 160 H LEU 160 -0.924 9.682 10.503 1215 HA LEU 160 HA LEU 160 -0.270 12.553 11.262 1216 1HB LEU 160 1HB LEU 160 -0.114 9.951 12.897 1217 2HB LEU 160 2HB LEU 160 0.141 11.585 13.525 1218 HG LEU 160 HG LEU 160 -2.433 10.564 12.183 1219 1HD1 LEU 160 2HD1 LEU 160 -2.073 9.648 14.498 1220 2HD1 LEU 160 3HD1 LEU 160 -1.832 11.299 15.126 1221 3HD1 LEU 160 1HD1 LEU 160 -3.422 10.812 14.483 1222 1HD2 LEU 160 3HD2 LEU 160 -2.018 12.999 11.724 1223 2HD2 LEU 160 1HD2 LEU 160 -3.390 12.792 12.844 1224 3HD2 LEU 160 2HD2 LEU 160 -1.799 13.303 13.467 1225 H SER 161 H SER 161 1.274 9.379 11.183 1226 HA SER 161 HA SER 161 4.009 10.645 10.624 1227 1HB SER 161 1HB SER 161 3.368 8.727 12.952 1228 2HB SER 161 2HB SER 161 4.992 9.275 12.490 1229 HG SER 161 HG SER 161 4.072 10.529 14.147 1230 H ALA 162 H ALA 162 5.662 8.897 10.620 1231 HA ALA 162 HA ALA 162 5.049 6.214 9.607 1232 1HB ALA 162 2HB ALA 162 3.993 7.508 7.713 1233 2HB ALA 162 3HB ALA 162 5.530 8.370 7.433 1234 3HB ALA 162 1HB ALA 162 5.427 6.614 7.150 1235 H LYS 163 H LYS 163 6.698 5.145 9.960 1236 HA LYS 163 HA LYS 163 9.305 5.683 8.782 1237 1HB LYS 163 1HB LYS 163 10.698 6.149 10.701 1238 2HB LYS 163 2HB LYS 163 9.437 7.382 10.635 1239 1HG LYS 163 1HG LYS 163 9.444 4.861 12.418 1240 2HG LYS 163 2HG LYS 163 9.810 6.500 12.962 1241 1HD LYS 163 1HD LYS 163 7.459 7.230 12.327 1242 2HD LYS 163 2HD LYS 163 7.093 5.579 11.807 1243 1HE LYS 163 1HE LYS 163 7.530 4.737 14.169 1244 2HE LYS 163 2HE LYS 163 7.912 6.385 14.688 1245 1HZ LYS 163 2HZ LYS 163 5.641 7.041 14.081 1246 2HZ LYS 163 3HZ LYS 163 5.282 5.502 13.598 1247 3HZ LYS 163 1HZ LYS 163 5.622 5.812 15.185 1248 H VAL 164 H VAL 164 10.784 4.133 9.016 1249 HA VAL 164 HA VAL 164 9.743 1.405 9.434 1250 HB VAL 164 HB VAL 164 12.072 0.741 8.943 1251 1HG1 VAL 164 3HG2 VAL 164 10.547 1.385 7.059 1252 2HG1 VAL 164 1HG2 VAL 164 11.080 3.081 7.193 1253 3HG1 VAL 164 2HG2 VAL 164 12.235 1.822 6.680 1254 1HG2 VAL 164 2HG1 VAL 164 13.241 2.519 10.275 1255 2HG2 VAL 164 3HG1 VAL 164 13.838 2.498 8.595 1256 3HG2 VAL 164 1HG1 VAL 164 12.692 3.760 9.120 1257 H LEU 165 H LEU 165 9.981 0.060 10.990 1258 HA LEU 165 HA LEU 165 10.361 0.898 13.737 1259 1HB LEU 165 1HB LEU 165 9.189 -1.212 12.957 1260 2HB LEU 165 2HB LEU 165 10.759 -1.952 12.634 1261 HG LEU 165 HG LEU 165 9.877 -0.822 15.362 1262 1HD1 LEU 165 2HD1 LEU 165 8.486 -2.799 14.686 1263 2HD1 LEU 165 3HD1 LEU 165 9.963 -3.749 14.377 1264 3HD1 LEU 165 1HD1 LEU 165 9.570 -3.222 16.035 1265 1HD2 LEU 165 2HD2 LEU 165 12.287 -2.603 14.603 1266 2HD2 LEU 165 3HD2 LEU 165 12.371 -0.891 15.092 1267 3HD2 LEU 165 1HD2 LEU 165 11.836 -2.124 16.260 1268 HA PRO 166 HA PRO 166 14.663 1.781 14.088 1269 1HB PRO 166 1HB PRO 166 13.907 0.740 16.868 1270 2HB PRO 166 2HB PRO 166 14.862 2.187 16.464 1271 1HG PRO 166 1HG PRO 166 12.251 2.508 17.127 1272 2HG PRO 166 2HG PRO 166 12.876 3.384 15.708 1273 1HD PRO 166 1HD PRO 166 11.190 0.825 15.732 1274 2HD PRO 166 2HD PRO 166 11.082 2.232 14.624 Start of MODEL 12 Raw file had 1274 H/Q atoms Start of MODEL 12 1 1H ALA 1 3H ALA 1 17.722 -7.655 14.430 2 2H ALA 1 1H ALA 1 16.502 -7.261 13.388 3 3H ALA 1 2H ALA 1 16.151 -7.953 14.847 4 HA ALA 1 HA ALA 1 17.248 -10.022 14.217 5 1HB ALA 1 2HB ALA 1 14.788 -9.765 13.750 6 2HB ALA 1 3HB ALA 1 15.152 -9.033 12.165 7 3HB ALA 1 1HB ALA 1 15.573 -10.737 12.481 8 H LYS 2 H LYS 2 16.845 -7.776 11.513 9 HA LYS 2 HA LYS 2 19.527 -7.771 10.515 10 1HB LYS 2 1HB LYS 2 19.472 -9.508 8.730 11 2HB LYS 2 2HB LYS 2 19.314 -10.234 10.339 12 1HG LYS 2 1HG LYS 2 16.797 -10.217 10.086 13 2HG LYS 2 2HG LYS 2 16.946 -9.557 8.467 14 1HD LYS 2 1HD LYS 2 18.068 -12.298 9.368 15 2HD LYS 2 2HD LYS 2 16.502 -12.058 8.604 16 1HE LYS 2 1HE LYS 2 17.634 -11.131 6.522 17 2HE LYS 2 2HE LYS 2 19.216 -11.410 7.264 18 1HZ LYS 2 3HZ LYS 2 17.199 -13.527 6.692 19 2HZ LYS 2 1HZ LYS 2 18.579 -13.242 5.830 20 3HZ LYS 2 2HZ LYS 2 18.675 -13.787 7.387 21 H GLY 3 H GLY 3 17.492 -6.020 10.645 22 1HA GLY 3 1HA GLY 3 17.591 -4.556 8.247 23 2HA GLY 3 2HA GLY 3 16.206 -5.619 7.940 24 H ASP 4 H ASP 4 14.551 -4.464 8.063 25 HA ASP 4 HA ASP 4 13.426 -3.518 10.595 26 1HB ASP 4 1HB ASP 4 14.464 -1.338 8.673 27 2HB ASP 4 2HB ASP 4 13.306 -1.040 9.976 28 HA PRO 5 HA PRO 5 10.758 -4.193 6.821 29 1HB PRO 5 1HB PRO 5 9.861 -6.707 7.404 30 2HB PRO 5 2HB PRO 5 11.544 -6.440 6.889 31 1HG PRO 5 1HG PRO 5 10.508 -6.705 9.769 32 2HG PRO 5 2HG PRO 5 11.827 -7.632 9.010 33 1HD PRO 5 1HD PRO 5 12.323 -5.355 10.532 34 2HD PRO 5 2HD PRO 5 13.333 -5.743 9.103 35 H HIS 6 H HIS 6 9.996 -2.392 8.507 36 HA HIS 6 HA HIS 6 7.084 -2.982 9.121 37 1HB HIS 6 1HB HIS 6 9.056 -2.147 11.332 38 2HB HIS 6 2HB HIS 6 7.299 -2.263 11.493 39 HD2 HIS 6 HD2 HIS 6 8.950 -4.915 9.274 40 HE1 HIS 6 HE1 HIS 6 8.060 -6.832 12.856 41 HE2 HIS 6 HE2 HIS 6 8.871 -7.293 10.460 42 H VAL 7 H VAL 7 6.701 -1.620 7.553 43 HA VAL 7 HA VAL 7 7.351 1.315 7.738 44 HB VAL 7 HB VAL 7 5.292 -0.311 6.118 45 1HG1 VAL 7 1HG2 VAL 7 5.628 2.750 6.165 46 2HG1 VAL 7 2HG2 VAL 7 4.623 1.818 5.024 47 3HG1 VAL 7 3HG2 VAL 7 4.208 1.840 6.754 48 1HG2 VAL 7 2HG1 VAL 7 7.711 -0.321 5.382 49 2HG2 VAL 7 3HG1 VAL 7 6.692 0.574 4.217 50 3HG2 VAL 7 1HG1 VAL 7 7.715 1.462 5.379 51 H LEU 8 H LEU 8 7.068 1.468 9.871 52 HA LEU 8 HA LEU 8 4.452 0.838 11.188 53 1HB LEU 8 1HB LEU 8 6.727 0.582 12.261 54 2HB LEU 8 2HB LEU 8 6.852 2.344 12.372 55 HG LEU 8 HG LEU 8 4.389 0.801 13.372 56 1HD1 LEU 8 2HD1 LEU 8 6.398 -0.168 14.472 57 2HD1 LEU 8 3HD1 LEU 8 6.944 1.457 14.964 58 3HD1 LEU 8 1HD1 LEU 8 5.437 0.771 15.644 59 1HD2 LEU 8 3HD2 LEU 8 4.147 3.291 13.115 60 2HD2 LEU 8 1HD2 LEU 8 4.092 2.824 14.834 61 3HD2 LEU 8 2HD2 LEU 8 5.573 3.547 14.155 62 H LEU 9 H LEU 9 2.878 1.905 10.848 63 HA LEU 9 HA LEU 9 2.956 4.927 10.232 64 1HB LEU 9 1HB LEU 9 1.367 2.613 9.121 65 2HB LEU 9 2HB LEU 9 0.512 4.145 9.294 66 HG LEU 9 HG LEU 9 3.279 3.978 7.984 67 1HD1 LEU 9 3HD1 LEU 9 0.507 3.832 6.618 68 2HD1 LEU 9 1HD1 LEU 9 2.072 3.984 5.776 69 3HD1 LEU 9 2HD1 LEU 9 1.697 2.505 6.698 70 1HD2 LEU 9 3HD2 LEU 9 2.484 6.235 8.794 71 2HD2 LEU 9 1HD2 LEU 9 2.519 6.188 7.013 72 3HD2 LEU 9 2HD2 LEU 9 0.967 6.042 7.877 73 H THR 10 H THR 10 0.981 5.961 10.513 74 HA THR 10 HA THR 10 -0.872 5.154 12.742 75 HB THR 10 HB THR 10 0.995 7.593 13.035 76 HG1 THR 10 HG1 THR 10 1.942 5.576 13.493 77 1HG2 THR 10 3HG2 THR 10 -1.211 6.460 14.884 78 2HG2 THR 10 1HG2 THR 10 -0.146 7.839 15.268 79 3HG2 THR 10 2HG2 THR 10 -1.327 7.967 13.938 80 H THR 11 H THR 11 -2.424 5.363 11.365 81 HA THR 11 HA THR 11 -2.982 7.973 9.896 82 HB THR 11 HB THR 11 -5.138 6.770 9.261 83 HG1 THR 11 HG1 THR 11 -5.054 4.523 9.582 84 1HG2 THR 11 2HG2 THR 11 -3.115 6.884 7.795 85 2HG2 THR 11 3HG2 THR 11 -2.445 5.430 8.581 86 3HG2 THR 11 1HG2 THR 11 -3.943 5.314 7.611 87 H SER 12 H SER 12 -4.932 8.964 10.105 88 HA SER 12 HA SER 12 -5.491 10.166 12.590 89 1HB SER 12 1HB SER 12 -7.756 10.738 11.724 90 2HB SER 12 2HB SER 12 -6.524 10.925 10.462 91 HG SER 12 HG SER 12 -8.359 9.789 9.749 92 H ALA 13 H ALA 13 -6.955 7.238 11.289 93 HA ALA 13 HA ALA 13 -8.817 6.617 13.400 94 1HB ALA 13 2HB ALA 13 -8.708 5.327 11.259 95 2HB ALA 13 3HB ALA 13 -7.138 4.636 11.742 96 3HB ALA 13 1HB ALA 13 -8.613 4.238 12.663 97 H GLY 14 H GLY 14 -5.702 5.297 12.920 98 1HA GLY 14 1HA GLY 14 -4.667 5.641 15.680 99 2HA GLY 14 2HA GLY 14 -5.361 4.021 15.528 100 H ASN 15 H ASN 15 -2.941 4.228 16.241 101 HA ASN 15 HA ASN 15 -0.860 4.163 14.139 102 1HB ASN 15 1HB ASN 15 -0.367 4.593 16.551 103 2HB ASN 15 2HB ASN 15 -0.910 2.964 16.976 104 1HD2 ASN 15 1HD2 ASN 15 2.321 2.766 14.443 105 2HD2 ASN 15 2HD2 ASN 15 0.731 3.545 13.961 106 H ILE 16 H ILE 16 -0.239 2.684 12.897 107 HA ILE 16 HA ILE 16 -0.798 -0.264 13.390 108 HB ILE 16 HB ILE 16 -1.620 -0.575 11.053 109 1HG1 ILE 16 1HG1 ILE 16 -1.647 2.503 11.057 110 2HG1 ILE 16 2HG1 ILE 16 -0.645 1.473 10.028 111 1HG2 ILE 16 2HG2 ILE 16 -3.183 -0.403 12.984 112 2HG2 ILE 16 3HG2 ILE 16 -3.258 1.369 12.788 113 3HG2 ILE 16 1HG2 ILE 16 -3.913 0.299 11.514 114 1HD1 ILE 16 3HD1 ILE 16 -3.744 1.533 10.014 115 2HD1 ILE 16 1HD1 ILE 16 -2.686 2.262 8.778 116 3HD1 ILE 16 2HD1 ILE 16 -2.741 0.489 8.972 117 H GLU 17 H GLU 17 0.069 -1.463 11.418 118 HA GLU 17 HA GLU 17 2.813 -0.491 10.547 119 1HB GLU 17 1HB GLU 17 2.463 -2.741 12.611 120 2HB GLU 17 2HB GLU 17 3.999 -2.149 11.956 121 1HG GLU 17 1HG GLU 17 3.531 0.143 12.926 122 2HG GLU 17 2HG GLU 17 1.979 -0.420 13.536 123 H LEU 18 H LEU 18 2.852 -1.128 8.625 124 HA LEU 18 HA LEU 18 2.119 -3.942 7.732 125 1HB LEU 18 1HB LEU 18 3.530 -1.634 6.262 126 2HB LEU 18 2HB LEU 18 3.321 -3.257 5.603 127 HG LEU 18 HG LEU 18 1.500 -1.996 4.734 128 1HD1 LEU 18 1HD1 LEU 18 0.884 -4.284 5.576 129 2HD1 LEU 18 2HD1 LEU 18 0.458 -3.596 7.165 130 3HD1 LEU 18 3HD1 LEU 18 -0.494 -3.162 5.721 131 1HD2 LEU 18 3HD2 LEU 18 1.590 -0.058 6.300 132 2HD2 LEU 18 1HD2 LEU 18 -0.075 -0.670 6.141 133 3HD2 LEU 18 2HD2 LEU 18 0.877 -1.053 7.602 134 H GLU 19 H GLU 19 3.535 -5.420 7.145 135 HA GLU 19 HA GLU 19 6.495 -5.115 7.970 136 1HB GLU 19 1HB GLU 19 6.496 -7.459 8.656 137 2HB GLU 19 2HB GLU 19 5.296 -6.556 9.593 138 1HG GLU 19 1HG GLU 19 3.474 -7.337 8.004 139 2HG GLU 19 2HG GLU 19 4.668 -8.234 7.071 140 H LEU 20 H LEU 20 7.724 -5.236 6.419 141 HA LEU 20 HA LEU 20 6.733 -6.225 3.697 142 1HB LEU 20 1HB LEU 20 9.104 -4.404 4.373 143 2HB LEU 20 2HB LEU 20 8.413 -4.711 2.774 144 HG LEU 20 HG LEU 20 6.969 -3.410 5.160 145 1HD1 LEU 20 2HD1 LEU 20 8.639 -1.908 4.039 146 2HD1 LEU 20 3HD1 LEU 20 7.884 -2.228 2.456 147 3HD1 LEU 20 1HD1 LEU 20 6.976 -1.355 3.717 148 1HD2 LEU 20 3HD2 LEU 20 5.392 -4.792 3.782 149 2HD2 LEU 20 1HD2 LEU 20 5.061 -3.054 3.574 150 3HD2 LEU 20 2HD2 LEU 20 5.929 -3.953 2.303 151 H ASP 21 H ASP 21 8.432 -6.804 2.199 152 HA ASP 21 HA ASP 21 10.438 -8.847 3.360 153 1HB ASP 21 1HB ASP 21 8.588 -9.140 0.920 154 2HB ASP 21 2HB ASP 21 9.817 -10.308 1.427 155 H LYS 22 H LYS 22 12.208 -7.879 3.060 156 HA LYS 22 HA LYS 22 12.914 -6.215 0.687 157 1HB LYS 22 1HB LYS 22 13.889 -5.829 2.935 158 2HB LYS 22 2HB LYS 22 14.599 -7.452 2.935 159 1HG LYS 22 1HG LYS 22 15.872 -6.873 0.820 160 2HG LYS 22 2HG LYS 22 15.234 -5.239 0.870 161 1HD LYS 22 1HD LYS 22 17.016 -6.534 3.039 162 2HD LYS 22 2HD LYS 22 17.617 -5.510 1.756 163 1HE LYS 22 1HE LYS 22 15.666 -4.567 3.969 164 2HE LYS 22 2HE LYS 22 17.411 -4.349 3.989 165 1HZ LYS 22 3HZ LYS 22 17.236 -2.993 1.975 166 2HZ LYS 22 1HZ LYS 22 15.597 -3.190 1.934 167 3HZ LYS 22 2HZ LYS 22 16.299 -2.371 3.185 168 H GLN 23 H GLN 23 13.516 -9.501 1.780 169 HA GLN 23 HA GLN 23 15.818 -10.229 0.301 170 1HB GLN 23 1HB GLN 23 14.668 -11.757 1.912 171 2HB GLN 23 2HB GLN 23 13.320 -11.966 0.785 172 1HG GLN 23 1HG GLN 23 14.884 -13.874 0.557 173 2HG GLN 23 2HG GLN 23 14.880 -12.930 -0.936 174 1HE2 GLN 23 2HE2 GLN 23 18.248 -12.944 1.473 175 2HE2 GLN 23 1HE2 GLN 23 16.607 -13.479 2.098 176 H LYS 24 H LYS 24 12.528 -10.953 -0.717 177 HA LYS 24 HA LYS 24 13.405 -11.451 -3.560 178 1HB LYS 24 1HB LYS 24 10.759 -11.658 -2.051 179 2HB LYS 24 2HB LYS 24 10.842 -11.746 -3.812 180 1HG LYS 24 1HG LYS 24 11.005 -14.038 -2.799 181 2HG LYS 24 2HG LYS 24 12.436 -13.622 -3.746 182 1HD LYS 24 1HD LYS 24 13.632 -12.930 -1.606 183 2HD LYS 24 2HD LYS 24 12.241 -13.437 -0.660 184 1HE LYS 24 1HE LYS 24 13.921 -15.301 -2.485 185 2HE LYS 24 2HE LYS 24 14.161 -15.110 -0.751 186 1HZ LYS 24 1HZ LYS 24 11.914 -15.970 -0.376 187 2HZ LYS 24 2HZ LYS 24 11.668 -16.153 -2.000 188 3HZ LYS 24 3HZ LYS 24 12.823 -17.052 -1.232 189 H ALA 25 H ALA 25 13.170 -8.663 -2.194 190 HA ALA 25 HA ALA 25 12.565 -7.332 -4.814 191 1HB ALA 25 2HB ALA 25 10.250 -7.579 -3.868 192 2HB ALA 25 3HB ALA 25 10.747 -6.708 -2.392 193 3HB ALA 25 1HB ALA 25 10.724 -5.865 -3.963 194 HA PRO 26 HA PRO 26 15.870 -5.404 -2.079 195 1HB PRO 26 1HB PRO 26 17.214 -5.759 -4.791 196 2HB PRO 26 2HB PRO 26 17.915 -6.012 -3.176 197 1HG PRO 26 1HG PRO 26 17.211 -8.180 -4.661 198 2HG PRO 26 2HG PRO 26 16.784 -8.151 -2.932 199 1HD PRO 26 1HD PRO 26 14.950 -7.516 -5.316 200 2HD PRO 26 2HD PRO 26 14.601 -8.513 -3.866 201 H VAL 27 H VAL 27 15.507 -5.023 -5.572 202 HA VAL 27 HA VAL 27 16.279 -2.269 -5.803 203 HB VAL 27 HB VAL 27 14.214 -3.804 -7.488 204 1HG1 VAL 27 3HG2 VAL 27 14.139 -1.322 -7.851 205 2HG1 VAL 27 1HG2 VAL 27 15.900 -1.295 -8.126 206 3HG1 VAL 27 2HG2 VAL 27 14.830 -2.147 -9.272 207 1HG2 VAL 27 2HG1 VAL 27 16.432 -4.972 -7.316 208 2HG2 VAL 27 3HG1 VAL 27 16.190 -4.313 -8.954 209 3HG2 VAL 27 1HG1 VAL 27 17.271 -3.477 -7.806 210 H SER 28 H SER 28 12.981 -3.443 -6.140 211 HA SER 28 HA SER 28 11.634 -0.963 -6.062 212 1HB SER 28 1HB SER 28 9.602 -2.210 -5.308 213 2HB SER 28 2HB SER 28 10.477 -3.068 -6.589 214 HG SER 28 HG SER 28 9.893 -4.416 -4.856 215 H VAL 29 H VAL 29 12.193 -3.094 -3.280 216 HA VAL 29 HA VAL 29 10.932 -1.377 -1.320 217 HB VAL 29 HB VAL 29 13.253 -3.243 -0.645 218 1HG1 VAL 29 3HG2 VAL 29 12.225 -1.824 1.182 219 2HG1 VAL 29 1HG2 VAL 29 10.611 -2.449 0.758 220 3HG1 VAL 29 2HG2 VAL 29 11.839 -3.551 1.428 221 1HG2 VAL 29 1HG1 VAL 29 10.318 -4.008 -1.247 222 2HG2 VAL 29 2HG1 VAL 29 11.735 -4.472 -2.225 223 3HG2 VAL 29 3HG1 VAL 29 11.554 -5.100 -0.567 224 H GLN 30 H GLN 30 14.286 -1.590 -2.379 225 HA GLN 30 HA GLN 30 15.535 0.243 -0.542 226 1HB GLN 30 1HB GLN 30 16.696 -1.093 -2.367 227 2HB GLN 30 2HB GLN 30 16.085 0.045 -3.570 228 1HG GLN 30 1HG GLN 30 17.865 0.769 -1.152 229 2HG GLN 30 2HG GLN 30 18.447 0.552 -2.803 230 1HE2 GLN 30 2HE2 GLN 30 17.376 4.217 -1.832 231 2HE2 GLN 30 1HE2 GLN 30 17.986 2.877 -0.737 232 H ASN 31 H ASN 31 14.291 0.981 -3.773 233 HA ASN 31 HA ASN 31 14.339 3.810 -3.736 234 1HB ASN 31 1HB ASN 31 12.062 2.057 -4.854 235 2HB ASN 31 2HB ASN 31 12.353 3.748 -5.276 236 1HD2 ASN 31 1HD2 ASN 31 14.938 0.834 -6.689 237 2HD2 ASN 31 2HD2 ASN 31 13.825 0.525 -5.263 238 H PHE 32 H PHE 32 11.693 1.734 -2.630 239 HA PHE 32 HA PHE 32 9.806 3.587 -1.653 240 1HB PHE 32 1HB PHE 32 10.771 1.077 -0.145 241 2HB PHE 32 2HB PHE 32 9.243 1.918 0.138 242 HD1 PHE 32 HD2 PHE 32 9.048 2.597 -2.972 243 HD2 PHE 32 HD1 PHE 32 9.502 -0.954 -0.741 244 HE1 PHE 32 HE2 PHE 32 7.974 1.337 -4.753 245 HE2 PHE 32 HE1 PHE 32 8.429 -2.210 -2.524 246 HZ PHE 32 HZ PHE 32 7.659 -1.065 -4.527 247 H VAL 33 H VAL 33 12.249 2.123 0.419 248 HA VAL 33 HA VAL 33 12.206 3.837 2.676 249 HB VAL 33 HB VAL 33 13.674 1.857 2.488 250 1HG1 VAL 33 3HG2 VAL 33 14.351 2.153 0.091 251 2HG1 VAL 33 1HG2 VAL 33 15.317 3.587 0.523 252 3HG1 VAL 33 2HG2 VAL 33 15.788 1.975 1.129 253 1HG2 VAL 33 2HG1 VAL 33 14.229 3.624 4.175 254 2HG2 VAL 33 3HG1 VAL 33 15.714 2.846 3.564 255 3HG2 VAL 33 1HG1 VAL 33 15.248 4.466 2.977 256 H ASP 34 H ASP 34 13.778 4.414 -0.421 257 HA ASP 34 HA ASP 34 15.062 6.943 0.009 258 1HB ASP 34 1HB ASP 34 13.251 6.070 -2.331 259 2HB ASP 34 2HB ASP 34 14.294 7.491 -2.365 260 OH TYR 35 OH TYR 35 9.647 7.859 -6.386 261 H TYR 35 H TYR 35 11.747 6.402 -1.052 262 HA TYR 35 HA TYR 35 10.727 9.110 -0.592 263 1HB TYR 35 1HB TYR 35 9.264 6.397 -0.521 264 2HB TYR 35 2HB TYR 35 8.459 7.968 -0.487 265 HD1 TYR 35 HD2 TYR 35 9.069 9.628 -2.341 266 HD2 TYR 35 HD1 TYR 35 9.844 5.488 -2.620 267 HE1 TYR 35 HE2 TYR 35 9.187 9.812 -4.762 268 HE2 TYR 35 HE1 TYR 35 9.961 5.677 -5.042 269 HH TYR 35 HH TYR 35 9.829 6.993 -6.758 270 H VAL 36 H VAL 36 10.570 6.143 1.327 271 HA VAL 36 HA VAL 36 9.245 7.057 3.677 272 HB VAL 36 HB VAL 36 11.708 5.220 3.547 273 1HG1 VAL 36 3HG2 VAL 36 11.194 6.044 5.864 274 2HG1 VAL 36 1HG2 VAL 36 9.497 5.529 5.684 275 3HG1 VAL 36 2HG2 VAL 36 10.801 4.311 5.711 276 1HG2 VAL 36 2HG1 VAL 36 9.829 4.486 2.045 277 2HG2 VAL 36 3HG1 VAL 36 9.989 3.384 3.438 278 3HG2 VAL 36 1HG1 VAL 36 8.683 4.599 3.406 279 H ASN 37 H ASN 37 12.740 6.813 3.325 280 HA ASN 37 HA ASN 37 13.561 8.426 5.547 281 1HB ASN 37 1HB ASN 37 14.897 8.299 2.772 282 2HB ASN 37 2HB ASN 37 15.666 8.876 4.260 283 1HD2 ASN 37 1HD2 ASN 37 16.715 5.367 4.111 284 2HD2 ASN 37 2HD2 ASN 37 17.050 7.001 3.347 285 H SER 38 H SER 38 12.847 9.392 2.235 286 HA SER 38 HA SER 38 13.517 12.187 2.374 287 1HB SER 38 1HB SER 38 11.193 10.884 0.826 288 2HB SER 38 2HB SER 38 11.881 12.486 0.495 289 HG SER 38 HG SER 38 13.283 10.013 0.462 290 H GLY 39 H GLY 39 10.350 12.163 1.554 291 1HA GLY 39 1HA GLY 39 8.965 12.691 4.122 292 2HA GLY 39 2HA GLY 39 9.488 14.223 3.381 293 H PHE 40 H PHE 40 7.807 11.229 2.850 294 HA PHE 40 HA PHE 40 6.143 12.406 0.533 295 1HB PHE 40 1HB PHE 40 7.588 10.525 -0.127 296 2HB PHE 40 2HB PHE 40 7.049 9.553 1.240 297 HD1 PHE 40 HD2 PHE 40 5.826 11.187 -1.865 298 HD2 PHE 40 HD1 PHE 40 5.103 8.256 1.082 299 HE1 PHE 40 HE2 PHE 40 4.036 10.258 -3.223 300 HE2 PHE 40 HE1 PHE 40 3.316 7.331 -0.279 301 HZ PHE 40 HZ PHE 40 2.792 8.316 -2.437 302 OH TYR 41 OH TYR 41 6.777 4.920 1.120 303 H TYR 41 H TYR 41 5.957 9.806 2.897 304 HA TYR 41 HA TYR 41 3.102 9.558 2.864 305 1HB TYR 41 1HB TYR 41 4.914 8.907 5.260 306 2HB TYR 41 2HB TYR 41 3.341 8.192 4.899 307 HD1 TYR 41 HD2 TYR 41 3.119 6.647 2.987 308 HD2 TYR 41 HD1 TYR 41 6.855 8.373 3.929 309 HE1 TYR 41 HE2 TYR 41 4.234 5.041 1.537 310 HE2 TYR 41 HE1 TYR 41 7.962 6.767 2.479 311 HH TYR 41 HH TYR 41 7.722 5.088 1.133 312 H ASN 42 H ASN 42 5.170 11.415 5.031 313 HA ASN 42 HA ASN 42 3.520 12.122 7.135 314 1HB ASN 42 1HB ASN 42 4.659 14.320 7.277 315 2HB ASN 42 2HB ASN 42 5.811 13.045 6.854 316 1HD2 ASN 42 1HD2 ASN 42 6.599 15.717 4.459 317 2HD2 ASN 42 2HD2 ASN 42 6.806 15.265 6.225 318 H ASN 43 H ASN 43 1.614 12.625 7.327 319 HA ASN 43 HA ASN 43 -0.531 13.589 7.024 320 1HB ASN 43 1HB ASN 43 0.669 15.662 7.473 321 2HB ASN 43 2HB ASN 43 1.191 15.814 5.787 322 1HD2 ASN 43 1HD2 ASN 43 -1.870 17.313 4.758 323 2HD2 ASN 43 2HD2 ASN 43 -0.158 16.780 4.367 324 H THR 44 H THR 44 0.402 11.752 5.134 325 HA THR 44 HA THR 44 -1.041 12.455 2.543 326 HB THR 44 HB THR 44 -0.722 10.051 2.007 327 HG1 THR 44 HG1 THR 44 -0.806 9.319 4.159 328 1HG2 THR 44 2HG2 THR 44 1.086 11.718 1.462 329 2HG2 THR 44 3HG2 THR 44 1.822 11.454 3.064 330 3HG2 THR 44 1HG2 THR 44 1.787 10.130 1.869 331 H THR 45 H THR 45 -2.195 9.699 2.650 332 HA THR 45 HA THR 45 -4.139 9.645 4.897 333 HB THR 45 HB THR 45 -6.187 9.963 3.482 334 HG1 THR 45 HG1 THR 45 -5.164 9.563 1.500 335 1HG2 THR 45 2HG2 THR 45 -5.285 11.874 4.854 336 2HG2 THR 45 3HG2 THR 45 -4.264 12.382 3.483 337 3HG2 THR 45 1HG2 THR 45 -6.041 12.463 3.351 338 H PHE 46 H PHE 46 -6.196 8.637 3.141 339 HA PHE 46 HA PHE 46 -5.199 6.006 2.048 340 1HB PHE 46 1HB PHE 46 -6.803 6.235 4.670 341 2HB PHE 46 2HB PHE 46 -6.891 4.798 3.654 342 HD1 PHE 46 HD1 PHE 46 -3.766 5.780 2.898 343 HD2 PHE 46 HD2 PHE 46 -5.909 4.322 6.225 344 HE1 PHE 46 HE1 PHE 46 -1.714 4.852 3.815 345 HE2 PHE 46 HE2 PHE 46 -3.857 3.389 7.136 346 HZ PHE 46 HZ PHE 46 -1.760 3.652 5.931 347 H HIS 47 H HIS 47 -6.036 7.530 0.443 348 HA HIS 47 HA HIS 47 -8.854 8.183 0.142 349 1HB HIS 47 1HB HIS 47 -8.321 8.353 -2.313 350 2HB HIS 47 2HB HIS 47 -7.141 9.198 -1.303 351 HD2 HIS 47 HD2 HIS 47 -7.013 7.271 -4.267 352 HE1 HIS 47 HE1 HIS 47 -3.782 5.659 -2.188 353 HE2 HIS 47 HE2 HIS 47 -4.812 5.799 -4.547 354 NH1 ARG 48 NH2 ARG 48 -11.371 2.930 -6.520 355 NH2 ARG 48 NH1 ARG 48 -11.206 0.682 -6.816 356 H ARG 48 H ARG 48 -7.024 5.662 -1.534 357 HA ARG 48 HA ARG 48 -9.419 4.291 -2.534 358 1HB ARG 48 1HB ARG 48 -7.053 4.247 -3.527 359 2HB ARG 48 2HB ARG 48 -6.594 3.125 -2.239 360 1HG ARG 48 1HG ARG 48 -7.267 1.855 -4.266 361 2HG ARG 48 2HG ARG 48 -8.390 1.530 -2.938 362 1HD ARG 48 1HD ARG 48 -10.019 3.236 -3.888 363 2HD ARG 48 2HD ARG 48 -8.889 3.574 -5.213 364 HE ARG 48 HE ARG 48 -9.464 0.692 -5.162 365 1HH1 ARG 48 2HH2 ARG 48 -11.030 3.766 -6.031 366 2HH1 ARG 48 1HH2 ARG 48 -12.110 2.893 -7.231 367 1HH2 ARG 48 1HH1 ARG 48 -10.744 -0.196 -6.555 368 2HH2 ARG 48 2HH1 ARG 48 -11.956 0.801 -7.505 369 H VAL 49 H VAL 49 -10.752 3.199 -1.476 370 HA VAL 49 HA VAL 49 -9.934 1.077 0.528 371 HB VAL 49 HB VAL 49 -11.759 3.439 1.272 372 1HG1 VAL 49 3HG2 VAL 49 -12.500 1.243 2.241 373 2HG1 VAL 49 1HG2 VAL 49 -10.859 0.954 2.874 374 3HG1 VAL 49 2HG2 VAL 49 -11.838 2.302 3.514 375 1HG2 VAL 49 2HG1 VAL 49 -9.316 4.034 1.269 376 2HG2 VAL 49 3HG1 VAL 49 -9.945 3.961 2.936 377 3HG2 VAL 49 1HG1 VAL 49 -8.959 2.620 2.293 378 H ILE 50 H ILE 50 -11.323 -0.413 0.892 379 HA ILE 50 HA ILE 50 -14.166 -0.340 -0.073 380 HB ILE 50 HB ILE 50 -12.929 -0.814 -2.188 381 1HG1 ILE 50 1HG1 ILE 50 -14.429 -3.213 -0.976 382 2HG1 ILE 50 2HG1 ILE 50 -15.180 -1.810 -1.743 383 1HG2 ILE 50 2HG2 ILE 50 -10.890 -1.875 -1.167 384 2HG2 ILE 50 3HG2 ILE 50 -11.866 -3.273 -0.644 385 3HG2 ILE 50 1HG2 ILE 50 -11.620 -2.957 -2.383 386 1HD1 ILE 50 3HD1 ILE 50 -13.250 -3.782 -3.154 387 2HD1 ILE 50 1HD1 ILE 50 -15.020 -3.725 -3.368 388 3HD1 ILE 50 2HD1 ILE 50 -14.011 -2.365 -3.927 389 HA PRO 51 HA PRO 51 -14.759 -2.508 3.638 390 1HB PRO 51 1HB PRO 51 -16.802 -3.752 1.717 391 2HB PRO 51 2HB PRO 51 -17.059 -3.252 3.409 392 1HG PRO 51 1HG PRO 51 -17.852 -1.563 1.441 393 2HG PRO 51 2HG PRO 51 -16.940 -0.889 2.813 394 1HD PRO 51 1HD PRO 51 -15.909 -1.496 0.001 395 2HD PRO 51 2HD PRO 51 -15.483 -0.133 1.085 396 H GLY 52 H GLY 52 -14.848 -4.577 4.471 397 1HA GLY 52 1HA GLY 52 -12.915 -6.313 4.505 398 2HA GLY 52 2HA GLY 52 -14.491 -7.069 4.258 399 H PHE 53 H PHE 53 -11.874 -5.515 2.495 400 HA PHE 53 HA PHE 53 -11.580 -7.846 0.611 401 1HB PHE 53 1HB PHE 53 -13.503 -6.498 -0.355 402 2HB PHE 53 2HB PHE 53 -12.446 -5.086 -0.459 403 HD1 PHE 53 HD2 PHE 53 -10.533 -5.113 -2.021 404 HD2 PHE 53 HD1 PHE 53 -13.173 -8.397 -1.816 405 HE1 PHE 53 HE2 PHE 53 -9.666 -5.945 -4.134 406 HE2 PHE 53 HE1 PHE 53 -12.304 -9.225 -3.929 407 HZ PHE 53 HZ PHE 53 -10.551 -8.000 -5.089 408 H MET 54 H MET 54 -10.891 -4.364 0.819 409 HA MET 54 HA MET 54 -7.949 -4.794 1.160 410 1HB MET 54 1HB MET 54 -7.290 -3.942 -1.084 411 2HB MET 54 2HB MET 54 -8.194 -5.457 -1.212 412 1HG MET 54 1HG MET 54 -10.312 -4.159 -1.685 413 2HG MET 54 2HG MET 54 -9.400 -2.636 -1.568 414 1HE MET 54 3HE MET 54 -10.248 -1.992 -4.063 415 2HE MET 54 2HE MET 54 -10.018 -3.058 -5.481 416 3HE MET 54 1HE MET 54 -11.131 -3.548 -4.169 417 H ILE 55 H ILE 55 -6.737 -3.004 1.142 418 HA ILE 55 HA ILE 55 -7.870 -0.247 0.860 419 HB ILE 55 HB ILE 55 -7.347 0.508 3.133 420 1HG1 ILE 55 1HG1 ILE 55 -6.714 -2.446 3.729 421 2HG1 ILE 55 2HG1 ILE 55 -5.506 -1.169 3.545 422 1HG2 ILE 55 2HG2 ILE 55 -9.664 -0.340 2.672 423 2HG2 ILE 55 3HG2 ILE 55 -9.170 -1.986 3.144 424 3HG2 ILE 55 1HG2 ILE 55 -9.196 -0.680 4.359 425 1HD1 ILE 55 2HD1 ILE 55 -6.524 0.100 5.488 426 2HD1 ILE 55 3HD1 ILE 55 -7.747 -1.183 5.684 427 3HD1 ILE 55 1HD1 ILE 55 -6.024 -1.539 5.977 428 H GLN 56 H GLN 56 -6.305 1.343 0.911 429 HA GLN 56 HA GLN 56 -3.395 0.414 0.538 430 1HB GLN 56 1HB GLN 56 -4.959 1.969 -1.574 431 2HB GLN 56 2HB GLN 56 -3.424 1.125 -1.770 432 1HG GLN 56 1HG GLN 56 -4.659 -1.081 -1.406 433 2HG GLN 56 2HG GLN 56 -6.177 -0.191 -1.257 434 1HE2 GLN 56 2HE2 GLN 56 -5.910 0.944 -4.818 435 2HE2 GLN 56 1HE2 GLN 56 -5.988 1.726 -3.160 436 H GLY 57 H GLY 57 -1.892 2.057 0.104 437 1HA GLY 57 1HA GLY 57 -2.714 4.956 0.311 438 2HA GLY 57 2HA GLY 57 -1.824 4.360 1.714 439 H GLY 58 H GLY 58 -1.180 6.394 -0.001 440 1HA GLY 58 1HA GLY 58 1.441 6.697 -0.194 441 2HA GLY 58 2HA GLY 58 1.379 5.458 -1.453 442 H GLY 59 H GLY 59 -0.699 5.955 -2.902 443 1HA GLY 59 1HA GLY 59 0.209 7.834 -4.805 444 2HA GLY 59 2HA GLY 59 -1.469 7.292 -4.741 445 H PHE 60 H PHE 60 -2.758 8.810 -4.849 446 HA PHE 60 HA PHE 60 -2.354 11.534 -4.940 447 1HB PHE 60 1HB PHE 60 -4.859 10.312 -3.636 448 2HB PHE 60 2HB PHE 60 -4.750 11.891 -4.419 449 HD1 PHE 60 HD2 PHE 60 -4.476 12.032 -6.859 450 HD2 PHE 60 HD1 PHE 60 -4.788 8.276 -4.964 451 HE1 PHE 60 HE2 PHE 60 -4.879 10.977 -9.011 452 HE2 PHE 60 HE1 PHE 60 -5.191 7.225 -7.116 453 HZ PHE 60 HZ PHE 60 -5.236 8.574 -9.142 454 H THR 61 H THR 61 -2.452 13.279 -3.750 455 HA THR 61 HA THR 61 -1.149 13.266 -1.147 456 HB THR 61 HB THR 61 -2.885 15.446 -2.449 457 HG1 THR 61 HG1 THR 61 -0.096 14.921 -2.465 458 1HG2 THR 61 3HG2 THR 61 -0.709 15.604 -0.257 459 2HG2 THR 61 1HG2 THR 61 -1.537 17.000 -1.000 460 3HG2 THR 61 2HG2 THR 61 -2.457 15.847 0.002 461 H GLU 62 H GLU 62 -4.021 15.109 -1.405 462 HA GLU 62 HA GLU 62 -5.489 13.509 0.777 463 1HB GLU 62 1HB GLU 62 -5.893 15.591 2.011 464 2HB GLU 62 2HB GLU 62 -4.148 15.315 1.868 465 1HG GLU 62 1HG GLU 62 -4.071 16.868 -0.137 466 2HG GLU 62 2HG GLU 62 -5.808 17.127 -0.012 467 H GLN 63 H GLN 63 -7.294 13.030 0.015 468 HA GLN 63 HA GLN 63 -9.490 13.277 -0.943 469 1HB GLN 63 1HB GLN 63 -9.555 15.638 -0.113 470 2HB GLN 63 2HB GLN 63 -8.608 16.176 -1.510 471 1HG GLN 63 1HG GLN 63 -10.407 15.309 -3.061 472 2HG GLN 63 2HG GLN 63 -11.345 14.759 -1.669 473 1HE2 GLN 63 2HE2 GLN 63 -12.956 17.944 -2.260 474 2HE2 GLN 63 1HE2 GLN 63 -12.957 16.160 -2.690 475 H MET 64 H MET 64 -7.008 15.112 -2.673 476 HA MET 64 HA MET 64 -6.166 13.481 -4.619 477 1HB MET 64 1HB MET 64 -8.860 14.431 -5.699 478 2HB MET 64 2HB MET 64 -7.650 13.519 -6.611 479 1HG MET 64 1HG MET 64 -7.771 11.652 -4.892 480 2HG MET 64 2HG MET 64 -9.082 12.521 -4.062 481 1HE MET 64 2HE MET 64 -10.398 10.083 -4.458 482 2HE MET 64 1HE MET 64 -10.747 9.436 -6.088 483 3HE MET 64 3HE MET 64 -9.066 9.460 -5.481 484 H GLN 65 H GLN 65 -4.717 14.649 -4.674 485 HA GLN 65 HA GLN 65 -4.666 17.001 -6.592 486 1HB GLN 65 1HB GLN 65 -3.366 17.179 -3.795 487 2HB GLN 65 2HB GLN 65 -3.163 18.352 -5.104 488 1HG GLN 65 1HG GLN 65 -5.837 17.608 -3.754 489 2HG GLN 65 2HG GLN 65 -4.926 19.098 -3.476 490 1HE2 GLN 65 2HE2 GLN 65 -5.680 20.444 -6.793 491 2HE2 GLN 65 1HE2 GLN 65 -4.324 20.281 -5.568 492 H GLN 66 H GLN 66 -4.029 15.361 -7.804 493 HA GLN 66 HA GLN 66 -2.587 13.175 -7.528 494 1HB GLN 66 1HB GLN 66 -1.423 13.464 -9.775 495 2HB GLN 66 2HB GLN 66 -3.156 13.740 -9.750 496 1HG GLN 66 1HG GLN 66 -2.100 15.519 -11.075 497 2HG GLN 66 2HG GLN 66 -2.777 16.236 -9.610 498 1HE2 GLN 66 2HE2 GLN 66 0.892 17.275 -10.285 499 2HE2 GLN 66 1HE2 GLN 66 -0.526 17.009 -11.420 500 H LYS 67 H LYS 67 -0.570 12.556 -8.376 501 HA LYS 67 HA LYS 67 1.254 12.805 -6.132 502 1HB LYS 67 1HB LYS 67 1.805 11.641 -8.918 503 2HB LYS 67 2HB LYS 67 2.681 11.238 -7.431 504 1HG LYS 67 1HG LYS 67 0.605 10.307 -6.401 505 2HG LYS 67 2HG LYS 67 -0.359 10.914 -7.736 506 1HD LYS 67 1HD LYS 67 -0.181 8.579 -8.068 507 2HD LYS 67 2HD LYS 67 0.772 9.306 -9.337 508 1HE LYS 67 1HE LYS 67 1.992 8.146 -6.724 509 2HE LYS 67 2HE LYS 67 1.696 7.178 -8.164 510 1HZ LYS 67 3HZ LYS 67 3.204 8.613 -9.415 511 2HZ LYS 67 1HZ LYS 67 3.504 9.536 -8.078 512 3HZ LYS 67 2HZ LYS 67 3.968 7.950 -8.109 513 H LYS 68 H LYS 68 3.583 12.335 -7.656 514 HA LYS 68 HA LYS 68 4.617 14.620 -9.133 515 1HB LYS 68 1HB LYS 68 4.135 15.847 -6.978 516 2HB LYS 68 2HB LYS 68 5.097 14.667 -6.083 517 1HG LYS 68 1HG LYS 68 6.450 16.696 -6.548 518 2HG LYS 68 2HG LYS 68 7.145 15.281 -7.342 519 1HD LYS 68 1HD LYS 68 6.048 15.970 -9.537 520 2HD LYS 68 2HD LYS 68 5.323 17.352 -8.729 521 1HE LYS 68 1HE LYS 68 7.224 18.201 -9.921 522 2HE LYS 68 2HE LYS 68 7.644 18.278 -8.213 523 1HZ LYS 68 2HZ LYS 68 8.533 16.159 -10.121 524 2HZ LYS 68 3HZ LYS 68 9.462 17.397 -9.541 525 3HZ LYS 68 1HZ LYS 68 8.936 16.210 -8.520 526 HA PRO 69 HA PRO 69 6.580 10.508 -8.469 527 1HB PRO 69 1HB PRO 69 6.437 9.640 -11.087 528 2HB PRO 69 2HB PRO 69 5.019 9.731 -10.016 529 1HG PRO 69 1HG PRO 69 5.922 11.819 -12.075 530 2HG PRO 69 2HG PRO 69 4.305 11.083 -11.917 531 1HD PRO 69 1HD PRO 69 4.854 13.534 -10.777 532 2HD PRO 69 2HD PRO 69 3.826 12.357 -9.896 533 H ASN 70 H ASN 70 8.043 9.305 -10.222 534 HA ASN 70 HA ASN 70 10.394 10.898 -11.197 535 1HB ASN 70 1HB ASN 70 10.604 9.184 -8.633 536 2HB ASN 70 2HB ASN 70 11.972 9.889 -9.497 537 1HD2 ASN 70 1HD2 ASN 70 11.591 13.044 -7.921 538 2HD2 ASN 70 2HD2 ASN 70 12.593 11.871 -8.915 539 HA PRO 71 HA PRO 71 11.499 7.328 -13.592 540 1HB PRO 71 1HB PRO 71 14.155 6.855 -12.829 541 2HB PRO 71 2HB PRO 71 13.637 8.183 -13.894 542 1HG PRO 71 1HG PRO 71 14.145 8.308 -10.877 543 2HG PRO 71 2HG PRO 71 14.759 9.415 -12.130 544 1HD PRO 71 1HD PRO 71 12.537 10.081 -10.653 545 2HD PRO 71 2HD PRO 71 12.563 10.453 -12.408 546 HA PRO 72 HA PRO 72 9.845 4.715 -10.273 547 1HB PRO 72 1HB PRO 72 9.255 3.302 -12.927 548 2HB PRO 72 2HB PRO 72 8.175 3.488 -11.524 549 1HG PRO 72 1HG PRO 72 7.822 5.147 -13.634 550 2HG PRO 72 2HG PRO 72 7.841 5.863 -12.002 551 1HD PRO 72 1HD PRO 72 10.115 5.840 -14.060 552 2HD PRO 72 2HD PRO 72 9.590 7.174 -12.983 553 H ILE 73 H ILE 73 9.685 1.982 -11.253 554 HA ILE 73 HA ILE 73 12.447 0.972 -11.749 555 HB ILE 73 HB ILE 73 12.784 -0.228 -9.689 556 1HG1 ILE 73 1HG1 ILE 73 10.360 -0.675 -9.182 557 2HG1 ILE 73 2HG1 ILE 73 11.305 -0.170 -7.778 558 1HG2 ILE 73 2HG2 ILE 73 13.599 2.141 -9.763 559 2HG2 ILE 73 3HG2 ILE 73 12.055 2.706 -9.073 560 3HG2 ILE 73 1HG2 ILE 73 13.142 1.678 -8.102 561 1HD1 ILE 73 2HD1 ILE 73 10.433 2.195 -8.015 562 2HD1 ILE 73 3HD1 ILE 73 9.460 1.689 -9.423 563 3HD1 ILE 73 1HD1 ILE 73 9.107 1.022 -7.808 564 H LYS 74 H LYS 74 12.620 -1.123 -12.080 565 HA LYS 74 HA LYS 74 10.800 -2.420 -13.717 566 1HB LYS 74 1HB LYS 74 12.505 -3.816 -11.584 567 2HB LYS 74 2HB LYS 74 11.853 -4.591 -13.034 568 1HG LYS 74 1HG LYS 74 13.083 -2.910 -14.479 569 2HG LYS 74 2HG LYS 74 13.741 -2.149 -13.031 570 1HD LYS 74 1HD LYS 74 14.928 -4.336 -12.436 571 2HD LYS 74 2HD LYS 74 14.243 -5.078 -13.873 572 1HE LYS 74 1HE LYS 74 16.502 -4.507 -14.439 573 2HE LYS 74 2HE LYS 74 15.481 -3.388 -15.338 574 1HZ LYS 74 1HZ LYS 74 16.908 -2.764 -12.788 575 2HZ LYS 74 2HZ LYS 74 17.351 -2.259 -14.297 576 3HZ LYS 74 3HZ LYS 74 15.954 -1.699 -13.617 577 H ASN 75 H ASN 75 9.296 -3.898 -13.665 578 HA ASN 75 HA ASN 75 7.199 -3.718 -11.620 579 1HB ASN 75 1HB ASN 75 6.087 -5.498 -12.940 580 2HB ASN 75 2HB ASN 75 6.751 -4.254 -14.008 581 1HD2 ASN 75 1HD2 ASN 75 7.932 -7.280 -15.657 582 2HD2 ASN 75 2HD2 ASN 75 6.494 -6.151 -15.499 583 H GLU 76 H GLU 76 6.231 -6.123 -11.233 584 HA GLU 76 HA GLU 76 7.681 -8.354 -10.418 585 1HB GLU 76 1HB GLU 76 8.515 -8.053 -8.186 586 2HB GLU 76 2HB GLU 76 9.195 -6.751 -9.162 587 1HG GLU 76 1HG GLU 76 6.728 -6.549 -7.304 588 2HG GLU 76 2HG GLU 76 8.340 -5.962 -6.911 589 H ALA 77 H ALA 77 6.536 -9.797 -9.494 590 HA ALA 77 HA ALA 77 4.120 -9.205 -7.757 591 1HB ALA 77 3HB ALA 77 3.854 -10.556 -10.538 592 2HB ALA 77 1HB ALA 77 2.553 -10.385 -9.335 593 3HB ALA 77 2HB ALA 77 3.233 -8.937 -10.118 594 H ASP 78 H ASP 78 5.714 -11.617 -9.801 595 HA ASP 78 HA ASP 78 4.841 -13.930 -8.225 596 1HB ASP 78 1HB ASP 78 6.507 -15.201 -9.555 597 2HB ASP 78 2HB ASP 78 5.522 -14.150 -10.577 598 H ASN 79 H ASN 79 7.937 -12.210 -8.440 599 HA ASN 79 HA ASN 79 9.520 -13.600 -6.517 600 1HB ASN 79 1HB ASN 79 10.628 -11.420 -6.033 601 2HB ASN 79 2HB ASN 79 10.381 -11.656 -7.769 602 1HD2 ASN 79 1HD2 ASN 79 9.228 -8.210 -7.190 603 2HD2 ASN 79 2HD2 ASN 79 10.768 -9.202 -7.292 604 H GLY 80 H GLY 80 7.004 -11.195 -6.000 605 1HA GLY 80 1HA GLY 80 6.962 -10.815 -3.185 606 2HA GLY 80 2HA GLY 80 5.488 -10.949 -4.154 607 H LEU 81 H LEU 81 6.025 -13.641 -5.039 608 HA LEU 81 HA LEU 81 6.068 -15.935 -4.195 609 1HB LEU 81 1HB LEU 81 5.582 -14.760 -1.407 610 2HB LEU 81 2HB LEU 81 5.902 -16.454 -1.798 611 HG LEU 81 HG LEU 81 7.796 -14.093 -2.360 612 1HD1 LEU 81 2HD1 LEU 81 7.640 -14.697 0.078 613 2HD1 LEU 81 3HD1 LEU 81 8.001 -16.399 -0.312 614 3HD1 LEU 81 1HD1 LEU 81 9.233 -15.140 -0.587 615 1HD2 LEU 81 3HD2 LEU 81 7.986 -15.912 -4.085 616 2HD2 LEU 81 1HD2 LEU 81 9.439 -15.856 -3.054 617 3HD2 LEU 81 2HD2 LEU 81 8.212 -17.124 -2.796 618 NH1 ARG 82 NH2 ARG 82 2.086 -21.103 0.164 619 NH2 ARG 82 NH1 ARG 82 2.978 -19.356 1.315 620 H ARG 82 H ARG 82 4.069 -16.104 -1.810 621 HA ARG 82 HA ARG 82 1.446 -15.273 -2.931 622 1HB ARG 82 1HB ARG 82 0.649 -17.660 -3.410 623 2HB ARG 82 2HB ARG 82 1.764 -16.935 -4.557 624 1HG ARG 82 1HG ARG 82 2.661 -19.046 -4.373 625 2HG ARG 82 2HG ARG 82 3.712 -18.135 -3.312 626 1HD ARG 82 1HD ARG 82 1.302 -19.842 -2.345 627 2HD ARG 82 2HD ARG 82 2.929 -20.485 -2.558 628 HE ARG 82 HE ARG 82 3.161 -18.198 -0.780 629 1HH1 ARG 82 2HH2 ARG 82 1.797 -21.485 -0.743 630 2HH1 ARG 82 1HH2 ARG 82 2.021 -21.570 1.076 631 1HH2 ARG 82 1HH1 ARG 82 3.368 -18.408 1.288 632 2HH2 ARG 82 2HH1 ARG 82 2.851 -19.944 2.146 633 H ASN 83 H ASN 83 0.581 -14.678 -1.254 634 HA ASN 83 HA ASN 83 0.425 -16.501 1.221 635 1HB ASN 83 1HB ASN 83 1.047 -13.490 1.197 636 2HB ASN 83 2HB ASN 83 0.791 -14.490 2.635 637 1HD2 ASN 83 1HD2 ASN 83 4.297 -15.096 2.646 638 2HD2 ASN 83 2HD2 ASN 83 2.804 -14.449 3.495 639 H THR 84 H THR 84 -0.847 -13.986 2.378 640 HA THR 84 HA THR 84 -3.623 -13.982 1.174 641 HB THR 84 HB THR 84 -2.669 -15.637 3.577 642 HG1 THR 84 HG1 THR 84 -4.228 -16.186 1.271 643 1HG2 THR 84 3HG2 THR 84 -5.566 -14.899 2.833 644 2HG2 THR 84 1HG2 THR 84 -5.088 -16.118 4.058 645 3HG2 THR 84 2HG2 THR 84 -4.693 -14.396 4.303 646 NH1 ARG 85 NH2 ARG 85 -10.140 -12.932 8.250 647 NH2 ARG 85 NH1 ARG 85 -9.549 -11.284 9.700 648 H ARG 85 H ARG 85 -5.136 -12.979 2.418 649 HA ARG 85 HA ARG 85 -5.035 -10.508 3.642 650 1HB ARG 85 1HB ARG 85 -7.093 -11.858 3.721 651 2HB ARG 85 2HB ARG 85 -6.283 -13.129 4.646 652 1HG ARG 85 1HG ARG 85 -5.942 -11.478 6.559 653 2HG ARG 85 2HG ARG 85 -6.904 -10.288 5.675 654 1HD ARG 85 1HD ARG 85 -8.898 -11.853 5.705 655 2HD ARG 85 2HD ARG 85 -7.922 -13.095 6.508 656 HE ARG 85 HE ARG 85 -7.889 -10.607 8.100 657 1HH1 ARG 85 2HH2 ARG 85 -9.976 -13.388 7.345 658 2HH1 ARG 85 1HH2 ARG 85 -10.836 -13.198 8.955 659 1HH2 ARG 85 1HH1 ARG 85 -8.937 -10.486 9.905 660 2HH2 ARG 85 2HH1 ARG 85 -10.286 -11.666 10.304 661 H GLY 86 H GLY 86 -3.471 -9.782 4.403 662 1HA GLY 86 1HA GLY 86 -2.497 -9.487 6.988 663 2HA GLY 86 2HA GLY 86 -1.793 -11.062 6.589 664 H THR 87 H THR 87 -1.817 -10.096 3.684 665 HA THR 87 HA THR 87 1.031 -8.946 3.800 666 HB THR 87 HB THR 87 1.123 -9.657 1.410 667 HG1 THR 87 HG1 THR 87 -1.122 -9.548 1.053 668 1HG2 THR 87 2HG2 THR 87 1.899 -11.166 3.256 669 2HG2 THR 87 3HG2 THR 87 0.253 -11.834 3.420 670 3HG2 THR 87 1HG2 THR 87 1.188 -12.112 1.922 671 H ILE 88 H ILE 88 1.708 -7.351 2.798 672 HA ILE 88 HA ILE 88 -0.175 -5.466 1.254 673 HB ILE 88 HB ILE 88 0.676 -3.946 2.630 674 1HG1 ILE 88 1HG1 ILE 88 3.132 -3.170 1.809 675 2HG1 ILE 88 2HG1 ILE 88 2.844 -4.364 0.582 676 1HG2 ILE 88 2HG2 ILE 88 1.871 -5.484 4.172 677 2HG2 ILE 88 3HG2 ILE 88 3.265 -5.546 3.053 678 3HG2 ILE 88 1HG2 ILE 88 2.844 -4.021 3.875 679 1HD1 ILE 88 2HD1 ILE 88 0.605 -3.131 0.029 680 2HD1 ILE 88 3HD1 ILE 88 0.977 -1.975 1.332 681 3HD1 ILE 88 1HD1 ILE 88 2.009 -2.027 -0.115 682 H ALA 89 H ALA 89 0.738 -4.487 -0.535 683 HA ALA 89 HA ALA 89 2.924 -5.833 -2.067 684 1HB ALA 89 2HB ALA 89 1.121 -7.567 -2.351 685 2HB ALA 89 3HB ALA 89 0.037 -6.335 -3.054 686 3HB ALA 89 1HB ALA 89 1.537 -6.796 -3.898 687 H MET 90 H MET 90 3.352 -5.090 -4.028 688 HA MET 90 HA MET 90 3.062 -2.152 -4.239 689 1HB MET 90 1HB MET 90 5.102 -3.690 -4.869 690 2HB MET 90 2HB MET 90 4.280 -3.893 -6.423 691 1HG MET 90 1HG MET 90 5.086 -1.243 -5.060 692 2HG MET 90 2HG MET 90 5.837 -1.939 -6.512 693 1HE MET 90 3HE MET 90 5.258 0.788 -7.252 694 2HE MET 90 2HE MET 90 3.575 1.349 -7.491 695 3HE MET 90 1HE MET 90 4.188 1.050 -5.839 696 H ALA 91 H ALA 91 1.617 -1.065 -5.178 697 HA ALA 91 HA ALA 91 -0.640 -2.121 -6.727 698 1HB ALA 91 2HB ALA 91 -0.702 0.065 -5.497 699 2HB ALA 91 3HB ALA 91 0.503 0.748 -6.622 700 3HB ALA 91 1HB ALA 91 -1.114 0.290 -7.215 701 NH1 ARG 92 NH2 ARG 92 -1.366 -2.348 -15.600 702 NH2 ARG 92 NH1 ARG 92 -3.022 -3.590 -14.663 703 H ARG 92 H ARG 92 -0.575 -0.106 -8.802 704 HA ARG 92 HA ARG 92 1.644 -0.398 -10.661 705 1HB ARG 92 1HB ARG 92 0.998 -2.820 -10.688 706 2HB ARG 92 2HB ARG 92 -0.677 -2.379 -11.065 707 1HG ARG 92 1HG ARG 92 0.175 -1.167 -13.169 708 2HG ARG 92 2HG ARG 92 1.792 -1.733 -12.794 709 1HD ARG 92 1HD ARG 92 0.969 -3.233 -14.485 710 2HD ARG 92 2HD ARG 92 0.983 -4.149 -12.996 711 HE ARG 92 HE ARG 92 -1.431 -4.290 -13.011 712 1HH1 ARG 92 2HH2 ARG 92 -0.385 -2.047 -15.568 713 2HH1 ARG 92 1HH2 ARG 92 -2.072 -2.067 -16.289 714 1HH2 ARG 92 1HH1 ARG 92 -3.307 -4.235 -13.918 715 2HH2 ARG 92 2HH1 ARG 92 -3.611 -3.222 -15.418 716 H THR 93 H THR 93 -1.230 -1.265 -12.118 717 HA THR 93 HA THR 93 -3.111 0.120 -12.923 718 HB THR 93 HB THR 93 -1.177 2.452 -12.400 719 HG1 THR 93 HG1 THR 93 -2.723 2.881 -10.784 720 1HG2 THR 93 2HG2 THR 93 -4.142 2.415 -13.283 721 2HG2 THR 93 3HG2 THR 93 -3.198 3.876 -12.883 722 3HG2 THR 93 1HG2 THR 93 -2.766 2.896 -14.309 723 H ALA 94 H ALA 94 -0.788 2.365 -13.998 724 HA ALA 94 HA ALA 94 -1.340 1.877 -16.802 725 1HB ALA 94 2HB ALA 94 -0.572 4.074 -15.895 726 2HB ALA 94 3HB ALA 94 1.039 3.389 -15.548 727 3HB ALA 94 1HB ALA 94 0.473 3.537 -17.232 728 H ASP 95 H ASP 95 1.736 2.212 -17.248 729 HA ASP 95 HA ASP 95 2.099 -0.293 -18.605 730 1HB ASP 95 1HB ASP 95 4.253 1.612 -17.518 731 2HB ASP 95 2HB ASP 95 4.519 0.362 -18.745 732 H LYS 96 H LYS 96 3.967 -1.657 -18.364 733 HA LYS 96 HA LYS 96 3.785 -3.411 -16.055 734 1HB LYS 96 1HB LYS 96 6.221 -3.011 -17.887 735 2HB LYS 96 2HB LYS 96 5.834 -4.465 -16.967 736 1HG LYS 96 1HG LYS 96 4.199 -3.208 -19.253 737 2HG LYS 96 2HG LYS 96 5.159 -4.669 -19.400 738 1HD LYS 96 1HD LYS 96 2.704 -4.415 -17.512 739 2HD LYS 96 2HD LYS 96 2.600 -4.898 -19.187 740 1HE LYS 96 1HE LYS 96 2.535 -6.944 -18.026 741 2HE LYS 96 2HE LYS 96 4.150 -6.891 -18.722 742 1HZ LYS 96 2HZ LYS 96 3.457 -6.247 -15.889 743 2HZ LYS 96 3HZ LYS 96 4.183 -7.632 -16.422 744 3HZ LYS 96 1HZ LYS 96 4.984 -6.190 -16.519 745 H ASP 97 H ASP 97 6.983 -2.866 -16.563 746 HA ASP 97 HA ASP 97 7.760 -2.050 -13.878 747 1HB ASP 97 1HB ASP 97 9.173 -1.477 -16.556 748 2HB ASP 97 2HB ASP 97 9.921 -1.362 -14.954 749 H SER 98 H SER 98 6.766 -0.396 -13.029 750 HA SER 98 HA SER 98 7.312 2.387 -13.985 751 1HB SER 98 1HB SER 98 4.443 1.265 -14.116 752 2HB SER 98 2HB SER 98 4.880 2.975 -14.294 753 HG SER 98 HG SER 98 6.206 2.367 -16.056 754 H ALA 99 H ALA 99 5.544 0.221 -11.854 755 HA ALA 99 HA ALA 99 4.361 1.798 -9.924 756 1HB ALA 99 2HB ALA 99 4.628 -0.683 -9.650 757 2HB ALA 99 3HB ALA 99 6.348 -0.469 -9.227 758 3HB ALA 99 1HB ALA 99 5.076 0.170 -8.156 759 H THR 100 H THR 100 4.967 3.749 -9.664 760 HA THR 100 HA THR 100 7.775 4.611 -9.171 761 HB THR 100 HB THR 100 6.744 6.870 -8.882 762 HG1 THR 100 HG1 THR 100 4.512 6.999 -9.283 763 1HG2 THR 100 2HG2 THR 100 7.316 5.974 -11.167 764 2HG2 THR 100 3HG2 THR 100 5.695 5.242 -11.291 765 3HG2 THR 100 1HG2 THR 100 5.870 7.016 -11.234 766 H SER 101 H SER 101 4.798 4.934 -7.261 767 HA SER 101 HA SER 101 6.015 4.029 -4.721 768 1HB SER 101 1HB SER 101 6.087 6.249 -3.575 769 2HB SER 101 2HB SER 101 7.224 6.208 -4.935 770 HG SER 101 HG SER 101 5.937 8.087 -4.893 771 H GLN 102 H GLN 102 4.291 2.890 -4.460 772 HA GLN 102 HA GLN 102 2.007 3.883 -3.056 773 1HB GLN 102 1HB GLN 102 1.556 5.098 -5.236 774 2HB GLN 102 2HB GLN 102 1.359 3.547 -6.056 775 1HG GLN 102 1HG GLN 102 -0.289 4.439 -3.599 776 2HG GLN 102 2HG GLN 102 -0.808 4.690 -5.265 777 1HE2 GLN 102 2HE2 GLN 102 -2.109 1.416 -5.584 778 2HE2 GLN 102 1HE2 GLN 102 -1.932 3.127 -6.223 779 H PHE 103 H PHE 103 0.873 2.294 -2.250 780 HA PHE 103 HA PHE 103 1.064 -0.515 -3.387 781 1HB PHE 103 1HB PHE 103 1.948 -1.454 -1.342 782 2HB PHE 103 2HB PHE 103 3.069 -0.218 -1.903 783 HD1 PHE 103 HD2 PHE 103 0.457 1.684 -0.729 784 HD2 PHE 103 HD1 PHE 103 3.451 -0.903 0.730 785 HE1 PHE 103 HE2 PHE 103 0.220 2.656 1.482 786 HE2 PHE 103 HE1 PHE 103 3.214 0.075 2.941 787 HZ PHE 103 HZ PHE 103 1.565 1.822 3.324 788 H PHE 104 H PHE 104 0.091 -1.907 -1.386 789 HA PHE 104 HA PHE 104 -2.540 -0.723 -0.504 790 1HB PHE 104 1HB PHE 104 -3.952 -2.045 -1.931 791 2HB PHE 104 2HB PHE 104 -2.841 -1.169 -2.974 792 HD1 PHE 104 HD1 PHE 104 -3.727 -4.413 -1.583 793 HD2 PHE 104 HD2 PHE 104 -1.092 -2.394 -4.172 794 HE1 PHE 104 HE1 PHE 104 -3.152 -6.534 -2.643 795 HE2 PHE 104 HE2 PHE 104 -0.512 -4.514 -5.235 796 HZ PHE 104 HZ PHE 104 -1.569 -6.582 -4.486 797 H ILE 105 H ILE 105 -3.257 -1.513 1.075 798 HA ILE 105 HA ILE 105 -2.057 -4.048 2.320 799 HB ILE 105 HB ILE 105 -3.852 -1.865 3.518 800 1HG1 ILE 105 1HG1 ILE 105 -0.833 -2.434 3.740 801 2HG1 ILE 105 2HG1 ILE 105 -1.566 -1.058 2.905 802 1HG2 ILE 105 2HG2 ILE 105 -4.117 -4.111 4.608 803 2HG2 ILE 105 3HG2 ILE 105 -2.349 -4.242 4.797 804 3HG2 ILE 105 1HG2 ILE 105 -3.250 -2.986 5.688 805 1HD1 ILE 105 3HD1 ILE 105 -1.855 -1.660 5.932 806 2HD1 ILE 105 1HD1 ILE 105 -0.815 -0.399 5.219 807 3HD1 ILE 105 2HD1 ILE 105 -2.589 -0.269 5.091 808 H ASN 106 H ASN 106 -3.013 -5.786 1.794 809 HA ASN 106 HA ASN 106 -5.846 -6.054 0.943 810 1HB ASN 106 1HB ASN 106 -3.880 -8.186 1.979 811 2HB ASN 106 2HB ASN 106 -5.426 -8.507 1.175 812 1HD2 ASN 106 1HD2 ASN 106 -2.853 -8.648 -1.500 813 2HD2 ASN 106 2HD2 ASN 106 -3.324 -9.569 0.016 814 H VAL 107 H VAL 107 -7.482 -7.072 2.000 815 HA VAL 107 HA VAL 107 -7.303 -7.597 4.979 816 HB VAL 107 HB VAL 107 -9.193 -6.153 5.542 817 1HG1 VAL 107 3HG2 VAL 107 -6.882 -5.178 5.667 818 2HG1 VAL 107 1HG2 VAL 107 -7.014 -4.620 3.979 819 3HG1 VAL 107 2HG2 VAL 107 -8.074 -3.923 5.234 820 1HG2 VAL 107 2HG1 VAL 107 -10.385 -6.264 3.337 821 2HG2 VAL 107 3HG1 VAL 107 -10.159 -4.569 3.846 822 3HG2 VAL 107 1HG1 VAL 107 -9.110 -5.271 2.584 823 H ALA 108 H ALA 108 -7.572 -9.150 2.640 824 HA ALA 108 HA ALA 108 -9.519 -11.066 3.682 825 1HB ALA 108 2HB ALA 108 -11.205 -9.419 2.789 826 2HB ALA 108 3HB ALA 108 -10.465 -9.522 1.169 827 3HB ALA 108 1HB ALA 108 -11.267 -10.948 1.878 828 H ASP 109 H ASP 109 -8.790 -12.863 3.213 829 HA ASP 109 HA ASP 109 -6.610 -13.635 1.634 830 1HB ASP 109 1HB ASP 109 -9.239 -15.217 1.893 831 2HB ASP 109 2HB ASP 109 -7.677 -15.900 1.410 832 H ASN 110 H ASN 110 -6.092 -13.929 -0.332 833 HA ASN 110 HA ASN 110 -8.118 -13.896 -2.613 834 1HB ASN 110 1HB ASN 110 -5.860 -11.817 -2.332 835 2HB ASN 110 2HB ASN 110 -6.979 -11.965 -3.690 836 1HD2 ASN 110 1HD2 ASN 110 -9.544 -10.126 -2.046 837 2HD2 ASN 110 2HD2 ASN 110 -8.905 -10.949 -3.556 838 H ALA 111 H ALA 111 -7.678 -15.533 -3.616 839 HA ALA 111 HA ALA 111 -4.817 -16.417 -4.279 840 1HB ALA 111 3HB ALA 111 -7.518 -17.802 -4.845 841 2HB ALA 111 1HB ALA 111 -5.903 -18.433 -5.262 842 3HB ALA 111 2HB ALA 111 -6.368 -18.250 -3.551 843 H PHE 112 H PHE 112 -8.007 -15.728 -5.649 844 HA PHE 112 HA PHE 112 -7.319 -15.477 -8.447 845 1HB PHE 112 1HB PHE 112 -9.291 -13.885 -8.565 846 2HB PHE 112 2HB PHE 112 -9.639 -15.439 -7.813 847 HD1 PHE 112 HD1 PHE 112 -8.997 -11.873 -7.090 848 HD2 PHE 112 HD2 PHE 112 -10.204 -15.589 -5.499 849 HE1 PHE 112 HE1 PHE 112 -9.801 -10.758 -5.085 850 HE2 PHE 112 HE2 PHE 112 -11.007 -14.471 -3.498 851 HZ PHE 112 HZ PHE 112 -10.810 -12.056 -3.291 852 H LEU 113 H LEU 113 -5.231 -14.846 -8.041 853 HA LEU 113 HA LEU 113 -4.625 -12.113 -8.930 854 1HB LEU 113 1HB LEU 113 -4.657 -12.576 -5.949 855 2HB LEU 113 2HB LEU 113 -3.147 -11.922 -6.574 856 HG LEU 113 HG LEU 113 -4.468 -10.167 -7.863 857 1HD1 LEU 113 2HD1 LEU 113 -6.714 -11.292 -7.815 858 2HD1 LEU 113 3HD1 LEU 113 -6.770 -11.128 -6.040 859 3HD1 LEU 113 1HD1 LEU 113 -6.799 -9.674 -7.073 860 1HD2 LEU 113 3HD2 LEU 113 -3.265 -9.655 -5.726 861 2HD2 LEU 113 1HD2 LEU 113 -4.773 -8.715 -5.838 862 3HD2 LEU 113 2HD2 LEU 113 -4.693 -10.149 -4.782 863 H ASP 114 H ASP 114 -3.627 -15.099 -7.367 864 HA ASP 114 HA ASP 114 -0.836 -15.139 -7.513 865 1HB ASP 114 1HB ASP 114 -2.661 -17.346 -8.645 866 2HB ASP 114 2HB ASP 114 -0.979 -17.561 -8.147 867 H HIS 115 H HIS 115 0.159 -13.991 -8.922 868 HA HIS 115 HA HIS 115 -0.349 -13.515 -11.676 869 1HB HIS 115 1HB HIS 115 2.491 -13.922 -10.568 870 2HB HIS 115 2HB HIS 115 1.985 -12.857 -11.885 871 HD2 HIS 115 HD2 HIS 115 2.862 -12.783 -8.346 872 HE1 HIS 115 HE1 HIS 115 0.113 -9.668 -8.594 873 HE2 HIS 115 HE2 HIS 115 1.913 -10.676 -7.044 874 H GLY 116 H GLY 116 -0.547 -14.695 -13.311 875 1HA GLY 116 1HA GLY 116 1.213 -17.041 -13.969 876 2HA GLY 116 2HA GLY 116 -0.422 -17.524 -13.491 877 H GLN 117 H GLN 117 0.390 -18.247 -15.801 878 HA GLN 117 HA GLN 117 0.026 -18.174 -18.159 879 1HB GLN 117 1HB GLN 117 -2.407 -16.529 -17.224 880 2HB GLN 117 2HB GLN 117 -2.164 -17.108 -18.874 881 1HG GLN 117 1HG GLN 117 -3.586 -18.732 -17.776 882 2HG GLN 117 2HG GLN 117 -2.014 -19.490 -18.026 883 1HE2 GLN 117 2HE2 GLN 117 -3.278 -18.576 -14.185 884 2HE2 GLN 117 1HE2 GLN 117 -4.006 -17.763 -15.660 885 NH1 ARG 118 NH2 ARG 118 -4.763 -13.735 -24.467 886 NH2 ARG 118 NH1 ARG 118 -5.971 -13.906 -22.549 887 H ARG 118 H ARG 118 -1.307 -15.898 -19.477 888 HA ARG 118 HA ARG 118 0.989 -14.505 -20.462 889 1HB ARG 118 1HB ARG 118 -1.890 -13.446 -20.254 890 2HB ARG 118 2HB ARG 118 -0.629 -12.796 -21.317 891 1HG ARG 118 1HG ARG 118 -0.366 -15.070 -22.384 892 2HG ARG 118 2HG ARG 118 -1.638 -15.722 -21.367 893 1HD ARG 118 1HD ARG 118 -2.030 -13.432 -23.422 894 2HD ARG 118 2HD ARG 118 -2.323 -15.140 -23.757 895 HE ARG 118 HE ARG 118 -3.917 -14.424 -21.418 896 1HH1 ARG 118 2HH2 ARG 118 -3.843 -13.792 -24.918 897 2HH1 ARG 118 1HH2 ARG 118 -5.658 -13.518 -24.921 898 1HH2 ARG 118 1HH1 ARG 118 -5.976 -14.092 -21.540 899 2HH2 ARG 118 2HH1 ARG 118 -6.781 -13.677 -23.136 900 H ASP 119 H ASP 119 -1.013 -12.065 -19.632 901 HA ASP 119 HA ASP 119 1.025 -10.508 -18.302 902 1HB ASP 119 1HB ASP 119 -2.026 -10.148 -18.177 903 2HB ASP 119 2HB ASP 119 -0.829 -8.909 -17.781 904 H PHE 120 H PHE 120 1.772 -10.455 -16.425 905 HA PHE 120 HA PHE 120 0.967 -12.060 -14.129 906 1HB PHE 120 1HB PHE 120 2.553 -9.425 -14.271 907 2HB PHE 120 2HB PHE 120 2.405 -10.419 -12.820 908 HD1 PHE 120 HD2 PHE 120 2.527 -13.130 -13.832 909 HD2 PHE 120 HD1 PHE 120 4.772 -9.751 -14.987 910 HE1 PHE 120 HE2 PHE 120 4.371 -14.574 -14.480 911 HE2 PHE 120 HE1 PHE 120 6.612 -11.197 -15.636 912 HZ PHE 120 HZ PHE 120 6.412 -13.610 -15.389 913 H GLY 121 H GLY 121 1.099 -9.622 -12.325 914 1HA GLY 121 1HA GLY 121 -1.460 -8.142 -12.626 915 2HA GLY 121 2HA GLY 121 -1.651 -9.490 -11.490 916 OH TYR 122 OH TYR 122 -6.278 -5.264 -10.005 917 H TYR 122 H TYR 122 -1.694 -8.705 -9.611 918 HA TYR 122 HA TYR 122 -0.345 -6.170 -8.811 919 1HB TYR 122 1HB TYR 122 -1.871 -8.204 -7.083 920 2HB TYR 122 2HB TYR 122 -1.444 -6.555 -6.626 921 HD1 TYR 122 HD1 TYR 122 -2.378 -4.647 -7.944 922 HD2 TYR 122 HD2 TYR 122 -3.732 -8.603 -8.520 923 HE1 TYR 122 HE1 TYR 122 -4.377 -3.805 -9.043 924 HE2 TYR 122 HE2 TYR 122 -5.730 -7.757 -9.618 925 HH TYR 122 HH TYR 122 -6.242 -4.305 -10.027 926 H ALA 123 H ALA 123 1.374 -5.835 -7.793 927 HA ALA 123 HA ALA 123 3.393 -7.951 -7.276 928 1HB ALA 123 2HB ALA 123 4.030 -5.630 -7.959 929 2HB ALA 123 3HB ALA 123 3.369 -4.982 -6.433 930 3HB ALA 123 1HB ALA 123 4.782 -6.070 -6.408 931 H VAL 124 H VAL 124 4.521 -6.961 -4.956 932 HA VAL 124 HA VAL 124 2.931 -7.115 -2.545 933 HB VAL 124 HB VAL 124 3.898 -9.851 -3.581 934 1HG1 VAL 124 3HG2 VAL 124 4.514 -9.542 -1.170 935 2HG1 VAL 124 1HG2 VAL 124 2.833 -9.089 -0.785 936 3HG1 VAL 124 2HG2 VAL 124 3.209 -10.742 -1.342 937 1HG2 VAL 124 1HG1 VAL 124 1.103 -8.873 -2.698 938 2HG2 VAL 124 2HG1 VAL 124 1.606 -9.202 -4.376 939 3HG2 VAL 124 3HG1 VAL 124 1.508 -10.537 -3.199 940 H PHE 125 H PHE 125 4.196 -6.872 -0.782 941 HA PHE 125 HA PHE 125 6.902 -8.044 -0.613 942 1HB PHE 125 1HB PHE 125 8.291 -6.093 -0.765 943 2HB PHE 125 2HB PHE 125 7.281 -6.078 -2.211 944 HD1 PHE 125 HD2 PHE 125 5.330 -4.527 -2.292 945 HD2 PHE 125 HD1 PHE 125 8.028 -4.432 0.950 946 HE1 PHE 125 HE2 PHE 125 4.393 -2.402 -1.571 947 HE2 PHE 125 HE1 PHE 125 7.092 -2.309 1.663 948 HZ PHE 125 HZ PHE 125 5.250 -1.312 0.428 949 H GLY 126 H GLY 126 4.300 -7.547 0.967 950 1HA GLY 126 1HA GLY 126 5.780 -7.539 3.583 951 2HA GLY 126 2HA GLY 126 4.761 -6.116 3.340 952 H LYS 127 H LYS 127 3.243 -6.311 4.529 953 HA LYS 127 HA LYS 127 1.149 -8.190 4.717 954 1HB LYS 127 1HB LYS 127 2.895 -9.909 5.237 955 2HB LYS 127 2HB LYS 127 3.446 -8.952 6.621 956 1HG LYS 127 1HG LYS 127 1.107 -9.093 7.608 957 2HG LYS 127 2HG LYS 127 0.607 -10.135 6.287 958 1HD LYS 127 1HD LYS 127 2.846 -10.792 8.322 959 2HD LYS 127 2HD LYS 127 1.175 -11.323 8.462 960 1HE LYS 127 1HE LYS 127 1.380 -12.637 6.299 961 2HE LYS 127 2HE LYS 127 3.068 -12.128 6.148 962 1HZ LYS 127 1HZ LYS 127 1.963 -13.713 8.416 963 2HZ LYS 127 2HZ LYS 127 2.890 -14.301 7.182 964 3HZ LYS 127 3HZ LYS 127 3.538 -13.238 8.267 965 H VAL 128 H VAL 128 1.416 -8.529 7.689 966 HA VAL 128 HA VAL 128 1.335 -5.746 8.831 967 HB VAL 128 HB VAL 128 -1.243 -7.404 8.564 968 1HG1 VAL 128 3HG2 VAL 128 -1.038 -6.210 10.765 969 2HG1 VAL 128 1HG2 VAL 128 -0.682 -4.682 9.917 970 3HG1 VAL 128 2HG2 VAL 128 -2.287 -5.443 9.749 971 1HG2 VAL 128 2HG1 VAL 128 -0.594 -6.219 6.444 972 2HG2 VAL 128 3HG1 VAL 128 -2.024 -5.451 7.181 973 3HG2 VAL 128 1HG1 VAL 128 -0.419 -4.687 7.340 974 H VAL 129 H VAL 129 2.219 -5.887 10.589 975 HA VAL 129 HA VAL 129 2.505 -8.415 12.166 976 HB VAL 129 HB VAL 129 3.725 -6.992 13.778 977 1HG1 VAL 129 3HG2 VAL 129 4.886 -7.916 11.755 978 2HG1 VAL 129 1HG2 VAL 129 4.445 -6.463 10.821 979 3HG1 VAL 129 2HG2 VAL 129 5.568 -6.330 12.201 980 1HG2 VAL 129 2HG1 VAL 129 2.322 -4.916 13.573 981 2HG2 VAL 129 3HG1 VAL 129 4.042 -4.546 13.282 982 3HG2 VAL 129 1HG1 VAL 129 2.911 -4.669 11.908 983 H LYS 130 H LYS 130 0.743 -5.371 12.437 984 HA LYS 130 HA LYS 130 -1.417 -6.593 14.099 985 1HB LYS 130 1HB LYS 130 0.488 -4.543 15.378 986 2HB LYS 130 2HB LYS 130 -1.000 -5.168 16.110 987 1HG LYS 130 1HG LYS 130 -0.082 -7.507 16.058 988 2HG LYS 130 2HG LYS 130 1.327 -6.946 15.177 989 1HD LYS 130 1HD LYS 130 2.065 -7.294 17.389 990 2HD LYS 130 2HD LYS 130 2.057 -5.560 17.189 991 1HE LYS 130 1HE LYS 130 -0.220 -7.142 18.598 992 2HE LYS 130 2HE LYS 130 1.209 -6.551 19.439 993 1HZ LYS 130 3HZ LYS 130 0.606 -4.280 18.826 994 2HZ LYS 130 1HZ LYS 130 -0.745 -4.806 18.035 995 3HZ LYS 130 2HZ LYS 130 -0.613 -5.008 19.669 996 H GLY 131 H GLY 131 -2.118 -4.279 15.440 997 1HA GLY 131 1HA GLY 131 -3.656 -2.476 15.096 998 2HA GLY 131 2HA GLY 131 -2.457 -1.853 13.962 999 H MET 132 H MET 132 -3.755 -4.966 13.265 1000 HA MET 132 HA MET 132 -4.859 -4.260 10.682 1001 1HB MET 132 1HB MET 132 -4.308 -6.618 11.544 1002 2HB MET 132 2HB MET 132 -5.826 -6.584 12.453 1003 1HG MET 132 1HG MET 132 -6.166 -7.687 10.254 1004 2HG MET 132 2HG MET 132 -7.083 -6.162 10.278 1005 1HE MET 132 3HE MET 132 -7.050 -6.580 7.472 1006 2HE MET 132 2HE MET 132 -5.525 -6.594 6.538 1007 3HE MET 132 1HE MET 132 -5.911 -7.956 7.628 1008 H ASP 133 H ASP 133 -6.385 -4.739 13.828 1009 HA ASP 133 HA ASP 133 -9.127 -4.208 13.316 1010 1HB ASP 133 1HB ASP 133 -7.444 -3.045 15.617 1011 2HB ASP 133 2HB ASP 133 -9.207 -3.160 15.598 1012 H VAL 134 H VAL 134 -6.629 -1.817 14.081 1013 HA VAL 134 HA VAL 134 -7.968 0.648 13.697 1014 HB VAL 134 HB VAL 134 -5.182 -0.202 12.726 1015 1HG1 VAL 134 3HG2 VAL 134 -5.949 1.783 11.404 1016 2HG1 VAL 134 1HG2 VAL 134 -6.375 2.639 12.910 1017 3HG1 VAL 134 2HG2 VAL 134 -4.671 2.246 12.557 1018 1HG2 VAL 134 2HG1 VAL 134 -5.605 -0.280 15.211 1019 2HG2 VAL 134 3HG1 VAL 134 -4.473 1.039 14.801 1020 3HG2 VAL 134 1HG1 VAL 134 -6.178 1.408 15.171 1021 H ALA 135 H ALA 135 -6.306 -1.174 11.163 1022 HA ALA 135 HA ALA 135 -7.206 0.221 8.833 1023 1HB ALA 135 2HB ALA 135 -5.617 -1.723 8.739 1024 2HB ALA 135 3HB ALA 135 -6.942 -2.844 9.154 1025 3HB ALA 135 1HB ALA 135 -6.973 -1.958 7.607 1026 H ASP 136 H ASP 136 -8.749 -2.471 10.517 1027 HA ASP 136 HA ASP 136 -11.239 -2.650 9.053 1028 1HB ASP 136 1HB ASP 136 -10.774 -2.937 12.086 1029 2HB ASP 136 2HB ASP 136 -12.213 -3.489 11.222 1030 H LYS 137 H LYS 137 -10.698 -1.052 12.146 1031 HA LYS 137 HA LYS 137 -12.970 0.521 12.525 1032 1HB LYS 137 1HB LYS 137 -10.065 1.519 12.729 1033 2HB LYS 137 2HB LYS 137 -11.450 2.330 13.462 1034 1HG LYS 137 1HG LYS 137 -10.500 -0.545 14.031 1035 2HG LYS 137 2HG LYS 137 -10.256 0.828 15.099 1036 1HD LYS 137 1HD LYS 137 -13.000 -0.343 14.285 1037 2HD LYS 137 2HD LYS 137 -12.159 -0.750 15.762 1038 1HE LYS 137 1HE LYS 137 -13.206 2.083 15.074 1039 2HE LYS 137 2HE LYS 137 -14.039 0.903 16.078 1040 1HZ LYS 137 2HZ LYS 137 -12.185 0.977 17.653 1041 2HZ LYS 137 3HZ LYS 137 -11.383 2.081 16.721 1042 3HZ LYS 137 1HZ LYS 137 -12.822 2.484 17.424 1043 H ILE 138 H ILE 138 -10.175 1.485 10.597 1044 HA ILE 138 HA ILE 138 -11.296 3.947 9.495 1045 HB ILE 138 HB ILE 138 -9.243 2.046 8.221 1046 1HG1 ILE 138 1HG1 ILE 138 -9.083 4.442 10.136 1047 2HG1 ILE 138 2HG1 ILE 138 -8.497 2.802 10.433 1048 1HG2 ILE 138 2HG2 ILE 138 -10.283 3.659 6.589 1049 2HG2 ILE 138 3HG2 ILE 138 -9.918 5.016 7.691 1050 3HG2 ILE 138 1HG2 ILE 138 -8.588 4.101 6.933 1051 1HD1 ILE 138 2HD1 ILE 138 -6.785 3.099 8.558 1052 2HD1 ILE 138 3HD1 ILE 138 -7.392 4.755 8.293 1053 3HD1 ILE 138 1HD1 ILE 138 -6.593 4.339 9.830 1054 H SER 139 H SER 139 -10.966 0.721 8.079 1055 HA SER 139 HA SER 139 -12.561 1.281 5.711 1056 1HB SER 139 1HB SER 139 -12.530 -1.185 5.361 1057 2HB SER 139 2HB SER 139 -10.930 -0.575 5.824 1058 HG SER 139 HG SER 139 -11.547 -2.420 6.996 1059 H GLN 140 H GLN 140 -13.676 1.303 8.678 1060 HA GLN 140 HA GLN 140 -16.476 0.206 7.992 1061 1HB GLN 140 1HB GLN 140 -15.203 1.081 10.644 1062 2HB GLN 140 2HB GLN 140 -16.946 0.903 10.434 1063 1HG GLN 140 1HG GLN 140 -16.063 -1.200 11.318 1064 2HG GLN 140 2HG GLN 140 -16.681 -1.463 9.689 1065 1HE2 GLN 140 2HE2 GLN 140 -13.467 -2.282 8.319 1066 2HE2 GLN 140 1HE2 GLN 140 -15.174 -1.727 7.956 1067 H VAL 141 H VAL 141 -14.777 3.026 9.277 1068 HA VAL 141 HA VAL 141 -16.914 4.914 9.408 1069 HB VAL 141 HB VAL 141 -15.215 6.683 9.049 1070 1HG1 VAL 141 3HG2 VAL 141 -15.355 5.506 11.262 1071 2HG1 VAL 141 1HG2 VAL 141 -14.187 4.282 10.701 1072 3HG1 VAL 141 2HG2 VAL 141 -13.673 5.978 10.907 1073 1HG2 VAL 141 2HG1 VAL 141 -13.987 5.605 7.140 1074 2HG2 VAL 141 3HG1 VAL 141 -12.857 6.034 8.451 1075 3HG2 VAL 141 1HG1 VAL 141 -13.371 4.340 8.234 1076 HA PRO 142 HA PRO 142 -18.756 5.069 5.430 1077 1HB PRO 142 1HB PRO 142 -19.195 7.890 6.538 1078 2HB PRO 142 2HB PRO 142 -20.382 6.832 5.734 1079 1HG PRO 142 1HG PRO 142 -20.424 6.986 8.441 1080 2HG PRO 142 2HG PRO 142 -20.524 5.376 7.686 1081 1HD PRO 142 1HD PRO 142 -18.073 6.686 8.978 1082 2HD PRO 142 2HD PRO 142 -18.613 4.977 9.068 1083 H THR 143 H THR 143 -18.963 6.731 3.709 1084 HA THR 143 HA THR 143 -16.611 8.553 3.169 1085 HB THR 143 HB THR 143 -16.287 7.259 0.907 1086 HG1 THR 143 HG1 THR 143 -17.982 5.801 1.312 1087 1HG2 THR 143 2HG2 THR 143 -14.519 7.467 2.615 1088 2HG2 THR 143 3HG2 THR 143 -15.177 6.054 3.500 1089 3HG2 THR 143 1HG2 THR 143 -14.492 5.855 1.853 1090 H HIS 144 H HIS 144 -16.811 7.796 0.471 1091 HA HIS 144 HA HIS 144 -19.435 7.848 -0.669 1092 1HB HIS 144 1HB HIS 144 -19.841 10.124 -1.395 1093 2HB HIS 144 2HB HIS 144 -19.665 10.115 0.354 1094 HD2 HIS 144 HD2 HIS 144 -16.171 9.887 -1.058 1095 HE1 HIS 144 HE1 HIS 144 -16.905 13.966 -0.858 1096 HE2 HIS 144 HE2 HIS 144 -15.021 12.257 -1.202 1097 H ASP 145 H ASP 145 -19.553 8.349 -2.900 1098 HA ASP 145 HA ASP 145 -17.365 7.342 -4.570 1099 1HB ASP 145 1HB ASP 145 -19.582 9.364 -5.275 1100 2HB ASP 145 2HB ASP 145 -18.567 8.507 -6.447 1101 H VAL 146 H VAL 146 -17.499 9.731 -6.369 1102 HA VAL 146 HA VAL 146 -16.512 12.054 -4.891 1103 HB VAL 146 HB VAL 146 -14.284 11.222 -6.715 1104 1HG1 VAL 146 3HG2 VAL 146 -14.426 13.406 -5.457 1105 2HG1 VAL 146 1HG2 VAL 146 -14.495 12.509 -3.919 1106 3HG1 VAL 146 2HG2 VAL 146 -13.016 12.445 -4.909 1107 1HG2 VAL 146 2HG1 VAL 146 -14.589 9.071 -5.470 1108 2HG2 VAL 146 3HG1 VAL 146 -13.085 9.907 -5.009 1109 3HG2 VAL 146 1HG1 VAL 146 -14.497 9.955 -3.921 1110 H GLY 147 H GLY 147 -14.831 12.875 -7.163 1111 1HA GLY 147 1HA GLY 147 -16.913 13.939 -9.071 1112 2HA GLY 147 2HA GLY 147 -15.154 14.120 -9.229 1113 HA PRO 148 HA PRO 148 -15.179 10.763 -12.184 1114 1HB PRO 148 1HB PRO 148 -12.448 10.482 -12.327 1115 2HB PRO 148 2HB PRO 148 -13.256 11.967 -12.885 1116 1HG PRO 148 1HG PRO 148 -11.924 11.487 -10.163 1117 2HG PRO 148 2HG PRO 148 -11.643 12.848 -11.277 1118 1HD PRO 148 1HD PRO 148 -13.416 13.044 -9.140 1119 2HD PRO 148 2HD PRO 148 -13.754 13.882 -10.690 1120 OH TYR 149 OH TYR 149 -7.601 9.135 -12.305 1121 H TYR 149 H TYR 149 -12.642 10.436 -9.747 1122 HA TYR 149 HA TYR 149 -12.792 7.506 -9.630 1123 1HB TYR 149 1HB TYR 149 -11.486 9.493 -7.678 1124 2HB TYR 149 2HB TYR 149 -11.208 7.749 -7.698 1125 HD1 TYR 149 HD2 TYR 149 -10.927 6.928 -10.329 1126 HD2 TYR 149 HD1 TYR 149 -9.735 10.633 -8.694 1127 HE1 TYR 149 HE2 TYR 149 -9.237 7.150 -12.060 1128 HE2 TYR 149 HE1 TYR 149 -8.046 10.853 -10.426 1129 HH TYR 149 HH TYR 149 -7.126 9.959 -12.176 1130 H GLN 150 H GLN 150 -14.056 6.285 -8.685 1131 HA GLN 150 HA GLN 150 -15.950 7.080 -6.470 1132 1HB GLN 150 1HB GLN 150 -15.267 4.307 -7.617 1133 2HB GLN 150 2HB GLN 150 -16.607 4.687 -6.527 1134 1HG GLN 150 1HG GLN 150 -16.199 5.826 -9.363 1135 2HG GLN 150 2HG GLN 150 -17.379 4.593 -8.906 1136 1HE2 GLN 150 2HE2 GLN 150 -19.191 7.851 -8.995 1137 2HE2 GLN 150 1HE2 GLN 150 -18.276 6.759 -10.152 1138 H ASN 151 H ASN 151 -15.957 5.105 -4.787 1139 HA ASN 151 HA ASN 151 -14.942 4.548 -2.651 1140 1HB ASN 151 1HB ASN 151 -12.757 3.653 -4.638 1141 2HB ASN 151 2HB ASN 151 -12.929 3.088 -2.968 1142 1HD2 ASN 151 1HD2 ASN 151 -14.676 0.502 -4.896 1143 2HD2 ASN 151 2HD2 ASN 151 -12.989 1.091 -4.481 1144 H VAL 152 H VAL 152 -14.857 6.554 -1.966 1145 HA VAL 152 HA VAL 152 -12.112 7.412 -1.107 1146 HB VAL 152 HB VAL 152 -13.911 9.272 -2.774 1147 1HG1 VAL 152 3HG2 VAL 152 -12.875 10.443 -0.812 1148 2HG1 VAL 152 1HG2 VAL 152 -11.267 9.826 -1.271 1149 3HG1 VAL 152 2HG2 VAL 152 -12.116 10.982 -2.333 1150 1HG2 VAL 152 1HG1 VAL 152 -11.057 8.153 -3.237 1151 2HG2 VAL 152 2HG1 VAL 152 -12.519 7.665 -4.134 1152 3HG2 VAL 152 3HG1 VAL 152 -11.884 9.324 -4.298 1153 HA PRO 153 HA PRO 153 -14.261 7.692 2.657 1154 1HB PRO 153 1HB PRO 153 -12.250 9.999 2.855 1155 2HB PRO 153 2HB PRO 153 -12.636 8.782 4.097 1156 1HG PRO 153 1HG PRO 153 -10.401 8.421 2.611 1157 2HG PRO 153 2HG PRO 153 -11.485 7.027 2.844 1158 1HD PRO 153 1HD PRO 153 -11.237 8.810 0.366 1159 2HD PRO 153 2HD PRO 153 -11.472 7.033 0.452 1160 H SER 154 H SER 154 -14.218 10.268 3.946 1161 HA SER 154 HA SER 154 -15.662 12.252 2.220 1162 1HB SER 154 1HB SER 154 -17.433 10.560 2.610 1163 2HB SER 154 2HB SER 154 -17.178 10.646 4.360 1164 HG SER 154 HG SER 154 -17.938 12.793 2.656 1165 H LYS 155 H LYS 155 -13.954 11.421 5.009 1166 HA LYS 155 HA LYS 155 -13.355 14.168 5.639 1167 1HB LYS 155 1HB LYS 155 -15.778 14.200 6.335 1168 2HB LYS 155 2HB LYS 155 -15.432 12.972 7.565 1169 1HG LYS 155 1HG LYS 155 -13.718 14.497 8.615 1170 2HG LYS 155 2HG LYS 155 -14.003 15.701 7.356 1171 1HD LYS 155 1HD LYS 155 -16.418 15.925 8.120 1172 2HD LYS 155 2HD LYS 155 -16.119 14.738 9.396 1173 1HE LYS 155 1HE LYS 155 -14.364 16.273 10.414 1174 2HE LYS 155 2HE LYS 155 -14.650 17.456 9.129 1175 1HZ LYS 155 1HZ LYS 155 -16.961 17.643 9.895 1176 2HZ LYS 155 2HZ LYS 155 -16.694 16.541 11.097 1177 3HZ LYS 155 3HZ LYS 155 -15.907 17.993 11.118 1178 HA PRO 156 HA PRO 156 -11.893 11.898 9.530 1179 1HB PRO 156 1HB PRO 156 -13.053 9.494 10.284 1180 2HB PRO 156 2HB PRO 156 -13.810 11.080 10.560 1181 1HG PRO 156 1HG PRO 156 -14.342 9.152 8.237 1182 2HG PRO 156 2HG PRO 156 -15.545 9.921 9.304 1183 1HD PRO 156 1HD PRO 156 -14.953 11.006 6.838 1184 2HD PRO 156 2HD PRO 156 -15.230 12.092 8.239 1185 H VAL 157 H VAL 157 -10.296 11.812 7.852 1186 HA VAL 157 HA VAL 157 -8.626 9.539 8.391 1187 HB VAL 157 HB VAL 157 -9.838 9.475 5.578 1188 1HG1 VAL 157 1HG2 VAL 157 -7.300 8.062 6.637 1189 2HG1 VAL 157 2HG2 VAL 157 -8.069 7.759 5.055 1190 3HG1 VAL 157 3HG2 VAL 157 -7.334 9.346 5.402 1191 1HG2 VAL 157 2HG1 VAL 157 -11.003 8.154 7.400 1192 2HG2 VAL 157 3HG1 VAL 157 -10.218 7.059 6.228 1193 3HG2 VAL 157 1HG1 VAL 157 -9.460 7.360 7.810 1194 H VAL 158 H VAL 158 -6.781 10.173 8.457 1195 HA VAL 158 HA VAL 158 -5.368 11.655 6.347 1196 HB VAL 158 HB VAL 158 -5.990 13.210 8.926 1197 1HG1 VAL 158 3HG2 VAL 158 -3.590 13.441 8.212 1198 2HG1 VAL 158 1HG2 VAL 158 -4.107 13.867 6.561 1199 3HG1 VAL 158 2HG2 VAL 158 -4.475 14.961 7.921 1200 1HG2 VAL 158 1HG1 VAL 158 -6.613 13.789 5.951 1201 2HG2 VAL 158 2HG1 VAL 158 -7.809 13.313 7.185 1202 3HG2 VAL 158 3HG1 VAL 158 -6.973 14.885 7.312 1203 H ILE 159 H ILE 159 -3.604 10.755 6.342 1204 HA ILE 159 HA ILE 159 -2.571 9.079 8.528 1205 HB ILE 159 HB ILE 159 -1.223 10.065 5.956 1206 1HG1 ILE 159 1HG1 ILE 159 -2.778 7.540 6.792 1207 2HG1 ILE 159 2HG1 ILE 159 -3.298 8.745 5.608 1208 1HG2 ILE 159 3HG2 ILE 159 -0.449 7.824 7.939 1209 2HG2 ILE 159 1HG2 ILE 159 0.352 8.150 6.377 1210 3HG2 ILE 159 2HG2 ILE 159 0.445 9.348 7.695 1211 1HD1 ILE 159 3HD1 ILE 159 -0.782 6.960 5.357 1212 2HD1 ILE 159 1HD1 ILE 159 -2.313 6.731 4.466 1213 3HD1 ILE 159 2HD1 ILE 159 -1.302 8.170 4.151 1214 H LEU 160 H LEU 160 -1.223 9.312 9.928 1215 HA LEU 160 HA LEU 160 -0.436 12.122 10.792 1216 1HB LEU 160 1HB LEU 160 -0.227 9.432 12.264 1217 2HB LEU 160 2HB LEU 160 0.171 11.016 12.946 1218 HG LEU 160 HG LEU 160 -2.569 10.184 11.823 1219 1HD1 LEU 160 2HD1 LEU 160 -2.037 9.163 14.061 1220 2HD1 LEU 160 3HD1 LEU 160 -1.651 10.776 14.716 1221 3HD1 LEU 160 1HD1 LEU 160 -3.318 10.393 14.215 1222 1HD2 LEU 160 3HD2 LEU 160 -2.073 12.612 11.409 1223 2HD2 LEU 160 1HD2 LEU 160 -3.339 12.430 12.650 1224 3HD2 LEU 160 2HD2 LEU 160 -1.672 12.837 13.131 1225 H SER 161 H SER 161 1.042 8.933 10.336 1226 HA SER 161 HA SER 161 3.618 10.106 9.339 1227 1HB SER 161 1HB SER 161 3.671 10.584 11.817 1228 2HB SER 161 2HB SER 161 3.503 8.850 12.150 1229 HG SER 161 HG SER 161 5.423 8.523 10.943 1230 H ALA 162 H ALA 162 5.265 8.690 9.038 1231 HA ALA 162 HA ALA 162 4.788 5.702 9.034 1232 1HB ALA 162 3HB ALA 162 5.182 7.251 6.380 1233 2HB ALA 162 1HB ALA 162 5.169 5.475 6.573 1234 3HB ALA 162 2HB ALA 162 3.690 6.411 6.883 1235 H LYS 163 H LYS 163 6.496 4.981 9.803 1236 HA LYS 163 HA LYS 163 9.237 5.771 8.766 1237 1HB LYS 163 1HB LYS 163 10.135 6.223 11.000 1238 2HB LYS 163 2HB LYS 163 8.828 7.366 10.648 1239 1HG LYS 163 1HG LYS 163 7.209 5.972 11.971 1240 2HG LYS 163 2HG LYS 163 8.430 4.729 12.186 1241 1HD LYS 163 1HD LYS 163 8.298 5.904 14.263 1242 2HD LYS 163 2HD LYS 163 9.851 6.315 13.548 1243 1HE LYS 163 1HE LYS 163 8.885 8.555 12.776 1244 2HE LYS 163 2HE LYS 163 7.322 8.116 13.481 1245 1HZ LYS 163 2HZ LYS 163 8.414 7.991 15.664 1246 2HZ LYS 163 3HZ LYS 163 9.872 8.398 15.002 1247 3HZ LYS 163 1HZ LYS 163 8.627 9.484 14.988 1248 H VAL 164 H VAL 164 10.540 4.219 8.677 1249 HA VAL 164 HA VAL 164 9.700 1.457 9.239 1250 HB VAL 164 HB VAL 164 11.966 0.871 8.536 1251 1HG1 VAL 164 3HG2 VAL 164 10.248 1.430 6.793 1252 2HG1 VAL 164 1HG2 VAL 164 10.737 3.143 6.842 1253 3HG1 VAL 164 2HG2 VAL 164 11.874 1.908 6.237 1254 1HG2 VAL 164 2HG1 VAL 164 13.212 2.716 9.700 1255 2HG2 VAL 164 3HG1 VAL 164 13.640 2.677 7.969 1256 3HG2 VAL 164 1HG1 VAL 164 12.509 3.914 8.583 1257 H LEU 165 H LEU 165 9.924 0.310 10.832 1258 HA LEU 165 HA LEU 165 10.790 1.284 13.493 1259 1HB LEU 165 1HB LEU 165 9.089 -0.519 13.251 1260 2HB LEU 165 2HB LEU 165 10.301 -1.605 12.553 1261 HG LEU 165 HG LEU 165 11.680 -1.452 14.624 1262 1HD1 LEU 165 2HD1 LEU 165 11.060 0.890 15.282 1263 2HD1 LEU 165 3HD1 LEU 165 9.409 0.353 15.689 1264 3HD1 LEU 165 1HD1 LEU 165 10.799 -0.236 16.638 1265 1HD2 LEU 165 3HD2 LEU 165 9.906 -3.230 14.494 1266 2HD2 LEU 165 1HD2 LEU 165 10.120 -2.670 16.172 1267 3HD2 LEU 165 2HD2 LEU 165 8.719 -2.113 15.220 1268 HA PRO 166 HA PRO 166 15.186 1.183 13.014 1269 1HB PRO 166 1HB PRO 166 14.723 0.770 16.014 1270 2HB PRO 166 2HB PRO 166 15.887 1.864 15.226 1271 1HG PRO 166 1HG PRO 166 13.570 2.911 16.175 1272 2HG PRO 166 2HG PRO 166 14.111 3.392 14.548 1273 1HD PRO 166 1HD PRO 166 11.935 1.358 15.269 1274 2HD PRO 166 2HD PRO 166 11.943 2.577 13.952 No H/Q in entry = 1274
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