NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
589389 | 2n1m | 25567 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 -7.355 -21.274 -15.474 2 HA2 GLY 1 1HA GLY 1 -5.155 -23.234 -15.348 3 HA3 GLY 1 2HA GLY 1 -5.020 -21.572 -15.947 4 H MET 2 H MET 2 -3.143 -21.742 -14.323 5 HA MET 2 HA MET 2 -3.971 -20.432 -11.833 6 HB3 MET 2 2HB MET 2 -3.954 -22.892 -11.342 7 HG3 MET 2 2HG MET 2 -0.951 -22.746 -11.808 8 HE1 MET 2 3HE MET 2 -0.658 -23.642 -9.180 9 HE2 MET 2 1HE MET 2 -2.420 -23.698 -8.936 10 HE3 MET 2 2HE MET 2 -1.433 -25.131 -8.598 11 H ALA 3 H ALA 3 -2.382 -18.982 -11.083 12 HA ALA 3 HA ALA 3 0.372 -19.271 -11.475 13 HB1 ALA 3 1HB ALA 3 0.802 -17.148 -12.772 14 HB2 ALA 3 2HB ALA 3 0.202 -18.493 -13.732 15 HB3 ALA 3 3HB ALA 3 -0.903 -17.173 -13.288 16 H LYS 4 H LYS 4 0.906 -18.542 -9.416 17 HA LYS 4 HA LYS 4 -0.411 -16.238 -8.236 18 HB3 LYS 4 2HB LYS 4 1.186 -16.582 -6.435 19 HG3 LYS 4 2HG LYS 4 0.187 -19.356 -7.195 20 HD3 LYS 4 2HD LYS 4 -0.427 -19.369 -4.767 21 HE3 LYS 4 2HE LYS 4 2.169 -19.625 -5.844 22 HZ1 LYS 4 3HZ LYS 4 3.572 -18.839 -4.100 23 HZ2 LYS 4 1HZ LYS 4 2.371 -18.246 -3.226 24 HZ3 LYS 4 2HZ LYS 4 2.781 -17.519 -4.662 25 H LYS 5 H LYS 5 0.019 -14.420 -9.441 26 HA LYS 5 HA LYS 5 2.853 -13.802 -10.095 27 HB3 LYS 5 2HB LYS 5 2.018 -11.978 -11.437 28 HG3 LYS 5 2HG LYS 5 0.183 -14.286 -11.883 29 HD3 LYS 5 2HD LYS 5 1.925 -12.764 -13.835 30 HE3 LYS 5 2HE LYS 5 -0.159 -14.985 -14.066 31 HZ1 LYS 5 3HZ LYS 5 0.173 -14.959 -16.370 32 HZ2 LYS 5 1HZ LYS 5 1.329 -13.763 -16.309 33 HZ3 LYS 5 2HZ LYS 5 -0.244 -13.432 -15.980 34 H THR 6 H THR 6 3.282 -11.546 -9.818 35 HA THR 6 HA THR 6 2.391 -10.551 -7.150 36 HB THR 6 HB THR 6 5.302 -10.873 -7.926 37 HG1 THR 6 1HG THR 6 4.462 -12.813 -7.234 38 HG21 THR 6 3HG2 THR 6 4.050 -9.700 -5.398 39 HG22 THR 6 1HG2 THR 6 5.122 -8.868 -6.529 40 HG23 THR 6 2HG2 THR 6 5.743 -10.192 -5.546 41 H LEU 7 H LEU 7 2.704 -8.215 -6.831 42 HA LEU 7 HA LEU 7 3.492 -6.655 -9.202 43 HB3 LEU 7 2HB LEU 7 0.835 -6.364 -7.733 44 HG LEU 7 HG LEU 7 1.678 -4.239 -8.751 45 HD11 LEU 7 1HD1 LEU 7 1.640 -5.867 -11.326 46 HD12 LEU 7 2HD1 LEU 7 3.011 -4.982 -10.616 47 HD13 LEU 7 3HD1 LEU 7 1.640 -4.088 -11.244 48 HD21 LEU 7 3HD2 LEU 7 -0.392 -3.761 -10.022 49 HD22 LEU 7 1HD2 LEU 7 -0.720 -4.667 -8.536 50 HD23 LEU 7 2HD2 LEU 7 -0.739 -5.505 -10.110 51 H ILE 8 H ILE 8 4.335 -4.644 -8.599 52 HA ILE 8 HA ILE 8 4.468 -3.909 -5.721 53 HB ILE 8 HB ILE 8 6.574 -3.743 -7.904 54 HG13 ILE 8 2HG1 ILE 8 6.030 -6.118 -6.667 55 HG21 ILE 8 1HG2 ILE 8 8.133 -3.116 -6.024 56 HG22 ILE 8 2HG2 ILE 8 6.866 -1.919 -6.326 57 HG23 ILE 8 3HG2 ILE 8 6.725 -3.034 -4.947 58 HD11 ILE 8 3HD1 ILE 8 8.333 -6.788 -7.108 59 HD12 ILE 8 1HD1 ILE 8 7.692 -5.842 -8.456 60 HD13 ILE 8 2HD1 ILE 8 8.821 -5.099 -7.292 61 H LEU 9 H LEU 9 3.052 -2.148 -5.672 62 HA LEU 9 HA LEU 9 3.231 -0.049 -7.736 63 HB3 LEU 9 2HB LEU 9 1.361 0.802 -5.966 64 HG LEU 9 HG LEU 9 -0.414 -0.365 -7.151 65 HD11 LEU 9 1HD1 LEU 9 0.477 1.779 -7.949 66 HD12 LEU 9 2HD1 LEU 9 -0.066 0.785 -9.300 67 HD13 LEU 9 3HD1 LEU 9 1.663 0.931 -8.952 68 HD21 LEU 9 3HD2 LEU 9 1.784 -1.680 -8.785 69 HD22 LEU 9 1HD2 LEU 9 0.063 -1.609 -9.225 70 HD23 LEU 9 2HD2 LEU 9 0.556 -2.462 -7.767 71 H TYR 10 H TYR 10 4.442 1.810 -7.214 72 HA TYR 10 HA TYR 10 5.210 2.238 -4.358 73 HB3 TYR 10 2HB TYR 10 6.960 0.911 -5.368 74 HD1 TYR 10 1HD TYR 10 6.158 0.308 -7.813 75 HD2 TYR 10 2HD TYR 10 8.609 3.736 -6.863 76 HE1 TYR 10 1HE TYR 10 6.744 0.529 -10.157 77 HE2 TYR 10 2HE TYR 10 9.300 3.894 -9.224 78 HH TYR 10 HH TYR 10 8.107 1.580 -11.699 79 H TYR 11 H TYR 11 4.316 4.150 -3.815 80 HA TYR 11 HA TYR 11 4.046 6.182 -5.878 81 HB3 TYR 11 2HB TYR 11 2.656 5.643 -3.453 82 HD1 TYR 11 2HD TYR 11 4.055 7.556 -1.874 83 HD2 TYR 11 1HD TYR 11 1.483 8.512 -5.234 84 HE1 TYR 11 2HE TYR 11 3.891 9.902 -1.097 85 HE2 TYR 11 1HE TYR 11 1.405 10.869 -4.475 86 HH TYR 11 HH TYR 11 2.552 11.994 -1.423 87 H SER 12 H SER 12 5.847 7.793 -6.076 88 HA SER 12 HA SER 12 6.574 9.381 -4.072 89 HB3 SER 12 2HB SER 12 9.167 7.940 -4.564 90 HG SER 12 HG SER 12 9.073 8.584 -2.156 91 H TRP 13 H TRP 13 8.762 10.664 -4.802 92 HA TRP 13 HA TRP 13 8.312 11.545 -7.532 93 HB3 TRP 13 2HB TRP 13 10.850 12.259 -6.071 94 HD1 TRP 13 HD TRP 13 7.714 14.327 -6.765 95 HE1 TRP 13 1HE TRP 13 8.188 16.212 -8.410 96 HE3 TRP 13 3HE TRP 13 12.543 13.126 -7.967 97 HZ2 TRP 13 2HZ TRP 13 10.340 17.006 -10.176 98 HZ3 TRP 13 3HZ TRP 13 13.758 14.440 -9.716 99 HH2 TRP 13 HH TRP 13 12.661 16.383 -10.808 100 H SER 14 H SER 14 10.238 11.688 -9.110 101 HA SER 14 HA SER 14 11.182 9.087 -9.745 102 HB3 SER 14 2HB SER 14 12.161 11.783 -10.748 103 HG SER 14 HG SER 14 12.566 10.661 -12.622 104 H GLY 15 H GLY 15 12.497 8.111 -8.245 105 HA2 GLY 15 1HA GLY 15 15.116 8.025 -8.212 106 HA3 GLY 15 2HA GLY 15 14.920 9.479 -7.221 107 H GLU 16 H GLU 16 12.965 9.170 -5.635 108 HA GLU 16 HA GLU 16 13.907 7.946 -3.441 109 HB3 GLU 16 2HB GLU 16 11.269 7.985 -2.831 110 HG3 GLU 16 2HG GLU 16 11.383 10.567 -2.798 111 H THR 17 H THR 17 10.830 6.459 -4.675 112 HA THR 17 HA THR 17 11.668 3.965 -3.446 113 HB THR 17 HB THR 17 9.378 3.280 -4.503 114 HG1 THR 17 1HG THR 17 8.035 5.245 -4.500 115 HG21 THR 17 3HG2 THR 17 8.193 4.260 -2.547 116 HG22 THR 17 1HG2 THR 17 9.628 5.265 -2.230 117 HG23 THR 17 2HG2 THR 17 9.736 3.503 -2.123 118 H LYS 18 H LYS 18 11.854 5.311 -6.664 119 HA LYS 18 HA LYS 18 11.675 3.147 -8.326 120 HB3 LYS 18 2HB LYS 18 13.656 5.466 -8.367 121 HG3 LYS 18 2HG LYS 18 13.402 4.866 -10.988 122 HD3 LYS 18 2HD LYS 18 15.578 3.728 -9.188 123 HE3 LYS 18 2HE LYS 18 15.586 2.737 -11.497 124 HZ1 LYS 18 3HZ LYS 18 16.449 4.282 -13.229 125 HZ2 LYS 18 1HZ LYS 18 16.122 5.553 -12.282 126 HZ3 LYS 18 2HZ LYS 18 14.906 4.621 -12.857 127 H LYS 19 H LYS 19 14.686 4.005 -6.515 128 HA LYS 19 HA LYS 19 16.102 1.725 -7.458 129 HB3 LYS 19 2HB LYS 19 17.151 3.702 -6.440 130 HG3 LYS 19 2HG LYS 19 15.462 3.609 -4.306 131 HD3 LYS 19 2HD LYS 19 16.808 1.444 -3.545 132 HE3 LYS 19 2HE LYS 19 18.581 3.557 -2.323 133 HZ1 LYS 19 3HZ LYS 19 18.584 1.082 -1.682 134 HZ2 LYS 19 1HZ LYS 19 20.040 1.783 -2.041 135 HZ3 LYS 19 2HZ LYS 19 19.322 0.822 -3.131 136 H MET 20 H MET 20 13.994 2.123 -4.631 137 HA MET 20 HA MET 20 14.659 -0.447 -3.580 138 HB3 MET 20 2HB MET 20 12.279 0.952 -2.470 139 HG3 MET 20 2HG MET 20 13.492 1.265 -0.433 140 HE1 MET 20 3HE MET 20 14.736 -2.331 -2.426 141 HE2 MET 20 1HE MET 20 15.775 -0.978 -1.948 142 HE3 MET 20 2HE MET 20 15.732 -2.452 -0.955 143 H ALA 21 H ALA 21 12.641 0.429 -6.067 144 HA ALA 21 HA ALA 21 10.690 -1.769 -5.491 145 HB1 ALA 21 1HB ALA 21 10.590 0.495 -7.519 146 HB2 ALA 21 2HB ALA 21 9.335 -0.725 -7.254 147 HB3 ALA 21 3HB ALA 21 9.726 0.431 -5.971 148 H GLU 22 H GLU 22 12.900 -0.533 -8.047 149 HA GLU 22 HA GLU 22 12.422 -2.508 -9.987 150 HB3 GLU 22 2HB GLU 22 14.758 -1.815 -10.776 151 HG3 GLU 22 2HG GLU 22 14.174 0.773 -10.685 152 H LYS 23 H LYS 23 14.530 -2.575 -7.138 153 HA LYS 23 HA LYS 23 16.028 -4.896 -7.870 154 HB3 LYS 23 2HB LYS 23 15.775 -5.075 -5.088 155 HG3 LYS 23 2HG LYS 23 17.852 -4.955 -6.666 156 HD3 LYS 23 2HD LYS 23 18.914 -2.690 -5.473 157 HE3 LYS 23 2HE LYS 23 19.070 -1.713 -7.732 158 HZ1 LYS 23 3HZ LYS 23 20.494 -3.643 -7.037 159 HZ2 LYS 23 1HZ LYS 23 20.332 -3.458 -8.676 160 HZ3 LYS 23 2HZ LYS 23 19.513 -4.623 -7.898 161 H ILE 24 H ILE 24 13.008 -4.563 -6.008 162 HA ILE 24 HA ILE 24 12.723 -7.291 -5.337 163 HB ILE 24 HB ILE 24 10.555 -5.147 -5.706 164 HG13 ILE 24 2HG1 ILE 24 12.407 -4.282 -4.251 165 HG21 ILE 24 1HG2 ILE 24 9.268 -6.378 -4.016 166 HG22 ILE 24 2HG2 ILE 24 9.713 -7.481 -5.296 167 HG23 ILE 24 3HG2 ILE 24 10.620 -7.511 -3.776 168 HD11 ILE 24 3HD1 ILE 24 11.140 -3.585 -2.347 169 HD12 ILE 24 1HD1 ILE 24 10.063 -3.586 -3.756 170 HD13 ILE 24 2HD1 ILE 24 9.968 -4.895 -2.549 171 H ASN 25 H ASN 25 11.496 -5.468 -8.195 172 HA ASN 25 HA ASN 25 9.819 -7.516 -9.221 173 HB3 ASN 25 2HB ASN 25 11.569 -5.548 -10.786 174 HD21 ASN 25 1HD2 ASN 25 9.648 -8.420 -11.178 175 HD22 ASN 25 2HD2 ASN 25 8.891 -8.039 -12.675 176 H SER 26 H SER 26 13.254 -7.097 -9.334 177 HA SER 26 HA SER 26 13.902 -9.369 -10.970 178 HB3 SER 26 2HB SER 26 16.146 -8.342 -9.528 179 HG SER 26 HG SER 26 16.246 -9.037 -11.607 180 H GLU 27 H GLU 27 13.135 -9.225 -7.523 181 HA GLU 27 HA GLU 27 14.843 -11.580 -7.078 182 HB3 GLU 27 2HB GLU 27 15.487 -10.652 -5.307 183 HG3 GLU 27 2HG GLU 27 13.077 -9.101 -4.622 184 H ILE 28 H ILE 28 11.720 -10.933 -8.075 185 HA ILE 28 HA ILE 28 10.693 -13.390 -6.745 186 HB ILE 28 HB ILE 28 9.220 -10.855 -7.482 187 HG13 ILE 28 2HG1 ILE 28 10.661 -10.489 -5.519 188 HG21 ILE 28 1HG2 ILE 28 8.217 -13.335 -5.985 189 HG22 ILE 28 2HG2 ILE 28 7.268 -11.879 -6.325 190 HG23 ILE 28 3HG2 ILE 28 7.772 -12.889 -7.641 191 HD11 ILE 28 3HD1 ILE 28 8.237 -9.606 -5.708 192 HD12 ILE 28 1HD1 ILE 28 7.877 -10.795 -4.419 193 HD13 ILE 28 2HD1 ILE 28 9.063 -9.511 -4.160 194 H LYS 29 H LYS 29 9.555 -14.838 -7.950 195 HA LYS 29 HA LYS 29 9.916 -14.702 -10.832 196 HB3 LYS 29 2HB LYS 29 8.031 -16.674 -9.584 197 HG3 LYS 29 2HG LYS 29 8.799 -16.815 -12.007 198 HD3 LYS 29 2HD LYS 29 11.081 -18.379 -11.787 199 HE3 LYS 29 2HE LYS 29 12.427 -16.346 -12.517 200 HZ1 LYS 29 3HZ LYS 29 11.281 -16.126 -14.613 201 HZ2 LYS 29 1HZ LYS 29 9.956 -16.909 -14.040 202 HZ3 LYS 29 2HZ LYS 29 11.435 -17.683 -14.163 203 H ASP 30 H ASP 30 8.495 -13.906 -12.197 204 HA ASP 30 HA ASP 30 6.635 -13.091 -13.176 205 HB3 ASP 30 2HB ASP 30 4.820 -14.646 -11.329 206 H SER 31 H SER 31 7.730 -11.434 -11.221 207 HA SER 31 HA SER 31 5.423 -10.084 -9.954 208 HB3 SER 31 2HB SER 31 8.408 -9.583 -9.630 209 HG SER 31 HG SER 31 7.572 -8.743 -7.587 210 H GLU 32 H GLU 32 5.775 -7.519 -10.010 211 HA GLU 32 HA GLU 32 7.120 -6.356 -12.216 212 HB3 GLU 32 2HB GLU 32 4.401 -5.611 -12.856 213 HG3 GLU 32 2HG GLU 32 5.883 -7.694 -14.438 214 H LEU 33 H LEU 33 6.592 -4.252 -12.696 215 HA LEU 33 HA LEU 33 6.272 -2.778 -10.150 216 HB3 LEU 33 2HB LEU 33 8.009 -1.568 -12.198 217 HG LEU 33 HG LEU 33 7.901 -1.304 -9.614 218 HD11 LEU 33 1HD1 LEU 33 8.301 -4.027 -9.715 219 HD12 LEU 33 2HD1 LEU 33 8.684 -2.969 -8.308 220 HD13 LEU 33 3HD1 LEU 33 9.951 -3.407 -9.437 221 HD21 LEU 33 3HD2 LEU 33 9.620 -0.230 -11.038 222 HD22 LEU 33 1HD2 LEU 33 10.559 -1.732 -11.061 223 HD23 LEU 33 2HD2 LEU 33 10.337 -0.820 -9.542 224 H LYS 34 H LYS 34 4.462 -1.430 -10.226 225 HA LYS 34 HA LYS 34 3.789 -0.140 -12.835 226 HB3 LYS 34 2HB LYS 34 1.419 -0.352 -11.325 227 HG3 LYS 34 2HG LYS 34 1.621 -0.573 -13.790 228 HD3 LYS 34 2HD LYS 34 2.266 -3.519 -13.246 229 HE3 LYS 34 2HE LYS 34 2.094 -1.910 -15.798 230 HZ1 LYS 34 3HZ LYS 34 1.807 -4.040 -16.832 231 HZ2 LYS 34 1HZ LYS 34 1.755 -4.818 -15.419 232 HZ3 LYS 34 2HZ LYS 34 3.180 -4.176 -15.938 233 H GLU 35 H GLU 35 2.487 1.869 -12.557 234 HA GLU 35 HA GLU 35 3.874 3.472 -10.525 235 HB3 GLU 35 2HB GLU 35 4.162 4.075 -12.866 236 HG3 GLU 35 2HG GLU 35 1.216 4.808 -12.869 237 H VAL 36 H VAL 36 2.829 4.709 -8.970 238 HA VAL 36 HA VAL 36 -0.075 5.001 -9.059 239 HB VAL 36 HB VAL 36 0.649 3.706 -7.019 240 HG11 VAL 36 1HG1 VAL 36 2.229 4.331 -5.565 241 HG12 VAL 36 2HG1 VAL 36 2.703 3.621 -7.098 242 HG13 VAL 36 3HG1 VAL 36 2.878 5.337 -7.028 243 HG21 VAL 36 3HG2 VAL 36 0.008 5.111 -5.245 244 HG22 VAL 36 1HG2 VAL 36 0.356 6.584 -6.182 245 HG23 VAL 36 2HG2 VAL 36 -1.028 5.540 -6.605 246 H LYS 37 H LYS 37 -0.498 6.885 -9.951 247 HA LYS 37 HA LYS 37 1.205 9.265 -9.335 248 HB3 LYS 37 2HB LYS 37 -0.217 10.226 -11.301 249 HG3 LYS 37 2HG LYS 37 1.886 8.052 -11.624 250 HD3 LYS 37 2HD LYS 37 0.701 9.819 -13.814 251 HE3 LYS 37 2HE LYS 37 2.157 8.250 -15.180 252 HZ1 LYS 37 3HZ LYS 37 4.079 9.501 -14.985 253 HZ2 LYS 37 1HZ LYS 37 3.870 9.824 -13.397 254 HZ3 LYS 37 2HZ LYS 37 2.891 10.565 -14.533 255 H VAL 38 H VAL 38 -0.355 11.276 -9.259 256 HA VAL 38 HA VAL 38 -2.733 10.595 -7.640 257 HB VAL 38 HB VAL 38 -2.344 12.861 -6.578 258 HG11 VAL 38 1HG1 VAL 38 -2.029 10.746 -5.407 259 HG12 VAL 38 2HG1 VAL 38 -0.367 10.610 -6.036 260 HG13 VAL 38 3HG1 VAL 38 -0.797 11.926 -4.918 261 HG21 VAL 38 3HG2 VAL 38 -0.612 13.695 -8.200 262 HG22 VAL 38 1HG2 VAL 38 -0.103 13.771 -6.515 263 HG23 VAL 38 2HG2 VAL 38 0.535 12.491 -7.552 264 H SER 39 H SER 39 -4.415 12.111 -7.838 265 HA SER 39 HA SER 39 -5.036 13.367 -10.365 266 HB3 SER 39 2HB SER 39 -6.140 13.471 -7.524 267 HG SER 39 HG SER 39 -7.867 14.328 -8.234 268 H GLU 40 H GLU 40 -5.916 15.742 -9.770 269 HA GLU 40 HA GLU 40 -5.455 17.944 -9.596 270 HB3 GLU 40 2HB GLU 40 -4.926 18.266 -6.951 271 HG3 GLU 40 2HG GLU 40 -7.359 17.221 -8.427 272 H GLY 41 H GLY 41 -3.969 19.606 -8.172 273 HA2 GLY 41 1HA GLY 41 -2.109 20.901 -8.497 274 HA3 GLY 41 2HA GLY 41 -1.205 19.448 -8.996 275 H THR 42 H THR 42 -0.906 19.139 -11.137 276 HA THR 42 HA THR 42 -0.623 19.687 -13.273 277 HB THR 42 HB THR 42 -2.035 17.900 -13.445 278 HG1 THR 42 1HG THR 42 -3.201 18.349 -15.312 279 HG21 THR 42 3HG2 THR 42 -4.457 17.925 -13.526 280 HG22 THR 42 1HG2 THR 42 -4.502 19.614 -13.026 281 HG23 THR 42 2HG2 THR 42 -3.874 18.372 -11.929 282 H PHE 43 H PHE 43 -3.836 21.273 -13.190 283 HA PHE 43 HA PHE 43 -2.885 23.445 -14.842 284 HB3 PHE 43 2HB PHE 43 -5.122 22.840 -15.159 285 HD1 PHE 43 1HD PHE 43 -5.531 24.192 -11.637 286 HD2 PHE 43 2HD PHE 43 -6.318 20.965 -14.409 287 HE1 PHE 43 1HE PHE 43 -6.888 23.023 -9.928 288 HE2 PHE 43 2HE PHE 43 -7.659 19.820 -12.697 289 HZ PHE 43 HZ PHE 43 -7.897 20.824 -10.415 290 H ASP 44 H ASP 44 -2.768 22.841 -11.450 291 HA ASP 44 HA ASP 44 -2.516 25.687 -10.694 292 HB3 ASP 44 2HB ASP 44 -1.634 24.432 -8.522 293 H ALA 45 H ALA 45 -0.795 26.591 -11.555 294 HA ALA 45 HA ALA 45 1.273 27.243 -11.898 295 HB1 ALA 45 1HB ALA 45 3.069 26.570 -10.475 296 HB2 ALA 45 2HB ALA 45 1.590 26.616 -9.515 297 HB3 ALA 45 3HB ALA 45 2.249 25.050 -10.044 298 H ASP 46 H ASP 46 3.709 25.822 -12.108 299 HA ASP 46 HA ASP 46 3.730 25.123 -14.920 300 HB3 ASP 46 2HB ASP 46 6.145 24.221 -13.796 301 H MET 47 H MET 47 3.292 23.300 -11.972 302 HA MET 47 HA MET 47 2.986 20.783 -13.194 303 HB3 MET 47 2HB MET 47 5.481 20.742 -13.195 304 HG3 MET 47 2HG MET 47 5.160 21.271 -10.211 305 HE1 MET 47 3HE MET 47 8.725 21.088 -8.915 306 HE2 MET 47 1HE MET 47 7.805 22.455 -9.567 307 HE3 MET 47 2HE MET 47 7.007 21.277 -8.500 308 H TYR 48 H TYR 48 2.641 19.184 -11.354 309 HA TYR 48 HA TYR 48 0.529 20.125 -9.853 310 HB3 TYR 48 2HB TYR 48 0.965 17.743 -10.673 311 HD1 TYR 48 1HD TYR 48 1.729 17.254 -7.098 312 HD2 TYR 48 2HD TYR 48 3.439 17.232 -11.085 313 HE1 TYR 48 1HE TYR 48 3.871 16.528 -6.175 314 HE2 TYR 48 2HE TYR 48 5.575 16.446 -10.149 315 HH TYR 48 HH TYR 48 6.178 16.594 -6.741 316 H LYS 49 H LYS 49 0.135 19.700 -7.449 317 HA LYS 49 HA LYS 49 2.373 20.809 -5.842 318 HB3 LYS 49 2HB LYS 49 -0.382 21.971 -5.602 319 HG3 LYS 49 2HG LYS 49 1.746 22.797 -4.370 320 HD3 LYS 49 2HD LYS 49 2.125 24.183 -7.080 321 HE3 LYS 49 2HE LYS 49 4.130 25.141 -6.021 322 HZ1 LYS 49 3HZ LYS 49 3.060 26.425 -4.209 323 HZ2 LYS 49 1HZ LYS 49 1.719 25.523 -4.321 324 HZ3 LYS 49 2HZ LYS 49 2.136 26.448 -5.588 325 H THR 50 H THR 50 0.004 18.393 -5.893 326 HA THR 50 HA THR 50 -1.140 18.842 -3.330 327 HB THR 50 HB THR 50 -2.282 18.073 -5.360 328 HG1 THR 50 1HG THR 50 -3.357 17.753 -3.429 329 HG21 THR 50 3HG2 THR 50 -1.141 15.325 -4.876 330 HG22 THR 50 1HG2 THR 50 -0.662 16.402 -6.211 331 HG23 THR 50 2HG2 THR 50 -2.327 15.807 -6.086 332 H SER 51 H SER 51 1.527 18.670 -2.863 333 HA SER 51 HA SER 51 1.689 16.728 -0.737 334 HB3 SER 51 2HB SER 51 2.306 15.107 -2.273 335 HG SER 51 HG SER 51 3.456 15.460 -4.124 336 H ASP 52 H ASP 52 2.092 19.777 -1.659 337 HA ASP 52 HA ASP 52 4.819 20.293 -1.474 338 HB3 ASP 52 2HB ASP 52 2.973 22.460 -0.578 339 H ILE 53 H ILE 53 2.797 19.396 1.125 340 HA ILE 53 HA ILE 53 4.847 20.108 3.084 341 HB ILE 53 HB ILE 53 3.072 21.881 3.139 342 HG13 ILE 53 2HG1 ILE 53 4.452 21.094 5.128 343 HG21 ILE 53 1HG2 ILE 53 1.127 20.356 2.558 344 HG22 ILE 53 2HG2 ILE 53 1.212 19.705 4.201 345 HG23 ILE 53 3HG2 ILE 53 0.834 21.414 3.947 346 HD11 ILE 53 3HD1 ILE 53 3.243 23.235 5.223 347 HD12 ILE 53 1HD1 ILE 53 1.782 22.396 5.800 348 HD13 ILE 53 2HD1 ILE 53 3.250 22.412 6.792 349 H ALA 54 H ALA 54 4.683 18.656 5.012 350 HA ALA 54 HA ALA 54 4.166 15.953 4.183 351 HB1 ALA 54 1HB ALA 54 6.026 16.696 5.727 352 HB2 ALA 54 2HB ALA 54 4.826 16.967 6.988 353 HB3 ALA 54 3HB ALA 54 5.061 15.338 6.340 354 H LEU 55 H LEU 55 2.892 17.718 7.024 355 HA LEU 55 HA LEU 55 0.516 15.996 7.142 356 HB3 LEU 55 2HB LEU 55 -0.130 17.349 9.061 357 HG LEU 55 HG LEU 55 1.843 15.418 9.019 358 HD11 LEU 55 1HD1 LEU 55 2.987 17.800 10.527 359 HD12 LEU 55 2HD1 LEU 55 3.607 17.210 8.980 360 HD13 LEU 55 3HD1 LEU 55 3.693 16.191 10.426 361 HD21 LEU 55 3HD2 LEU 55 0.805 16.943 11.440 362 HD22 LEU 55 1HD2 LEU 55 1.572 15.341 11.476 363 HD23 LEU 55 2HD2 LEU 55 0.020 15.561 10.637 364 H ASP 56 H ASP 56 -0.041 16.659 4.895 365 HA ASP 56 HA ASP 56 -1.612 19.194 4.815 366 HB3 ASP 56 2HB ASP 56 -1.283 17.069 2.644 367 H GLN 57 H GLN 57 -2.379 15.958 3.679 368 HA GLN 57 HA GLN 57 -5.107 16.125 4.040 369 HB3 GLN 57 2HB GLN 57 -5.193 14.009 3.076 370 HG3 GLN 57 2HG GLN 57 -3.584 13.764 1.332 371 HE21 GLN 57 1HE2 GLN 57 -2.071 15.803 0.171 372 HE22 GLN 57 2HE2 GLN 57 -3.056 17.240 -0.002 373 H ILE 58 H ILE 58 -3.634 16.219 6.732 374 HA ILE 58 HA ILE 58 -4.807 13.803 8.073 375 HB ILE 58 HB ILE 58 -2.156 15.213 8.582 376 HG13 ILE 58 2HG1 ILE 58 -3.014 12.554 7.425 377 HG21 ILE 58 1HG2 ILE 58 -3.226 14.660 10.776 378 HG22 ILE 58 2HG2 ILE 58 -3.355 12.975 10.261 379 HG23 ILE 58 3HG2 ILE 58 -1.766 13.733 10.458 380 HD11 ILE 58 3HD1 ILE 58 -0.418 14.077 7.034 381 HD12 ILE 58 1HD1 ILE 58 -1.100 12.800 6.008 382 HD13 ILE 58 2HD1 ILE 58 -1.851 14.399 6.040 383 H GLN 59 H GLN 59 -3.842 17.280 8.701 384 HA GLN 59 HA GLN 59 -5.927 17.403 10.776 385 HB3 GLN 59 2HB GLN 59 -4.139 16.790 12.102 386 HG3 GLN 59 2HG GLN 59 -2.374 17.871 9.972 387 HE21 GLN 59 1HE2 GLN 59 -1.896 20.101 10.313 388 HE22 GLN 59 2HE2 GLN 59 -0.893 20.571 11.682 389 H GLY 60 H GLY 60 -7.103 18.904 9.609 390 HA2 GLY 60 1HA GLY 60 -7.345 21.407 9.406 391 HA3 GLY 60 2HA GLY 60 -5.703 21.422 8.742 392 H ASN 61 H ASN 61 -5.997 18.878 7.385 393 HA ASN 61 HA ASN 61 -8.288 19.282 5.545 394 HB3 ASN 61 2HB ASN 61 -6.676 17.970 3.845 395 HD21 ASN 61 1HD2 ASN 61 -4.870 20.238 2.948 396 HD22 ASN 61 2HD2 ASN 61 -6.023 21.429 2.329 397 H LYS 62 H LYS 62 -8.820 17.159 4.468 398 HA LYS 62 HA LYS 62 -8.477 14.810 6.193 399 HB3 LYS 62 2HB LYS 62 -11.296 15.141 5.905 400 HG3 LYS 62 2HG LYS 62 -9.630 15.422 8.429 401 HD3 LYS 62 2HD LYS 62 -12.583 14.980 7.859 402 HE3 LYS 62 2HE LYS 62 -11.880 13.370 9.574 403 HZ1 LYS 62 3HZ LYS 62 -10.152 14.728 10.674 404 HZ2 LYS 62 1HZ LYS 62 -11.289 14.210 11.730 405 HZ3 LYS 62 2HZ LYS 62 -11.291 15.770 11.202 406 H ASP 63 H ASP 63 -10.652 16.332 3.779 407 HA ASP 63 HA ASP 63 -10.860 14.283 1.849 408 HB3 ASP 63 2HB ASP 63 -10.970 16.380 0.297 409 H PHE 64 H PHE 64 -9.444 13.625 0.242 410 HA PHE 64 HA PHE 64 -6.713 14.778 0.154 411 HB3 PHE 64 2HB PHE 64 -6.380 12.977 1.584 412 HD1 PHE 64 1HD PHE 64 -7.867 10.953 -1.231 413 HD2 PHE 64 2HD PHE 64 -7.707 11.744 2.985 414 HE1 PHE 64 1HE PHE 64 -9.551 9.156 -0.825 415 HE2 PHE 64 2HE PHE 64 -9.312 9.918 3.423 416 HZ PHE 64 HZ PHE 64 -10.324 8.668 1.480 417 HA PRO 65 HA PRO 65 -7.163 14.369 -4.185 418 HB3 PRO 65 2HB PRO 65 -5.060 15.335 -4.389 419 HG3 PRO 65 2HG PRO 65 -3.214 14.569 -3.009 420 HD3 PRO 65 2HD PRO 65 -5.010 15.283 -1.586 421 H GLU 66 H GLU 66 -7.508 12.876 -5.843 422 HA GLU 66 HA GLU 66 -7.659 10.054 -5.132 423 HB3 GLU 66 2HB GLU 66 -8.126 10.157 -7.854 424 HG3 GLU 66 2HG GLU 66 -10.082 10.985 -5.690 425 H ILE 67 H ILE 67 -6.913 8.488 -6.935 426 HA ILE 67 HA ILE 67 -4.007 8.856 -7.384 427 HB ILE 67 HB ILE 67 -4.027 6.346 -7.472 428 HG13 ILE 67 2HG1 ILE 67 -6.569 6.191 -7.856 429 HG21 ILE 67 1HG2 ILE 67 -3.920 6.093 -5.061 430 HG22 ILE 67 2HG2 ILE 67 -3.292 7.681 -5.494 431 HG23 ILE 67 3HG2 ILE 67 -4.924 7.536 -4.810 432 HD11 ILE 67 3HD1 ILE 67 -6.901 4.161 -6.526 433 HD12 ILE 67 1HD1 ILE 67 -5.350 4.177 -7.386 434 HD13 ILE 67 2HD1 ILE 67 -5.420 4.489 -5.624 435 H GLN 68 H GLN 68 -3.191 7.811 -9.323 436 HA GLN 68 HA GLN 68 -5.130 7.262 -11.493 437 HB3 GLN 68 2HB GLN 68 -3.490 8.380 -13.062 438 HG3 GLN 68 2HG GLN 68 -4.747 10.351 -11.117 439 HE21 GLN 68 1HE2 GLN 68 -3.343 12.170 -11.670 440 HE22 GLN 68 2HE2 GLN 68 -3.501 12.840 -13.277 441 H LEU 69 H LEU 69 -4.309 5.703 -12.974 442 HA LEU 69 HA LEU 69 -1.711 4.786 -13.191 443 HB3 LEU 69 2HB LEU 69 -2.137 3.714 -10.954 444 HG LEU 69 HG LEU 69 -3.772 1.691 -12.502 445 HD11 LEU 69 1HD1 LEU 69 -2.197 0.888 -10.757 446 HD12 LEU 69 2HD1 LEU 69 -3.891 0.527 -10.420 447 HD13 LEU 69 3HD1 LEU 69 -3.079 1.848 -9.554 448 HD21 LEU 69 3HD2 LEU 69 -4.818 3.597 -10.368 449 HD22 LEU 69 1HD2 LEU 69 -5.644 2.143 -10.989 450 HD23 LEU 69 2HD2 LEU 69 -5.336 3.499 -12.070 451 H ASP 70 H ASP 70 -2.281 2.237 -14.149 452 HA ASP 70 HA ASP 70 -3.853 2.882 -16.587 453 HB3 ASP 70 2HB ASP 70 -2.342 0.345 -16.561 454 H ASN 71 H ASN 71 -4.657 0.531 -17.587 455 HA ASN 71 HA ASN 71 -6.850 -0.155 -15.739 456 HB3 ASN 71 2HB ASN 71 -6.330 -1.180 -18.517 457 HD21 ASN 71 1HD2 ASN 71 -8.969 -0.345 -16.143 458 HD22 ASN 71 2HD2 ASN 71 -9.712 -1.911 -16.243 459 H ILE 72 H ILE 72 -5.645 -1.194 -14.216 460 HA ILE 72 HA ILE 72 -4.575 -3.928 -14.816 461 HB ILE 72 HB ILE 72 -3.951 -2.079 -12.498 462 HG13 ILE 72 2HG1 ILE 72 -3.029 -1.666 -15.096 463 HG21 ILE 72 1HG2 ILE 72 -2.674 -4.721 -13.319 464 HG22 ILE 72 2HG2 ILE 72 -2.050 -3.630 -12.059 465 HG23 ILE 72 3HG2 ILE 72 -3.624 -4.407 -11.855 466 HD11 ILE 72 3HD1 ILE 72 -1.523 -1.186 -12.506 467 HD12 ILE 72 1HD1 ILE 72 -1.137 -0.461 -14.092 468 HD13 ILE 72 2HD1 ILE 72 -2.676 -0.099 -13.300 469 H ASP 73 H ASP 73 -5.464 -5.680 -13.838 470 HA ASP 73 HA ASP 73 -7.660 -5.163 -11.877 471 HB3 ASP 73 2HB ASP 73 -7.798 -7.685 -13.381 472 H TYR 74 H TYR 74 -6.963 -5.591 -9.972 473 HA TYR 74 HA TYR 74 -4.575 -6.965 -9.397 474 HB3 TYR 74 2HB TYR 74 -5.168 -6.610 -7.068 475 HD1 TYR 74 2HD TYR 74 -3.940 -4.872 -9.247 476 HD2 TYR 74 1HD TYR 74 -7.429 -4.293 -6.771 477 HE1 TYR 74 2HE TYR 74 -3.925 -2.474 -9.802 478 HE2 TYR 74 1HE TYR 74 -7.306 -1.844 -7.188 479 HH TYR 74 HH TYR 74 -5.832 -0.528 -9.780 480 H ASN 75 H ASN 75 -7.690 -8.185 -9.887 481 HA ASN 75 HA ASN 75 -7.718 -10.689 -8.571 482 HB3 ASN 75 2HB ASN 75 -9.546 -11.163 -10.096 483 HD21 ASN 75 1HD2 ASN 75 -10.735 -10.328 -8.179 484 HD22 ASN 75 2HD2 ASN 75 -11.257 -8.646 -8.166 485 H ASN 76 H ASN 76 -5.756 -9.620 -11.246 486 HA ASN 76 HA ASN 76 -5.440 -12.340 -12.349 487 HB3 ASN 76 2HB ASN 76 -4.309 -11.247 -14.157 488 HD21 ASN 76 1HD2 ASN 76 -5.416 -8.452 -14.788 489 HD22 ASN 76 2HD2 ASN 76 -7.101 -8.765 -15.137 490 H TYR 77 H TYR 77 -4.253 -11.102 -9.629 491 HA TYR 77 HA TYR 77 -1.564 -12.196 -9.945 492 HB3 TYR 77 2HB TYR 77 -0.541 -10.290 -8.813 493 HD1 TYR 77 2HD TYR 77 -3.323 -8.524 -10.522 494 HD2 TYR 77 1HD TYR 77 0.685 -10.084 -10.983 495 HE1 TYR 77 2HE TYR 77 -3.205 -7.534 -12.791 496 HE2 TYR 77 1HE TYR 77 0.818 -9.077 -13.222 497 HH TYR 77 HH TYR 77 -0.349 -7.264 -14.636 498 H ASP 78 H ASP 78 -0.658 -12.654 -7.712 499 HA ASP 78 HA ASP 78 -2.896 -13.284 -5.802 500 HB3 ASP 78 2HB ASP 78 -0.400 -14.905 -6.300 501 H LEU 79 H LEU 79 0.070 -11.529 -6.155 502 HA LEU 79 HA LEU 79 0.196 -11.150 -3.199 503 HB3 LEU 79 2HB LEU 79 2.649 -11.343 -4.933 504 HG LEU 79 HG LEU 79 3.875 -11.820 -3.120 505 HD11 LEU 79 1HD1 LEU 79 3.369 -10.520 -1.166 506 HD12 LEU 79 2HD1 LEU 79 1.664 -10.408 -1.601 507 HD13 LEU 79 3HD1 LEU 79 2.913 -9.616 -2.606 508 HD21 LEU 79 3HD2 LEU 79 2.965 -13.883 -2.466 509 HD22 LEU 79 1HD2 LEU 79 1.436 -13.175 -1.960 510 HD23 LEU 79 2HD2 LEU 79 2.903 -12.903 -0.992 511 H ILE 80 H ILE 80 0.239 -8.916 -2.711 512 HA ILE 80 HA ILE 80 1.100 -7.029 -4.857 513 HB ILE 80 HB ILE 80 -1.479 -7.048 -3.266 514 HG13 ILE 80 2HG1 ILE 80 -1.482 -8.455 -5.261 515 HG21 ILE 80 1HG2 ILE 80 -2.059 -4.899 -4.164 516 HG22 ILE 80 2HG2 ILE 80 -0.476 -4.683 -3.437 517 HG23 ILE 80 3HG2 ILE 80 -0.650 -4.863 -5.200 518 HD11 ILE 80 3HD1 ILE 80 -3.519 -6.964 -5.053 519 HD12 ILE 80 1HD1 ILE 80 -2.768 -5.901 -6.277 520 HD13 ILE 80 2HD1 ILE 80 -3.145 -7.581 -6.676 521 H LEU 81 H LEU 81 2.878 -6.063 -4.160 522 HA LEU 81 HA LEU 81 3.144 -5.215 -1.358 523 HB3 LEU 81 2HB LEU 81 5.404 -4.288 -2.541 524 HG LEU 81 HG LEU 81 6.568 -6.423 -2.118 525 HD11 LEU 81 1HD1 LEU 81 5.868 -6.504 0.358 526 HD12 LEU 81 2HD1 LEU 81 4.771 -5.183 -0.033 527 HD13 LEU 81 3HD1 LEU 81 6.526 -5.012 -0.300 528 HD21 LEU 81 3HD2 LEU 81 5.440 -8.348 -1.202 529 HD22 LEU 81 1HD2 LEU 81 4.702 -7.966 -2.765 530 HD23 LEU 81 2HD2 LEU 81 3.861 -7.541 -1.271 531 H ILE 82 H ILE 82 3.647 -3.059 -0.832 532 HA ILE 82 HA ILE 82 2.678 -0.941 -2.688 533 HB ILE 82 HB ILE 82 1.890 -1.535 0.196 534 HG13 ILE 82 2HG1 ILE 82 0.740 -3.008 -1.496 535 HG21 ILE 82 1HG2 ILE 82 0.942 0.717 -1.582 536 HG22 ILE 82 2HG2 ILE 82 0.477 0.406 0.106 537 HG23 ILE 82 3HG2 ILE 82 2.105 0.902 -0.255 538 HD11 ILE 82 3HD1 ILE 82 -1.469 -2.779 -0.661 539 HD12 ILE 82 1HD1 ILE 82 -0.322 -2.513 0.672 540 HD13 ILE 82 2HD1 ILE 82 -1.165 -1.138 -0.084 541 H GLY 83 H GLY 83 4.190 0.793 -2.629 542 HA2 GLY 83 1HA GLY 83 6.083 0.891 -0.308 543 HA3 GLY 83 2HA GLY 83 6.544 1.202 -1.953 544 H SER 84 H SER 84 6.283 2.855 0.772 545 HA SER 84 HA SER 84 5.669 5.391 -0.514 546 HB3 SER 84 2HB SER 84 4.012 5.839 1.512 547 HG SER 84 HG SER 84 3.546 4.395 -0.882 548 HA PRO 85 HA PRO 85 8.434 6.884 2.750 549 HB3 PRO 85 2HB PRO 85 8.556 8.819 1.443 550 HG3 PRO 85 2HG PRO 85 6.644 9.728 0.398 551 HD3 PRO 85 2HD PRO 85 6.684 7.519 -0.332 552 H VAL 86 H VAL 86 8.332 8.330 4.871 553 HA VAL 86 HA VAL 86 5.831 8.744 6.172 554 HB VAL 86 HB VAL 86 5.991 6.331 6.539 555 HG11 VAL 86 1HG1 VAL 86 7.540 5.259 8.016 556 HG12 VAL 86 2HG1 VAL 86 8.332 5.866 6.565 557 HG13 VAL 86 3HG1 VAL 86 8.523 6.734 8.107 558 HG21 VAL 86 3HG2 VAL 86 5.704 6.373 9.000 559 HG22 VAL 86 1HG2 VAL 86 6.452 7.959 9.090 560 HG23 VAL 86 2HG2 VAL 86 4.896 7.748 8.238 561 H TRP 87 H TRP 87 6.196 10.574 7.565 562 HA TRP 87 HA TRP 87 8.747 10.483 9.086 563 HB3 TRP 87 2HB TRP 87 8.016 12.812 7.332 564 HD1 TRP 87 HD TRP 87 11.039 11.399 9.343 565 HE1 TRP 87 1HE TRP 87 12.497 13.361 10.172 566 HE3 TRP 87 3HE TRP 87 8.396 15.301 7.330 567 HZ2 TRP 87 2HZ TRP 87 12.533 16.212 9.946 568 HZ3 TRP 87 3HZ TRP 87 9.174 17.632 7.654 569 HH2 TRP 87 HH TRP 87 11.248 18.090 8.950 570 H SER 88 H SER 88 5.507 11.436 9.153 571 HA SER 88 HA SER 88 5.974 12.281 11.963 572 HB3 SER 88 2HB SER 88 4.050 13.794 10.181 573 HG SER 88 HG SER 88 5.165 14.266 12.816 574 H GLY 89 H GLY 89 5.148 9.749 10.758 575 HA2 GLY 89 1HA GLY 89 3.815 8.242 12.098 576 HA3 GLY 89 2HA GLY 89 2.525 9.460 12.174 577 H TYR 90 H TYR 90 1.919 10.272 9.762 578 HA TYR 90 HA TYR 90 1.985 8.191 7.727 579 HB3 TYR 90 2HB TYR 90 0.266 7.203 8.905 580 HD1 TYR 90 2HD TYR 90 -0.193 10.849 9.546 581 HD2 TYR 90 1HD TYR 90 -1.907 6.933 10.005 582 HE1 TYR 90 2HE TYR 90 -1.440 11.638 11.513 583 HE2 TYR 90 1HE TYR 90 -3.171 7.697 11.960 584 HH TYR 90 HH TYR 90 -3.821 9.558 13.156 585 HA PRO 91 HA PRO 91 1.121 12.557 6.362 586 HB3 PRO 91 2HB PRO 91 2.879 13.610 7.340 587 HG3 PRO 91 2HG PRO 91 4.972 12.573 7.602 588 HD3 PRO 91 2HD PRO 91 3.589 10.988 8.556 589 H ALA 92 H ALA 92 0.349 10.409 4.798 590 HA ALA 92 HA ALA 92 0.604 11.570 2.260 591 HB1 ALA 92 1HB ALA 92 1.605 8.678 2.576 592 HB2 ALA 92 2HB ALA 92 1.544 9.643 1.078 593 HB3 ALA 92 3HB ALA 92 2.698 10.045 2.313 594 H THR 93 H THR 93 -1.363 10.725 1.078 595 HA THR 93 HA THR 93 -2.636 8.333 2.297 596 HB THR 93 HB THR 93 -4.907 9.394 1.880 597 HG1 THR 93 1HG THR 93 -4.512 11.117 0.712 598 HG21 THR 93 3HG2 THR 93 -5.057 10.669 3.920 599 HG22 THR 93 1HG2 THR 93 -3.290 10.767 4.049 600 HG23 THR 93 2HG2 THR 93 -4.116 9.191 4.174 601 HA PRO 94 HA PRO 94 -2.567 8.246 -2.382 602 HB3 PRO 94 2HB PRO 94 -0.262 8.402 -2.800 603 HG3 PRO 94 2HG PRO 94 1.327 7.734 -1.118 604 HD3 PRO 94 2HD PRO 94 -0.143 9.300 -0.192 605 H ILE 95 H ILE 95 -1.602 5.648 -0.042 606 HA ILE 95 HA ILE 95 -2.667 3.634 -1.768 607 HB ILE 95 HB ILE 95 -2.095 3.154 1.173 608 HG13 ILE 95 2HG1 ILE 95 0.306 2.772 0.550 609 HG21 ILE 95 1HG2 ILE 95 -1.484 1.399 -1.226 610 HG22 ILE 95 2HG2 ILE 95 -1.575 0.990 0.507 611 HG23 ILE 95 3HG2 ILE 95 -3.015 1.372 -0.393 612 HD11 ILE 95 3HD1 ILE 95 1.364 3.745 -1.336 613 HD12 ILE 95 1HD1 ILE 95 0.063 2.746 -1.986 614 HD13 ILE 95 2HD1 ILE 95 -0.123 4.493 -1.917 615 H LYS 96 H LYS 96 -4.147 5.713 0.502 616 HA LYS 96 HA LYS 96 -6.196 4.256 1.636 617 HB3 LYS 96 2HB LYS 96 -6.248 7.142 0.595 618 HG3 LYS 96 2HG LYS 96 -8.531 6.399 1.147 619 HD3 LYS 96 2HD LYS 96 -7.471 4.880 3.243 620 HE3 LYS 96 2HE LYS 96 -7.189 6.970 4.654 621 HZ1 LYS 96 3HZ LYS 96 -9.291 7.972 5.410 622 HZ2 LYS 96 1HZ LYS 96 -10.108 7.142 4.241 623 HZ3 LYS 96 2HZ LYS 96 -8.977 8.267 3.830 624 H THR 97 H THR 97 -6.521 6.055 -1.522 625 HA THR 97 HA THR 97 -9.086 4.985 -1.988 626 HB THR 97 HB THR 97 -7.006 5.948 -3.988 627 HG1 THR 97 1HG THR 97 -8.926 7.559 -2.721 628 HG21 THR 97 3HG2 THR 97 -8.988 6.827 -5.248 629 HG22 THR 97 1HG2 THR 97 -10.063 6.042 -4.074 630 HG23 THR 97 2HG2 THR 97 -9.015 5.058 -5.112 631 H LEU 98 H LEU 98 -5.823 3.773 -2.949 632 HA LEU 98 HA LEU 98 -6.724 1.840 -4.807 633 HB3 LEU 98 2HB LEU 98 -4.266 1.386 -3.090 634 HG LEU 98 HG LEU 98 -3.163 0.775 -5.074 635 HD11 LEU 98 1HD1 LEU 98 -5.921 -0.394 -5.551 636 HD12 LEU 98 2HD1 LEU 98 -4.762 -0.974 -4.323 637 HD13 LEU 98 3HD1 LEU 98 -4.365 -1.050 -6.044 638 HD21 LEU 98 3HD2 LEU 98 -4.033 1.094 -7.336 639 HD22 LEU 98 1HD2 LEU 98 -3.982 2.630 -6.476 640 HD23 LEU 98 2HD2 LEU 98 -5.530 1.773 -6.709 641 H LEU 99 H LEU 99 -5.997 1.535 -1.316 642 HA LEU 99 HA LEU 99 -6.586 -1.203 -0.956 643 HB3 LEU 99 2HB LEU 99 -7.333 -0.309 1.436 644 HG LEU 99 HG LEU 99 -4.602 0.077 0.188 645 HD11 LEU 99 1HD1 LEU 99 -5.126 0.320 3.167 646 HD12 LEU 99 2HD1 LEU 99 -4.946 1.719 2.091 647 HD13 LEU 99 3HD1 LEU 99 -3.613 0.573 2.280 648 HD21 LEU 99 3HD2 LEU 99 -3.988 -1.867 1.581 649 HD22 LEU 99 1HD2 LEU 99 -5.323 -2.247 0.483 650 HD23 LEU 99 2HD2 LEU 99 -5.653 -1.946 2.201 651 H ASP 100 H ASP 100 -8.761 1.577 -1.276 652 HA ASP 100 HA ASP 100 -11.080 -0.008 -0.565 653 HB3 ASP 100 2HB ASP 100 -11.495 2.667 -1.779 654 H GLN 101 H GLN 101 -9.358 0.418 -3.453 655 HA GLN 101 HA GLN 101 -11.647 -0.374 -5.161 656 HB3 GLN 101 2HB GLN 101 -9.895 -0.512 -6.920 657 HG3 GLN 101 2HG GLN 101 -9.877 2.103 -5.355 658 HE21 GLN 101 1HE2 GLN 101 -10.057 3.915 -7.362 659 HE22 GLN 101 2HE2 GLN 101 -8.716 3.769 -8.476 660 H MET 102 H MET 102 -8.791 -1.770 -3.499 661 HA MET 102 HA MET 102 -8.830 -4.285 -4.823 662 HB3 MET 102 2HB MET 102 -7.296 -4.972 -3.011 663 HG3 MET 102 2HG MET 102 -6.045 -2.438 -3.221 664 HE1 MET 102 3HE MET 102 -3.672 -5.566 -2.902 665 HE2 MET 102 1HE MET 102 -4.266 -4.073 -2.131 666 HE3 MET 102 2HE MET 102 -5.330 -5.486 -2.322 667 H LYS 103 H LYS 103 -11.461 -3.516 -3.291 668 HA LYS 103 HA LYS 103 -11.714 -5.029 -0.928 669 HB3 LYS 103 2HB LYS 103 -14.183 -4.792 -1.392 670 HG3 LYS 103 2HG LYS 103 -14.350 -2.346 -1.993 671 HD3 LYS 103 2HD LYS 103 -13.980 -3.090 0.459 672 HE3 LYS 103 2HE LYS 103 -11.222 -2.153 -0.368 673 HZ1 LYS 103 3HZ LYS 103 -10.784 -1.552 1.953 674 HZ2 LYS 103 1HZ LYS 103 -12.361 -1.722 2.330 675 HZ3 LYS 103 2HZ LYS 103 -11.931 -0.550 1.306 676 H ASN 104 H ASN 104 -11.741 -6.216 -4.148 677 HA ASN 104 HA ASN 104 -12.973 -8.844 -3.423 678 HB3 ASN 104 2HB ASN 104 -14.394 -7.635 -4.965 679 HD21 ASN 104 1HD2 ASN 104 -13.799 -5.378 -5.454 680 HD22 ASN 104 2HD2 ASN 104 -12.730 -5.027 -6.773 681 H TYR 105 H TYR 105 -10.032 -7.632 -3.559 682 HA TYR 105 HA TYR 105 -8.604 -9.222 -5.460 683 HB3 TYR 105 2HB TYR 105 -7.945 -7.875 -2.817 684 HD1 TYR 105 1HD TYR 105 -6.268 -9.256 -5.937 685 HD2 TYR 105 2HD TYR 105 -5.923 -8.123 -1.765 686 HE1 TYR 105 1HE TYR 105 -4.016 -10.195 -5.880 687 HE2 TYR 105 2HE TYR 105 -3.593 -8.982 -1.752 688 HH TYR 105 HH TYR 105 -2.232 -10.799 -4.437 689 H ARG 106 H ARG 106 -7.319 -11.135 -4.997 690 HA ARG 106 HA ARG 106 -8.024 -12.792 -2.671 691 HB3 ARG 106 2HB ARG 106 -7.932 -14.757 -4.309 692 HG3 ARG 106 2HG ARG 106 -10.272 -13.791 -5.458 693 HD3 ARG 106 2HD ARG 106 -11.358 -14.609 -3.240 694 HE ARG 106 HE ARG 106 -9.988 -16.303 -5.173 695 HH11 ARG 106 1HH1 ARG 106 -11.961 -16.343 -2.251 696 HH12 ARG 106 2HH1 ARG 106 -13.105 -17.520 -2.811 697 HH21 ARG 106 1HH2 ARG 106 -11.593 -17.750 -6.029 698 HH22 ARG 106 2HH2 ARG 106 -12.884 -18.362 -5.030 699 H GLY 107 H GLY 107 -6.000 -12.926 -1.707 700 HA2 GLY 107 1HA GLY 107 -3.655 -13.861 -2.391 701 HA3 GLY 107 2HA GLY 107 -3.678 -12.424 -3.418 702 H GLU 108 H GLU 108 -1.811 -11.781 -2.086 703 HA GLU 108 HA GLU 108 -2.474 -11.294 0.770 704 HB3 GLU 108 2HB GLU 108 0.052 -11.757 1.047 705 HG3 GLU 108 2HG GLU 108 -1.718 -13.974 -0.092 706 H VAL 109 H VAL 109 -1.929 -9.408 1.783 707 HA VAL 109 HA VAL 109 -0.768 -7.300 0.002 708 HB VAL 109 HB VAL 109 -2.527 -6.949 2.445 709 HG11 VAL 109 1HG1 VAL 109 -1.695 -5.021 0.230 710 HG12 VAL 109 2HG1 VAL 109 -2.849 -4.659 1.538 711 HG13 VAL 109 3HG1 VAL 109 -1.151 -4.964 1.920 712 HG21 VAL 109 3HG2 VAL 109 -3.230 -6.961 -0.537 713 HG22 VAL 109 1HG2 VAL 109 -3.866 -8.058 0.708 714 HG23 VAL 109 2HG2 VAL 109 -4.308 -6.357 0.736 715 H ALA 110 H ALA 110 1.141 -6.420 0.456 716 HA ALA 110 HA ALA 110 1.997 -6.205 3.289 717 HB1 ALA 110 1HB ALA 110 3.290 -8.086 2.499 718 HB2 ALA 110 2HB ALA 110 3.698 -7.245 0.999 719 HB3 ALA 110 3HB ALA 110 4.367 -6.671 2.531 720 H SER 111 H SER 111 3.592 -4.332 3.534 721 HA SER 111 HA SER 111 3.394 -2.370 1.386 722 HB3 SER 111 2HB SER 111 2.116 -1.851 4.091 723 HG SER 111 HG SER 111 1.958 0.133 3.409 724 H PHE 112 H PHE 112 5.536 -2.022 1.223 725 HA PHE 112 HA PHE 112 7.230 -2.163 3.594 726 HB3 PHE 112 2HB PHE 112 7.958 -3.385 1.631 727 HD1 PHE 112 1HD PHE 112 6.373 -2.835 -0.432 728 HD2 PHE 112 2HD PHE 112 10.021 -0.724 0.489 729 HE1 PHE 112 1HE PHE 112 6.539 -2.118 -2.775 730 HE2 PHE 112 2HE PHE 112 10.202 -0.040 -1.883 731 HZ PHE 112 HZ PHE 112 8.464 -0.724 -3.527 732 H PHE 113 H PHE 113 8.181 -0.351 4.501 733 HA PHE 113 HA PHE 113 7.546 2.277 3.219 734 HB3 PHE 113 2HB PHE 113 6.505 2.332 5.251 735 HD1 PHE 113 1HD PHE 113 6.188 0.012 6.238 736 HD2 PHE 113 2HD PHE 113 9.596 2.477 7.163 737 HE1 PHE 113 1HE PHE 113 6.607 -1.324 8.271 738 HE2 PHE 113 2HE PHE 113 10.034 1.126 9.174 739 HZ PHE 113 HZ PHE 113 8.528 -0.787 9.759 740 H THR 114 H THR 114 9.195 3.722 2.821 741 HA THR 114 HA THR 114 11.945 2.574 3.000 742 HB THR 114 HB THR 114 12.402 3.840 0.964 743 HG1 THR 114 1HG THR 114 11.046 5.495 0.988 744 HG21 THR 114 3HG2 THR 114 11.229 2.456 -0.590 745 HG22 THR 114 1HG2 THR 114 9.902 2.158 0.557 746 HG23 THR 114 2HG2 THR 114 11.515 1.485 0.861 747 H SER 115 H SER 115 10.643 4.228 5.135 748 HA SER 115 HA SER 115 12.672 6.349 5.420 749 HB3 SER 115 2HB SER 115 10.500 7.754 6.135 750 HG SER 115 HG SER 115 11.940 8.233 4.343 751 H ALA 116 H ALA 116 12.999 6.828 7.671 752 HA ALA 116 HA ALA 116 11.178 5.714 9.678 753 HB1 ALA 116 1HB ALA 116 14.053 4.703 9.572 754 HB2 ALA 116 2HB ALA 116 12.812 4.267 10.757 755 HB3 ALA 116 3HB ALA 116 12.629 3.757 9.071 756 H GLY 117 H GLY 117 13.046 8.239 8.802 757 HA2 GLY 117 1HA GLY 117 14.935 8.858 10.516 758 HA3 GLY 117 2HA GLY 117 13.848 10.092 9.874 759 H THR 118 H THR 118 11.487 9.676 11.330 760 HA THR 118 HA THR 118 12.287 9.729 14.202 761 HB THR 118 HB THR 118 10.586 11.699 14.280 762 HG1 THR 118 1HG THR 118 10.715 12.887 12.248 763 HG21 THR 118 3HG2 THR 118 13.266 12.136 12.897 764 HG22 THR 118 1HG2 THR 118 13.012 11.917 14.644 765 HG23 THR 118 2HG2 THR 118 12.319 13.315 13.816 766 H ASN 119 H ASN 119 10.441 8.179 11.965 767 HA ASN 119 HA ASN 119 8.314 7.390 13.910 768 HB3 ASN 119 2HB ASN 119 6.952 7.717 11.492 769 HD21 ASN 119 1HD2 ASN 119 5.881 7.187 13.719 770 HD22 ASN 119 2HD2 ASN 119 5.309 8.576 14.663 771 H HIS 120 H HIS 120 9.164 5.412 14.120 772 HA HIS 120 HA HIS 120 8.912 3.621 11.780 773 HB3 HIS 120 2HB HIS 120 10.573 3.252 14.282 774 HD1 HIS 120 1HD HIS 120 11.964 0.907 14.327 775 HD2 HIS 120 2HD HIS 120 9.164 1.407 11.196 776 HE1 HIS 120 1HE HIS 120 11.712 -1.334 13.224 777 H LYS 121 H LYS 121 8.642 2.965 15.304 778 HA LYS 121 HA LYS 121 6.826 0.907 15.038 779 HB3 LYS 121 2HB LYS 121 6.028 1.580 17.388 780 HG3 LYS 121 2HG LYS 121 8.749 1.599 18.119 781 HD3 LYS 121 2HD LYS 121 8.406 -0.851 18.510 782 HE3 LYS 121 2HE LYS 121 6.129 1.008 19.317 783 HZ1 LYS 121 3HZ LYS 121 6.652 -1.710 20.357 784 HZ2 LYS 121 1HZ LYS 121 5.333 -1.223 19.485 785 HZ3 LYS 121 2HZ LYS 121 5.571 -0.612 20.951 786 H ALA 122 H ALA 122 5.922 4.364 15.051 787 HA ALA 122 HA ALA 122 3.181 3.990 15.686 788 HB1 ALA 122 1HB ALA 122 4.621 6.172 15.554 789 HB2 ALA 122 2HB ALA 122 4.145 6.194 13.843 790 HB3 ALA 122 3HB ALA 122 2.904 6.216 15.081 791 H TYR 123 H TYR 123 4.687 4.423 12.528 792 HA TYR 123 HA TYR 123 2.665 4.301 10.749 793 HB3 TYR 123 2HB TYR 123 5.389 3.037 10.381 794 HD1 TYR 123 1HD TYR 123 3.618 5.681 8.400 795 HD2 TYR 123 2HD TYR 123 4.788 1.504 8.543 796 HE1 TYR 123 1HE TYR 123 3.265 5.519 5.987 797 HE2 TYR 123 2HE TYR 123 4.364 1.358 6.118 798 HH TYR 123 HH TYR 123 3.507 4.192 4.106 799 H VAL 124 H VAL 124 4.329 1.457 12.170 800 HA VAL 124 HA VAL 124 3.077 -0.534 10.627 801 HB VAL 124 HB VAL 124 4.052 -0.605 13.516 802 HG11 VAL 124 1HG1 VAL 124 2.682 -2.559 13.059 803 HG12 VAL 124 2HG1 VAL 124 3.583 -2.892 11.567 804 HG13 VAL 124 3HG1 VAL 124 4.378 -3.032 13.152 805 HG21 VAL 124 3HG2 VAL 124 5.892 0.144 12.142 806 HG22 VAL 124 1HG2 VAL 124 6.156 -1.573 12.461 807 HG23 VAL 124 2HG2 VAL 124 5.531 -1.052 10.888 808 H SER 125 H SER 125 2.070 0.939 13.720 809 HA SER 125 HA SER 125 -0.430 -0.503 13.951 810 HB3 SER 125 2HB SER 125 -0.030 2.124 15.320 811 HG SER 125 HG SER 125 -0.072 -0.493 16.416 812 H HIS 126 H HIS 126 0.563 2.739 12.732 813 HA HIS 126 HA HIS 126 -2.044 3.766 12.296 814 HB3 HIS 126 2HB HIS 126 -0.879 5.235 10.636 815 HD1 HIS 126 1HD HIS 126 1.466 6.809 11.383 816 HD2 HIS 126 2HD HIS 126 -1.083 5.009 14.199 817 HE1 HIS 126 1HE HIS 126 1.603 8.234 13.559 818 H PHE 127 H PHE 127 0.081 1.833 10.122 819 HA PHE 127 HA PHE 127 -1.542 2.169 7.811 820 HB3 PHE 127 2HB PHE 127 0.450 0.019 8.603 821 HD1 PHE 127 1HD PHE 127 -1.512 1.410 5.677 822 HD2 PHE 127 2HD PHE 127 0.762 -1.864 7.263 823 HE1 PHE 127 1HE PHE 127 -2.073 0.079 3.682 824 HE2 PHE 127 2HE PHE 127 0.067 -3.284 5.329 825 HZ PHE 127 HZ PHE 127 -1.352 -2.308 3.530 826 H ASN 128 H ASN 128 -1.561 -0.186 10.458 827 HA ASN 128 HA ASN 128 -3.494 -2.040 9.490 828 HB3 ASN 128 2HB ASN 128 -4.103 -2.099 12.072 829 HD21 ASN 128 1HD2 ASN 128 -0.524 -2.121 11.444 830 HD22 ASN 128 2HD2 ASN 128 -0.464 -3.865 11.459 831 H GLU 129 H GLU 129 -4.034 0.916 11.485 832 HA GLU 129 HA GLU 129 -6.786 0.865 11.451 833 HB3 GLU 129 2HB GLU 129 -6.716 3.268 11.806 834 HG3 GLU 129 2HG GLU 129 -5.166 3.536 13.621 835 H TRP 130 H TRP 130 -4.708 1.911 8.789 836 HA TRP 130 HA TRP 130 -7.014 3.017 7.272 837 HB3 TRP 130 2HB TRP 130 -5.171 3.998 5.861 838 HD1 TRP 130 HD TRP 130 -6.536 4.571 9.273 839 HE1 TRP 130 1HE TRP 130 -6.280 7.007 9.918 840 HE3 TRP 130 3HE TRP 130 -3.226 5.993 5.636 841 HZ2 TRP 130 2HZ TRP 130 -4.670 9.276 9.077 842 HZ3 TRP 130 3HZ TRP 130 -2.289 8.281 5.642 843 HH2 TRP 130 HH TRP 130 -2.998 9.934 7.334 844 H ALA 131 H ALA 131 -5.990 0.045 7.625 845 HA ALA 131 HA ALA 131 -6.342 -0.594 4.720 846 HB1 ALA 131 1HB ALA 131 -4.505 -2.027 6.683 847 HB2 ALA 131 2HB ALA 131 -4.775 -2.464 4.986 848 HB3 ALA 131 3HB ALA 131 -3.970 -0.928 5.391 849 H ASP 132 H ASP 132 -6.904 -1.360 8.036 850 HA ASP 132 HA ASP 132 -7.550 -3.785 8.403 851 HB3 ASP 132 2HB ASP 132 -9.201 -1.489 9.387 852 H GLY 133 H GLY 133 -8.313 -4.516 6.479 853 HA2 GLY 133 1HA GLY 133 -10.942 -5.616 6.454 854 HA3 GLY 133 2HA GLY 133 -10.944 -4.158 5.445 855 H LEU 134 H LEU 134 -7.906 -4.862 4.741 856 HA LEU 134 HA LEU 134 -8.328 -7.031 2.806 857 HB3 LEU 134 2HB LEU 134 -5.973 -6.055 2.216 858 HG LEU 134 HG LEU 134 -7.003 -3.878 1.347 859 HD11 LEU 134 1HD1 LEU 134 -6.523 -5.795 -0.122 860 HD12 LEU 134 2HD1 LEU 134 -8.142 -5.201 -0.552 861 HD13 LEU 134 3HD1 LEU 134 -7.971 -6.639 0.457 862 HD21 LEU 134 3HD2 LEU 134 -9.325 -3.741 0.866 863 HD22 LEU 134 1HD2 LEU 134 -9.092 -3.786 2.615 864 HD23 LEU 134 2HD2 LEU 134 -9.665 -5.239 1.756 865 H ASN 135 H ASN 135 -6.451 -8.603 2.591 866 HA ASN 135 HA ASN 135 -5.803 -9.667 5.238 867 HB3 ASN 135 2HB ASN 135 -5.093 -10.803 2.505 868 HD21 ASN 135 1HD2 ASN 135 -3.304 -11.869 3.617 869 HD22 ASN 135 2HD2 ASN 135 -3.617 -13.281 4.593 870 H VAL 136 H VAL 136 -4.183 -8.385 6.096 871 HA VAL 136 HA VAL 136 -1.675 -8.079 4.515 872 HB VAL 136 HB VAL 136 -2.634 -6.727 7.036 873 HG11 VAL 136 1HG1 VAL 136 0.136 -6.510 5.761 874 HG12 VAL 136 2HG1 VAL 136 -0.517 -5.408 6.998 875 HG13 VAL 136 3HG1 VAL 136 -0.248 -7.097 7.402 876 HG21 VAL 136 3HG2 VAL 136 -2.434 -4.684 5.687 877 HG22 VAL 136 1HG2 VAL 136 -1.758 -5.609 4.327 878 HG23 VAL 136 2HG2 VAL 136 -3.445 -5.841 4.824 879 H ILE 137 H ILE 137 0.118 -9.175 4.977 880 HA ILE 137 HA ILE 137 0.198 -10.921 7.430 881 HB ILE 137 HB ILE 137 1.413 -12.575 6.211 882 HG13 ILE 137 2HG1 ILE 137 1.467 -12.542 3.681 883 HG21 ILE 137 1HG2 ILE 137 -0.489 -13.279 4.640 884 HG22 ILE 137 2HG2 ILE 137 -0.772 -13.081 6.377 885 HG23 ILE 137 3HG2 ILE 137 -1.321 -11.830 5.281 886 HD11 ILE 137 3HD1 ILE 137 0.453 -10.264 3.218 887 HD12 ILE 137 1HD1 ILE 137 1.882 -9.566 4.011 888 HD13 ILE 137 2HD1 ILE 137 2.067 -10.548 2.552 889 H GLY 138 H GLY 138 1.756 -8.202 6.216 890 HA2 GLY 138 1HA GLY 138 3.530 -8.311 8.368 891 HA3 GLY 138 2HA GLY 138 4.462 -8.801 6.953 892 H VAL 139 H VAL 139 4.872 -6.450 8.529 893 HA VAL 139 HA VAL 139 4.529 -4.236 6.620 894 HB VAL 139 HB VAL 139 3.573 -4.283 9.515 895 HG11 VAL 139 1HG1 VAL 139 4.217 -2.035 7.640 896 HG12 VAL 139 2HG1 VAL 139 2.934 -1.837 8.857 897 HG13 VAL 139 3HG1 VAL 139 4.601 -2.225 9.346 898 HG21 VAL 139 3HG2 VAL 139 1.405 -3.595 8.559 899 HG22 VAL 139 1HG2 VAL 139 2.074 -3.780 6.912 900 HG23 VAL 139 2HG2 VAL 139 1.873 -5.178 7.993 901 H ALA 140 H ALA 140 6.731 -4.032 6.243 902 HA ALA 140 HA ALA 140 8.515 -3.571 8.522 903 HB1 ALA 140 1HB ALA 140 8.751 -5.991 8.075 904 HB2 ALA 140 2HB ALA 140 9.137 -5.652 6.368 905 HB3 ALA 140 3HB ALA 140 10.224 -5.112 7.658 906 H ARG 141 H ARG 141 10.800 -2.938 7.381 907 HA ARG 141 HA ARG 141 10.114 -0.961 5.288 908 HB3 ARG 141 2HB ARG 141 11.201 -0.022 7.279 909 HG3 ARG 141 2HG ARG 141 13.692 -1.613 6.563 910 HD3 ARG 141 2HD ARG 141 12.910 0.372 8.742 911 HE ARG 141 HE ARG 141 15.513 -0.848 9.005 912 HH11 ARG 141 1HH1 ARG 141 12.105 -1.100 10.063 913 HH12 ARG 141 2HH1 ARG 141 12.387 -2.364 11.173 914 HH21 ARG 141 1HH2 ARG 141 15.931 -2.409 10.680 915 HH22 ARG 141 2HH2 ARG 141 14.586 -3.051 11.574 916 H ASP 142 H ASP 142 11.778 -0.668 3.663 917 HA ASP 142 HA ASP 142 12.930 -1.409 1.876 918 HB3 ASP 142 2HB ASP 142 15.067 -2.489 2.367 919 H ASP 143 H ASP 143 14.344 -3.985 1.587 920 HA ASP 143 HA ASP 143 12.061 -5.742 1.006 921 HB3 ASP 143 2HB ASP 143 12.790 -4.803 -1.036 922 H SER 144 H SER 144 12.822 -6.168 3.381 923 HA SER 144 HA SER 144 14.895 -8.310 3.379 924 HB3 SER 144 2HB SER 144 14.308 -6.374 5.631 925 HG SER 144 HG SER 144 15.253 -8.539 5.982 926 H GLU 145 H GLU 145 11.597 -7.904 3.546 927 HA GLU 145 HA GLU 145 11.431 -10.567 4.882 928 HB3 GLU 145 2HB GLU 145 9.231 -10.007 5.722 929 HG3 GLU 145 2HG GLU 145 10.989 -7.774 6.739 930 H VAL 146 H VAL 146 11.562 -9.451 1.940 931 HA VAL 146 HA VAL 146 8.946 -9.996 0.812 932 HB VAL 146 HB VAL 146 11.695 -9.909 -0.496 933 HG11 VAL 146 1HG1 VAL 146 8.923 -9.432 -1.678 934 HG12 VAL 146 2HG1 VAL 146 10.506 -9.373 -2.519 935 HG13 VAL 146 3HG1 VAL 146 9.906 -10.897 -1.906 936 HG21 VAL 146 3HG2 VAL 146 11.140 -7.551 -1.073 937 HG22 VAL 146 1HG2 VAL 146 9.686 -7.647 -0.053 938 HG23 VAL 146 2HG2 VAL 146 11.303 -7.785 0.665 939 H ASP 147 H ASP 147 11.654 -11.871 1.807 940 HA ASP 147 HA ASP 147 11.264 -14.239 0.323 941 HB3 ASP 147 2HB ASP 147 12.270 -14.823 3.001 942 H LYS 148 H LYS 148 9.178 -12.976 2.689 943 HA LYS 148 HA LYS 148 7.863 -15.630 3.037 944 HB3 LYS 148 2HB LYS 148 8.531 -14.890 5.220 945 HG3 LYS 148 2HG LYS 148 6.989 -12.352 4.600 946 HD3 LYS 148 2HD LYS 148 8.243 -13.002 7.256 947 HE3 LYS 148 2HE LYS 148 5.872 -11.214 6.575 948 HZ1 LYS 148 3HZ LYS 148 6.270 -11.191 8.870 949 HZ2 LYS 148 1HZ LYS 148 7.142 -9.856 8.325 950 HZ3 LYS 148 2HZ LYS 148 7.896 -11.247 8.701 951 H TRP 149 H TRP 149 7.456 -12.223 2.091 952 HA TRP 149 HA TRP 149 4.595 -12.511 1.580 953 HB3 TRP 149 2HB TRP 149 4.819 -10.297 0.631 954 HD1 TRP 149 HD TRP 149 4.685 -11.296 3.768 955 HE1 TRP 149 1HE TRP 149 5.311 -9.602 5.570 956 HE3 TRP 149 3HE TRP 149 7.441 -8.079 0.925 957 HZ2 TRP 149 2HZ TRP 149 6.884 -7.163 5.786 958 HZ3 TRP 149 3HZ TRP 149 8.346 -6.003 1.892 959 HH2 TRP 149 HH TRP 149 8.118 -5.542 4.330 960 H SER 150 H SER 150 5.724 -14.594 0.514 961 HA SER 150 HA SER 150 5.261 -14.591 -2.323 962 HB3 SER 150 2HB SER 150 8.166 -14.899 -1.442 963 HG SER 150 HG SER 150 7.039 -14.404 -3.986 964 H LYS 151 H LYS 151 6.088 -16.262 0.672 965 HA LYS 151 HA LYS 151 6.284 -18.862 -0.785 966 HB3 LYS 151 2HB LYS 151 7.956 -19.456 0.921 967 HG3 LYS 151 2HG LYS 151 9.810 -17.993 0.362 968 HD3 LYS 151 2HD LYS 151 8.043 -18.301 -2.105 969 HE3 LYS 151 2HE LYS 151 10.278 -18.546 -3.195 970 HZ1 LYS 151 3HZ LYS 151 9.153 -16.321 -3.152 971 HZ2 LYS 151 1HZ LYS 151 10.784 -16.262 -3.279 972 HZ3 LYS 151 2HZ LYS 151 10.086 -15.915 -1.864 Start of MODEL 2 1 H1 GLY 1 H GLY 1 -3.410 -26.865 -11.657 2 HA2 GLY 1 1HA GLY 1 -1.178 -25.319 -12.847 3 HA3 GLY 1 2HA GLY 1 -2.883 -24.837 -12.892 4 H MET 2 H MET 2 0.020 -24.288 -11.310 5 HA MET 2 HA MET 2 -1.363 -22.838 -9.199 6 HB3 MET 2 2HB MET 2 -0.832 -24.633 -7.868 7 HG3 MET 2 2HG MET 2 0.656 -25.951 -9.353 8 HE1 MET 2 3HE MET 2 3.164 -24.427 -6.698 9 HE2 MET 2 1HE MET 2 4.327 -23.588 -7.751 10 HE3 MET 2 2HE MET 2 2.680 -22.960 -7.587 11 H ALA 3 H ALA 3 -0.616 -20.806 -9.176 12 HA ALA 3 HA ALA 3 2.025 -20.077 -10.075 13 HB1 ALA 3 1HB ALA 3 1.315 -18.651 -11.948 14 HB2 ALA 3 2HB ALA 3 1.130 -20.383 -12.308 15 HB3 ALA 3 3HB ALA 3 -0.306 -19.401 -11.914 16 H LYS 4 H LYS 4 2.273 -18.841 -8.339 17 HA LYS 4 HA LYS 4 0.262 -16.736 -7.696 18 HB3 LYS 4 2HB LYS 4 1.102 -17.728 -5.753 19 HG3 LYS 4 2HG LYS 4 3.857 -17.097 -6.823 20 HD3 LYS 4 2HD LYS 4 3.390 -15.784 -4.768 21 HE3 LYS 4 2HE LYS 4 3.324 -18.526 -3.424 22 HZ1 LYS 4 3HZ LYS 4 3.058 -15.901 -2.088 23 HZ2 LYS 4 1HZ LYS 4 4.456 -16.814 -2.138 24 HZ3 LYS 4 2HZ LYS 4 3.180 -17.379 -1.389 25 H LYS 5 H LYS 5 0.530 -14.680 -8.433 26 HA LYS 5 HA LYS 5 3.011 -13.970 -9.911 27 HB3 LYS 5 2HB LYS 5 1.890 -12.495 -11.336 28 HG3 LYS 5 2HG LYS 5 1.283 -14.914 -11.915 29 HD3 LYS 5 2HD LYS 5 -1.542 -13.902 -11.531 30 HE3 LYS 5 2HE LYS 5 -2.044 -16.324 -11.378 31 HZ1 LYS 5 3HZ LYS 5 -1.468 -16.888 -13.666 32 HZ2 LYS 5 1HZ LYS 5 -0.411 -15.656 -13.781 33 HZ3 LYS 5 2HZ LYS 5 -2.021 -15.368 -13.596 34 H THR 6 H THR 6 3.242 -11.611 -9.811 35 HA THR 6 HA THR 6 2.230 -10.459 -7.263 36 HB THR 6 HB THR 6 5.155 -10.499 -8.025 37 HG1 THR 6 1HG THR 6 4.761 -12.452 -7.308 38 HG21 THR 6 3HG2 THR 6 4.745 -8.476 -6.791 39 HG22 THR 6 1HG2 THR 6 5.440 -9.625 -5.656 40 HG23 THR 6 2HG2 THR 6 3.704 -9.315 -5.627 41 H LEU 7 H LEU 7 2.053 -8.184 -7.173 42 HA LEU 7 HA LEU 7 3.060 -6.640 -9.510 43 HB3 LEU 7 2HB LEU 7 0.446 -6.153 -8.020 44 HG LEU 7 HG LEU 7 1.471 -4.106 -9.167 45 HD11 LEU 7 1HD1 LEU 7 2.538 -5.140 -11.113 46 HD12 LEU 7 2HD1 LEU 7 1.260 -4.040 -11.652 47 HD13 LEU 7 3HD1 LEU 7 0.986 -5.794 -11.664 48 HD21 LEU 7 3HD2 LEU 7 -0.959 -4.374 -8.773 49 HD22 LEU 7 1HD2 LEU 7 -1.126 -5.185 -10.341 50 HD23 LEU 7 2HD2 LEU 7 -0.624 -3.475 -10.256 51 H ILE 8 H ILE 8 4.165 -4.811 -8.888 52 HA ILE 8 HA ILE 8 4.057 -4.018 -6.005 53 HB ILE 8 HB ILE 8 6.433 -3.832 -7.846 54 HG13 ILE 8 2HG1 ILE 8 5.632 -6.118 -6.255 55 HG21 ILE 8 1HG2 ILE 8 7.722 -3.168 -5.866 56 HG22 ILE 8 2HG2 ILE 8 6.414 -2.033 -6.223 57 HG23 ILE 8 3HG2 ILE 8 6.234 -3.194 -4.895 58 HD11 ILE 8 3HD1 ILE 8 6.760 -6.117 -8.551 59 HD12 ILE 8 1HD1 ILE 8 8.300 -5.783 -7.709 60 HD13 ILE 8 2HD1 ILE 8 7.419 -7.251 -7.332 61 H LEU 9 H LEU 9 2.591 -2.408 -6.176 62 HA LEU 9 HA LEU 9 2.842 -0.403 -8.369 63 HB3 LEU 9 2HB LEU 9 0.876 0.649 -7.039 64 HG LEU 9 HG LEU 9 0.259 -2.056 -8.246 65 HD11 LEU 9 1HD1 LEU 9 -1.524 -1.105 -6.789 66 HD12 LEU 9 2HD1 LEU 9 -2.010 -1.140 -8.480 67 HD13 LEU 9 3HD1 LEU 9 -1.510 0.395 -7.741 68 HD21 LEU 9 3HD2 LEU 9 -0.227 -0.935 -10.306 69 HD22 LEU 9 1HD2 LEU 9 1.383 -0.390 -9.831 70 HD23 LEU 9 2HD2 LEU 9 -0.007 0.674 -9.617 71 H TYR 10 H TYR 10 3.816 1.548 -8.044 72 HA TYR 10 HA TYR 10 4.171 2.508 -5.242 73 HB3 TYR 10 2HB TYR 10 6.301 1.556 -5.771 74 HD1 TYR 10 2HD TYR 10 6.424 4.359 -8.255 75 HD2 TYR 10 1HD TYR 10 6.687 0.110 -7.633 76 HE1 TYR 10 2HE TYR 10 7.485 4.126 -10.463 77 HE2 TYR 10 1HE TYR 10 7.689 -0.136 -9.903 78 HH TYR 10 HH TYR 10 7.673 2.155 -12.276 79 H TYR 11 H TYR 11 3.936 4.801 -5.031 80 HA TYR 11 HA TYR 11 2.628 6.165 -7.304 81 HB3 TYR 11 2HB TYR 11 2.350 7.867 -5.385 82 HD1 TYR 11 2HD TYR 11 1.412 4.361 -4.503 83 HD2 TYR 11 1HD TYR 11 0.101 8.324 -5.554 84 HE1 TYR 11 2HE TYR 11 -0.944 3.664 -4.143 85 HE2 TYR 11 1HE TYR 11 -2.243 7.648 -5.217 86 HH TYR 11 HH TYR 11 -3.302 5.719 -3.554 87 H SER 12 H SER 12 4.770 6.116 -8.454 88 HA SER 12 HA SER 12 6.091 8.621 -8.093 89 HB3 SER 12 2HB SER 12 7.782 6.110 -7.771 90 HG SER 12 HG SER 12 9.412 7.546 -7.287 91 H TRP 13 H TRP 13 7.633 8.920 -9.912 92 HA TRP 13 HA TRP 13 7.050 7.267 -12.315 93 HB3 TRP 13 2HB TRP 13 8.616 9.865 -11.890 94 HD1 TRP 13 HD TRP 13 10.292 9.698 -13.905 95 HE1 TRP 13 1HE TRP 13 9.993 9.878 -16.445 96 HE3 TRP 13 3HE TRP 13 5.286 8.737 -14.163 97 HZ2 TRP 13 2HZ TRP 13 7.799 9.669 -18.356 98 HZ3 TRP 13 3HZ TRP 13 4.104 8.739 -16.345 99 HH2 TRP 13 HH TRP 13 5.353 9.220 -18.444 100 H SER 14 H SER 14 10.210 8.800 -11.545 101 HA SER 14 HA SER 14 11.486 6.128 -11.312 102 HB3 SER 14 2HB SER 14 13.295 7.023 -12.634 103 HG SER 14 HG SER 14 11.284 6.286 -13.741 104 H GLY 15 H GLY 15 10.617 8.394 -9.331 105 HA2 GLY 15 1HA GLY 15 13.246 8.862 -8.001 106 HA3 GLY 15 2HA GLY 15 11.835 9.882 -7.862 107 H GLU 16 H GLU 16 12.604 9.435 -5.571 108 HA GLU 16 HA GLU 16 12.402 8.576 -3.541 109 HB3 GLU 16 2HB GLU 16 9.538 8.174 -3.716 110 HG3 GLU 16 2HG GLU 16 10.792 9.145 -1.739 111 H THR 17 H THR 17 9.846 6.300 -4.799 112 HA THR 17 HA THR 17 10.979 4.148 -3.241 113 HB THR 17 HB THR 17 9.335 2.874 -4.957 114 HG1 THR 17 1HG THR 17 8.800 4.518 -6.257 115 HG21 THR 17 3HG2 THR 17 8.986 2.888 -2.573 116 HG22 THR 17 1HG2 THR 17 7.471 3.322 -3.375 117 HG23 THR 17 2HG2 THR 17 8.460 4.572 -2.584 118 H LYS 18 H LYS 18 11.576 5.291 -6.498 119 HA LYS 18 HA LYS 18 11.590 3.164 -7.973 120 HB3 LYS 18 2HB LYS 18 13.511 5.502 -8.142 121 HG3 LYS 18 2HG LYS 18 13.393 5.015 -10.637 122 HD3 LYS 18 2HD LYS 18 15.029 2.762 -9.525 123 HE3 LYS 18 2HE LYS 18 15.688 5.096 -11.364 124 HZ1 LYS 18 3HZ LYS 18 17.519 3.518 -10.501 125 HZ2 LYS 18 1HZ LYS 18 17.385 3.792 -12.105 126 HZ3 LYS 18 2HZ LYS 18 16.788 2.398 -11.515 127 H LYS 19 H LYS 19 14.708 3.757 -6.244 128 HA LYS 19 HA LYS 19 15.981 1.454 -7.376 129 HB3 LYS 19 2HB LYS 19 17.297 3.151 -6.237 130 HG3 LYS 19 2HG LYS 19 15.877 2.251 -3.687 131 HD3 LYS 19 2HD LYS 19 18.281 2.454 -3.242 132 HE3 LYS 19 2HE LYS 19 17.859 5.096 -4.553 133 HZ1 LYS 19 3HZ LYS 19 19.423 6.169 -3.105 134 HZ2 LYS 19 1HZ LYS 19 19.500 4.879 -2.113 135 HZ3 LYS 19 2HZ LYS 19 18.087 5.723 -2.223 136 H MET 20 H MET 20 13.838 1.849 -4.667 137 HA MET 20 HA MET 20 13.972 -0.848 -3.663 138 HB3 MET 20 2HB MET 20 12.170 1.321 -2.559 139 HG3 MET 20 2HG MET 20 12.922 0.736 -0.426 140 HE1 MET 20 3HE MET 20 14.637 -1.940 -2.188 141 HE2 MET 20 1HE MET 20 14.464 -2.768 -0.654 142 HE3 MET 20 2HE MET 20 13.620 -3.409 -2.069 143 H ALA 21 H ALA 21 12.871 -0.366 -6.315 144 HA ALA 21 HA ALA 21 10.221 -1.649 -5.923 145 HB1 ALA 21 1HB ALA 21 9.339 -0.492 -7.891 146 HB2 ALA 21 2HB ALA 21 9.695 0.652 -6.581 147 HB3 ALA 21 3HB ALA 21 10.785 0.534 -7.985 148 H GLU 22 H GLU 22 12.765 -0.654 -8.249 149 HA GLU 22 HA GLU 22 12.682 -2.827 -10.035 150 HB3 GLU 22 2HB GLU 22 15.070 -2.030 -10.512 151 HG3 GLU 22 2HG GLU 22 14.329 0.477 -10.805 152 H LYS 23 H LYS 23 14.319 -2.460 -6.906 153 HA LYS 23 HA LYS 23 15.888 -4.843 -7.003 154 HB3 LYS 23 2HB LYS 23 14.902 -4.583 -4.305 155 HG3 LYS 23 2HG LYS 23 17.224 -5.200 -5.314 156 HD3 LYS 23 2HD LYS 23 18.715 -3.351 -4.767 157 HE3 LYS 23 2HE LYS 23 16.687 -2.713 -6.943 158 HZ1 LYS 23 3HZ LYS 23 18.291 -1.264 -7.850 159 HZ2 LYS 23 1HZ LYS 23 19.350 -1.550 -6.599 160 HZ3 LYS 23 2HZ LYS 23 17.957 -0.780 -6.294 161 H ILE 24 H ILE 24 12.739 -4.435 -5.435 162 HA ILE 24 HA ILE 24 12.416 -7.048 -4.700 163 HB ILE 24 HB ILE 24 10.404 -4.856 -5.290 164 HG13 ILE 24 2HG1 ILE 24 12.252 -4.495 -3.508 165 HG21 ILE 24 1HG2 ILE 24 10.012 -7.421 -3.678 166 HG22 ILE 24 2HG2 ILE 24 8.833 -6.098 -3.771 167 HG23 ILE 24 3HG2 ILE 24 9.208 -7.028 -5.214 168 HD11 ILE 24 3HD1 ILE 24 10.890 -3.815 -1.622 169 HD12 ILE 24 1HD1 ILE 24 10.221 -3.217 -3.160 170 HD13 ILE 24 2HD1 ILE 24 9.464 -4.585 -2.316 171 H ASN 25 H ASN 25 11.516 -5.490 -7.793 172 HA ASN 25 HA ASN 25 9.995 -7.580 -8.950 173 HB3 ASN 25 2HB ASN 25 11.945 -5.654 -10.198 174 HD21 ASN 25 1HD2 ASN 25 9.257 -8.049 -10.811 175 HD22 ASN 25 2HD2 ASN 25 9.499 -8.129 -12.494 176 H SER 26 H SER 26 13.491 -7.126 -8.746 177 HA SER 26 HA SER 26 14.251 -9.438 -10.295 178 HB3 SER 26 2HB SER 26 16.129 -8.165 -8.334 179 HG SER 26 HG SER 26 16.521 -9.597 -10.293 180 H GLU 27 H GLU 27 12.852 -9.316 -7.232 181 HA GLU 27 HA GLU 27 14.436 -11.578 -6.138 182 HB3 GLU 27 2HB GLU 27 13.661 -10.692 -3.950 183 HG3 GLU 27 2HG GLU 27 15.181 -8.657 -5.633 184 H ILE 28 H ILE 28 11.358 -10.839 -7.459 185 HA ILE 28 HA ILE 28 10.054 -12.992 -5.844 186 HB ILE 28 HB ILE 28 8.817 -10.450 -6.937 187 HG13 ILE 28 2HG1 ILE 28 10.151 -10.052 -4.879 188 HG21 ILE 28 1HG2 ILE 28 7.172 -12.154 -7.124 189 HG22 ILE 28 2HG2 ILE 28 7.574 -12.858 -5.540 190 HG23 ILE 28 3HG2 ILE 28 6.767 -11.314 -5.664 191 HD11 ILE 28 3HD1 ILE 28 7.298 -10.257 -3.863 192 HD12 ILE 28 1HD1 ILE 28 8.562 -9.135 -3.404 193 HD13 ILE 28 2HD1 ILE 28 7.820 -8.987 -5.006 194 H LYS 29 H LYS 29 8.783 -14.435 -6.855 195 HA LYS 29 HA LYS 29 9.258 -14.961 -9.630 196 HB3 LYS 29 2HB LYS 29 6.886 -16.323 -8.561 197 HG3 LYS 29 2HG LYS 29 8.626 -16.982 -10.379 198 HD3 LYS 29 2HD LYS 29 9.999 -18.341 -8.064 199 HE3 LYS 29 2HE LYS 29 10.925 -17.388 -10.769 200 HZ1 LYS 29 3HZ LYS 29 12.989 -18.269 -10.274 201 HZ2 LYS 29 1HZ LYS 29 12.519 -18.894 -8.803 202 HZ3 LYS 29 2HZ LYS 29 12.612 -17.279 -9.043 203 H ASP 30 H ASP 30 8.215 -14.336 -11.344 204 HA ASP 30 HA ASP 30 6.848 -13.242 -12.703 205 HB3 ASP 30 2HB ASP 30 4.608 -14.569 -11.154 206 H SER 31 H SER 31 7.741 -11.506 -10.753 207 HA SER 31 HA SER 31 5.418 -9.928 -9.944 208 HB3 SER 31 2HB SER 31 7.200 -9.944 -8.378 209 HG SER 31 HG SER 31 9.058 -10.406 -9.522 210 H GLU 32 H GLU 32 4.833 -7.976 -10.722 211 HA GLU 32 HA GLU 32 6.224 -6.876 -13.109 212 HB3 GLU 32 2HB GLU 32 3.743 -6.079 -13.610 213 HG3 GLU 32 2HG GLU 32 4.653 -8.926 -14.132 214 H LEU 33 H LEU 33 5.922 -4.700 -13.385 215 HA LEU 33 HA LEU 33 5.869 -3.236 -10.798 216 HB3 LEU 33 2HB LEU 33 7.935 -2.257 -12.621 217 HG LEU 33 HG LEU 33 7.937 -2.181 -10.140 218 HD11 LEU 33 1HD1 LEU 33 7.118 -4.346 -9.678 219 HD12 LEU 33 2HD1 LEU 33 8.770 -4.269 -9.077 220 HD13 LEU 33 3HD1 LEU 33 8.318 -5.147 -10.612 221 HD21 LEU 33 3HD2 LEU 33 9.979 -1.708 -11.414 222 HD22 LEU 33 1HD2 LEU 33 10.320 -3.438 -11.581 223 HD23 LEU 33 2HD2 LEU 33 10.373 -2.663 -9.981 224 H LYS 34 H LYS 34 4.606 -1.391 -10.830 225 HA LYS 34 HA LYS 34 3.880 -0.158 -13.447 226 HB3 LYS 34 2HB LYS 34 1.517 -0.166 -12.067 227 HG3 LYS 34 2HG LYS 34 1.645 -0.819 -14.412 228 HD3 LYS 34 2HD LYS 34 2.691 -3.446 -13.309 229 HE3 LYS 34 2HE LYS 34 0.818 -2.981 -15.682 230 HZ1 LYS 34 3HZ LYS 34 2.628 -4.637 -16.113 231 HZ2 LYS 34 1HZ LYS 34 1.076 -5.166 -16.255 232 HZ3 LYS 34 2HZ LYS 34 1.939 -5.614 -14.975 233 H GLU 35 H GLU 35 3.212 1.992 -13.312 234 HA GLU 35 HA GLU 35 4.267 3.451 -10.936 235 HB3 GLU 35 2HB GLU 35 4.195 5.371 -12.687 236 HG3 GLU 35 2HG GLU 35 6.088 3.022 -12.675 237 H VAL 36 H VAL 36 2.773 4.236 -9.580 238 HA VAL 36 HA VAL 36 -0.026 4.698 -10.468 239 HB VAL 36 HB VAL 36 1.201 4.697 -7.702 240 HG11 VAL 36 1HG1 VAL 36 -1.233 4.678 -7.031 241 HG12 VAL 36 2HG1 VAL 36 -0.628 6.217 -7.657 242 HG13 VAL 36 3HG1 VAL 36 -1.644 5.155 -8.679 243 HG21 VAL 36 3HG2 VAL 36 -0.170 2.677 -7.403 244 HG22 VAL 36 1HG2 VAL 36 -0.640 2.752 -9.112 245 HG23 VAL 36 2HG2 VAL 36 1.061 2.456 -8.659 246 H LYS 37 H LYS 37 -0.900 6.878 -10.174 247 HA LYS 37 HA LYS 37 0.944 9.152 -9.760 248 HB3 LYS 37 2HB LYS 37 -0.387 10.273 -11.667 249 HG3 LYS 37 2HG LYS 37 1.486 7.988 -12.416 250 HD3 LYS 37 2HD LYS 37 0.090 8.793 -14.322 251 HE3 LYS 37 2HE LYS 37 1.634 11.405 -14.058 252 HZ1 LYS 37 3HZ LYS 37 -0.036 12.146 -15.664 253 HZ2 LYS 37 1HZ LYS 37 -0.702 10.649 -15.719 254 HZ3 LYS 37 2HZ LYS 37 0.830 10.928 -16.286 255 H VAL 38 H VAL 38 -0.756 11.214 -9.713 256 HA VAL 38 HA VAL 38 -3.085 10.350 -8.076 257 HB VAL 38 HB VAL 38 -2.900 12.520 -6.859 258 HG11 VAL 38 1HG1 VAL 38 -1.203 11.683 -5.293 259 HG12 VAL 38 2HG1 VAL 38 -2.284 10.386 -5.842 260 HG13 VAL 38 3HG1 VAL 38 -0.634 10.518 -6.501 261 HG21 VAL 38 3HG2 VAL 38 -0.757 13.656 -6.683 262 HG22 VAL 38 1HG2 VAL 38 -0.040 12.600 -7.924 263 HG23 VAL 38 2HG2 VAL 38 -1.344 13.734 -8.330 264 H SER 39 H SER 39 -5.077 11.362 -8.496 265 HA SER 39 HA SER 39 -5.503 12.476 -11.108 266 HB3 SER 39 2HB SER 39 -7.490 13.140 -9.054 267 HG SER 39 HG SER 39 -8.823 12.154 -10.372 268 H GLU 40 H GLU 40 -6.524 14.701 -11.344 269 HA GLU 40 HA GLU 40 -5.941 16.667 -9.286 270 HB3 GLU 40 2HB GLU 40 -4.051 16.935 -10.667 271 HG3 GLU 40 2HG GLU 40 -5.499 17.543 -13.210 272 H GLY 41 H GLY 41 -7.467 18.457 -9.499 273 HA2 GLY 41 1HA GLY 41 -9.974 17.748 -10.950 274 HA3 GLY 41 2HA GLY 41 -9.784 18.914 -9.638 275 H THR 42 H THR 42 -7.254 19.963 -10.979 276 HA THR 42 HA THR 42 -7.817 20.914 -13.559 277 HB THR 42 HB THR 42 -9.319 22.416 -12.164 278 HG1 THR 42 1HG THR 42 -8.712 23.213 -14.028 279 HG21 THR 42 3HG2 THR 42 -6.731 23.602 -11.076 280 HG22 THR 42 1HG2 THR 42 -7.867 22.612 -10.130 281 HG23 THR 42 2HG2 THR 42 -8.384 24.172 -10.788 282 H PHE 43 H PHE 43 -5.863 22.430 -14.121 283 HA PHE 43 HA PHE 43 -3.834 22.925 -12.261 284 HB3 PHE 43 2HB PHE 43 -3.156 20.579 -12.651 285 HD1 PHE 43 2HD PHE 43 -4.648 19.304 -14.199 286 HD2 PHE 43 1HD PHE 43 -1.511 21.828 -15.690 287 HE1 PHE 43 2HE PHE 43 -4.780 18.169 -16.399 288 HE2 PHE 43 1HE PHE 43 -1.633 20.723 -17.886 289 HZ PHE 43 HZ PHE 43 -3.270 18.881 -18.254 290 H ASP 44 H ASP 44 -1.942 23.979 -13.560 291 HA ASP 44 HA ASP 44 -2.490 24.224 -16.404 292 HB3 ASP 44 2HB ASP 44 -2.065 26.806 -14.882 293 H ALA 45 H ALA 45 -0.128 25.835 -14.117 294 HA ALA 45 HA ALA 45 2.028 24.192 -15.341 295 HB1 ALA 45 1HB ALA 45 3.389 26.214 -15.686 296 HB2 ALA 45 2HB ALA 45 1.923 26.229 -16.683 297 HB3 ALA 45 3HB ALA 45 2.006 27.230 -15.220 298 H ASP 46 H ASP 46 1.458 23.248 -13.144 299 HA ASP 46 HA ASP 46 2.138 25.044 -10.875 300 HB3 ASP 46 2HB ASP 46 0.562 23.654 -9.603 301 H MET 47 H MET 47 2.852 21.806 -12.081 302 HA MET 47 HA MET 47 3.946 20.070 -11.329 303 HB3 MET 47 2HB MET 47 6.120 21.911 -10.369 304 HG3 MET 47 2HG MET 47 5.945 19.057 -11.454 305 HE1 MET 47 3HE MET 47 7.728 21.187 -13.262 306 HE2 MET 47 1HE MET 47 9.067 20.077 -13.594 307 HE3 MET 47 2HE MET 47 7.393 19.475 -13.612 308 H TYR 48 H TYR 48 2.303 19.573 -9.971 309 HA TYR 48 HA TYR 48 1.436 18.520 -8.226 310 HB3 TYR 48 2HB TYR 48 2.857 17.663 -6.444 311 HD1 TYR 48 2HD TYR 48 1.923 16.095 -8.446 312 HD2 TYR 48 1HD TYR 48 5.877 17.817 -8.217 313 HE1 TYR 48 2HE TYR 48 2.786 14.338 -9.957 314 HE2 TYR 48 1HE TYR 48 6.737 16.044 -9.732 315 HH TYR 48 HH TYR 48 6.192 13.986 -10.839 316 H LYS 49 H LYS 49 0.190 18.949 -6.435 317 HA LYS 49 HA LYS 49 0.822 21.311 -4.774 318 HB3 LYS 49 2HB LYS 49 -0.398 22.483 -6.309 319 HG3 LYS 49 2HG LYS 49 -2.853 21.567 -6.840 320 HD3 LYS 49 2HD LYS 49 -0.350 20.979 -8.463 321 HE3 LYS 49 2HE LYS 49 -2.043 19.488 -9.350 322 HZ1 LYS 49 3HZ LYS 49 -4.053 20.423 -8.533 323 HZ2 LYS 49 1HZ LYS 49 -4.137 20.495 -10.174 324 HZ3 LYS 49 2HZ LYS 49 -3.801 21.859 -9.354 325 H THR 50 H THR 50 1.218 18.801 -4.047 326 HA THR 50 HA THR 50 -0.728 18.247 -1.903 327 HB THR 50 HB THR 50 -0.136 16.227 -4.120 328 HG1 THR 50 1HG THR 50 -2.681 17.313 -3.638 329 HG21 THR 50 3HG2 THR 50 -0.558 15.120 -1.939 330 HG22 THR 50 1HG2 THR 50 -1.886 14.833 -3.075 331 HG23 THR 50 2HG2 THR 50 -2.069 16.023 -1.768 332 H SER 51 H SER 51 2.146 17.082 -3.771 333 HA SER 51 HA SER 51 2.753 15.103 -1.992 334 HB3 SER 51 2HB SER 51 4.518 14.695 -3.555 335 HG SER 51 HG SER 51 3.554 15.161 -5.562 336 H ASP 52 H ASP 52 3.273 18.187 -1.028 337 HA ASP 52 HA ASP 52 6.183 17.894 -0.505 338 HB3 ASP 52 2HB ASP 52 5.588 19.539 -2.152 339 H ILE 53 H ILE 53 3.202 18.634 1.358 340 HA ILE 53 HA ILE 53 4.974 19.555 3.551 341 HB ILE 53 HB ILE 53 3.284 21.101 2.743 342 HG13 ILE 53 2HG1 ILE 53 4.231 21.002 5.124 343 HG21 ILE 53 1HG2 ILE 53 1.209 19.221 3.946 344 HG22 ILE 53 2HG2 ILE 53 0.917 20.805 3.191 345 HG23 ILE 53 3HG2 ILE 53 1.467 19.459 2.201 346 HD11 ILE 53 3HD1 ILE 53 2.789 22.743 5.985 347 HD12 ILE 53 1HD1 ILE 53 3.077 23.002 4.260 348 HD13 ILE 53 2HD1 ILE 53 1.523 22.334 4.810 349 H ALA 54 H ALA 54 4.590 18.868 5.730 350 HA ALA 54 HA ALA 54 4.238 15.990 5.866 351 HB1 ALA 54 1HB ALA 54 6.020 17.120 7.129 352 HB2 ALA 54 2HB ALA 54 4.809 18.040 8.058 353 HB3 ALA 54 3HB ALA 54 4.921 16.269 8.212 354 H LEU 55 H LEU 55 2.459 18.801 7.451 355 HA LEU 55 HA LEU 55 0.277 17.016 8.168 356 HB3 LEU 55 2HB LEU 55 -0.637 19.200 9.038 357 HG LEU 55 HG LEU 55 0.803 19.631 10.822 358 HD11 LEU 55 1HD1 LEU 55 0.831 17.465 11.905 359 HD12 LEU 55 2HD1 LEU 55 0.867 16.625 10.346 360 HD13 LEU 55 3HD1 LEU 55 -0.564 17.542 10.813 361 HD21 LEU 55 3HD2 LEU 55 2.986 17.835 9.760 362 HD22 LEU 55 1HD2 LEU 55 2.936 18.768 11.263 363 HD23 LEU 55 2HD2 LEU 55 3.001 19.625 9.719 364 H ASP 56 H ASP 56 0.216 16.580 5.581 365 HA ASP 56 HA ASP 56 -1.184 18.694 4.117 366 HB3 ASP 56 2HB ASP 56 -0.699 15.817 3.314 367 H GLN 57 H GLN 57 -2.493 15.318 4.316 368 HA GLN 57 HA GLN 57 -4.997 16.531 5.393 369 HB3 GLN 57 2HB GLN 57 -5.405 16.198 3.151 370 HG3 GLN 57 2HG GLN 57 -5.637 13.662 2.410 371 HE21 GLN 57 1HE2 GLN 57 -2.230 13.822 2.536 372 HE22 GLN 57 2HE2 GLN 57 -2.003 14.954 1.183 373 H ILE 58 H ILE 58 -3.914 16.095 7.400 374 HA ILE 58 HA ILE 58 -4.579 13.348 8.397 375 HB ILE 58 HB ILE 58 -2.372 15.247 9.188 376 HG13 ILE 58 2HG1 ILE 58 -2.609 12.618 7.756 377 HG21 ILE 58 1HG2 ILE 58 -3.270 14.516 11.301 378 HG22 ILE 58 2HG2 ILE 58 -3.414 12.857 10.747 379 HG23 ILE 58 3HG2 ILE 58 -1.813 13.587 11.011 380 HD11 ILE 58 3HD1 ILE 58 -0.361 14.662 7.920 381 HD12 ILE 58 1HD1 ILE 58 -0.497 13.329 6.760 382 HD13 ILE 58 2HD1 ILE 58 -1.645 14.673 6.700 383 H GLN 59 H GLN 59 -4.157 16.722 9.583 384 HA GLN 59 HA GLN 59 -6.383 16.299 11.469 385 HB3 GLN 59 2HB GLN 59 -4.459 16.006 12.653 386 HG3 GLN 59 2HG GLN 59 -3.158 18.560 11.722 387 HE21 GLN 59 1HE2 GLN 59 -2.014 18.991 13.662 388 HE22 GLN 59 2HE2 GLN 59 -1.244 17.751 14.619 389 H GLY 60 H GLY 60 -7.947 17.787 11.288 390 HA2 GLY 60 1HA GLY 60 -9.032 19.725 10.699 391 HA3 GLY 60 2HA GLY 60 -7.462 20.532 10.665 392 H ASN 61 H ASN 61 -7.167 17.989 8.450 393 HA ASN 61 HA ASN 61 -8.683 19.323 6.254 394 HB3 ASN 61 2HB ASN 61 -6.793 18.340 4.769 395 HD21 ASN 61 1HD2 ASN 61 -4.484 19.764 4.643 396 HD22 ASN 61 2HD2 ASN 61 -4.826 21.471 4.671 397 H LYS 62 H LYS 62 -9.889 17.777 5.101 398 HA LYS 62 HA LYS 62 -9.408 14.941 5.575 399 HB3 LYS 62 2HB LYS 62 -11.823 14.557 6.022 400 HG3 LYS 62 2HG LYS 62 -10.019 14.787 7.892 401 HD3 LYS 62 2HD LYS 62 -11.060 17.465 8.004 402 HE3 LYS 62 2HE LYS 62 -11.899 17.485 10.353 403 HZ1 LYS 62 3HZ LYS 62 -13.512 17.458 8.538 404 HZ2 LYS 62 1HZ LYS 62 -14.131 16.737 9.836 405 HZ3 LYS 62 2HZ LYS 62 -13.622 15.822 8.591 406 H ASP 63 H ASP 63 -10.907 13.672 4.093 407 HA ASP 63 HA ASP 63 -11.750 13.089 2.193 408 HB3 ASP 63 2HB ASP 63 -12.044 15.853 1.066 409 H PHE 64 H PHE 64 -10.033 11.969 1.606 410 HA PHE 64 HA PHE 64 -7.480 12.903 0.928 411 HB3 PHE 64 2HB PHE 64 -7.119 10.596 0.084 412 HD1 PHE 64 2HD PHE 64 -6.441 11.486 2.662 413 HD2 PHE 64 1HD PHE 64 -9.712 8.904 1.548 414 HE1 PHE 64 2HE PHE 64 -6.595 10.659 4.996 415 HE2 PHE 64 1HE PHE 64 -9.811 8.034 3.850 416 HZ PHE 64 HZ PHE 64 -8.283 8.951 5.606 417 HA PRO 65 HA PRO 65 -7.845 13.832 -3.485 418 HB3 PRO 65 2HB PRO 65 -5.633 14.551 -3.416 419 HG3 PRO 65 2HG PRO 65 -3.962 13.310 -2.230 420 HD3 PRO 65 2HD PRO 65 -5.662 13.807 -0.665 421 H GLU 66 H GLU 66 -7.937 12.769 -5.599 422 HA GLU 66 HA GLU 66 -8.491 9.860 -5.460 423 HB3 GLU 66 2HB GLU 66 -9.125 10.245 -7.868 424 HG3 GLU 66 2HG GLU 66 -10.630 12.134 -6.031 425 H ILE 67 H ILE 67 -7.588 8.657 -7.494 426 HA ILE 67 HA ILE 67 -4.685 9.252 -7.689 427 HB ILE 67 HB ILE 67 -4.195 6.967 -7.240 428 HG13 ILE 67 2HG1 ILE 67 -6.608 6.183 -8.116 429 HG21 ILE 67 1HG2 ILE 67 -4.365 8.553 -5.329 430 HG22 ILE 67 2HG2 ILE 67 -6.049 8.086 -5.076 431 HG23 ILE 67 3HG2 ILE 67 -4.783 6.898 -4.833 432 HD11 ILE 67 3HD1 ILE 67 -5.229 4.730 -5.845 433 HD12 ILE 67 1HD1 ILE 67 -6.290 4.042 -7.090 434 HD13 ILE 67 2HD1 ILE 67 -4.703 4.698 -7.553 435 H GLN 68 H GLN 68 -3.601 7.884 -9.486 436 HA GLN 68 HA GLN 68 -5.494 7.056 -11.590 437 HB3 GLN 68 2HB GLN 68 -3.898 8.034 -13.307 438 HG3 GLN 68 2HG GLN 68 -4.781 10.214 -13.352 439 HE21 GLN 68 1HE2 GLN 68 -7.398 10.300 -11.553 440 HE22 GLN 68 2HE2 GLN 68 -8.444 9.161 -12.359 441 H LEU 69 H LEU 69 -4.738 5.556 -12.904 442 HA LEU 69 HA LEU 69 -2.141 4.377 -12.750 443 HB3 LEU 69 2HB LEU 69 -3.235 3.575 -10.552 444 HG LEU 69 HG LEU 69 -4.356 1.430 -12.382 445 HD11 LEU 69 1HD1 LEU 69 -4.515 1.773 -9.376 446 HD12 LEU 69 2HD1 LEU 69 -3.389 0.696 -10.240 447 HD13 LEU 69 3HD1 LEU 69 -5.130 0.411 -10.336 448 HD21 LEU 69 3HD2 LEU 69 -5.967 3.293 -12.484 449 HD22 LEU 69 1HD2 LEU 69 -5.917 3.475 -10.716 450 HD23 LEU 69 2HD2 LEU 69 -6.611 2.017 -11.461 451 H ASP 70 H ASP 70 -2.366 2.019 -13.861 452 HA ASP 70 HA ASP 70 -3.712 2.580 -16.416 453 HB3 ASP 70 2HB ASP 70 -2.302 0.051 -16.302 454 H ASN 71 H ASN 71 -4.429 0.272 -17.505 455 HA ASN 71 HA ASN 71 -6.974 -0.132 -16.140 456 HB3 ASN 71 2HB ASN 71 -6.110 -1.558 -18.656 457 HD21 ASN 71 1HD2 ASN 71 -8.180 -2.630 -16.934 458 HD22 ASN 71 2HD2 ASN 71 -9.725 -1.945 -17.343 459 H ILE 72 H ILE 72 -5.547 -1.099 -14.368 460 HA ILE 72 HA ILE 72 -4.587 -3.863 -14.803 461 HB ILE 72 HB ILE 72 -4.261 -2.026 -12.418 462 HG13 ILE 72 2HG1 ILE 72 -3.112 -1.475 -14.784 463 HG21 ILE 72 1HG2 ILE 72 -3.973 -4.352 -11.723 464 HG22 ILE 72 2HG2 ILE 72 -2.855 -4.647 -13.075 465 HG23 ILE 72 3HG2 ILE 72 -2.414 -3.547 -11.753 466 HD11 ILE 72 3HD1 ILE 72 -2.730 -0.222 -12.698 467 HD12 ILE 72 1HD1 ILE 72 -1.523 -1.435 -12.214 468 HD13 ILE 72 2HD1 ILE 72 -1.257 -0.432 -13.661 469 H ASP 73 H ASP 73 -5.558 -5.640 -13.976 470 HA ASP 73 HA ASP 73 -7.932 -5.311 -12.212 471 HB3 ASP 73 2HB ASP 73 -7.332 -7.815 -13.796 472 H TYR 74 H TYR 74 -7.320 -5.589 -10.140 473 HA TYR 74 HA TYR 74 -4.904 -6.821 -9.298 474 HB3 TYR 74 2HB TYR 74 -5.785 -6.676 -7.042 475 HD1 TYR 74 2HD TYR 74 -4.189 -4.732 -8.453 476 HD2 TYR 74 1HD TYR 74 -8.320 -4.424 -7.210 477 HE1 TYR 74 2HE TYR 74 -4.032 -2.258 -8.501 478 HE2 TYR 74 1HE TYR 74 -8.135 -1.967 -7.222 479 HH TYR 74 HH TYR 74 -6.857 -0.194 -8.161 480 H ASN 75 H ASN 75 -8.019 -8.206 -9.995 481 HA ASN 75 HA ASN 75 -7.830 -10.741 -8.730 482 HB3 ASN 75 2HB ASN 75 -9.236 -11.402 -10.904 483 HD21 ASN 75 1HD2 ASN 75 -10.182 -8.309 -9.272 484 HD22 ASN 75 2HD2 ASN 75 -11.160 -9.107 -8.086 485 H ASN 76 H ASN 76 -5.948 -9.505 -11.419 486 HA ASN 76 HA ASN 76 -5.327 -12.172 -12.458 487 HB3 ASN 76 2HB ASN 76 -3.950 -10.933 -14.082 488 HD21 ASN 76 1HD2 ASN 76 -4.853 -9.118 -15.694 489 HD22 ASN 76 2HD2 ASN 76 -6.523 -9.467 -16.141 490 H TYR 77 H TYR 77 -4.311 -10.960 -9.622 491 HA TYR 77 HA TYR 77 -1.649 -12.130 -9.970 492 HB3 TYR 77 2HB TYR 77 -0.588 -10.385 -8.610 493 HD1 TYR 77 1HD TYR 77 0.721 -10.408 -10.803 494 HD2 TYR 77 2HD TYR 77 -2.985 -8.209 -10.362 495 HE1 TYR 77 1HE TYR 77 1.221 -9.161 -12.846 496 HE2 TYR 77 2HE TYR 77 -2.506 -6.998 -12.455 497 HH TYR 77 HH TYR 77 0.509 -7.471 -14.329 498 H ASP 78 H ASP 78 -0.711 -12.715 -7.821 499 HA ASP 78 HA ASP 78 -2.874 -13.496 -5.866 500 HB3 ASP 78 2HB ASP 78 -0.347 -15.020 -6.485 501 H LEU 79 H LEU 79 -0.072 -11.615 -6.216 502 HA LEU 79 HA LEU 79 0.233 -11.366 -3.287 503 HB3 LEU 79 2HB LEU 79 2.654 -11.192 -5.006 504 HG LEU 79 HG LEU 79 3.902 -12.060 -3.342 505 HD11 LEU 79 1HD1 LEU 79 1.652 -10.862 -1.686 506 HD12 LEU 79 2HD1 LEU 79 2.943 -9.953 -2.514 507 HD13 LEU 79 3HD1 LEU 79 3.321 -11.099 -1.213 508 HD21 LEU 79 3HD2 LEU 79 1.412 -13.514 -2.319 509 HD22 LEU 79 1HD2 LEU 79 2.956 -13.483 -1.432 510 HD23 LEU 79 2HD2 LEU 79 2.906 -14.180 -3.065 511 H ILE 80 H ILE 80 0.420 -9.121 -2.752 512 HA ILE 80 HA ILE 80 1.088 -7.235 -4.978 513 HB ILE 80 HB ILE 80 -1.261 -7.077 -3.061 514 HG13 ILE 80 2HG1 ILE 80 -1.641 -8.473 -5.042 515 HG21 ILE 80 1HG2 ILE 80 -0.180 -4.836 -3.247 516 HG22 ILE 80 2HG2 ILE 80 -0.257 -4.951 -5.021 517 HG23 ILE 80 3HG2 ILE 80 -1.736 -4.859 -4.045 518 HD11 ILE 80 3HD1 ILE 80 -3.019 -5.826 -5.583 519 HD12 ILE 80 1HD1 ILE 80 -3.472 -7.416 -6.177 520 HD13 ILE 80 2HD1 ILE 80 -3.567 -7.071 -4.437 521 H LEU 81 H LEU 81 2.687 -5.868 -4.490 522 HA LEU 81 HA LEU 81 3.223 -5.205 -1.645 523 HB3 LEU 81 2HB LEU 81 5.288 -4.059 -2.733 524 HG LEU 81 HG LEU 81 6.696 -5.972 -2.928 525 HD11 LEU 81 1HD1 LEU 81 6.508 -5.153 -0.746 526 HD12 LEU 81 2HD1 LEU 81 6.260 -6.874 -0.569 527 HD13 LEU 81 3HD1 LEU 81 4.873 -5.807 -0.514 528 HD21 LEU 81 3HD2 LEU 81 5.950 -8.264 -2.578 529 HD22 LEU 81 1HD2 LEU 81 5.252 -7.565 -4.031 530 HD23 LEU 81 2HD2 LEU 81 4.256 -7.729 -2.572 531 H ILE 82 H ILE 82 3.339 -3.094 -1.075 532 HA ILE 82 HA ILE 82 2.614 -1.008 -3.040 533 HB ILE 82 HB ILE 82 1.632 -1.160 -0.175 534 HG13 ILE 82 2HG1 ILE 82 0.561 -3.053 -1.415 535 HG21 ILE 82 1HG2 ILE 82 1.433 0.762 -2.432 536 HG22 ILE 82 2HG2 ILE 82 -0.060 0.508 -1.576 537 HG23 ILE 82 3HG2 ILE 82 1.402 1.033 -0.685 538 HD11 ILE 82 3HD1 ILE 82 -1.743 -2.589 -0.782 539 HD12 ILE 82 1HD1 ILE 82 -0.629 -2.144 0.521 540 HD13 ILE 82 2HD1 ILE 82 -1.375 -0.893 -0.490 541 H GLY 83 H GLY 83 3.816 1.015 -2.617 542 HA2 GLY 83 1HA GLY 83 5.557 1.014 -0.198 543 HA3 GLY 83 2HA GLY 83 6.210 1.391 -1.791 544 H SER 84 H SER 84 6.005 3.092 0.686 545 HA SER 84 HA SER 84 5.102 5.563 -0.551 546 HB3 SER 84 2HB SER 84 3.627 4.698 1.964 547 HG SER 84 HG SER 84 2.856 6.596 1.742 548 HA PRO 85 HA PRO 85 8.206 6.909 2.452 549 HB3 PRO 85 2HB PRO 85 8.452 8.821 1.149 550 HG3 PRO 85 2HG PRO 85 6.544 9.940 0.211 551 HD3 PRO 85 2HD PRO 85 6.481 7.687 -0.532 552 H VAL 86 H VAL 86 8.451 7.928 4.649 553 HA VAL 86 HA VAL 86 6.012 8.365 6.225 554 HB VAL 86 HB VAL 86 8.076 6.450 7.321 555 HG11 VAL 86 1HG1 VAL 86 6.560 7.550 8.897 556 HG12 VAL 86 2HG1 VAL 86 5.159 6.961 7.973 557 HG13 VAL 86 3HG1 VAL 86 6.249 5.820 8.797 558 HG21 VAL 86 3HG2 VAL 86 5.665 5.569 5.737 559 HG22 VAL 86 1HG2 VAL 86 7.394 5.327 5.347 560 HG23 VAL 86 2HG2 VAL 86 6.696 4.533 6.767 561 H TRP 87 H TRP 87 6.569 10.252 7.429 562 HA TRP 87 HA TRP 87 9.115 10.106 8.848 563 HB3 TRP 87 2HB TRP 87 8.662 12.648 7.303 564 HD1 TRP 87 HD TRP 87 11.547 10.153 7.869 565 HE1 TRP 87 1HE TRP 87 13.501 11.304 9.046 566 HE3 TRP 87 3HE TRP 87 9.469 14.808 8.441 567 HZ2 TRP 87 2HZ TRP 87 14.058 13.926 10.193 568 HZ3 TRP 87 3HZ TRP 87 10.717 16.582 9.630 569 HH2 TRP 87 HH TRP 87 12.995 16.157 10.514 570 H SER 88 H SER 88 5.949 11.277 8.775 571 HA SER 88 HA SER 88 6.321 12.085 11.595 572 HB3 SER 88 2HB SER 88 5.875 14.161 10.486 573 HG SER 88 HG SER 88 4.008 14.096 8.968 574 H GLY 89 H GLY 89 5.762 9.486 10.520 575 HA2 GLY 89 1HA GLY 89 4.543 7.723 11.466 576 HA3 GLY 89 2HA GLY 89 3.410 8.900 12.153 577 H TYR 90 H TYR 90 2.434 10.275 9.945 578 HA TYR 90 HA TYR 90 1.881 8.482 7.703 579 HB3 TYR 90 2HB TYR 90 0.043 7.701 8.687 580 HD1 TYR 90 2HD TYR 90 0.550 11.011 10.408 581 HD2 TYR 90 1HD TYR 90 -1.786 7.378 10.248 582 HE1 TYR 90 2HE TYR 90 -0.387 11.507 12.624 583 HE2 TYR 90 1HE TYR 90 -2.648 7.851 12.503 584 HH TYR 90 HH TYR 90 -2.686 9.391 14.336 585 HA PRO 91 HA PRO 91 2.485 12.987 6.837 586 HB3 PRO 91 2HB PRO 91 4.769 12.631 6.481 587 HG3 PRO 91 2HG PRO 91 5.576 10.592 5.540 588 HD3 PRO 91 2HD PRO 91 4.324 9.909 7.433 589 H ALA 92 H ALA 92 1.693 10.242 4.702 590 HA ALA 92 HA ALA 92 0.487 12.067 2.687 591 HB1 ALA 92 1HB ALA 92 1.511 10.703 0.987 592 HB2 ALA 92 2HB ALA 92 2.787 11.105 2.133 593 HB3 ALA 92 3HB ALA 92 2.052 9.489 2.170 594 H THR 93 H THR 93 -1.263 11.053 1.408 595 HA THR 93 HA THR 93 -2.346 8.488 2.466 596 HB THR 93 HB THR 93 -4.625 9.556 2.191 597 HG1 THR 93 1HG THR 93 -3.357 11.507 1.156 598 HG21 THR 93 3HG2 THR 93 -2.772 10.566 4.393 599 HG22 THR 93 1HG2 THR 93 -3.954 9.236 4.421 600 HG23 THR 93 2HG2 THR 93 -4.492 10.918 4.344 601 HA PRO 94 HA PRO 94 -2.536 8.454 -2.173 602 HB3 PRO 94 2HB PRO 94 -0.333 8.604 -2.867 603 HG3 PRO 94 2HG PRO 94 1.473 8.282 -1.367 604 HD3 PRO 94 2HD PRO 94 0.033 9.841 -0.399 605 H ILE 95 H ILE 95 -1.307 6.300 0.482 606 HA ILE 95 HA ILE 95 -2.813 4.098 -0.769 607 HB ILE 95 HB ILE 95 -1.228 3.498 1.658 608 HG13 ILE 95 2HG1 ILE 95 0.931 3.363 0.600 609 HG21 ILE 95 1HG2 ILE 95 -2.366 1.811 0.423 610 HG22 ILE 95 2HG2 ILE 95 -1.662 2.344 -1.126 611 HG23 ILE 95 3HG2 ILE 95 -0.643 1.655 0.118 612 HD11 ILE 95 3HD1 ILE 95 -0.262 4.763 -1.827 613 HD12 ILE 95 1HD1 ILE 95 1.467 4.663 -1.487 614 HD13 ILE 95 2HD1 ILE 95 0.541 3.187 -1.796 615 H LYS 96 H LYS 96 -4.516 5.472 -0.261 616 HA LYS 96 HA LYS 96 -5.975 4.333 2.030 617 HB3 LYS 96 2HB LYS 96 -7.230 6.829 1.535 618 HG3 LYS 96 2HG LYS 96 -6.249 7.487 3.781 619 HD3 LYS 96 2HD LYS 96 -7.391 4.666 3.624 620 HE3 LYS 96 2HE LYS 96 -7.627 6.850 5.749 621 HZ1 LYS 96 3HZ LYS 96 -8.943 5.297 6.952 622 HZ2 LYS 96 1HZ LYS 96 -8.710 4.096 5.868 623 HZ3 LYS 96 2HZ LYS 96 -9.609 5.368 5.436 624 H THR 97 H THR 97 -6.475 6.446 -0.895 625 HA THR 97 HA THR 97 -8.840 5.352 -1.614 626 HB THR 97 HB THR 97 -6.734 6.442 -3.524 627 HG1 THR 97 1HG THR 97 -7.584 8.559 -2.680 628 HG21 THR 97 3HG2 THR 97 -8.882 5.881 -4.537 629 HG22 THR 97 1HG2 THR 97 -8.673 7.641 -4.508 630 HG23 THR 97 2HG2 THR 97 -9.744 6.848 -3.330 631 H LEU 98 H LEU 98 -5.595 4.207 -2.729 632 HA LEU 98 HA LEU 98 -6.522 2.364 -4.647 633 HB3 LEU 98 2HB LEU 98 -4.114 1.810 -2.870 634 HG LEU 98 HG LEU 98 -2.939 1.222 -4.843 635 HD11 LEU 98 1HD1 LEU 98 -5.578 -0.207 -5.250 636 HD12 LEU 98 2HD1 LEU 98 -4.418 -0.588 -3.953 637 HD13 LEU 98 3HD1 LEU 98 -3.969 -0.772 -5.662 638 HD21 LEU 98 3HD2 LEU 98 -3.765 2.838 -6.385 639 HD22 LEU 98 1HD2 LEU 98 -5.330 1.975 -6.501 640 HD23 LEU 98 2HD2 LEU 98 -3.846 1.222 -7.099 641 H LEU 99 H LEU 99 -6.027 1.958 -1.161 642 HA LEU 99 HA LEU 99 -6.347 -0.855 -0.971 643 HB3 LEU 99 2HB LEU 99 -7.092 -0.362 1.421 644 HG LEU 99 HG LEU 99 -4.576 0.990 0.380 645 HD11 LEU 99 1HD1 LEU 99 -5.327 2.083 2.506 646 HD12 LEU 99 2HD1 LEU 99 -3.789 1.233 2.661 647 HD13 LEU 99 3HD1 LEU 99 -5.272 0.511 3.304 648 HD21 LEU 99 3HD2 LEU 99 -5.019 -1.589 1.933 649 HD22 LEU 99 1HD2 LEU 99 -3.443 -0.955 1.402 650 HD23 LEU 99 2HD2 LEU 99 -4.638 -1.493 0.202 651 H ASP 100 H ASP 100 -8.805 1.754 -0.928 652 HA ASP 100 HA ASP 100 -10.978 -0.119 -0.533 653 HB3 ASP 100 2HB ASP 100 -11.508 2.601 -1.621 654 H GLN 101 H GLN 101 -9.131 0.553 -3.257 655 HA GLN 101 HA GLN 101 -11.287 -0.293 -5.132 656 HB3 GLN 101 2HB GLN 101 -9.677 -0.016 -6.894 657 HG3 GLN 101 2HG GLN 101 -9.420 2.518 -5.245 658 HE21 GLN 101 1HE2 GLN 101 -9.264 4.492 -6.660 659 HE22 GLN 101 2HE2 GLN 101 -9.050 4.276 -8.368 660 H MET 102 H MET 102 -8.891 -1.706 -3.040 661 HA MET 102 HA MET 102 -8.582 -4.104 -4.752 662 HB3 MET 102 2HB MET 102 -7.051 -4.870 -3.043 663 HG3 MET 102 2HG MET 102 -6.538 -1.993 -3.812 664 HE1 MET 102 3HE MET 102 -5.057 -5.303 -1.965 665 HE2 MET 102 1HE MET 102 -4.437 -5.197 -3.625 666 HE3 MET 102 2HE MET 102 -3.338 -4.963 -2.249 667 H LYS 103 H LYS 103 -11.190 -3.247 -3.158 668 HA LYS 103 HA LYS 103 -11.717 -4.762 -0.914 669 HB3 LYS 103 2HB LYS 103 -14.104 -4.821 -1.711 670 HG3 LYS 103 2HG LYS 103 -14.167 -2.269 -2.565 671 HD3 LYS 103 2HD LYS 103 -14.973 -3.330 -0.285 672 HE3 LYS 103 2HE LYS 103 -12.569 -1.623 0.481 673 HZ1 LYS 103 3HZ LYS 103 -13.435 -1.404 2.459 674 HZ2 LYS 103 1HZ LYS 103 -13.939 -2.977 2.568 675 HZ3 LYS 103 2HZ LYS 103 -14.893 -1.860 1.830 676 H ASN 104 H ASN 104 -11.945 -5.822 -4.313 677 HA ASN 104 HA ASN 104 -12.467 -8.629 -3.460 678 HB3 ASN 104 2HB ASN 104 -13.528 -8.877 -5.659 679 HD21 ASN 104 1HD2 ASN 104 -14.692 -5.607 -5.292 680 HD22 ASN 104 2HD2 ASN 104 -15.876 -5.976 -4.043 681 H TYR 105 H TYR 105 -9.926 -7.849 -3.222 682 HA TYR 105 HA TYR 105 -8.510 -9.296 -5.413 683 HB3 TYR 105 2HB TYR 105 -7.715 -7.707 -2.946 684 HD1 TYR 105 2HD TYR 105 -5.971 -9.093 -6.005 685 HD2 TYR 105 1HD TYR 105 -5.956 -8.522 -1.713 686 HE1 TYR 105 2HE TYR 105 -3.801 -10.221 -5.871 687 HE2 TYR 105 1HE TYR 105 -3.751 -9.658 -1.586 688 HH TYR 105 HH TYR 105 -2.183 -11.075 -4.416 689 H ARG 106 H ARG 106 -6.990 -11.089 -4.738 690 HA ARG 106 HA ARG 106 -7.848 -12.757 -2.452 691 HB3 ARG 106 2HB ARG 106 -7.540 -14.708 -3.956 692 HG3 ARG 106 2HG ARG 106 -9.768 -13.328 -5.330 693 HD3 ARG 106 2HD ARG 106 -10.067 -15.649 -3.484 694 HE ARG 106 HE ARG 106 -11.394 -14.571 -5.846 695 HH11 ARG 106 1HH1 ARG 106 -11.127 -17.421 -3.702 696 HH12 ARG 106 2HH1 ARG 106 -12.511 -18.203 -4.377 697 HH21 ARG 106 1HH2 ARG 106 -13.087 -15.711 -6.847 698 HH22 ARG 106 2HH2 ARG 106 -13.581 -17.272 -6.268 699 H GLY 107 H GLY 107 -5.977 -13.629 -1.470 700 HA2 GLY 107 1HA GLY 107 -3.772 -14.618 -1.904 701 HA3 GLY 107 2HA GLY 107 -3.406 -13.241 -2.932 702 H GLU 108 H GLU 108 -2.032 -11.837 -1.928 703 HA GLU 108 HA GLU 108 -2.069 -11.585 1.035 704 HB3 GLU 108 2HB GLU 108 0.463 -11.923 0.734 705 HG3 GLU 108 2HG GLU 108 -1.388 -14.276 0.234 706 H VAL 109 H VAL 109 -1.944 -9.432 1.539 707 HA VAL 109 HA VAL 109 -0.460 -7.698 -0.419 708 HB VAL 109 HB VAL 109 -2.272 -6.583 1.684 709 HG11 VAL 109 1HG1 VAL 109 -2.428 -4.735 0.007 710 HG12 VAL 109 2HG1 VAL 109 -0.754 -5.042 0.476 711 HG13 VAL 109 3HG1 VAL 109 -1.351 -5.638 -1.075 712 HG21 VAL 109 3HG2 VAL 109 -3.761 -8.113 0.431 713 HG22 VAL 109 1HG2 VAL 109 -4.118 -6.431 0.059 714 HG23 VAL 109 2HG2 VAL 109 -3.187 -7.406 -1.101 715 H ALA 110 H ALA 110 1.409 -6.732 0.211 716 HA ALA 110 HA ALA 110 1.836 -6.248 3.098 717 HB1 ALA 110 1HB ALA 110 3.380 -8.120 2.354 718 HB2 ALA 110 2HB ALA 110 4.086 -6.963 1.193 719 HB3 ALA 110 3HB ALA 110 4.217 -6.657 2.919 720 H SER 111 H SER 111 3.309 -4.349 3.382 721 HA SER 111 HA SER 111 3.295 -2.465 1.101 722 HB3 SER 111 2HB SER 111 1.922 -1.960 3.761 723 HG SER 111 HG SER 111 2.653 -0.155 2.184 724 H PHE 112 H PHE 112 5.508 -2.054 1.148 725 HA PHE 112 HA PHE 112 6.979 -2.199 3.701 726 HB3 PHE 112 2HB PHE 112 7.705 -3.543 1.742 727 HD1 PHE 112 1HD PHE 112 6.421 -2.997 -0.461 728 HD2 PHE 112 2HD PHE 112 9.867 -0.757 0.890 729 HE1 PHE 112 1HE PHE 112 6.656 -2.010 -2.690 730 HE2 PHE 112 2HE PHE 112 10.096 0.210 -1.390 731 HZ PHE 112 HZ PHE 112 8.481 -0.394 -3.170 732 H PHE 113 H PHE 113 8.482 -0.416 4.336 733 HA PHE 113 HA PHE 113 7.925 2.172 2.926 734 HB3 PHE 113 2HB PHE 113 6.836 2.415 4.974 735 HD1 PHE 113 2HD PHE 113 10.166 2.627 6.625 736 HD2 PHE 113 1HD PHE 113 6.414 0.572 6.368 737 HE1 PHE 113 2HE PHE 113 10.588 1.568 8.836 738 HE2 PHE 113 1HE PHE 113 6.908 -0.629 8.491 739 HZ PHE 113 HZ PHE 113 8.999 -0.157 9.709 740 H THR 114 H THR 114 9.535 3.663 2.688 741 HA THR 114 HA THR 114 12.232 2.599 2.563 742 HB THR 114 HB THR 114 12.418 4.940 1.377 743 HG1 THR 114 1HG THR 114 10.206 5.484 0.597 744 HG21 THR 114 3HG2 THR 114 11.446 4.066 -0.687 745 HG22 THR 114 1HG2 THR 114 10.520 2.851 0.223 746 HG23 THR 114 2HG2 THR 114 12.291 2.773 0.169 747 H SER 115 H SER 115 10.494 4.491 4.889 748 HA SER 115 HA SER 115 12.975 5.723 5.963 749 HB3 SER 115 2HB SER 115 11.554 7.854 6.095 750 HG SER 115 HG SER 115 13.155 7.155 4.401 751 H ALA 116 H ALA 116 12.895 6.208 8.168 752 HA ALA 116 HA ALA 116 10.604 5.130 9.731 753 HB1 ALA 116 1HB ALA 116 12.070 3.215 8.989 754 HB2 ALA 116 2HB ALA 116 13.424 3.970 9.857 755 HB3 ALA 116 3HB ALA 116 11.998 3.414 10.751 756 H GLY 117 H GLY 117 12.740 7.581 9.417 757 HA2 GLY 117 1HA GLY 117 14.718 7.557 11.124 758 HA3 GLY 117 2HA GLY 117 13.838 9.061 10.801 759 H THR 118 H THR 118 11.732 9.304 12.168 760 HA THR 118 HA THR 118 12.282 8.436 14.953 761 HB THR 118 HB THR 118 10.934 11.033 14.409 762 HG1 THR 118 1HG THR 118 12.489 11.854 13.418 763 HG21 THR 118 3HG2 THR 118 12.166 11.691 16.441 764 HG22 THR 118 1HG2 THR 118 13.082 10.166 16.401 765 HG23 THR 118 2HG2 THR 118 11.335 10.157 16.723 766 H ASN 119 H ASN 119 10.385 7.672 12.486 767 HA ASN 119 HA ASN 119 8.095 7.106 14.243 768 HB3 ASN 119 2HB ASN 119 6.782 7.598 11.894 769 HD21 ASN 119 1HD2 ASN 119 5.939 7.375 14.510 770 HD22 ASN 119 2HD2 ASN 119 5.176 8.908 14.866 771 H HIS 120 H HIS 120 8.696 5.034 14.360 772 HA HIS 120 HA HIS 120 8.612 3.387 11.869 773 HB3 HIS 120 2HB HIS 120 10.244 3.085 14.430 774 HD1 HIS 120 1HD HIS 120 10.953 0.574 14.906 775 HD2 HIS 120 2HD HIS 120 10.005 1.494 10.906 776 HE1 HIS 120 1HE HIS 120 11.490 -1.498 13.535 777 H LYS 121 H LYS 121 8.319 2.941 15.439 778 HA LYS 121 HA LYS 121 6.509 0.776 15.253 779 HB3 LYS 121 2HB LYS 121 6.000 1.260 17.651 780 HG3 LYS 121 2HG LYS 121 8.364 1.341 18.568 781 HD3 LYS 121 2HD LYS 121 9.212 -0.765 17.471 782 HE3 LYS 121 2HE LYS 121 6.287 -0.874 18.312 783 HZ1 LYS 121 3HZ LYS 121 7.139 -2.970 17.531 784 HZ2 LYS 121 1HZ LYS 121 6.909 -3.044 19.118 785 HZ3 LYS 121 2HZ LYS 121 8.442 -2.913 18.548 786 H ALA 122 H ALA 122 5.729 4.333 15.443 787 HA ALA 122 HA ALA 122 2.964 4.036 15.741 788 HB1 ALA 122 1HB ALA 122 4.402 6.106 14.026 789 HB2 ALA 122 2HB ALA 122 2.802 6.247 14.776 790 HB3 ALA 122 3HB ALA 122 4.235 6.199 15.798 791 H TYR 123 H TYR 123 4.934 3.935 12.733 792 HA TYR 123 HA TYR 123 2.760 4.261 10.955 793 HB3 TYR 123 2HB TYR 123 5.523 3.047 10.582 794 HD1 TYR 123 2HD TYR 123 3.620 5.374 8.374 795 HD2 TYR 123 1HD TYR 123 4.952 1.305 8.980 796 HE1 TYR 123 2HE TYR 123 2.803 4.776 6.137 797 HE2 TYR 123 1HE TYR 123 4.112 0.699 6.775 798 HH TYR 123 HH TYR 123 2.697 1.397 5.086 799 H VAL 124 H VAL 124 4.313 1.292 12.225 800 HA VAL 124 HA VAL 124 2.867 -0.594 10.700 801 HB VAL 124 HB VAL 124 4.010 -0.802 13.519 802 HG11 VAL 124 1HG1 VAL 124 2.524 -2.710 13.030 803 HG12 VAL 124 2HG1 VAL 124 3.386 -3.007 11.509 804 HG13 VAL 124 3HG1 VAL 124 4.213 -3.225 13.068 805 HG21 VAL 124 3HG2 VAL 124 5.330 -1.460 10.840 806 HG22 VAL 124 1HG2 VAL 124 5.783 -0.099 11.895 807 HG23 VAL 124 2HG2 VAL 124 6.027 -1.754 12.432 808 H SER 125 H SER 125 1.919 1.182 13.638 809 HA SER 125 HA SER 125 -0.552 -0.314 14.034 810 HB3 SER 125 2HB SER 125 0.493 2.285 15.195 811 HG SER 125 HG SER 125 -1.818 0.759 15.788 812 H HIS 126 H HIS 126 0.342 2.973 12.877 813 HA HIS 126 HA HIS 126 -2.155 3.985 12.226 814 HB3 HIS 126 2HB HIS 126 -0.975 5.273 10.431 815 HD1 HIS 126 1HD HIS 126 1.450 6.822 11.083 816 HD2 HIS 126 2HD HIS 126 -1.123 5.207 13.973 817 HE1 HIS 126 1HE HIS 126 1.632 8.341 13.177 818 H PHE 127 H PHE 127 -0.085 1.921 10.155 819 HA PHE 127 HA PHE 127 -1.891 1.931 7.949 820 HB3 PHE 127 2HB PHE 127 0.362 0.035 8.717 821 HD1 PHE 127 1HD PHE 127 -1.459 1.540 5.741 822 HD2 PHE 127 2HD PHE 127 0.415 -1.931 7.477 823 HE1 PHE 127 1HE PHE 127 -2.035 0.217 3.726 824 HE2 PHE 127 2HE PHE 127 -0.140 -3.242 5.408 825 HZ PHE 127 HZ PHE 127 -1.362 -2.153 3.573 826 H ASN 128 H ASN 128 -1.785 -0.102 10.868 827 HA ASN 128 HA ASN 128 -3.429 -2.267 9.880 828 HB3 ASN 128 2HB ASN 128 -4.204 -2.122 12.461 829 HD21 ASN 128 1HD2 ASN 128 -0.687 -2.459 11.594 830 HD22 ASN 128 2HD2 ASN 128 -0.771 -4.204 11.538 831 H GLU 129 H GLU 129 -4.164 0.853 11.436 832 HA GLU 129 HA GLU 129 -6.961 0.504 11.430 833 HB3 GLU 129 2HB GLU 129 -7.126 2.755 12.054 834 HG3 GLU 129 2HG GLU 129 -5.445 3.222 13.631 835 H TRP 130 H TRP 130 -4.784 2.090 9.067 836 HA TRP 130 HA TRP 130 -6.976 3.038 7.441 837 HB3 TRP 130 2HB TRP 130 -5.019 3.727 5.954 838 HD1 TRP 130 HD TRP 130 -6.624 4.583 9.205 839 HE1 TRP 130 1HE TRP 130 -6.352 7.040 9.723 840 HE3 TRP 130 3HE TRP 130 -2.998 5.734 5.768 841 HZ2 TRP 130 2HZ TRP 130 -4.911 9.327 8.617 842 HZ3 TRP 130 3HZ TRP 130 -2.106 8.037 5.626 843 HH2 TRP 130 HH TRP 130 -3.083 9.848 7.012 844 H ALA 131 H ALA 131 -5.613 -0.036 7.704 845 HA ALA 131 HA ALA 131 -6.222 -0.675 4.840 846 HB1 ALA 131 1HB ALA 131 -4.736 -2.586 5.103 847 HB2 ALA 131 2HB ALA 131 -3.890 -1.092 5.551 848 HB3 ALA 131 3HB ALA 131 -4.486 -2.190 6.814 849 H ASP 132 H ASP 132 -7.460 -1.014 7.943 850 HA ASP 132 HA ASP 132 -8.382 -3.516 8.359 851 HB3 ASP 132 2HB ASP 132 -9.622 -0.810 8.865 852 H GLY 133 H GLY 133 -9.210 -4.894 6.988 853 HA2 GLY 133 1HA GLY 133 -11.478 -5.473 5.959 854 HA3 GLY 133 2HA GLY 133 -11.242 -4.040 4.967 855 H LEU 134 H LEU 134 -8.133 -5.114 5.127 856 HA LEU 134 HA LEU 134 -8.472 -7.219 3.042 857 HB3 LEU 134 2HB LEU 134 -6.428 -6.222 1.974 858 HG LEU 134 HG LEU 134 -8.850 -4.407 2.090 859 HD11 LEU 134 1HD1 LEU 134 -7.814 -3.285 0.163 860 HD12 LEU 134 2HD1 LEU 134 -6.358 -4.294 0.325 861 HD13 LEU 134 3HD1 LEU 134 -6.816 -3.137 1.606 862 HD21 LEU 134 3HD2 LEU 134 -7.874 -6.312 -0.086 863 HD22 LEU 134 1HD2 LEU 134 -9.331 -5.292 -0.115 864 HD23 LEU 134 2HD2 LEU 134 -9.226 -6.622 1.030 865 H ASN 135 H ASN 135 -7.000 -8.791 3.044 866 HA ASN 135 HA ASN 135 -5.662 -9.617 5.386 867 HB3 ASN 135 2HB ASN 135 -5.215 -10.407 2.475 868 HD21 ASN 135 1HD2 ASN 135 -3.527 -11.750 2.316 869 HD22 ASN 135 2HD2 ASN 135 -3.013 -12.925 3.513 870 H VAL 136 H VAL 136 -4.070 -8.280 6.222 871 HA VAL 136 HA VAL 136 -1.816 -7.478 4.467 872 HB VAL 136 HB VAL 136 -2.390 -6.817 7.396 873 HG11 VAL 136 1HG1 VAL 136 -0.165 -5.853 5.544 874 HG12 VAL 136 2HG1 VAL 136 -0.548 -5.144 7.123 875 HG13 VAL 136 3HG1 VAL 136 0.003 -6.809 7.042 876 HG21 VAL 136 3HG2 VAL 136 -2.560 -4.919 5.024 877 HG22 VAL 136 1HG2 VAL 136 -3.954 -5.591 5.917 878 HG23 VAL 136 2HG2 VAL 136 -2.825 -4.519 6.722 879 H ILE 137 H ILE 137 -0.028 -8.724 4.470 880 HA ILE 137 HA ILE 137 0.442 -10.565 6.765 881 HB ILE 137 HB ILE 137 1.310 -12.231 5.204 882 HG13 ILE 137 2HG1 ILE 137 0.243 -10.445 2.963 883 HG21 ILE 137 1HG2 ILE 137 -1.021 -12.314 5.992 884 HG22 ILE 137 2HG2 ILE 137 -1.517 -11.367 4.574 885 HG23 ILE 137 3HG2 ILE 137 -0.837 -12.994 4.362 886 HD11 ILE 137 3HD1 ILE 137 2.425 -10.857 1.872 887 HD12 ILE 137 1HD1 ILE 137 2.683 -10.003 3.390 888 HD13 ILE 137 2HD1 ILE 137 2.981 -11.753 3.291 889 H GLY 138 H GLY 138 1.624 -7.751 5.682 890 HA2 GLY 138 1HA GLY 138 4.182 -8.299 6.908 891 HA3 GLY 138 2HA GLY 138 4.313 -8.146 5.150 892 H VAL 139 H VAL 139 4.593 -6.439 7.946 893 HA VAL 139 HA VAL 139 4.439 -3.887 6.467 894 HB VAL 139 HB VAL 139 3.444 -4.179 9.323 895 HG11 VAL 139 1HG1 VAL 139 3.242 -1.861 7.356 896 HG12 VAL 139 2HG1 VAL 139 2.582 -1.900 8.997 897 HG13 VAL 139 3HG1 VAL 139 4.341 -1.930 8.747 898 HG21 VAL 139 3HG2 VAL 139 1.805 -5.265 7.880 899 HG22 VAL 139 1HG2 VAL 139 1.202 -3.725 8.460 900 HG23 VAL 139 2HG2 VAL 139 1.800 -3.867 6.775 901 H ALA 140 H ALA 140 6.655 -4.142 6.135 902 HA ALA 140 HA ALA 140 8.396 -3.976 8.527 903 HB1 ALA 140 1HB ALA 140 10.045 -5.376 7.424 904 HB2 ALA 140 2HB ALA 140 8.501 -6.239 7.421 905 HB3 ALA 140 3HB ALA 140 9.093 -5.435 5.949 906 H ARG 141 H ARG 141 10.403 -2.680 8.112 907 HA ARG 141 HA ARG 141 10.297 -0.653 6.039 908 HB3 ARG 141 2HB ARG 141 12.704 -1.672 7.623 909 HG3 ARG 141 2HG ARG 141 12.234 1.105 6.463 910 HD3 ARG 141 2HD ARG 141 14.409 -0.232 8.071 911 HE ARG 141 HE ARG 141 15.378 0.400 5.896 912 HH11 ARG 141 1HH1 ARG 141 15.497 2.583 8.667 913 HH12 ARG 141 2HH1 ARG 141 16.495 3.779 7.896 914 HH21 ARG 141 1HH2 ARG 141 17.027 1.754 5.022 915 HH22 ARG 141 2HH2 ARG 141 17.671 3.066 5.897 916 H ASP 142 H ASP 142 11.277 -0.707 4.167 917 HA ASP 142 HA ASP 142 12.023 -1.510 2.169 918 HB3 ASP 142 2HB ASP 142 13.790 -0.328 3.192 919 H ASP 143 H ASP 143 14.285 -3.468 1.867 920 HA ASP 143 HA ASP 143 12.603 -5.617 0.929 921 HB3 ASP 143 2HB ASP 143 14.291 -4.947 -0.581 922 H SER 144 H SER 144 13.576 -5.088 3.975 923 HA SER 144 HA SER 144 15.140 -7.200 4.791 924 HB3 SER 144 2HB SER 144 12.958 -6.354 6.654 925 HG SER 144 HG SER 144 14.785 -7.149 7.551 926 H GLU 145 H GLU 145 11.820 -7.703 3.660 927 HA GLU 145 HA GLU 145 11.823 -10.394 4.992 928 HB3 GLU 145 2HB GLU 145 9.466 -10.037 5.518 929 HG3 GLU 145 2HG GLU 145 10.684 -7.527 6.644 930 H VAL 146 H VAL 146 12.080 -9.173 2.073 931 HA VAL 146 HA VAL 146 9.807 -9.716 0.608 932 HB VAL 146 HB VAL 146 12.785 -10.015 -0.168 933 HG11 VAL 146 1HG1 VAL 146 12.094 -9.466 -2.508 934 HG12 VAL 146 2HG1 VAL 146 11.552 -11.051 -1.968 935 HG13 VAL 146 3HG1 VAL 146 10.399 -9.718 -2.049 936 HG21 VAL 146 3HG2 VAL 146 10.980 -7.631 -0.762 937 HG22 VAL 146 1HG2 VAL 146 11.983 -7.752 0.691 938 HG23 VAL 146 2HG2 VAL 146 12.744 -7.760 -0.898 939 H ASP 147 H ASP 147 11.694 -12.259 2.027 940 HA ASP 147 HA ASP 147 11.340 -14.144 -0.238 941 HB3 ASP 147 2HB ASP 147 12.412 -14.523 2.591 942 H LYS 148 H LYS 148 10.132 -13.153 2.843 943 HA LYS 148 HA LYS 148 8.558 -15.392 3.511 944 HB3 LYS 148 2HB LYS 148 7.872 -12.581 4.437 945 HG3 LYS 148 2HG LYS 148 8.762 -15.083 5.755 946 HD3 LYS 148 2HD LYS 148 8.846 -13.325 7.389 947 HE3 LYS 148 2HE LYS 148 5.889 -12.769 6.836 948 HZ1 LYS 148 3HZ LYS 148 5.992 -11.327 8.568 949 HZ2 LYS 148 1HZ LYS 148 7.601 -10.980 8.291 950 HZ3 LYS 148 2HZ LYS 148 7.258 -12.327 9.067 951 H TRP 149 H TRP 149 7.962 -12.475 1.599 952 HA TRP 149 HA TRP 149 5.079 -13.251 1.481 953 HB3 TRP 149 2HB TRP 149 4.552 -11.164 0.850 954 HD1 TRP 149 HD TRP 149 5.190 -12.154 3.805 955 HE1 TRP 149 1HE TRP 149 5.780 -10.438 5.595 956 HE3 TRP 149 3HE TRP 149 6.801 -8.414 0.808 957 HZ2 TRP 149 2HZ TRP 149 7.049 -7.799 5.719 958 HZ3 TRP 149 3HZ TRP 149 7.643 -6.304 1.739 959 HH2 TRP 149 HH TRP 149 7.891 -6.005 4.196 960 H SER 150 H SER 150 7.608 -14.424 -0.034 961 HA SER 150 HA SER 150 6.469 -14.202 -2.779 962 HB3 SER 150 2HB SER 150 9.355 -14.695 -2.029 963 HG SER 150 HG SER 150 9.665 -14.791 -4.125 964 H LYS 151 H LYS 151 8.139 -16.284 -0.382 965 HA LYS 151 HA LYS 151 8.100 -18.693 -1.519 966 HB3 LYS 151 2HB LYS 151 9.151 -18.182 0.538 967 HG3 LYS 151 2HG LYS 151 7.247 -16.822 1.601 968 HD3 LYS 151 2HD LYS 151 6.349 -19.640 2.266 969 HE3 LYS 151 2HE LYS 151 4.958 -18.573 4.072 970 HZ1 LYS 151 3HZ LYS 151 6.800 -18.354 5.662 971 HZ2 LYS 151 1HZ LYS 151 7.882 -18.436 4.456 972 HZ3 LYS 151 2HZ LYS 151 6.916 -19.740 4.772 Start of MODEL 3 1 H1 GLY 1 H GLY 1 -6.728 -19.919 -10.033 2 HA2 GLY 1 1HA GLY 1 -5.115 -20.444 -11.806 3 HA3 GLY 1 2HA GLY 1 -4.381 -19.445 -10.526 4 H MET 2 H MET 2 -2.502 -20.613 -11.778 5 HA MET 2 HA MET 2 -1.487 -22.532 -9.832 6 HB3 MET 2 2HB MET 2 -2.519 -24.024 -11.506 7 HG3 MET 2 2HG MET 2 -0.536 -23.586 -13.613 8 HE1 MET 2 3HE MET 2 -4.391 -23.074 -12.771 9 HE2 MET 2 1HE MET 2 -3.973 -22.017 -14.129 10 HE3 MET 2 2HE MET 2 -5.083 -23.378 -14.387 11 H ALA 3 H ALA 3 -1.044 -19.895 -10.248 12 HA ALA 3 HA ALA 3 1.821 -19.805 -10.438 13 HB1 ALA 3 1HB ALA 3 1.949 -17.902 -12.028 14 HB2 ALA 3 2HB ALA 3 1.457 -19.407 -12.813 15 HB3 ALA 3 3HB ALA 3 0.239 -18.148 -12.457 16 H LYS 4 H LYS 4 2.038 -18.854 -8.447 17 HA LYS 4 HA LYS 4 0.233 -16.822 -7.449 18 HB3 LYS 4 2HB LYS 4 1.747 -16.562 -5.604 19 HG3 LYS 4 2HG LYS 4 1.893 -19.560 -6.154 20 HD3 LYS 4 2HD LYS 4 1.130 -19.620 -3.757 21 HE3 LYS 4 2HE LYS 4 3.635 -17.969 -4.344 22 HZ1 LYS 4 3HZ LYS 4 2.956 -19.266 -1.768 23 HZ2 LYS 4 1HZ LYS 4 2.921 -17.631 -2.073 24 HZ3 LYS 4 2HZ LYS 4 4.324 -18.447 -2.156 25 H LYS 5 H LYS 5 0.270 -15.277 -9.318 26 HA LYS 5 HA LYS 5 2.606 -13.921 -10.081 27 HB3 LYS 5 2HB LYS 5 0.359 -12.253 -10.513 28 HG3 LYS 5 2HG LYS 5 1.789 -14.418 -11.969 29 HD3 LYS 5 2HD LYS 5 0.704 -13.407 -14.017 30 HE3 LYS 5 2HE LYS 5 -1.021 -15.346 -12.458 31 HZ1 LYS 5 3HZ LYS 5 -1.726 -14.697 -14.735 32 HZ2 LYS 5 1HZ LYS 5 -1.320 -16.281 -14.659 33 HZ3 LYS 5 2HZ LYS 5 -0.262 -15.234 -15.311 34 H THR 6 H THR 6 2.984 -11.661 -9.834 35 HA THR 6 HA THR 6 2.274 -10.609 -7.148 36 HB THR 6 HB THR 6 5.111 -10.944 -8.169 37 HG1 THR 6 1HG THR 6 3.543 -12.396 -6.341 38 HG21 THR 6 3HG2 THR 6 5.119 -9.006 -6.778 39 HG22 THR 6 1HG2 THR 6 5.726 -10.337 -5.795 40 HG23 THR 6 2HG2 THR 6 4.072 -9.747 -5.568 41 H LEU 7 H LEU 7 2.337 -8.320 -6.909 42 HA LEU 7 HA LEU 7 3.299 -6.758 -9.224 43 HB3 LEU 7 2HB LEU 7 1.000 -5.530 -7.819 44 HG LEU 7 HG LEU 7 1.184 -6.122 -10.788 45 HD11 LEU 7 1HD1 LEU 7 -0.346 -4.253 -10.991 46 HD12 LEU 7 2HD1 LEU 7 -0.152 -3.837 -9.273 47 HD13 LEU 7 3HD1 LEU 7 -0.980 -5.325 -9.739 48 HD21 LEU 7 3HD2 LEU 7 2.081 -3.875 -11.193 49 HD22 LEU 7 1HD2 LEU 7 3.236 -4.870 -10.335 50 HD23 LEU 7 2HD2 LEU 7 2.310 -3.630 -9.452 51 H ILE 8 H ILE 8 4.073 -4.682 -8.581 52 HA ILE 8 HA ILE 8 4.330 -4.129 -5.673 53 HB ILE 8 HB ILE 8 6.391 -3.915 -7.907 54 HG13 ILE 8 2HG1 ILE 8 5.957 -6.186 -6.532 55 HG21 ILE 8 1HG2 ILE 8 6.562 -2.928 -5.036 56 HG22 ILE 8 2HG2 ILE 8 7.935 -3.030 -6.157 57 HG23 ILE 8 3HG2 ILE 8 6.596 -1.932 -6.519 58 HD11 ILE 8 3HD1 ILE 8 8.742 -5.068 -6.930 59 HD12 ILE 8 1HD1 ILE 8 8.276 -6.776 -6.775 60 HD13 ILE 8 2HD1 ILE 8 7.735 -5.839 -8.182 61 H LEU 9 H LEU 9 3.131 -2.338 -5.366 62 HA LEU 9 HA LEU 9 2.942 -0.278 -7.508 63 HB3 LEU 9 2HB LEU 9 0.741 0.277 -6.171 64 HG LEU 9 HG LEU 9 1.044 -2.135 -7.987 65 HD11 LEU 9 1HD1 LEU 9 -1.511 -0.782 -7.009 66 HD12 LEU 9 2HD1 LEU 9 -0.983 -2.440 -6.639 67 HD13 LEU 9 3HD1 LEU 9 -1.420 -2.000 -8.296 68 HD21 LEU 9 3HD2 LEU 9 -0.228 0.565 -8.627 69 HD22 LEU 9 1HD2 LEU 9 0.343 -0.706 -9.720 70 HD23 LEU 9 2HD2 LEU 9 1.497 0.293 -8.859 71 H TYR 10 H TYR 10 4.491 1.122 -6.964 72 HA TYR 10 HA TYR 10 4.595 2.043 -4.129 73 HB3 TYR 10 2HB TYR 10 6.667 1.063 -5.068 74 HD1 TYR 10 1HD TYR 10 7.208 4.589 -6.062 75 HD2 TYR 10 2HD TYR 10 6.888 0.527 -7.501 76 HE1 TYR 10 1HE TYR 10 8.141 5.269 -8.253 77 HE2 TYR 10 2HE TYR 10 7.931 1.174 -9.618 78 HH TYR 10 HH TYR 10 8.431 4.575 -10.535 79 H TYR 11 H TYR 11 4.089 4.144 -3.653 80 HA TYR 11 HA TYR 11 3.713 6.044 -5.931 81 HB3 TYR 11 2HB TYR 11 2.434 5.891 -3.205 82 HD1 TYR 11 2HD TYR 11 1.599 8.265 -5.951 83 HD2 TYR 11 1HD TYR 11 3.359 7.832 -2.049 84 HE1 TYR 11 2HE TYR 11 1.367 10.696 -5.572 85 HE2 TYR 11 1HE TYR 11 3.029 10.262 -1.614 86 HH TYR 11 HH TYR 11 1.565 12.072 -2.363 87 H SER 12 H SER 12 5.019 7.735 -5.997 88 HA SER 12 HA SER 12 6.293 8.866 -3.727 89 HB3 SER 12 2HB SER 12 7.985 7.168 -4.254 90 HG SER 12 HG SER 12 7.313 7.242 -6.663 91 H TRP 13 H TRP 13 7.487 10.884 -4.678 92 HA TRP 13 HA TRP 13 6.286 11.771 -7.274 93 HB3 TRP 13 2HB TRP 13 6.633 13.430 -4.762 94 HD1 TRP 13 HD TRP 13 4.306 13.903 -7.791 95 HE1 TRP 13 1HE TRP 13 4.705 16.170 -8.836 96 HE3 TRP 13 3HE TRP 13 8.375 15.321 -5.024 97 HZ2 TRP 13 2HZ TRP 13 6.527 18.422 -8.450 98 HZ3 TRP 13 3HZ TRP 13 9.289 17.634 -5.256 99 HH2 TRP 13 HH TRP 13 8.409 19.142 -7.010 100 H SER 14 H SER 14 8.909 12.637 -4.873 101 HA SER 14 HA SER 14 10.660 13.432 -7.036 102 HB3 SER 14 2HB SER 14 11.572 12.760 -4.236 103 HG SER 14 HG SER 14 13.241 13.653 -5.216 104 H GLY 15 H GLY 15 9.667 10.297 -6.234 105 HA2 GLY 15 1HA GLY 15 10.625 8.250 -6.979 106 HA3 GLY 15 2HA GLY 15 12.090 9.125 -7.443 107 H GLU 16 H GLU 16 10.285 7.739 -4.774 108 HA GLU 16 HA GLU 16 12.693 7.828 -2.986 109 HB3 GLU 16 2HB GLU 16 10.817 7.543 -1.179 110 HG3 GLU 16 2HG GLU 16 10.323 9.970 -1.065 111 H THR 17 H THR 17 9.618 5.965 -2.803 112 HA THR 17 HA THR 17 10.817 3.548 -2.138 113 HB THR 17 HB THR 17 8.509 2.688 -2.877 114 HG1 THR 17 1HG THR 17 7.098 4.775 -3.025 115 HG21 THR 17 3HG2 THR 17 8.712 4.981 -0.880 116 HG22 THR 17 1HG2 THR 17 8.888 3.242 -0.571 117 HG23 THR 17 2HG2 THR 17 7.316 3.889 -1.046 118 H LYS 18 H LYS 18 10.389 4.952 -5.305 119 HA LYS 18 HA LYS 18 10.259 2.821 -7.055 120 HB3 LYS 18 2HB LYS 18 12.047 5.305 -7.292 121 HG3 LYS 18 2HG LYS 18 11.148 3.178 -9.261 122 HD3 LYS 18 2HD LYS 18 12.300 5.877 -10.060 123 HE3 LYS 18 2HE LYS 18 11.310 3.362 -11.484 124 HZ1 LYS 18 3HZ LYS 18 11.848 4.626 -13.521 125 HZ2 LYS 18 1HZ LYS 18 11.894 6.023 -12.639 126 HZ3 LYS 18 2HZ LYS 18 10.510 5.177 -12.726 127 H LYS 19 H LYS 19 13.361 4.073 -5.691 128 HA LYS 19 HA LYS 19 14.920 2.167 -7.079 129 HB3 LYS 19 2HB LYS 19 16.488 2.701 -4.935 130 HG3 LYS 19 2HG LYS 19 17.002 4.975 -5.947 131 HD3 LYS 19 2HD LYS 19 17.485 2.347 -6.920 132 HE3 LYS 19 2HE LYS 19 17.109 4.375 -9.179 133 HZ1 LYS 19 3HZ LYS 19 17.633 2.556 -10.565 134 HZ2 LYS 19 1HZ LYS 19 17.480 1.459 -9.347 135 HZ3 LYS 19 2HZ LYS 19 18.752 2.477 -9.354 136 H MET 20 H MET 20 13.169 1.775 -4.054 137 HA MET 20 HA MET 20 14.410 -0.793 -3.434 138 HB3 MET 20 2HB MET 20 12.482 -0.661 -1.642 139 HG3 MET 20 2HG MET 20 13.641 1.535 -0.655 140 HE1 MET 20 3HE MET 20 15.121 -2.114 -1.837 141 HE2 MET 20 1HE MET 20 16.333 -0.850 -2.205 142 HE3 MET 20 2HE MET 20 16.604 -2.012 -0.884 143 H ALA 21 H ALA 21 11.353 0.392 -4.835 144 HA ALA 21 HA ALA 21 9.946 -2.047 -4.960 145 HB1 ALA 21 1HB ALA 21 8.677 -0.885 -6.783 146 HB2 ALA 21 2HB ALA 21 8.908 0.148 -5.343 147 HB3 ALA 21 3HB ALA 21 9.885 0.387 -6.810 148 H GLU 22 H GLU 22 11.961 -0.490 -7.485 149 HA GLU 22 HA GLU 22 11.586 -2.334 -9.561 150 HB3 GLU 22 2HB GLU 22 13.541 -1.514 -10.519 151 HG3 GLU 22 2HG GLU 22 12.960 0.467 -10.891 152 H LYS 23 H LYS 23 13.801 -2.321 -6.900 153 HA LYS 23 HA LYS 23 15.602 -4.441 -7.545 154 HB3 LYS 23 2HB LYS 23 15.110 -4.528 -4.733 155 HG3 LYS 23 2HG LYS 23 17.251 -4.800 -6.030 156 HD3 LYS 23 2HD LYS 23 18.544 -2.649 -5.703 157 HE3 LYS 23 2HE LYS 23 16.574 -2.700 -8.034 158 HZ1 LYS 23 3HZ LYS 23 19.326 -1.621 -7.903 159 HZ2 LYS 23 1HZ LYS 23 17.942 -0.735 -7.995 160 HZ3 LYS 23 2HZ LYS 23 18.362 -1.674 -9.239 161 H ILE 24 H ILE 24 12.751 -4.658 -5.457 162 HA ILE 24 HA ILE 24 12.763 -7.451 -5.180 163 HB ILE 24 HB ILE 24 10.386 -5.483 -5.076 164 HG13 ILE 24 2HG1 ILE 24 12.332 -4.738 -3.662 165 HG21 ILE 24 1HG2 ILE 24 9.397 -7.083 -3.431 166 HG22 ILE 24 2HG2 ILE 24 9.632 -7.814 -5.016 167 HG23 ILE 24 3HG2 ILE 24 10.770 -8.182 -3.717 168 HD11 ILE 24 3HD1 ILE 24 9.994 -4.205 -2.940 169 HD12 ILE 24 1HD1 ILE 24 10.057 -5.629 -1.872 170 HD13 ILE 24 2HD1 ILE 24 11.193 -4.296 -1.636 171 H ASN 25 H ASN 25 11.183 -5.476 -7.726 172 HA ASN 25 HA ASN 25 9.572 -7.514 -8.865 173 HB3 ASN 25 2HB ASN 25 11.127 -5.267 -10.195 174 HD21 ASN 25 1HD2 ASN 25 8.161 -7.338 -10.792 175 HD22 ASN 25 2HD2 ASN 25 8.621 -7.672 -12.441 176 H SER 26 H SER 26 13.022 -6.881 -9.258 177 HA SER 26 HA SER 26 13.529 -8.848 -11.266 178 HB3 SER 26 2HB SER 26 15.663 -7.978 -9.354 179 HG SER 26 HG SER 26 16.677 -7.458 -11.250 180 H GLU 27 H GLU 27 12.998 -9.285 -7.807 181 HA GLU 27 HA GLU 27 14.624 -11.708 -7.732 182 HB3 GLU 27 2HB GLU 27 15.688 -10.481 -6.298 183 HG3 GLU 27 2HG GLU 27 13.490 -9.261 -4.806 184 H ILE 28 H ILE 28 11.764 -11.353 -8.617 185 HA ILE 28 HA ILE 28 10.646 -13.624 -7.092 186 HB ILE 28 HB ILE 28 9.123 -11.098 -7.840 187 HG13 ILE 28 2HG1 ILE 28 10.527 -10.835 -5.800 188 HG21 ILE 28 1HG2 ILE 28 8.093 -13.665 -6.543 189 HG22 ILE 28 2HG2 ILE 28 7.160 -12.172 -6.682 190 HG23 ILE 28 3HG2 ILE 28 7.606 -13.000 -8.130 191 HD11 ILE 28 3HD1 ILE 28 7.714 -11.168 -4.796 192 HD12 ILE 28 1HD1 ILE 28 8.987 -10.077 -4.248 193 HD13 ILE 28 2HD1 ILE 28 8.229 -9.808 -5.837 194 H LYS 29 H LYS 29 8.867 -14.649 -8.551 195 HA LYS 29 HA LYS 29 9.572 -14.289 -11.415 196 HB3 LYS 29 2HB LYS 29 8.551 -16.888 -10.286 197 HG3 LYS 29 2HG LYS 29 8.627 -16.458 -12.806 198 HD3 LYS 29 2HD LYS 29 11.617 -16.686 -12.235 199 HE3 LYS 29 2HE LYS 29 10.237 -16.433 -14.933 200 HZ1 LYS 29 3HZ LYS 29 12.604 -15.808 -14.745 201 HZ2 LYS 29 1HZ LYS 29 12.382 -17.153 -15.715 202 HZ3 LYS 29 2HZ LYS 29 12.940 -17.335 -14.203 203 H ASP 30 H ASP 30 7.967 -13.981 -12.708 204 HA ASP 30 HA ASP 30 5.999 -13.428 -13.568 205 HB3 ASP 30 2HB ASP 30 4.161 -14.841 -11.731 206 H SER 31 H SER 31 7.395 -11.871 -11.472 207 HA SER 31 HA SER 31 5.362 -10.365 -10.098 208 HB3 SER 31 2HB SER 31 7.392 -10.562 -8.948 209 HG SER 31 HG SER 31 9.475 -10.091 -10.277 210 H GLU 32 H GLU 32 4.904 -8.198 -10.547 211 HA GLU 32 HA GLU 32 6.065 -6.945 -12.969 212 HB3 GLU 32 2HB GLU 32 3.682 -5.732 -12.975 213 HG3 GLU 32 2HG GLU 32 2.801 -7.424 -14.509 214 H LEU 33 H LEU 33 5.737 -4.562 -12.876 215 HA LEU 33 HA LEU 33 5.807 -3.392 -10.206 216 HB3 LEU 33 2HB LEU 33 8.105 -3.908 -10.873 217 HG LEU 33 HG LEU 33 7.857 -1.854 -13.128 218 HD11 LEU 33 1HD1 LEU 33 10.231 -3.469 -12.100 219 HD12 LEU 33 2HD1 LEU 33 9.897 -1.776 -11.739 220 HD13 LEU 33 3HD1 LEU 33 10.261 -2.231 -13.390 221 HD21 LEU 33 3HD2 LEU 33 8.772 -3.715 -14.610 222 HD22 LEU 33 1HD2 LEU 33 7.080 -3.901 -14.152 223 HD23 LEU 33 2HD2 LEU 33 8.340 -4.859 -13.335 224 H LYS 34 H LYS 34 4.654 -1.514 -10.187 225 HA LYS 34 HA LYS 34 4.317 0.063 -12.631 226 HB3 LYS 34 2HB LYS 34 1.826 0.377 -11.459 227 HG3 LYS 34 2HG LYS 34 2.519 0.035 -13.942 228 HD3 LYS 34 2HD LYS 34 2.735 -2.613 -13.459 229 HE3 LYS 34 2HE LYS 34 -0.214 -2.125 -14.072 230 HZ1 LYS 34 3HZ LYS 34 1.203 -4.718 -14.046 231 HZ2 LYS 34 1HZ LYS 34 0.714 -3.912 -15.366 232 HZ3 LYS 34 2HZ LYS 34 -0.413 -4.450 -14.330 233 H GLU 35 H GLU 35 4.101 2.251 -12.151 234 HA GLU 35 HA GLU 35 4.641 3.001 -9.352 235 HB3 GLU 35 2HB GLU 35 4.935 5.157 -10.052 236 HG3 GLU 35 2HG GLU 35 6.381 3.453 -11.551 237 H VAL 36 H VAL 36 3.239 4.769 -8.516 238 HA VAL 36 HA VAL 36 0.437 4.776 -9.490 239 HB VAL 36 HB VAL 36 1.225 4.920 -6.558 240 HG11 VAL 36 1HG1 VAL 36 -1.265 4.701 -6.210 241 HG12 VAL 36 2HG1 VAL 36 -0.811 6.198 -7.008 242 HG13 VAL 36 3HG1 VAL 36 -1.490 4.863 -7.958 243 HG21 VAL 36 3HG2 VAL 36 -0.108 2.687 -8.115 244 HG22 VAL 36 1HG2 VAL 36 1.477 2.606 -7.312 245 HG23 VAL 36 2HG2 VAL 36 0.017 2.748 -6.337 246 H LYS 37 H LYS 37 -0.517 7.014 -9.092 247 HA LYS 37 HA LYS 37 1.372 9.240 -8.590 248 HB3 LYS 37 2HB LYS 37 0.032 10.334 -10.588 249 HG3 LYS 37 2HG LYS 37 2.188 8.262 -11.146 250 HD3 LYS 37 2HD LYS 37 0.803 10.390 -12.739 251 HE3 LYS 37 2HE LYS 37 3.725 9.674 -13.194 252 HZ1 LYS 37 3HZ LYS 37 1.800 11.476 -14.525 253 HZ2 LYS 37 1HZ LYS 37 2.601 10.225 -15.215 254 HZ3 LYS 37 2HZ LYS 37 3.415 11.598 -14.761 255 H VAL 38 H VAL 38 -0.482 11.309 -8.949 256 HA VAL 38 HA VAL 38 -2.880 10.652 -7.399 257 HB VAL 38 HB VAL 38 -2.514 12.872 -6.180 258 HG11 VAL 38 1HG1 VAL 38 -1.203 11.770 -4.372 259 HG12 VAL 38 2HG1 VAL 38 -2.538 10.790 -4.996 260 HG13 VAL 38 3HG1 VAL 38 -0.881 10.413 -5.475 261 HG21 VAL 38 3HG2 VAL 38 0.412 12.347 -6.915 262 HG22 VAL 38 1HG2 VAL 38 -0.579 13.728 -7.422 263 HG23 VAL 38 2HG2 VAL 38 -0.162 13.507 -5.720 264 H SER 39 H SER 39 -4.696 12.143 -7.817 265 HA SER 39 HA SER 39 -4.750 13.415 -10.360 266 HB3 SER 39 2HB SER 39 -6.843 14.357 -9.224 267 HG SER 39 HG SER 39 -7.884 12.355 -9.185 268 H GLU 40 H GLU 40 -5.182 15.729 -10.555 269 HA GLU 40 HA GLU 40 -3.680 17.546 -8.777 270 HB3 GLU 40 2HB GLU 40 -3.672 17.824 -11.255 271 HG3 GLU 40 2HG GLU 40 -6.319 19.150 -11.329 272 H GLY 41 H GLY 41 -5.188 19.622 -8.250 273 HA2 GLY 41 1HA GLY 41 -7.280 20.564 -8.001 274 HA3 GLY 41 2HA GLY 41 -8.018 18.990 -8.185 275 H THR 42 H THR 42 -6.871 21.354 -5.984 276 HA THR 42 HA THR 42 -8.263 19.983 -3.743 277 HB THR 42 HB THR 42 -6.210 21.653 -2.659 278 HG1 THR 42 1HG THR 42 -4.947 19.635 -4.113 279 HG21 THR 42 3HG2 THR 42 -5.429 19.620 -1.587 280 HG22 THR 42 1HG2 THR 42 -6.366 18.617 -2.718 281 HG23 THR 42 2HG2 THR 42 -7.185 19.681 -1.553 282 H PHE 43 H PHE 43 -7.431 23.007 -5.427 283 HA PHE 43 HA PHE 43 -9.405 24.484 -3.826 284 HB3 PHE 43 2HB PHE 43 -7.332 24.502 -2.517 285 HD1 PHE 43 1HD PHE 43 -5.384 23.339 -3.895 286 HD2 PHE 43 2HD PHE 43 -6.331 27.542 -4.112 287 HE1 PHE 43 1HE PHE 43 -3.122 23.791 -4.764 288 HE2 PHE 43 2HE PHE 43 -4.034 28.001 -4.887 289 HZ PHE 43 HZ PHE 43 -2.419 26.143 -5.239 290 H ASP 44 H ASP 44 -9.139 23.750 -6.713 291 HA ASP 44 HA ASP 44 -9.475 24.639 -8.754 292 HB3 ASP 44 2HB ASP 44 -10.066 27.389 -7.661 293 H ALA 45 H ALA 45 -7.139 24.187 -8.795 294 HA ALA 45 HA ALA 45 -5.636 26.204 -10.120 295 HB1 ALA 45 1HB ALA 45 -5.213 26.975 -7.737 296 HB2 ALA 45 2HB ALA 45 -4.645 25.344 -7.341 297 HB3 ALA 45 3HB ALA 45 -3.745 26.340 -8.495 298 H ASP 46 H ASP 46 -3.542 25.255 -10.838 299 HA ASP 46 HA ASP 46 -2.996 22.436 -10.034 300 HB3 ASP 46 2HB ASP 46 -2.016 23.769 -12.591 301 H MET 47 H MET 47 -1.772 22.874 -8.233 302 HA MET 47 HA MET 47 0.851 23.689 -8.722 303 HB3 MET 47 2HB MET 47 0.209 25.347 -6.429 304 HG3 MET 47 2HG MET 47 1.167 25.963 -9.246 305 HE1 MET 47 3HE MET 47 3.026 29.297 -8.656 306 HE2 MET 47 1HE MET 47 3.668 27.654 -8.451 307 HE3 MET 47 2HE MET 47 2.582 28.025 -9.816 308 H TYR 48 H TYR 48 2.141 22.802 -7.222 309 HA TYR 48 HA TYR 48 1.665 20.531 -6.018 310 HB3 TYR 48 2HB TYR 48 3.606 22.738 -5.359 311 HD1 TYR 48 1HD TYR 48 3.155 19.066 -4.520 312 HD2 TYR 48 2HD TYR 48 4.764 22.907 -3.399 313 HE1 TYR 48 1HE TYR 48 3.988 18.107 -2.380 314 HE2 TYR 48 2HE TYR 48 5.580 21.966 -1.285 315 HH TYR 48 HH TYR 48 5.861 19.997 0.023 316 H LYS 49 H LYS 49 -0.018 19.955 -4.666 317 HA LYS 49 HA LYS 49 0.215 21.014 -1.963 318 HB3 LYS 49 2HB LYS 49 -2.571 21.216 -3.145 319 HG3 LYS 49 2HG LYS 49 -1.048 22.128 -0.696 320 HD3 LYS 49 2HD LYS 49 -2.610 23.977 -0.315 321 HE3 LYS 49 2HE LYS 49 -1.024 24.427 -2.881 322 HZ1 LYS 49 3HZ LYS 49 -2.498 26.201 -1.902 323 HZ2 LYS 49 1HZ LYS 49 -0.895 26.638 -2.088 324 HZ3 LYS 49 2HZ LYS 49 -1.485 26.242 -0.617 325 H THR 50 H THR 50 0.735 18.501 -3.084 326 HA THR 50 HA THR 50 -1.469 16.783 -2.032 327 HB THR 50 HB THR 50 0.038 16.356 -4.632 328 HG1 THR 50 1HG THR 50 -2.483 17.605 -4.479 329 HG21 THR 50 3HG2 THR 50 -1.256 14.402 -3.733 330 HG22 THR 50 1HG2 THR 50 -1.990 15.035 -5.224 331 HG23 THR 50 2HG2 THR 50 -2.712 15.413 -3.654 332 H SER 51 H SER 51 1.830 16.414 -3.472 333 HA SER 51 HA SER 51 2.368 14.145 -1.813 334 HB3 SER 51 2HB SER 51 4.240 13.877 -3.301 335 HG SER 51 HG SER 51 2.296 13.420 -4.265 336 H ASP 52 H ASP 52 2.193 16.421 -0.032 337 HA ASP 52 HA ASP 52 4.957 17.254 0.488 338 HB3 ASP 52 2HB ASP 52 2.861 18.722 0.866 339 H ILE 53 H ILE 53 5.437 17.197 3.025 340 HA ILE 53 HA ILE 53 4.922 14.591 4.154 341 HB ILE 53 HB ILE 53 7.395 14.238 4.645 342 HG13 ILE 53 2HG1 ILE 53 8.117 16.590 3.686 343 HG21 ILE 53 1HG2 ILE 53 7.774 12.977 2.563 344 HG22 ILE 53 2HG2 ILE 53 6.054 12.866 3.022 345 HG23 ILE 53 3HG2 ILE 53 6.563 13.958 1.740 346 HD11 ILE 53 3HD1 ILE 53 9.680 14.153 2.759 347 HD12 ILE 53 1HD1 ILE 53 10.277 15.808 2.961 348 HD13 ILE 53 2HD1 ILE 53 9.765 14.881 4.382 349 H ALA 54 H ALA 54 3.837 15.580 5.868 350 HA ALA 54 HA ALA 54 5.520 16.240 8.031 351 HB1 ALA 54 1HB ALA 54 3.752 18.555 7.121 352 HB2 ALA 54 2HB ALA 54 4.810 18.474 8.567 353 HB3 ALA 54 3HB ALA 54 5.522 18.522 6.970 354 H LEU 55 H LEU 55 3.428 17.632 9.518 355 HA LEU 55 HA LEU 55 1.440 15.548 10.074 356 HB3 LEU 55 2HB LEU 55 0.500 17.530 11.502 357 HG LEU 55 HG LEU 55 2.453 15.604 12.120 358 HD11 LEU 55 1HD1 LEU 55 3.307 18.376 13.092 359 HD12 LEU 55 2HD1 LEU 55 4.198 17.319 11.964 360 HD13 LEU 55 3HD1 LEU 55 3.958 16.833 13.648 361 HD21 LEU 55 3HD2 LEU 55 0.369 16.004 13.355 362 HD22 LEU 55 1HD2 LEU 55 0.972 17.574 13.906 363 HD23 LEU 55 2HD2 LEU 55 1.762 16.077 14.450 364 H ASP 56 H ASP 56 1.591 17.627 7.419 365 HA ASP 56 HA ASP 56 -1.063 18.775 7.825 366 HB3 ASP 56 2HB ASP 56 0.488 18.824 5.231 367 H GLN 57 H GLN 57 -2.803 18.295 6.332 368 HA GLN 57 HA GLN 57 -4.370 16.889 5.576 369 HB3 GLN 57 2HB GLN 57 -3.872 15.174 4.002 370 HG3 GLN 57 2HG GLN 57 -1.755 17.375 3.714 371 HE21 GLN 57 1HE2 GLN 57 -0.240 16.606 2.207 372 HE22 GLN 57 2HE2 GLN 57 -0.709 15.798 0.734 373 H ILE 58 H ILE 58 -2.540 16.204 8.225 374 HA ILE 58 HA ILE 58 -4.088 13.754 8.879 375 HB ILE 58 HB ILE 58 -1.947 15.026 10.579 376 HG13 ILE 58 2HG1 ILE 58 -0.884 14.406 8.455 377 HG21 ILE 58 1HG2 ILE 58 -1.950 12.831 11.731 378 HG22 ILE 58 2HG2 ILE 58 -3.594 13.452 11.678 379 HG23 ILE 58 3HG2 ILE 58 -3.104 12.192 10.541 380 HD11 ILE 58 3HD1 ILE 58 0.882 13.094 9.278 381 HD12 ILE 58 1HD1 ILE 58 0.261 13.950 10.711 382 HD13 ILE 58 2HD1 ILE 58 -0.157 12.257 10.444 383 H GLN 59 H GLN 59 -3.120 16.495 10.978 384 HA GLN 59 HA GLN 59 -5.368 15.933 12.561 385 HB3 GLN 59 2HB GLN 59 -3.737 16.549 13.885 386 HG3 GLN 59 2HG GLN 59 -3.043 18.639 11.860 387 HE21 GLN 59 1HE2 GLN 59 -1.454 19.918 12.239 388 HE22 GLN 59 2HE2 GLN 59 -1.026 20.713 13.790 389 H GLY 60 H GLY 60 -7.403 16.401 12.204 390 HA2 GLY 60 1HA GLY 60 -9.286 17.720 11.992 391 HA3 GLY 60 2HA GLY 60 -8.266 19.149 11.789 392 H ASN 61 H ASN 61 -7.048 17.021 9.513 393 HA ASN 61 HA ASN 61 -8.788 18.101 7.367 394 HB3 ASN 61 2HB ASN 61 -6.728 15.972 6.849 395 HD21 ASN 61 1HD2 ASN 61 -5.950 18.983 5.502 396 HD22 ASN 61 2HD2 ASN 61 -6.761 18.780 3.979 397 H LYS 62 H LYS 62 -9.750 16.402 5.805 398 HA LYS 62 HA LYS 62 -10.313 13.745 6.768 399 HB3 LYS 62 2HB LYS 62 -11.889 14.875 8.248 400 HG3 LYS 62 2HG LYS 62 -12.968 16.179 5.704 401 HD3 LYS 62 2HD LYS 62 -14.535 17.251 7.342 402 HE3 LYS 62 2HE LYS 62 -15.130 14.282 7.077 403 HZ1 LYS 62 3HZ LYS 62 -16.737 16.741 6.767 404 HZ2 LYS 62 1HZ LYS 62 -16.816 15.707 8.070 405 HZ3 LYS 62 2HZ LYS 62 -17.335 15.224 6.607 406 H ASP 63 H ASP 63 -9.554 15.570 4.207 407 HA ASP 63 HA ASP 63 -11.137 13.888 2.360 408 HB3 ASP 63 2HB ASP 63 -10.966 15.916 0.767 409 H PHE 64 H PHE 64 -9.420 12.541 2.106 410 HA PHE 64 HA PHE 64 -6.740 13.576 1.594 411 HB3 PHE 64 2HB PHE 64 -6.178 11.223 1.324 412 HD1 PHE 64 1HD PHE 64 -6.877 13.299 3.814 413 HD2 PHE 64 2HD PHE 64 -7.499 9.113 2.962 414 HE1 PHE 64 1HE PHE 64 -7.064 12.857 6.203 415 HE2 PHE 64 2HE PHE 64 -7.557 8.657 5.417 416 HZ PHE 64 HZ PHE 64 -7.358 10.517 7.039 417 HA PRO 65 HA PRO 65 -7.413 14.068 -2.760 418 HB3 PRO 65 2HB PRO 65 -5.367 15.138 -2.859 419 HG3 PRO 65 2HG PRO 65 -3.484 14.333 -1.597 420 HD3 PRO 65 2HD PRO 65 -5.260 14.644 -0.056 421 H GLU 66 H GLU 66 -7.538 12.919 -4.752 422 HA GLU 66 HA GLU 66 -7.868 10.037 -4.612 423 HB3 GLU 66 2HB GLU 66 -8.121 10.299 -7.079 424 HG3 GLU 66 2HG GLU 66 -9.722 12.323 -5.498 425 H ILE 67 H ILE 67 -6.689 8.583 -5.997 426 HA ILE 67 HA ILE 67 -3.831 9.232 -6.398 427 HB ILE 67 HB ILE 67 -3.459 6.919 -6.844 428 HG13 ILE 67 2HG1 ILE 67 -5.557 6.314 -7.982 429 HG21 ILE 67 1HG2 ILE 67 -3.759 6.109 -4.607 430 HG22 ILE 67 2HG2 ILE 67 -3.539 7.867 -4.506 431 HG23 ILE 67 3HG2 ILE 67 -5.153 7.189 -4.343 432 HD11 ILE 67 3HD1 ILE 67 -4.167 4.521 -6.900 433 HD12 ILE 67 1HD1 ILE 67 -5.274 4.575 -5.504 434 HD13 ILE 67 2HD1 ILE 67 -5.880 4.119 -7.106 435 H GLN 68 H GLN 68 -2.998 8.284 -8.545 436 HA GLN 68 HA GLN 68 -4.955 7.985 -10.686 437 HB3 GLN 68 2HB GLN 68 -3.121 8.932 -12.290 438 HG3 GLN 68 2HG GLN 68 -3.902 11.265 -12.044 439 HE21 GLN 68 1HE2 GLN 68 -6.681 11.475 -11.179 440 HE22 GLN 68 2HE2 GLN 68 -7.633 10.531 -12.275 441 H LEU 69 H LEU 69 -4.119 6.507 -12.244 442 HA LEU 69 HA LEU 69 -1.668 5.185 -12.118 443 HB3 LEU 69 2HB LEU 69 -2.601 4.291 -9.904 444 HG LEU 69 HG LEU 69 -4.211 2.416 -11.635 445 HD11 LEU 69 1HD1 LEU 69 -3.156 1.547 -9.554 446 HD12 LEU 69 2HD1 LEU 69 -4.920 1.478 -9.523 447 HD13 LEU 69 3HD1 LEU 69 -4.067 2.745 -8.618 448 HD21 LEU 69 3HD2 LEU 69 -5.275 4.637 -9.805 449 HD22 LEU 69 1HD2 LEU 69 -6.259 3.313 -10.468 450 HD23 LEU 69 2HD2 LEU 69 -5.555 4.488 -11.554 451 H ASP 70 H ASP 70 -1.976 2.958 -13.264 452 HA ASP 70 HA ASP 70 -3.157 3.284 -15.854 453 HB3 ASP 70 2HB ASP 70 -2.370 0.639 -14.761 454 H ASN 71 H ASN 71 -4.380 1.020 -16.629 455 HA ASN 71 HA ASN 71 -6.809 0.639 -14.918 456 HB3 ASN 71 2HB ASN 71 -6.013 -0.477 -17.589 457 HD21 ASN 71 1HD2 ASN 71 -8.646 -0.603 -14.985 458 HD22 ASN 71 2HD2 ASN 71 -9.175 -2.161 -15.586 459 H ILE 72 H ILE 72 -5.721 -0.191 -13.249 460 HA ILE 72 HA ILE 72 -4.251 -2.790 -13.611 461 HB ILE 72 HB ILE 72 -4.426 -1.205 -11.039 462 HG13 ILE 72 2HG1 ILE 72 -3.291 0.212 -12.616 463 HG21 ILE 72 1HG2 ILE 72 -2.597 -2.664 -10.312 464 HG22 ILE 72 2HG2 ILE 72 -3.967 -3.641 -10.806 465 HG23 ILE 72 3HG2 ILE 72 -2.568 -3.468 -11.895 466 HD11 ILE 72 3HD1 ILE 72 -0.958 -1.289 -11.426 467 HD12 ILE 72 1HD1 ILE 72 -1.055 0.415 -11.888 468 HD13 ILE 72 2HD1 ILE 72 -1.976 -0.165 -10.483 469 H ASP 73 H ASP 73 -5.304 -4.591 -13.286 470 HA ASP 73 HA ASP 73 -7.794 -4.568 -11.649 471 HB3 ASP 73 2HB ASP 73 -7.145 -6.812 -13.559 472 H TYR 74 H TYR 74 -7.302 -5.287 -9.647 473 HA TYR 74 HA TYR 74 -4.626 -6.156 -9.085 474 HB3 TYR 74 2HB TYR 74 -5.407 -6.114 -6.758 475 HD1 TYR 74 2HD TYR 74 -3.855 -4.149 -7.121 476 HD2 TYR 74 1HD TYR 74 -8.089 -3.913 -7.940 477 HE1 TYR 74 2HE TYR 74 -3.749 -1.667 -7.026 478 HE2 TYR 74 1HE TYR 74 -7.957 -1.454 -7.958 479 HH TYR 74 HH TYR 74 -6.528 0.488 -7.652 480 H ASN 75 H ASN 75 -7.598 -7.849 -9.700 481 HA ASN 75 HA ASN 75 -7.431 -10.041 -7.978 482 HB3 ASN 75 2HB ASN 75 -8.624 -11.143 -10.226 483 HD21 ASN 75 1HD2 ASN 75 -9.974 -8.088 -8.761 484 HD22 ASN 75 2HD2 ASN 75 -10.879 -8.994 -7.575 485 H ASN 76 H ASN 76 -5.744 -9.583 -11.047 486 HA ASN 76 HA ASN 76 -5.054 -12.397 -11.155 487 HB3 ASN 76 2HB ASN 76 -5.728 -11.552 -13.195 488 HD21 ASN 76 1HD2 ASN 76 -6.554 -9.349 -13.387 489 HD22 ASN 76 2HD2 ASN 76 -5.496 -8.142 -14.010 490 H TYR 77 H TYR 77 -3.882 -10.439 -9.043 491 HA TYR 77 HA TYR 77 -1.179 -11.602 -9.344 492 HB3 TYR 77 2HB TYR 77 -0.214 -9.723 -8.161 493 HD1 TYR 77 2HD TYR 77 0.834 -10.117 -10.507 494 HD2 TYR 77 1HD TYR 77 -2.577 -7.552 -9.858 495 HE1 TYR 77 2HE TYR 77 1.264 -9.031 -12.657 496 HE2 TYR 77 1HE TYR 77 -2.110 -6.406 -12.006 497 HH TYR 77 HH TYR 77 0.227 -7.662 -14.320 498 H ASP 78 H ASP 78 -0.711 -13.001 -7.787 499 HA ASP 78 HA ASP 78 -2.704 -13.533 -5.690 500 HB3 ASP 78 2HB ASP 78 0.019 -14.858 -5.834 501 H LEU 79 H LEU 79 0.023 -11.556 -6.001 502 HA LEU 79 HA LEU 79 0.384 -11.220 -3.076 503 HB3 LEU 79 2HB LEU 79 2.672 -11.327 -5.042 504 HG LEU 79 HG LEU 79 4.083 -11.839 -3.332 505 HD11 LEU 79 1HD1 LEU 79 3.143 -9.604 -2.862 506 HD12 LEU 79 2HD1 LEU 79 3.708 -10.439 -1.413 507 HD13 LEU 79 3HD1 LEU 79 1.964 -10.358 -1.754 508 HD21 LEU 79 3HD2 LEU 79 3.094 -13.850 -2.563 509 HD22 LEU 79 1HD2 LEU 79 1.665 -13.028 -1.930 510 HD23 LEU 79 2HD2 LEU 79 3.250 -12.835 -1.127 511 H ILE 80 H ILE 80 0.461 -8.955 -2.614 512 HA ILE 80 HA ILE 80 1.316 -7.168 -4.815 513 HB ILE 80 HB ILE 80 -1.205 -6.613 -3.245 514 HG13 ILE 80 2HG1 ILE 80 -1.553 -8.456 -4.863 515 HG21 ILE 80 1HG2 ILE 80 0.064 -5.144 -5.604 516 HG22 ILE 80 2HG2 ILE 80 -1.427 -4.674 -4.754 517 HG23 ILE 80 3HG2 ILE 80 0.117 -4.597 -3.921 518 HD11 ILE 80 3HD1 ILE 80 -3.444 -6.868 -4.661 519 HD12 ILE 80 1HD1 ILE 80 -2.789 -5.949 -6.040 520 HD13 ILE 80 2HD1 ILE 80 -3.311 -7.620 -6.257 521 H LEU 81 H LEU 81 2.933 -6.055 -4.121 522 HA LEU 81 HA LEU 81 3.214 -5.300 -1.286 523 HB3 LEU 81 2HB LEU 81 5.450 -4.337 -2.538 524 HG LEU 81 HG LEU 81 6.633 -6.455 -2.042 525 HD11 LEU 81 1HD1 LEU 81 4.797 -5.267 0.055 526 HD12 LEU 81 2HD1 LEU 81 6.482 -4.855 -0.330 527 HD13 LEU 81 3HD1 LEU 81 6.107 -6.400 0.422 528 HD21 LEU 81 3HD2 LEU 81 3.910 -7.519 -1.159 529 HD22 LEU 81 1HD2 LEU 81 5.494 -8.304 -0.968 530 HD23 LEU 81 2HD2 LEU 81 4.822 -8.049 -2.586 531 H ILE 82 H ILE 82 3.046 -3.268 -0.624 532 HA ILE 82 HA ILE 82 2.155 -1.184 -2.556 533 HB ILE 82 HB ILE 82 1.170 -1.920 0.240 534 HG13 ILE 82 2HG1 ILE 82 0.452 -3.605 -1.406 535 HG21 ILE 82 1HG2 ILE 82 -0.564 -0.280 -0.128 536 HG22 ILE 82 2HG2 ILE 82 1.008 0.491 -0.228 537 HG23 ILE 82 3HG2 ILE 82 0.088 0.139 -1.725 538 HD11 ILE 82 3HD1 ILE 82 -1.882 -3.595 -1.128 539 HD12 ILE 82 1HD1 ILE 82 -1.216 -2.844 0.332 540 HD13 ILE 82 2HD1 ILE 82 -1.964 -1.841 -0.941 541 H GLY 83 H GLY 83 3.665 0.486 -2.565 542 HA2 GLY 83 1HA GLY 83 5.583 0.569 -0.281 543 HA3 GLY 83 2HA GLY 83 5.900 1.073 -1.927 544 H SER 84 H SER 84 5.658 2.355 1.089 545 HA SER 84 HA SER 84 5.006 4.979 -0.072 546 HB3 SER 84 2HB SER 84 2.912 4.554 0.787 547 HG SER 84 HG SER 84 2.528 3.617 2.814 548 HA PRO 85 HA PRO 85 8.298 6.347 2.689 549 HB3 PRO 85 2HB PRO 85 8.489 7.996 1.002 550 HG3 PRO 85 2HG PRO 85 6.547 9.179 0.205 551 HD3 PRO 85 2HD PRO 85 6.144 6.943 -0.276 552 H VAL 86 H VAL 86 8.578 7.796 4.756 553 HA VAL 86 HA VAL 86 6.096 8.297 6.244 554 HB VAL 86 HB VAL 86 8.143 6.690 7.708 555 HG11 VAL 86 1HG1 VAL 86 6.189 5.965 8.987 556 HG12 VAL 86 2HG1 VAL 86 6.288 7.729 8.911 557 HG13 VAL 86 3HG1 VAL 86 5.122 6.872 7.894 558 HG21 VAL 86 3HG2 VAL 86 7.142 4.544 7.169 559 HG22 VAL 86 1HG2 VAL 86 6.224 5.327 5.845 560 HG23 VAL 86 2HG2 VAL 86 8.000 5.288 5.820 561 H TRP 87 H TRP 87 6.471 9.805 7.782 562 HA TRP 87 HA TRP 87 9.077 10.576 8.760 563 HB3 TRP 87 2HB TRP 87 7.796 12.601 6.871 564 HD1 TRP 87 HD TRP 87 11.490 11.832 7.649 565 HE1 TRP 87 1HE TRP 87 12.649 13.991 8.482 566 HE3 TRP 87 3HE TRP 87 7.487 15.019 7.587 567 HZ2 TRP 87 2HZ TRP 87 11.889 16.647 9.225 568 HZ3 TRP 87 3HZ TRP 87 7.745 17.371 8.310 569 HH2 TRP 87 HH TRP 87 9.931 18.177 9.197 570 H SER 88 H SER 88 5.740 11.136 8.779 571 HA SER 88 HA SER 88 6.040 12.151 11.511 572 HB3 SER 88 2HB SER 88 4.467 14.034 11.197 573 HG SER 88 HG SER 88 6.929 13.876 10.233 574 H GLY 89 H GLY 89 5.422 9.681 10.827 575 HA2 GLY 89 1HA GLY 89 4.008 7.956 11.313 576 HA3 GLY 89 2HA GLY 89 2.826 9.129 11.901 577 H TYR 90 H TYR 90 2.310 10.609 9.615 578 HA TYR 90 HA TYR 90 1.204 8.751 7.620 579 HB3 TYR 90 2HB TYR 90 -1.021 9.230 8.070 580 HD1 TYR 90 1HD TYR 90 0.610 10.358 11.301 581 HD2 TYR 90 2HD TYR 90 -1.924 7.495 9.335 582 HE1 TYR 90 1HE TYR 90 0.264 9.243 13.451 583 HE2 TYR 90 2HE TYR 90 -2.401 6.440 11.509 584 HH TYR 90 HH TYR 90 -0.516 7.098 14.447 585 HA PRO 91 HA PRO 91 2.584 13.108 6.470 586 HB3 PRO 91 2HB PRO 91 4.871 12.524 6.687 587 HG3 PRO 91 2HG PRO 91 5.648 10.378 5.891 588 HD3 PRO 91 2HD PRO 91 4.118 10.110 7.695 589 H ALA 92 H ALA 92 1.244 10.496 4.829 590 HA ALA 92 HA ALA 92 0.725 11.962 2.393 591 HB1 ALA 92 1HB ALA 92 2.017 9.198 2.169 592 HB2 ALA 92 2HB ALA 92 1.768 10.422 0.904 593 HB3 ALA 92 3HB ALA 92 3.000 10.681 2.128 594 H THR 93 H THR 93 -0.967 10.648 1.166 595 HA THR 93 HA THR 93 -2.291 8.478 2.693 596 HB THR 93 HB THR 93 -4.463 9.625 1.843 597 HG1 THR 93 1HG THR 93 -2.866 11.978 2.123 598 HG21 THR 93 3HG2 THR 93 -2.866 10.713 4.201 599 HG22 THR 93 1HG2 THR 93 -4.241 9.572 4.171 600 HG23 THR 93 2HG2 THR 93 -4.498 11.275 3.822 601 HA PRO 94 HA PRO 94 -2.105 7.663 -1.914 602 HB3 PRO 94 2HB PRO 94 0.246 8.211 -2.198 603 HG3 PRO 94 2HG PRO 94 1.856 7.615 -0.484 604 HD3 PRO 94 2HD PRO 94 0.318 9.079 0.367 605 H ILE 95 H ILE 95 -1.822 5.992 1.041 606 HA ILE 95 HA ILE 95 -2.751 3.501 -0.277 607 HB ILE 95 HB ILE 95 -1.547 3.490 2.433 608 HG13 ILE 95 2HG1 ILE 95 0.696 2.891 1.679 609 HG21 ILE 95 1HG2 ILE 95 -0.835 1.199 1.652 610 HG22 ILE 95 2HG2 ILE 95 -2.562 1.525 1.730 611 HG23 ILE 95 3HG2 ILE 95 -1.766 1.531 0.157 612 HD11 ILE 95 3HD1 ILE 95 0.044 2.568 -0.863 613 HD12 ILE 95 1HD1 ILE 95 0.327 4.312 -0.953 614 HD13 ILE 95 2HD1 ILE 95 1.614 3.252 -0.420 615 H LYS 96 H LYS 96 -4.502 5.264 -0.142 616 HA LYS 96 HA LYS 96 -6.328 4.237 1.973 617 HB3 LYS 96 2HB LYS 96 -6.911 7.082 1.381 618 HG3 LYS 96 2HG LYS 96 -6.560 7.240 3.863 619 HD3 LYS 96 2HD LYS 96 -8.304 4.833 3.112 620 HE3 LYS 96 2HE LYS 96 -8.077 6.751 5.407 621 HZ1 LYS 96 3HZ LYS 96 -10.274 6.757 5.872 622 HZ2 LYS 96 1HZ LYS 96 -10.706 5.628 4.734 623 HZ3 LYS 96 2HZ LYS 96 -10.271 7.164 4.299 624 H THR 97 H THR 97 -6.401 6.160 -1.123 625 HA THR 97 HA THR 97 -9.117 5.209 -1.720 626 HB THR 97 HB THR 97 -6.857 6.402 -3.354 627 HG1 THR 97 1HG THR 97 -9.070 7.761 -3.627 628 HG21 THR 97 3HG2 THR 97 -9.552 5.581 -4.453 629 HG22 THR 97 1HG2 THR 97 -7.964 4.919 -4.916 630 HG23 THR 97 2HG2 THR 97 -8.336 6.597 -5.273 631 H LEU 98 H LEU 98 -5.787 4.205 -2.632 632 HA LEU 98 HA LEU 98 -6.291 2.238 -4.499 633 HB3 LEU 98 2HB LEU 98 -4.246 1.786 -2.367 634 HG LEU 98 HG LEU 98 -4.812 0.313 -4.572 635 HD11 LEU 98 1HD1 LEU 98 -3.076 2.590 -5.654 636 HD12 LEU 98 2HD1 LEU 98 -4.723 2.146 -6.177 637 HD13 LEU 98 3HD1 LEU 98 -3.390 1.049 -6.482 638 HD21 LEU 98 3HD2 LEU 98 -2.027 1.184 -3.826 639 HD22 LEU 98 1HD2 LEU 98 -2.502 -0.321 -4.698 640 HD23 LEU 98 2HD2 LEU 98 -3.006 -0.071 -3.013 641 H LEU 99 H LEU 99 -6.201 1.610 -0.981 642 HA LEU 99 HA LEU 99 -6.847 -1.092 -0.872 643 HB3 LEU 99 2HB LEU 99 -8.014 -0.346 1.303 644 HG LEU 99 HG LEU 99 -6.168 -0.408 2.369 645 HD11 LEU 99 1HD1 LEU 99 -4.094 -1.161 1.408 646 HD12 LEU 99 2HD1 LEU 99 -4.635 -0.684 -0.215 647 HD13 LEU 99 3HD1 LEU 99 -5.462 -1.987 0.668 648 HD21 LEU 99 3HD2 LEU 99 -4.717 1.646 0.706 649 HD22 LEU 99 1HD2 LEU 99 -4.494 1.199 2.435 650 HD23 LEU 99 2HD2 LEU 99 -5.909 2.083 1.952 651 H ASP 100 H ASP 100 -9.133 1.644 -1.227 652 HA ASP 100 HA ASP 100 -11.477 -0.010 -0.913 653 HB3 ASP 100 2HB ASP 100 -11.292 2.674 -2.314 654 H GLN 101 H GLN 101 -9.353 0.727 -3.592 655 HA GLN 101 HA GLN 101 -11.297 0.023 -5.685 656 HB3 GLN 101 2HB GLN 101 -9.377 0.174 -7.175 657 HG3 GLN 101 2HG GLN 101 -9.138 2.490 -5.219 658 HE21 GLN 101 1HE2 GLN 101 -9.405 4.547 -7.194 659 HE22 GLN 101 2HE2 GLN 101 -8.144 4.347 -8.367 660 H MET 102 H MET 102 -8.570 -1.394 -3.887 661 HA MET 102 HA MET 102 -8.576 -3.948 -5.168 662 HB3 MET 102 2HB MET 102 -6.972 -4.588 -3.507 663 HG3 MET 102 2HG MET 102 -6.651 -1.689 -4.321 664 HE1 MET 102 3HE MET 102 -4.808 -4.775 -2.542 665 HE2 MET 102 1HE MET 102 -4.203 -4.603 -4.206 666 HE3 MET 102 2HE MET 102 -3.138 -4.254 -2.829 667 H LYS 103 H LYS 103 -11.215 -2.989 -3.659 668 HA LYS 103 HA LYS 103 -11.550 -4.722 -1.442 669 HB3 LYS 103 2HB LYS 103 -14.117 -4.281 -2.085 670 HG3 LYS 103 2HG LYS 103 -13.764 -1.763 -1.492 671 HD3 LYS 103 2HD LYS 103 -12.965 -4.042 0.359 672 HE3 LYS 103 2HE LYS 103 -12.082 -1.887 1.213 673 HZ1 LYS 103 3HZ LYS 103 -13.713 -0.238 1.967 674 HZ2 LYS 103 1HZ LYS 103 -14.922 -1.047 1.221 675 HZ3 LYS 103 2HZ LYS 103 -13.744 -0.335 0.335 676 H ASN 104 H ASN 104 -11.161 -5.847 -4.621 677 HA ASN 104 HA ASN 104 -12.681 -8.316 -4.024 678 HB3 ASN 104 2HB ASN 104 -13.155 -8.501 -6.368 679 HD21 ASN 104 1HD2 ASN 104 -13.328 -5.073 -6.685 680 HD22 ASN 104 2HD2 ASN 104 -14.883 -4.803 -5.921 681 H TYR 105 H TYR 105 -9.735 -7.251 -3.707 682 HA TYR 105 HA TYR 105 -8.054 -8.646 -5.459 683 HB3 TYR 105 2HB TYR 105 -7.535 -6.868 -3.622 684 HD1 TYR 105 2HD TYR 105 -9.464 -7.668 -1.755 685 HD2 TYR 105 1HD TYR 105 -5.397 -9.127 -2.013 686 HE1 TYR 105 2HE TYR 105 -9.675 -8.607 0.470 687 HE2 TYR 105 1HE TYR 105 -5.609 -10.000 0.313 688 HH TYR 105 HH TYR 105 -8.716 -10.421 1.743 689 H ARG 106 H ARG 106 -6.834 -10.554 -5.197 690 HA ARG 106 HA ARG 106 -7.824 -12.695 -3.400 691 HB3 ARG 106 2HB ARG 106 -7.455 -14.157 -5.498 692 HG3 ARG 106 2HG ARG 106 -9.508 -13.116 -6.730 693 HD3 ARG 106 2HD ARG 106 -9.726 -14.134 -3.847 694 HE ARG 106 HE ARG 106 -11.823 -13.546 -5.547 695 HH11 ARG 106 1HH1 ARG 106 -10.535 -16.480 -3.986 696 HH12 ARG 106 2HH1 ARG 106 -11.955 -17.432 -4.253 697 HH21 ARG 106 1HH2 ARG 106 -13.866 -14.646 -5.434 698 HH22 ARG 106 2HH2 ARG 106 -13.930 -16.319 -4.948 699 H GLY 107 H GLY 107 -5.780 -11.868 -2.161 700 HA2 GLY 107 1HA GLY 107 -3.521 -13.401 -2.883 701 HA3 GLY 107 2HA GLY 107 -3.310 -11.732 -3.456 702 H GLU 108 H GLU 108 -1.486 -11.962 -1.894 703 HA GLU 108 HA GLU 108 -2.272 -11.512 0.964 704 HB3 GLU 108 2HB GLU 108 0.243 -12.033 1.243 705 HG3 GLU 108 2HG GLU 108 -1.910 -13.984 0.484 706 H VAL 109 H VAL 109 -1.405 -9.703 2.101 707 HA VAL 109 HA VAL 109 -0.560 -7.529 0.261 708 HB VAL 109 HB VAL 109 -2.324 -7.277 2.716 709 HG11 VAL 109 1HG1 VAL 109 -1.192 -5.213 1.951 710 HG12 VAL 109 2HG1 VAL 109 -1.845 -5.465 0.318 711 HG13 VAL 109 3HG1 VAL 109 -2.937 -5.133 1.688 712 HG21 VAL 109 3HG2 VAL 109 -4.004 -6.909 0.560 713 HG22 VAL 109 1HG2 VAL 109 -3.018 -8.252 -0.012 714 HG23 VAL 109 2HG2 VAL 109 -3.883 -8.408 1.512 715 H ALA 110 H ALA 110 1.256 -6.516 0.690 716 HA ALA 110 HA ALA 110 2.240 -6.356 3.471 717 HB1 ALA 110 1HB ALA 110 3.475 -8.204 2.522 718 HB2 ALA 110 2HB ALA 110 3.822 -7.283 1.043 719 HB3 ALA 110 3HB ALA 110 4.554 -6.816 2.581 720 H SER 111 H SER 111 3.588 -4.433 3.769 721 HA SER 111 HA SER 111 2.912 -2.265 1.894 722 HB3 SER 111 2HB SER 111 2.333 -1.771 4.788 723 HG SER 111 HG SER 111 0.396 -0.937 3.629 724 H PHE 112 H PHE 112 4.986 -1.648 1.433 725 HA PHE 112 HA PHE 112 7.006 -2.187 3.531 726 HB3 PHE 112 2HB PHE 112 7.211 -3.539 1.506 727 HD1 PHE 112 1HD PHE 112 5.431 -2.651 -0.314 728 HD2 PHE 112 2HD PHE 112 9.577 -1.512 -0.146 729 HE1 PHE 112 1HE PHE 112 5.364 -1.960 -2.691 730 HE2 PHE 112 2HE PHE 112 9.498 -0.824 -2.482 731 HZ PHE 112 HZ PHE 112 7.384 -1.031 -3.784 732 H PHE 113 H PHE 113 8.448 -0.631 4.179 733 HA PHE 113 HA PHE 113 7.971 2.122 3.083 734 HB3 PHE 113 2HB PHE 113 6.844 1.772 5.229 735 HD1 PHE 113 1HD PHE 113 7.181 -0.307 6.545 736 HD2 PHE 113 2HD PHE 113 10.071 2.898 6.627 737 HE1 PHE 113 1HE PHE 113 8.305 -1.329 8.521 738 HE2 PHE 113 2HE PHE 113 11.149 1.861 8.606 739 HZ PHE 113 HZ PHE 113 10.242 -0.243 9.546 740 H THR 114 H THR 114 9.627 3.588 2.969 741 HA THR 114 HA THR 114 12.375 2.450 3.156 742 HB THR 114 HB THR 114 12.769 3.625 1.028 743 HG1 THR 114 1HG THR 114 11.323 5.233 0.915 744 HG21 THR 114 3HG2 THR 114 10.348 1.773 0.885 745 HG22 THR 114 1HG2 THR 114 12.043 1.268 0.995 746 HG23 THR 114 2HG2 THR 114 11.460 2.168 -0.427 747 H SER 115 H SER 115 10.739 4.589 4.883 748 HA SER 115 HA SER 115 13.080 6.321 5.265 749 HB3 SER 115 2HB SER 115 11.588 8.308 5.474 750 HG SER 115 HG SER 115 12.634 8.034 3.541 751 H ALA 116 H ALA 116 13.563 5.852 7.310 752 HA ALA 116 HA ALA 116 11.409 4.848 9.128 753 HB1 ALA 116 1HB ALA 116 12.877 3.166 8.018 754 HB2 ALA 116 2HB ALA 116 14.268 3.900 8.847 755 HB3 ALA 116 3HB ALA 116 12.961 3.153 9.791 756 H GLY 117 H GLY 117 13.482 7.458 9.007 757 HA2 GLY 117 1HA GLY 117 15.239 7.213 11.129 758 HA3 GLY 117 2HA GLY 117 14.607 8.757 10.543 759 H THR 118 H THR 118 12.056 8.903 11.297 760 HA THR 118 HA THR 118 12.271 8.805 14.261 761 HB THR 118 HB THR 118 10.567 10.881 12.993 762 HG1 THR 118 1HG THR 118 12.477 12.186 12.562 763 HG21 THR 118 3HG2 THR 118 12.766 10.974 15.108 764 HG22 THR 118 1HG2 THR 118 11.023 10.827 15.431 765 HG23 THR 118 2HG2 THR 118 11.664 12.302 14.692 766 H ASN 119 H ASN 119 10.658 7.198 11.886 767 HA ASN 119 HA ASN 119 8.351 6.638 13.648 768 HB3 ASN 119 2HB ASN 119 7.022 6.559 11.355 769 HD21 ASN 119 1HD2 ASN 119 6.146 7.166 13.768 770 HD22 ASN 119 2HD2 ASN 119 5.434 8.746 13.699 771 H HIS 120 H HIS 120 8.286 4.499 13.903 772 HA HIS 120 HA HIS 120 8.402 2.815 11.472 773 HB3 HIS 120 2HB HIS 120 9.691 2.161 14.143 774 HD1 HIS 120 1HD HIS 120 11.029 -0.195 14.112 775 HD2 HIS 120 2HD HIS 120 8.091 0.370 11.125 776 HE1 HIS 120 1HE HIS 120 10.573 -2.496 13.081 777 H LYS 121 H LYS 121 7.626 2.606 15.042 778 HA LYS 121 HA LYS 121 5.638 0.637 14.595 779 HB3 LYS 121 2HB LYS 121 4.908 1.119 16.912 780 HG3 LYS 121 2HG LYS 121 7.890 1.349 17.118 781 HD3 LYS 121 2HD LYS 121 6.410 0.507 19.019 782 HE3 LYS 121 2HE LYS 121 5.975 -1.650 16.921 783 HZ1 LYS 121 3HZ LYS 121 6.879 -2.713 18.893 784 HZ2 LYS 121 1HZ LYS 121 5.344 -3.171 18.572 785 HZ3 LYS 121 2HZ LYS 121 5.649 -2.108 19.811 786 H ALA 122 H ALA 122 5.309 4.164 14.423 787 HA ALA 122 HA ALA 122 2.461 4.258 14.476 788 HB1 ALA 122 1HB ALA 122 4.429 6.031 12.966 789 HB2 ALA 122 2HB ALA 122 2.743 6.417 13.348 790 HB3 ALA 122 3HB ALA 122 3.921 6.260 14.664 791 H TYR 123 H TYR 123 4.769 3.393 11.842 792 HA TYR 123 HA TYR 123 3.001 3.846 9.657 793 HB3 TYR 123 2HB TYR 123 5.353 1.927 9.942 794 HD1 TYR 123 1HD TYR 123 4.208 0.226 8.458 795 HD2 TYR 123 2HD TYR 123 4.845 4.321 7.226 796 HE1 TYR 123 1HE TYR 123 3.821 -0.422 6.122 797 HE2 TYR 123 2HE TYR 123 4.528 3.662 4.865 798 HH TYR 123 HH TYR 123 4.069 1.871 3.369 799 H VAL 124 H VAL 124 3.755 0.954 11.608 800 HA VAL 124 HA VAL 124 2.139 -0.961 10.359 801 HB VAL 124 HB VAL 124 2.594 -0.587 13.360 802 HG11 VAL 124 1HG1 VAL 124 0.914 -2.300 12.847 803 HG12 VAL 124 2HG1 VAL 124 2.029 -3.097 11.727 804 HG13 VAL 124 3HG1 VAL 124 2.381 -3.034 13.481 805 HG21 VAL 124 3HG2 VAL 124 4.797 -0.527 12.267 806 HG22 VAL 124 1HG2 VAL 124 4.583 -2.072 13.067 807 HG23 VAL 124 2HG2 VAL 124 4.379 -1.956 11.300 808 H SER 125 H SER 125 1.307 1.330 13.019 809 HA SER 125 HA SER 125 -1.340 0.462 13.364 810 HB3 SER 125 2HB SER 125 -1.370 2.839 14.438 811 HG SER 125 HG SER 125 -0.350 2.091 16.184 812 H HIS 126 H HIS 126 0.138 3.040 11.239 813 HA HIS 126 HA HIS 126 -2.169 4.389 10.593 814 HB3 HIS 126 2HB HIS 126 0.625 4.001 9.469 815 HD1 HIS 126 1HD HIS 126 1.071 6.819 8.324 816 HD2 HIS 126 2HD HIS 126 -1.822 4.041 7.204 817 HE1 HIS 126 1HE HIS 126 0.444 7.368 5.885 818 H PHE 127 H PHE 127 -0.216 1.889 8.877 819 HA PHE 127 HA PHE 127 -2.014 1.702 6.737 820 HB3 PHE 127 2HB PHE 127 -0.135 -0.450 7.784 821 HD1 PHE 127 1HD PHE 127 -1.739 1.006 4.689 822 HD2 PHE 127 2HD PHE 127 -0.482 -2.551 6.752 823 HE1 PHE 127 1HE PHE 127 -2.320 -0.374 2.702 824 HE2 PHE 127 2HE PHE 127 -1.114 -3.926 4.784 825 HZ PHE 127 HZ PHE 127 -2.002 -2.831 2.739 826 H ASN 128 H ASN 128 -1.921 -0.155 9.791 827 HA ASN 128 HA ASN 128 -4.050 -1.911 9.050 828 HB3 ASN 128 2HB ASN 128 -4.395 -1.974 11.652 829 HD21 ASN 128 1HD2 ASN 128 -2.000 -2.746 12.958 830 HD22 ASN 128 2HD2 ASN 128 -1.414 -4.163 12.108 831 H GLU 129 H GLU 129 -4.226 1.475 10.464 832 HA GLU 129 HA GLU 129 -7.110 1.206 10.813 833 HB3 GLU 129 2HB GLU 129 -6.958 3.784 10.738 834 HG3 GLU 129 2HG GLU 129 -5.158 2.656 12.859 835 H TRP 130 H TRP 130 -4.963 2.111 8.084 836 HA TRP 130 HA TRP 130 -7.368 3.209 6.716 837 HB3 TRP 130 2HB TRP 130 -5.485 4.082 5.218 838 HD1 TRP 130 HD TRP 130 -7.000 4.713 8.624 839 HE1 TRP 130 1HE TRP 130 -6.625 7.110 9.376 840 HE3 TRP 130 3HE TRP 130 -3.573 6.154 5.117 841 HZ2 TRP 130 2HZ TRP 130 -4.900 9.285 8.736 842 HZ3 TRP 130 3HZ TRP 130 -2.415 8.338 5.348 843 HH2 TRP 130 HH TRP 130 -3.065 9.913 7.154 844 H ALA 131 H ALA 131 -6.194 0.256 7.037 845 HA ALA 131 HA ALA 131 -6.946 -0.520 4.292 846 HB1 ALA 131 1HB ALA 131 -4.349 -1.536 5.503 847 HB2 ALA 131 2HB ALA 131 -4.906 -1.593 3.806 848 HB3 ALA 131 3HB ALA 131 -4.398 -0.059 4.506 849 H ASP 132 H ASP 132 -8.085 -0.784 6.994 850 HA ASP 132 HA ASP 132 -7.728 -3.526 7.854 851 HB3 ASP 132 2HB ASP 132 -9.971 -1.633 8.451 852 H GLY 133 H GLY 133 -8.098 -4.630 6.014 853 HA2 GLY 133 1HA GLY 133 -10.640 -5.909 5.969 854 HA3 GLY 133 2HA GLY 133 -10.527 -4.908 4.517 855 H LEU 134 H LEU 134 -7.551 -5.249 4.300 856 HA LEU 134 HA LEU 134 -7.797 -7.627 2.668 857 HB3 LEU 134 2HB LEU 134 -5.763 -6.909 1.713 858 HG LEU 134 HG LEU 134 -5.888 -4.537 1.153 859 HD11 LEU 134 1HD1 LEU 134 -6.989 -6.211 -0.273 860 HD12 LEU 134 2HD1 LEU 134 -7.898 -4.697 -0.309 861 HD13 LEU 134 3HD1 LEU 134 -8.492 -6.039 0.660 862 HD21 LEU 134 3HD2 LEU 134 -7.666 -3.098 1.561 863 HD22 LEU 134 1HD2 LEU 134 -6.995 -3.627 3.113 864 HD23 LEU 134 2HD2 LEU 134 -8.542 -4.313 2.517 865 H ASN 135 H ASN 135 -6.042 -9.198 2.624 866 HA ASN 135 HA ASN 135 -5.373 -10.232 5.244 867 HB3 ASN 135 2HB ASN 135 -4.567 -11.220 2.474 868 HD21 ASN 135 1HD2 ASN 135 -2.735 -12.505 2.796 869 HD22 ASN 135 2HD2 ASN 135 -2.516 -13.607 4.139 870 H VAL 136 H VAL 136 -4.022 -8.657 6.170 871 HA VAL 136 HA VAL 136 -1.443 -8.082 4.897 872 HB VAL 136 HB VAL 136 -2.493 -7.080 7.582 873 HG11 VAL 136 1HG1 VAL 136 -0.061 -6.791 7.384 874 HG12 VAL 136 2HG1 VAL 136 -0.248 -6.082 5.762 875 HG13 VAL 136 3HG1 VAL 136 -0.853 -5.230 7.204 876 HG21 VAL 136 3HG2 VAL 136 -2.684 -5.850 4.806 877 HG22 VAL 136 1HG2 VAL 136 -4.030 -6.334 5.852 878 HG23 VAL 136 2HG2 VAL 136 -3.021 -4.981 6.327 879 H ILE 137 H ILE 137 0.459 -9.143 5.318 880 HA ILE 137 HA ILE 137 0.649 -10.698 7.865 881 HB ILE 137 HB ILE 137 1.649 -12.442 6.778 882 HG13 ILE 137 2HG1 ILE 137 2.161 -12.579 4.368 883 HG21 ILE 137 1HG2 ILE 137 -0.619 -11.641 4.912 884 HG22 ILE 137 2HG2 ILE 137 -0.016 -13.271 5.241 885 HG23 ILE 137 3HG2 ILE 137 -0.804 -12.359 6.530 886 HD11 ILE 137 3HD1 ILE 137 2.088 -9.549 4.354 887 HD12 ILE 137 1HD1 ILE 137 2.711 -10.616 3.111 888 HD13 ILE 137 2HD1 ILE 137 0.962 -10.610 3.458 889 H GLY 138 H GLY 138 2.216 -8.074 6.216 890 HA2 GLY 138 1HA GLY 138 4.102 -7.768 8.296 891 HA3 GLY 138 2HA GLY 138 4.905 -8.634 6.980 892 H VAL 139 H VAL 139 4.827 -5.660 8.181 893 HA VAL 139 HA VAL 139 4.772 -4.204 5.638 894 HB VAL 139 HB VAL 139 3.747 -2.464 7.017 895 HG11 VAL 139 1HG1 VAL 139 1.502 -3.334 7.018 896 HG12 VAL 139 2HG1 VAL 139 2.343 -4.038 5.616 897 HG13 VAL 139 3HG1 VAL 139 2.060 -5.009 7.060 898 HG21 VAL 139 3HG2 VAL 139 4.564 -3.812 9.155 899 HG22 VAL 139 1HG2 VAL 139 3.217 -2.630 9.160 900 HG23 VAL 139 2HG2 VAL 139 2.902 -4.401 9.113 901 H ALA 140 H ALA 140 6.954 -4.768 5.825 902 HA ALA 140 HA ALA 140 8.621 -3.656 8.040 903 HB1 ALA 140 1HB ALA 140 10.303 -5.274 7.559 904 HB2 ALA 140 2HB ALA 140 8.743 -6.104 7.489 905 HB3 ALA 140 3HB ALA 140 9.598 -5.672 5.997 906 H ARG 141 H ARG 141 10.980 -3.224 7.349 907 HA ARG 141 HA ARG 141 10.805 -0.931 5.551 908 HB3 ARG 141 2HB ARG 141 11.915 -0.929 7.885 909 HG3 ARG 141 2HG ARG 141 14.287 -1.068 7.804 910 HD3 ARG 141 2HD ARG 141 13.175 -3.819 7.120 911 HE ARG 141 HE ARG 141 15.790 -3.042 7.766 912 HH11 ARG 141 1HH1 ARG 141 13.405 -5.484 8.765 913 HH12 ARG 141 2HH1 ARG 141 14.573 -6.507 9.529 914 HH21 ARG 141 1HH2 ARG 141 17.328 -4.366 8.822 915 HH22 ARG 141 2HH2 ARG 141 16.851 -5.899 9.467 916 H ASP 142 H ASP 142 12.411 -0.559 3.951 917 HA ASP 142 HA ASP 142 13.413 -1.090 1.960 918 HB3 ASP 142 2HB ASP 142 15.540 -2.140 2.243 919 H ASP 143 H ASP 143 14.661 -3.690 1.201 920 HA ASP 143 HA ASP 143 12.188 -5.189 0.561 921 HB3 ASP 143 2HB ASP 143 13.666 -4.699 -1.323 922 H SER 144 H SER 144 13.755 -5.000 3.233 923 HA SER 144 HA SER 144 15.403 -7.206 3.497 924 HB3 SER 144 2HB SER 144 14.088 -5.935 5.905 925 HG SER 144 HG SER 144 15.945 -7.304 6.119 926 H GLU 145 H GLU 145 12.086 -7.568 3.299 927 HA GLU 145 HA GLU 145 12.164 -10.165 4.716 928 HB3 GLU 145 2HB GLU 145 10.157 -9.846 5.911 929 HG3 GLU 145 2HG GLU 145 11.548 -7.198 6.416 930 H VAL 146 H VAL 146 12.145 -9.246 1.821 931 HA VAL 146 HA VAL 146 9.585 -9.771 0.658 932 HB VAL 146 HB VAL 146 12.451 -9.956 -0.330 933 HG11 VAL 146 1HG1 VAL 146 11.278 -11.619 -1.705 934 HG12 VAL 146 2HG1 VAL 146 9.971 -10.463 -2.032 935 HG13 VAL 146 3HG1 VAL 146 11.616 -10.174 -2.651 936 HG21 VAL 146 3HG2 VAL 146 11.336 -7.719 0.116 937 HG22 VAL 146 1HG2 VAL 146 11.834 -7.980 -1.560 938 HG23 VAL 146 2HG2 VAL 146 10.125 -8.135 -1.107 939 H ASP 147 H ASP 147 12.147 -11.949 1.748 940 HA ASP 147 HA ASP 147 11.362 -14.352 0.616 941 HB3 ASP 147 2HB ASP 147 12.772 -15.359 2.343 942 H LYS 148 H LYS 148 9.551 -12.605 2.959 943 HA LYS 148 HA LYS 148 8.047 -15.086 3.719 944 HB3 LYS 148 2HB LYS 148 8.922 -14.086 5.727 945 HG3 LYS 148 2HG LYS 148 7.710 -11.553 4.637 946 HD3 LYS 148 2HD LYS 148 6.753 -11.832 6.945 947 HE3 LYS 148 2HE LYS 148 9.720 -12.065 7.511 948 HZ1 LYS 148 3HZ LYS 148 9.399 -11.275 9.707 949 HZ2 LYS 148 1HZ LYS 148 7.780 -10.956 9.455 950 HZ3 LYS 148 2HZ LYS 148 8.947 -10.135 8.661 951 H TRP 149 H TRP 149 7.951 -12.310 1.769 952 HA TRP 149 HA TRP 149 4.986 -12.368 1.645 953 HB3 TRP 149 2HB TRP 149 5.133 -10.238 0.581 954 HD1 TRP 149 HD TRP 149 5.066 -10.991 3.699 955 HE1 TRP 149 1HE TRP 149 5.925 -9.300 5.432 956 HE3 TRP 149 3HE TRP 149 7.944 -8.116 0.638 957 HZ2 TRP 149 2HZ TRP 149 7.579 -6.954 5.458 958 HZ3 TRP 149 3HZ TRP 149 9.145 -6.145 1.503 959 HH2 TRP 149 HH TRP 149 8.994 -5.534 3.893 960 H SER 150 H SER 150 6.458 -14.544 0.567 961 HA SER 150 HA SER 150 5.409 -14.558 -2.135 962 HB3 SER 150 2HB SER 150 8.432 -14.548 -1.765 963 HG SER 150 HG SER 150 8.011 -15.909 -3.492 964 H LYS 151 H LYS 151 7.322 -16.194 0.412 965 HA LYS 151 HA LYS 151 7.671 -18.677 -0.586 966 HB3 LYS 151 2HB LYS 151 8.678 -18.159 1.387 967 HG3 LYS 151 2HG LYS 151 6.482 -16.745 2.298 968 HD3 LYS 151 2HD LYS 151 6.954 -18.993 4.286 969 HE3 LYS 151 2HE LYS 151 6.274 -16.552 4.915 970 HZ1 LYS 151 3HZ LYS 151 3.995 -16.089 4.724 971 HZ2 LYS 151 1HZ LYS 151 3.620 -17.558 4.097 972 HZ3 LYS 151 2HZ LYS 151 4.433 -16.447 3.189 Start of MODEL 4 1 H1 GLY 1 H GLY 1 -6.468 -24.754 -12.020 2 HA2 GLY 1 1HA GLY 1 -4.171 -24.000 -12.353 3 HA3 GLY 1 2HA GLY 1 -5.247 -22.621 -12.038 4 H MET 2 H MET 2 -2.281 -23.140 -11.456 5 HA MET 2 HA MET 2 -2.311 -22.055 -8.760 6 HB3 MET 2 2HB MET 2 -0.592 -24.501 -9.371 7 HG3 MET 2 2HG MET 2 -1.038 -22.727 -6.942 8 HE1 MET 2 3HE MET 2 -0.130 -22.964 -4.763 9 HE2 MET 2 1HE MET 2 1.099 -24.146 -4.247 10 HE3 MET 2 2HE MET 2 1.492 -22.907 -5.472 11 H ALA 3 H ALA 3 -1.317 -20.228 -9.114 12 HA ALA 3 HA ALA 3 1.209 -19.856 -10.386 13 HB1 ALA 3 1HB ALA 3 -0.095 -20.006 -12.477 14 HB2 ALA 3 2HB ALA 3 -1.324 -18.896 -11.828 15 HB3 ALA 3 3HB ALA 3 0.317 -18.310 -12.161 16 H LYS 4 H LYS 4 1.920 -18.446 -8.862 17 HA LYS 4 HA LYS 4 -0.060 -16.721 -7.438 18 HB3 LYS 4 2HB LYS 4 1.330 -16.701 -5.589 19 HG3 LYS 4 2HG LYS 4 1.272 -19.605 -6.550 20 HD3 LYS 4 2HD LYS 4 2.507 -18.719 -4.489 21 HE3 LYS 4 2HE LYS 4 0.184 -17.455 -3.905 22 HZ1 LYS 4 3HZ LYS 4 -0.833 -19.636 -3.369 23 HZ2 LYS 4 1HZ LYS 4 -0.859 -18.522 -2.151 24 HZ3 LYS 4 2HZ LYS 4 0.246 -19.778 -2.123 25 H LYS 5 H LYS 5 0.092 -15.108 -9.222 26 HA LYS 5 HA LYS 5 2.767 -14.087 -9.873 27 HB3 LYS 5 2HB LYS 5 1.774 -12.407 -11.187 28 HG3 LYS 5 2HG LYS 5 -0.641 -13.921 -11.481 29 HD3 LYS 5 2HD LYS 5 0.613 -12.378 -13.189 30 HE3 LYS 5 2HE LYS 5 1.705 -14.959 -14.258 31 HZ1 LYS 5 3HZ LYS 5 2.251 -12.951 -15.399 32 HZ2 LYS 5 1HZ LYS 5 3.614 -13.566 -14.669 33 HZ3 LYS 5 2HZ LYS 5 2.874 -12.249 -14.032 34 H THR 6 H THR 6 3.054 -11.772 -9.712 35 HA THR 6 HA THR 6 2.290 -10.655 -7.092 36 HB THR 6 HB THR 6 5.197 -10.999 -7.851 37 HG1 THR 6 1HG THR 6 5.147 -12.489 -6.080 38 HG21 THR 6 3HG2 THR 6 3.764 -9.592 -5.585 39 HG22 THR 6 1HG2 THR 6 5.241 -9.141 -6.448 40 HG23 THR 6 2HG2 THR 6 5.262 -10.428 -5.226 41 H LEU 7 H LEU 7 2.615 -8.358 -6.902 42 HA LEU 7 HA LEU 7 3.488 -6.943 -9.325 43 HB3 LEU 7 2HB LEU 7 1.077 -5.762 -8.109 44 HG LEU 7 HG LEU 7 1.375 -6.910 -10.916 45 HD11 LEU 7 1HD1 LEU 7 -0.358 -5.197 -11.435 46 HD12 LEU 7 2HD1 LEU 7 -0.384 -4.730 -9.715 47 HD13 LEU 7 3HD1 LEU 7 -0.898 -6.346 -10.202 48 HD21 LEU 7 3HD2 LEU 7 2.421 -4.286 -9.839 49 HD22 LEU 7 1HD2 LEU 7 1.901 -4.450 -11.508 50 HD23 LEU 7 2HD2 LEU 7 3.188 -5.475 -10.937 51 H ILE 8 H ILE 8 4.347 -4.895 -8.858 52 HA ILE 8 HA ILE 8 4.346 -3.968 -6.018 53 HB ILE 8 HB ILE 8 6.568 -3.687 -8.098 54 HG13 ILE 8 2HG1 ILE 8 6.233 -5.551 -5.724 55 HG21 ILE 8 1HG2 ILE 8 6.550 -2.907 -5.154 56 HG22 ILE 8 2HG2 ILE 8 7.881 -2.710 -6.297 57 HG23 ILE 8 3HG2 ILE 8 6.408 -1.759 -6.504 58 HD11 ILE 8 3HD1 ILE 8 7.673 -7.040 -7.137 59 HD12 ILE 8 1HD1 ILE 8 6.110 -6.690 -7.872 60 HD13 ILE 8 2HD1 ILE 8 7.578 -5.848 -8.443 61 H LEU 9 H LEU 9 2.816 -2.364 -5.994 62 HA LEU 9 HA LEU 9 2.637 -0.366 -8.181 63 HB3 LEU 9 2HB LEU 9 0.670 0.300 -6.479 64 HG LEU 9 HG LEU 9 -0.913 -1.286 -7.549 65 HD11 LEU 9 1HD1 LEU 9 -0.657 -0.331 -9.843 66 HD12 LEU 9 2HD1 LEU 9 0.940 0.294 -9.386 67 HD13 LEU 9 3HD1 LEU 9 -0.525 0.875 -8.574 68 HD21 LEU 9 3HD2 LEU 9 1.517 -2.304 -9.036 69 HD22 LEU 9 1HD2 LEU 9 -0.179 -2.626 -9.441 70 HD23 LEU 9 2HD2 LEU 9 0.496 -3.218 -7.907 71 H TYR 10 H TYR 10 4.100 1.328 -7.826 72 HA TYR 10 HA TYR 10 4.224 2.442 -5.053 73 HB3 TYR 10 2HB TYR 10 6.279 1.137 -5.500 74 HD1 TYR 10 1HD TYR 10 6.354 0.141 -7.832 75 HD2 TYR 10 2HD TYR 10 7.451 4.249 -7.044 76 HE1 TYR 10 1HE TYR 10 7.410 0.282 -10.059 77 HE2 TYR 10 2HE TYR 10 8.441 4.412 -9.291 78 HH TYR 10 HH TYR 10 8.098 3.196 -11.512 79 H TYR 11 H TYR 11 4.325 4.709 -4.930 80 HA TYR 11 HA TYR 11 3.236 5.930 -7.332 81 HB3 TYR 11 2HB TYR 11 2.319 5.577 -4.859 82 HD1 TYR 11 2HD TYR 11 4.143 6.018 -3.114 83 HD2 TYR 11 1HD TYR 11 1.831 9.121 -5.063 84 HE1 TYR 11 2HE TYR 11 4.812 7.635 -1.381 85 HE2 TYR 11 1HE TYR 11 2.542 10.728 -3.373 86 HH TYR 11 HH TYR 11 3.723 11.063 -1.472 87 H SER 12 H SER 12 3.650 7.912 -8.062 88 HA SER 12 HA SER 12 6.367 8.778 -8.117 89 HB3 SER 12 2HB SER 12 3.745 10.053 -8.969 90 HG SER 12 HG SER 12 4.807 11.521 -9.919 91 H TRP 13 H TRP 13 7.373 9.879 -6.598 92 HA TRP 13 HA TRP 13 6.254 12.279 -5.511 93 HB3 TRP 13 2HB TRP 13 6.829 9.968 -3.636 94 HD1 TRP 13 HD TRP 13 8.348 10.463 -1.683 95 HE1 TRP 13 1HE TRP 13 9.195 12.496 -0.456 96 HE3 TRP 13 3HE TRP 13 5.519 14.032 -4.031 97 HZ2 TRP 13 2HZ TRP 13 8.600 15.383 -0.375 98 HZ3 TRP 13 3HZ TRP 13 5.754 16.435 -3.390 99 HH2 TRP 13 HH TRP 13 7.289 17.088 -1.571 100 H SER 14 H SER 14 8.908 10.160 -4.350 101 HA SER 14 HA SER 14 10.944 11.767 -5.744 102 HB3 SER 14 2HB SER 14 12.219 11.749 -3.528 103 HG SER 14 HG SER 14 11.564 13.626 -3.961 104 H GLY 15 H GLY 15 13.086 10.665 -5.495 105 HA2 GLY 15 1HA GLY 15 12.755 8.234 -6.814 106 HA3 GLY 15 2HA GLY 15 14.289 8.965 -6.341 107 H GLU 16 H GLU 16 12.727 8.477 -3.453 108 HA GLU 16 HA GLU 16 14.193 6.325 -2.459 109 HB3 GLU 16 2HB GLU 16 12.308 6.122 -0.814 110 HG3 GLU 16 2HG GLU 16 14.233 7.885 -0.676 111 H THR 17 H THR 17 10.673 6.128 -3.444 112 HA THR 17 HA THR 17 10.795 3.317 -3.041 113 HB THR 17 HB THR 17 8.560 3.271 -4.075 114 HG1 THR 17 1HG THR 17 7.980 5.853 -4.057 115 HG21 THR 17 3HG2 THR 17 8.837 3.587 -1.680 116 HG22 THR 17 1HG2 THR 17 7.463 4.538 -2.264 117 HG23 THR 17 2HG2 THR 17 9.005 5.341 -1.883 118 H LYS 18 H LYS 18 11.405 5.228 -5.940 119 HA LYS 18 HA LYS 18 11.094 3.268 -7.894 120 HB3 LYS 18 2HB LYS 18 13.251 5.413 -7.670 121 HG3 LYS 18 2HG LYS 18 13.040 3.423 -9.713 122 HD3 LYS 18 2HD LYS 18 12.838 4.903 -11.707 123 HE3 LYS 18 2HE LYS 18 10.325 4.639 -10.015 124 HZ1 LYS 18 3HZ LYS 18 9.165 4.743 -12.138 125 HZ2 LYS 18 1HZ LYS 18 10.596 5.026 -12.939 126 HZ3 LYS 18 2HZ LYS 18 9.980 6.119 -11.916 127 H LYS 19 H LYS 19 14.209 3.929 -6.111 128 HA LYS 19 HA LYS 19 15.463 1.574 -7.146 129 HB3 LYS 19 2HB LYS 19 16.890 3.221 -6.154 130 HG3 LYS 19 2HG LYS 19 15.250 2.821 -3.655 131 HD3 LYS 19 2HD LYS 19 17.570 2.384 -2.960 132 HE3 LYS 19 2HE LYS 19 17.962 5.160 -4.141 133 HZ1 LYS 19 3HZ LYS 19 18.762 5.196 -1.887 134 HZ2 LYS 19 1HZ LYS 19 20.008 5.215 -2.947 135 HZ3 LYS 19 2HZ LYS 19 19.699 3.839 -2.138 136 H MET 20 H MET 20 13.287 2.037 -4.398 137 HA MET 20 HA MET 20 13.817 -0.610 -3.346 138 HB3 MET 20 2HB MET 20 12.125 0.150 -1.611 139 HG3 MET 20 2HG MET 20 13.550 1.623 -0.484 140 HE1 MET 20 3HE MET 20 14.200 -1.474 -1.388 141 HE2 MET 20 1HE MET 20 15.808 -1.625 -0.675 142 HE3 MET 20 2HE MET 20 14.517 -0.784 0.221 143 H ALA 21 H ALA 21 12.044 0.174 -5.935 144 HA ALA 21 HA ALA 21 10.006 -1.966 -5.429 145 HB1 ALA 21 1HB ALA 21 8.978 0.192 -5.916 146 HB2 ALA 21 2HB ALA 21 10.012 0.412 -7.347 147 HB3 ALA 21 3HB ALA 21 8.785 -0.862 -7.334 148 H GLU 22 H GLU 22 12.378 -0.608 -7.677 149 HA GLU 22 HA GLU 22 12.154 -2.456 -9.792 150 HB3 GLU 22 2HB GLU 22 14.494 -1.557 -10.304 151 HG3 GLU 22 2HG GLU 22 13.727 0.984 -9.962 152 H LYS 23 H LYS 23 13.916 -2.645 -6.708 153 HA LYS 23 HA LYS 23 15.474 -4.977 -7.460 154 HB3 LYS 23 2HB LYS 23 15.227 -4.985 -4.655 155 HG3 LYS 23 2HG LYS 23 17.333 -4.870 -6.336 156 HD3 LYS 23 2HD LYS 23 18.615 -2.987 -5.537 157 HE3 LYS 23 2HE LYS 23 16.089 -1.823 -6.771 158 HZ1 LYS 23 3HZ LYS 23 18.932 -1.234 -7.336 159 HZ2 LYS 23 1HZ LYS 23 17.991 -0.279 -6.396 160 HZ3 LYS 23 2HZ LYS 23 17.638 -0.478 -7.982 161 H ILE 24 H ILE 24 12.567 -4.621 -5.372 162 HA ILE 24 HA ILE 24 12.011 -7.318 -4.979 163 HB ILE 24 HB ILE 24 9.966 -5.085 -5.424 164 HG13 ILE 24 2HG1 ILE 24 11.669 -4.447 -3.735 165 HG21 ILE 24 1HG2 ILE 24 9.740 -7.598 -3.713 166 HG22 ILE 24 2HG2 ILE 24 8.464 -6.377 -3.954 167 HG23 ILE 24 3HG2 ILE 24 8.977 -7.379 -5.300 168 HD11 ILE 24 3HD1 ILE 24 10.231 -3.731 -1.956 169 HD12 ILE 24 1HD1 ILE 24 9.354 -3.578 -3.488 170 HD13 ILE 24 2HD1 ILE 24 9.001 -4.922 -2.377 171 H ASN 25 H ASN 25 11.084 -5.376 -7.880 172 HA ASN 25 HA ASN 25 9.502 -7.411 -9.095 173 HB3 ASN 25 2HB ASN 25 11.270 -5.298 -10.348 174 HD21 ASN 25 1HD2 ASN 25 8.317 -7.376 -11.132 175 HD22 ASN 25 2HD2 ASN 25 8.930 -7.693 -12.747 176 H SER 26 H SER 26 13.048 -7.052 -9.055 177 HA SER 26 HA SER 26 13.471 -9.301 -10.871 178 HB3 SER 26 2HB SER 26 15.540 -7.933 -9.124 179 HG SER 26 HG SER 26 16.153 -9.656 -10.524 180 H GLU 27 H GLU 27 12.995 -8.854 -7.407 181 HA GLU 27 HA GLU 27 14.425 -11.337 -6.729 182 HB3 GLU 27 2HB GLU 27 15.101 -9.151 -5.751 183 HG3 GLU 27 2HG GLU 27 12.537 -9.455 -4.492 184 H ILE 28 H ILE 28 11.699 -10.965 -7.867 185 HA ILE 28 HA ILE 28 10.410 -13.031 -6.157 186 HB ILE 28 HB ILE 28 9.116 -10.559 -7.347 187 HG13 ILE 28 2HG1 ILE 28 10.119 -10.073 -5.211 188 HG21 ILE 28 1HG2 ILE 28 7.697 -12.911 -6.035 189 HG22 ILE 28 2HG2 ILE 28 6.965 -11.413 -6.610 190 HG23 ILE 28 3HG2 ILE 28 7.642 -12.509 -7.758 191 HD11 ILE 28 3HD1 ILE 28 7.698 -9.312 -5.521 192 HD12 ILE 28 1HD1 ILE 28 7.263 -10.701 -4.500 193 HD13 ILE 28 2HD1 ILE 28 8.269 -9.425 -3.849 194 H LYS 29 H LYS 29 9.595 -14.733 -7.317 195 HA LYS 29 HA LYS 29 10.260 -14.888 -10.145 196 HB3 LYS 29 2HB LYS 29 8.351 -16.880 -8.951 197 HG3 LYS 29 2HG LYS 29 11.039 -17.750 -9.829 198 HD3 LYS 29 2HD LYS 29 9.010 -19.244 -9.657 199 HE3 LYS 29 2HE LYS 29 7.445 -17.593 -10.818 200 HZ1 LYS 29 3HZ LYS 29 7.376 -17.558 -13.147 201 HZ2 LYS 29 1HZ LYS 29 8.464 -18.755 -13.342 202 HZ3 LYS 29 2HZ LYS 29 8.987 -17.292 -12.831 203 H ASP 30 H ASP 30 8.883 -14.454 -11.839 204 HA ASP 30 HA ASP 30 7.085 -13.916 -13.061 205 HB3 ASP 30 2HB ASP 30 4.897 -14.951 -11.427 206 H SER 31 H SER 31 7.947 -11.998 -10.979 207 HA SER 31 HA SER 31 5.643 -10.610 -9.999 208 HB3 SER 31 2HB SER 31 8.411 -9.443 -10.356 209 HG SER 31 HG SER 31 7.887 -9.041 -8.043 210 H GLU 32 H GLU 32 5.675 -8.127 -10.496 211 HA GLU 32 HA GLU 32 6.467 -7.177 -13.109 212 HB3 GLU 32 2HB GLU 32 3.811 -6.322 -13.123 213 HG3 GLU 32 2HG GLU 32 5.358 -8.433 -14.548 214 H LEU 33 H LEU 33 6.163 -4.680 -13.125 215 HA LEU 33 HA LEU 33 5.434 -3.593 -10.532 216 HB3 LEU 33 2HB LEU 33 7.907 -3.647 -10.783 217 HG LEU 33 HG LEU 33 7.504 -1.510 -12.942 218 HD11 LEU 33 1HD1 LEU 33 9.967 -2.390 -11.368 219 HD12 LEU 33 2HD1 LEU 33 9.141 -0.830 -11.265 220 HD13 LEU 33 3HD1 LEU 33 9.984 -1.264 -12.744 221 HD21 LEU 33 3HD2 LEU 33 8.975 -4.188 -13.089 222 HD22 LEU 33 1HD2 LEU 33 9.115 -2.884 -14.286 223 HD23 LEU 33 2HD2 LEU 33 7.570 -3.684 -14.055 224 H LYS 34 H LYS 34 4.164 -1.819 -10.669 225 HA LYS 34 HA LYS 34 3.330 -0.747 -13.309 226 HB3 LYS 34 2HB LYS 34 1.043 -0.694 -11.783 227 HG3 LYS 34 2HG LYS 34 0.831 -1.434 -14.016 228 HD3 LYS 34 2HD LYS 34 2.722 -3.558 -13.463 229 HE3 LYS 34 2HE LYS 34 -0.096 -4.428 -14.102 230 HZ1 LYS 34 3HZ LYS 34 1.156 -6.485 -15.067 231 HZ2 LYS 34 1HZ LYS 34 2.395 -5.500 -15.311 232 HZ3 LYS 34 2HZ LYS 34 0.979 -5.159 -16.049 233 H GLU 35 H GLU 35 2.496 1.502 -12.983 234 HA GLU 35 HA GLU 35 3.711 2.688 -10.531 235 HB3 GLU 35 2HB GLU 35 3.942 4.702 -12.002 236 HG3 GLU 35 2HG GLU 35 5.530 2.485 -13.276 237 H VAL 36 H VAL 36 2.777 4.570 -9.710 238 HA VAL 36 HA VAL 36 -0.163 4.886 -10.157 239 HB VAL 36 HB VAL 36 1.485 5.047 -7.625 240 HG11 VAL 36 1HG1 VAL 36 -0.171 6.745 -7.443 241 HG12 VAL 36 2HG1 VAL 36 -1.415 5.717 -8.135 242 HG13 VAL 36 3HG1 VAL 36 -0.753 5.352 -6.532 243 HG21 VAL 36 3HG2 VAL 36 -0.612 3.073 -8.455 244 HG22 VAL 36 1HG2 VAL 36 1.130 2.756 -8.284 245 HG23 VAL 36 2HG2 VAL 36 0.186 3.179 -6.864 246 H LYS 37 H LYS 37 -0.632 7.011 -10.897 247 HA LYS 37 HA LYS 37 1.291 9.226 -10.315 248 HB3 LYS 37 2HB LYS 37 0.003 10.459 -12.019 249 HG3 LYS 37 2HG LYS 37 0.726 7.739 -13.187 250 HD3 LYS 37 2HD LYS 37 0.935 10.497 -14.462 251 HE3 LYS 37 2HE LYS 37 0.758 9.253 -16.564 252 HZ1 LYS 37 3HZ LYS 37 2.768 7.946 -16.486 253 HZ2 LYS 37 1HZ LYS 37 2.830 7.962 -14.862 254 HZ3 LYS 37 2HZ LYS 37 3.012 9.354 -15.708 255 H VAL 38 H VAL 38 0.042 11.319 -9.716 256 HA VAL 38 HA VAL 38 -2.277 10.752 -7.964 257 HB VAL 38 HB VAL 38 -1.082 12.349 -6.291 258 HG11 VAL 38 1HG1 VAL 38 -1.785 10.050 -5.840 259 HG12 VAL 38 2HG1 VAL 38 -0.288 9.435 -6.576 260 HG13 VAL 38 3HG1 VAL 38 -0.225 10.413 -5.082 261 HG21 VAL 38 3HG2 VAL 38 0.943 12.776 -7.729 262 HG22 VAL 38 1HG2 VAL 38 1.314 12.147 -6.117 263 HG23 VAL 38 2HG2 VAL 38 1.408 11.074 -7.519 264 H SER 39 H SER 39 -3.532 12.691 -7.409 265 HA SER 39 HA SER 39 -3.668 14.350 -9.742 266 HB3 SER 39 2HB SER 39 -5.482 14.600 -7.343 267 HG SER 39 HG SER 39 -6.922 15.090 -8.983 268 H GLU 40 H GLU 40 -4.754 16.705 -8.781 269 HA GLU 40 HA GLU 40 -2.366 18.223 -8.085 270 HB3 GLU 40 2HB GLU 40 -4.825 19.820 -8.405 271 HG3 GLU 40 2HG GLU 40 -3.356 20.022 -10.765 272 H GLY 41 H GLY 41 -3.335 20.435 -6.785 273 HA2 GLY 41 1HA GLY 41 -3.829 19.471 -4.027 274 HA3 GLY 41 2HA GLY 41 -3.355 21.104 -4.536 275 H THR 42 H THR 42 -4.978 22.610 -4.909 276 HA THR 42 HA THR 42 -7.775 21.715 -4.912 277 HB THR 42 HB THR 42 -7.185 21.725 -2.583 278 HG1 THR 42 1HG THR 42 -9.186 22.385 -2.978 279 HG21 THR 42 3HG2 THR 42 -5.263 23.330 -2.603 280 HG22 THR 42 1HG2 THR 42 -6.438 23.626 -1.327 281 HG23 THR 42 2HG2 THR 42 -6.427 24.667 -2.767 282 H PHE 43 H PHE 43 -8.765 22.808 -6.358 283 HA PHE 43 HA PHE 43 -8.980 23.873 -8.270 284 HB3 PHE 43 2HB PHE 43 -8.111 26.450 -8.139 285 HD1 PHE 43 2HD PHE 43 -10.879 24.128 -7.105 286 HD2 PHE 43 1HD PHE 43 -9.757 28.186 -8.091 287 HE1 PHE 43 2HE PHE 43 -13.250 24.715 -7.441 288 HE2 PHE 43 1HE PHE 43 -12.147 28.761 -8.401 289 HZ PHE 43 HZ PHE 43 -13.901 27.016 -8.078 290 H ASP 44 H ASP 44 -7.900 25.045 -10.046 291 HA ASP 44 HA ASP 44 -6.537 24.734 -11.749 292 HB3 ASP 44 2HB ASP 44 -3.942 24.763 -11.017 293 H ALA 45 H ALA 45 -4.649 23.282 -12.688 294 HA ALA 45 HA ALA 45 -5.103 20.505 -11.802 295 HB1 ALA 45 1HB ALA 45 -6.431 19.833 -13.682 296 HB2 ALA 45 2HB ALA 45 -7.254 21.184 -12.897 297 HB3 ALA 45 3HB ALA 45 -6.337 21.445 -14.409 298 H ASP 46 H ASP 46 -2.865 22.550 -12.956 299 HA ASP 46 HA ASP 46 -2.003 20.819 -15.245 300 HB3 ASP 46 2HB ASP 46 -1.673 23.811 -15.098 301 H MET 47 H MET 47 -0.933 21.426 -12.260 302 HA MET 47 HA MET 47 1.653 20.490 -13.033 303 HB3 MET 47 2HB MET 47 2.060 22.925 -13.115 304 HG3 MET 47 2HG MET 47 1.877 22.931 -10.117 305 HE1 MET 47 3HE MET 47 2.218 25.040 -8.791 306 HE2 MET 47 1HE MET 47 2.216 26.679 -9.496 307 HE3 MET 47 2HE MET 47 0.771 25.647 -9.615 308 H TYR 48 H TYR 48 2.716 20.665 -10.254 309 HA TYR 48 HA TYR 48 0.668 18.942 -8.922 310 HB3 TYR 48 2HB TYR 48 3.666 18.502 -9.109 311 HD1 TYR 48 2HD TYR 48 0.541 16.474 -8.413 312 HD2 TYR 48 1HD TYR 48 4.496 17.624 -7.095 313 HE1 TYR 48 2HE TYR 48 0.415 14.818 -6.605 314 HE2 TYR 48 1HE TYR 48 4.385 15.943 -5.291 315 HH TYR 48 HH TYR 48 2.725 14.570 -4.021 316 H LYS 49 H LYS 49 0.111 19.648 -6.975 317 HA LYS 49 HA LYS 49 2.085 21.154 -5.317 318 HB3 LYS 49 2HB LYS 49 -0.770 21.775 -4.805 319 HG3 LYS 49 2HG LYS 49 1.244 23.113 -3.979 320 HD3 LYS 49 2HD LYS 49 1.155 24.118 -6.867 321 HE3 LYS 49 2HE LYS 49 2.817 24.986 -4.460 322 HZ1 LYS 49 3HZ LYS 49 3.814 26.540 -5.928 323 HZ2 LYS 49 1HZ LYS 49 2.854 26.128 -7.183 324 HZ3 LYS 49 2HZ LYS 49 3.957 25.057 -6.653 325 H THR 50 H THR 50 0.250 18.306 -5.344 326 HA THR 50 HA THR 50 -1.580 18.855 -3.497 327 HB THR 50 HB THR 50 -1.334 16.909 -5.176 328 HG1 THR 50 1HG THR 50 -3.227 16.910 -4.293 329 HG21 THR 50 3HG2 THR 50 -0.601 15.335 -2.679 330 HG22 THR 50 1HG2 THR 50 0.594 15.834 -3.886 331 HG23 THR 50 2HG2 THR 50 -0.742 14.756 -4.350 332 H SER 51 H SER 51 1.673 17.686 -2.541 333 HA SER 51 HA SER 51 1.196 18.849 -0.010 334 HB3 SER 51 2HB SER 51 0.286 16.755 0.693 335 HG SER 51 HG SER 51 1.860 14.886 0.578 336 H ASP 52 H ASP 52 3.241 19.491 0.869 337 HA ASP 52 HA ASP 52 5.686 18.313 -0.333 338 HB3 ASP 52 2HB ASP 52 5.083 21.280 -0.449 339 H ILE 53 H ILE 53 4.204 19.100 2.503 340 HA ILE 53 HA ILE 53 6.771 19.628 3.857 341 HB ILE 53 HB ILE 53 5.489 21.726 3.324 342 HG13 ILE 53 2HG1 ILE 53 7.316 21.353 5.091 343 HG21 ILE 53 1HG2 ILE 53 3.674 21.016 5.662 344 HG22 ILE 53 2HG2 ILE 53 3.628 22.449 4.627 345 HG23 ILE 53 3HG2 ILE 53 3.190 20.864 3.970 346 HD11 ILE 53 3HD1 ILE 53 5.457 23.720 5.498 347 HD12 ILE 53 1HD1 ILE 53 7.197 23.626 5.851 348 HD13 ILE 53 2HD1 ILE 53 6.647 23.560 4.177 349 H ALA 54 H ALA 54 5.421 17.188 3.555 350 HA ALA 54 HA ALA 54 4.654 15.383 4.544 351 HB1 ALA 54 1HB ALA 54 5.801 16.744 6.977 352 HB2 ALA 54 2HB ALA 54 4.922 15.235 7.138 353 HB3 ALA 54 3HB ALA 54 6.357 15.304 6.105 354 H LEU 55 H LEU 55 3.568 17.606 7.122 355 HA LEU 55 HA LEU 55 0.926 16.515 7.290 356 HB3 LEU 55 2HB LEU 55 0.631 18.891 8.441 357 HG LEU 55 HG LEU 55 1.807 18.232 10.468 358 HD11 LEU 55 1HD1 LEU 55 0.326 15.846 9.326 359 HD12 LEU 55 2HD1 LEU 55 -0.469 17.354 9.793 360 HD13 LEU 55 3HD1 LEU 55 0.373 16.376 11.009 361 HD21 LEU 55 3HD2 LEU 55 2.774 15.757 9.000 362 HD22 LEU 55 1HD2 LEU 55 2.990 16.129 10.712 363 HD23 LEU 55 2HD2 LEU 55 3.777 17.137 9.492 364 H ASP 56 H ASP 56 -0.330 16.577 5.424 365 HA ASP 56 HA ASP 56 -1.416 19.256 5.013 366 HB3 ASP 56 2HB ASP 56 -0.903 17.946 2.391 367 H GLN 57 H GLN 57 -1.683 15.758 4.531 368 HA GLN 57 HA GLN 57 -4.625 15.981 4.192 369 HB3 GLN 57 2HB GLN 57 -4.394 13.596 3.422 370 HG3 GLN 57 2HG GLN 57 -4.585 15.518 1.823 371 HE21 GLN 57 1HE2 GLN 57 -3.589 17.136 0.675 372 HE22 GLN 57 2HE2 GLN 57 -1.895 17.235 0.284 373 H ILE 58 H ILE 58 -3.412 16.381 6.823 374 HA ILE 58 HA ILE 58 -4.473 13.961 8.211 375 HB ILE 58 HB ILE 58 -1.926 15.456 8.937 376 HG13 ILE 58 2HG1 ILE 58 -2.460 12.827 7.565 377 HG21 ILE 58 1HG2 ILE 58 -3.253 13.077 10.319 378 HG22 ILE 58 2HG2 ILE 58 -1.711 13.831 10.769 379 HG23 ILE 58 3HG2 ILE 58 -3.212 14.733 10.959 380 HD11 ILE 58 3HD1 ILE 58 0.122 14.406 7.548 381 HD12 ILE 58 1HD1 ILE 58 -0.559 13.345 6.294 382 HD13 ILE 58 2HD1 ILE 58 -1.231 14.959 6.559 383 H GLN 59 H GLN 59 -3.250 17.218 9.110 384 HA GLN 59 HA GLN 59 -5.016 17.398 11.355 385 HB3 GLN 59 2HB GLN 59 -4.196 19.807 11.314 386 HG3 GLN 59 2HG GLN 59 -2.118 17.592 11.222 387 HE21 GLN 59 1HE2 GLN 59 -0.878 18.644 13.616 388 HE22 GLN 59 2HE2 GLN 59 -0.097 20.174 13.245 389 H GLY 60 H GLY 60 -7.204 17.265 10.822 390 HA2 GLY 60 1HA GLY 60 -9.268 18.031 10.179 391 HA3 GLY 60 2HA GLY 60 -8.527 19.616 9.922 392 H ASN 61 H ASN 61 -7.222 16.909 8.084 393 HA ASN 61 HA ASN 61 -8.576 17.928 5.618 394 HB3 ASN 61 2HB ASN 61 -6.254 17.440 4.569 395 HD21 ASN 61 1HD2 ASN 61 -6.031 19.867 7.251 396 HD22 ASN 61 2HD2 ASN 61 -6.591 21.164 6.233 397 H LYS 62 H LYS 62 -9.906 16.256 5.243 398 HA LYS 62 HA LYS 62 -8.726 13.555 4.898 399 HB3 LYS 62 2HB LYS 62 -10.959 12.685 5.520 400 HG3 LYS 62 2HG LYS 62 -9.695 14.330 7.746 401 HD3 LYS 62 2HD LYS 62 -11.558 11.924 7.627 402 HE3 LYS 62 2HE LYS 62 -10.999 12.660 10.319 403 HZ1 LYS 62 3HZ LYS 62 -10.383 10.375 10.482 404 HZ2 LYS 62 1HZ LYS 62 -9.990 10.270 8.896 405 HZ3 LYS 62 2HZ LYS 62 -11.552 10.446 9.355 406 H ASP 63 H ASP 63 -9.116 15.893 3.019 407 HA ASP 63 HA ASP 63 -10.980 14.718 1.009 408 HB3 ASP 63 2HB ASP 63 -9.993 17.544 1.516 409 H PHE 64 H PHE 64 -9.429 13.187 0.383 410 HA PHE 64 HA PHE 64 -6.647 13.928 0.021 411 HB3 PHE 64 2HB PHE 64 -6.388 11.506 -0.392 412 HD1 PHE 64 2HD PHE 64 -6.324 13.300 2.090 413 HD2 PHE 64 1HD PHE 64 -8.687 9.824 1.133 414 HE1 PHE 64 2HE PHE 64 -6.562 12.819 4.476 415 HE2 PHE 64 1HE PHE 64 -8.947 9.348 3.536 416 HZ PHE 64 HZ PHE 64 -7.851 10.835 5.244 417 HA PRO 65 HA PRO 65 -6.795 14.219 -4.471 418 HB3 PRO 65 2HB PRO 65 -4.552 14.879 -4.389 419 HG3 PRO 65 2HG PRO 65 -2.978 13.777 -2.952 420 HD3 PRO 65 2HD PRO 65 -4.736 14.520 -1.564 421 H GLU 66 H GLU 66 -7.045 12.882 -6.443 422 HA GLU 66 HA GLU 66 -7.740 10.143 -6.052 423 HB3 GLU 66 2HB GLU 66 -7.825 12.403 -8.096 424 HG3 GLU 66 2HG GLU 66 -7.991 9.434 -8.717 425 H ILE 67 H ILE 67 -6.776 8.586 -7.515 426 HA ILE 67 HA ILE 67 -3.888 8.939 -8.163 427 HB ILE 67 HB ILE 67 -4.004 6.364 -8.329 428 HG13 ILE 67 2HG1 ILE 67 -6.580 6.323 -8.077 429 HG21 ILE 67 1HG2 ILE 67 -2.750 7.634 -6.650 430 HG22 ILE 67 2HG2 ILE 67 -4.183 7.731 -5.617 431 HG23 ILE 67 3HG2 ILE 67 -3.423 6.169 -5.938 432 HD11 ILE 67 3HD1 ILE 67 -6.663 4.297 -6.724 433 HD12 ILE 67 1HD1 ILE 67 -5.332 4.255 -7.889 434 HD13 ILE 67 2HD1 ILE 67 -5.007 4.583 -6.167 435 H GLN 68 H GLN 68 -3.256 8.348 -10.200 436 HA GLN 68 HA GLN 68 -5.349 7.741 -12.240 437 HB3 GLN 68 2HB GLN 68 -3.605 8.971 -13.768 438 HG3 GLN 68 2HG GLN 68 -5.486 10.524 -11.926 439 HE21 GLN 68 1HE2 GLN 68 -3.987 12.235 -11.449 440 HE22 GLN 68 2HE2 GLN 68 -3.471 13.341 -12.727 441 H LEU 69 H LEU 69 -4.810 6.027 -13.509 442 HA LEU 69 HA LEU 69 -2.165 4.981 -13.859 443 HB3 LEU 69 2HB LEU 69 -2.847 4.222 -11.483 444 HG LEU 69 HG LEU 69 -4.193 1.979 -12.959 445 HD11 LEU 69 1HD1 LEU 69 -4.518 0.952 -10.978 446 HD12 LEU 69 2HD1 LEU 69 -4.564 2.416 -10.027 447 HD13 LEU 69 3HD1 LEU 69 -2.996 1.782 -10.629 448 HD21 LEU 69 3HD2 LEU 69 -5.641 4.160 -11.359 449 HD22 LEU 69 1HD2 LEU 69 -6.357 2.615 -11.889 450 HD23 LEU 69 2HD2 LEU 69 -5.864 3.796 -13.089 451 H ASP 70 H ASP 70 -2.840 2.462 -14.772 452 HA ASP 70 HA ASP 70 -4.510 3.044 -17.142 453 HB3 ASP 70 2HB ASP 70 -3.144 0.452 -16.646 454 H ASN 71 H ASN 71 -5.741 0.820 -17.751 455 HA ASN 71 HA ASN 71 -7.577 -0.034 -15.601 456 HB3 ASN 71 2HB ASN 71 -7.077 -0.765 -18.459 457 HD21 ASN 71 1HD2 ASN 71 -9.089 -1.692 -15.551 458 HD22 ASN 71 2HD2 ASN 71 -9.533 -3.188 -16.344 459 H ILE 72 H ILE 72 -5.741 -0.561 -14.321 460 HA ILE 72 HA ILE 72 -4.392 -3.169 -14.847 461 HB ILE 72 HB ILE 72 -4.345 -1.738 -12.192 462 HG13 ILE 72 2HG1 ILE 72 -3.567 -0.125 -13.983 463 HG21 ILE 72 1HG2 ILE 72 -2.248 -2.968 -11.847 464 HG22 ILE 72 2HG2 ILE 72 -3.583 -4.041 -12.135 465 HG23 ILE 72 3HG2 ILE 72 -2.428 -3.718 -13.453 466 HD11 ILE 72 3HD1 ILE 72 -1.577 0.572 -12.956 467 HD12 ILE 72 1HD1 ILE 72 -2.583 -0.166 -11.675 468 HD13 ILE 72 2HD1 ILE 72 -1.232 -1.052 -12.342 469 H ASP 73 H ASP 73 -4.995 -5.043 -13.802 470 HA ASP 73 HA ASP 73 -7.400 -4.975 -12.065 471 HB3 ASP 73 2HB ASP 73 -6.560 -7.106 -14.067 472 H TYR 74 H TYR 74 -7.021 -5.793 -10.127 473 HA TYR 74 HA TYR 74 -4.423 -6.913 -9.420 474 HB3 TYR 74 2HB TYR 74 -5.115 -6.471 -7.173 475 HD1 TYR 74 2HD TYR 74 -3.548 -4.625 -8.312 476 HD2 TYR 74 1HD TYR 74 -7.842 -4.331 -8.006 477 HE1 TYR 74 2HE TYR 74 -3.408 -2.178 -8.669 478 HE2 TYR 74 1HE TYR 74 -7.710 -1.905 -8.442 479 HH TYR 74 HH TYR 74 -6.056 -0.388 -9.744 480 H ASN 75 H ASN 75 -7.694 -8.215 -10.022 481 HA ASN 75 HA ASN 75 -7.805 -10.306 -8.181 482 HB3 ASN 75 2HB ASN 75 -9.280 -11.474 -9.767 483 HD21 ASN 75 1HD2 ASN 75 -9.987 -9.724 -7.792 484 HD22 ASN 75 2HD2 ASN 75 -11.138 -8.566 -8.452 485 H ASN 76 H ASN 76 -6.310 -10.190 -11.336 486 HA ASN 76 HA ASN 76 -5.802 -13.024 -11.408 487 HB3 ASN 76 2HB ASN 76 -6.362 -11.649 -13.399 488 HD21 ASN 76 1HD2 ASN 76 -6.001 -9.260 -13.058 489 HD22 ASN 76 2HD2 ASN 76 -4.493 -8.572 -13.586 490 H TYR 77 H TYR 77 -4.316 -11.096 -9.366 491 HA TYR 77 HA TYR 77 -1.697 -12.473 -9.637 492 HB3 TYR 77 2HB TYR 77 -0.727 -10.631 -8.278 493 HD1 TYR 77 1HD TYR 77 -3.188 -8.832 -10.438 494 HD2 TYR 77 2HD TYR 77 0.793 -10.491 -10.203 495 HE1 TYR 77 1HE TYR 77 -2.584 -7.728 -12.564 496 HE2 TYR 77 2HE TYR 77 1.395 -9.360 -12.297 497 HH TYR 77 HH TYR 77 -0.967 -7.462 -14.243 498 H ASP 78 H ASP 78 -0.746 -12.743 -7.256 499 HA ASP 78 HA ASP 78 -2.954 -13.521 -5.413 500 HB3 ASP 78 2HB ASP 78 -0.455 -15.171 -5.654 501 H LEU 79 H LEU 79 -0.209 -11.626 -5.939 502 HA LEU 79 HA LEU 79 0.223 -11.180 -3.060 503 HB3 LEU 79 2HB LEU 79 2.600 -11.299 -4.864 504 HG LEU 79 HG LEU 79 3.796 -12.123 -3.116 505 HD11 LEU 79 1HD1 LEU 79 3.040 -9.814 -2.616 506 HD12 LEU 79 2HD1 LEU 79 3.455 -10.763 -1.198 507 HD13 LEU 79 3HD1 LEU 79 1.749 -10.485 -1.572 508 HD21 LEU 79 3HD2 LEU 79 2.490 -13.070 -0.996 509 HD22 LEU 79 1HD2 LEU 79 2.780 -14.055 -2.420 510 HD23 LEU 79 2HD2 LEU 79 1.191 -13.316 -2.186 511 H ILE 80 H ILE 80 0.479 -8.863 -2.712 512 HA ILE 80 HA ILE 80 1.426 -7.240 -4.987 513 HB ILE 80 HB ILE 80 -1.191 -6.626 -3.573 514 HG13 ILE 80 2HG1 ILE 80 -1.460 -8.343 -5.272 515 HG21 ILE 80 1HG2 ILE 80 -1.259 -4.620 -5.045 516 HG22 ILE 80 2HG2 ILE 80 0.132 -4.557 -3.985 517 HG23 ILE 80 3HG2 ILE 80 0.349 -5.031 -5.684 518 HD11 ILE 80 3HD1 ILE 80 -2.909 -7.401 -6.924 519 HD12 ILE 80 1HD1 ILE 80 -3.209 -6.561 -5.390 520 HD13 ILE 80 2HD1 ILE 80 -2.266 -5.775 -6.683 521 H LEU 81 H LEU 81 2.912 -5.846 -4.369 522 HA LEU 81 HA LEU 81 3.216 -5.176 -1.480 523 HB3 LEU 81 2HB LEU 81 5.528 -4.624 -2.040 524 HG LEU 81 HG LEU 81 6.549 -6.648 -2.230 525 HD11 LEU 81 1HD1 LEU 81 3.779 -7.347 -1.186 526 HD12 LEU 81 2HD1 LEU 81 5.122 -6.604 -0.270 527 HD13 LEU 81 3HD1 LEU 81 5.247 -8.261 -0.895 528 HD21 LEU 81 3HD2 LEU 81 5.749 -7.392 -4.414 529 HD22 LEU 81 1HD2 LEU 81 4.208 -7.909 -3.685 530 HD23 LEU 81 2HD2 LEU 81 5.729 -8.682 -3.204 531 H ILE 82 H ILE 82 3.447 -3.060 -0.826 532 HA ILE 82 HA ILE 82 2.834 -0.893 -2.785 533 HB ILE 82 HB ILE 82 1.896 -1.082 0.089 534 HG13 ILE 82 2HG1 ILE 82 0.882 -3.009 -1.194 535 HG21 ILE 82 1HG2 ILE 82 1.984 1.176 -1.035 536 HG22 ILE 82 2HG2 ILE 82 0.841 0.563 -2.251 537 HG23 ILE 82 3HG2 ILE 82 0.397 0.692 -0.536 538 HD11 ILE 82 3HD1 ILE 82 -0.330 -2.065 0.703 539 HD12 ILE 82 1HD1 ILE 82 -1.107 -0.874 -0.364 540 HD13 ILE 82 2HD1 ILE 82 -1.423 -2.593 -0.596 541 H GLY 83 H GLY 83 4.023 1.108 -2.439 542 HA2 GLY 83 1HA GLY 83 5.861 1.194 -0.101 543 HA3 GLY 83 2HA GLY 83 6.416 1.543 -1.718 544 H SER 84 H SER 84 6.206 3.139 0.784 545 HA SER 84 HA SER 84 5.104 5.720 -0.070 546 HB3 SER 84 2HB SER 84 3.136 5.356 0.913 547 HG SER 84 HG SER 84 3.009 3.628 2.659 548 HA PRO 85 HA PRO 85 8.432 6.835 2.904 549 HB3 PRO 85 2HB PRO 85 8.601 8.801 1.594 550 HG3 PRO 85 2HG PRO 85 6.655 9.964 0.858 551 HD3 PRO 85 2HD PRO 85 6.465 7.793 0.004 552 H VAL 86 H VAL 86 8.527 8.274 5.055 553 HA VAL 86 HA VAL 86 6.053 8.863 6.335 554 HB VAL 86 HB VAL 86 6.226 6.424 6.798 555 HG11 VAL 86 1HG1 VAL 86 7.710 5.546 8.504 556 HG12 VAL 86 2HG1 VAL 86 8.594 6.082 7.089 557 HG13 VAL 86 3HG1 VAL 86 8.606 7.077 8.561 558 HG21 VAL 86 3HG2 VAL 86 6.354 8.175 9.281 559 HG22 VAL 86 1HG2 VAL 86 4.921 7.943 8.233 560 HG23 VAL 86 2HG2 VAL 86 5.607 6.576 9.101 561 H TRP 87 H TRP 87 6.484 10.546 7.929 562 HA TRP 87 HA TRP 87 9.065 10.448 9.202 563 HB3 TRP 87 2HB TRP 87 8.429 13.074 7.831 564 HD1 TRP 87 HD TRP 87 11.396 11.059 9.349 565 HE1 TRP 87 1HE TRP 87 12.888 12.659 10.683 566 HE3 TRP 87 3HE TRP 87 9.143 15.478 8.121 567 HZ2 TRP 87 2HZ TRP 87 12.965 15.487 11.316 568 HZ3 TRP 87 3HZ TRP 87 9.981 17.606 9.053 569 HH2 TRP 87 HH TRP 87 11.866 17.618 10.688 570 H SER 88 H SER 88 5.867 11.540 9.221 571 HA SER 88 HA SER 88 6.141 11.940 12.115 572 HB3 SER 88 2HB SER 88 6.267 14.178 11.454 573 HG SER 88 HG SER 88 5.442 15.013 9.680 574 H GLY 89 H GLY 89 5.283 9.780 12.064 575 HA2 GLY 89 1HA GLY 89 3.626 8.371 12.604 576 HA3 GLY 89 2HA GLY 89 2.469 9.691 12.508 577 H TYR 90 H TYR 90 2.235 10.402 10.048 578 HA TYR 90 HA TYR 90 2.070 8.309 8.050 579 HB3 TYR 90 2HB TYR 90 0.368 7.341 9.206 580 HD1 TYR 90 2HD TYR 90 -0.045 10.974 10.029 581 HD2 TYR 90 1HD TYR 90 -1.771 7.043 10.359 582 HE1 TYR 90 2HE TYR 90 -1.285 11.678 12.032 583 HE2 TYR 90 1HE TYR 90 -2.963 7.712 12.391 584 HH TYR 90 HH TYR 90 -3.093 9.331 14.064 585 HA PRO 91 HA PRO 91 1.465 12.742 6.883 586 HB3 PRO 91 2HB PRO 91 3.535 13.207 7.803 587 HG3 PRO 91 2HG PRO 91 5.470 11.913 7.256 588 HD3 PRO 91 2HD PRO 91 4.002 10.454 8.357 589 H ALA 92 H ALA 92 0.329 10.940 5.069 590 HA ALA 92 HA ALA 92 0.293 12.356 2.662 591 HB1 ALA 92 1HB ALA 92 2.567 10.910 2.470 592 HB2 ALA 92 2HB ALA 92 1.472 9.563 2.409 593 HB3 ALA 92 3HB ALA 92 1.412 10.831 1.162 594 H THR 93 H THR 93 -1.443 11.030 1.181 595 HA THR 93 HA THR 93 -2.340 8.549 2.519 596 HB THR 93 HB THR 93 -4.729 9.223 2.044 597 HG1 THR 93 1HG THR 93 -4.558 10.905 0.702 598 HG21 THR 93 3HG2 THR 93 -3.395 11.098 4.027 599 HG22 THR 93 1HG2 THR 93 -3.710 9.376 4.328 600 HG23 THR 93 2HG2 THR 93 -5.047 10.485 4.028 601 HA PRO 94 HA PRO 94 -2.117 8.440 -2.179 602 HB3 PRO 94 2HB PRO 94 0.201 8.954 -2.472 603 HG3 PRO 94 2HG PRO 94 1.777 8.426 -0.719 604 HD3 PRO 94 2HD PRO 94 0.020 9.786 0.041 605 H ILE 95 H ILE 95 -1.706 6.143 0.393 606 HA ILE 95 HA ILE 95 -2.197 3.891 -1.443 607 HB ILE 95 HB ILE 95 -1.847 3.842 1.561 608 HG13 ILE 95 2HG1 ILE 95 0.565 3.251 1.108 609 HG21 ILE 95 1HG2 ILE 95 -0.991 1.536 1.089 610 HG22 ILE 95 2HG2 ILE 95 -2.692 1.782 0.728 611 HG23 ILE 95 3HG2 ILE 95 -1.537 1.748 -0.605 612 HD11 ILE 95 3HD1 ILE 95 0.409 4.904 -1.426 613 HD12 ILE 95 1HD1 ILE 95 1.752 3.977 -0.800 614 HD13 ILE 95 2HD1 ILE 95 0.361 3.134 -1.513 615 H LYS 96 H LYS 96 -4.091 6.218 0.184 616 HA LYS 96 HA LYS 96 -6.024 4.462 1.373 617 HB3 LYS 96 2HB LYS 96 -6.084 7.453 0.781 618 HG3 LYS 96 2HG LYS 96 -8.338 6.597 1.359 619 HD3 LYS 96 2HD LYS 96 -7.378 4.782 3.059 620 HE3 LYS 96 2HE LYS 96 -7.614 5.433 5.390 621 HZ1 LYS 96 3HZ LYS 96 -5.874 7.508 4.283 622 HZ2 LYS 96 1HZ LYS 96 -5.398 5.914 4.471 623 HZ3 LYS 96 2HZ LYS 96 -5.830 6.880 5.755 624 H THR 97 H THR 97 -6.199 6.325 -1.768 625 HA THR 97 HA THR 97 -8.940 5.393 -2.137 626 HB THR 97 HB THR 97 -6.888 6.439 -4.145 627 HG1 THR 97 1HG THR 97 -8.319 8.249 -4.080 628 HG21 THR 97 3HG2 THR 97 -9.840 6.156 -4.618 629 HG22 THR 97 1HG2 THR 97 -8.619 5.032 -5.248 630 HG23 THR 97 2HG2 THR 97 -8.560 6.713 -5.716 631 H LEU 98 H LEU 98 -5.747 4.217 -3.322 632 HA LEU 98 HA LEU 98 -6.686 2.142 -4.936 633 HB3 LEU 98 2HB LEU 98 -4.212 1.784 -3.217 634 HG LEU 98 HG LEU 98 -3.098 1.037 -5.145 635 HD11 LEU 98 1HD1 LEU 98 -4.608 -0.680 -4.246 636 HD12 LEU 98 2HD1 LEU 98 -4.194 -0.907 -5.952 637 HD13 LEU 98 3HD1 LEU 98 -5.787 -0.267 -5.529 638 HD21 LEU 98 3HD2 LEU 98 -3.867 2.670 -6.718 639 HD22 LEU 98 1HD2 LEU 98 -5.459 1.867 -6.833 640 HD23 LEU 98 2HD2 LEU 98 -3.994 1.053 -7.414 641 H LEU 99 H LEU 99 -6.002 2.058 -1.452 642 HA LEU 99 HA LEU 99 -6.621 -0.668 -0.991 643 HB3 LEU 99 2HB LEU 99 -7.315 0.282 1.388 644 HG LEU 99 HG LEU 99 -4.519 0.587 0.255 645 HD11 LEU 99 1HD1 LEU 99 -4.789 2.028 2.207 646 HD12 LEU 99 2HD1 LEU 99 -3.839 0.609 2.670 647 HD13 LEU 99 3HD1 LEU 99 -5.543 0.712 3.127 648 HD21 LEU 99 3HD2 LEU 99 -5.333 -1.753 0.260 649 HD22 LEU 99 1HD2 LEU 99 -5.778 -1.589 1.972 650 HD23 LEU 99 2HD2 LEU 99 -4.079 -1.511 1.477 651 H ASP 100 H ASP 100 -8.914 1.883 -1.756 652 HA ASP 100 HA ASP 100 -11.123 0.060 -0.911 653 HB3 ASP 100 2HB ASP 100 -11.801 2.704 -2.051 654 H GLN 101 H GLN 101 -9.316 1.022 -3.707 655 HA GLN 101 HA GLN 101 -11.317 0.099 -5.633 656 HB3 GLN 101 2HB GLN 101 -9.479 0.218 -7.275 657 HG3 GLN 101 2HG GLN 101 -9.762 2.734 -5.574 658 HE21 GLN 101 1HE2 GLN 101 -10.069 4.721 -6.919 659 HE22 GLN 101 2HE2 GLN 101 -9.202 4.890 -8.406 660 H MET 102 H MET 102 -8.534 -1.304 -3.937 661 HA MET 102 HA MET 102 -8.405 -3.806 -5.240 662 HB3 MET 102 2HB MET 102 -7.220 -4.409 -2.987 663 HG3 MET 102 2HG MET 102 -5.572 -2.355 -3.437 664 HE1 MET 102 3HE MET 102 -5.398 -5.632 -2.792 665 HE2 MET 102 1HE MET 102 -3.717 -5.708 -3.365 666 HE3 MET 102 2HE MET 102 -4.301 -4.289 -2.456 667 H LYS 103 H LYS 103 -11.281 -3.100 -3.964 668 HA LYS 103 HA LYS 103 -11.600 -4.756 -1.701 669 HB3 LYS 103 2HB LYS 103 -14.111 -4.740 -2.559 670 HG3 LYS 103 2HG LYS 103 -14.107 -2.081 -2.445 671 HD3 LYS 103 2HD LYS 103 -13.508 -4.082 -0.237 672 HE3 LYS 103 2HE LYS 103 -14.198 -1.128 0.057 673 HZ1 LYS 103 3HZ LYS 103 -14.025 -3.274 2.092 674 HZ2 LYS 103 1HZ LYS 103 -15.368 -2.382 1.674 675 HZ3 LYS 103 2HZ LYS 103 -14.083 -1.661 2.407 676 H ASN 104 H ASN 104 -11.607 -5.739 -5.015 677 HA ASN 104 HA ASN 104 -12.693 -8.426 -4.354 678 HB3 ASN 104 2HB ASN 104 -13.968 -7.428 -6.093 679 HD21 ASN 104 1HD2 ASN 104 -13.016 -5.081 -6.307 680 HD22 ASN 104 2HD2 ASN 104 -11.942 -4.723 -7.673 681 H TYR 105 H TYR 105 -9.775 -7.080 -4.124 682 HA TYR 105 HA TYR 105 -8.085 -8.773 -5.708 683 HB3 TYR 105 2HB TYR 105 -7.753 -7.306 -3.056 684 HD1 TYR 105 1HD TYR 105 -5.739 -8.608 -5.973 685 HD2 TYR 105 2HD TYR 105 -5.952 -7.837 -1.708 686 HE1 TYR 105 1HE TYR 105 -3.558 -9.698 -5.679 687 HE2 TYR 105 2HE TYR 105 -3.744 -8.951 -1.434 688 HH TYR 105 HH TYR 105 -1.799 -9.657 -2.591 689 H ARG 106 H ARG 106 -6.848 -10.582 -4.960 690 HA ARG 106 HA ARG 106 -7.823 -12.127 -2.675 691 HB3 ARG 106 2HB ARG 106 -7.893 -14.139 -4.062 692 HG3 ARG 106 2HG ARG 106 -9.776 -12.228 -5.462 693 HD3 ARG 106 2HD ARG 106 -10.787 -14.545 -3.947 694 HE ARG 106 HE ARG 106 -12.058 -13.393 -5.715 695 HH11 ARG 106 1HH1 ARG 106 -9.620 -15.724 -6.943 696 HH12 ARG 106 2HH1 ARG 106 -10.588 -16.270 -8.242 697 HH21 ARG 106 1HH2 ARG 106 -13.187 -13.865 -7.636 698 HH22 ARG 106 2HH2 ARG 106 -12.584 -15.056 -8.738 699 H GLY 107 H GLY 107 -5.981 -13.049 -1.750 700 HA2 GLY 107 1HA GLY 107 -3.725 -14.070 -2.259 701 HA3 GLY 107 2HA GLY 107 -3.427 -12.584 -3.170 702 H GLU 108 H GLU 108 -1.964 -11.553 -1.997 703 HA GLU 108 HA GLU 108 -2.304 -11.227 0.965 704 HB3 GLU 108 2HB GLU 108 0.282 -11.631 0.826 705 HG3 GLU 108 2HG GLU 108 -1.730 -13.894 0.360 706 H VAL 109 H VAL 109 -1.969 -9.156 1.658 707 HA VAL 109 HA VAL 109 -0.610 -7.282 -0.228 708 HB VAL 109 HB VAL 109 -2.416 -6.605 2.127 709 HG11 VAL 109 1HG1 VAL 109 -1.232 -4.939 -0.139 710 HG12 VAL 109 2HG1 VAL 109 -2.465 -4.356 0.999 711 HG13 VAL 109 3HG1 VAL 109 -0.863 -4.785 1.593 712 HG21 VAL 109 3HG2 VAL 109 -3.021 -6.747 -0.855 713 HG22 VAL 109 1HG2 VAL 109 -3.819 -7.655 0.461 714 HG23 VAL 109 2HG2 VAL 109 -4.051 -5.913 0.323 715 H ALA 110 H ALA 110 1.228 -6.244 0.361 716 HA ALA 110 HA ALA 110 1.980 -6.129 3.188 717 HB1 ALA 110 1HB ALA 110 3.556 -7.748 2.878 718 HB2 ALA 110 2HB ALA 110 3.440 -7.688 1.131 719 HB3 ALA 110 3HB ALA 110 4.459 -6.515 1.980 720 H SER 111 H SER 111 3.383 -4.220 3.622 721 HA SER 111 HA SER 111 3.285 -2.169 1.501 722 HB3 SER 111 2HB SER 111 2.091 -1.659 4.245 723 HG SER 111 HG SER 111 2.670 0.055 2.578 724 H PHE 112 H PHE 112 5.460 -1.737 1.404 725 HA PHE 112 HA PHE 112 7.071 -1.948 3.874 726 HB3 PHE 112 2HB PHE 112 7.883 -3.226 1.983 727 HD1 PHE 112 1HD PHE 112 6.484 -3.228 -0.097 728 HD2 PHE 112 2HD PHE 112 9.498 -0.273 0.676 729 HE1 PHE 112 1HE PHE 112 6.486 -2.581 -2.501 730 HE2 PHE 112 2HE PHE 112 9.494 0.376 -1.729 731 HZ PHE 112 HZ PHE 112 7.973 -0.792 -3.313 732 H PHE 113 H PHE 113 8.198 -0.200 4.782 733 HA PHE 113 HA PHE 113 7.626 2.462 3.537 734 HB3 PHE 113 2HB PHE 113 6.456 2.378 5.550 735 HD1 PHE 113 1HD PHE 113 6.291 0.152 6.670 736 HD2 PHE 113 2HD PHE 113 9.628 2.776 7.347 737 HE1 PHE 113 1HE PHE 113 6.915 -1.140 8.693 738 HE2 PHE 113 2HE PHE 113 10.263 1.494 9.333 739 HZ PHE 113 HZ PHE 113 8.883 -0.519 10.015 740 H THR 114 H THR 114 9.332 3.760 3.053 741 HA THR 114 HA THR 114 12.026 2.531 3.318 742 HB THR 114 HB THR 114 12.396 3.713 1.079 743 HG1 THR 114 1HG THR 114 9.613 3.592 0.808 744 HG21 THR 114 3HG2 THR 114 10.975 2.009 -0.208 745 HG22 THR 114 1HG2 THR 114 10.367 1.481 1.381 746 HG23 THR 114 2HG2 THR 114 12.066 1.332 1.004 747 H SER 115 H SER 115 11.014 4.152 5.351 748 HA SER 115 HA SER 115 12.770 6.475 5.442 749 HB3 SER 115 2HB SER 115 10.667 7.843 5.972 750 HG SER 115 HG SER 115 11.699 7.944 3.906 751 H ALA 116 H ALA 116 13.255 6.737 7.745 752 HA ALA 116 HA ALA 116 11.517 5.305 9.681 753 HB1 ALA 116 1HB ALA 116 14.405 4.478 9.160 754 HB2 ALA 116 2HB ALA 116 13.300 3.775 10.358 755 HB3 ALA 116 3HB ALA 116 12.968 3.570 8.637 756 H GLY 117 H GLY 117 13.325 8.057 9.140 757 HA2 GLY 117 1HA GLY 117 15.303 8.135 10.955 758 HA3 GLY 117 2HA GLY 117 14.435 9.563 10.395 759 H THR 118 H THR 118 11.883 8.855 11.814 760 HA THR 118 HA THR 118 12.634 8.890 14.674 761 HB THR 118 HB THR 118 10.752 10.927 14.523 762 HG1 THR 118 1HG THR 118 11.326 12.312 12.981 763 HG21 THR 118 3HG2 THR 118 12.645 12.412 15.103 764 HG22 THR 118 1HG2 THR 118 13.785 11.153 14.592 765 HG23 THR 118 2HG2 THR 118 12.731 10.865 15.972 766 H ASN 119 H ASN 119 10.886 7.253 12.473 767 HA ASN 119 HA ASN 119 8.654 6.678 14.332 768 HB3 ASN 119 2HB ASN 119 7.296 6.627 12.082 769 HD21 ASN 119 1HD2 ASN 119 6.605 7.046 14.713 770 HD22 ASN 119 2HD2 ASN 119 5.848 8.606 14.837 771 H HIS 120 H HIS 120 8.470 4.570 14.455 772 HA HIS 120 HA HIS 120 8.903 2.828 12.106 773 HB3 HIS 120 2HB HIS 120 10.119 2.385 14.880 774 HD1 HIS 120 1HD HIS 120 9.817 -0.233 15.419 775 HD2 HIS 120 2HD HIS 120 10.315 0.745 11.360 776 HE1 HIS 120 1HE HIS 120 9.695 -2.424 14.126 777 H LYS 121 H LYS 121 8.139 2.373 15.597 778 HA LYS 121 HA LYS 121 6.168 0.400 15.145 779 HB3 LYS 121 2HB LYS 121 5.346 1.038 17.483 780 HG3 LYS 121 2HG LYS 121 7.334 0.440 18.753 781 HD3 LYS 121 2HD LYS 121 7.438 -1.308 16.286 782 HE3 LYS 121 2HE LYS 121 8.777 -1.788 18.457 783 HZ1 LYS 121 3HZ LYS 121 6.947 -1.469 20.066 784 HZ2 LYS 121 1HZ LYS 121 7.503 -3.003 20.111 785 HZ3 LYS 121 2HZ LYS 121 6.078 -2.647 19.354 786 H ALA 122 H ALA 122 5.776 3.987 15.155 787 HA ALA 122 HA ALA 122 2.939 3.995 15.325 788 HB1 ALA 122 1HB ALA 122 4.189 6.035 15.576 789 HB2 ALA 122 2HB ALA 122 4.880 5.879 13.957 790 HB3 ALA 122 3HB ALA 122 3.146 6.203 14.154 791 H TYR 123 H TYR 123 4.996 3.984 12.331 792 HA TYR 123 HA TYR 123 2.924 4.008 10.516 793 HB3 TYR 123 2HB TYR 123 5.546 2.507 10.148 794 HD1 TYR 123 1HD TYR 123 4.485 0.936 8.517 795 HD2 TYR 123 2HD TYR 123 4.224 5.229 7.969 796 HE1 TYR 123 1HE TYR 123 3.738 0.597 6.193 797 HE2 TYR 123 2HE TYR 123 3.495 4.887 5.667 798 HH TYR 123 HH TYR 123 3.537 1.776 4.047 799 H VAL 124 H VAL 124 4.424 1.081 11.954 800 HA VAL 124 HA VAL 124 2.986 -0.795 10.411 801 HB VAL 124 HB VAL 124 4.169 -0.996 13.205 802 HG11 VAL 124 1HG1 VAL 124 3.340 -3.151 11.214 803 HG12 VAL 124 2HG1 VAL 124 4.448 -3.471 12.565 804 HG13 VAL 124 3HG1 VAL 124 2.799 -2.906 12.880 805 HG21 VAL 124 3HG2 VAL 124 6.181 -1.925 12.074 806 HG22 VAL 124 1HG2 VAL 124 5.421 -1.671 10.498 807 HG23 VAL 124 2HG2 VAL 124 5.876 -0.285 11.513 808 H SER 125 H SER 125 1.911 1.079 13.174 809 HA SER 125 HA SER 125 -0.488 -0.655 13.563 810 HB3 SER 125 2HB SER 125 0.137 1.783 15.182 811 HG SER 125 HG SER 125 -1.518 -0.018 15.662 812 H HIS 126 H HIS 126 0.486 2.716 12.666 813 HA HIS 126 HA HIS 126 -2.092 3.721 12.056 814 HB3 HIS 126 2HB HIS 126 -0.716 5.178 10.460 815 HD1 HIS 126 1HD HIS 126 1.444 6.819 11.647 816 HD2 HIS 126 2HD HIS 126 -1.642 5.059 13.899 817 HE1 HIS 126 1HE HIS 126 1.164 8.249 13.782 818 H PHE 127 H PHE 127 0.041 1.557 10.117 819 HA PHE 127 HA PHE 127 -1.525 1.912 7.737 820 HB3 PHE 127 2HB PHE 127 0.272 -0.392 8.542 821 HD1 PHE 127 1HD PHE 127 -1.221 1.506 5.621 822 HD2 PHE 127 2HD PHE 127 0.139 -2.294 7.122 823 HE1 PHE 127 1HE PHE 127 -1.828 0.429 3.478 824 HE2 PHE 127 2HE PHE 127 -0.542 -3.375 4.998 825 HZ PHE 127 HZ PHE 127 -1.518 -2.013 3.166 826 H ASN 128 H ASN 128 -1.711 -0.365 10.471 827 HA ASN 128 HA ASN 128 -3.835 -2.021 9.512 828 HB3 ASN 128 2HB ASN 128 -4.425 -2.042 12.098 829 HD21 ASN 128 1HD2 ASN 128 -0.975 -2.527 12.099 830 HD22 ASN 128 2HD2 ASN 128 -1.060 -4.247 11.772 831 H GLU 129 H GLU 129 -3.960 0.950 11.543 832 HA GLU 129 HA GLU 129 -6.737 1.188 11.593 833 HB3 GLU 129 2HB GLU 129 -6.300 3.622 11.978 834 HG3 GLU 129 2HG GLU 129 -5.017 3.560 13.957 835 H TRP 130 H TRP 130 -4.655 1.941 8.908 836 HA TRP 130 HA TRP 130 -6.843 3.410 7.528 837 HB3 TRP 130 2HB TRP 130 -4.885 4.202 6.133 838 HD1 TRP 130 HD TRP 130 -6.198 4.842 9.577 839 HE1 TRP 130 1HE TRP 130 -6.014 7.344 9.963 840 HE3 TRP 130 3HE TRP 130 -2.885 6.067 5.859 841 HZ2 TRP 130 2HZ TRP 130 -4.196 9.479 9.226 842 HZ3 TRP 130 3HZ TRP 130 -1.924 8.342 5.761 843 HH2 TRP 130 HH TRP 130 -2.575 10.066 7.422 844 H ALA 131 H ALA 131 -6.135 0.287 7.755 845 HA ALA 131 HA ALA 131 -6.750 -0.229 4.914 846 HB1 ALA 131 1HB ALA 131 -4.310 -1.500 6.215 847 HB2 ALA 131 2HB ALA 131 -4.841 -1.595 4.517 848 HB3 ALA 131 3HB ALA 131 -4.210 -0.073 5.158 849 H ASP 132 H ASP 132 -7.916 -0.764 7.773 850 HA ASP 132 HA ASP 132 -7.472 -3.476 8.420 851 HB3 ASP 132 2HB ASP 132 -9.679 -1.680 9.370 852 H GLY 133 H GLY 133 -8.184 -3.999 6.084 853 HA2 GLY 133 1HA GLY 133 -10.320 -5.878 6.621 854 HA3 GLY 133 2HA GLY 133 -10.773 -4.770 5.318 855 H LEU 134 H LEU 134 -7.839 -4.663 4.295 856 HA LEU 134 HA LEU 134 -8.054 -6.962 2.567 857 HB3 LEU 134 2HB LEU 134 -5.713 -6.203 1.905 858 HG LEU 134 HG LEU 134 -6.202 -3.948 1.121 859 HD11 LEU 134 1HD1 LEU 134 -6.815 -5.900 -0.357 860 HD12 LEU 134 2HD1 LEU 134 -7.848 -4.509 -0.641 861 HD13 LEU 134 3HD1 LEU 134 -8.486 -5.837 0.299 862 HD21 LEU 134 3HD2 LEU 134 -8.280 -2.900 1.160 863 HD22 LEU 134 1HD2 LEU 134 -7.758 -3.196 2.825 864 HD23 LEU 134 2HD2 LEU 134 -9.000 -4.242 2.074 865 H ASN 135 H ASN 135 -6.459 -8.666 2.426 866 HA ASN 135 HA ASN 135 -5.715 -9.792 5.005 867 HB3 ASN 135 2HB ASN 135 -5.154 -10.687 2.148 868 HD21 ASN 135 1HD2 ASN 135 -3.563 -12.157 2.062 869 HD22 ASN 135 2HD2 ASN 135 -3.064 -13.274 3.327 870 H VAL 136 H VAL 136 -4.075 -8.586 5.995 871 HA VAL 136 HA VAL 136 -1.713 -7.988 4.312 872 HB VAL 136 HB VAL 136 -2.464 -6.918 7.077 873 HG11 VAL 136 1HG1 VAL 136 -0.587 -5.262 6.644 874 HG12 VAL 136 2HG1 VAL 136 -0.034 -6.911 6.911 875 HG13 VAL 136 3HG1 VAL 136 -0.095 -6.251 5.257 876 HG21 VAL 136 3HG2 VAL 136 -2.424 -5.570 4.347 877 HG22 VAL 136 1HG2 VAL 136 -3.885 -5.992 5.275 878 HG23 VAL 136 2HG2 VAL 136 -2.788 -4.763 5.897 879 H ILE 137 H ILE 137 0.146 -8.932 4.573 880 HA ILE 137 HA ILE 137 0.592 -10.820 6.836 881 HB ILE 137 HB ILE 137 1.512 -12.421 5.175 882 HG13 ILE 137 2HG1 ILE 137 0.283 -10.599 3.050 883 HG21 ILE 137 1HG2 ILE 137 -0.616 -13.268 4.417 884 HG22 ILE 137 2HG2 ILE 137 -0.791 -12.591 6.046 885 HG23 ILE 137 3HG2 ILE 137 -1.385 -11.685 4.636 886 HD11 ILE 137 3HD1 ILE 137 2.627 -9.909 3.342 887 HD12 ILE 137 1HD1 ILE 137 3.125 -11.627 3.305 888 HD13 ILE 137 2HD1 ILE 137 2.445 -10.854 1.866 889 H GLY 138 H GLY 138 1.728 -7.981 5.771 890 HA2 GLY 138 1HA GLY 138 4.381 -8.546 6.710 891 HA3 GLY 138 2HA GLY 138 4.334 -8.431 4.948 892 H VAL 139 H VAL 139 4.887 -6.722 7.702 893 HA VAL 139 HA VAL 139 5.054 -4.247 6.098 894 HB VAL 139 HB VAL 139 3.832 -4.301 8.905 895 HG11 VAL 139 1HG1 VAL 139 3.996 -2.044 6.862 896 HG12 VAL 139 2HG1 VAL 139 3.296 -1.950 8.483 897 HG13 VAL 139 3HG1 VAL 139 5.040 -2.205 8.283 898 HG21 VAL 139 3HG2 VAL 139 2.151 -5.236 7.384 899 HG22 VAL 139 1HG2 VAL 139 1.714 -3.611 7.843 900 HG23 VAL 139 2HG2 VAL 139 2.402 -3.896 6.238 901 H ALA 140 H ALA 140 7.258 -4.043 6.042 902 HA ALA 140 HA ALA 140 8.616 -3.830 8.667 903 HB1 ALA 140 1HB ALA 140 9.031 -6.081 7.605 904 HB2 ALA 140 2HB ALA 140 9.698 -5.256 6.187 905 HB3 ALA 140 3HB ALA 140 10.484 -5.096 7.764 906 H ARG 141 H ARG 141 10.915 -2.721 8.180 907 HA ARG 141 HA ARG 141 10.508 -0.451 6.379 908 HB3 ARG 141 2HB ARG 141 13.011 -1.465 7.787 909 HG3 ARG 141 2HG ARG 141 12.429 1.407 7.102 910 HD3 ARG 141 2HD ARG 141 14.480 0.121 8.397 911 HE ARG 141 HE ARG 141 15.244 0.519 5.529 912 HH11 ARG 141 1HH1 ARG 141 16.294 -0.904 8.644 913 HH12 ARG 141 2HH1 ARG 141 17.577 -1.779 7.849 914 HH21 ARG 141 1HH2 ARG 141 16.799 -0.532 4.648 915 HH22 ARG 141 2HH2 ARG 141 17.976 -1.501 5.493 916 H ASP 142 H ASP 142 11.227 -0.354 4.412 917 HA ASP 142 HA ASP 142 11.858 -0.946 2.279 918 HB3 ASP 142 2HB ASP 142 14.206 -1.934 2.123 919 H ASP 143 H ASP 143 13.203 -3.146 1.273 920 HA ASP 143 HA ASP 143 11.113 -5.096 0.802 921 HB3 ASP 143 2HB ASP 143 12.371 -4.248 -1.073 922 H SER 144 H SER 144 12.749 -4.897 3.489 923 HA SER 144 HA SER 144 14.696 -6.945 3.384 924 HB3 SER 144 2HB SER 144 13.379 -5.886 5.902 925 HG SER 144 HG SER 144 15.076 -7.483 5.988 926 H GLU 145 H GLU 145 11.400 -7.525 3.378 927 HA GLU 145 HA GLU 145 11.778 -10.193 4.597 928 HB3 GLU 145 2HB GLU 145 9.781 -10.126 5.858 929 HG3 GLU 145 2HG GLU 145 10.908 -7.395 6.502 930 H VAL 146 H VAL 146 11.687 -9.113 1.742 931 HA VAL 146 HA VAL 146 9.179 -9.753 0.597 932 HB VAL 146 HB VAL 146 12.005 -9.542 -0.458 933 HG11 VAL 146 1HG1 VAL 146 10.941 -11.077 -2.039 934 HG12 VAL 146 2HG1 VAL 146 9.497 -10.049 -2.097 935 HG13 VAL 146 3HG1 VAL 146 11.033 -9.475 -2.767 936 HG21 VAL 146 3HG2 VAL 146 9.569 -7.815 -1.047 937 HG22 VAL 146 1HG2 VAL 146 10.653 -7.498 0.313 938 HG23 VAL 146 2HG2 VAL 146 11.289 -7.475 -1.337 939 H ASP 147 H ASP 147 11.970 -11.851 1.175 940 HA ASP 147 HA ASP 147 11.339 -14.177 -0.071 941 HB3 ASP 147 2HB ASP 147 12.330 -13.785 2.763 942 H LYS 148 H LYS 148 10.029 -13.272 3.138 943 HA LYS 148 HA LYS 148 8.466 -15.686 3.380 944 HB3 LYS 148 2HB LYS 148 8.995 -14.607 5.453 945 HG3 LYS 148 2HG LYS 148 7.796 -12.185 4.173 946 HD3 LYS 148 2HD LYS 148 6.547 -12.426 6.303 947 HE3 LYS 148 2HE LYS 148 9.351 -12.167 7.437 948 HZ1 LYS 148 3HZ LYS 148 8.166 -10.388 8.407 949 HZ2 LYS 148 1HZ LYS 148 8.232 -11.579 9.510 950 HZ3 LYS 148 2HZ LYS 148 6.815 -11.310 8.676 951 H TRP 149 H TRP 149 7.857 -12.603 1.716 952 HA TRP 149 HA TRP 149 5.013 -13.167 1.630 953 HB3 TRP 149 2HB TRP 149 4.815 -11.028 0.501 954 HD1 TRP 149 HD TRP 149 5.300 -11.655 3.684 955 HE1 TRP 149 1HE TRP 149 5.968 -9.709 5.151 956 HE3 TRP 149 3HE TRP 149 7.203 -8.635 0.063 957 HZ2 TRP 149 2HZ TRP 149 7.386 -7.086 4.781 958 HZ3 TRP 149 3HZ TRP 149 8.250 -6.470 0.619 959 HH2 TRP 149 HH TRP 149 8.396 -5.767 3.031 960 H SER 150 H SER 150 7.320 -14.723 0.015 961 HA SER 150 HA SER 150 5.335 -15.214 -2.160 962 HB3 SER 150 2HB SER 150 7.622 -15.671 -3.470 963 HG SER 150 HG SER 150 6.071 -14.266 -4.274 964 H LYS 151 H LYS 151 8.158 -16.222 -0.331 965 HA LYS 151 HA LYS 151 9.381 -18.200 -0.406 966 HB3 LYS 151 2HB LYS 151 8.085 -19.959 0.828 967 HG3 LYS 151 2HG LYS 151 7.655 -17.155 1.919 968 HD3 LYS 151 2HD LYS 151 8.430 -18.185 4.017 969 HE3 LYS 151 2HE LYS 151 6.093 -19.765 2.891 970 HZ1 LYS 151 3HZ LYS 151 5.247 -19.410 5.165 971 HZ2 LYS 151 1HZ LYS 151 6.622 -18.657 5.560 972 HZ3 LYS 151 2HZ LYS 151 6.683 -20.256 5.161 Start of MODEL 5 1 H1 GLY 1 H GLY 1 -6.367 -22.422 -9.427 2 HA2 GLY 1 1HA GLY 1 -4.665 -22.705 -11.834 3 HA3 GLY 1 2HA GLY 1 -4.933 -21.177 -10.968 4 H MET 2 H MET 2 -2.386 -22.392 -11.469 5 HA MET 2 HA MET 2 -1.344 -22.367 -8.737 6 HB3 MET 2 2HB MET 2 0.372 -24.161 -9.484 7 HG3 MET 2 2HG MET 2 -1.419 -26.082 -9.162 8 HE1 MET 2 3HE MET 2 -0.094 -22.903 -6.973 9 HE2 MET 2 1HE MET 2 -1.757 -23.248 -6.421 10 HE3 MET 2 2HE MET 2 -0.371 -23.601 -5.367 11 H ALA 3 H ALA 3 -1.229 -20.129 -9.728 12 HA ALA 3 HA ALA 3 1.475 -19.745 -10.630 13 HB1 ALA 3 1HB ALA 3 0.294 -19.736 -12.807 14 HB2 ALA 3 2HB ALA 3 -0.847 -18.518 -12.170 15 HB3 ALA 3 3HB ALA 3 0.868 -18.112 -12.369 16 H LYS 4 H LYS 4 2.063 -18.550 -8.992 17 HA LYS 4 HA LYS 4 0.165 -16.698 -7.599 18 HB3 LYS 4 2HB LYS 4 1.561 -16.714 -5.698 19 HG3 LYS 4 2HG LYS 4 1.060 -19.591 -6.546 20 HD3 LYS 4 2HD LYS 4 2.489 -18.599 -4.405 21 HE3 LYS 4 2HE LYS 4 0.564 -17.642 -3.283 22 HZ1 LYS 4 3HZ LYS 4 -0.525 -20.383 -3.260 23 HZ2 LYS 4 1HZ LYS 4 -1.183 -19.089 -4.075 24 HZ3 LYS 4 2HZ LYS 4 -1.148 -19.109 -2.445 25 H LYS 5 H LYS 5 0.413 -14.922 -8.976 26 HA LYS 5 HA LYS 5 3.111 -13.947 -9.705 27 HB3 LYS 5 2HB LYS 5 2.066 -12.179 -10.864 28 HG3 LYS 5 2HG LYS 5 1.552 -14.455 -11.929 29 HD3 LYS 5 2HD LYS 5 -1.089 -13.716 -10.655 30 HE3 LYS 5 2HE LYS 5 -2.161 -15.327 -12.213 31 HZ1 LYS 5 3HZ LYS 5 -2.073 -12.892 -12.725 32 HZ2 LYS 5 1HZ LYS 5 -2.412 -13.864 -13.996 33 HZ3 LYS 5 2HZ LYS 5 -0.916 -13.165 -13.820 34 H THR 6 H THR 6 3.192 -11.456 -9.385 35 HA THR 6 HA THR 6 2.255 -10.503 -6.775 36 HB THR 6 HB THR 6 5.180 -10.614 -7.638 37 HG1 THR 6 1HG THR 6 4.744 -12.415 -6.607 38 HG21 THR 6 3HG2 THR 6 5.703 -9.491 -5.484 39 HG22 THR 6 1HG2 THR 6 3.986 -9.106 -5.276 40 HG23 THR 6 2HG2 THR 6 4.895 -8.430 -6.642 41 H LEU 7 H LEU 7 1.913 -8.256 -6.790 42 HA LEU 7 HA LEU 7 3.031 -6.761 -9.075 43 HB3 LEU 7 2HB LEU 7 0.724 -5.455 -7.760 44 HG LEU 7 HG LEU 7 0.976 -6.093 -10.708 45 HD11 LEU 7 1HD1 LEU 7 -0.176 -3.632 -9.316 46 HD12 LEU 7 2HD1 LEU 7 -1.133 -5.062 -9.691 47 HD13 LEU 7 3HD1 LEU 7 -0.406 -4.135 -11.007 48 HD21 LEU 7 3HD2 LEU 7 2.260 -3.653 -9.418 49 HD22 LEU 7 1HD2 LEU 7 2.090 -3.987 -11.152 50 HD23 LEU 7 2HD2 LEU 7 3.108 -5.016 -10.203 51 H ILE 8 H ILE 8 3.873 -4.739 -8.467 52 HA ILE 8 HA ILE 8 4.127 -4.186 -5.562 53 HB ILE 8 HB ILE 8 6.255 -3.842 -7.700 54 HG13 ILE 8 2HG1 ILE 8 5.741 -6.319 -6.965 55 HG21 ILE 8 1HG2 ILE 8 6.177 -3.469 -4.686 56 HG22 ILE 8 2HG2 ILE 8 7.695 -3.478 -5.586 57 HG23 ILE 8 3HG2 ILE 8 6.485 -2.221 -5.915 58 HD11 ILE 8 3HD1 ILE 8 8.567 -5.305 -6.630 59 HD12 ILE 8 1HD1 ILE 8 8.035 -6.948 -7.010 60 HD13 ILE 8 2HD1 ILE 8 7.760 -5.641 -8.185 61 H LEU 9 H LEU 9 2.923 -2.358 -5.237 62 HA LEU 9 HA LEU 9 2.793 -0.278 -7.379 63 HB3 LEU 9 2HB LEU 9 0.836 0.541 -5.923 64 HG LEU 9 HG LEU 9 0.474 -2.195 -7.206 65 HD11 LEU 9 1HD1 LEU 9 -1.892 -1.489 -7.357 66 HD12 LEU 9 2HD1 LEU 9 -1.509 0.027 -6.516 67 HD13 LEU 9 3HD1 LEU 9 -1.351 -1.538 -5.679 68 HD21 LEU 9 3HD2 LEU 9 0.248 0.625 -8.378 69 HD22 LEU 9 1HD2 LEU 9 -0.390 -0.840 -9.157 70 HD23 LEU 9 2HD2 LEU 9 1.344 -0.678 -8.894 71 H TYR 10 H TYR 10 4.247 1.284 -7.109 72 HA TYR 10 HA TYR 10 4.711 2.337 -4.337 73 HB3 TYR 10 2HB TYR 10 6.724 3.345 -5.906 74 HD1 TYR 10 2HD TYR 10 6.500 3.232 -3.064 75 HD2 TYR 10 1HD TYR 10 8.150 0.328 -5.780 76 HE1 TYR 10 2HE TYR 10 8.108 2.492 -1.303 77 HE2 TYR 10 1HE TYR 10 9.844 -0.294 -4.070 78 HH TYR 10 HH TYR 10 9.515 0.319 -0.820 79 H TYR 11 H TYR 11 3.707 4.187 -3.975 80 HA TYR 11 HA TYR 11 3.298 6.242 -6.042 81 HB3 TYR 11 2HB TYR 11 3.054 6.278 -3.004 82 HD1 TYR 11 2HD TYR 11 1.021 8.004 -5.690 83 HD2 TYR 11 1HD TYR 11 3.936 8.477 -2.501 84 HE1 TYR 11 2HE TYR 11 0.978 10.421 -5.969 85 HE2 TYR 11 1HE TYR 11 3.709 10.942 -2.685 86 HH TYR 11 HH TYR 11 2.902 12.707 -4.041 87 H SER 12 H SER 12 4.545 8.218 -5.957 88 HA SER 12 HA SER 12 6.996 8.434 -4.470 89 HB3 SER 12 2HB SER 12 7.463 6.797 -6.386 90 HG SER 12 HG SER 12 6.113 8.054 -7.923 91 H TRP 13 H TRP 13 8.176 10.438 -5.772 92 HA TRP 13 HA TRP 13 6.199 12.177 -7.104 93 HB3 TRP 13 2HB TRP 13 7.878 13.172 -4.762 94 HD1 TRP 13 HD TRP 13 4.556 14.227 -6.467 95 HE1 TRP 13 1HE TRP 13 4.558 16.762 -6.812 96 HE3 TRP 13 3HE TRP 13 9.367 15.248 -4.997 97 HZ2 TRP 13 2HZ TRP 13 6.433 18.928 -6.601 98 HZ3 TRP 13 3HZ TRP 13 10.257 17.560 -5.164 99 HH2 TRP 13 HH TRP 13 8.801 19.409 -5.951 100 H SER 14 H SER 14 9.584 11.928 -5.923 101 HA SER 14 HA SER 14 10.524 12.038 -8.682 102 HB3 SER 14 2HB SER 14 11.353 14.070 -6.588 103 HG SER 14 HG SER 14 13.205 13.731 -7.454 104 H GLY 15 H GLY 15 11.257 10.019 -8.586 105 HA2 GLY 15 1HA GLY 15 12.985 8.578 -8.559 106 HA3 GLY 15 2HA GLY 15 13.894 10.035 -8.177 107 H GLU 16 H GLU 16 11.792 8.760 -5.623 108 HA GLU 16 HA GLU 16 14.245 8.067 -4.095 109 HB3 GLU 16 2HB GLU 16 12.683 7.921 -2.170 110 HG3 GLU 16 2HG GLU 16 12.547 10.626 -3.539 111 H THR 17 H THR 17 10.926 6.721 -4.217 112 HA THR 17 HA THR 17 11.634 4.156 -3.401 113 HB THR 17 HB THR 17 9.420 3.503 -4.322 114 HG1 THR 17 1HG THR 17 9.751 5.922 -5.640 115 HG21 THR 17 3HG2 THR 17 8.017 4.920 -2.911 116 HG22 THR 17 1HG2 THR 17 9.317 6.121 -2.756 117 HG23 THR 17 2HG2 THR 17 9.504 4.489 -2.068 118 H LYS 18 H LYS 18 11.858 5.439 -6.672 119 HA LYS 18 HA LYS 18 11.584 3.251 -8.311 120 HB3 LYS 18 2HB LYS 18 13.770 5.378 -8.451 121 HG3 LYS 18 2HG LYS 18 12.336 3.990 -10.744 122 HD3 LYS 18 2HD LYS 18 14.894 5.642 -10.657 123 HE3 LYS 18 2HE LYS 18 14.559 4.216 -12.700 124 HZ1 LYS 18 3HZ LYS 18 12.130 5.893 -12.980 125 HZ2 LYS 18 1HZ LYS 18 12.258 4.274 -13.104 126 HZ3 LYS 18 2HZ LYS 18 12.918 5.259 -14.266 127 H LYS 19 H LYS 19 14.776 4.173 -6.802 128 HA LYS 19 HA LYS 19 16.021 1.768 -7.561 129 HB3 LYS 19 2HB LYS 19 17.026 3.299 -5.213 130 HG3 LYS 19 2HG LYS 19 18.675 3.883 -7.270 131 HD3 LYS 19 2HD LYS 19 20.090 1.827 -6.770 132 HE3 LYS 19 2HE LYS 19 20.183 2.194 -4.218 133 HZ1 LYS 19 3HZ LYS 19 21.623 3.458 -5.498 134 HZ2 LYS 19 1HZ LYS 19 20.902 4.529 -4.514 135 HZ3 LYS 19 2HZ LYS 19 20.467 4.445 -6.121 136 H MET 20 H MET 20 13.555 1.879 -5.284 137 HA MET 20 HA MET 20 14.737 -0.357 -3.790 138 HB3 MET 20 2HB MET 20 12.964 0.149 -2.181 139 HG3 MET 20 2HG MET 20 13.597 2.258 -1.297 140 HE1 MET 20 3HE MET 20 14.915 0.016 -0.526 141 HE2 MET 20 1HE MET 20 15.507 -0.709 -2.046 142 HE3 MET 20 2HE MET 20 16.649 -0.214 -0.789 143 H ALA 21 H ALA 21 12.359 0.753 -6.016 144 HA ALA 21 HA ALA 21 10.448 -1.376 -5.794 145 HB1 ALA 21 1HB ALA 21 11.042 0.523 -8.103 146 HB2 ALA 21 2HB ALA 21 9.522 -0.346 -7.838 147 HB3 ALA 21 3HB ALA 21 10.047 0.926 -6.716 148 H GLU 22 H GLU 22 12.937 -0.685 -8.264 149 HA GLU 22 HA GLU 22 12.296 -2.956 -9.832 150 HB3 GLU 22 2HB GLU 22 14.198 -2.430 -11.185 151 HG3 GLU 22 2HG GLU 22 14.055 0.230 -11.022 152 H LYS 23 H LYS 23 14.674 -2.542 -7.050 153 HA LYS 23 HA LYS 23 16.180 -4.892 -7.526 154 HB3 LYS 23 2HB LYS 23 16.146 -4.837 -4.899 155 HG3 LYS 23 2HG LYS 23 18.031 -4.086 -6.531 156 HD3 LYS 23 2HD LYS 23 18.287 -1.519 -5.516 157 HE3 LYS 23 2HE LYS 23 17.619 -0.637 -7.763 158 HZ1 LYS 23 3HZ LYS 23 19.849 -1.711 -7.237 159 HZ2 LYS 23 1HZ LYS 23 19.453 -1.415 -8.817 160 HZ3 LYS 23 2HZ LYS 23 19.348 -2.937 -8.224 161 H ILE 24 H ILE 24 13.312 -4.401 -5.453 162 HA ILE 24 HA ILE 24 13.022 -7.142 -4.737 163 HB ILE 24 HB ILE 24 11.164 -4.710 -4.813 164 HG13 ILE 24 2HG1 ILE 24 13.210 -4.814 -3.238 165 HG21 ILE 24 1HG2 ILE 24 9.686 -6.677 -4.919 166 HG22 ILE 24 2HG2 ILE 24 10.550 -7.426 -3.579 167 HG23 ILE 24 3HG2 ILE 24 9.574 -5.962 -3.325 168 HD11 ILE 24 3HD1 ILE 24 12.030 -4.141 -1.173 169 HD12 ILE 24 1HD1 ILE 24 11.432 -3.338 -2.619 170 HD13 ILE 24 2HD1 ILE 24 10.503 -4.660 -1.860 171 H ASN 25 H ASN 25 11.703 -5.227 -7.471 172 HA ASN 25 HA ASN 25 9.941 -7.252 -8.427 173 HB3 ASN 25 2HB ASN 25 11.516 -5.171 -9.985 174 HD21 ASN 25 1HD2 ASN 25 8.207 -6.778 -10.088 175 HD22 ASN 25 2HD2 ASN 25 8.459 -7.313 -11.717 176 H SER 26 H SER 26 13.366 -6.674 -9.131 177 HA SER 26 HA SER 26 13.950 -8.875 -10.718 178 HB3 SER 26 2HB SER 26 16.161 -8.201 -8.990 179 HG SER 26 HG SER 26 16.541 -8.585 -11.138 180 H GLU 27 H GLU 27 13.267 -8.959 -7.218 181 HA GLU 27 HA GLU 27 14.996 -11.310 -6.874 182 HB3 GLU 27 2HB GLU 27 15.252 -9.133 -5.610 183 HG3 GLU 27 2HG GLU 27 12.843 -9.574 -4.765 184 H ILE 28 H ILE 28 11.686 -10.467 -7.028 185 HA ILE 28 HA ILE 28 10.711 -13.025 -5.982 186 HB ILE 28 HB ILE 28 9.325 -10.561 -7.086 187 HG13 ILE 28 2HG1 ILE 28 10.576 -10.140 -4.967 188 HG21 ILE 28 1HG2 ILE 28 8.171 -13.013 -5.674 189 HG22 ILE 28 2HG2 ILE 28 7.263 -11.542 -6.006 190 HG23 ILE 28 3HG2 ILE 28 7.842 -12.481 -7.348 191 HD11 ILE 28 3HD1 ILE 28 7.628 -10.156 -4.369 192 HD12 ILE 28 1HD1 ILE 28 8.885 -9.088 -3.748 193 HD13 ILE 28 2HD1 ILE 28 8.408 -8.971 -5.451 194 H LYS 29 H LYS 29 9.209 -14.256 -7.539 195 HA LYS 29 HA LYS 29 10.256 -14.318 -10.335 196 HB3 LYS 29 2HB LYS 29 8.326 -16.346 -9.858 197 HG3 LYS 29 2HG LYS 29 10.520 -16.356 -11.208 198 HD3 LYS 29 2HD LYS 29 11.498 -17.289 -8.465 199 HE3 LYS 29 2HE LYS 29 13.001 -17.269 -11.115 200 HZ1 LYS 29 3HZ LYS 29 14.608 -18.531 -9.902 201 HZ2 LYS 29 1HZ LYS 29 13.664 -18.575 -8.540 202 HZ3 LYS 29 2HZ LYS 29 14.321 -17.157 -9.073 203 H ASP 30 H ASP 30 8.965 -13.833 -12.021 204 HA ASP 30 HA ASP 30 7.299 -12.876 -13.169 205 HB3 ASP 30 2HB ASP 30 5.554 -14.772 -11.589 206 H SER 31 H SER 31 8.040 -11.378 -10.848 207 HA SER 31 HA SER 31 5.709 -10.109 -9.767 208 HB3 SER 31 2HB SER 31 7.418 -9.928 -8.290 209 HG SER 31 HG SER 31 9.761 -9.660 -9.425 210 H GLU 32 H GLU 32 4.730 -8.461 -10.676 211 HA GLU 32 HA GLU 32 6.093 -6.772 -12.758 212 HB3 GLU 32 2HB GLU 32 3.710 -5.759 -12.890 213 HG3 GLU 32 2HG GLU 32 4.207 -8.552 -13.920 214 H LEU 33 H LEU 33 5.516 -4.535 -12.399 215 HA LEU 33 HA LEU 33 5.082 -3.637 -9.727 216 HB3 LEU 33 2HB LEU 33 7.378 -3.612 -9.829 217 HG LEU 33 HG LEU 33 8.214 -3.874 -11.818 218 HD11 LEU 33 1HD1 LEU 33 8.103 -2.366 -13.797 219 HD12 LEU 33 2HD1 LEU 33 6.736 -1.548 -13.001 220 HD13 LEU 33 3HD1 LEU 33 6.652 -3.289 -13.430 221 HD21 LEU 33 3HD2 LEU 33 9.849 -2.076 -12.193 222 HD22 LEU 33 1HD2 LEU 33 9.567 -2.331 -10.459 223 HD23 LEU 33 2HD2 LEU 33 8.814 -0.953 -11.284 224 H LYS 34 H LYS 34 4.998 -1.164 -10.198 225 HA LYS 34 HA LYS 34 4.033 -0.029 -12.553 226 HB3 LYS 34 2HB LYS 34 1.507 0.024 -11.177 227 HG3 LYS 34 2HG LYS 34 2.153 0.127 -13.754 228 HD3 LYS 34 2HD LYS 34 2.529 -2.335 -14.174 229 HE3 LYS 34 2HE LYS 34 -0.422 -2.492 -13.384 230 HZ1 LYS 34 3HZ LYS 34 -0.188 -4.870 -13.873 231 HZ2 LYS 34 1HZ LYS 34 1.302 -4.674 -14.439 232 HZ3 LYS 34 2HZ LYS 34 0.047 -3.981 -15.226 233 H GLU 35 H GLU 35 3.140 2.257 -12.116 234 HA GLU 35 HA GLU 35 4.154 3.225 -9.471 235 HB3 GLU 35 2HB GLU 35 4.193 5.420 -10.584 236 HG3 GLU 35 2HG GLU 35 5.995 3.645 -12.241 237 H VAL 36 H VAL 36 2.777 4.479 -8.198 238 HA VAL 36 HA VAL 36 -0.088 4.637 -9.011 239 HB VAL 36 HB VAL 36 1.190 5.430 -6.372 240 HG11 VAL 36 1HG1 VAL 36 -1.683 4.732 -7.107 241 HG12 VAL 36 2HG1 VAL 36 -1.098 5.046 -5.461 242 HG13 VAL 36 3HG1 VAL 36 -1.075 6.340 -6.657 243 HG21 VAL 36 3HG2 VAL 36 -0.036 2.737 -7.069 244 HG22 VAL 36 1HG2 VAL 36 1.675 3.028 -6.707 245 HG23 VAL 36 2HG2 VAL 36 0.457 3.261 -5.453 246 H LYS 37 H LYS 37 -1.158 6.844 -9.094 247 HA LYS 37 HA LYS 37 0.690 9.173 -8.903 248 HB3 LYS 37 2HB LYS 37 -0.645 10.186 -10.720 249 HG3 LYS 37 2HG LYS 37 0.541 7.513 -11.610 250 HD3 LYS 37 2HD LYS 37 -0.575 9.944 -13.050 251 HE3 LYS 37 2HE LYS 37 0.826 7.607 -14.393 252 HZ1 LYS 37 3HZ LYS 37 -0.008 10.287 -15.326 253 HZ2 LYS 37 1HZ LYS 37 -0.846 8.922 -15.600 254 HZ3 LYS 37 2HZ LYS 37 0.663 9.108 -16.273 255 H VAL 38 H VAL 38 -0.597 11.222 -8.497 256 HA VAL 38 HA VAL 38 -3.254 10.697 -7.296 257 HB VAL 38 HB VAL 38 -3.159 12.898 -6.196 258 HG11 VAL 38 1HG1 VAL 38 -2.611 10.752 -5.071 259 HG12 VAL 38 2HG1 VAL 38 -0.911 11.051 -5.388 260 HG13 VAL 38 3HG1 VAL 38 -1.811 12.173 -4.369 261 HG21 VAL 38 3HG2 VAL 38 -1.094 14.079 -5.914 262 HG22 VAL 38 1HG2 VAL 38 -0.206 12.909 -6.906 263 HG23 VAL 38 2HG2 VAL 38 -1.433 13.958 -7.655 264 H SER 39 H SER 39 -4.852 12.502 -7.660 265 HA SER 39 HA SER 39 -5.404 13.151 -10.375 266 HB3 SER 39 2HB SER 39 -6.450 14.096 -7.673 267 HG SER 39 HG SER 39 -7.234 15.580 -9.007 268 H GLU 40 H GLU 40 -5.717 15.310 -11.097 269 HA GLU 40 HA GLU 40 -3.869 17.477 -10.493 270 HB3 GLU 40 2HB GLU 40 -4.918 17.068 -12.718 271 HG3 GLU 40 2HG GLU 40 -7.455 18.395 -11.808 272 H GLY 41 H GLY 41 -5.502 19.672 -10.186 273 HA2 GLY 41 1HA GLY 41 -6.520 19.335 -7.415 274 HA3 GLY 41 2HA GLY 41 -6.156 20.866 -8.232 275 H THR 42 H THR 42 -7.705 21.837 -9.464 276 HA THR 42 HA THR 42 -9.672 22.494 -10.215 277 HB THR 42 HB THR 42 -10.129 19.545 -10.768 278 HG1 THR 42 1HG THR 42 -8.964 19.949 -12.601 279 HG21 THR 42 3HG2 THR 42 -12.138 20.891 -11.260 280 HG22 THR 42 1HG2 THR 42 -11.357 20.350 -12.751 281 HG23 THR 42 2HG2 THR 42 -11.154 22.033 -12.201 282 H PHE 43 H PHE 43 -10.106 19.991 -7.676 283 HA PHE 43 HA PHE 43 -12.448 21.499 -6.713 284 HB3 PHE 43 2HB PHE 43 -13.267 19.633 -8.201 285 HD1 PHE 43 2HD PHE 43 -11.097 18.094 -8.687 286 HD2 PHE 43 1HD PHE 43 -13.769 17.606 -5.331 287 HE1 PHE 43 2HE PHE 43 -10.297 15.778 -8.391 288 HE2 PHE 43 1HE PHE 43 -13.001 15.280 -5.069 289 HZ PHE 43 HZ PHE 43 -11.273 14.336 -6.608 290 H ASP 44 H ASP 44 -12.998 20.870 -4.522 291 HA ASP 44 HA ASP 44 -12.489 21.000 -2.384 292 HB3 ASP 44 2HB ASP 44 -9.906 19.477 -2.823 293 H ALA 45 H ALA 45 -12.041 22.843 -1.564 294 HA ALA 45 HA ALA 45 -11.386 24.955 -1.284 295 HB1 ALA 45 1HB ALA 45 -8.875 23.288 -0.955 296 HB2 ALA 45 2HB ALA 45 -9.032 24.969 -0.382 297 HB3 ALA 45 3HB ALA 45 -10.075 23.688 0.271 298 H ASP 46 H ASP 46 -8.291 24.118 -2.791 299 HA ASP 46 HA ASP 46 -8.866 25.697 -5.210 300 HB3 ASP 46 2HB ASP 46 -6.781 26.625 -3.194 301 H MET 47 H MET 47 -6.487 23.879 -3.224 302 HA MET 47 HA MET 47 -5.283 22.702 -5.635 303 HB3 MET 47 2HB MET 47 -4.001 24.719 -5.497 304 HG3 MET 47 2HG MET 47 -3.633 24.191 -2.519 305 HE1 MET 47 3HE MET 47 -3.593 27.516 -2.100 306 HE2 MET 47 1HE MET 47 -2.833 26.299 -1.054 307 HE3 MET 47 2HE MET 47 -1.862 27.640 -1.709 308 H TYR 48 H TYR 48 -4.314 20.694 -5.199 309 HA TYR 48 HA TYR 48 -4.962 19.399 -2.712 310 HB3 TYR 48 2HB TYR 48 -3.221 17.700 -3.623 311 HD1 TYR 48 1HD TYR 48 -6.422 19.250 -4.837 312 HD2 TYR 48 2HD TYR 48 -3.934 15.702 -4.754 313 HE1 TYR 48 1HE TYR 48 -8.311 17.912 -5.506 314 HE2 TYR 48 2HE TYR 48 -5.902 14.333 -5.355 315 HH TYR 48 HH TYR 48 -9.152 15.767 -5.413 316 H LYS 49 H LYS 49 -3.630 18.759 -1.033 317 HA LYS 49 HA LYS 49 -1.108 20.309 -0.707 318 HB3 LYS 49 2HB LYS 49 -2.599 19.162 1.636 319 HG3 LYS 49 2HG LYS 49 -0.544 20.635 1.893 320 HD3 LYS 49 2HD LYS 49 -2.525 22.703 0.811 321 HE3 LYS 49 2HE LYS 49 0.097 23.048 2.317 322 HZ1 LYS 49 3HZ LYS 49 -0.282 25.388 1.978 323 HZ2 LYS 49 1HZ LYS 49 -1.606 25.095 1.048 324 HZ3 LYS 49 2HZ LYS 49 -0.057 24.622 0.577 325 H THR 50 H THR 50 -2.173 17.299 -1.410 326 HA THR 50 HA THR 50 -1.043 15.583 0.363 327 HB THR 50 HB THR 50 -2.854 15.269 -1.374 328 HG1 THR 50 1HG THR 50 -0.820 13.432 -0.871 329 HG21 THR 50 3HG2 THR 50 -2.373 14.438 -3.550 330 HG22 THR 50 1HG2 THR 50 -0.623 14.566 -3.300 331 HG23 THR 50 2HG2 THR 50 -1.617 16.034 -3.389 332 H SER 51 H SER 51 0.932 17.573 -1.371 333 HA SER 51 HA SER 51 3.019 15.626 -2.049 334 HB3 SER 51 2HB SER 51 2.458 16.901 -3.928 335 HG SER 51 HG SER 51 2.459 19.414 -3.291 336 H ASP 52 H ASP 52 2.191 17.563 0.586 337 HA ASP 52 HA ASP 52 4.735 18.938 0.873 338 HB3 ASP 52 2HB ASP 52 2.299 18.804 2.665 339 H ILE 53 H ILE 53 3.843 15.825 1.692 340 HA ILE 53 HA ILE 53 4.785 14.178 2.890 341 HB ILE 53 HB ILE 53 7.371 15.735 3.017 342 HG13 ILE 53 2HG1 ILE 53 5.927 15.046 0.508 343 HG21 ILE 53 1HG2 ILE 53 6.807 12.785 2.451 344 HG22 ILE 53 2HG2 ILE 53 8.403 13.554 2.560 345 HG23 ILE 53 3HG2 ILE 53 7.387 13.453 3.985 346 HD11 ILE 53 3HD1 ILE 53 8.573 16.504 0.983 347 HD12 ILE 53 1HD1 ILE 53 7.580 16.540 -0.487 348 HD13 ILE 53 2HD1 ILE 53 6.994 17.307 0.992 349 H ALA 54 H ALA 54 3.336 16.144 4.475 350 HA ALA 54 HA ALA 54 4.703 15.843 7.097 351 HB1 ALA 54 1HB ALA 54 5.375 18.020 6.099 352 HB2 ALA 54 2HB ALA 54 3.658 18.465 5.949 353 HB3 ALA 54 3HB ALA 54 4.385 18.223 7.558 354 H LEU 55 H LEU 55 2.781 17.485 8.448 355 HA LEU 55 HA LEU 55 0.311 15.854 8.268 356 HB3 LEU 55 2HB LEU 55 -0.543 17.550 9.885 357 HG LEU 55 HG LEU 55 0.572 15.129 10.304 358 HD11 LEU 55 1HD1 LEU 55 2.372 17.011 11.899 359 HD12 LEU 55 2HD1 LEU 55 2.889 15.945 10.583 360 HD13 LEU 55 3HD1 LEU 55 2.282 15.240 12.085 361 HD21 LEU 55 3HD2 LEU 55 -0.156 15.340 12.631 362 HD22 LEU 55 1HD2 LEU 55 -1.281 16.103 11.500 363 HD23 LEU 55 2HD2 LEU 55 -0.177 17.122 12.448 364 H ASP 56 H ASP 56 -0.055 16.239 6.099 365 HA ASP 56 HA ASP 56 -1.210 18.919 5.503 366 HB3 ASP 56 2HB ASP 56 0.450 18.630 3.937 367 H GLN 57 H GLN 57 -1.941 15.711 4.052 368 HA GLN 57 HA GLN 57 -4.772 16.081 4.584 369 HB3 GLN 57 2HB GLN 57 -4.606 13.582 3.590 370 HG3 GLN 57 2HG GLN 57 -5.752 15.020 2.253 371 HE21 GLN 57 1HE2 GLN 57 -5.914 17.220 2.951 372 HE22 GLN 57 2HE2 GLN 57 -4.961 18.489 2.209 373 H ILE 58 H ILE 58 -3.682 16.248 7.037 374 HA ILE 58 HA ILE 58 -4.639 13.738 8.345 375 HB ILE 58 HB ILE 58 -2.101 15.211 9.061 376 HG13 ILE 58 2HG1 ILE 58 -2.800 12.526 7.849 377 HG21 ILE 58 1HG2 ILE 58 -3.632 13.110 10.637 378 HG22 ILE 58 2HG2 ILE 58 -1.922 13.499 10.927 379 HG23 ILE 58 3HG2 ILE 58 -3.157 14.718 11.187 380 HD11 ILE 58 3HD1 ILE 58 -0.999 12.891 6.443 381 HD12 ILE 58 1HD1 ILE 58 -1.466 14.568 6.723 382 HD13 ILE 58 2HD1 ILE 58 -0.126 13.865 7.640 383 H GLN 59 H GLN 59 -3.481 16.868 9.890 384 HA GLN 59 HA GLN 59 -5.959 16.778 11.367 385 HB3 GLN 59 2HB GLN 59 -3.955 17.265 12.555 386 HG3 GLN 59 2HG GLN 59 -3.747 19.707 10.778 387 HE21 GLN 59 1HE2 GLN 59 -1.615 18.175 13.322 388 HE22 GLN 59 2HE2 GLN 59 -1.461 19.654 14.231 389 H GLY 60 H GLY 60 -7.647 18.233 11.276 390 HA2 GLY 60 1HA GLY 60 -9.210 19.476 10.264 391 HA3 GLY 60 2HA GLY 60 -7.945 20.316 9.369 392 H ASN 61 H ASN 61 -7.217 17.310 8.342 393 HA ASN 61 HA ASN 61 -8.520 17.789 5.859 394 HB3 ASN 61 2HB ASN 61 -7.041 15.283 6.764 395 HD21 ASN 61 1HD2 ASN 61 -8.277 13.857 5.329 396 HD22 ASN 61 2HD2 ASN 61 -8.460 14.243 3.624 397 H LYS 62 H LYS 62 -10.595 17.419 5.429 398 HA LYS 62 HA LYS 62 -12.137 15.426 6.879 399 HB3 LYS 62 2HB LYS 62 -12.900 17.219 4.541 400 HG3 LYS 62 2HG LYS 62 -14.545 15.250 5.461 401 HD3 LYS 62 2HD LYS 62 -16.242 16.419 6.952 402 HE3 LYS 62 2HE LYS 62 -14.873 16.353 9.118 403 HZ1 LYS 62 3HZ LYS 62 -14.407 13.929 8.868 404 HZ2 LYS 62 1HZ LYS 62 -14.883 14.003 7.308 405 HZ3 LYS 62 2HZ LYS 62 -15.938 14.392 8.505 406 H ASP 63 H ASP 63 -12.267 15.800 3.276 407 HA ASP 63 HA ASP 63 -12.355 12.863 3.074 408 HB3 ASP 63 2HB ASP 63 -12.584 13.385 0.590 409 H PHE 64 H PHE 64 -10.844 11.587 1.885 410 HA PHE 64 HA PHE 64 -8.111 12.633 1.847 411 HB3 PHE 64 2HB PHE 64 -7.636 10.252 1.127 412 HD1 PHE 64 2HD PHE 64 -10.194 10.977 3.886 413 HD2 PHE 64 1HD PHE 64 -6.276 9.468 2.832 414 HE1 PHE 64 2HE PHE 64 -9.688 10.748 6.201 415 HE2 PHE 64 1HE PHE 64 -5.819 9.078 5.245 416 HZ PHE 64 HZ PHE 64 -7.476 9.781 6.957 417 HA PRO 65 HA PRO 65 -8.267 13.807 -2.395 418 HB3 PRO 65 2HB PRO 65 -6.250 14.879 -2.033 419 HG3 PRO 65 2HG PRO 65 -4.525 13.851 -0.749 420 HD3 PRO 65 2HD PRO 65 -6.493 13.841 0.595 421 H GLU 66 H GLU 66 -8.239 13.014 -4.596 422 HA GLU 66 HA GLU 66 -8.470 10.145 -4.739 423 HB3 GLU 66 2HB GLU 66 -8.592 10.844 -7.328 424 HG3 GLU 66 2HG GLU 66 -10.807 11.652 -5.423 425 H ILE 67 H ILE 67 -7.542 8.925 -6.540 426 HA ILE 67 HA ILE 67 -4.649 9.390 -6.907 427 HB ILE 67 HB ILE 67 -4.342 6.959 -6.960 428 HG13 ILE 67 2HG1 ILE 67 -6.794 6.419 -7.447 429 HG21 ILE 67 1HG2 ILE 67 -5.473 7.950 -4.302 430 HG22 ILE 67 2HG2 ILE 67 -4.275 6.660 -4.544 431 HG23 ILE 67 3HG2 ILE 67 -3.859 8.324 -4.937 432 HD11 ILE 67 3HD1 ILE 67 -5.156 4.672 -6.845 433 HD12 ILE 67 1HD1 ILE 67 -5.589 4.905 -5.129 434 HD13 ILE 67 2HD1 ILE 67 -6.800 4.313 -6.274 435 H GLN 68 H GLN 68 -3.851 8.249 -8.877 436 HA GLN 68 HA GLN 68 -5.832 7.867 -11.038 437 HB3 GLN 68 2HB GLN 68 -3.659 8.826 -12.379 438 HG3 GLN 68 2HG GLN 68 -5.799 10.688 -11.267 439 HE21 GLN 68 1HE2 GLN 68 -3.892 12.301 -11.517 440 HE22 GLN 68 2HE2 GLN 68 -3.766 12.983 -13.113 441 H LEU 69 H LEU 69 -5.124 6.258 -12.518 442 HA LEU 69 HA LEU 69 -2.555 5.106 -12.474 443 HB3 LEU 69 2HB LEU 69 -3.551 4.138 -10.303 444 HG LEU 69 HG LEU 69 -4.971 2.310 -12.254 445 HD11 LEU 69 1HD1 LEU 69 -3.979 1.215 -10.296 446 HD12 LEU 69 2HD1 LEU 69 -5.739 1.153 -10.276 447 HD13 LEU 69 3HD1 LEU 69 -4.887 2.303 -9.222 448 HD21 LEU 69 3HD2 LEU 69 -6.439 4.284 -11.979 449 HD22 LEU 69 1HD2 LEU 69 -6.185 4.270 -10.222 450 HD23 LEU 69 2HD2 LEU 69 -7.103 2.975 -11.005 451 H ASP 70 H ASP 70 -2.789 2.850 -13.674 452 HA ASP 70 HA ASP 70 -3.940 3.344 -16.275 453 HB3 ASP 70 2HB ASP 70 -2.686 0.783 -15.438 454 H ASN 71 H ASN 71 -4.760 1.121 -17.357 455 HA ASN 71 HA ASN 71 -7.166 0.209 -15.902 456 HB3 ASN 71 2HB ASN 71 -6.187 -1.024 -18.479 457 HD21 ASN 71 1HD2 ASN 71 -7.516 -2.877 -17.178 458 HD22 ASN 71 2HD2 ASN 71 -9.233 -2.684 -17.171 459 H ILE 72 H ILE 72 -6.209 -0.658 -14.157 460 HA ILE 72 HA ILE 72 -4.597 -3.168 -14.500 461 HB ILE 72 HB ILE 72 -4.712 -1.514 -11.961 462 HG13 ILE 72 2HG1 ILE 72 -3.799 -0.111 -13.719 463 HG21 ILE 72 1HG2 ILE 72 -2.735 -3.642 -12.912 464 HG22 ILE 72 2HG2 ILE 72 -2.705 -2.801 -11.340 465 HG23 ILE 72 3HG2 ILE 72 -4.016 -3.896 -11.707 466 HD11 ILE 72 3HD1 ILE 72 -2.608 0.040 -11.573 467 HD12 ILE 72 1HD1 ILE 72 -1.422 -1.142 -12.163 468 HD13 ILE 72 2HD1 ILE 72 -1.621 0.409 -13.000 469 H ASP 73 H ASP 73 -5.508 -5.027 -14.005 470 HA ASP 73 HA ASP 73 -7.882 -5.200 -12.225 471 HB3 ASP 73 2HB ASP 73 -7.055 -7.762 -12.828 472 H TYR 74 H TYR 74 -7.395 -5.603 -10.042 473 HA TYR 74 HA TYR 74 -4.740 -6.632 -9.289 474 HB3 TYR 74 2HB TYR 74 -5.584 -6.431 -7.018 475 HD1 TYR 74 1HD TYR 74 -3.980 -4.610 -8.743 476 HD2 TYR 74 2HD TYR 74 -7.831 -4.082 -6.898 477 HE1 TYR 74 1HE TYR 74 -3.745 -2.148 -8.965 478 HE2 TYR 74 2HE TYR 74 -7.548 -1.613 -6.994 479 HH TYR 74 HH TYR 74 -6.435 0.027 -8.336 480 H ASN 75 H ASN 75 -7.820 -7.965 -10.189 481 HA ASN 75 HA ASN 75 -7.892 -10.206 -8.429 482 HB3 ASN 75 2HB ASN 75 -9.221 -11.261 -10.478 483 HD21 ASN 75 1HD2 ASN 75 -10.062 -7.848 -9.643 484 HD22 ASN 75 2HD2 ASN 75 -11.494 -8.330 -8.769 485 H ASN 76 H ASN 76 -5.810 -9.635 -11.127 486 HA ASN 76 HA ASN 76 -5.142 -12.493 -11.386 487 HB3 ASN 76 2HB ASN 76 -5.644 -11.737 -13.451 488 HD21 ASN 76 1HD2 ASN 76 -3.267 -9.138 -12.488 489 HD22 ASN 76 2HD2 ASN 76 -4.265 -7.898 -13.151 490 H TYR 77 H TYR 77 -4.206 -10.741 -9.014 491 HA TYR 77 HA TYR 77 -1.468 -11.768 -9.339 492 HB3 TYR 77 2HB TYR 77 -0.496 -9.981 -8.069 493 HD1 TYR 77 2HD TYR 77 0.413 -10.161 -10.564 494 HD2 TYR 77 1HD TYR 77 -2.820 -7.587 -9.331 495 HE1 TYR 77 2HE TYR 77 0.714 -8.829 -12.599 496 HE2 TYR 77 1HE TYR 77 -2.516 -6.230 -11.390 497 HH TYR 77 HH TYR 77 -0.535 -7.298 -14.009 498 H ASP 78 H ASP 78 -0.734 -12.899 -7.572 499 HA ASP 78 HA ASP 78 -2.785 -13.606 -5.560 500 HB3 ASP 78 2HB ASP 78 -0.041 -14.856 -5.845 501 H LEU 79 H LEU 79 -0.054 -11.578 -5.886 502 HA LEU 79 HA LEU 79 0.147 -11.162 -2.955 503 HB3 LEU 79 2HB LEU 79 2.525 -10.693 -4.668 504 HG LEU 79 HG LEU 79 3.862 -11.451 -3.021 505 HD11 LEU 79 1HD1 LEU 79 3.204 -10.429 -0.949 506 HD12 LEU 79 2HD1 LEU 79 1.490 -10.371 -1.431 507 HD13 LEU 79 3HD1 LEU 79 2.697 -9.392 -2.289 508 HD21 LEU 79 3HD2 LEU 79 3.078 -12.882 -1.155 509 HD22 LEU 79 1HD2 LEU 79 2.923 -13.621 -2.721 510 HD23 LEU 79 2HD2 LEU 79 1.466 -12.963 -1.919 511 H ILE 80 H ILE 80 0.024 -8.923 -2.454 512 HA ILE 80 HA ILE 80 0.665 -7.022 -4.644 513 HB ILE 80 HB ILE 80 -1.816 -6.898 -2.890 514 HG13 ILE 80 2HG1 ILE 80 -2.057 -8.515 -4.691 515 HG21 ILE 80 1HG2 ILE 80 -2.281 -4.809 -4.157 516 HG22 ILE 80 2HG2 ILE 80 -0.818 -4.685 -3.204 517 HG23 ILE 80 3HG2 ILE 80 -0.678 -4.943 -4.942 518 HD11 ILE 80 3HD1 ILE 80 -3.768 -7.719 -6.127 519 HD12 ILE 80 1HD1 ILE 80 -4.038 -7.030 -4.523 520 HD13 ILE 80 2HD1 ILE 80 -3.368 -6.028 -5.846 521 H LEU 81 H LEU 81 2.380 -6.028 -4.063 522 HA LEU 81 HA LEU 81 2.997 -5.459 -1.202 523 HB3 LEU 81 2HB LEU 81 5.323 -5.245 -1.982 524 HG LEU 81 HG LEU 81 4.028 -7.789 -3.057 525 HD11 LEU 81 1HD1 LEU 81 6.248 -8.790 -2.902 526 HD12 LEU 81 2HD1 LEU 81 6.957 -7.197 -2.579 527 HD13 LEU 81 3HD1 LEU 81 6.146 -7.540 -4.127 528 HD21 LEU 81 3HD2 LEU 81 4.961 -8.761 -0.929 529 HD22 LEU 81 1HD2 LEU 81 3.652 -7.601 -0.693 530 HD23 LEU 81 2HD2 LEU 81 5.344 -7.115 -0.388 531 H ILE 82 H ILE 82 3.233 -3.315 -0.584 532 HA ILE 82 HA ILE 82 2.721 -1.234 -2.663 533 HB ILE 82 HB ILE 82 1.250 -1.557 -0.020 534 HG13 ILE 82 2HG1 ILE 82 0.720 -3.551 -1.413 535 HG21 ILE 82 1HG2 ILE 82 -0.275 0.073 -0.940 536 HG22 ILE 82 2HG2 ILE 82 1.355 0.701 -1.136 537 HG23 ILE 82 3HG2 ILE 82 0.514 0.004 -2.536 538 HD11 ILE 82 3HD1 ILE 82 -1.658 -1.730 -1.460 539 HD12 ILE 82 1HD1 ILE 82 -1.617 -3.494 -1.406 540 HD13 ILE 82 2HD1 ILE 82 -1.041 -2.585 -0.001 541 H GLY 83 H GLY 83 4.238 0.616 -2.397 542 HA2 GLY 83 1HA GLY 83 5.232 1.003 0.390 543 HA3 GLY 83 2HA GLY 83 6.163 1.140 -1.099 544 H SER 84 H SER 84 5.853 3.164 0.957 545 HA SER 84 HA SER 84 5.503 5.377 -0.791 546 HB3 SER 84 2HB SER 84 3.209 5.337 -0.108 547 HG SER 84 HG SER 84 3.700 4.117 2.004 548 HA PRO 85 HA PRO 85 8.559 6.780 2.318 549 HB3 PRO 85 2HB PRO 85 9.056 8.576 0.916 550 HG3 PRO 85 2HG PRO 85 7.324 9.796 -0.202 551 HD3 PRO 85 2HD PRO 85 7.068 7.535 -0.851 552 H VAL 86 H VAL 86 8.583 8.275 4.411 553 HA VAL 86 HA VAL 86 6.017 8.846 5.620 554 HB VAL 86 HB VAL 86 6.244 6.426 6.002 555 HG11 VAL 86 1HG1 VAL 86 7.748 5.471 7.632 556 HG12 VAL 86 2HG1 VAL 86 8.613 6.088 6.241 557 HG13 VAL 86 3HG1 VAL 86 8.644 7.006 7.755 558 HG21 VAL 86 3HG2 VAL 86 5.653 6.500 8.359 559 HG22 VAL 86 1HG2 VAL 86 6.468 8.056 8.569 560 HG23 VAL 86 2HG2 VAL 86 5.011 7.930 7.546 561 H TRP 87 H TRP 87 6.369 10.331 7.376 562 HA TRP 87 HA TRP 87 8.986 10.452 8.551 563 HB3 TRP 87 2HB TRP 87 7.975 13.050 7.362 564 HD1 TRP 87 HD TRP 87 11.167 11.267 8.728 565 HE1 TRP 87 1HE TRP 87 12.647 12.983 9.889 566 HE3 TRP 87 3HE TRP 87 8.461 15.530 7.684 567 HZ2 TRP 87 2HZ TRP 87 12.626 15.803 10.410 568 HZ3 TRP 87 3HZ TRP 87 9.272 17.708 8.545 569 HH2 TRP 87 HH TRP 87 11.298 17.846 9.960 570 H SER 88 H SER 88 5.720 11.348 8.642 571 HA SER 88 HA SER 88 5.966 11.342 11.599 572 HB3 SER 88 2HB SER 88 4.166 13.121 11.719 573 HG SER 88 HG SER 88 6.023 14.614 10.660 574 H GLY 89 H GLY 89 5.558 9.079 10.637 575 HA2 GLY 89 1HA GLY 89 4.239 7.286 11.041 576 HA3 GLY 89 2HA GLY 89 2.936 8.360 11.573 577 H TYR 90 H TYR 90 2.119 9.743 9.507 578 HA TYR 90 HA TYR 90 1.614 8.053 7.144 579 HB3 TYR 90 2HB TYR 90 -0.003 7.142 8.524 580 HD1 TYR 90 2HD TYR 90 0.221 10.754 9.631 581 HD2 TYR 90 1HD TYR 90 -1.762 6.956 10.156 582 HE1 TYR 90 2HE TYR 90 -0.414 11.411 11.884 583 HE2 TYR 90 1HE TYR 90 -2.422 7.604 12.422 584 HH TYR 90 HH TYR 90 -1.943 9.181 14.212 585 HA PRO 91 HA PRO 91 1.496 12.751 6.724 586 HB3 PRO 91 2HB PRO 91 3.756 13.167 6.932 587 HG3 PRO 91 2HG PRO 91 5.357 11.552 6.372 588 HD3 PRO 91 2HD PRO 91 3.946 10.328 7.791 589 H ALA 92 H ALA 92 2.551 10.313 4.261 590 HA ALA 92 HA ALA 92 1.318 11.725 2.065 591 HB1 ALA 92 1HB ALA 92 3.443 10.317 1.971 592 HB2 ALA 92 2HB ALA 92 2.434 8.883 2.272 593 HB3 ALA 92 3HB ALA 92 2.218 9.870 0.801 594 H THR 93 H THR 93 -0.625 10.924 1.013 595 HA THR 93 HA THR 93 -2.084 8.729 2.409 596 HB THR 93 HB THR 93 -4.165 10.066 1.936 597 HG1 THR 93 1HG THR 93 -2.304 12.241 1.782 598 HG21 THR 93 3HG2 THR 93 -3.254 9.845 4.216 599 HG22 THR 93 1HG2 THR 93 -4.061 11.388 3.966 600 HG23 THR 93 2HG2 THR 93 -2.286 11.316 3.989 601 HA PRO 94 HA PRO 94 -2.369 7.863 -2.089 602 HB3 PRO 94 2HB PRO 94 -0.145 8.549 -2.752 603 HG3 PRO 94 2HG PRO 94 1.763 7.938 -1.347 604 HD3 PRO 94 2HD PRO 94 0.373 9.446 -0.277 605 H ILE 95 H ILE 95 -1.870 6.358 0.862 606 HA ILE 95 HA ILE 95 -2.602 3.719 -0.304 607 HB ILE 95 HB ILE 95 -1.404 3.977 2.425 608 HG13 ILE 95 2HG1 ILE 95 0.857 3.587 1.817 609 HG21 ILE 95 1HG2 ILE 95 -0.646 1.698 1.946 610 HG22 ILE 95 2HG2 ILE 95 -2.396 1.898 1.697 611 HG23 ILE 95 3HG2 ILE 95 -1.310 1.834 0.313 612 HD11 ILE 95 3HD1 ILE 95 0.540 2.633 -0.500 613 HD12 ILE 95 1HD1 ILE 95 0.267 4.287 -1.080 614 HD13 ILE 95 2HD1 ILE 95 1.808 3.823 -0.352 615 H LYS 96 H LYS 96 -4.511 5.702 0.018 616 HA LYS 96 HA LYS 96 -6.094 4.172 1.972 617 HB3 LYS 96 2HB LYS 96 -7.482 6.628 1.731 618 HG3 LYS 96 2HG LYS 96 -7.048 6.901 4.094 619 HD3 LYS 96 2HD LYS 96 -7.216 3.896 3.700 620 HE3 LYS 96 2HE LYS 96 -8.599 5.850 5.579 621 HZ1 LYS 96 3HZ LYS 96 -8.766 2.894 5.484 622 HZ2 LYS 96 1HZ LYS 96 -9.934 3.909 5.007 623 HZ3 LYS 96 2HZ LYS 96 -9.492 3.910 6.584 624 H THR 97 H THR 97 -6.527 6.158 -1.047 625 HA THR 97 HA THR 97 -9.165 4.976 -1.301 626 HB THR 97 HB THR 97 -7.435 6.564 -3.224 627 HG1 THR 97 1HG THR 97 -9.804 7.630 -2.532 628 HG21 THR 97 3HG2 THR 97 -9.455 6.889 -4.631 629 HG22 THR 97 1HG2 THR 97 -10.311 5.653 -3.681 630 HG23 THR 97 2HG2 THR 97 -8.902 5.217 -4.666 631 H LEU 98 H LEU 98 -5.990 3.983 -2.568 632 HA LEU 98 HA LEU 98 -6.842 2.282 -4.646 633 HB3 LEU 98 2HB LEU 98 -4.360 2.170 -2.863 634 HG LEU 98 HG LEU 98 -3.081 1.348 -4.614 635 HD11 LEU 98 1HD1 LEU 98 -5.552 -0.366 -5.006 636 HD12 LEU 98 2HD1 LEU 98 -4.458 -0.478 -3.593 637 HD13 LEU 98 3HD1 LEU 98 -3.853 -0.795 -5.227 638 HD21 LEU 98 3HD2 LEU 98 -3.850 1.071 -6.921 639 HD22 LEU 98 1HD2 LEU 98 -3.969 2.736 -6.377 640 HD23 LEU 98 2HD2 LEU 98 -5.446 1.736 -6.478 641 H LEU 99 H LEU 99 -6.274 1.617 -1.178 642 HA LEU 99 HA LEU 99 -6.928 -1.125 -1.046 643 HB3 LEU 99 2HB LEU 99 -7.742 -0.408 1.344 644 HG LEU 99 HG LEU 99 -4.945 0.109 0.292 645 HD11 LEU 99 1HD1 LEU 99 -5.884 0.317 3.157 646 HD12 LEU 99 2HD1 LEU 99 -5.299 1.665 2.170 647 HD13 LEU 99 3HD1 LEU 99 -4.190 0.362 2.646 648 HD21 LEU 99 3HD2 LEU 99 -4.458 -1.902 1.756 649 HD22 LEU 99 1HD2 LEU 99 -5.590 -2.224 0.428 650 HD23 LEU 99 2HD2 LEU 99 -6.179 -1.997 2.095 651 H ASP 100 H ASP 100 -9.097 1.729 -1.021 652 HA ASP 100 HA ASP 100 -11.498 0.149 -0.556 653 HB3 ASP 100 2HB ASP 100 -11.216 2.973 -1.638 654 H GLN 101 H GLN 101 -9.633 0.891 -3.305 655 HA GLN 101 HA GLN 101 -11.746 0.083 -5.226 656 HB3 GLN 101 2HB GLN 101 -10.028 0.267 -6.942 657 HG3 GLN 101 2HG GLN 101 -9.949 2.652 -5.061 658 HE21 GLN 101 1HE2 GLN 101 -10.748 4.447 -7.138 659 HE22 GLN 101 2HE2 GLN 101 -9.382 4.653 -8.222 660 H MET 102 H MET 102 -9.500 -1.551 -3.173 661 HA MET 102 HA MET 102 -9.268 -3.965 -4.844 662 HB3 MET 102 2HB MET 102 -7.981 -4.877 -2.922 663 HG3 MET 102 2HG MET 102 -7.148 -2.151 -3.916 664 HE1 MET 102 3HE MET 102 -4.108 -5.108 -2.055 665 HE2 MET 102 1HE MET 102 -5.840 -5.499 -2.065 666 HE3 MET 102 2HE MET 102 -4.969 -5.312 -3.594 667 H LYS 103 H LYS 103 -12.046 -3.125 -3.840 668 HA LYS 103 HA LYS 103 -12.886 -4.694 -1.680 669 HB3 LYS 103 2HB LYS 103 -15.174 -4.553 -2.637 670 HG3 LYS 103 2HG LYS 103 -15.324 -2.144 -3.332 671 HD3 LYS 103 2HD LYS 103 -15.342 -2.938 -0.863 672 HE3 LYS 103 2HE LYS 103 -12.615 -1.635 -1.107 673 HZ1 LYS 103 3HZ LYS 103 -13.781 -0.350 0.541 674 HZ2 LYS 103 1HZ LYS 103 -12.661 -1.335 1.255 675 HZ3 LYS 103 2HZ LYS 103 -14.241 -1.720 1.367 676 H ASN 104 H ASN 104 -12.009 -5.922 -4.819 677 HA ASN 104 HA ASN 104 -13.599 -8.404 -4.424 678 HB3 ASN 104 2HB ASN 104 -13.914 -8.488 -6.741 679 HD21 ASN 104 1HD2 ASN 104 -15.833 -7.332 -5.537 680 HD22 ASN 104 2HD2 ASN 104 -16.161 -5.669 -5.951 681 H TYR 105 H TYR 105 -10.717 -7.668 -3.554 682 HA TYR 105 HA TYR 105 -8.760 -8.562 -5.134 683 HB3 TYR 105 2HB TYR 105 -8.683 -7.263 -2.981 684 HD1 TYR 105 2HD TYR 105 -10.844 -8.941 -1.737 685 HD2 TYR 105 1HD TYR 105 -6.552 -8.949 -1.179 686 HE1 TYR 105 2HE TYR 105 -11.141 -9.674 0.567 687 HE2 TYR 105 1HE TYR 105 -6.857 -9.734 1.109 688 HH TYR 105 HH TYR 105 -10.156 -10.226 2.553 689 H ARG 106 H ARG 106 -7.260 -10.232 -5.195 690 HA ARG 106 HA ARG 106 -8.134 -12.983 -4.489 691 HB3 ARG 106 2HB ARG 106 -7.179 -13.544 -6.796 692 HG3 ARG 106 2HG ARG 106 -8.982 -12.325 -8.136 693 HD3 ARG 106 2HD ARG 106 -9.640 -14.147 -5.803 694 HE ARG 106 HE ARG 106 -11.764 -13.543 -6.279 695 HH11 ARG 106 1HH1 ARG 106 -10.181 -14.329 -9.420 696 HH12 ARG 106 2HH1 ARG 106 -11.655 -14.025 -10.293 697 HH21 ARG 106 1HH2 ARG 106 -13.481 -12.877 -7.535 698 HH22 ARG 106 2HH2 ARG 106 -13.559 -13.235 -9.250 699 H GLY 107 H GLY 107 -5.953 -11.009 -3.301 700 HA2 GLY 107 1HA GLY 107 -3.781 -12.983 -3.370 701 HA3 GLY 107 2HA GLY 107 -3.406 -11.335 -3.916 702 H GLU 108 H GLU 108 -1.930 -12.045 -1.746 703 HA GLU 108 HA GLU 108 -3.261 -11.354 0.751 704 HB3 GLU 108 2HB GLU 108 -0.759 -11.625 1.389 705 HG3 GLU 108 2HG GLU 108 -2.494 -13.837 0.268 706 H VAL 109 H VAL 109 -2.497 -9.462 1.953 707 HA VAL 109 HA VAL 109 -1.288 -7.350 0.190 708 HB VAL 109 HB VAL 109 -2.984 -6.905 2.742 709 HG11 VAL 109 1HG1 VAL 109 -3.082 -4.579 1.952 710 HG12 VAL 109 2HG1 VAL 109 -1.413 -5.065 2.267 711 HG13 VAL 109 3HG1 VAL 109 -2.000 -4.977 0.591 712 HG21 VAL 109 3HG2 VAL 109 -4.745 -6.110 1.205 713 HG22 VAL 109 1HG2 VAL 109 -3.788 -6.664 -0.188 714 HG23 VAL 109 2HG2 VAL 109 -4.429 -7.832 0.985 715 H ALA 110 H ALA 110 0.675 -6.496 0.669 716 HA ALA 110 HA ALA 110 1.374 -6.364 3.483 717 HB1 ALA 110 1HB ALA 110 2.593 -8.401 2.820 718 HB2 ALA 110 2HB ALA 110 3.361 -7.521 1.480 719 HB3 ALA 110 3HB ALA 110 3.726 -7.084 3.152 720 H SER 111 H SER 111 3.375 -4.853 3.755 721 HA SER 111 HA SER 111 3.457 -2.865 1.588 722 HB3 SER 111 2HB SER 111 2.922 -2.022 4.451 723 HG SER 111 HG SER 111 2.999 -0.758 1.934 724 H PHE 112 H PHE 112 5.305 -1.512 1.589 725 HA PHE 112 HA PHE 112 7.482 -2.208 3.433 726 HB3 PHE 112 2HB PHE 112 7.356 -3.964 1.689 727 HD1 PHE 112 2HD PHE 112 5.635 -3.071 -0.185 728 HD2 PHE 112 1HD PHE 112 9.908 -2.480 -0.184 729 HE1 PHE 112 2HE PHE 112 5.563 -2.448 -2.587 730 HE2 PHE 112 1HE PHE 112 9.820 -1.954 -2.590 731 HZ PHE 112 HZ PHE 112 7.660 -1.859 -3.769 732 H PHE 113 H PHE 113 8.047 -0.226 4.081 733 HA PHE 113 HA PHE 113 7.931 2.020 2.104 734 HB3 PHE 113 2HB PHE 113 6.396 2.137 4.065 735 HD1 PHE 113 2HD PHE 113 6.871 0.393 5.890 736 HD2 PHE 113 1HD PHE 113 9.055 4.084 5.503 737 HE1 PHE 113 2HE PHE 113 7.886 0.026 8.101 738 HE2 PHE 113 1HE PHE 113 9.991 3.767 7.777 739 HZ PHE 113 HZ PHE 113 9.508 1.702 9.009 740 H THR 114 H THR 114 9.548 3.746 2.468 741 HA THR 114 HA THR 114 12.173 2.439 2.520 742 HB THR 114 HB THR 114 12.499 4.342 0.779 743 HG1 THR 114 1HG THR 114 10.856 5.628 0.540 744 HG21 THR 114 3HG2 THR 114 10.311 2.282 0.271 745 HG22 THR 114 1HG2 THR 114 12.044 1.921 0.242 746 HG23 THR 114 2HG2 THR 114 11.353 3.043 -0.948 747 H SER 115 H SER 115 10.635 4.448 4.550 748 HA SER 115 HA SER 115 12.915 6.323 5.042 749 HB3 SER 115 2HB SER 115 10.791 7.749 5.744 750 HG SER 115 HG SER 115 10.948 8.646 3.761 751 H ALA 116 H ALA 116 13.275 4.205 6.275 752 HA ALA 116 HA ALA 116 11.878 3.492 8.647 753 HB1 ALA 116 1HB ALA 116 13.886 2.213 9.173 754 HB2 ALA 116 2HB ALA 116 13.543 2.077 7.427 755 HB3 ALA 116 3HB ALA 116 14.828 3.150 8.004 756 H GLY 117 H GLY 117 14.369 5.865 8.109 757 HA2 GLY 117 1HA GLY 117 15.994 5.798 10.091 758 HA3 GLY 117 2HA GLY 117 15.475 7.373 9.484 759 H THR 118 H THR 118 13.178 8.025 10.535 760 HA THR 118 HA THR 118 13.374 7.537 13.482 761 HB THR 118 HB THR 118 12.497 9.963 13.605 762 HG1 THR 118 1HG THR 118 12.088 10.387 11.492 763 HG21 THR 118 3HG2 THR 118 15.337 9.535 12.613 764 HG22 THR 118 1HG2 THR 118 14.783 9.214 14.275 765 HG23 THR 118 2HG2 THR 118 14.717 10.861 13.631 766 H ASN 119 H ASN 119 11.546 6.330 11.208 767 HA ASN 119 HA ASN 119 9.148 6.340 12.903 768 HB3 ASN 119 2HB ASN 119 8.086 7.063 10.326 769 HD21 ASN 119 1HD2 ASN 119 6.393 6.737 12.033 770 HD22 ASN 119 2HD2 ASN 119 6.044 8.102 13.126 771 H HIS 120 H HIS 120 9.808 4.068 13.043 772 HA HIS 120 HA HIS 120 8.897 2.564 10.656 773 HB3 HIS 120 2HB HIS 120 10.615 1.643 12.968 774 HD1 HIS 120 1HD HIS 120 11.454 -0.907 12.828 775 HD2 HIS 120 2HD HIS 120 8.331 0.180 10.210 776 HE1 HIS 120 1HE HIS 120 10.437 -3.073 11.948 777 H LYS 121 H LYS 121 8.670 2.400 14.244 778 HA LYS 121 HA LYS 121 6.790 0.375 14.319 779 HB3 LYS 121 2HB LYS 121 7.997 1.146 16.232 780 HG3 LYS 121 2HG LYS 121 7.264 3.713 15.840 781 HD3 LYS 121 2HD LYS 121 5.321 2.682 17.958 782 HE3 LYS 121 2HE LYS 121 5.783 5.522 16.978 783 HZ1 LYS 121 3HZ LYS 121 4.399 6.003 18.918 784 HZ2 LYS 121 1HZ LYS 121 4.126 4.412 19.172 785 HZ3 LYS 121 2HZ LYS 121 3.571 5.132 17.797 786 H ALA 122 H ALA 122 6.209 3.770 13.829 787 HA ALA 122 HA ALA 122 3.432 3.804 14.350 788 HB1 ALA 122 1HB ALA 122 4.731 5.731 12.431 789 HB2 ALA 122 2HB ALA 122 3.599 6.043 13.745 790 HB3 ALA 122 3HB ALA 122 5.290 5.713 14.108 791 H TYR 123 H TYR 123 5.234 3.541 11.257 792 HA TYR 123 HA TYR 123 3.119 3.688 9.448 793 HB3 TYR 123 2HB TYR 123 5.583 1.920 9.125 794 HD1 TYR 123 2HD TYR 123 4.207 0.587 7.437 795 HD2 TYR 123 1HD TYR 123 4.978 4.815 6.988 796 HE1 TYR 123 2HE TYR 123 3.578 0.470 5.040 797 HE2 TYR 123 1HE TYR 123 4.427 4.680 4.595 798 HH TYR 123 HH TYR 123 2.775 1.978 3.300 799 H VAL 124 H VAL 124 4.422 0.805 11.067 800 HA VAL 124 HA VAL 124 2.900 -1.190 9.753 801 HB VAL 124 HB VAL 124 4.328 -0.957 12.431 802 HG11 VAL 124 1HG1 VAL 124 2.729 -2.744 12.784 803 HG12 VAL 124 2HG1 VAL 124 3.170 -3.507 11.246 804 HG13 VAL 124 3HG1 VAL 124 4.344 -3.415 12.571 805 HG21 VAL 124 3HG2 VAL 124 5.111 -2.413 9.871 806 HG22 VAL 124 1HG2 VAL 124 5.719 -0.819 10.343 807 HG23 VAL 124 2HG2 VAL 124 6.093 -2.236 11.334 808 H SER 125 H SER 125 2.259 0.648 12.794 809 HA SER 125 HA SER 125 -0.217 -0.747 13.324 810 HB3 SER 125 2HB SER 125 0.785 1.904 14.388 811 HG SER 125 HG SER 125 -0.989 -0.118 15.352 812 H HIS 126 H HIS 126 0.602 2.499 11.967 813 HA HIS 126 HA HIS 126 -2.031 3.369 11.461 814 HB3 HIS 126 2HB HIS 126 -1.013 4.810 9.739 815 HD1 HIS 126 1HD HIS 126 -1.529 5.185 12.899 816 HD2 HIS 126 2HD HIS 126 2.068 5.687 10.792 817 HE1 HIS 126 1HE HIS 126 -0.083 6.723 14.306 818 H PHE 127 H PHE 127 0.059 1.152 9.540 819 HA PHE 127 HA PHE 127 -1.766 1.119 7.352 820 HB3 PHE 127 2HB PHE 127 0.119 -1.149 8.111 821 HD1 PHE 127 1HD PHE 127 -1.383 0.954 5.344 822 HD2 PHE 127 2HD PHE 127 0.186 -2.891 6.503 823 HE1 PHE 127 1HE PHE 127 -1.838 0.096 3.084 824 HE2 PHE 127 2HE PHE 127 -0.360 -3.775 4.227 825 HZ PHE 127 HZ PHE 127 -1.357 -2.287 2.529 826 H ASN 128 H ASN 128 -1.553 -0.848 10.323 827 HA ASN 128 HA ASN 128 -3.477 -2.825 9.536 828 HB3 ASN 128 2HB ASN 128 -3.933 -2.818 12.156 829 HD21 ASN 128 1HD2 ASN 128 -0.402 -2.806 11.422 830 HD22 ASN 128 2HD2 ASN 128 -0.346 -4.564 11.428 831 H GLU 129 H GLU 129 -3.817 0.371 11.035 832 HA GLU 129 HA GLU 129 -6.685 0.321 11.246 833 HB3 GLU 129 2HB GLU 129 -6.376 2.838 11.379 834 HG3 GLU 129 2HG GLU 129 -4.807 2.905 13.307 835 H TRP 130 H TRP 130 -4.545 1.923 8.762 836 HA TRP 130 HA TRP 130 -6.948 2.758 7.409 837 HB3 TRP 130 2HB TRP 130 -5.222 3.647 5.754 838 HD1 TRP 130 HD TRP 130 -6.213 4.128 9.340 839 HE1 TRP 130 1HE TRP 130 -5.832 6.500 10.087 840 HE3 TRP 130 3HE TRP 130 -3.297 5.726 5.426 841 HZ2 TRP 130 2HZ TRP 130 -4.716 8.922 8.953 842 HZ3 TRP 130 3HZ TRP 130 -2.537 8.078 5.336 843 HH2 TRP 130 HH TRP 130 -3.292 9.724 7.069 844 H ALA 131 H ALA 131 -5.527 -0.205 7.456 845 HA ALA 131 HA ALA 131 -6.611 -0.955 4.792 846 HB1 ALA 131 1HB ALA 131 -4.835 -2.422 4.389 847 HB2 ALA 131 2HB ALA 131 -4.022 -0.987 5.024 848 HB3 ALA 131 3HB ALA 131 -4.306 -2.390 6.085 849 H ASP 132 H ASP 132 -7.642 -0.862 7.723 850 HA ASP 132 HA ASP 132 -8.628 -3.475 8.277 851 HB3 ASP 132 2HB ASP 132 -9.744 -0.690 8.653 852 H GLY 133 H GLY 133 -9.642 -4.748 6.901 853 HA2 GLY 133 1HA GLY 133 -11.683 -4.984 5.676 854 HA3 GLY 133 2HA GLY 133 -11.204 -3.674 4.604 855 H LEU 134 H LEU 134 -8.327 -5.431 4.941 856 HA LEU 134 HA LEU 134 -9.070 -7.591 3.049 857 HB3 LEU 134 2HB LEU 134 -7.158 -6.980 1.625 858 HG LEU 134 HG LEU 134 -9.079 -4.641 2.003 859 HD11 LEU 134 1HD1 LEU 134 -6.822 -3.943 1.263 860 HD12 LEU 134 2HD1 LEU 134 -8.140 -3.561 0.150 861 HD13 LEU 134 3HD1 LEU 134 -7.030 -4.924 -0.197 862 HD21 LEU 134 3HD2 LEU 134 -8.751 -6.629 -0.266 863 HD22 LEU 134 1HD2 LEU 134 -9.948 -5.340 -0.166 864 HD23 LEU 134 2HD2 LEU 134 -10.010 -6.723 0.975 865 H ASN 135 H ASN 135 -7.478 -9.207 2.893 866 HA ASN 135 HA ASN 135 -6.238 -10.094 5.238 867 HB3 ASN 135 2HB ASN 135 -5.642 -11.163 2.447 868 HD21 ASN 135 1HD2 ASN 135 -3.782 -12.278 3.419 869 HD22 ASN 135 2HD2 ASN 135 -4.027 -13.583 4.574 870 H VAL 136 H VAL 136 -4.861 -8.221 5.617 871 HA VAL 136 HA VAL 136 -2.292 -8.236 4.206 872 HB VAL 136 HB VAL 136 -2.995 -6.074 4.721 873 HG11 VAL 136 1HG1 VAL 136 -4.619 -6.597 6.439 874 HG12 VAL 136 2HG1 VAL 136 -3.316 -6.816 7.633 875 HG13 VAL 136 3HG1 VAL 136 -3.634 -5.240 6.846 876 HG21 VAL 136 3HG2 VAL 136 -0.842 -6.723 6.755 877 HG22 VAL 136 1HG2 VAL 136 -0.581 -6.434 5.022 878 HG23 VAL 136 2HG2 VAL 136 -1.198 -5.143 6.050 879 H ILE 137 H ILE 137 -0.552 -9.258 4.750 880 HA ILE 137 HA ILE 137 -0.570 -10.879 7.254 881 HB ILE 137 HB ILE 137 0.503 -12.651 5.901 882 HG13 ILE 137 2HG1 ILE 137 -0.063 -10.799 3.538 883 HG21 ILE 137 1HG2 ILE 137 -1.980 -12.439 6.335 884 HG22 ILE 137 2HG2 ILE 137 -2.133 -11.713 4.731 885 HG23 ILE 137 3HG2 ILE 137 -1.556 -13.388 4.894 886 HD11 ILE 137 3HD1 ILE 137 2.291 -10.727 4.389 887 HD12 ILE 137 1HD1 ILE 137 2.385 -12.496 4.092 888 HD13 ILE 137 2HD1 ILE 137 2.104 -11.359 2.767 889 H GLY 138 H GLY 138 1.047 -8.261 6.009 890 HA2 GLY 138 1HA GLY 138 2.892 -8.298 8.092 891 HA3 GLY 138 2HA GLY 138 3.744 -8.883 6.670 892 H VAL 139 H VAL 139 4.393 -6.463 7.963 893 HA VAL 139 HA VAL 139 4.708 -4.924 5.681 894 HB VAL 139 HB VAL 139 2.709 -3.923 6.095 895 HG11 VAL 139 1HG1 VAL 139 1.991 -4.661 8.212 896 HG12 VAL 139 2HG1 VAL 139 3.258 -3.713 9.042 897 HG13 VAL 139 3HG1 VAL 139 1.905 -2.909 8.185 898 HG21 VAL 139 3HG2 VAL 139 4.577 -2.042 7.626 899 HG22 VAL 139 1HG2 VAL 139 4.591 -2.207 5.872 900 HG23 VAL 139 2HG2 VAL 139 3.147 -1.582 6.684 901 H ALA 140 H ALA 140 6.586 -3.609 5.887 902 HA ALA 140 HA ALA 140 7.989 -3.517 8.457 903 HB1 ALA 140 1HB ALA 140 9.250 -4.912 6.051 904 HB2 ALA 140 2HB ALA 140 9.909 -4.765 7.682 905 HB3 ALA 140 3HB ALA 140 8.483 -5.785 7.392 906 H ARG 141 H ARG 141 10.174 -2.475 8.043 907 HA ARG 141 HA ARG 141 10.086 -0.364 5.973 908 HB3 ARG 141 2HB ARG 141 10.805 0.048 8.402 909 HG3 ARG 141 2HG ARG 141 13.106 0.075 8.793 910 HD3 ARG 141 2HD ARG 141 12.590 -2.845 8.265 911 HE ARG 141 HE ARG 141 14.342 -1.418 10.044 912 HH11 ARG 141 1HH1 ARG 141 12.216 -4.259 9.884 913 HH12 ARG 141 2HH1 ARG 141 12.976 -5.095 11.182 914 HH21 ARG 141 1HH2 ARG 141 15.424 -2.639 11.836 915 HH22 ARG 141 2HH2 ARG 141 14.669 -4.112 12.346 916 H ASP 142 H ASP 142 11.884 -0.204 4.510 917 HA ASP 142 HA ASP 142 13.382 -0.935 2.984 918 HB3 ASP 142 2HB ASP 142 15.250 -2.349 3.866 919 H ASP 143 H ASP 143 14.582 -3.213 2.330 920 HA ASP 143 HA ASP 143 12.446 -5.002 1.400 921 HB3 ASP 143 2HB ASP 143 13.938 -4.139 -0.258 922 H SER 144 H SER 144 13.473 -5.024 4.272 923 HA SER 144 HA SER 144 15.205 -7.220 4.693 924 HB3 SER 144 2HB SER 144 13.141 -6.154 6.661 925 HG SER 144 HG SER 144 14.747 -7.856 7.297 926 H GLU 145 H GLU 145 11.646 -7.167 4.282 927 HA GLU 145 HA GLU 145 11.531 -9.996 5.245 928 HB3 GLU 145 2HB GLU 145 9.441 -9.570 6.226 929 HG3 GLU 145 2HG GLU 145 11.106 -7.097 6.849 930 H VAL 146 H VAL 146 11.644 -8.522 2.471 931 HA VAL 146 HA VAL 146 9.362 -9.132 0.945 932 HB VAL 146 HB VAL 146 12.349 -9.043 0.280 933 HG11 VAL 146 1HG1 VAL 146 11.074 -10.178 -1.565 934 HG12 VAL 146 2HG1 VAL 146 10.051 -8.739 -1.687 935 HG13 VAL 146 3HG1 VAL 146 11.796 -8.644 -2.035 936 HG21 VAL 146 3HG2 VAL 146 10.184 -6.926 -0.034 937 HG22 VAL 146 1HG2 VAL 146 11.387 -6.953 1.260 938 HG23 VAL 146 2HG2 VAL 146 11.915 -6.753 -0.404 939 H ASP 147 H ASP 147 11.903 -11.192 2.118 940 HA ASP 147 HA ASP 147 11.657 -13.549 0.646 941 HB3 ASP 147 2HB ASP 147 11.970 -14.395 3.291 942 H LYS 148 H LYS 148 9.806 -12.635 3.586 943 HA LYS 148 HA LYS 148 8.348 -15.146 3.498 944 HB3 LYS 148 2HB LYS 148 8.770 -14.215 5.655 945 HG3 LYS 148 2HG LYS 148 7.378 -11.739 4.634 946 HD3 LYS 148 2HD LYS 148 6.049 -12.360 6.628 947 HE3 LYS 148 2HE LYS 148 7.413 -11.944 8.828 948 HZ1 LYS 148 3HZ LYS 148 7.983 -14.244 9.049 949 HZ2 LYS 148 1HZ LYS 148 7.658 -14.568 7.484 950 HZ3 LYS 148 2HZ LYS 148 6.439 -14.079 8.486 951 H TRP 149 H TRP 149 7.727 -11.855 2.262 952 HA TRP 149 HA TRP 149 4.910 -12.491 1.805 953 HB3 TRP 149 2HB TRP 149 4.647 -10.355 0.937 954 HD1 TRP 149 HD TRP 149 4.640 -11.155 3.984 955 HE1 TRP 149 1HE TRP 149 5.256 -9.422 5.754 956 HE3 TRP 149 3HE TRP 149 7.313 -7.971 1.052 957 HZ2 TRP 149 2HZ TRP 149 6.575 -6.833 5.836 958 HZ3 TRP 149 3HZ TRP 149 8.233 -5.898 1.945 959 HH2 TRP 149 HH TRP 149 7.820 -5.250 4.341 960 H SER 150 H SER 150 7.465 -13.894 0.238 961 HA SER 150 HA SER 150 5.655 -14.321 -2.049 962 HB3 SER 150 2HB SER 150 7.919 -14.277 -3.348 963 HG SER 150 HG SER 150 6.247 -12.245 -2.462 964 H LYS 151 H LYS 151 7.328 -15.624 0.552 965 HA LYS 151 HA LYS 151 8.261 -18.068 -0.665 966 HB3 LYS 151 2HB LYS 151 8.057 -18.643 2.014 967 HG3 LYS 151 2HG LYS 151 10.337 -17.458 2.277 968 HD3 LYS 151 2HD LYS 151 9.738 -19.472 0.084 969 HE3 LYS 151 2HE LYS 151 12.451 -18.758 1.262 970 HZ1 LYS 151 3HZ LYS 151 13.208 -20.319 -0.352 971 HZ2 LYS 151 1HZ LYS 151 11.713 -20.534 -0.985 972 HZ3 LYS 151 2HZ LYS 151 12.044 -21.071 0.547 Start of MODEL 6 1 H1 GLY 1 H GLY 1 -0.981 -27.050 -11.840 2 HA2 GLY 1 1HA GLY 1 1.288 -27.102 -9.925 3 HA3 GLY 1 2HA GLY 1 1.324 -26.280 -11.494 4 H MET 2 H MET 2 1.820 -24.281 -10.209 5 HA MET 2 HA MET 2 -0.620 -22.888 -9.458 6 HB3 MET 2 2HB MET 2 0.009 -23.831 -7.313 7 HG3 MET 2 2HG MET 2 1.992 -22.933 -6.113 8 HE1 MET 2 3HE MET 2 3.692 -23.744 -9.380 9 HE2 MET 2 1HE MET 2 4.856 -23.643 -8.054 10 HE3 MET 2 2HE MET 2 4.637 -25.181 -8.927 11 H ALA 3 H ALA 3 0.032 -20.444 -9.052 12 HA ALA 3 HA ALA 3 2.616 -19.662 -10.015 13 HB1 ALA 3 1HB ALA 3 0.215 -18.934 -11.734 14 HB2 ALA 3 2HB ALA 3 1.776 -18.084 -11.736 15 HB3 ALA 3 3HB ALA 3 1.712 -19.778 -12.230 16 H LYS 4 H LYS 4 2.877 -18.642 -8.194 17 HA LYS 4 HA LYS 4 0.952 -16.705 -7.135 18 HB3 LYS 4 2HB LYS 4 2.899 -16.007 -5.718 19 HG3 LYS 4 2HG LYS 4 2.217 -18.967 -5.365 20 HD3 LYS 4 2HD LYS 4 3.552 -16.793 -3.749 21 HE3 LYS 4 2HE LYS 4 1.477 -17.894 -2.541 22 HZ1 LYS 4 3HZ LYS 4 3.636 -19.845 -2.014 23 HZ2 LYS 4 1HZ LYS 4 2.215 -20.202 -2.837 24 HZ3 LYS 4 2HZ LYS 4 2.171 -19.766 -1.263 25 H LYS 5 H LYS 5 1.210 -14.490 -7.661 26 HA LYS 5 HA LYS 5 3.527 -13.640 -9.255 27 HB3 LYS 5 2HB LYS 5 2.003 -12.319 -10.637 28 HG3 LYS 5 2HG LYS 5 1.325 -15.194 -10.495 29 HD3 LYS 5 2HD LYS 5 0.808 -13.099 -12.479 30 HE3 LYS 5 2HE LYS 5 1.008 -16.125 -12.930 31 HZ1 LYS 5 3HZ LYS 5 0.199 -13.945 -14.786 32 HZ2 LYS 5 1HZ LYS 5 -0.732 -15.217 -14.298 33 HZ3 LYS 5 2HZ LYS 5 0.538 -15.505 -15.255 34 H THR 6 H THR 6 3.529 -11.333 -9.219 35 HA THR 6 HA THR 6 2.688 -10.235 -6.519 36 HB THR 6 HB THR 6 5.519 -10.092 -7.633 37 HG1 THR 6 1HG THR 6 4.577 -11.734 -5.522 38 HG21 THR 6 3HG2 THR 6 4.968 -8.283 -6.026 39 HG22 THR 6 1HG2 THR 6 6.118 -9.442 -5.339 40 HG23 THR 6 2HG2 THR 6 4.410 -9.496 -4.853 41 H LEU 7 H LEU 7 1.882 -8.135 -6.675 42 HA LEU 7 HA LEU 7 3.046 -6.422 -8.824 43 HB3 LEU 7 2HB LEU 7 0.241 -6.177 -7.713 44 HG LEU 7 HG LEU 7 1.209 -4.021 -8.573 45 HD11 LEU 7 1HD1 LEU 7 2.885 -4.800 -10.152 46 HD12 LEU 7 2HD1 LEU 7 1.706 -3.855 -11.031 47 HD13 LEU 7 3HD1 LEU 7 1.642 -5.623 -11.130 48 HD21 LEU 7 3HD2 LEU 7 -0.727 -5.072 -10.645 49 HD22 LEU 7 1HD2 LEU 7 -0.525 -3.420 -10.024 50 HD23 LEU 7 2HD2 LEU 7 -1.234 -4.672 -8.996 51 H ILE 8 H ILE 8 4.490 -5.124 -7.894 52 HA ILE 8 HA ILE 8 4.003 -3.813 -5.291 53 HB ILE 8 HB ILE 8 6.096 -3.222 -7.444 54 HG13 ILE 8 2HG1 ILE 8 6.313 -4.644 -4.768 55 HG21 ILE 8 1HG2 ILE 8 5.672 -1.959 -4.704 56 HG22 ILE 8 2HG2 ILE 8 7.101 -1.714 -5.734 57 HG23 ILE 8 3HG2 ILE 8 5.530 -1.150 -6.279 58 HD11 ILE 8 3HD1 ILE 8 7.587 -5.143 -7.514 59 HD12 ILE 8 1HD1 ILE 8 7.858 -6.120 -6.068 60 HD13 ILE 8 2HD1 ILE 8 6.244 -6.081 -6.784 61 H LEU 9 H LEU 9 2.309 -2.330 -5.268 62 HA LEU 9 HA LEU 9 2.217 -0.399 -7.552 63 HB3 LEU 9 2HB LEU 9 0.317 0.601 -6.148 64 HG LEU 9 HG LEU 9 -0.136 -2.138 -7.374 65 HD11 LEU 9 1HD1 LEU 9 -2.088 0.126 -6.751 66 HD12 LEU 9 2HD1 LEU 9 -1.932 -1.401 -5.850 67 HD13 LEU 9 3HD1 LEU 9 -2.486 -1.423 -7.532 68 HD21 LEU 9 3HD2 LEU 9 0.783 -0.657 -9.053 69 HD22 LEU 9 1HD2 LEU 9 -0.344 0.643 -8.627 70 HD23 LEU 9 2HD2 LEU 9 -0.943 -0.862 -9.346 71 H TYR 10 H TYR 10 3.509 1.278 -7.367 72 HA TYR 10 HA TYR 10 3.903 2.478 -4.660 73 HB3 TYR 10 2HB TYR 10 6.087 3.264 -6.161 74 HD1 TYR 10 1HD TYR 10 5.593 3.480 -3.318 75 HD2 TYR 10 2HD TYR 10 7.663 0.453 -5.577 76 HE1 TYR 10 1HE TYR 10 7.267 3.266 -1.523 77 HE2 TYR 10 2HE TYR 10 9.370 0.276 -3.796 78 HH TYR 10 HH TYR 10 9.257 2.420 -0.903 79 H TYR 11 H TYR 11 3.392 4.634 -4.642 80 HA TYR 11 HA TYR 11 2.147 5.793 -6.944 81 HB3 TYR 11 2HB TYR 11 1.432 5.848 -4.488 82 HD1 TYR 11 1HD TYR 11 3.679 5.606 -3.006 83 HD2 TYR 11 2HD TYR 11 2.155 9.325 -4.610 84 HE1 TYR 11 1HE TYR 11 5.143 6.858 -1.494 85 HE2 TYR 11 2HE TYR 11 3.590 10.586 -3.028 86 HH TYR 11 HH TYR 11 6.199 9.156 -1.344 87 H SER 12 H SER 12 5.057 5.378 -7.232 88 HA SER 12 HA SER 12 6.776 7.206 -6.443 89 HB3 SER 12 2HB SER 12 8.230 6.401 -8.133 90 HG SER 12 HG SER 12 6.852 4.243 -8.666 91 H TRP 13 H TRP 13 7.372 9.278 -6.790 92 HA TRP 13 HA TRP 13 5.910 10.764 -8.890 93 HB3 TRP 13 2HB TRP 13 7.145 12.257 -6.634 94 HD1 TRP 13 HD TRP 13 3.443 11.968 -6.922 95 HE1 TRP 13 1HE TRP 13 2.428 13.924 -8.268 96 HE3 TRP 13 3HE TRP 13 7.755 14.131 -8.613 97 HZ2 TRP 13 2HZ TRP 13 3.374 15.814 -10.242 98 HZ3 TRP 13 3HZ TRP 13 7.675 15.986 -10.250 99 HH2 TRP 13 HH TRP 13 5.462 16.810 -11.096 100 H SER 14 H SER 14 9.039 11.642 -7.242 101 HA SER 14 HA SER 14 10.420 10.947 -9.732 102 HB3 SER 14 2HB SER 14 10.885 13.693 -8.525 103 HG SER 14 HG SER 14 11.913 13.985 -10.459 104 H GLY 15 H GLY 15 12.134 9.852 -9.225 105 HA2 GLY 15 1HA GLY 15 13.835 8.822 -8.205 106 HA3 GLY 15 2HA GLY 15 14.253 10.417 -7.655 107 H GLU 16 H GLU 16 11.327 9.406 -6.172 108 HA GLU 16 HA GLU 16 12.650 8.892 -3.613 109 HB3 GLU 16 2HB GLU 16 10.055 8.191 -3.191 110 HG3 GLU 16 2HG GLU 16 9.551 10.700 -2.957 111 H THR 17 H THR 17 10.078 6.797 -4.994 112 HA THR 17 HA THR 17 11.370 4.580 -3.769 113 HB THR 17 HB THR 17 9.238 3.481 -4.600 114 HG1 THR 17 1HG THR 17 8.107 4.646 -6.062 115 HG21 THR 17 3HG2 THR 17 9.155 4.476 -2.385 116 HG22 THR 17 1HG2 THR 17 7.682 4.978 -3.217 117 HG23 THR 17 2HG2 THR 17 9.009 6.122 -3.029 118 H LYS 18 H LYS 18 11.805 5.897 -6.875 119 HA LYS 18 HA LYS 18 11.617 3.565 -8.443 120 HB3 LYS 18 2HB LYS 18 13.309 6.040 -9.085 121 HG3 LYS 18 2HG LYS 18 12.465 3.517 -10.526 122 HD3 LYS 18 2HD LYS 18 13.087 5.674 -12.430 123 HE3 LYS 18 2HE LYS 18 12.654 3.238 -12.939 124 HZ1 LYS 18 3HZ LYS 18 9.775 3.709 -12.663 125 HZ2 LYS 18 1HZ LYS 18 10.617 3.155 -11.374 126 HZ3 LYS 18 2HZ LYS 18 10.641 2.297 -12.741 127 H LYS 19 H LYS 19 14.197 4.289 -6.230 128 HA LYS 19 HA LYS 19 15.878 2.168 -7.337 129 HB3 LYS 19 2HB LYS 19 16.598 2.202 -4.727 130 HG3 LYS 19 2HG LYS 19 17.939 4.364 -5.230 131 HD3 LYS 19 2HD LYS 19 17.995 1.702 -6.570 132 HE3 LYS 19 2HE LYS 19 18.450 3.151 -8.529 133 HZ1 LYS 19 3HZ LYS 19 19.481 5.074 -7.777 134 HZ2 LYS 19 1HZ LYS 19 20.755 4.211 -8.346 135 HZ3 LYS 19 2HZ LYS 19 20.474 4.289 -6.719 136 H MET 20 H MET 20 13.901 2.208 -4.380 137 HA MET 20 HA MET 20 14.179 -0.513 -4.006 138 HB3 MET 20 2HB MET 20 12.450 -0.090 -2.255 139 HG3 MET 20 2HG MET 20 13.755 1.507 -1.001 140 HE1 MET 20 3HE MET 20 14.593 -1.235 -1.655 141 HE2 MET 20 1HE MET 20 16.352 -1.432 -1.672 142 HE3 MET 20 2HE MET 20 15.560 -0.642 -0.285 143 H ALA 21 H ALA 21 11.627 1.140 -5.841 144 HA ALA 21 HA ALA 21 9.768 -1.029 -5.945 145 HB1 ALA 21 1HB ALA 21 10.333 1.105 -8.082 146 HB2 ALA 21 2HB ALA 21 8.813 0.233 -7.804 147 HB3 ALA 21 3HB ALA 21 9.392 1.439 -6.630 148 H GLU 22 H GLU 22 12.628 -0.118 -7.900 149 HA GLU 22 HA GLU 22 11.973 -1.997 -10.024 150 HB3 GLU 22 2HB GLU 22 14.319 -1.151 -10.761 151 HG3 GLU 22 2HG GLU 22 13.524 1.230 -11.034 152 H LYS 23 H LYS 23 14.303 -1.800 -7.280 153 HA LYS 23 HA LYS 23 15.733 -4.176 -7.936 154 HB3 LYS 23 2HB LYS 23 15.973 -4.137 -5.324 155 HG3 LYS 23 2HG LYS 23 17.657 -3.248 -7.186 156 HD3 LYS 23 2HD LYS 23 18.307 -0.948 -5.996 157 HE3 LYS 23 2HE LYS 23 16.915 0.324 -7.767 158 HZ1 LYS 23 3HZ LYS 23 18.446 -0.223 -9.350 159 HZ2 LYS 23 1HZ LYS 23 18.482 -1.825 -8.994 160 HZ3 LYS 23 2HZ LYS 23 19.224 -0.747 -8.013 161 H ILE 24 H ILE 24 12.998 -3.731 -5.534 162 HA ILE 24 HA ILE 24 12.818 -6.448 -4.928 163 HB ILE 24 HB ILE 24 10.580 -4.377 -4.992 164 HG13 ILE 24 2HG1 ILE 24 12.559 -3.906 -3.519 165 HG21 ILE 24 1HG2 ILE 24 10.645 -7.050 -3.489 166 HG22 ILE 24 2HG2 ILE 24 9.322 -5.856 -3.476 167 HG23 ILE 24 3HG2 ILE 24 9.682 -6.753 -4.941 168 HD11 ILE 24 3HD1 ILE 24 10.268 -3.194 -2.855 169 HD12 ILE 24 1HD1 ILE 24 10.185 -4.622 -1.790 170 HD13 ILE 24 2HD1 ILE 24 11.417 -3.380 -1.516 171 H ASN 25 H ASN 25 11.141 -4.711 -7.623 172 HA ASN 25 HA ASN 25 9.640 -6.908 -8.553 173 HB3 ASN 25 2HB ASN 25 10.940 -4.591 -10.040 174 HD21 ASN 25 1HD2 ASN 25 8.183 -6.987 -10.242 175 HD22 ASN 25 2HD2 ASN 25 8.315 -7.159 -11.964 176 H SER 26 H SER 26 13.003 -6.075 -9.185 177 HA SER 26 HA SER 26 13.434 -8.076 -11.245 178 HB3 SER 26 2HB SER 26 15.425 -6.560 -9.519 179 HG SER 26 HG SER 26 16.802 -6.858 -11.152 180 H GLU 27 H GLU 27 13.744 -8.037 -7.694 181 HA GLU 27 HA GLU 27 15.602 -10.257 -7.558 182 HB3 GLU 27 2HB GLU 27 15.186 -9.977 -5.085 183 HG3 GLU 27 2HG GLU 27 15.458 -7.305 -5.130 184 H ILE 28 H ILE 28 12.400 -10.259 -8.267 185 HA ILE 28 HA ILE 28 11.680 -12.725 -6.759 186 HB ILE 28 HB ILE 28 10.015 -10.468 -7.920 187 HG13 ILE 28 2HG1 ILE 28 11.328 -9.966 -5.796 188 HG21 ILE 28 1HG2 ILE 28 9.005 -12.864 -6.349 189 HG22 ILE 28 2HG2 ILE 28 8.039 -11.437 -6.784 190 HG23 ILE 28 3HG2 ILE 28 8.641 -12.437 -8.048 191 HD11 ILE 28 3HD1 ILE 28 9.017 -8.958 -5.978 192 HD12 ILE 28 1HD1 ILE 28 8.447 -10.328 -4.985 193 HD13 ILE 28 2HD1 ILE 28 9.634 -9.214 -4.323 194 H LYS 29 H LYS 29 10.066 -14.144 -7.941 195 HA LYS 29 HA LYS 29 10.782 -14.442 -10.824 196 HB3 LYS 29 2HB LYS 29 9.116 -16.603 -9.788 197 HG3 LYS 29 2HG LYS 29 10.806 -16.435 -11.722 198 HD3 LYS 29 2HD LYS 29 12.696 -17.404 -9.513 199 HE3 LYS 29 2HE LYS 29 13.021 -16.553 -12.417 200 HZ1 LYS 29 3HZ LYS 29 14.896 -15.856 -11.108 201 HZ2 LYS 29 1HZ LYS 29 15.321 -17.096 -12.108 202 HZ3 LYS 29 2HZ LYS 29 15.101 -17.376 -10.502 203 H ASP 30 H ASP 30 9.159 -14.081 -12.294 204 HA ASP 30 HA ASP 30 7.219 -13.321 -13.115 205 HB3 ASP 30 2HB ASP 30 5.687 -15.026 -11.143 206 H SER 31 H SER 31 8.277 -11.467 -11.511 207 HA SER 31 HA SER 31 6.234 -10.274 -9.924 208 HB3 SER 31 2HB SER 31 8.179 -10.109 -8.848 209 HG SER 31 HG SER 31 10.250 -9.939 -10.278 210 H GLU 32 H GLU 32 5.181 -8.336 -10.374 211 HA GLU 32 HA GLU 32 6.097 -6.657 -12.663 212 HB3 GLU 32 2HB GLU 32 3.567 -5.893 -12.541 213 HG3 GLU 32 2HG GLU 32 4.937 -7.654 -14.264 214 H LEU 33 H LEU 33 5.704 -4.320 -12.334 215 HA LEU 33 HA LEU 33 4.842 -3.535 -9.715 216 HB3 LEU 33 2HB LEU 33 7.371 -3.341 -9.935 217 HG LEU 33 HG LEU 33 6.667 -1.007 -11.802 218 HD11 LEU 33 1HD1 LEU 33 9.266 -1.753 -10.403 219 HD12 LEU 33 2HD1 LEU 33 8.220 -0.364 -10.026 220 HD13 LEU 33 3HD1 LEU 33 9.069 -0.441 -11.578 221 HD21 LEU 33 3HD2 LEU 33 8.525 -3.381 -12.257 222 HD22 LEU 33 1HD2 LEU 33 8.405 -1.967 -13.318 223 HD23 LEU 33 2HD2 LEU 33 7.026 -3.048 -13.143 224 H LYS 34 H LYS 34 3.702 -1.495 -9.858 225 HA LYS 34 HA LYS 34 3.385 -0.332 -12.529 226 HB3 LYS 34 2HB LYS 34 0.829 -0.026 -11.366 227 HG3 LYS 34 2HG LYS 34 1.782 -0.720 -13.875 228 HD3 LYS 34 2HD LYS 34 0.162 -3.009 -12.692 229 HE3 LYS 34 2HE LYS 34 -0.793 -1.944 -14.826 230 HZ1 LYS 34 3HZ LYS 34 0.155 -2.422 -16.796 231 HZ2 LYS 34 1HZ LYS 34 1.175 -3.561 -16.255 232 HZ3 LYS 34 2HZ LYS 34 1.483 -1.947 -15.969 233 H GLU 35 H GLU 35 2.585 1.853 -12.396 234 HA GLU 35 HA GLU 35 3.432 3.219 -9.922 235 HB3 GLU 35 2HB GLU 35 4.542 3.950 -11.961 236 HG3 GLU 35 2HG GLU 35 1.767 4.616 -13.013 237 H VAL 36 H VAL 36 1.962 4.531 -8.820 238 HA VAL 36 HA VAL 36 -0.865 4.558 -9.744 239 HB VAL 36 HB VAL 36 0.182 5.051 -6.921 240 HG11 VAL 36 1HG1 VAL 36 -2.643 4.711 -8.001 241 HG12 VAL 36 2HG1 VAL 36 -2.208 4.756 -6.282 242 HG13 VAL 36 3HG1 VAL 36 -1.927 6.168 -7.289 243 HG21 VAL 36 3HG2 VAL 36 0.522 2.684 -7.454 244 HG22 VAL 36 1HG2 VAL 36 -0.838 2.865 -6.348 245 HG23 VAL 36 2HG2 VAL 36 -1.148 2.584 -8.068 246 H LYS 37 H LYS 37 -1.808 6.881 -9.843 247 HA LYS 37 HA LYS 37 0.287 8.989 -9.792 248 HB3 LYS 37 2HB LYS 37 -1.629 10.300 -10.865 249 HG3 LYS 37 2HG LYS 37 -0.697 7.735 -12.195 250 HD3 LYS 37 2HD LYS 37 -0.877 9.324 -14.275 251 HE3 LYS 37 2HE LYS 37 -3.540 8.177 -13.449 252 HZ1 LYS 37 3HZ LYS 37 -3.402 7.247 -15.626 253 HZ2 LYS 37 1HZ LYS 37 -1.859 7.743 -15.846 254 HZ3 LYS 37 2HZ LYS 37 -3.082 8.848 -15.783 255 H VAL 38 H VAL 38 -0.558 11.092 -8.849 256 HA VAL 38 HA VAL 38 -2.508 10.717 -6.677 257 HB VAL 38 HB VAL 38 -1.226 12.519 -5.422 258 HG11 VAL 38 1HG1 VAL 38 0.114 10.850 -4.245 259 HG12 VAL 38 2HG1 VAL 38 -1.481 10.221 -4.676 260 HG13 VAL 38 3HG1 VAL 38 -0.057 9.720 -5.617 261 HG21 VAL 38 3HG2 VAL 38 1.132 11.477 -7.074 262 HG22 VAL 38 1HG2 VAL 38 0.436 13.117 -7.174 263 HG23 VAL 38 2HG2 VAL 38 1.221 12.576 -5.687 264 H SER 39 H SER 39 -4.037 12.199 -6.623 265 HA SER 39 HA SER 39 -4.347 14.133 -8.809 266 HB3 SER 39 2HB SER 39 -6.735 13.890 -7.394 267 HG SER 39 HG SER 39 -6.890 13.297 -9.410 268 H GLU 40 H GLU 40 -4.944 16.212 -8.190 269 HA GLU 40 HA GLU 40 -4.380 17.134 -5.436 270 HB3 GLU 40 2HB GLU 40 -5.657 19.207 -6.404 271 HG3 GLU 40 2HG GLU 40 -3.271 19.075 -5.798 272 H GLY 41 H GLY 41 -5.963 17.418 -3.983 273 HA2 GLY 41 1HA GLY 41 -7.904 15.391 -3.970 274 HA3 GLY 41 2HA GLY 41 -7.735 16.693 -2.778 275 H THR 42 H THR 42 -8.599 18.935 -3.737 276 HA THR 42 HA THR 42 -10.948 18.755 -5.390 277 HB THR 42 HB THR 42 -12.109 19.903 -3.166 278 HG1 THR 42 1HG THR 42 -11.715 18.718 -1.386 279 HG21 THR 42 3HG2 THR 42 -13.160 18.188 -4.637 280 HG22 THR 42 1HG2 THR 42 -13.495 17.952 -2.910 281 HG23 THR 42 2HG2 THR 42 -12.308 16.926 -3.730 282 H PHE 43 H PHE 43 -11.900 21.002 -5.572 283 HA PHE 43 HA PHE 43 -11.822 23.249 -5.771 284 HB3 PHE 43 2HB PHE 43 -9.902 23.378 -3.441 285 HD1 PHE 43 2HD PHE 43 -10.851 25.662 -5.716 286 HD2 PHE 43 1HD PHE 43 -11.742 24.703 -1.600 287 HE1 PHE 43 2HE PHE 43 -11.316 28.019 -5.275 288 HE2 PHE 43 1HE PHE 43 -12.251 27.079 -1.178 289 HZ PHE 43 HZ PHE 43 -12.016 28.764 -3.004 290 H ASP 44 H ASP 44 -10.212 21.682 -7.380 291 HA ASP 44 HA ASP 44 -8.737 21.669 -8.989 292 HB3 ASP 44 2HB ASP 44 -7.889 23.768 -9.957 293 H ALA 45 H ALA 45 -7.232 24.139 -6.991 294 HA ALA 45 HA ALA 45 -5.187 24.480 -6.136 295 HB1 ALA 45 1HB ALA 45 -4.023 22.648 -5.034 296 HB2 ALA 45 2HB ALA 45 -5.761 22.591 -4.745 297 HB3 ALA 45 3HB ALA 45 -5.012 21.472 -5.898 298 H ASP 46 H ASP 46 -4.934 21.824 -8.485 299 HA ASP 46 HA ASP 46 -3.566 21.412 -10.238 300 HB3 ASP 46 2HB ASP 46 -3.160 23.806 -11.508 301 H MET 47 H MET 47 -2.056 21.982 -7.662 302 HA MET 47 HA MET 47 0.645 22.309 -8.583 303 HB3 MET 47 2HB MET 47 -0.523 24.639 -6.984 304 HG3 MET 47 2HG MET 47 1.973 24.227 -8.647 305 HE1 MET 47 3HE MET 47 1.522 25.873 -10.534 306 HE2 MET 47 1HE MET 47 -0.100 26.369 -9.991 307 HE3 MET 47 2HE MET 47 1.130 27.595 -10.322 308 H TYR 48 H TYR 48 2.029 22.602 -6.525 309 HA TYR 48 HA TYR 48 1.926 20.537 -4.909 310 HB3 TYR 48 2HB TYR 48 3.363 21.740 -3.319 311 HD1 TYR 48 1HD TYR 48 4.351 19.931 -5.034 312 HD2 TYR 48 2HD TYR 48 4.365 24.201 -5.611 313 HE1 TYR 48 1HE TYR 48 6.343 19.717 -6.484 314 HE2 TYR 48 2HE TYR 48 6.373 24.000 -7.054 315 HH TYR 48 HH TYR 48 8.187 22.532 -7.525 316 H LYS 49 H LYS 49 0.020 19.865 -4.015 317 HA LYS 49 HA LYS 49 -0.455 21.036 -1.390 318 HB3 LYS 49 2HB LYS 49 -2.965 20.690 -3.061 319 HG3 LYS 49 2HG LYS 49 -2.165 22.225 -0.544 320 HD3 LYS 49 2HD LYS 49 -4.398 23.126 -0.387 321 HE3 LYS 49 2HE LYS 49 -3.406 23.835 -3.164 322 HZ1 LYS 49 3HZ LYS 49 -4.234 25.674 -1.032 323 HZ2 LYS 49 1HZ LYS 49 -5.311 25.085 -2.115 324 HZ3 LYS 49 2HZ LYS 49 -4.029 25.988 -2.629 325 H THR 50 H THR 50 -0.813 18.308 -3.660 326 HA THR 50 HA THR 50 -2.060 16.428 -2.216 327 HB THR 50 HB THR 50 0.546 16.328 -3.780 328 HG1 THR 50 1HG THR 50 -0.825 15.970 -5.477 329 HG21 THR 50 3HG2 THR 50 -1.362 14.008 -3.247 330 HG22 THR 50 1HG2 THR 50 0.257 14.176 -2.521 331 HG23 THR 50 2HG2 THR 50 0.089 14.000 -4.263 332 H SER 51 H SER 51 1.386 17.506 -1.582 333 HA SER 51 HA SER 51 1.199 16.594 1.167 334 HB3 SER 51 2HB SER 51 3.238 15.095 0.823 335 HG SER 51 HG SER 51 0.655 14.715 0.261 336 H ASP 52 H ASP 52 2.154 18.263 2.212 337 HA ASP 52 HA ASP 52 3.923 20.112 0.665 338 HB3 ASP 52 2HB ASP 52 2.588 20.355 3.394 339 H ILE 53 H ILE 53 3.839 18.086 3.601 340 HA ILE 53 HA ILE 53 6.755 18.055 3.765 341 HB ILE 53 HB ILE 53 6.330 20.149 4.825 342 HG13 ILE 53 2HG1 ILE 53 8.054 18.564 5.701 343 HG21 ILE 53 1HG2 ILE 53 4.984 20.579 6.737 344 HG22 ILE 53 2HG2 ILE 53 3.934 19.817 5.556 345 HG23 ILE 53 3HG2 ILE 53 4.551 18.886 6.951 346 HD11 ILE 53 3HD1 ILE 53 8.626 19.813 7.655 347 HD12 ILE 53 1HD1 ILE 53 7.876 20.944 6.510 348 HD13 ILE 53 2HD1 ILE 53 6.953 20.344 7.907 349 H ALA 54 H ALA 54 3.859 17.363 5.770 350 HA ALA 54 HA ALA 54 4.008 14.641 5.320 351 HB1 ALA 54 1HB ALA 54 5.874 14.316 6.726 352 HB2 ALA 54 2HB ALA 54 5.314 15.488 7.912 353 HB3 ALA 54 3HB ALA 54 4.491 13.912 7.757 354 H LEU 55 H LEU 55 3.211 16.115 8.520 355 HA LEU 55 HA LEU 55 0.429 15.237 8.186 356 HB3 LEU 55 2HB LEU 55 0.222 16.327 10.491 357 HG LEU 55 HG LEU 55 0.549 13.800 9.712 358 HD11 LEU 55 1HD1 LEU 55 3.043 14.318 11.371 359 HD12 LEU 55 2HD1 LEU 55 2.979 13.870 9.645 360 HD13 LEU 55 3HD1 LEU 55 2.413 12.733 10.869 361 HD21 LEU 55 3HD2 LEU 55 0.800 14.733 12.568 362 HD22 LEU 55 1HD2 LEU 55 0.182 13.151 12.005 363 HD23 LEU 55 2HD2 LEU 55 -0.687 14.638 11.592 364 H ASP 56 H ASP 56 0.386 16.709 6.229 365 HA ASP 56 HA ASP 56 -0.741 19.351 7.045 366 HB3 ASP 56 2HB ASP 56 0.751 19.564 5.248 367 H GLN 57 H GLN 57 -1.736 16.395 5.205 368 HA GLN 57 HA GLN 57 -4.555 17.103 5.803 369 HB3 GLN 57 2HB GLN 57 -5.016 15.660 3.767 370 HG3 GLN 57 2HG GLN 57 -3.489 18.286 3.693 371 HE21 GLN 57 1HE2 GLN 57 -2.140 17.264 1.960 372 HE22 GLN 57 2HE2 GLN 57 -2.720 17.498 0.331 373 H ILE 58 H ILE 58 -3.373 15.941 7.950 374 HA ILE 58 HA ILE 58 -4.255 13.080 7.853 375 HB ILE 58 HB ILE 58 -1.928 14.261 9.357 376 HG13 ILE 58 2HG1 ILE 58 -0.562 12.681 7.945 377 HG21 ILE 58 1HG2 ILE 58 -3.099 12.324 10.511 378 HG22 ILE 58 2HG2 ILE 58 -2.677 11.318 9.115 379 HG23 ILE 58 3HG2 ILE 58 -1.424 12.066 10.136 380 HD11 ILE 58 3HD1 ILE 58 -1.179 11.732 5.988 381 HD12 ILE 58 1HD1 ILE 58 -2.751 11.598 6.813 382 HD13 ILE 58 2HD1 ILE 58 -2.444 12.911 5.663 383 H GLN 59 H GLN 59 -3.522 15.660 10.316 384 HA GLN 59 HA GLN 59 -5.463 14.266 12.107 385 HB3 GLN 59 2HB GLN 59 -4.301 15.700 13.866 386 HG3 GLN 59 2HG GLN 59 -2.580 13.707 12.335 387 HE21 GLN 59 1HE2 GLN 59 -1.503 16.140 13.701 388 HE22 GLN 59 2HE2 GLN 59 -0.475 15.530 14.961 389 H GLY 60 H GLY 60 -7.432 15.066 11.564 390 HA2 GLY 60 1HA GLY 60 -9.058 16.687 12.206 391 HA3 GLY 60 2HA GLY 60 -7.892 17.981 11.953 392 H ASN 61 H ASN 61 -6.823 16.917 9.393 393 HA ASN 61 HA ASN 61 -9.106 17.720 7.644 394 HB3 ASN 61 2HB ASN 61 -7.411 17.677 5.833 395 HD21 ASN 61 1HD2 ASN 61 -4.946 19.296 6.511 396 HD22 ASN 61 2HD2 ASN 61 -5.607 20.796 7.060 397 H LYS 62 H LYS 62 -10.507 15.993 7.276 398 HA LYS 62 HA LYS 62 -9.311 13.358 6.565 399 HB3 LYS 62 2HB LYS 62 -12.019 13.032 6.247 400 HG3 LYS 62 2HG LYS 62 -12.110 12.148 8.552 401 HD3 LYS 62 2HD LYS 62 -9.538 11.341 7.128 402 HE3 LYS 62 2HE LYS 62 -11.451 9.784 8.915 403 HZ1 LYS 62 3HZ LYS 62 -9.646 8.184 8.836 404 HZ2 LYS 62 1HZ LYS 62 -8.761 9.157 7.883 405 HZ3 LYS 62 2HZ LYS 62 -10.161 8.470 7.302 406 H ASP 63 H ASP 63 -10.163 16.269 5.121 407 HA ASP 63 HA ASP 63 -10.749 15.196 2.463 408 HB3 ASP 63 2HB ASP 63 -10.562 17.533 1.760 409 H PHE 64 H PHE 64 -9.099 14.202 1.417 410 HA PHE 64 HA PHE 64 -6.327 15.151 1.746 411 HB3 PHE 64 2HB PHE 64 -6.322 13.363 3.231 412 HD1 PHE 64 2HD PHE 64 -7.664 11.653 0.103 413 HD2 PHE 64 1HD PHE 64 -7.460 11.730 4.410 414 HE1 PHE 64 2HE PHE 64 -9.170 9.716 0.211 415 HE2 PHE 64 1HE PHE 64 -8.927 9.754 4.514 416 HZ PHE 64 HZ PHE 64 -9.865 8.783 2.411 417 HA PRO 65 HA PRO 65 -6.250 14.639 -2.707 418 HB3 PRO 65 2HB PRO 65 -3.992 15.196 -2.728 419 HG3 PRO 65 2HG PRO 65 -2.488 14.252 -1.097 420 HD3 PRO 65 2HD PRO 65 -4.244 15.455 -0.022 421 H GLU 66 H GLU 66 -6.804 13.027 -4.305 422 HA GLU 66 HA GLU 66 -7.085 10.321 -3.295 423 HB3 GLU 66 2HB GLU 66 -9.099 11.340 -3.965 424 HG3 GLU 66 2HG GLU 66 -7.890 11.585 -6.718 425 H ILE 67 H ILE 67 -7.016 8.843 -5.586 426 HA ILE 67 HA ILE 67 -4.387 9.355 -6.849 427 HB ILE 67 HB ILE 67 -4.039 6.930 -6.849 428 HG13 ILE 67 2HG1 ILE 67 -6.784 6.850 -5.690 429 HG21 ILE 67 1HG2 ILE 67 -4.477 7.927 -4.011 430 HG22 ILE 67 2HG2 ILE 67 -3.354 6.664 -4.578 431 HG23 ILE 67 3HG2 ILE 67 -3.095 8.350 -5.048 432 HD11 ILE 67 3HD1 ILE 67 -6.325 5.715 -7.801 433 HD12 ILE 67 1HD1 ILE 67 -5.035 4.767 -7.019 434 HD13 ILE 67 2HD1 ILE 67 -6.735 4.550 -6.526 435 H GLN 68 H GLN 68 -4.187 8.133 -8.863 436 HA GLN 68 HA GLN 68 -6.624 7.290 -10.290 437 HB3 GLN 68 2HB GLN 68 -5.399 8.304 -12.347 438 HG3 GLN 68 2HG GLN 68 -6.603 10.228 -10.276 439 HE21 GLN 68 1HE2 GLN 68 -4.684 11.572 -10.982 440 HE22 GLN 68 2HE2 GLN 68 -5.102 12.854 -12.071 441 H LEU 69 H LEU 69 -5.915 5.541 -11.877 442 HA LEU 69 HA LEU 69 -3.202 5.255 -12.509 443 HB3 LEU 69 2HB LEU 69 -2.995 4.173 -10.259 444 HG LEU 69 HG LEU 69 -4.420 1.794 -11.460 445 HD11 LEU 69 1HD1 LEU 69 -2.422 1.537 -9.899 446 HD12 LEU 69 2HD1 LEU 69 -3.908 0.802 -9.295 447 HD13 LEU 69 3HD1 LEU 69 -3.374 2.355 -8.640 448 HD21 LEU 69 3HD2 LEU 69 -6.079 2.072 -9.559 449 HD22 LEU 69 1HD2 LEU 69 -6.200 3.344 -10.778 450 HD23 LEU 69 2HD2 LEU 69 -5.384 3.682 -9.239 451 H ASP 70 H ASP 70 -2.893 3.091 -13.597 452 HA ASP 70 HA ASP 70 -4.526 3.107 -15.889 453 HB3 ASP 70 2HB ASP 70 -2.726 0.795 -15.466 454 H ASN 71 H ASN 71 -5.013 0.740 -16.882 455 HA ASN 71 HA ASN 71 -7.294 -0.185 -15.234 456 HB3 ASN 71 2HB ASN 71 -6.676 -1.355 -17.925 457 HD21 ASN 71 1HD2 ASN 71 -8.206 -2.906 -16.182 458 HD22 ASN 71 2HD2 ASN 71 -9.887 -2.481 -16.275 459 H ILE 72 H ILE 72 -6.072 -1.136 -13.624 460 HA ILE 72 HA ILE 72 -4.387 -3.502 -14.283 461 HB ILE 72 HB ILE 72 -4.606 -2.020 -11.638 462 HG13 ILE 72 2HG1 ILE 72 -3.757 -0.500 -13.402 463 HG21 ILE 72 1HG2 ILE 72 -3.726 -4.343 -11.456 464 HG22 ILE 72 2HG2 ILE 72 -2.529 -4.002 -12.729 465 HG23 ILE 72 3HG2 ILE 72 -2.463 -3.184 -11.155 466 HD11 ILE 72 3HD1 ILE 72 -1.863 0.307 -12.301 467 HD12 ILE 72 1HD1 ILE 72 -2.858 -0.459 -11.043 468 HD13 ILE 72 2HD1 ILE 72 -1.429 -1.295 -11.671 469 H ASP 73 H ASP 73 -4.751 -5.589 -13.307 470 HA ASP 73 HA ASP 73 -7.436 -6.112 -12.170 471 HB3 ASP 73 2HB ASP 73 -6.297 -8.508 -12.582 472 H TYR 74 H TYR 74 -7.233 -6.224 -9.843 473 HA TYR 74 HA TYR 74 -4.670 -7.137 -8.690 474 HB3 TYR 74 2HB TYR 74 -5.817 -6.629 -6.553 475 HD1 TYR 74 1HD TYR 74 -4.137 -5.060 -8.816 476 HD2 TYR 74 2HD TYR 74 -7.649 -4.171 -6.516 477 HE1 TYR 74 1HE TYR 74 -3.930 -2.661 -9.429 478 HE2 TYR 74 2HE TYR 74 -7.427 -1.747 -7.089 479 HH TYR 74 HH TYR 74 -6.559 -0.848 -9.533 480 H ASN 75 H ASN 75 -6.827 -8.728 -10.373 481 HA ASN 75 HA ASN 75 -7.433 -10.878 -8.433 482 HB3 ASN 75 2HB ASN 75 -8.179 -11.000 -11.377 483 HD21 ASN 75 1HD2 ASN 75 -9.577 -10.982 -8.096 484 HD22 ASN 75 2HD2 ASN 75 -10.122 -12.668 -8.161 485 H ASN 76 H ASN 76 -5.686 -10.419 -11.544 486 HA ASN 76 HA ASN 76 -4.583 -13.092 -11.428 487 HB3 ASN 76 2HB ASN 76 -5.098 -12.272 -13.586 488 HD21 ASN 76 1HD2 ASN 76 -2.580 -9.912 -12.367 489 HD22 ASN 76 2HD2 ASN 76 -3.182 -8.663 -13.420 490 H TYR 77 H TYR 77 -3.949 -11.598 -9.079 491 HA TYR 77 HA TYR 77 -1.120 -12.133 -9.187 492 HB3 TYR 77 2HB TYR 77 -0.552 -10.259 -7.704 493 HD1 TYR 77 1HD TYR 77 0.610 -10.788 -10.113 494 HD2 TYR 77 2HD TYR 77 -2.575 -7.948 -9.461 495 HE1 TYR 77 1HE TYR 77 1.203 -9.646 -12.212 496 HE2 TYR 77 2HE TYR 77 -1.968 -6.795 -11.557 497 HH TYR 77 HH TYR 77 0.673 -7.929 -13.711 498 H ASP 78 H ASP 78 -0.368 -12.951 -7.253 499 HA ASP 78 HA ASP 78 -2.491 -14.087 -5.473 500 HB3 ASP 78 2HB ASP 78 0.427 -14.852 -5.345 501 H LEU 79 H LEU 79 0.420 -12.072 -5.621 502 HA LEU 79 HA LEU 79 0.114 -11.197 -2.819 503 HB3 LEU 79 2HB LEU 79 2.707 -10.666 -3.379 504 HG LEU 79 HG LEU 79 1.333 -13.112 -2.254 505 HD11 LEU 79 1HD1 LEU 79 3.157 -14.162 -3.356 506 HD12 LEU 79 2HD1 LEU 79 3.657 -13.965 -1.664 507 HD13 LEU 79 3HD1 LEU 79 4.278 -12.863 -2.912 508 HD21 LEU 79 3HD2 LEU 79 3.363 -11.143 -1.083 509 HD22 LEU 79 1HD2 LEU 79 2.429 -12.369 -0.205 510 HD23 LEU 79 2HD2 LEU 79 1.604 -10.974 -0.925 511 H ILE 80 H ILE 80 -0.054 -9.112 -2.445 512 HA ILE 80 HA ILE 80 0.478 -7.163 -4.645 513 HB ILE 80 HB ILE 80 -1.967 -7.456 -2.862 514 HG13 ILE 80 2HG1 ILE 80 -2.010 -8.702 -4.905 515 HG21 ILE 80 1HG2 ILE 80 -1.484 -5.199 -2.522 516 HG22 ILE 80 2HG2 ILE 80 -0.840 -4.951 -4.137 517 HG23 ILE 80 3HG2 ILE 80 -2.597 -5.136 -3.877 518 HD11 ILE 80 3HD1 ILE 80 -4.118 -7.347 -4.471 519 HD12 ILE 80 1HD1 ILE 80 -3.526 -6.191 -5.702 520 HD13 ILE 80 2HD1 ILE 80 -3.836 -7.867 -6.145 521 H LEU 81 H LEU 81 1.866 -5.621 -4.067 522 HA LEU 81 HA LEU 81 2.556 -5.388 -1.168 523 HB3 LEU 81 2HB LEU 81 4.842 -5.176 -1.751 524 HG LEU 81 HG LEU 81 3.777 -7.472 -3.476 525 HD11 LEU 81 1HD1 LEU 81 5.996 -6.822 -4.166 526 HD12 LEU 81 2HD1 LEU 81 6.100 -8.294 -3.196 527 HD13 LEU 81 3HD1 LEU 81 6.538 -6.730 -2.468 528 HD21 LEU 81 3HD2 LEU 81 4.444 -8.910 -1.585 529 HD22 LEU 81 1HD2 LEU 81 3.203 -7.762 -1.066 530 HD23 LEU 81 2HD2 LEU 81 4.914 -7.483 -0.648 531 H ILE 82 H ILE 82 2.933 -3.267 -0.484 532 HA ILE 82 HA ILE 82 2.660 -1.152 -2.537 533 HB ILE 82 HB ILE 82 1.099 -1.149 0.078 534 HG13 ILE 82 2HG1 ILE 82 0.176 -2.937 -1.414 535 HG21 ILE 82 1HG2 ILE 82 1.166 0.587 -2.432 536 HG22 ILE 82 2HG2 ILE 82 -0.041 0.755 -1.175 537 HG23 ILE 82 3HG2 ILE 82 1.650 1.055 -0.780 538 HD11 ILE 82 3HD1 ILE 82 -2.099 -2.325 -1.471 539 HD12 ILE 82 1HD1 ILE 82 -1.398 -1.607 -0.007 540 HD13 ILE 82 2HD1 ILE 82 -1.742 -0.598 -1.436 541 H GLY 83 H GLY 83 4.105 0.557 -2.227 542 HA2 GLY 83 1HA GLY 83 5.605 0.557 0.360 543 HA3 GLY 83 2HA GLY 83 6.275 0.934 -1.189 544 H SER 84 H SER 84 6.187 2.632 1.173 545 HA SER 84 HA SER 84 5.168 5.060 0.084 546 HB3 SER 84 2HB SER 84 3.970 4.344 2.772 547 HG SER 84 HG SER 84 2.331 5.707 2.028 548 HA PRO 85 HA PRO 85 8.491 6.066 2.979 549 HB3 PRO 85 2HB PRO 85 8.749 8.040 1.756 550 HG3 PRO 85 2HG PRO 85 6.853 9.335 1.073 551 HD3 PRO 85 2HD PRO 85 6.456 7.172 0.206 552 H VAL 86 H VAL 86 8.802 7.137 5.175 553 HA VAL 86 HA VAL 86 6.448 7.905 6.634 554 HB VAL 86 HB VAL 86 6.346 5.541 6.969 555 HG11 VAL 86 1HG1 VAL 86 8.966 5.606 8.424 556 HG12 VAL 86 2HG1 VAL 86 7.806 4.261 8.381 557 HG13 VAL 86 3HG1 VAL 86 8.608 4.785 6.898 558 HG21 VAL 86 3HG2 VAL 86 6.105 5.644 9.462 559 HG22 VAL 86 1HG2 VAL 86 7.091 7.119 9.468 560 HG23 VAL 86 2HG2 VAL 86 5.497 7.110 8.687 561 H TRP 87 H TRP 87 7.147 9.829 7.266 562 HA TRP 87 HA TRP 87 9.747 9.894 8.700 563 HB3 TRP 87 2HB TRP 87 9.176 12.086 6.720 564 HD1 TRP 87 HD TRP 87 12.008 9.732 7.825 565 HE1 TRP 87 1HE TRP 87 13.968 11.116 8.821 566 HE3 TRP 87 3HE TRP 87 10.099 14.432 7.185 567 HZ2 TRP 87 2HZ TRP 87 14.719 13.893 8.986 568 HZ3 TRP 87 3HZ TRP 87 11.443 16.425 7.821 569 HH2 TRP 87 HH TRP 87 13.737 16.161 8.727 570 H SER 88 H SER 88 6.568 10.700 9.026 571 HA SER 88 HA SER 88 7.287 12.238 11.423 572 HB3 SER 88 2HB SER 88 5.012 13.340 9.840 573 HG SER 88 HG SER 88 5.900 14.361 11.832 574 H GLY 89 H GLY 89 6.125 9.513 10.512 575 HA2 GLY 89 1HA GLY 89 4.667 8.077 11.606 576 HA3 GLY 89 2HA GLY 89 3.724 9.440 12.230 577 H TYR 90 H TYR 90 3.153 10.907 9.907 578 HA TYR 90 HA TYR 90 1.792 9.043 8.052 579 HB3 TYR 90 2HB TYR 90 -0.293 10.161 8.394 580 HD1 TYR 90 2HD TYR 90 1.142 11.068 11.670 581 HD2 TYR 90 1HD TYR 90 -1.088 8.052 9.537 582 HE1 TYR 90 2HE TYR 90 0.354 10.139 13.828 583 HE2 TYR 90 1HE TYR 90 -1.871 7.123 11.694 584 HH TYR 90 HH TYR 90 -0.757 7.195 14.216 585 HA PRO 91 HA PRO 91 3.834 12.683 6.043 586 HB3 PRO 91 2HB PRO 91 5.727 11.362 5.723 587 HG3 PRO 91 2HG PRO 91 5.523 9.067 5.125 588 HD3 PRO 91 2HD PRO 91 4.279 9.196 7.149 589 H ALA 92 H ALA 92 1.855 10.181 4.428 590 HA ALA 92 HA ALA 92 1.042 12.103 2.320 591 HB1 ALA 92 1HB ALA 92 3.153 10.732 1.733 592 HB2 ALA 92 2HB ALA 92 2.119 9.284 1.771 593 HB3 ALA 92 3HB ALA 92 1.819 10.602 0.611 594 H THR 93 H THR 93 -0.813 11.052 0.979 595 HA THR 93 HA THR 93 -2.102 8.724 2.273 596 HB THR 93 HB THR 93 -4.353 10.163 1.709 597 HG1 THR 93 1HG THR 93 -2.423 12.070 2.521 598 HG21 THR 93 3HG2 THR 93 -4.561 10.740 4.043 599 HG22 THR 93 1HG2 THR 93 -2.830 10.432 4.314 600 HG23 THR 93 2HG2 THR 93 -3.925 9.104 3.854 601 HA PRO 94 HA PRO 94 -2.445 8.400 -2.371 602 HB3 PRO 94 2HB PRO 94 -0.216 8.710 -3.045 603 HG3 PRO 94 2HG PRO 94 1.592 8.235 -1.568 604 HD3 PRO 94 2HD PRO 94 0.260 9.662 -0.367 605 H ILE 95 H ILE 95 -1.028 6.304 0.139 606 HA ILE 95 HA ILE 95 -2.507 3.971 -0.856 607 HB ILE 95 HB ILE 95 -0.872 4.008 1.643 608 HG13 ILE 95 2HG1 ILE 95 1.131 3.220 0.386 609 HG21 ILE 95 1HG2 ILE 95 -2.087 2.075 1.356 610 HG22 ILE 95 2HG2 ILE 95 -1.692 1.929 -0.360 611 HG23 ILE 95 3HG2 ILE 95 -0.452 1.637 0.907 612 HD11 ILE 95 3HD1 ILE 95 1.597 3.972 -1.816 613 HD12 ILE 95 1HD1 ILE 95 0.081 3.039 -1.920 614 HD13 ILE 95 2HD1 ILE 95 0.063 4.814 -1.968 615 H LYS 96 H LYS 96 -4.196 5.876 -0.325 616 HA LYS 96 HA LYS 96 -5.680 4.665 1.957 617 HB3 LYS 96 2HB LYS 96 -6.460 7.496 1.233 618 HG3 LYS 96 2HG LYS 96 -6.686 7.693 3.689 619 HD3 LYS 96 2HD LYS 96 -8.080 5.174 2.670 620 HE3 LYS 96 2HE LYS 96 -8.468 7.010 5.067 621 HZ1 LYS 96 3HZ LYS 96 -10.561 5.746 5.381 622 HZ2 LYS 96 1HZ LYS 96 -10.522 5.246 3.849 623 HZ3 LYS 96 2HZ LYS 96 -10.636 6.865 4.229 624 H THR 97 H THR 97 -6.472 6.789 -0.890 625 HA THR 97 HA THR 97 -8.939 5.740 -1.326 626 HB THR 97 HB THR 97 -6.924 6.763 -3.340 627 HG1 THR 97 1HG THR 97 -8.907 8.288 -2.045 628 HG21 THR 97 3HG2 THR 97 -8.952 7.630 -4.565 629 HG22 THR 97 1HG2 THR 97 -9.958 6.633 -3.495 630 HG23 THR 97 2HG2 THR 97 -8.802 5.866 -4.586 631 H LEU 98 H LEU 98 -5.953 4.531 -3.004 632 HA LEU 98 HA LEU 98 -7.138 2.751 -4.695 633 HB3 LEU 98 2HB LEU 98 -4.433 2.413 -3.275 634 HG LEU 98 HG LEU 98 -3.636 1.512 -5.392 635 HD11 LEU 98 1HD1 LEU 98 -4.535 -0.150 -3.648 636 HD12 LEU 98 2HD1 LEU 98 -4.310 -0.721 -5.307 637 HD13 LEU 98 3HD1 LEU 98 -5.923 -0.355 -4.754 638 HD21 LEU 98 3HD2 LEU 98 -5.286 2.535 -6.911 639 HD22 LEU 98 1HD2 LEU 98 -6.515 1.369 -6.374 640 HD23 LEU 98 2HD2 LEU 98 -5.056 0.822 -7.208 641 H LEU 99 H LEU 99 -6.005 1.900 -1.383 642 HA LEU 99 HA LEU 99 -6.714 -0.801 -1.302 643 HB3 LEU 99 2HB LEU 99 -7.007 -0.031 1.298 644 HG LEU 99 HG LEU 99 -4.473 -0.118 -0.393 645 HD11 LEU 99 1HD1 LEU 99 -4.591 0.101 2.633 646 HD12 LEU 99 2HD1 LEU 99 -4.158 1.416 1.545 647 HD13 LEU 99 3HD1 LEU 99 -3.151 -0.046 1.615 648 HD21 LEU 99 3HD2 LEU 99 -5.547 -2.003 1.764 649 HD22 LEU 99 1HD2 LEU 99 -4.057 -2.213 0.836 650 HD23 LEU 99 2HD2 LEU 99 -5.624 -2.296 0.019 651 H ASP 100 H ASP 100 -8.800 2.082 -0.898 652 HA ASP 100 HA ASP 100 -10.991 0.518 0.179 653 HB3 ASP 100 2HB ASP 100 -11.233 3.257 -1.056 654 H GLN 101 H GLN 101 -9.687 1.076 -2.921 655 HA GLN 101 HA GLN 101 -12.198 0.735 -4.422 656 HB3 GLN 101 2HB GLN 101 -10.874 0.746 -6.416 657 HG3 GLN 101 2HG GLN 101 -9.517 2.777 -4.652 658 HE21 GLN 101 1HE2 GLN 101 -10.742 4.929 -6.280 659 HE22 GLN 101 2HE2 GLN 101 -9.880 4.906 -7.788 660 H MET 102 H MET 102 -9.737 -1.257 -2.888 661 HA MET 102 HA MET 102 -9.942 -3.364 -4.814 662 HB3 MET 102 2HB MET 102 -8.297 -4.537 -3.505 663 HG3 MET 102 2HG MET 102 -7.628 -1.629 -3.300 664 HE1 MET 102 3HE MET 102 -4.603 -5.136 -2.904 665 HE2 MET 102 1HE MET 102 -6.344 -5.430 -2.912 666 HE3 MET 102 2HE MET 102 -5.539 -4.825 -4.381 667 H LYS 103 H LYS 103 -12.383 -2.791 -2.765 668 HA LYS 103 HA LYS 103 -12.179 -4.729 -0.792 669 HB3 LYS 103 2HB LYS 103 -14.417 -4.207 -0.151 670 HG3 LYS 103 2HG LYS 103 -13.781 -1.575 -1.230 671 HD3 LYS 103 2HD LYS 103 -14.040 -2.825 1.517 672 HE3 LYS 103 2HE LYS 103 -12.628 -0.258 0.825 673 HZ1 LYS 103 3HZ LYS 103 -14.262 -0.813 3.091 674 HZ2 LYS 103 1HZ LYS 103 -13.533 0.603 2.569 675 HZ3 LYS 103 2HZ LYS 103 -12.686 -0.451 3.483 676 H ASN 104 H ASN 104 -12.472 -5.953 -3.740 677 HA ASN 104 HA ASN 104 -14.116 -8.266 -2.810 678 HB3 ASN 104 2HB ASN 104 -14.401 -8.729 -5.329 679 HD21 ASN 104 1HD2 ASN 104 -15.462 -5.432 -4.188 680 HD22 ASN 104 2HD2 ASN 104 -17.022 -5.983 -3.672 681 H TYR 105 H TYR 105 -11.019 -7.129 -3.473 682 HA TYR 105 HA TYR 105 -9.976 -9.540 -4.716 683 HB3 TYR 105 2HB TYR 105 -7.781 -8.159 -4.336 684 HD1 TYR 105 1HD TYR 105 -8.837 -9.184 -6.757 685 HD2 TYR 105 2HD TYR 105 -9.462 -5.377 -5.008 686 HE1 TYR 105 1HE TYR 105 -9.611 -8.322 -8.984 687 HE2 TYR 105 2HE TYR 105 -10.247 -4.428 -7.259 688 HH TYR 105 HH TYR 105 -11.246 -5.924 -9.712 689 H ARG 106 H ARG 106 -7.946 -10.463 -3.746 690 HA ARG 106 HA ARG 106 -7.957 -11.046 -0.980 691 HB3 ARG 106 2HB ARG 106 -9.794 -12.023 -1.066 692 HG3 ARG 106 2HG ARG 106 -9.294 -14.052 -3.089 693 HD3 ARG 106 2HD ARG 106 -11.570 -12.145 -2.463 694 HE ARG 106 HE ARG 106 -11.767 -14.966 -3.507 695 HH11 ARG 106 1HH1 ARG 106 -13.084 -11.592 -3.697 696 HH12 ARG 106 2HH1 ARG 106 -14.476 -12.196 -4.594 697 HH21 ARG 106 1HH2 ARG 106 -13.178 -15.340 -5.281 698 HH22 ARG 106 2HH2 ARG 106 -14.309 -14.108 -5.717 699 H GLY 107 H GLY 107 -6.525 -13.403 -0.994 700 HA2 GLY 107 1HA GLY 107 -4.431 -14.279 -1.782 701 HA3 GLY 107 2HA GLY 107 -4.212 -12.843 -2.800 702 H GLU 108 H GLU 108 -2.263 -12.065 -1.755 703 HA GLU 108 HA GLU 108 -2.469 -11.649 1.214 704 HB3 GLU 108 2HB GLU 108 0.012 -12.150 1.125 705 HG3 GLU 108 2HG GLU 108 -1.883 -14.421 0.403 706 H VAL 109 H VAL 109 -2.486 -9.575 1.668 707 HA VAL 109 HA VAL 109 -1.022 -7.735 -0.163 708 HB VAL 109 HB VAL 109 -2.865 -6.955 2.122 709 HG11 VAL 109 1HG1 VAL 109 -2.803 -4.714 1.061 710 HG12 VAL 109 2HG1 VAL 109 -1.214 -5.207 1.643 711 HG13 VAL 109 3HG1 VAL 109 -1.582 -5.300 -0.089 712 HG21 VAL 109 3HG2 VAL 109 -4.417 -6.251 0.272 713 HG22 VAL 109 1HG2 VAL 109 -3.355 -7.082 -0.887 714 HG23 VAL 109 2HG2 VAL 109 -4.198 -7.997 0.380 715 H ALA 110 H ALA 110 0.880 -6.751 0.491 716 HA ALA 110 HA ALA 110 1.609 -6.877 3.359 717 HB1 ALA 110 1HB ALA 110 3.633 -7.568 1.224 718 HB2 ALA 110 2HB ALA 110 3.713 -7.863 2.971 719 HB3 ALA 110 3HB ALA 110 2.633 -8.821 1.976 720 H SER 111 H SER 111 3.559 -5.345 3.728 721 HA SER 111 HA SER 111 3.527 -3.045 1.873 722 HB3 SER 111 2HB SER 111 1.701 -2.435 3.215 723 HG SER 111 HG SER 111 2.214 -4.044 4.919 724 H PHE 112 H PHE 112 5.334 -1.697 1.964 725 HA PHE 112 HA PHE 112 7.400 -2.393 3.953 726 HB3 PHE 112 2HB PHE 112 7.703 -3.927 2.139 727 HD1 PHE 112 2HD PHE 112 5.962 -3.542 0.217 728 HD2 PHE 112 1HD PHE 112 9.769 -1.528 0.461 729 HE1 PHE 112 2HE PHE 112 5.809 -2.954 -2.183 730 HE2 PHE 112 1HE PHE 112 9.615 -0.951 -1.921 731 HZ PHE 112 HZ PHE 112 7.634 -1.669 -3.269 732 H PHE 113 H PHE 113 8.026 -0.544 4.909 733 HA PHE 113 HA PHE 113 7.933 1.963 3.309 734 HB3 PHE 113 2HB PHE 113 6.637 2.071 5.295 735 HD1 PHE 113 1HD PHE 113 9.822 2.788 7.044 736 HD2 PHE 113 2HD PHE 113 6.437 0.135 6.800 737 HE1 PHE 113 1HE PHE 113 10.531 1.663 9.140 738 HE2 PHE 113 2HE PHE 113 7.173 -0.991 8.875 739 HZ PHE 113 HZ PHE 113 9.288 -0.283 9.978 740 H THR 114 H THR 114 9.811 2.459 2.302 741 HA THR 114 HA THR 114 12.353 1.429 3.421 742 HB THR 114 HB THR 114 13.313 2.011 1.317 743 HG1 THR 114 1HG THR 114 12.212 3.945 1.092 744 HG21 THR 114 3HG2 THR 114 11.927 -0.071 1.358 745 HG22 THR 114 1HG2 THR 114 11.915 0.689 -0.232 746 HG23 THR 114 2HG2 THR 114 10.519 0.853 0.811 747 H SER 115 H SER 115 11.650 2.914 5.323 748 HA SER 115 HA SER 115 12.956 5.564 5.221 749 HB3 SER 115 2HB SER 115 10.788 6.657 5.838 750 HG SER 115 HG SER 115 11.566 5.782 3.368 751 H ALA 116 H ALA 116 13.417 3.210 6.846 752 HA ALA 116 HA ALA 116 11.916 3.453 9.339 753 HB1 ALA 116 1HB ALA 116 14.323 1.687 8.830 754 HB2 ALA 116 2HB ALA 116 13.054 1.498 10.045 755 HB3 ALA 116 3HB ALA 116 12.677 1.278 8.323 756 H GLY 117 H GLY 117 13.016 5.857 9.043 757 HA2 GLY 117 1HA GLY 117 15.365 6.150 10.814 758 HA3 GLY 117 2HA GLY 117 14.390 7.438 10.085 759 H THR 118 H THR 118 12.889 8.475 11.487 760 HA THR 118 HA THR 118 13.279 7.619 14.163 761 HB THR 118 HB THR 118 11.509 9.936 13.551 762 HG1 THR 118 1HG THR 118 12.917 11.089 12.559 763 HG21 THR 118 3HG2 THR 118 14.102 9.617 15.109 764 HG22 THR 118 1HG2 THR 118 12.468 9.511 15.807 765 HG23 THR 118 2HG2 THR 118 13.047 11.043 15.129 766 H ASN 119 H ASN 119 10.712 6.763 12.055 767 HA ASN 119 HA ASN 119 8.630 7.026 14.180 768 HB3 ASN 119 2HB ASN 119 7.715 7.626 11.487 769 HD21 ASN 119 1HD2 ASN 119 6.273 7.363 13.878 770 HD22 ASN 119 2HD2 ASN 119 5.787 8.986 14.386 771 H HIS 120 H HIS 120 9.997 4.457 12.927 772 HA HIS 120 HA HIS 120 8.300 3.101 11.226 773 HB3 HIS 120 2HB HIS 120 10.091 2.144 13.418 774 HD1 HIS 120 1HD HIS 120 10.559 -0.459 13.773 775 HD2 HIS 120 2HD HIS 120 7.186 0.467 11.401 776 HE1 HIS 120 1HE HIS 120 9.155 -2.557 13.641 777 H LYS 121 H LYS 121 8.021 2.578 14.840 778 HA LYS 121 HA LYS 121 5.872 0.902 14.451 779 HB3 LYS 121 2HB LYS 121 7.040 0.912 16.509 780 HG3 LYS 121 2HG LYS 121 5.594 3.439 17.386 781 HD3 LYS 121 2HD LYS 121 7.987 1.957 18.559 782 HE3 LYS 121 2HE LYS 121 7.659 4.427 19.157 783 HZ1 LYS 121 3HZ LYS 121 5.351 3.277 20.639 784 HZ2 LYS 121 1HZ LYS 121 5.256 4.418 19.469 785 HZ3 LYS 121 2HZ LYS 121 5.979 4.783 20.883 786 H ALA 122 H ALA 122 5.625 4.378 14.442 787 HA ALA 122 HA ALA 122 2.773 4.581 14.707 788 HB1 ALA 122 1HB ALA 122 4.372 6.549 14.714 789 HB2 ALA 122 2HB ALA 122 4.664 6.266 12.986 790 HB3 ALA 122 3HB ALA 122 3.050 6.741 13.541 791 H TYR 123 H TYR 123 4.812 3.720 11.894 792 HA TYR 123 HA TYR 123 2.978 4.079 9.811 793 HB3 TYR 123 2HB TYR 123 5.011 1.817 10.046 794 HD1 TYR 123 1HD TYR 123 4.723 4.504 7.605 795 HD2 TYR 123 2HD TYR 123 3.830 0.387 8.342 796 HE1 TYR 123 1HE TYR 123 4.437 4.162 5.160 797 HE2 TYR 123 2HE TYR 123 3.412 0.027 5.921 798 HH TYR 123 HH TYR 123 3.284 1.065 3.777 799 H VAL 124 H VAL 124 3.456 1.320 11.995 800 HA VAL 124 HA VAL 124 1.889 -0.582 10.545 801 HB VAL 124 HB VAL 124 2.644 -0.373 13.500 802 HG11 VAL 124 1HG1 VAL 124 1.687 -2.793 11.899 803 HG12 VAL 124 2HG1 VAL 124 2.339 -2.842 13.556 804 HG13 VAL 124 3HG1 VAL 124 0.835 -1.981 13.237 805 HG21 VAL 124 3HG2 VAL 124 4.449 -1.997 12.828 806 HG22 VAL 124 1HG2 VAL 124 4.028 -1.730 11.139 807 HG23 VAL 124 2HG2 VAL 124 4.669 -0.397 12.123 808 H SER 125 H SER 125 1.220 1.627 13.228 809 HA SER 125 HA SER 125 -1.535 0.891 13.471 810 HB3 SER 125 2HB SER 125 -0.797 3.453 14.645 811 HG SER 125 HG SER 125 -2.201 1.948 15.771 812 H HIS 126 H HIS 126 0.101 3.371 11.426 813 HA HIS 126 HA HIS 126 -2.505 4.534 10.733 814 HB3 HIS 126 2HB HIS 126 -0.189 5.657 10.444 815 HD1 HIS 126 1HD HIS 126 -1.368 4.055 7.060 816 HD2 HIS 126 2HD HIS 126 1.919 5.840 8.978 817 HE1 HIS 126 1HE HIS 126 0.566 4.023 5.391 818 H PHE 127 H PHE 127 -0.367 1.915 9.492 819 HA PHE 127 HA PHE 127 -1.850 1.681 7.078 820 HB3 PHE 127 2HB PHE 127 -0.004 -0.422 8.270 821 HD1 PHE 127 1HD PHE 127 -0.916 1.403 5.135 822 HD2 PHE 127 2HD PHE 127 -0.281 -2.429 6.961 823 HE1 PHE 127 1HE PHE 127 -1.339 0.316 2.942 824 HE2 PHE 127 2HE PHE 127 -0.746 -3.540 4.790 825 HZ PHE 127 HZ PHE 127 -1.263 -2.194 2.775 826 H ASN 128 H ASN 128 -1.910 -0.196 10.107 827 HA ASN 128 HA ASN 128 -3.849 -2.127 9.448 828 HB3 ASN 128 2HB ASN 128 -4.630 -1.653 11.935 829 HD21 ASN 128 1HD2 ASN 128 -1.442 -1.914 12.956 830 HD22 ASN 128 2HD2 ASN 128 -1.215 -3.603 12.566 831 H GLU 129 H GLU 129 -4.437 1.187 10.761 832 HA GLU 129 HA GLU 129 -7.217 1.040 10.394 833 HB3 GLU 129 2HB GLU 129 -7.065 3.595 10.474 834 HG3 GLU 129 2HG GLU 129 -6.214 3.793 12.731 835 H TRP 130 H TRP 130 -4.706 2.203 8.005 836 HA TRP 130 HA TRP 130 -6.909 3.164 6.298 837 HB3 TRP 130 2HB TRP 130 -5.059 4.083 4.978 838 HD1 TRP 130 HD TRP 130 -6.427 4.682 8.359 839 HE1 TRP 130 1HE TRP 130 -5.760 6.956 9.270 840 HE3 TRP 130 3HE TRP 130 -3.023 5.944 4.828 841 HZ2 TRP 130 2HZ TRP 130 -3.704 9.023 8.668 842 HZ3 TRP 130 3HZ TRP 130 -1.687 8.009 5.012 843 HH2 TRP 130 HH TRP 130 -1.998 9.532 6.944 844 H ALA 131 H ALA 131 -5.773 0.108 6.792 845 HA ALA 131 HA ALA 131 -6.126 -0.630 3.909 846 HB1 ALA 131 1HB ALA 131 -3.757 -0.922 4.723 847 HB2 ALA 131 2HB ALA 131 -4.369 -2.068 5.937 848 HB3 ALA 131 3HB ALA 131 -4.535 -2.436 4.213 849 H ASP 132 H ASP 132 -7.387 -0.928 7.006 850 HA ASP 132 HA ASP 132 -8.199 -3.468 7.425 851 HB3 ASP 132 2HB ASP 132 -9.782 -0.982 7.943 852 H GLY 133 H GLY 133 -8.672 -4.179 5.300 853 HA2 GLY 133 1HA GLY 133 -11.464 -4.921 5.158 854 HA3 GLY 133 2HA GLY 133 -11.026 -3.860 3.809 855 H LEU 134 H LEU 134 -8.211 -4.877 3.617 856 HA LEU 134 HA LEU 134 -8.724 -7.409 2.232 857 HB3 LEU 134 2HB LEU 134 -6.562 -6.655 1.118 858 HG LEU 134 HG LEU 134 -7.499 -4.459 0.091 859 HD11 LEU 134 1HD1 LEU 134 -7.301 -6.676 -1.082 860 HD12 LEU 134 2HD1 LEU 134 -8.760 -5.830 -1.630 861 HD13 LEU 134 3HD1 LEU 134 -8.884 -7.121 -0.419 862 HD21 LEU 134 3HD2 LEU 134 -9.872 -4.229 -0.162 863 HD22 LEU 134 1HD2 LEU 134 -9.453 -4.075 1.535 864 HD23 LEU 134 2HD2 LEU 134 -10.170 -5.583 0.931 865 H ASN 135 H ASN 135 -7.344 -9.151 2.590 866 HA ASN 135 HA ASN 135 -6.198 -9.633 5.126 867 HB3 ASN 135 2HB ASN 135 -5.733 -11.011 2.477 868 HD21 ASN 135 1HD2 ASN 135 -4.087 -12.424 2.331 869 HD22 ASN 135 2HD2 ASN 135 -3.322 -13.253 3.683 870 H VAL 136 H VAL 136 -4.468 -8.660 6.003 871 HA VAL 136 HA VAL 136 -2.173 -8.112 4.228 872 HB VAL 136 HB VAL 136 -2.971 -6.725 6.816 873 HG11 VAL 136 1HG1 VAL 136 -0.987 -5.268 6.549 874 HG12 VAL 136 2HG1 VAL 136 -0.546 -6.928 6.890 875 HG13 VAL 136 3HG1 VAL 136 -0.408 -6.309 5.225 876 HG21 VAL 136 3HG2 VAL 136 -2.562 -5.573 4.024 877 HG22 VAL 136 1HG2 VAL 136 -4.134 -5.907 4.770 878 HG23 VAL 136 2HG2 VAL 136 -3.082 -4.685 5.474 879 H ILE 137 H ILE 137 -0.334 -9.185 4.585 880 HA ILE 137 HA ILE 137 -0.246 -11.098 6.862 881 HB ILE 137 HB ILE 137 1.268 -12.368 5.350 882 HG13 ILE 137 2HG1 ILE 137 1.743 -10.098 3.967 883 HG21 ILE 137 1HG2 ILE 137 -1.440 -11.745 4.095 884 HG22 ILE 137 2HG2 ILE 137 -0.496 -13.243 3.953 885 HG23 ILE 137 3HG2 ILE 137 -1.202 -12.788 5.504 886 HD11 ILE 137 3HD1 ILE 137 2.926 -12.182 3.552 887 HD12 ILE 137 1HD1 ILE 137 1.519 -12.792 2.642 888 HD13 ILE 137 2HD1 ILE 137 2.427 -11.389 2.033 889 H GLY 138 H GLY 138 1.317 -8.175 5.909 890 HA2 GLY 138 1HA GLY 138 3.368 -8.498 7.920 891 HA3 GLY 138 2HA GLY 138 3.990 -8.604 6.262 892 H VAL 139 H VAL 139 4.516 -6.579 8.285 893 HA VAL 139 HA VAL 139 4.250 -4.284 6.541 894 HB VAL 139 HB VAL 139 3.489 -4.059 9.513 895 HG11 VAL 139 1HG1 VAL 139 4.496 -2.039 8.551 896 HG12 VAL 139 2HG1 VAL 139 3.312 -2.060 7.225 897 HG13 VAL 139 3HG1 VAL 139 2.773 -1.777 8.887 898 HG21 VAL 139 3HG2 VAL 139 1.174 -3.542 8.892 899 HG22 VAL 139 1HG2 VAL 139 1.513 -3.990 7.209 900 HG23 VAL 139 2HG2 VAL 139 1.598 -5.201 8.495 901 H ALA 140 H ALA 140 6.461 -4.102 6.218 902 HA ALA 140 HA ALA 140 8.158 -3.936 8.624 903 HB1 ALA 140 1HB ALA 140 8.330 -6.300 7.666 904 HB2 ALA 140 2HB ALA 140 9.148 -5.576 6.255 905 HB3 ALA 140 3HB ALA 140 9.842 -5.413 7.857 906 H ARG 141 H ARG 141 10.520 -3.477 7.528 907 HA ARG 141 HA ARG 141 10.112 -1.025 5.910 908 HB3 ARG 141 2HB ARG 141 11.165 -0.613 8.096 909 HG3 ARG 141 2HG ARG 141 13.361 -2.501 7.212 910 HD3 ARG 141 2HD ARG 141 12.982 -0.869 9.735 911 HE ARG 141 HE ARG 141 13.770 -2.821 10.638 912 HH11 ARG 141 1HH1 ARG 141 15.780 -2.195 7.657 913 HH12 ARG 141 2HH1 ARG 141 16.946 -3.335 8.219 914 HH21 ARG 141 1HH2 ARG 141 15.022 -4.556 10.920 915 HH22 ARG 141 2HH2 ARG 141 16.363 -4.925 9.869 916 H ASP 142 H ASP 142 11.931 -0.632 4.417 917 HA ASP 142 HA ASP 142 13.370 -1.228 2.721 918 HB3 ASP 142 2HB ASP 142 15.338 -2.361 3.451 919 H ASP 143 H ASP 143 14.633 -3.952 2.319 920 HA ASP 143 HA ASP 143 12.199 -5.331 1.294 921 HB3 ASP 143 2HB ASP 143 13.425 -4.276 -0.505 922 H SER 144 H SER 144 14.098 -5.650 3.795 923 HA SER 144 HA SER 144 15.515 -8.038 3.419 924 HB3 SER 144 2HB SER 144 14.424 -7.091 6.093 925 HG SER 144 HG SER 144 15.634 -9.135 5.668 926 H GLU 145 H GLU 145 12.038 -7.878 3.836 927 HA GLU 145 HA GLU 145 12.021 -10.671 4.932 928 HB3 GLU 145 2HB GLU 145 9.866 -10.177 5.757 929 HG3 GLU 145 2HG GLU 145 11.373 -7.609 6.345 930 H VAL 146 H VAL 146 11.866 -9.380 1.935 931 HA VAL 146 HA VAL 146 9.506 -10.237 0.748 932 HB VAL 146 HB VAL 146 12.348 -10.061 -0.317 933 HG11 VAL 146 1HG1 VAL 146 11.236 -11.411 -1.929 934 HG12 VAL 146 2HG1 VAL 146 9.767 -10.442 -1.856 935 HG13 VAL 146 3HG1 VAL 146 11.243 -9.772 -2.585 936 HG21 VAL 146 3HG2 VAL 146 10.015 -8.110 -0.309 937 HG22 VAL 146 1HG2 VAL 146 11.493 -7.939 0.559 938 HG23 VAL 146 2HG2 VAL 146 11.530 -7.856 -1.203 939 H ASP 147 H ASP 147 12.254 -12.138 1.620 940 HA ASP 147 HA ASP 147 11.981 -14.590 0.339 941 HB3 ASP 147 2HB ASP 147 13.036 -13.594 2.958 942 H LYS 148 H LYS 148 9.737 -13.307 2.683 943 HA LYS 148 HA LYS 148 8.525 -16.023 2.876 944 HB3 LYS 148 2HB LYS 148 9.124 -15.150 5.084 945 HG3 LYS 148 2HG LYS 148 6.689 -13.352 4.869 946 HD3 LYS 148 2HD LYS 148 9.038 -13.570 6.793 947 HE3 LYS 148 2HE LYS 148 6.735 -11.627 7.004 948 HZ1 LYS 148 3HZ LYS 148 8.467 -10.408 8.208 949 HZ2 LYS 148 1HZ LYS 148 9.506 -11.636 8.064 950 HZ3 LYS 148 2HZ LYS 148 8.110 -11.852 8.935 951 H TRP 149 H TRP 149 8.066 -12.664 1.912 952 HA TRP 149 HA TRP 149 5.167 -12.864 1.513 953 HB3 TRP 149 2HB TRP 149 5.366 -10.611 0.664 954 HD1 TRP 149 HD TRP 149 5.346 -11.784 3.768 955 HE1 TRP 149 1HE TRP 149 6.023 -10.159 5.623 956 HE3 TRP 149 3HE TRP 149 7.834 -8.351 0.925 957 HZ2 TRP 149 2HZ TRP 149 7.308 -7.570 5.823 958 HZ3 TRP 149 3HZ TRP 149 8.605 -6.223 1.910 959 HH2 TRP 149 HH TRP 149 8.242 -5.765 4.347 960 H SER 150 H SER 150 6.625 -14.894 0.094 961 HA SER 150 HA SER 150 6.058 -14.359 -2.699 962 HB3 SER 150 2HB SER 150 8.981 -14.448 -1.832 963 HG SER 150 HG SER 150 8.599 -15.152 -4.001 964 H LYS 151 H LYS 151 7.148 -16.491 -0.080 965 HA LYS 151 HA LYS 151 7.352 -18.762 -1.970 966 HB3 LYS 151 2HB LYS 151 9.141 -18.594 -0.498 967 HG3 LYS 151 2HG LYS 151 7.999 -17.373 1.404 968 HD3 LYS 151 2HD LYS 151 7.891 -19.636 3.142 969 HE3 LYS 151 2HE LYS 151 5.728 -17.718 2.177 970 HZ1 LYS 151 3HZ LYS 151 4.477 -18.410 4.040 971 HZ2 LYS 151 1HZ LYS 151 5.690 -19.416 4.594 972 HZ3 LYS 151 2HZ LYS 151 4.867 -19.736 3.197 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -7.721 -19.540 -11.386 2 HA2 GLY 1 1HA GLY 1 -6.132 -20.639 -12.917 3 HA3 GLY 1 2HA GLY 1 -5.452 -19.224 -12.082 4 H MET 2 H MET 2 -3.369 -20.312 -12.646 5 HA MET 2 HA MET 2 -2.376 -21.543 -10.230 6 HB3 MET 2 2HB MET 2 -1.667 -23.029 -12.759 7 HG3 MET 2 2HG MET 2 -2.009 -24.582 -10.364 8 HE1 MET 2 3HE MET 2 1.369 -23.398 -10.260 9 HE2 MET 2 1HE MET 2 2.322 -24.314 -11.451 10 HE3 MET 2 2HE MET 2 1.343 -22.919 -11.959 11 H ALA 3 H ALA 3 -1.895 -19.069 -10.830 12 HA ALA 3 HA ALA 3 0.951 -19.047 -11.430 13 HB1 ALA 3 1HB ALA 3 0.193 -18.559 -13.658 14 HB2 ALA 3 2HB ALA 3 -0.891 -17.281 -13.044 15 HB3 ALA 3 3HB ALA 3 0.877 -17.111 -12.883 16 H LYS 4 H LYS 4 1.406 -18.465 -9.430 17 HA LYS 4 HA LYS 4 -0.187 -16.534 -7.954 18 HB3 LYS 4 2HB LYS 4 1.313 -16.890 -6.115 19 HG3 LYS 4 2HG LYS 4 1.123 -19.637 -7.447 20 HD3 LYS 4 2HD LYS 4 0.753 -20.380 -5.112 21 HE3 LYS 4 2HE LYS 4 3.237 -18.604 -5.295 22 HZ1 LYS 4 3HZ LYS 4 2.906 -21.069 -3.688 23 HZ2 LYS 4 1HZ LYS 4 2.831 -19.525 -3.065 24 HZ3 LYS 4 2HZ LYS 4 4.194 -20.044 -3.744 25 H LYS 5 H LYS 5 0.005 -14.654 -9.333 26 HA LYS 5 HA LYS 5 2.752 -13.642 -9.800 27 HB3 LYS 5 2HB LYS 5 1.767 -11.844 -11.099 28 HG3 LYS 5 2HG LYS 5 0.109 -14.157 -11.792 29 HD3 LYS 5 2HD LYS 5 2.321 -12.813 -13.398 30 HE3 LYS 5 2HE LYS 5 1.526 -15.225 -13.890 31 HZ1 LYS 5 3HZ LYS 5 -0.515 -15.305 -15.193 32 HZ2 LYS 5 1HZ LYS 5 -0.829 -13.716 -14.874 33 HZ3 LYS 5 2HZ LYS 5 -0.875 -14.839 -13.676 34 H THR 6 H THR 6 3.077 -11.421 -9.534 35 HA THR 6 HA THR 6 2.173 -10.450 -6.855 36 HB THR 6 HB THR 6 5.058 -10.595 -7.724 37 HG1 THR 6 1HG THR 6 4.375 -12.597 -7.177 38 HG21 THR 6 3HG2 THR 6 3.842 -9.752 -5.052 39 HG22 THR 6 1HG2 THR 6 4.666 -8.669 -6.196 40 HG23 THR 6 2HG2 THR 6 5.571 -9.951 -5.395 41 H LEU 7 H LEU 7 1.989 -8.102 -6.707 42 HA LEU 7 HA LEU 7 3.112 -6.601 -9.023 43 HB3 LEU 7 2HB LEU 7 0.550 -5.803 -7.640 44 HG LEU 7 HG LEU 7 1.665 -3.896 -8.801 45 HD11 LEU 7 1HD1 LEU 7 2.146 -5.956 -10.893 46 HD12 LEU 7 2HD1 LEU 7 3.057 -4.476 -10.504 47 HD13 LEU 7 3HD1 LEU 7 1.599 -4.416 -11.506 48 HD21 LEU 7 3HD2 LEU 7 -0.616 -4.961 -10.469 49 HD22 LEU 7 1HD2 LEU 7 -0.118 -3.268 -10.256 50 HD23 LEU 7 2HD2 LEU 7 -0.802 -4.165 -8.891 51 H ILE 8 H ILE 8 3.944 -4.630 -8.633 52 HA ILE 8 HA ILE 8 4.569 -3.830 -5.832 53 HB ILE 8 HB ILE 8 6.259 -4.172 -8.342 54 HG13 ILE 8 2HG1 ILE 8 5.882 -6.146 -6.640 55 HG21 ILE 8 1HG2 ILE 8 8.139 -3.193 -7.289 56 HG22 ILE 8 2HG2 ILE 8 6.848 -2.006 -7.249 57 HG23 ILE 8 3HG2 ILE 8 7.266 -2.931 -5.768 58 HD11 ILE 8 3HD1 ILE 8 8.764 -5.397 -7.227 59 HD12 ILE 8 1HD1 ILE 8 8.055 -7.019 -7.067 60 HD13 ILE 8 2HD1 ILE 8 7.663 -6.023 -8.471 61 H LEU 9 H LEU 9 3.350 -1.939 -5.686 62 HA LEU 9 HA LEU 9 3.470 0.114 -7.844 63 HB3 LEU 9 2HB LEU 9 1.300 0.844 -6.621 64 HG LEU 9 HG LEU 9 1.504 -1.614 -8.363 65 HD11 LEU 9 1HD1 LEU 9 -1.035 -0.662 -7.012 66 HD12 LEU 9 2HD1 LEU 9 -0.335 -2.297 -7.136 67 HD13 LEU 9 3HD1 LEU 9 -1.033 -1.549 -8.565 68 HD21 LEU 9 3HD2 LEU 9 0.028 1.029 -8.699 69 HD22 LEU 9 1HD2 LEU 9 0.378 -0.161 -9.949 70 HD23 LEU 9 2HD2 LEU 9 1.712 0.763 -9.199 71 H TYR 10 H TYR 10 4.065 2.224 -7.106 72 HA TYR 10 HA TYR 10 4.221 2.702 -4.216 73 HB3 TYR 10 2HB TYR 10 6.501 1.846 -4.772 74 HD1 TYR 10 1HD TYR 10 6.583 1.305 -7.310 75 HD2 TYR 10 2HD TYR 10 7.435 5.245 -5.737 76 HE1 TYR 10 1HE TYR 10 7.648 1.903 -9.412 77 HE2 TYR 10 2HE TYR 10 8.602 5.820 -7.819 78 HH TYR 10 HH TYR 10 8.534 3.649 -10.662 79 H TYR 11 H TYR 11 4.051 4.855 -3.684 80 HA TYR 11 HA TYR 11 4.498 6.874 -5.759 81 HB3 TYR 11 2HB TYR 11 2.055 6.909 -3.928 82 HD1 TYR 11 1HD TYR 11 3.559 8.257 -7.136 83 HD2 TYR 11 2HD TYR 11 1.143 9.164 -3.672 84 HE1 TYR 11 1HE TYR 11 3.483 10.575 -7.797 85 HE2 TYR 11 2HE TYR 11 1.144 11.544 -4.301 86 HH TYR 11 HH TYR 11 3.350 12.838 -6.413 87 H SER 12 H SER 12 6.471 7.358 -4.936 88 HA SER 12 HA SER 12 6.349 9.184 -2.779 89 HB3 SER 12 2HB SER 12 8.432 7.022 -2.372 90 HG SER 12 HG SER 12 8.716 8.057 -0.485 91 H TRP 13 H TRP 13 6.812 10.602 -4.427 92 HA TRP 13 HA TRP 13 8.059 11.792 -5.891 93 HB3 TRP 13 2HB TRP 13 10.534 10.839 -4.453 94 HD1 TRP 13 HD TRP 13 8.659 14.220 -4.506 95 HE1 TRP 13 1HE TRP 13 10.203 16.031 -5.465 96 HE3 TRP 13 3HE TRP 13 12.704 11.319 -5.657 97 HZ2 TRP 13 2HZ TRP 13 12.772 16.160 -6.774 98 HZ3 TRP 13 3HZ TRP 13 14.663 12.284 -6.773 99 HH2 TRP 13 HH TRP 13 14.718 14.730 -7.354 100 H SER 14 H SER 14 10.683 11.372 -7.038 101 HA SER 14 HA SER 14 10.475 8.665 -8.244 102 HB3 SER 14 2HB SER 14 11.344 11.088 -9.842 103 HG SER 14 HG SER 14 10.529 8.401 -10.421 104 H GLY 15 H GLY 15 11.791 8.122 -6.503 105 HA2 GLY 15 1HA GLY 15 14.341 7.547 -6.747 106 HA3 GLY 15 2HA GLY 15 14.536 9.261 -6.394 107 H GLU 16 H GLU 16 11.810 8.393 -4.553 108 HA GLU 16 HA GLU 16 13.500 8.080 -2.181 109 HB3 GLU 16 2HB GLU 16 10.484 8.308 -2.316 110 HG3 GLU 16 2HG GLU 16 10.865 9.578 -0.180 111 H THR 17 H THR 17 10.380 6.309 -3.053 112 HA THR 17 HA THR 17 11.415 3.914 -1.840 113 HB THR 17 HB THR 17 9.262 2.977 -2.966 114 HG1 THR 17 1HG THR 17 8.271 4.256 -4.191 115 HG21 THR 17 3HG2 THR 17 7.757 4.037 -1.334 116 HG22 THR 17 1HG2 THR 17 9.002 5.242 -0.959 117 HG23 THR 17 2HG2 THR 17 9.280 3.532 -0.592 118 H LYS 18 H LYS 18 11.908 5.172 -4.972 119 HA LYS 18 HA LYS 18 11.046 3.188 -6.603 120 HB3 LYS 18 2HB LYS 18 13.531 4.827 -7.237 121 HG3 LYS 18 2HG LYS 18 11.335 3.561 -8.929 122 HD3 LYS 18 2HD LYS 18 12.236 5.853 -9.784 123 HE3 LYS 18 2HE LYS 18 14.631 4.024 -10.051 124 HZ1 LYS 18 3HZ LYS 18 15.477 5.492 -11.750 125 HZ2 LYS 18 1HZ LYS 18 14.023 6.289 -11.842 126 HZ3 LYS 18 2HZ LYS 18 14.161 4.681 -12.242 127 H LYS 19 H LYS 19 14.318 3.052 -5.066 128 HA LYS 19 HA LYS 19 15.215 0.810 -6.572 129 HB3 LYS 19 2HB LYS 19 16.562 0.261 -4.485 130 HG3 LYS 19 2HG LYS 19 16.800 3.112 -5.548 131 HD3 LYS 19 2HD LYS 19 19.275 2.590 -5.158 132 HE3 LYS 19 2HE LYS 19 18.506 2.654 -2.393 133 HZ1 LYS 19 3HZ LYS 19 18.892 5.105 -2.778 134 HZ2 LYS 19 1HZ LYS 19 19.077 4.811 -4.344 135 HZ3 LYS 19 2HZ LYS 19 20.130 4.163 -3.278 136 H MET 20 H MET 20 13.223 0.923 -3.578 137 HA MET 20 HA MET 20 12.887 -1.980 -3.467 138 HB3 MET 20 2HB MET 20 11.158 -1.161 -1.674 139 HG3 MET 20 2HG MET 20 12.706 -0.829 0.053 140 HE1 MET 20 3HE MET 20 14.873 -1.652 -2.733 141 HE2 MET 20 1HE MET 20 15.974 -2.360 -1.536 142 HE3 MET 20 2HE MET 20 15.179 -3.420 -2.715 143 H ALA 21 H ALA 21 11.891 -0.279 -5.860 144 HA ALA 21 HA ALA 21 9.498 -2.033 -6.035 145 HB1 ALA 21 1HB ALA 21 8.795 0.278 -6.462 146 HB2 ALA 21 2HB ALA 21 10.079 0.485 -7.677 147 HB3 ALA 21 3HB ALA 21 8.758 -0.651 -7.976 148 H GLU 22 H GLU 22 12.222 -0.575 -7.818 149 HA GLU 22 HA GLU 22 12.147 -2.338 -10.011 150 HB3 GLU 22 2HB GLU 22 14.520 -1.331 -10.348 151 HG3 GLU 22 2HG GLU 22 13.760 1.084 -10.344 152 H LYS 23 H LYS 23 14.015 -2.466 -7.003 153 HA LYS 23 HA LYS 23 15.786 -4.594 -7.658 154 HB3 LYS 23 2HB LYS 23 15.013 -4.838 -4.875 155 HG3 LYS 23 2HG LYS 23 17.234 -5.279 -6.048 156 HD3 LYS 23 2HD LYS 23 18.754 -3.457 -5.473 157 HE3 LYS 23 2HE LYS 23 16.726 -2.610 -7.604 158 HZ1 LYS 23 3HZ LYS 23 18.299 -0.933 -7.585 159 HZ2 LYS 23 1HZ LYS 23 18.906 -1.952 -8.684 160 HZ3 LYS 23 2HZ LYS 23 19.531 -1.914 -7.136 161 H ILE 24 H ILE 24 12.875 -4.796 -5.728 162 HA ILE 24 HA ILE 24 12.823 -7.518 -5.370 163 HB ILE 24 HB ILE 24 10.709 -5.319 -5.268 164 HG13 ILE 24 2HG1 ILE 24 12.919 -5.401 -3.757 165 HG21 ILE 24 1HG2 ILE 24 10.547 -8.137 -4.100 166 HG22 ILE 24 2HG2 ILE 24 9.402 -6.834 -3.740 167 HG23 ILE 24 3HG2 ILE 24 9.507 -7.487 -5.373 168 HD11 ILE 24 3HD1 ILE 24 10.172 -5.137 -2.523 169 HD12 ILE 24 1HD1 ILE 24 11.706 -4.730 -1.718 170 HD13 ILE 24 2HD1 ILE 24 11.221 -3.869 -3.179 171 H ASN 25 H ASN 25 11.216 -5.574 -7.932 172 HA ASN 25 HA ASN 25 9.684 -7.600 -9.125 173 HB3 ASN 25 2HB ASN 25 11.282 -5.371 -10.437 174 HD21 ASN 25 1HD2 ASN 25 9.415 -8.261 -11.099 175 HD22 ASN 25 2HD2 ASN 25 9.079 -7.911 -12.745 176 H SER 26 H SER 26 13.187 -6.951 -9.437 177 HA SER 26 HA SER 26 13.575 -8.892 -11.537 178 HB3 SER 26 2HB SER 26 15.869 -7.952 -9.860 179 HG SER 26 HG SER 26 16.733 -8.269 -11.720 180 H GLU 27 H GLU 27 13.012 -9.340 -8.166 181 HA GLU 27 HA GLU 27 14.893 -11.641 -8.010 182 HB3 GLU 27 2HB GLU 27 14.795 -11.361 -5.607 183 HG3 GLU 27 2HG GLU 27 15.165 -8.576 -6.684 184 H ILE 28 H ILE 28 11.483 -10.754 -7.972 185 HA ILE 28 HA ILE 28 10.629 -13.374 -6.936 186 HB ILE 28 HB ILE 28 9.195 -10.797 -7.641 187 HG13 ILE 28 2HG1 ILE 28 10.568 -10.573 -5.602 188 HG21 ILE 28 1HG2 ILE 28 7.642 -12.604 -8.000 189 HG22 ILE 28 2HG2 ILE 28 8.060 -13.352 -6.435 190 HG23 ILE 28 3HG2 ILE 28 7.177 -11.810 -6.541 191 HD11 ILE 28 3HD1 ILE 28 8.972 -9.860 -4.007 192 HD12 ILE 28 1HD1 ILE 28 8.220 -9.569 -5.586 193 HD13 ILE 28 2HD1 ILE 28 7.742 -10.969 -4.588 194 H LYS 29 H LYS 29 9.282 -14.733 -8.256 195 HA LYS 29 HA LYS 29 9.683 -14.533 -11.151 196 HB3 LYS 29 2HB LYS 29 8.003 -16.666 -10.550 197 HG3 LYS 29 2HG LYS 29 10.187 -16.577 -11.915 198 HD3 LYS 29 2HD LYS 29 11.285 -17.484 -9.189 199 HE3 LYS 29 2HE LYS 29 12.596 -16.975 -11.897 200 HZ1 LYS 29 3HZ LYS 29 13.863 -17.957 -9.415 201 HZ2 LYS 29 1HZ LYS 29 14.016 -16.404 -10.029 202 HZ3 LYS 29 2HZ LYS 29 14.561 -17.710 -10.864 203 H ASP 30 H ASP 30 8.019 -14.163 -12.543 204 HA ASP 30 HA ASP 30 6.050 -13.477 -13.352 205 HB3 ASP 30 2HB ASP 30 4.084 -14.498 -11.654 206 H SER 31 H SER 31 7.439 -11.822 -11.196 207 HA SER 31 HA SER 31 5.345 -10.132 -10.154 208 HB3 SER 31 2HB SER 31 7.620 -8.608 -10.191 209 HG SER 31 HG SER 31 6.631 -9.005 -8.361 210 H GLU 32 H GLU 32 5.233 -7.920 -10.710 211 HA GLU 32 HA GLU 32 6.021 -6.830 -13.305 212 HB3 GLU 32 2HB GLU 32 3.548 -5.805 -13.330 213 HG3 GLU 32 2HG GLU 32 4.309 -8.545 -14.310 214 H LEU 33 H LEU 33 6.097 -4.581 -13.161 215 HA LEU 33 HA LEU 33 5.963 -3.441 -10.438 216 HB3 LEU 33 2HB LEU 33 8.287 -4.080 -11.424 217 HG LEU 33 HG LEU 33 7.905 -1.352 -12.755 218 HD11 LEU 33 1HD1 LEU 33 10.286 -1.451 -13.211 219 HD12 LEU 33 2HD1 LEU 33 10.414 -3.074 -12.504 220 HD13 LEU 33 3HD1 LEU 33 10.040 -1.689 -11.473 221 HD21 LEU 33 3HD2 LEU 33 8.488 -2.335 -14.858 222 HD22 LEU 33 1HD2 LEU 33 7.226 -3.392 -14.212 223 HD23 LEU 33 2HD2 LEU 33 8.907 -3.877 -14.106 224 H LYS 34 H LYS 34 5.232 -1.304 -10.287 225 HA LYS 34 HA LYS 34 4.287 0.066 -12.727 226 HB3 LYS 34 2HB LYS 34 1.974 0.108 -11.603 227 HG3 LYS 34 2HG LYS 34 1.241 -2.198 -12.008 228 HD3 LYS 34 2HD LYS 34 3.018 -1.143 -14.223 229 HE3 LYS 34 2HE LYS 34 0.683 -3.112 -14.323 230 HZ1 LYS 34 3HZ LYS 34 1.428 -3.360 -16.624 231 HZ2 LYS 34 1HZ LYS 34 2.603 -2.223 -16.395 232 HZ3 LYS 34 2HZ LYS 34 1.058 -1.769 -16.340 233 H GLU 35 H GLU 35 3.347 2.134 -12.128 234 HA GLU 35 HA GLU 35 4.341 3.296 -9.579 235 HB3 GLU 35 2HB GLU 35 5.438 4.360 -11.457 236 HG3 GLU 35 2HG GLU 35 2.676 4.442 -12.648 237 H VAL 36 H VAL 36 2.868 5.139 -8.874 238 HA VAL 36 HA VAL 36 0.061 4.973 -9.745 239 HB VAL 36 HB VAL 36 0.707 5.729 -6.923 240 HG11 VAL 36 1HG1 VAL 36 -1.480 4.961 -6.375 241 HG12 VAL 36 2HG1 VAL 36 -1.555 6.029 -7.775 242 HG13 VAL 36 3HG1 VAL 36 -1.702 4.273 -8.010 243 HG21 VAL 36 3HG2 VAL 36 0.481 3.587 -5.933 244 HG22 VAL 36 1HG2 VAL 36 0.295 2.810 -7.524 245 HG23 VAL 36 2HG2 VAL 36 1.845 3.522 -7.026 246 H LYS 37 H LYS 37 -0.858 7.264 -9.619 247 HA LYS 37 HA LYS 37 0.932 9.275 -8.437 248 HB3 LYS 37 2HB LYS 37 0.219 10.835 -10.232 249 HG3 LYS 37 2HG LYS 37 1.701 8.399 -11.318 250 HD3 LYS 37 2HD LYS 37 0.966 9.971 -13.065 251 HE3 LYS 37 2HE LYS 37 2.633 11.926 -11.420 252 HZ1 LYS 37 3HZ LYS 37 3.245 12.196 -13.668 253 HZ2 LYS 37 1HZ LYS 37 2.270 13.436 -13.299 254 HZ3 LYS 37 2HZ LYS 37 1.685 12.209 -14.200 255 H VAL 38 H VAL 38 -0.607 11.388 -8.227 256 HA VAL 38 HA VAL 38 -3.041 10.497 -6.875 257 HB VAL 38 HB VAL 38 -3.395 12.942 -6.479 258 HG11 VAL 38 1HG1 VAL 38 -1.631 13.045 -4.775 259 HG12 VAL 38 2HG1 VAL 38 -2.349 11.436 -4.854 260 HG13 VAL 38 3HG1 VAL 38 -0.754 11.737 -5.581 261 HG21 VAL 38 3HG2 VAL 38 -0.567 13.298 -7.600 262 HG22 VAL 38 1HG2 VAL 38 -2.065 13.855 -8.396 263 HG23 VAL 38 2HG2 VAL 38 -1.595 14.524 -6.834 264 H SER 39 H SER 39 -5.125 11.590 -7.468 265 HA SER 39 HA SER 39 -5.631 11.787 -10.337 266 HB3 SER 39 2HB SER 39 -7.619 11.932 -8.060 267 HG SER 39 HG SER 39 -8.794 10.876 -9.975 268 H GLU 40 H GLU 40 -7.287 13.547 -10.761 269 HA GLU 40 HA GLU 40 -6.862 16.070 -9.314 270 HB3 GLU 40 2HB GLU 40 -5.255 16.219 -11.000 271 HG3 GLU 40 2HG GLU 40 -7.380 15.604 -13.093 272 H GLY 41 H GLY 41 -8.815 14.145 -9.336 273 HA2 GLY 41 1HA GLY 41 -11.136 15.234 -10.869 274 HA3 GLY 41 2HA GLY 41 -10.929 13.549 -10.381 275 H THR 42 H THR 42 -13.245 14.193 -9.800 276 HA THR 42 HA THR 42 -14.883 14.899 -8.494 277 HB THR 42 HB THR 42 -13.472 13.673 -6.161 278 HG1 THR 42 1HG THR 42 -12.802 12.255 -7.430 279 HG21 THR 42 3HG2 THR 42 -16.202 13.227 -7.442 280 HG22 THR 42 1HG2 THR 42 -15.886 14.301 -6.065 281 HG23 THR 42 2HG2 THR 42 -15.627 12.559 -5.894 282 H PHE 43 H PHE 43 -13.577 17.063 -8.897 283 HA PHE 43 HA PHE 43 -13.031 19.131 -8.354 284 HB3 PHE 43 2HB PHE 43 -15.402 19.157 -8.332 285 HD1 PHE 43 2HD PHE 43 -14.846 19.670 -4.650 286 HD2 PHE 43 1HD PHE 43 -16.902 17.395 -7.695 287 HE1 PHE 43 2HE PHE 43 -16.240 18.593 -2.914 288 HE2 PHE 43 1HE PHE 43 -18.336 16.375 -5.947 289 HZ PHE 43 HZ PHE 43 -17.988 16.947 -3.557 290 H ASP 44 H ASP 44 -12.718 20.884 -6.809 291 HA ASP 44 HA ASP 44 -11.105 20.147 -4.462 292 HB3 ASP 44 2HB ASP 44 -9.658 19.638 -6.321 293 H ALA 45 H ALA 45 -10.991 22.952 -6.587 294 HA ALA 45 HA ALA 45 -11.244 25.106 -6.357 295 HB1 ALA 45 1HB ALA 45 -13.666 24.617 -5.843 296 HB2 ALA 45 2HB ALA 45 -13.248 24.654 -4.111 297 HB3 ALA 45 3HB ALA 45 -13.039 26.094 -5.106 298 H ASP 46 H ASP 46 -11.240 26.889 -4.571 299 HA ASP 46 HA ASP 46 -9.836 28.076 -3.282 300 HB3 ASP 46 2HB ASP 46 -9.785 26.974 -0.876 301 H MET 47 H MET 47 -8.316 27.165 -5.030 302 HA MET 47 HA MET 47 -6.193 26.895 -5.653 303 HB3 MET 47 2HB MET 47 -4.366 27.432 -3.994 304 HG3 MET 47 2HG MET 47 -6.724 29.317 -4.331 305 HE1 MET 47 3HE MET 47 -5.639 29.569 -1.452 306 HE2 MET 47 1HE MET 47 -5.398 31.328 -1.398 307 HE3 MET 47 2HE MET 47 -6.789 30.655 -2.266 308 H TYR 48 H TYR 48 -7.712 24.550 -4.439 309 HA TYR 48 HA TYR 48 -7.623 22.404 -4.515 310 HB3 TYR 48 2HB TYR 48 -6.695 22.761 -6.728 311 HD1 TYR 48 1HD TYR 48 -3.768 21.217 -4.809 312 HD2 TYR 48 2HD TYR 48 -5.087 23.975 -7.857 313 HE1 TYR 48 1HE TYR 48 -1.434 21.752 -5.315 314 HE2 TYR 48 2HE TYR 48 -2.727 24.515 -8.379 315 HH TYR 48 HH TYR 48 0.020 22.981 -6.643 316 H LYS 49 H LYS 49 -6.764 20.367 -3.801 317 HA LYS 49 HA LYS 49 -4.347 20.360 -2.211 318 HB3 LYS 49 2HB LYS 49 -5.679 19.012 -0.409 319 HG3 LYS 49 2HG LYS 49 -4.487 21.359 -0.293 320 HD3 LYS 49 2HD LYS 49 -7.042 22.299 0.874 321 HE3 LYS 49 2HE LYS 49 -5.770 24.149 -0.985 322 HZ1 LYS 49 3HZ LYS 49 -5.405 25.441 0.951 323 HZ2 LYS 49 1HZ LYS 49 -5.604 24.160 1.949 324 HZ3 LYS 49 2HZ LYS 49 -6.907 24.743 1.115 325 H THR 50 H THR 50 -3.447 18.935 -3.517 326 HA THR 50 HA THR 50 -4.437 16.219 -3.549 327 HB THR 50 HB THR 50 -5.597 17.351 -5.356 328 HG1 THR 50 1HG THR 50 -5.042 15.658 -6.931 329 HG21 THR 50 3HG2 THR 50 -3.981 18.959 -6.162 330 HG22 THR 50 1HG2 THR 50 -4.570 17.909 -7.458 331 HG23 THR 50 2HG2 THR 50 -2.952 17.646 -6.780 332 H SER 51 H SER 51 -1.791 18.537 -3.996 333 HA SER 51 HA SER 51 0.078 16.358 -4.768 334 HB3 SER 51 2HB SER 51 0.639 19.333 -4.689 335 HG SER 51 HG SER 51 2.139 18.793 -6.149 336 H ASP 52 H ASP 52 -1.208 17.144 -2.094 337 HA ASP 52 HA ASP 52 0.685 18.848 -0.828 338 HB3 ASP 52 2HB ASP 52 -1.361 19.052 0.725 339 H ILE 53 H ILE 53 2.363 17.781 0.179 340 HA ILE 53 HA ILE 53 1.724 15.359 1.813 341 HB ILE 53 HB ILE 53 4.027 15.896 -0.092 342 HG13 ILE 53 2HG1 ILE 53 1.665 15.210 -1.059 343 HG21 ILE 53 1HG2 ILE 53 4.788 14.512 1.818 344 HG22 ILE 53 2HG2 ILE 53 3.438 13.402 1.569 345 HG23 ILE 53 3HG2 ILE 53 4.730 13.542 0.356 346 HD11 ILE 53 3HD1 ILE 53 3.733 15.244 -2.379 347 HD12 ILE 53 1HD1 ILE 53 4.130 13.610 -1.821 348 HD13 ILE 53 2HD1 ILE 53 2.674 13.884 -2.802 349 H ALA 54 H ALA 54 2.831 15.067 3.593 350 HA ALA 54 HA ALA 54 3.929 15.316 5.487 351 HB1 ALA 54 1HB ALA 54 5.663 16.931 5.946 352 HB2 ALA 54 2HB ALA 54 5.965 16.119 4.400 353 HB3 ALA 54 3HB ALA 54 5.346 17.784 4.429 354 H LEU 55 H LEU 55 2.304 15.614 6.856 355 HA LEU 55 HA LEU 55 1.001 16.518 8.394 356 HB3 LEU 55 2HB LEU 55 1.608 18.512 9.293 357 HG LEU 55 HG LEU 55 4.232 17.211 8.458 358 HD11 LEU 55 1HD1 LEU 55 3.109 18.637 10.860 359 HD12 LEU 55 2HD1 LEU 55 4.260 19.327 9.706 360 HD13 LEU 55 3HD1 LEU 55 4.792 17.994 10.758 361 HD21 LEU 55 3HD2 LEU 55 3.858 15.824 10.565 362 HD22 LEU 55 1HD2 LEU 55 2.864 15.342 9.198 363 HD23 LEU 55 2HD2 LEU 55 2.151 16.299 10.513 364 H ASP 56 H ASP 56 -0.068 16.626 5.621 365 HA ASP 56 HA ASP 56 -1.916 18.916 5.931 366 HB3 ASP 56 2HB ASP 56 -0.910 17.960 3.252 367 H GLN 57 H GLN 57 -4.030 18.268 5.673 368 HA GLN 57 HA GLN 57 -5.834 17.024 5.674 369 HB3 GLN 57 2HB GLN 57 -5.057 16.764 3.274 370 HG3 GLN 57 2HG GLN 57 -5.541 13.868 3.547 371 HE21 GLN 57 1HE2 GLN 57 -4.205 12.569 2.035 372 HE22 GLN 57 2HE2 GLN 57 -3.426 13.291 0.667 373 H ILE 58 H ILE 58 -3.435 16.073 7.444 374 HA ILE 58 HA ILE 58 -4.657 13.460 8.294 375 HB ILE 58 HB ILE 58 -1.871 14.579 8.683 376 HG13 ILE 58 2HG1 ILE 58 -3.100 12.105 7.292 377 HG21 ILE 58 1HG2 ILE 58 -1.353 12.656 10.100 378 HG22 ILE 58 2HG2 ILE 58 -2.771 13.388 10.826 379 HG23 ILE 58 3HG2 ILE 58 -2.963 11.942 9.840 380 HD11 ILE 58 3HD1 ILE 58 -2.595 13.792 5.690 381 HD12 ILE 58 1HD1 ILE 58 -0.988 14.122 6.390 382 HD13 ILE 58 2HD1 ILE 58 -1.342 12.577 5.564 383 H GLN 59 H GLN 59 -2.878 16.168 9.852 384 HA GLN 59 HA GLN 59 -4.508 15.798 12.307 385 HB3 GLN 59 2HB GLN 59 -2.806 17.381 13.283 386 HG3 GLN 59 2HG GLN 59 -1.631 14.886 11.994 387 HE21 GLN 59 1HE2 GLN 59 0.055 17.034 12.124 388 HE22 GLN 59 2HE2 GLN 59 1.257 16.762 13.350 389 H GLY 60 H GLY 60 -6.032 17.250 12.830 390 HA2 GLY 60 1HA GLY 60 -7.361 19.141 12.749 391 HA3 GLY 60 2HA GLY 60 -6.196 19.940 11.682 392 H ASN 61 H ASN 61 -5.907 18.351 9.543 393 HA ASN 61 HA ASN 61 -8.437 19.174 8.308 394 HB3 ASN 61 2HB ASN 61 -7.019 19.178 6.234 395 HD21 ASN 61 1HD2 ASN 61 -7.052 21.396 5.920 396 HD22 ASN 61 2HD2 ASN 61 -6.202 22.531 6.968 397 H LYS 62 H LYS 62 -9.086 17.892 6.215 398 HA LYS 62 HA LYS 62 -8.667 15.016 6.296 399 HB3 LYS 62 2HB LYS 62 -11.507 15.149 6.480 400 HG3 LYS 62 2HG LYS 62 -9.535 14.565 8.709 401 HD3 LYS 62 2HD LYS 62 -12.249 13.353 8.080 402 HE3 LYS 62 2HE LYS 62 -10.526 11.843 9.115 403 HZ1 LYS 62 3HZ LYS 62 -9.309 13.344 10.486 404 HZ2 LYS 62 1HZ LYS 62 -10.055 12.288 11.482 405 HZ3 LYS 62 2HZ LYS 62 -10.658 13.815 11.322 406 H ASP 63 H ASP 63 -10.475 14.021 4.853 407 HA ASP 63 HA ASP 63 -10.961 13.439 2.795 408 HB3 ASP 63 2HB ASP 63 -10.936 15.554 1.009 409 H PHE 64 H PHE 64 -9.823 13.321 0.546 410 HA PHE 64 HA PHE 64 -7.109 14.320 0.465 411 HB3 PHE 64 2HB PHE 64 -6.515 12.571 1.832 412 HD1 PHE 64 2HD PHE 64 -8.465 10.617 -0.718 413 HD2 PHE 64 1HD PHE 64 -7.322 11.104 3.396 414 HE1 PHE 64 2HE PHE 64 -9.901 8.692 -0.090 415 HE2 PHE 64 1HE PHE 64 -8.643 9.105 4.014 416 HZ PHE 64 HZ PHE 64 -10.018 7.939 2.278 417 HA PRO 65 HA PRO 65 -7.930 13.786 -3.843 418 HB3 PRO 65 2HB PRO 65 -5.945 14.635 -4.328 419 HG3 PRO 65 2HG PRO 65 -3.947 14.049 -3.128 420 HD3 PRO 65 2HD PRO 65 -5.578 14.824 -1.571 421 H GLU 66 H GLU 66 -8.386 12.095 -5.480 422 HA GLU 66 HA GLU 66 -8.192 9.276 -4.610 423 HB3 GLU 66 2HB GLU 66 -8.879 8.958 -7.143 424 HG3 GLU 66 2HG GLU 66 -10.896 10.196 -5.254 425 H ILE 67 H ILE 67 -7.266 7.906 -6.744 426 HA ILE 67 HA ILE 67 -4.501 8.893 -7.197 427 HB ILE 67 HB ILE 67 -3.869 6.482 -7.266 428 HG13 ILE 67 2HG1 ILE 67 -6.409 5.758 -7.478 429 HG21 ILE 67 1HG2 ILE 67 -4.915 7.461 -4.568 430 HG22 ILE 67 2HG2 ILE 67 -3.657 6.237 -4.825 431 HG23 ILE 67 3HG2 ILE 67 -3.372 7.911 -5.316 432 HD11 ILE 67 3HD1 ILE 67 -4.684 4.113 -7.520 433 HD12 ILE 67 1HD1 ILE 67 -4.402 4.280 -5.776 434 HD13 ILE 67 2HD1 ILE 67 -5.941 3.604 -6.365 435 H GLN 68 H GLN 68 -3.548 7.946 -9.144 436 HA GLN 68 HA GLN 68 -5.421 6.888 -11.155 437 HB3 GLN 68 2HB GLN 68 -3.960 8.202 -12.854 438 HG3 GLN 68 2HG GLN 68 -6.016 9.591 -11.062 439 HE21 GLN 68 1HE2 GLN 68 -4.058 11.312 -11.664 440 HE22 GLN 68 2HE2 GLN 68 -4.528 12.362 -12.967 441 H LEU 69 H LEU 69 -4.442 5.405 -12.484 442 HA LEU 69 HA LEU 69 -1.703 4.854 -12.527 443 HB3 LEU 69 2HB LEU 69 -2.379 3.761 -10.306 444 HG LEU 69 HG LEU 69 -3.381 1.491 -12.059 445 HD11 LEU 69 1HD1 LEU 69 -3.480 1.955 -9.038 446 HD12 LEU 69 2HD1 LEU 69 -2.221 1.019 -9.860 447 HD13 LEU 69 3HD1 LEU 69 -3.905 0.461 -9.898 448 HD21 LEU 69 3HD2 LEU 69 -5.064 3.367 -10.342 449 HD22 LEU 69 1HD2 LEU 69 -5.621 1.788 -10.969 450 HD23 LEU 69 2HD2 LEU 69 -5.239 3.070 -12.101 451 H ASP 70 H ASP 70 -1.718 2.486 -13.818 452 HA ASP 70 HA ASP 70 -3.181 3.208 -16.269 453 HB3 ASP 70 2HB ASP 70 -1.641 0.695 -16.170 454 H ASN 71 H ASN 71 -4.011 1.184 -17.521 455 HA ASN 71 HA ASN 71 -6.158 -0.022 -16.033 456 HB3 ASN 71 2HB ASN 71 -5.182 -0.815 -18.771 457 HD21 ASN 71 1HD2 ASN 71 -5.962 -2.972 -17.726 458 HD22 ASN 71 2HD2 ASN 71 -7.676 -3.333 -17.865 459 H ILE 72 H ILE 72 -5.064 -0.932 -14.426 460 HA ILE 72 HA ILE 72 -3.620 -3.515 -14.755 461 HB ILE 72 HB ILE 72 -4.074 -1.658 -12.375 462 HG13 ILE 72 2HG1 ILE 72 -2.478 -0.750 -14.128 463 HG21 ILE 72 1HG2 ILE 72 -2.535 -2.991 -11.088 464 HG22 ILE 72 2HG2 ILE 72 -3.797 -4.017 -11.673 465 HG23 ILE 72 3HG2 ILE 72 -2.210 -4.069 -12.477 466 HD11 ILE 72 3HD1 ILE 72 -2.073 -0.320 -11.680 467 HD12 ILE 72 1HD1 ILE 72 -0.865 -1.603 -11.725 468 HD13 ILE 72 2HD1 ILE 72 -0.665 -0.165 -12.748 469 H ASP 73 H ASP 73 -4.600 -5.431 -13.375 470 HA ASP 73 HA ASP 73 -7.303 -4.940 -12.344 471 HB3 ASP 73 2HB ASP 73 -7.240 -7.547 -13.005 472 H TYR 74 H TYR 74 -7.160 -5.325 -10.174 473 HA TYR 74 HA TYR 74 -4.868 -6.491 -8.887 474 HB3 TYR 74 2HB TYR 74 -6.124 -6.491 -6.867 475 HD1 TYR 74 1HD TYR 74 -4.375 -4.445 -7.813 476 HD2 TYR 74 2HD TYR 74 -8.688 -4.290 -7.521 477 HE1 TYR 74 1HE TYR 74 -4.299 -1.995 -8.028 478 HE2 TYR 74 2HE TYR 74 -8.598 -1.846 -7.668 479 HH TYR 74 HH TYR 74 -6.836 -0.341 -9.107 480 H ASN 75 H ASN 75 -7.771 -7.932 -10.186 481 HA ASN 75 HA ASN 75 -7.915 -10.119 -8.490 482 HB3 ASN 75 2HB ASN 75 -9.688 -10.862 -9.866 483 HD21 ASN 75 1HD2 ASN 75 -11.162 -9.375 -8.669 484 HD22 ASN 75 2HD2 ASN 75 -11.514 -7.823 -9.449 485 H ASN 76 H ASN 76 -6.113 -9.835 -11.567 486 HA ASN 76 HA ASN 76 -5.749 -12.692 -11.754 487 HB3 ASN 76 2HB ASN 76 -5.848 -11.297 -13.767 488 HD21 ASN 76 1HD2 ASN 76 -5.655 -8.990 -13.764 489 HD22 ASN 76 2HD2 ASN 76 -4.108 -8.165 -13.652 490 H TYR 77 H TYR 77 -4.345 -10.656 -9.536 491 HA TYR 77 HA TYR 77 -1.712 -12.045 -9.664 492 HB3 TYR 77 2HB TYR 77 -1.079 -10.344 -7.928 493 HD1 TYR 77 2HD TYR 77 0.639 -10.357 -9.712 494 HD2 TYR 77 1HD TYR 77 -3.121 -8.329 -10.277 495 HE1 TYR 77 2HE TYR 77 1.676 -8.944 -11.446 496 HE2 TYR 77 1HE TYR 77 -2.085 -6.906 -12.019 497 HH TYR 77 HH TYR 77 -0.056 -6.509 -13.338 498 H ASP 78 H ASP 78 -0.852 -12.586 -7.402 499 HA ASP 78 HA ASP 78 -3.032 -13.632 -5.633 500 HB3 ASP 78 2HB ASP 78 -0.355 -14.995 -5.951 501 H LEU 79 H LEU 79 -0.118 -11.709 -5.902 502 HA LEU 79 HA LEU 79 -0.216 -11.195 -3.007 503 HB3 LEU 79 2HB LEU 79 2.539 -11.228 -3.676 504 HG LEU 79 HG LEU 79 0.692 -13.066 -2.100 505 HD11 LEU 79 1HD1 LEU 79 2.843 -14.125 -1.245 506 HD12 LEU 79 2HD1 LEU 79 3.632 -13.441 -2.685 507 HD13 LEU 79 3HD1 LEU 79 2.310 -14.605 -2.875 508 HD21 LEU 79 3HD2 LEU 79 2.978 -11.213 -1.333 509 HD22 LEU 79 1HD2 LEU 79 1.972 -12.140 -0.203 510 HD23 LEU 79 2HD2 LEU 79 1.236 -10.837 -1.155 511 H ILE 80 H ILE 80 0.323 -9.125 -2.450 512 HA ILE 80 HA ILE 80 1.124 -7.212 -4.632 513 HB ILE 80 HB ILE 80 -1.234 -7.092 -2.725 514 HG13 ILE 80 2HG1 ILE 80 -1.521 -8.377 -4.829 515 HG21 ILE 80 1HG2 ILE 80 -0.174 -4.838 -2.790 516 HG22 ILE 80 2HG2 ILE 80 -0.186 -4.898 -4.568 517 HG23 ILE 80 3HG2 ILE 80 -1.704 -4.854 -3.642 518 HD11 ILE 80 3HD1 ILE 80 -3.398 -7.353 -5.839 519 HD12 ILE 80 1HD1 ILE 80 -3.445 -7.042 -4.100 520 HD13 ILE 80 2HD1 ILE 80 -2.967 -5.755 -5.230 521 H LEU 81 H LEU 81 2.608 -5.655 -4.116 522 HA LEU 81 HA LEU 81 3.178 -5.051 -1.265 523 HB3 LEU 81 2HB LEU 81 5.308 -4.042 -2.386 524 HG LEU 81 HG LEU 81 6.574 -6.008 -2.464 525 HD11 LEU 81 1HD1 LEU 81 6.169 -6.911 -0.270 526 HD12 LEU 81 2HD1 LEU 81 4.486 -6.399 -0.302 527 HD13 LEU 81 3HD1 LEU 81 5.797 -5.188 -0.233 528 HD21 LEU 81 3HD2 LEU 81 5.830 -8.264 -2.416 529 HD22 LEU 81 1HD2 LEU 81 5.071 -7.472 -3.802 530 HD23 LEU 81 2HD2 LEU 81 4.138 -7.788 -2.322 531 H ILE 82 H ILE 82 3.587 -2.919 -0.691 532 HA ILE 82 HA ILE 82 2.481 -0.747 -2.384 533 HB ILE 82 HB ILE 82 1.686 -1.602 0.441 534 HG13 ILE 82 2HG1 ILE 82 0.558 -2.928 -1.294 535 HG21 ILE 82 1HG2 ILE 82 0.602 0.801 -1.059 536 HG22 ILE 82 2HG2 ILE 82 0.254 0.283 0.604 537 HG23 ILE 82 3HG2 ILE 82 1.833 0.911 0.225 538 HD11 ILE 82 3HD1 ILE 82 -1.715 -2.630 -0.707 539 HD12 ILE 82 1HD1 ILE 82 -0.743 -2.284 0.725 540 HD13 ILE 82 2HD1 ILE 82 -1.468 -0.950 -0.221 541 H GLY 83 H GLY 83 3.822 1.100 -2.173 542 HA2 GLY 83 1HA GLY 83 5.606 1.253 0.239 543 HA3 GLY 83 2HA GLY 83 6.149 1.676 -1.383 544 H SER 84 H SER 84 5.738 3.246 1.266 545 HA SER 84 HA SER 84 4.956 5.735 0.049 546 HB3 SER 84 2HB SER 84 3.262 4.809 2.396 547 HG SER 84 HG SER 84 2.753 6.800 2.243 548 HA PRO 85 HA PRO 85 8.028 6.712 3.071 549 HB3 PRO 85 2HB PRO 85 8.394 8.554 1.674 550 HG3 PRO 85 2HG PRO 85 6.590 9.917 0.928 551 HD3 PRO 85 2HD PRO 85 5.890 7.785 0.245 552 H VAL 86 H VAL 86 8.509 8.223 5.062 553 HA VAL 86 HA VAL 86 6.281 8.856 6.748 554 HB VAL 86 HB VAL 86 6.323 6.414 6.947 555 HG11 VAL 86 1HG1 VAL 86 8.797 6.075 6.769 556 HG12 VAL 86 2HG1 VAL 86 8.916 6.607 8.461 557 HG13 VAL 86 3HG1 VAL 86 7.950 5.167 8.025 558 HG21 VAL 86 3HG2 VAL 86 5.418 7.769 8.740 559 HG22 VAL 86 1HG2 VAL 86 6.297 6.395 9.441 560 HG23 VAL 86 2HG2 VAL 86 7.047 7.988 9.447 561 H TRP 87 H TRP 87 6.977 10.743 7.603 562 HA TRP 87 HA TRP 87 9.509 10.655 9.153 563 HB3 TRP 87 2HB TRP 87 10.012 12.968 8.295 564 HD1 TRP 87 HD TRP 87 11.925 10.870 7.788 565 HE1 TRP 87 1HE TRP 87 12.735 9.977 5.546 566 HE3 TRP 87 3HE TRP 87 8.183 12.723 4.819 567 HZ2 TRP 87 2HZ TRP 87 11.859 10.109 2.736 568 HZ3 TRP 87 3HZ TRP 87 8.252 12.399 2.379 569 HH2 TRP 87 HH TRP 87 10.083 11.114 1.326 570 H SER 88 H SER 88 6.218 11.382 9.111 571 HA SER 88 HA SER 88 6.520 12.313 11.896 572 HB3 SER 88 2HB SER 88 4.744 13.957 11.587 573 HG SER 88 HG SER 88 6.775 14.766 11.108 574 H GLY 89 H GLY 89 5.610 9.774 10.211 575 HA2 GLY 89 1HA GLY 89 4.350 7.973 11.137 576 HA3 GLY 89 2HA GLY 89 3.191 9.116 11.824 577 H TYR 90 H TYR 90 2.487 10.742 9.716 578 HA TYR 90 HA TYR 90 1.361 8.963 7.644 579 HB3 TYR 90 2HB TYR 90 -0.824 9.544 8.185 580 HD1 TYR 90 1HD TYR 90 0.726 10.799 11.302 581 HD2 TYR 90 2HD TYR 90 -1.382 7.525 9.482 582 HE1 TYR 90 1HE TYR 90 0.255 9.872 13.558 583 HE2 TYR 90 2HE TYR 90 -1.936 6.621 11.713 584 HH TYR 90 HH TYR 90 -1.373 6.733 14.029 585 HA PRO 91 HA PRO 91 3.048 13.105 6.256 586 HB3 PRO 91 2HB PRO 91 5.150 12.191 5.824 587 HG3 PRO 91 2HG PRO 91 5.384 9.947 5.097 588 HD3 PRO 91 2HD PRO 91 4.245 9.958 7.199 589 H ALA 92 H ALA 92 1.269 10.516 4.585 590 HA ALA 92 HA ALA 92 0.118 12.371 2.655 591 HB1 ALA 92 1HB ALA 92 0.884 11.109 0.767 592 HB2 ALA 92 2HB ALA 92 2.329 11.392 1.729 593 HB3 ALA 92 3HB ALA 92 1.538 9.806 1.791 594 H THR 93 H THR 93 -1.691 10.980 1.397 595 HA THR 93 HA THR 93 -2.251 8.426 2.779 596 HB THR 93 HB THR 93 -4.598 8.909 3.109 597 HG1 THR 93 1HG THR 93 -5.041 10.257 1.486 598 HG21 THR 93 3HG2 THR 93 -3.264 11.403 4.234 599 HG22 THR 93 1HG2 THR 93 -3.122 9.803 4.971 600 HG23 THR 93 2HG2 THR 93 -4.715 10.556 4.817 601 HA PRO 94 HA PRO 94 -3.183 8.259 -1.869 602 HB3 PRO 94 2HB PRO 94 -1.170 9.048 -2.708 603 HG3 PRO 94 2HG PRO 94 0.874 8.696 -1.533 604 HD3 PRO 94 2HD PRO 94 -0.524 9.824 -0.071 605 H ILE 95 H ILE 95 -2.273 6.448 0.727 606 HA ILE 95 HA ILE 95 -2.823 3.803 -0.550 607 HB ILE 95 HB ILE 95 -1.656 4.197 2.217 608 HG13 ILE 95 2HG1 ILE 95 0.636 4.053 1.445 609 HG21 ILE 95 1HG2 ILE 95 -0.578 2.045 1.715 610 HG22 ILE 95 2HG2 ILE 95 -2.329 1.954 1.552 611 HG23 ILE 95 3HG2 ILE 95 -1.334 2.036 0.096 612 HD11 ILE 95 3HD1 ILE 95 -0.440 4.601 -1.357 613 HD12 ILE 95 1HD1 ILE 95 1.239 4.783 -0.855 614 HD13 ILE 95 2HD1 ILE 95 0.483 3.180 -0.830 615 H LYS 96 H LYS 96 -4.908 5.635 -0.164 616 HA LYS 96 HA LYS 96 -6.462 4.051 1.839 617 HB3 LYS 96 2HB LYS 96 -7.923 6.455 1.121 618 HG3 LYS 96 2HG LYS 96 -7.437 7.046 3.568 619 HD3 LYS 96 2HD LYS 96 -8.453 4.240 2.922 620 HE3 LYS 96 2HE LYS 96 -9.117 5.986 5.345 621 HZ1 LYS 96 3HZ LYS 96 -10.769 4.314 4.717 622 HZ2 LYS 96 1HZ LYS 96 -10.042 3.851 6.111 623 HZ3 LYS 96 2HZ LYS 96 -9.622 3.144 4.691 624 H THR 97 H THR 97 -7.088 5.985 -1.097 625 HA THR 97 HA THR 97 -9.295 4.661 -1.970 626 HB THR 97 HB THR 97 -7.111 5.933 -3.646 627 HG1 THR 97 1HG THR 97 -9.156 7.039 -2.048 628 HG21 THR 97 3HG2 THR 97 -8.861 6.671 -5.147 629 HG22 THR 97 1HG2 THR 97 -10.117 5.945 -4.134 630 HG23 THR 97 2HG2 THR 97 -8.962 4.910 -5.001 631 H LEU 98 H LEU 98 -5.906 3.701 -2.834 632 HA LEU 98 HA LEU 98 -6.655 1.818 -4.807 633 HB3 LEU 98 2HB LEU 98 -4.219 1.671 -2.904 634 HG LEU 98 HG LEU 98 -3.027 0.680 -4.680 635 HD11 LEU 98 1HD1 LEU 98 -3.967 -1.365 -5.287 636 HD12 LEU 98 2HD1 LEU 98 -5.613 -0.775 -5.176 637 HD13 LEU 98 3HD1 LEU 98 -4.628 -0.966 -3.696 638 HD21 LEU 98 3HD2 LEU 98 -5.336 1.320 -6.543 639 HD22 LEU 98 1HD2 LEU 98 -3.904 0.378 -6.999 640 HD23 LEU 98 2HD2 LEU 98 -3.715 2.070 -6.527 641 H LEU 99 H LEU 99 -5.887 1.180 -1.390 642 HA LEU 99 HA LEU 99 -6.513 -1.579 -1.240 643 HB3 LEU 99 2HB LEU 99 -7.069 -0.802 1.259 644 HG LEU 99 HG LEU 99 -4.374 -0.321 -0.130 645 HD11 LEU 99 1HD1 LEU 99 -4.797 -0.405 2.861 646 HD12 LEU 99 2HD1 LEU 99 -4.591 1.082 1.957 647 HD13 LEU 99 3HD1 LEU 99 -3.285 -0.128 1.995 648 HD21 LEU 99 3HD2 LEU 99 -5.007 -2.702 -0.019 649 HD22 LEU 99 1HD2 LEU 99 -5.174 -2.571 1.750 650 HD23 LEU 99 2HD2 LEU 99 -3.598 -2.347 0.983 651 H ASP 100 H ASP 100 -8.539 1.294 -0.725 652 HA ASP 100 HA ASP 100 -10.998 -0.065 -0.291 653 HB3 ASP 100 2HB ASP 100 -11.723 2.381 -1.151 654 H GLN 101 H GLN 101 -9.240 0.135 -3.273 655 HA GLN 101 HA GLN 101 -11.695 -0.242 -4.889 656 HB3 GLN 101 2HB GLN 101 -10.130 -0.409 -6.780 657 HG3 GLN 101 2HG GLN 101 -9.422 2.204 -5.507 658 HE21 GLN 101 1HE2 GLN 101 -10.462 3.995 -7.181 659 HE22 GLN 101 2HE2 GLN 101 -10.031 3.650 -8.831 660 H MET 102 H MET 102 -9.052 -2.037 -3.361 661 HA MET 102 HA MET 102 -9.099 -4.344 -5.079 662 HB3 MET 102 2HB MET 102 -7.673 -5.316 -3.271 663 HG3 MET 102 2HG MET 102 -6.975 -2.521 -4.211 664 HE1 MET 102 3HE MET 102 -5.147 -5.830 -3.645 665 HE2 MET 102 1HE MET 102 -3.903 -5.495 -2.416 666 HE3 MET 102 2HE MET 102 -5.611 -5.716 -1.937 667 H LYS 103 H LYS 103 -11.730 -3.616 -3.885 668 HA LYS 103 HA LYS 103 -12.417 -5.349 -1.707 669 HB3 LYS 103 2HB LYS 103 -14.784 -4.673 -2.429 670 HG3 LYS 103 2HG LYS 103 -14.224 -2.088 -2.253 671 HD3 LYS 103 2HD LYS 103 -13.753 -4.142 -0.068 672 HE3 LYS 103 2HE LYS 103 -13.682 -1.113 0.066 673 HZ1 LYS 103 3HZ LYS 103 -13.809 -1.513 2.514 674 HZ2 LYS 103 1HZ LYS 103 -14.443 -2.998 2.207 675 HZ3 LYS 103 2HZ LYS 103 -15.211 -1.609 1.706 676 H ASN 104 H ASN 104 -11.824 -6.264 -5.017 677 HA ASN 104 HA ASN 104 -13.161 -8.852 -4.506 678 HB3 ASN 104 2HB ASN 104 -13.626 -8.942 -6.929 679 HD21 ASN 104 1HD2 ASN 104 -14.679 -5.730 -6.957 680 HD22 ASN 104 2HD2 ASN 104 -16.060 -5.880 -5.896 681 H TYR 105 H TYR 105 -10.334 -7.714 -4.150 682 HA TYR 105 HA TYR 105 -8.696 -9.264 -6.033 683 HB3 TYR 105 2HB TYR 105 -8.217 -7.779 -3.419 684 HD1 TYR 105 2HD TYR 105 -6.281 -9.353 -6.287 685 HD2 TYR 105 1HD TYR 105 -6.379 -8.177 -2.130 686 HE1 TYR 105 2HE TYR 105 -4.040 -10.325 -5.955 687 HE2 TYR 105 1HE TYR 105 -4.130 -9.103 -1.808 688 HH TYR 105 HH TYR 105 -2.283 -10.006 -2.830 689 H ARG 106 H ARG 106 -7.634 -11.210 -5.463 690 HA ARG 106 HA ARG 106 -8.426 -12.630 -2.992 691 HB3 ARG 106 2HB ARG 106 -8.542 -14.699 -4.408 692 HG3 ARG 106 2HG ARG 106 -10.798 -13.377 -5.647 693 HD3 ARG 106 2HD ARG 106 -11.989 -14.435 -3.651 694 HE ARG 106 HE ARG 106 -11.070 -15.649 -5.874 695 HH11 ARG 106 1HH1 ARG 106 -11.088 -16.788 -2.546 696 HH12 ARG 106 2HH1 ARG 106 -10.987 -18.473 -2.940 697 HH21 ARG 106 1HH2 ARG 106 -10.847 -17.773 -6.454 698 HH22 ARG 106 2HH2 ARG 106 -10.769 -19.062 -5.294 699 H GLY 107 H GLY 107 -6.392 -12.760 -2.009 700 HA2 GLY 107 1HA GLY 107 -4.075 -13.925 -2.732 701 HA3 GLY 107 2HA GLY 107 -4.007 -12.397 -3.612 702 H GLU 108 H GLU 108 -2.099 -11.982 -2.016 703 HA GLU 108 HA GLU 108 -3.123 -11.126 0.672 704 HB3 GLU 108 2HB GLU 108 -0.946 -11.890 1.546 705 HG3 GLU 108 2HG GLU 108 -3.142 -13.406 1.204 706 H VAL 109 H VAL 109 -1.812 -9.457 1.753 707 HA VAL 109 HA VAL 109 -0.433 -7.668 -0.209 708 HB VAL 109 HB VAL 109 -2.313 -6.794 2.013 709 HG11 VAL 109 1HG1 VAL 109 -1.206 -5.328 -0.422 710 HG12 VAL 109 2HG1 VAL 109 -2.375 -4.664 0.741 711 HG13 VAL 109 3HG1 VAL 109 -0.742 -5.051 1.272 712 HG21 VAL 109 3HG2 VAL 109 -2.979 -7.181 -0.935 713 HG22 VAL 109 1HG2 VAL 109 -3.732 -8.012 0.451 714 HG23 VAL 109 2HG2 VAL 109 -3.993 -6.289 0.225 715 H ALA 110 H ALA 110 1.412 -6.585 0.547 716 HA ALA 110 HA ALA 110 1.759 -6.304 3.457 717 HB1 ALA 110 1HB ALA 110 3.235 -8.225 2.822 718 HB2 ALA 110 2HB ALA 110 4.045 -7.202 1.641 719 HB3 ALA 110 3HB ALA 110 4.158 -6.812 3.356 720 H SER 111 H SER 111 3.633 -4.607 3.789 721 HA SER 111 HA SER 111 3.811 -2.750 1.538 722 HB3 SER 111 2HB SER 111 2.770 -1.861 4.264 723 HG SER 111 HG SER 111 3.389 -0.524 1.836 724 H PHE 112 H PHE 112 5.489 -1.152 1.779 725 HA PHE 112 HA PHE 112 7.514 -1.857 3.763 726 HB3 PHE 112 2HB PHE 112 8.032 -3.002 1.664 727 HD1 PHE 112 1HD PHE 112 9.587 0.237 0.848 728 HD2 PHE 112 2HD PHE 112 6.638 -2.669 -0.390 729 HE1 PHE 112 1HE PHE 112 9.549 1.226 -1.433 730 HE2 PHE 112 2HE PHE 112 6.646 -1.716 -2.642 731 HZ PHE 112 HZ PHE 112 8.085 0.243 -3.185 732 H PHE 113 H PHE 113 8.864 -0.168 4.421 733 HA PHE 113 HA PHE 113 8.296 2.558 3.344 734 HB3 PHE 113 2HB PHE 113 7.138 2.538 5.364 735 HD1 PHE 113 2HD PHE 113 6.759 0.243 6.297 736 HD2 PHE 113 1HD PHE 113 10.186 2.596 7.363 737 HE1 PHE 113 2HE PHE 113 7.212 -1.271 8.212 738 HE2 PHE 113 1HE PHE 113 10.624 1.125 9.299 739 HZ PHE 113 HZ PHE 113 9.158 -0.858 9.711 740 H THR 114 H THR 114 10.081 3.293 2.392 741 HA THR 114 HA THR 114 12.784 2.279 3.137 742 HB THR 114 HB THR 114 13.506 3.730 1.173 743 HG1 THR 114 1HG THR 114 11.920 5.074 0.615 744 HG21 THR 114 3HG2 THR 114 13.152 1.277 1.001 745 HG22 THR 114 1HG2 THR 114 12.751 2.144 -0.506 746 HG23 THR 114 2HG2 THR 114 11.445 1.564 0.553 747 H SER 115 H SER 115 10.669 4.898 3.774 748 HA SER 115 HA SER 115 12.698 6.756 4.805 749 HB3 SER 115 2HB SER 115 10.548 7.954 5.464 750 HG SER 115 HG SER 115 10.542 6.958 2.775 751 H ALA 116 H ALA 116 12.805 7.205 7.138 752 HA ALA 116 HA ALA 116 11.308 5.373 8.950 753 HB1 ALA 116 1HB ALA 116 13.384 4.649 10.091 754 HB2 ALA 116 2HB ALA 116 13.376 4.143 8.397 755 HB3 ALA 116 3HB ALA 116 14.357 5.536 8.898 756 H GLY 117 H GLY 117 12.438 8.482 8.397 757 HA2 GLY 117 1HA GLY 117 14.364 9.023 9.927 758 HA3 GLY 117 2HA GLY 117 13.147 10.275 9.733 759 H THR 118 H THR 118 11.230 10.061 11.502 760 HA THR 118 HA THR 118 12.385 9.189 14.102 761 HB THR 118 HB THR 118 10.910 11.131 14.934 762 HG1 THR 118 1HG THR 118 10.185 12.541 13.425 763 HG21 THR 118 3HG2 THR 118 13.449 11.100 14.640 764 HG22 THR 118 1HG2 THR 118 12.706 12.690 14.562 765 HG23 THR 118 2HG2 THR 118 13.212 11.873 13.072 766 H ASN 119 H ASN 119 10.186 8.102 11.978 767 HA ASN 119 HA ASN 119 8.088 7.430 14.007 768 HB3 ASN 119 2HB ASN 119 6.563 7.665 11.867 769 HD21 ASN 119 1HD2 ASN 119 5.328 7.927 13.913 770 HD22 ASN 119 2HD2 ASN 119 5.133 9.549 14.506 771 H HIS 120 H HIS 120 9.006 5.415 14.271 772 HA HIS 120 HA HIS 120 8.656 3.511 12.028 773 HB3 HIS 120 2HB HIS 120 9.911 3.146 14.749 774 HD1 HIS 120 1HD HIS 120 10.303 0.650 15.461 775 HD2 HIS 120 2HD HIS 120 8.782 1.161 11.551 776 HE1 HIS 120 1HE HIS 120 9.568 -1.656 14.643 777 H LYS 121 H LYS 121 7.914 3.204 15.503 778 HA LYS 121 HA LYS 121 5.892 1.449 15.315 779 HB3 LYS 121 2HB LYS 121 5.023 2.687 17.536 780 HG3 LYS 121 2HG LYS 121 7.460 2.071 18.555 781 HD3 LYS 121 2HD LYS 121 5.327 0.961 19.113 782 HE3 LYS 121 2HE LYS 121 5.946 -1.065 16.928 783 HZ1 LYS 121 3HZ LYS 121 3.444 -0.461 18.365 784 HZ2 LYS 121 1HZ LYS 121 4.497 -1.666 18.841 785 HZ3 LYS 121 2HZ LYS 121 3.705 -1.728 17.383 786 H ALA 122 H ALA 122 5.225 4.974 15.155 787 HA ALA 122 HA ALA 122 2.417 4.800 15.143 788 HB1 ALA 122 1HB ALA 122 3.773 6.914 15.319 789 HB2 ALA 122 2HB ALA 122 4.109 6.767 13.560 790 HB3 ALA 122 3HB ALA 122 2.443 7.008 14.136 791 H TYR 123 H TYR 123 4.654 4.177 12.418 792 HA TYR 123 HA TYR 123 2.739 4.647 10.356 793 HB3 TYR 123 2HB TYR 123 5.291 3.056 10.371 794 HD1 TYR 123 2HD TYR 123 4.418 1.383 8.643 795 HD2 TYR 123 1HD TYR 123 4.396 5.640 7.932 796 HE1 TYR 123 2HE TYR 123 4.244 0.991 6.191 797 HE2 TYR 123 1HE TYR 123 4.386 5.239 5.495 798 HH TYR 123 HH TYR 123 4.998 3.507 3.875 799 H VAL 124 H VAL 124 4.048 1.659 11.884 800 HA VAL 124 HA VAL 124 2.556 -0.274 10.536 801 HB VAL 124 HB VAL 124 3.296 -0.230 13.505 802 HG11 VAL 124 1HG1 VAL 124 2.700 -2.539 11.612 803 HG12 VAL 124 2HG1 VAL 124 3.349 -2.707 13.257 804 HG13 VAL 124 3HG1 VAL 124 1.746 -2.017 13.016 805 HG21 VAL 124 3HG2 VAL 124 5.333 0.162 12.280 806 HG22 VAL 124 1HG2 VAL 124 5.332 -1.530 12.772 807 HG23 VAL 124 2HG2 VAL 124 4.934 -1.100 11.088 808 H SER 125 H SER 125 1.628 1.716 13.349 809 HA SER 125 HA SER 125 -0.906 0.439 13.687 810 HB3 SER 125 2HB SER 125 -0.356 3.215 14.674 811 HG SER 125 HG SER 125 -2.093 2.116 15.608 812 H HIS 126 H HIS 126 0.140 3.222 11.683 813 HA HIS 126 HA HIS 126 -2.593 4.094 11.109 814 HB3 HIS 126 2HB HIS 126 -0.321 5.285 10.399 815 HD1 HIS 126 1HD HIS 126 -2.255 4.114 7.269 816 HD2 HIS 126 2HD HIS 126 1.641 4.789 8.677 817 HE1 HIS 126 1HE HIS 126 -0.725 3.867 5.253 818 H PHE 127 H PHE 127 -0.220 1.850 9.608 819 HA PHE 127 HA PHE 127 -1.796 1.470 7.346 820 HB3 PHE 127 2HB PHE 127 0.354 -0.437 8.357 821 HD1 PHE 127 2HD PHE 127 -0.909 1.432 5.356 822 HD2 PHE 127 1HD PHE 127 0.269 -2.368 6.961 823 HE1 PHE 127 2HE PHE 127 -1.312 0.385 3.148 824 HE2 PHE 127 1HE PHE 127 -0.117 -3.427 4.737 825 HZ PHE 127 HZ PHE 127 -0.945 -2.071 2.855 826 H ASN 128 H ASN 128 -1.521 -0.550 10.220 827 HA ASN 128 HA ASN 128 -3.194 -2.703 9.569 828 HB3 ASN 128 2HB ASN 128 -3.943 -2.347 12.096 829 HD21 ASN 128 1HD2 ASN 128 -0.429 -1.986 11.925 830 HD22 ASN 128 2HD2 ASN 128 -0.123 -3.719 12.029 831 H GLU 129 H GLU 129 -4.205 0.577 10.730 832 HA GLU 129 HA GLU 129 -6.998 -0.177 10.507 833 HB3 GLU 129 2HB GLU 129 -7.311 2.338 10.933 834 HG3 GLU 129 2HG GLU 129 -6.747 2.236 13.237 835 H TRP 130 H TRP 130 -4.675 1.576 8.375 836 HA TRP 130 HA TRP 130 -6.914 2.481 6.698 837 HB3 TRP 130 2HB TRP 130 -5.058 3.530 5.417 838 HD1 TRP 130 HD TRP 130 -6.476 3.871 8.842 839 HE1 TRP 130 1HE TRP 130 -6.217 6.252 9.675 840 HE3 TRP 130 3HE TRP 130 -3.023 5.580 5.445 841 HZ2 TRP 130 2HZ TRP 130 -4.685 8.639 9.003 842 HZ3 TRP 130 3HZ TRP 130 -2.129 7.877 5.642 843 HH2 TRP 130 HH TRP 130 -3.037 9.443 7.382 844 H ALA 131 H ALA 131 -5.257 -0.442 7.007 845 HA ALA 131 HA ALA 131 -6.069 -1.253 4.263 846 HB1 ALA 131 1HB ALA 131 -4.116 -2.607 6.162 847 HB2 ALA 131 2HB ALA 131 -4.489 -3.083 4.490 848 HB3 ALA 131 3HB ALA 131 -3.637 -1.555 4.809 849 H ASP 132 H ASP 132 -6.981 -1.488 7.566 850 HA ASP 132 HA ASP 132 -8.155 -3.882 7.945 851 HB3 ASP 132 2HB ASP 132 -9.608 -1.259 8.464 852 H GLY 133 H GLY 133 -9.363 -5.154 6.768 853 HA2 GLY 133 1HA GLY 133 -11.526 -5.367 5.524 854 HA3 GLY 133 2HA GLY 133 -10.960 -4.043 4.509 855 H LEU 134 H LEU 134 -8.065 -5.238 4.859 856 HA LEU 134 HA LEU 134 -8.303 -7.470 2.912 857 HB3 LEU 134 2HB LEU 134 -6.294 -6.387 1.782 858 HG LEU 134 HG LEU 134 -8.951 -4.883 1.824 859 HD11 LEU 134 1HD1 LEU 134 -6.578 -4.463 -0.009 860 HD12 LEU 134 2HD1 LEU 134 -7.221 -3.327 1.222 861 HD13 LEU 134 3HD1 LEU 134 -8.209 -3.754 -0.160 862 HD21 LEU 134 3HD2 LEU 134 -9.221 -5.922 -0.397 863 HD22 LEU 134 1HD2 LEU 134 -9.069 -7.134 0.878 864 HD23 LEU 134 2HD2 LEU 134 -7.687 -6.804 -0.190 865 H ASN 135 H ASN 135 -6.725 -8.938 2.927 866 HA ASN 135 HA ASN 135 -5.479 -9.576 5.390 867 HB3 ASN 135 2HB ASN 135 -5.050 -10.729 2.612 868 HD21 ASN 135 1HD2 ASN 135 -3.396 -12.148 2.541 869 HD22 ASN 135 2HD2 ASN 135 -2.669 -12.983 3.887 870 H VAL 136 H VAL 136 -3.886 -8.204 6.161 871 HA VAL 136 HA VAL 136 -1.577 -7.782 4.389 872 HB VAL 136 HB VAL 136 -2.416 -6.314 6.904 873 HG11 VAL 136 1HG1 VAL 136 0.048 -6.442 6.861 874 HG12 VAL 136 2HG1 VAL 136 0.063 -5.885 5.171 875 HG13 VAL 136 3HG1 VAL 136 -0.500 -4.818 6.481 876 HG21 VAL 136 3HG2 VAL 136 -2.584 -4.379 5.369 877 HG22 VAL 136 1HG2 VAL 136 -2.198 -5.434 3.986 878 HG23 VAL 136 2HG2 VAL 136 -3.697 -5.671 4.900 879 H ILE 137 H ILE 137 0.097 -9.180 4.603 880 HA ILE 137 HA ILE 137 0.452 -10.519 7.227 881 HB ILE 137 HB ILE 137 1.234 -12.398 6.203 882 HG13 ILE 137 2HG1 ILE 137 1.558 -12.771 3.812 883 HG21 ILE 137 1HG2 ILE 137 -1.086 -11.479 4.502 884 HG22 ILE 137 2HG2 ILE 137 -0.606 -13.153 4.839 885 HG23 ILE 137 3HG2 ILE 137 -1.198 -12.121 6.152 886 HD11 ILE 137 3HD1 ILE 137 2.027 -11.044 2.252 887 HD12 ILE 137 1HD1 ILE 137 0.401 -10.711 2.887 888 HD13 ILE 137 2HD1 ILE 137 1.813 -9.795 3.483 889 H GLY 138 H GLY 138 1.846 -7.884 5.780 890 HA2 GLY 138 1HA GLY 138 3.612 -7.932 7.955 891 HA3 GLY 138 2HA GLY 138 4.582 -8.248 6.519 892 H VAL 139 H VAL 139 4.958 -6.040 8.181 893 HA VAL 139 HA VAL 139 4.661 -3.846 6.266 894 HB VAL 139 HB VAL 139 4.072 -3.405 9.222 895 HG11 VAL 139 1HG1 VAL 139 3.541 -1.715 6.736 896 HG12 VAL 139 2HG1 VAL 139 3.163 -1.258 8.411 897 HG13 VAL 139 3HG1 VAL 139 4.853 -1.449 7.913 898 HG21 VAL 139 3HG2 VAL 139 2.011 -3.812 7.042 899 HG22 VAL 139 1HG2 VAL 139 2.219 -4.788 8.505 900 HG23 VAL 139 2HG2 VAL 139 1.684 -3.125 8.645 901 H ALA 140 H ALA 140 6.906 -3.683 5.851 902 HA ALA 140 HA ALA 140 8.766 -3.587 8.168 903 HB1 ALA 140 1HB ALA 140 9.132 -5.496 5.823 904 HB2 ALA 140 2HB ALA 140 10.179 -5.314 7.242 905 HB3 ALA 140 3HB ALA 140 8.546 -5.971 7.434 906 H ARG 141 H ARG 141 11.260 -3.456 6.809 907 HA ARG 141 HA ARG 141 10.862 -1.411 4.760 908 HB3 ARG 141 2HB ARG 141 11.415 -0.255 6.855 909 HG3 ARG 141 2HG ARG 141 13.940 -1.982 6.863 910 HD3 ARG 141 2HD ARG 141 13.168 0.516 8.415 911 HE ARG 141 HE ARG 141 14.396 -0.491 10.013 912 HH11 ARG 141 1HH1 ARG 141 16.175 -0.974 6.857 913 HH12 ARG 141 2HH1 ARG 141 17.555 -1.593 7.711 914 HH21 ARG 141 1HH2 ARG 141 16.372 -1.411 10.950 915 HH22 ARG 141 2HH2 ARG 141 17.677 -1.838 9.858 916 H ASP 142 H ASP 142 12.717 -1.125 3.560 917 HA ASP 142 HA ASP 142 14.135 -1.867 1.959 918 HB3 ASP 142 2HB ASP 142 16.212 -2.983 2.801 919 H ASP 143 H ASP 143 15.544 -4.359 1.670 920 HA ASP 143 HA ASP 143 13.400 -5.926 0.498 921 HB3 ASP 143 2HB ASP 143 14.864 -5.867 -1.145 922 H SER 144 H SER 144 14.328 -5.859 3.524 923 HA SER 144 HA SER 144 15.645 -8.314 3.986 924 HB3 SER 144 2HB SER 144 14.210 -6.856 6.196 925 HG SER 144 HG SER 144 16.246 -7.090 7.155 926 H GLU 145 H GLU 145 12.196 -7.809 3.642 927 HA GLU 145 HA GLU 145 11.714 -10.422 5.012 928 HB3 GLU 145 2HB GLU 145 9.708 -9.761 5.934 929 HG3 GLU 145 2HG GLU 145 11.375 -7.294 6.468 930 H VAL 146 H VAL 146 11.942 -9.379 1.989 931 HA VAL 146 HA VAL 146 9.391 -9.804 0.854 932 HB VAL 146 HB VAL 146 12.153 -10.283 -0.352 933 HG11 VAL 146 1HG1 VAL 146 10.428 -11.264 -1.800 934 HG12 VAL 146 2HG1 VAL 146 9.455 -9.780 -1.693 935 HG13 VAL 146 3HG1 VAL 146 11.023 -9.780 -2.530 936 HG21 VAL 146 3HG2 VAL 146 11.863 -7.967 0.568 937 HG22 VAL 146 1HG2 VAL 146 12.003 -8.002 -1.179 938 HG23 VAL 146 2HG2 VAL 146 10.400 -7.783 -0.433 939 H ASP 147 H ASP 147 11.798 -12.149 1.871 940 HA ASP 147 HA ASP 147 10.935 -14.508 0.681 941 HB3 ASP 147 2HB ASP 147 11.841 -14.081 3.555 942 H LYS 148 H LYS 148 9.655 -13.108 3.751 943 HA LYS 148 HA LYS 148 7.864 -15.322 4.138 944 HB3 LYS 148 2HB LYS 148 8.418 -14.150 6.119 945 HG3 LYS 148 2HG LYS 148 7.572 -11.701 4.612 946 HD3 LYS 148 2HD LYS 148 6.187 -11.629 6.703 947 HE3 LYS 148 2HE LYS 148 7.408 -10.724 8.691 948 HZ1 LYS 148 3HZ LYS 148 6.797 -13.189 8.518 949 HZ2 LYS 148 1HZ LYS 148 7.861 -12.708 9.665 950 HZ3 LYS 148 2HZ LYS 148 8.434 -13.436 8.318 951 H TRP 149 H TRP 149 7.608 -12.457 2.135 952 HA TRP 149 HA TRP 149 4.688 -12.832 1.849 953 HB3 TRP 149 2HB TRP 149 4.637 -10.761 0.792 954 HD1 TRP 149 HD TRP 149 4.720 -11.288 3.882 955 HE1 TRP 149 1HE TRP 149 5.543 -9.486 5.493 956 HE3 TRP 149 3HE TRP 149 7.473 -8.505 0.632 957 HZ2 TRP 149 2HZ TRP 149 6.974 -6.954 5.334 958 HZ3 TRP 149 3HZ TRP 149 8.458 -6.353 1.334 959 HH2 TRP 149 HH TRP 149 8.219 -5.555 3.671 960 H SER 150 H SER 150 7.304 -14.403 0.520 961 HA SER 150 HA SER 150 5.929 -14.661 -2.113 962 HB3 SER 150 2HB SER 150 8.902 -14.097 -1.808 963 HG SER 150 HG SER 150 7.064 -13.802 -3.983 964 H LYS 151 H LYS 151 7.575 -16.170 0.488 965 HA LYS 151 HA LYS 151 8.766 -18.357 -0.696 966 HB3 LYS 151 2HB LYS 151 9.214 -17.941 1.530 967 HG3 LYS 151 2HG LYS 151 7.041 -16.790 2.207 968 HD3 LYS 151 2HD LYS 151 6.184 -19.618 2.897 969 HE3 LYS 151 2HE LYS 151 4.228 -18.531 3.873 970 HZ1 LYS 151 3HZ LYS 151 6.359 -18.660 5.217 971 HZ2 LYS 151 1HZ LYS 151 5.202 -17.645 5.780 972 HZ3 LYS 151 2HZ LYS 151 6.507 -17.046 4.977 Start of MODEL 8 1 H1 GLY 1 H GLY 1 -4.113 -26.785 -12.347 2 HA2 GLY 1 1HA GLY 1 -2.804 -24.525 -13.754 3 HA3 GLY 1 2HA GLY 1 -4.556 -24.664 -13.487 4 H MET 2 H MET 2 -1.547 -23.606 -12.150 5 HA MET 2 HA MET 2 -2.883 -22.260 -9.997 6 HB3 MET 2 2HB MET 2 -0.713 -24.312 -9.365 7 HG3 MET 2 2HG MET 2 -1.191 -23.595 -6.974 8 HE1 MET 2 3HE MET 2 2.566 -22.937 -7.862 9 HE2 MET 2 1HE MET 2 1.391 -24.061 -7.146 10 HE3 MET 2 2HE MET 2 1.432 -23.801 -8.909 11 H ALA 3 H ALA 3 -1.978 -20.213 -10.166 12 HA ALA 3 HA ALA 3 0.885 -19.945 -10.414 13 HB1 ALA 3 1HB ALA 3 0.376 -19.837 -12.793 14 HB2 ALA 3 2HB ALA 3 -0.940 -18.670 -12.504 15 HB3 ALA 3 3HB ALA 3 0.746 -18.210 -12.182 16 H LYS 4 H LYS 4 1.073 -18.850 -8.538 17 HA LYS 4 HA LYS 4 -0.765 -16.671 -7.764 18 HB3 LYS 4 2HB LYS 4 0.784 -16.515 -5.844 19 HG3 LYS 4 2HG LYS 4 -0.042 -19.452 -6.180 20 HD3 LYS 4 2HD LYS 4 -0.469 -19.071 -3.684 21 HE3 LYS 4 2HE LYS 4 2.420 -18.821 -4.679 22 HZ1 LYS 4 3HZ LYS 4 2.890 -19.746 -2.418 23 HZ2 LYS 4 1HZ LYS 4 1.364 -19.368 -1.977 24 HZ3 LYS 4 2HZ LYS 4 2.433 -18.194 -2.400 25 H LYS 5 H LYS 5 -0.206 -14.615 -8.598 26 HA LYS 5 HA LYS 5 2.683 -14.196 -9.289 27 HB3 LYS 5 2HB LYS 5 1.908 -12.459 -10.786 28 HG3 LYS 5 2HG LYS 5 0.388 -15.032 -11.127 29 HD3 LYS 5 2HD LYS 5 1.533 -13.012 -13.026 30 HE3 LYS 5 2HE LYS 5 -0.067 -15.306 -14.074 31 HZ1 LYS 5 3HZ LYS 5 2.634 -14.289 -14.739 32 HZ2 LYS 5 1HZ LYS 5 1.235 -13.873 -15.532 33 HZ3 LYS 5 2HZ LYS 5 1.836 -15.403 -15.627 34 H THR 6 H THR 6 3.256 -11.966 -9.191 35 HA THR 6 HA THR 6 2.388 -10.756 -6.587 36 HB THR 6 HB THR 6 5.253 -11.180 -7.468 37 HG1 THR 6 1HG THR 6 4.121 -13.016 -6.537 38 HG21 THR 6 3HG2 THR 6 5.213 -9.090 -6.228 39 HG22 THR 6 1HG2 THR 6 5.788 -10.340 -5.128 40 HG23 THR 6 2HG2 THR 6 4.118 -9.779 -5.013 41 H LEU 7 H LEU 7 2.781 -8.416 -6.404 42 HA LEU 7 HA LEU 7 3.371 -6.987 -8.914 43 HB3 LEU 7 2HB LEU 7 1.170 -5.918 -7.191 44 HG LEU 7 HG LEU 7 0.985 -6.462 -10.160 45 HD11 LEU 7 1HD1 LEU 7 -1.005 -5.714 -8.792 46 HD12 LEU 7 2HD1 LEU 7 -0.583 -4.588 -10.093 47 HD13 LEU 7 3HD1 LEU 7 -0.134 -4.225 -8.411 48 HD21 LEU 7 3HD2 LEU 7 3.048 -5.207 -10.069 49 HD22 LEU 7 1HD2 LEU 7 2.299 -3.982 -8.984 50 HD23 LEU 7 2HD2 LEU 7 1.748 -4.207 -10.650 51 H ILE 8 H ILE 8 4.279 -4.900 -8.475 52 HA ILE 8 HA ILE 8 4.867 -4.146 -5.656 53 HB ILE 8 HB ILE 8 6.675 -4.032 -8.095 54 HG13 ILE 8 2HG1 ILE 8 6.278 -6.375 -6.902 55 HG21 ILE 8 1HG2 ILE 8 8.455 -3.326 -6.519 56 HG22 ILE 8 2HG2 ILE 8 7.132 -2.164 -6.559 57 HG23 ILE 8 3HG2 ILE 8 7.272 -3.313 -5.199 58 HD11 ILE 8 3HD1 ILE 8 9.094 -5.354 -7.320 59 HD12 ILE 8 1HD1 ILE 8 8.510 -7.032 -7.388 60 HD13 ILE 8 2HD1 ILE 8 7.976 -5.864 -8.614 61 H LEU 9 H LEU 9 3.535 -2.372 -5.370 62 HA LEU 9 HA LEU 9 3.350 -0.299 -7.484 63 HB3 LEU 9 2HB LEU 9 1.513 0.398 -5.690 64 HG LEU 9 HG LEU 9 1.549 -1.670 -7.884 65 HD11 LEU 9 1HD1 LEU 9 -0.880 -1.278 -6.137 66 HD12 LEU 9 2HD1 LEU 9 0.094 -2.749 -6.245 67 HD13 LEU 9 3HD1 LEU 9 -0.814 -2.161 -7.660 68 HD21 LEU 9 3HD2 LEU 9 -0.000 0.890 -7.309 69 HD22 LEU 9 1HD2 LEU 9 -0.146 -0.058 -8.784 70 HD23 LEU 9 2HD2 LEU 9 1.412 0.710 -8.375 71 H TYR 10 H TYR 10 4.527 1.538 -7.253 72 HA TYR 10 HA TYR 10 5.530 2.208 -4.536 73 HB3 TYR 10 2HB TYR 10 7.132 0.774 -5.645 74 HD1 TYR 10 2HD TYR 10 6.201 0.166 -8.078 75 HD2 TYR 10 1HD TYR 10 8.777 3.517 -7.196 76 HE1 TYR 10 2HE TYR 10 6.877 0.251 -10.433 77 HE2 TYR 10 1HE TYR 10 9.486 3.578 -9.574 78 HH TYR 10 HH TYR 10 8.106 1.531 -12.094 79 H TYR 11 H TYR 11 4.086 3.844 -4.313 80 HA TYR 11 HA TYR 11 3.810 5.972 -6.167 81 HB3 TYR 11 2HB TYR 11 2.838 5.438 -3.506 82 HD1 TYR 11 1HD TYR 11 1.713 8.277 -5.464 83 HD2 TYR 11 2HD TYR 11 4.313 7.404 -2.131 84 HE1 TYR 11 1HE TYR 11 2.188 10.675 -5.220 85 HE2 TYR 11 2HE TYR 11 4.692 9.846 -1.808 86 HH TYR 11 HH TYR 11 3.494 12.263 -4.195 87 H SER 12 H SER 12 4.987 8.071 -6.092 88 HA SER 12 HA SER 12 6.405 9.010 -3.931 89 HB3 SER 12 2HB SER 12 8.659 9.290 -5.323 90 HG SER 12 HG SER 12 7.805 7.007 -3.905 91 H TRP 13 H TRP 13 7.477 11.122 -4.630 92 HA TRP 13 HA TRP 13 5.770 12.594 -6.422 93 HB3 TRP 13 2HB TRP 13 8.421 13.701 -5.517 94 HD1 TRP 13 HD TRP 13 5.267 14.764 -3.812 95 HE1 TRP 13 1HE TRP 13 4.386 16.911 -4.717 96 HE3 TRP 13 3HE TRP 13 8.422 15.220 -7.817 97 HZ2 TRP 13 2HZ TRP 13 4.793 18.561 -7.171 98 HZ3 TRP 13 3HZ TRP 13 8.150 17.101 -9.413 99 HH2 TRP 13 HH TRP 13 6.338 18.722 -9.135 100 H SER 14 H SER 14 9.373 12.528 -6.725 101 HA SER 14 HA SER 14 9.095 11.317 -9.416 102 HB3 SER 14 2HB SER 14 10.609 13.008 -10.358 103 HG SER 14 HG SER 14 9.000 14.636 -10.498 104 H GLY 15 H GLY 15 10.007 9.447 -8.849 105 HA2 GLY 15 1HA GLY 15 11.835 8.083 -9.111 106 HA3 GLY 15 2HA GLY 15 12.840 9.528 -9.214 107 H GLU 16 H GLU 16 10.872 8.582 -6.361 108 HA GLU 16 HA GLU 16 13.377 8.463 -4.766 109 HB3 GLU 16 2HB GLU 16 11.258 8.344 -2.986 110 HG3 GLU 16 2HG GLU 16 11.523 10.863 -2.864 111 H THR 17 H THR 17 10.245 6.620 -4.488 112 HA THR 17 HA THR 17 11.451 4.304 -3.409 113 HB THR 17 HB THR 17 9.248 3.236 -4.125 114 HG1 THR 17 1HG THR 17 7.723 5.063 -4.702 115 HG21 THR 17 3HG2 THR 17 7.832 4.568 -2.596 116 HG22 THR 17 1HG2 THR 17 9.111 5.800 -2.493 117 HG23 THR 17 2HG2 THR 17 9.392 4.163 -1.924 118 H LYS 18 H LYS 18 11.575 5.416 -6.602 119 HA LYS 18 HA LYS 18 11.203 3.341 -8.309 120 HB3 LYS 18 2HB LYS 18 13.488 5.367 -8.306 121 HG3 LYS 18 2HG LYS 18 13.779 3.571 -10.111 122 HD3 LYS 18 2HD LYS 18 11.221 4.920 -11.081 123 HE3 LYS 18 2HE LYS 18 11.508 3.788 -13.218 124 HZ1 LYS 18 3HZ LYS 18 12.580 6.032 -12.849 125 HZ2 LYS 18 1HZ LYS 18 13.199 5.156 -14.115 126 HZ3 LYS 18 2HZ LYS 18 14.018 5.259 -12.719 127 H LYS 19 H LYS 19 14.418 3.957 -6.849 128 HA LYS 19 HA LYS 19 15.628 1.660 -7.837 129 HB3 LYS 19 2HB LYS 19 16.751 3.631 -6.727 130 HG3 LYS 19 2HG LYS 19 16.119 2.198 -4.121 131 HD3 LYS 19 2HD LYS 19 18.303 3.540 -4.383 132 HE3 LYS 19 2HE LYS 19 17.218 5.619 -5.360 133 HZ1 LYS 19 3HZ LYS 19 15.199 5.797 -4.057 134 HZ2 LYS 19 1HZ LYS 19 16.164 7.053 -3.633 135 HZ3 LYS 19 2HZ LYS 19 16.061 5.774 -2.636 136 H MET 20 H MET 20 13.565 1.955 -4.985 137 HA MET 20 HA MET 20 14.227 -0.690 -3.949 138 HB3 MET 20 2HB MET 20 12.331 -0.002 -2.297 139 HG3 MET 20 2HG MET 20 13.742 2.321 -1.743 140 HE1 MET 20 3HE MET 20 15.217 -1.798 -0.278 141 HE2 MET 20 1HE MET 20 14.162 -1.664 -1.703 142 HE3 MET 20 2HE MET 20 15.780 -0.928 -1.718 143 H ALA 21 H ALA 21 12.345 0.241 -6.575 144 HA ALA 21 HA ALA 21 10.474 -2.053 -6.129 145 HB1 ALA 21 1HB ALA 21 9.395 0.061 -6.757 146 HB2 ALA 21 2HB ALA 21 10.396 0.162 -8.221 147 HB3 ALA 21 3HB ALA 21 9.226 -1.163 -8.034 148 H GLU 22 H GLU 22 13.026 -0.714 -8.259 149 HA GLU 22 HA GLU 22 12.654 -2.718 -10.259 150 HB3 GLU 22 2HB GLU 22 14.664 -1.809 -11.284 151 HG3 GLU 22 2HG GLU 22 13.578 0.704 -10.114 152 H LYS 23 H LYS 23 14.532 -2.810 -7.260 153 HA LYS 23 HA LYS 23 16.309 -4.950 -8.124 154 HB3 LYS 23 2HB LYS 23 16.034 -5.123 -5.347 155 HG3 LYS 23 2HG LYS 23 18.174 -4.672 -6.929 156 HD3 LYS 23 2HD LYS 23 19.171 -2.661 -5.870 157 HE3 LYS 23 2HE LYS 23 16.697 -1.939 -7.504 158 HZ1 LYS 23 3HZ LYS 23 19.235 -0.535 -7.072 159 HZ2 LYS 23 1HZ LYS 23 17.786 -0.090 -6.441 160 HZ3 LYS 23 2HZ LYS 23 18.045 -0.062 -8.114 161 H ILE 24 H ILE 24 13.625 -4.907 -5.808 162 HA ILE 24 HA ILE 24 13.159 -7.545 -5.361 163 HB ILE 24 HB ILE 24 11.214 -5.231 -5.462 164 HG13 ILE 24 2HG1 ILE 24 13.254 -5.294 -3.804 165 HG21 ILE 24 1HG2 ILE 24 9.755 -6.603 -3.938 166 HG22 ILE 24 2HG2 ILE 24 9.876 -7.301 -5.550 167 HG23 ILE 24 3HG2 ILE 24 10.824 -7.995 -4.234 168 HD11 ILE 24 3HD1 ILE 24 10.675 -5.208 -2.277 169 HD12 ILE 24 1HD1 ILE 24 12.048 -4.093 -2.219 170 HD13 ILE 24 2HD1 ILE 24 10.925 -4.020 -3.571 171 H ASN 25 H ASN 25 11.793 -5.572 -8.037 172 HA ASN 25 HA ASN 25 10.012 -7.473 -9.104 173 HB3 ASN 25 2HB ASN 25 11.595 -5.231 -10.401 174 HD21 ASN 25 1HD2 ASN 25 8.666 -7.347 -10.891 175 HD22 ASN 25 2HD2 ASN 25 8.893 -7.396 -12.615 176 H SER 26 H SER 26 13.503 -7.350 -9.487 177 HA SER 26 HA SER 26 13.546 -9.454 -11.537 178 HB3 SER 26 2HB SER 26 15.846 -8.384 -9.854 179 HG SER 26 HG SER 26 15.945 -8.994 -12.603 180 H GLU 27 H GLU 27 13.585 -9.327 -7.944 181 HA GLU 27 HA GLU 27 14.869 -11.953 -7.801 182 HB3 GLU 27 2HB GLU 27 15.942 -10.757 -6.247 183 HG3 GLU 27 2HG GLU 27 13.439 -9.513 -5.225 184 H ILE 28 H ILE 28 11.720 -10.685 -7.940 185 HA ILE 28 HA ILE 28 10.587 -13.182 -6.776 186 HB ILE 28 HB ILE 28 9.133 -10.636 -7.487 187 HG13 ILE 28 2HG1 ILE 28 10.630 -10.241 -5.560 188 HG21 ILE 28 1HG2 ILE 28 8.276 -13.144 -5.948 189 HG22 ILE 28 2HG2 ILE 28 7.258 -11.740 -6.297 190 HG23 ILE 28 3HG2 ILE 28 7.781 -12.776 -7.605 191 HD11 ILE 28 3HD1 ILE 28 7.934 -10.792 -4.320 192 HD12 ILE 28 1HD1 ILE 28 9.098 -9.534 -3.921 193 HD13 ILE 28 2HD1 ILE 28 8.198 -9.422 -5.438 194 H LYS 29 H LYS 29 10.091 -14.700 -8.061 195 HA LYS 29 HA LYS 29 10.074 -14.338 -10.924 196 HB3 LYS 29 2HB LYS 29 8.904 -16.799 -9.593 197 HG3 LYS 29 2HG LYS 29 9.146 -16.765 -12.082 198 HD3 LYS 29 2HD LYS 29 11.968 -16.032 -11.288 199 HE3 LYS 29 2HE LYS 29 12.853 -16.708 -13.441 200 HZ1 LYS 29 3HZ LYS 29 13.304 -18.832 -12.854 201 HZ2 LYS 29 1HZ LYS 29 11.794 -19.187 -12.281 202 HZ3 LYS 29 2HZ LYS 29 12.811 -18.232 -11.417 203 H ASP 30 H ASP 30 8.379 -14.139 -12.272 204 HA ASP 30 HA ASP 30 6.371 -13.592 -13.047 205 HB3 ASP 30 2HB ASP 30 4.970 -15.304 -11.007 206 H SER 31 H SER 31 7.537 -11.829 -11.071 207 HA SER 31 HA SER 31 5.214 -10.611 -9.778 208 HB3 SER 31 2HB SER 31 8.090 -9.640 -9.935 209 HG SER 31 HG SER 31 7.488 -8.946 -7.787 210 H GLU 32 H GLU 32 5.239 -8.119 -10.086 211 HA GLU 32 HA GLU 32 6.071 -7.082 -12.681 212 HB3 GLU 32 2HB GLU 32 3.579 -5.910 -12.526 213 HG3 GLU 32 2HG GLU 32 4.167 -8.557 -13.862 214 H LEU 33 H LEU 33 5.821 -4.588 -12.626 215 HA LEU 33 HA LEU 33 5.432 -3.541 -9.970 216 HB3 LEU 33 2HB LEU 33 7.866 -3.696 -10.546 217 HG LEU 33 HG LEU 33 7.244 -1.368 -12.428 218 HD11 LEU 33 1HD1 LEU 33 9.687 -1.190 -12.619 219 HD12 LEU 33 2HD1 LEU 33 9.900 -2.563 -11.511 220 HD13 LEU 33 3HD1 LEU 33 9.191 -1.038 -10.929 221 HD21 LEU 33 3HD2 LEU 33 8.538 -2.694 -14.136 222 HD22 LEU 33 1HD2 LEU 33 6.982 -3.408 -13.744 223 HD23 LEU 33 2HD2 LEU 33 8.463 -4.099 -13.048 224 H LYS 34 H LYS 34 4.400 -1.463 -9.990 225 HA LYS 34 HA LYS 34 3.117 -0.591 -12.539 226 HB3 LYS 34 2HB LYS 34 1.209 -0.362 -10.505 227 HG3 LYS 34 2HG LYS 34 0.550 -0.895 -12.702 228 HD3 LYS 34 2HD LYS 34 0.670 -3.747 -12.751 229 HE3 LYS 34 2HE LYS 34 1.697 -1.499 -14.471 230 HZ1 LYS 34 3HZ LYS 34 2.290 -3.270 -16.068 231 HZ2 LYS 34 1HZ LYS 34 2.143 -4.398 -14.914 232 HZ3 LYS 34 2HZ LYS 34 3.293 -3.239 -14.759 233 H GLU 35 H GLU 35 2.155 1.495 -12.396 234 HA GLU 35 HA GLU 35 3.558 3.283 -10.492 235 HB3 GLU 35 2HB GLU 35 3.015 5.043 -12.208 236 HG3 GLU 35 2HG GLU 35 4.713 2.751 -13.255 237 H VAL 36 H VAL 36 2.386 3.827 -8.845 238 HA VAL 36 HA VAL 36 -0.328 4.884 -8.999 239 HB VAL 36 HB VAL 36 0.173 3.697 -6.885 240 HG11 VAL 36 1HG1 VAL 36 2.859 4.661 -7.165 241 HG12 VAL 36 2HG1 VAL 36 2.095 4.070 -5.604 242 HG13 VAL 36 3HG1 VAL 36 2.220 3.070 -6.998 243 HG21 VAL 36 3HG2 VAL 36 -0.029 5.382 -5.245 244 HG22 VAL 36 1HG2 VAL 36 0.624 6.593 -6.372 245 HG23 VAL 36 2HG2 VAL 36 -0.965 5.853 -6.644 246 H LYS 37 H LYS 37 -0.624 7.130 -9.272 247 HA LYS 37 HA LYS 37 1.520 8.938 -8.488 248 HB3 LYS 37 2HB LYS 37 2.049 8.855 -10.727 249 HG3 LYS 37 2HG LYS 37 -0.757 9.307 -11.777 250 HD3 LYS 37 2HD LYS 37 1.798 8.123 -12.946 251 HE3 LYS 37 2HE LYS 37 -0.795 8.898 -14.341 252 HZ1 LYS 37 3HZ LYS 37 1.330 8.826 -15.626 253 HZ2 LYS 37 1HZ LYS 37 0.171 7.798 -16.174 254 HZ3 LYS 37 2HZ LYS 37 1.423 7.216 -15.304 255 H VAL 38 H VAL 38 0.298 11.320 -8.701 256 HA VAL 38 HA VAL 38 -2.396 10.907 -7.465 257 HB VAL 38 HB VAL 38 -1.980 12.970 -6.159 258 HG11 VAL 38 1HG1 VAL 38 -0.623 11.846 -4.437 259 HG12 VAL 38 2HG1 VAL 38 -1.838 10.765 -5.143 260 HG13 VAL 38 3HG1 VAL 38 -0.138 10.612 -5.619 261 HG21 VAL 38 3HG2 VAL 38 0.957 12.580 -6.843 262 HG22 VAL 38 1HG2 VAL 38 -0.062 13.872 -7.516 263 HG23 VAL 38 2HG2 VAL 38 0.251 13.798 -5.773 264 H SER 39 H SER 39 -3.721 13.076 -7.569 265 HA SER 39 HA SER 39 -3.785 13.910 -10.402 266 HB3 SER 39 2HB SER 39 -5.880 14.937 -8.607 267 HG SER 39 HG SER 39 -6.806 14.790 -10.481 268 H GLU 40 H GLU 40 -4.500 16.259 -10.561 269 HA GLU 40 HA GLU 40 -2.573 18.060 -9.288 270 HB3 GLU 40 2HB GLU 40 -3.135 18.245 -11.655 271 HG3 GLU 40 2HG GLU 40 -5.859 19.366 -11.047 272 H GLY 41 H GLY 41 -3.921 20.311 -8.735 273 HA2 GLY 41 1HA GLY 41 -6.222 20.807 -7.838 274 HA3 GLY 41 2HA GLY 41 -5.901 19.579 -6.609 275 H THR 42 H THR 42 -3.986 22.360 -7.974 276 HA THR 42 HA THR 42 -3.896 23.633 -5.351 277 HB THR 42 HB THR 42 -2.053 21.984 -5.276 278 HG1 THR 42 1HG THR 42 -1.705 23.906 -4.202 279 HG21 THR 42 3HG2 THR 42 -1.532 21.774 -7.695 280 HG22 THR 42 1HG2 THR 42 -0.098 22.153 -6.757 281 HG23 THR 42 2HG2 THR 42 -0.885 23.430 -7.692 282 H PHE 43 H PHE 43 -3.021 25.907 -5.605 283 HA PHE 43 HA PHE 43 -3.435 26.928 -8.365 284 HB3 PHE 43 2HB PHE 43 -3.046 28.610 -5.873 285 HD1 PHE 43 2HD PHE 43 -1.980 30.323 -7.480 286 HD2 PHE 43 1HD PHE 43 -5.984 28.816 -8.005 287 HE1 PHE 43 2HE PHE 43 -2.523 32.259 -8.914 288 HE2 PHE 43 1HE PHE 43 -6.542 30.773 -9.421 289 HZ PHE 43 HZ PHE 43 -4.828 32.513 -9.865 290 H ASP 44 H ASP 44 -1.422 25.552 -8.749 291 HA ASP 44 HA ASP 44 0.811 27.393 -8.771 292 HB3 ASP 44 2HB ASP 44 1.371 24.496 -8.025 293 H ALA 45 H ALA 45 2.365 26.512 -10.497 294 HA ALA 45 HA ALA 45 0.776 26.670 -12.816 295 HB1 ALA 45 1HB ALA 45 2.874 27.888 -12.462 296 HB2 ALA 45 2HB ALA 45 3.783 26.364 -12.562 297 HB3 ALA 45 3HB ALA 45 2.900 26.952 -13.972 298 H ASP 46 H ASP 46 -0.163 24.443 -12.188 299 HA ASP 46 HA ASP 46 -0.496 22.306 -12.398 300 HB3 ASP 46 2HB ASP 46 0.037 22.654 -15.322 301 H MET 47 H MET 47 1.615 22.387 -11.226 302 HA MET 47 HA MET 47 3.577 20.461 -12.383 303 HB3 MET 47 2HB MET 47 4.376 22.750 -12.514 304 HG3 MET 47 2HG MET 47 4.242 22.887 -9.480 305 HE1 MET 47 3HE MET 47 7.055 23.621 -11.356 306 HE2 MET 47 1HE MET 47 7.459 24.955 -10.248 307 HE3 MET 47 2HE MET 47 6.797 23.451 -9.606 308 H TYR 48 H TYR 48 1.200 20.427 -10.266 309 HA TYR 48 HA TYR 48 0.651 19.523 -8.336 310 HB3 TYR 48 2HB TYR 48 1.757 17.448 -7.651 311 HD1 TYR 48 2HD TYR 48 2.854 17.775 -11.209 312 HD2 TYR 48 1HD TYR 48 -0.221 16.354 -8.537 313 HE1 TYR 48 2HE TYR 48 1.725 16.666 -13.103 314 HE2 TYR 48 1HE TYR 48 -1.310 15.192 -10.430 315 HH TYR 48 HH TYR 48 -1.508 15.271 -12.883 316 H LYS 49 H LYS 49 1.158 19.230 -6.007 317 HA LYS 49 HA LYS 49 3.513 20.795 -5.044 318 HB3 LYS 49 2HB LYS 49 1.690 21.772 -3.317 319 HG3 LYS 49 2HG LYS 49 1.255 23.577 -5.355 320 HD3 LYS 49 2HD LYS 49 2.245 24.096 -3.196 321 HE3 LYS 49 2HE LYS 49 3.994 22.208 -3.239 322 HZ1 LYS 49 3HZ LYS 49 5.062 22.799 -5.379 323 HZ2 LYS 49 1HZ LYS 49 6.137 22.897 -4.132 324 HZ3 LYS 49 2HZ LYS 49 5.474 24.247 -4.809 325 H THR 50 H THR 50 0.862 18.583 -4.289 326 HA THR 50 HA THR 50 0.951 18.100 -1.700 327 HB THR 50 HB THR 50 0.735 16.261 -4.108 328 HG1 THR 50 1HG THR 50 -1.380 17.180 -2.492 329 HG21 THR 50 3HG2 THR 50 -0.625 14.686 -2.857 330 HG22 THR 50 1HG2 THR 50 -0.232 15.530 -1.343 331 HG23 THR 50 2HG2 THR 50 1.042 14.711 -2.272 332 H SER 51 H SER 51 2.352 17.318 -0.134 333 HA SER 51 HA SER 51 4.494 15.490 -0.749 334 HB3 SER 51 2HB SER 51 5.573 17.328 -1.705 335 HG SER 51 HG SER 51 5.670 19.370 -0.726 336 H ASP 52 H ASP 52 6.158 15.922 1.319 337 HA ASP 52 HA ASP 52 4.658 14.485 3.269 338 HB3 ASP 52 2HB ASP 52 7.615 15.142 3.424 339 H ILE 53 H ILE 53 3.487 16.714 3.670 340 HA ILE 53 HA ILE 53 4.629 18.887 4.953 341 HB ILE 53 HB ILE 53 1.829 17.738 4.979 342 HG13 ILE 53 2HG1 ILE 53 3.225 18.863 2.905 343 HG21 ILE 53 1HG2 ILE 53 0.981 19.994 5.650 344 HG22 ILE 53 2HG2 ILE 53 1.830 19.153 6.940 345 HG23 ILE 53 3HG2 ILE 53 2.648 20.463 6.055 346 HD11 ILE 53 3HD1 ILE 53 0.261 19.258 3.457 347 HD12 ILE 53 1HD1 ILE 53 1.083 19.461 1.891 348 HD13 ILE 53 2HD1 ILE 53 1.031 17.866 2.660 349 H ALA 54 H ALA 54 3.255 16.050 6.515 350 HA ALA 54 HA ALA 54 3.370 15.089 8.520 351 HB1 ALA 54 1HB ALA 54 5.691 15.732 8.929 352 HB2 ALA 54 2HB ALA 54 5.158 17.318 9.520 353 HB3 ALA 54 3HB ALA 54 4.702 15.870 10.402 354 H LEU 55 H LEU 55 1.706 15.120 9.979 355 HA LEU 55 HA LEU 55 -0.305 15.575 10.515 356 HB3 LEU 55 2HB LEU 55 -0.280 17.816 11.896 357 HG LEU 55 HG LEU 55 0.737 15.017 12.405 358 HD11 LEU 55 1HD1 LEU 55 0.775 15.492 14.755 359 HD12 LEU 55 2HD1 LEU 55 0.428 17.217 14.410 360 HD13 LEU 55 3HD1 LEU 55 1.938 16.470 13.836 361 HD21 LEU 55 3HD2 LEU 55 -1.765 15.328 12.068 362 HD22 LEU 55 1HD2 LEU 55 -1.757 16.356 13.506 363 HD23 LEU 55 2HD2 LEU 55 -1.292 14.648 13.632 364 H ASP 56 H ASP 56 -1.869 17.783 10.800 365 HA ASP 56 HA ASP 56 -3.503 18.829 9.832 366 HB3 ASP 56 2HB ASP 56 -2.467 20.869 8.440 367 H GLN 57 H GLN 57 -2.264 16.702 7.802 368 HA GLN 57 HA GLN 57 -4.799 17.050 6.269 369 HB3 GLN 57 2HB GLN 57 -3.103 17.474 4.663 370 HG3 GLN 57 2HG GLN 57 -1.848 14.776 5.296 371 HE21 GLN 57 1HE2 GLN 57 0.412 14.582 4.214 372 HE22 GLN 57 2HE2 GLN 57 0.662 15.406 2.716 373 H ILE 58 H ILE 58 -3.966 15.734 8.863 374 HA ILE 58 HA ILE 58 -5.057 13.050 8.209 375 HB ILE 58 HB ILE 58 -2.939 13.351 10.380 376 HG13 ILE 58 2HG1 ILE 58 -2.495 12.960 7.462 377 HG21 ILE 58 1HG2 ILE 58 -4.258 11.030 8.925 378 HG22 ILE 58 2HG2 ILE 58 -2.989 10.863 10.151 379 HG23 ILE 58 3HG2 ILE 58 -4.566 11.504 10.608 380 HD11 ILE 58 3HD1 ILE 58 -1.419 14.782 8.679 381 HD12 ILE 58 1HD1 ILE 58 -0.587 13.576 9.710 382 HD13 ILE 58 2HD1 ILE 58 -0.249 13.657 7.971 383 H GLN 59 H GLN 59 -4.210 14.505 11.401 384 HA GLN 59 HA GLN 59 -6.546 13.147 12.342 385 HB3 GLN 59 2HB GLN 59 -5.784 13.885 14.574 386 HG3 GLN 59 2HG GLN 59 -3.323 12.868 13.140 387 HE21 GLN 59 1HE2 GLN 59 -2.724 13.767 15.557 388 HE22 GLN 59 2HE2 GLN 59 -2.892 12.540 16.770 389 H GLY 60 H GLY 60 -8.462 14.049 11.827 390 HA2 GLY 60 1HA GLY 60 -10.261 15.510 12.255 391 HA3 GLY 60 2HA GLY 60 -9.170 16.655 13.039 392 H ASN 61 H ASN 61 -7.689 15.816 10.133 393 HA ASN 61 HA ASN 61 -9.279 17.687 8.462 394 HB3 ASN 61 2HB ASN 61 -7.063 17.927 7.145 395 HD21 ASN 61 1HD2 ASN 61 -5.472 19.971 8.051 396 HD22 ASN 61 2HD2 ASN 61 -6.438 21.181 8.874 397 H LYS 62 H LYS 62 -10.602 15.997 8.013 398 HA LYS 62 HA LYS 62 -9.351 13.416 7.277 399 HB3 LYS 62 2HB LYS 62 -11.664 12.528 7.667 400 HG3 LYS 62 2HG LYS 62 -10.492 14.093 10.009 401 HD3 LYS 62 2HD LYS 62 -12.417 11.741 9.845 402 HE3 LYS 62 2HE LYS 62 -11.088 13.140 12.184 403 HZ1 LYS 62 3HZ LYS 62 -13.411 13.156 12.585 404 HZ2 LYS 62 1HZ LYS 62 -12.767 12.026 13.574 405 HZ3 LYS 62 2HZ LYS 62 -13.588 11.569 12.201 406 H ASP 63 H ASP 63 -8.907 15.063 5.214 407 HA ASP 63 HA ASP 63 -10.550 13.832 3.156 408 HB3 ASP 63 2HB ASP 63 -9.984 16.646 2.477 409 H PHE 64 H PHE 64 -9.178 13.648 1.144 410 HA PHE 64 HA PHE 64 -6.431 14.643 1.414 411 HB3 PHE 64 2HB PHE 64 -6.048 12.681 2.594 412 HD1 PHE 64 1HD PHE 64 -7.632 11.250 -0.542 413 HD2 PHE 64 2HD PHE 64 -7.071 10.921 3.723 414 HE1 PHE 64 1HE PHE 64 -9.043 9.248 -0.511 415 HE2 PHE 64 2HE PHE 64 -8.489 8.884 3.746 416 HZ PHE 64 HZ PHE 64 -9.499 8.057 1.614 417 HA PRO 65 HA PRO 65 -6.539 14.936 -2.942 418 HB3 PRO 65 2HB PRO 65 -4.323 15.471 -3.136 419 HG3 PRO 65 2HG PRO 65 -2.749 14.580 -1.587 420 HD3 PRO 65 2HD PRO 65 -4.629 15.424 -0.358 421 H GLU 66 H GLU 66 -7.038 13.895 -4.860 422 HA GLU 66 HA GLU 66 -7.764 11.105 -4.892 423 HB3 GLU 66 2HB GLU 66 -7.528 11.791 -7.562 424 HG3 GLU 66 2HG GLU 66 -9.844 12.798 -7.346 425 H ILE 67 H ILE 67 -6.953 9.664 -6.594 426 HA ILE 67 HA ILE 67 -3.975 9.707 -6.825 427 HB ILE 67 HB ILE 67 -3.941 7.264 -6.625 428 HG13 ILE 67 2HG1 ILE 67 -6.442 6.987 -7.199 429 HG21 ILE 67 1HG2 ILE 67 -4.044 7.196 -4.183 430 HG22 ILE 67 2HG2 ILE 67 -3.417 8.757 -4.702 431 HG23 ILE 67 3HG2 ILE 67 -5.095 8.627 -4.146 432 HD11 ILE 67 3HD1 ILE 67 -5.275 5.438 -4.867 433 HD12 ILE 67 1HD1 ILE 67 -6.790 5.039 -5.690 434 HD13 ILE 67 2HD1 ILE 67 -5.264 5.027 -6.598 435 H GLN 68 H GLN 68 -3.198 8.399 -8.683 436 HA GLN 68 HA GLN 68 -5.140 8.075 -10.891 437 HB3 GLN 68 2HB GLN 68 -3.337 9.189 -12.342 438 HG3 GLN 68 2HG GLN 68 -4.641 11.132 -10.374 439 HE21 GLN 68 1HE2 GLN 68 -2.495 12.274 -11.494 440 HE22 GLN 68 2HE2 GLN 68 -3.024 13.253 -12.837 441 H LEU 69 H LEU 69 -4.472 6.525 -12.368 442 HA LEU 69 HA LEU 69 -1.918 5.356 -12.595 443 HB3 LEU 69 2HB LEU 69 -2.612 4.287 -10.407 444 HG LEU 69 HG LEU 69 -4.018 2.318 -12.157 445 HD11 LEU 69 1HD1 LEU 69 -2.837 1.588 -10.108 446 HD12 LEU 69 2HD1 LEU 69 -4.563 1.203 -10.136 447 HD13 LEU 69 3HD1 LEU 69 -3.974 2.561 -9.145 448 HD21 LEU 69 3HD2 LEU 69 -6.197 2.847 -11.018 449 HD22 LEU 69 1HD2 LEU 69 -5.672 4.163 -12.062 450 HD23 LEU 69 2HD2 LEU 69 -5.454 4.294 -10.302 451 H ASP 70 H ASP 70 -2.875 2.940 -13.612 452 HA ASP 70 HA ASP 70 -4.416 3.762 -16.048 453 HB3 ASP 70 2HB ASP 70 -2.960 1.458 -16.603 454 H ASN 71 H ASN 71 -5.321 1.450 -17.102 455 HA ASN 71 HA ASN 71 -6.979 0.378 -14.891 456 HB3 ASN 71 2HB ASN 71 -7.143 -0.679 -17.693 457 HD21 ASN 71 1HD2 ASN 71 -7.674 -1.973 -14.763 458 HD22 ASN 71 2HD2 ASN 71 -9.339 -2.364 -14.917 459 H ILE 72 H ILE 72 -5.402 -0.521 -13.718 460 HA ILE 72 HA ILE 72 -4.373 -3.191 -14.575 461 HB ILE 72 HB ILE 72 -4.110 -1.741 -11.935 462 HG13 ILE 72 2HG1 ILE 72 -2.734 -1.171 -14.408 463 HG21 ILE 72 1HG2 ILE 72 -3.870 -4.122 -11.600 464 HG22 ILE 72 2HG2 ILE 72 -2.658 -4.219 -12.896 465 HG23 ILE 72 3HG2 ILE 72 -2.306 -3.309 -11.406 466 HD11 ILE 72 3HD1 ILE 72 -3.101 0.388 -12.541 467 HD12 ILE 72 1HD1 ILE 72 -1.911 -0.483 -11.561 468 HD13 ILE 72 2HD1 ILE 72 -1.415 0.357 -13.059 469 H ASP 73 H ASP 73 -5.268 -5.055 -13.586 470 HA ASP 73 HA ASP 73 -7.952 -4.646 -12.296 471 HB3 ASP 73 2HB ASP 73 -7.101 -6.853 -14.200 472 H TYR 74 H TYR 74 -7.710 -5.192 -10.210 473 HA TYR 74 HA TYR 74 -5.464 -6.637 -9.159 474 HB3 TYR 74 2HB TYR 74 -6.505 -6.101 -7.021 475 HD1 TYR 74 1HD TYR 74 -4.666 -4.585 -8.976 476 HD2 TYR 74 2HD TYR 74 -8.390 -3.569 -7.070 477 HE1 TYR 74 1HE TYR 74 -4.137 -2.161 -9.222 478 HE2 TYR 74 2HE TYR 74 -7.822 -1.164 -7.214 479 HH TYR 74 HH TYR 74 -6.322 0.469 -8.107 480 H ASN 75 H ASN 75 -6.981 -8.357 -10.848 481 HA ASN 75 HA ASN 75 -7.758 -10.486 -8.868 482 HB3 ASN 75 2HB ASN 75 -9.191 -11.231 -11.055 483 HD21 ASN 75 1HD2 ASN 75 -9.192 -8.774 -8.470 484 HD22 ASN 75 2HD2 ASN 75 -10.735 -9.199 -7.789 485 H ASN 76 H ASN 76 -5.579 -9.798 -11.363 486 HA ASN 76 HA ASN 76 -5.148 -12.664 -11.925 487 HB3 ASN 76 2HB ASN 76 -5.570 -11.318 -13.878 488 HD21 ASN 76 1HD2 ASN 76 -5.896 -9.150 -14.260 489 HD22 ASN 76 2HD2 ASN 76 -4.691 -7.895 -14.026 490 H TYR 77 H TYR 77 -4.059 -10.682 -9.589 491 HA TYR 77 HA TYR 77 -1.448 -12.073 -9.566 492 HB3 TYR 77 2HB TYR 77 -0.439 -10.317 -8.237 493 HD1 TYR 77 2HD TYR 77 0.528 -10.692 -10.738 494 HD2 TYR 77 1HD TYR 77 -2.154 -7.565 -9.533 495 HE1 TYR 77 2HE TYR 77 0.966 -9.539 -12.862 496 HE2 TYR 77 1HE TYR 77 -1.779 -6.414 -11.704 497 HH TYR 77 HH TYR 77 0.473 -7.715 -14.156 498 H ASP 78 H ASP 78 -0.872 -12.840 -7.402 499 HA ASP 78 HA ASP 78 -3.271 -13.097 -5.599 500 HB3 ASP 78 2HB ASP 78 -0.890 -14.962 -5.578 501 H LEU 79 H LEU 79 -0.310 -11.499 -5.844 502 HA LEU 79 HA LEU 79 -0.174 -10.984 -2.933 503 HB3 LEU 79 2HB LEU 79 2.479 -11.015 -4.045 504 HG LEU 79 HG LEU 79 1.121 -12.952 -2.123 505 HD11 LEU 79 1HD1 LEU 79 4.046 -12.555 -2.856 506 HD12 LEU 79 2HD1 LEU 79 3.057 -13.981 -3.259 507 HD13 LEU 79 3HD1 LEU 79 3.458 -13.614 -1.575 508 HD21 LEU 79 3HD2 LEU 79 3.014 -10.585 -1.654 509 HD22 LEU 79 1HD2 LEU 79 2.411 -11.697 -0.410 510 HD23 LEU 79 2HD2 LEU 79 1.284 -10.622 -1.239 511 H ILE 80 H ILE 80 0.051 -8.744 -2.585 512 HA ILE 80 HA ILE 80 1.057 -7.081 -4.833 513 HB ILE 80 HB ILE 80 -1.560 -6.654 -3.360 514 HG13 ILE 80 2HG1 ILE 80 -1.759 -8.256 -5.159 515 HG21 ILE 80 1HG2 ILE 80 -0.136 -4.840 -5.361 516 HG22 ILE 80 2HG2 ILE 80 -1.744 -4.555 -4.648 517 HG23 ILE 80 3HG2 ILE 80 -0.321 -4.503 -3.626 518 HD11 ILE 80 3HD1 ILE 80 -3.556 -6.496 -5.353 519 HD12 ILE 80 1HD1 ILE 80 -2.544 -5.645 -6.546 520 HD13 ILE 80 2HD1 ILE 80 -3.138 -7.269 -6.883 521 H LEU 81 H LEU 81 2.740 -5.998 -4.204 522 HA LEU 81 HA LEU 81 3.272 -5.449 -1.339 523 HB3 LEU 81 2HB LEU 81 5.605 -5.110 -2.193 524 HG LEU 81 HG LEU 81 4.339 -7.772 -2.991 525 HD11 LEU 81 1HD1 LEU 81 6.628 -8.679 -3.012 526 HD12 LEU 81 2HD1 LEU 81 7.281 -7.035 -2.848 527 HD13 LEU 81 3HD1 LEU 81 6.361 -7.491 -4.298 528 HD21 LEU 81 3HD2 LEU 81 5.489 -8.524 -0.899 529 HD22 LEU 81 1HD2 LEU 81 4.210 -7.338 -0.619 530 HD23 LEU 81 2HD2 LEU 81 5.912 -6.830 -0.559 531 H ILE 82 H ILE 82 3.436 -3.345 -0.653 532 HA ILE 82 HA ILE 82 3.048 -1.183 -2.687 533 HB ILE 82 HB ILE 82 1.663 -1.280 0.010 534 HG13 ILE 82 2HG1 ILE 82 0.908 -3.306 -1.261 535 HG21 ILE 82 1HG2 ILE 82 0.233 0.399 -1.073 536 HG22 ILE 82 2HG2 ILE 82 1.911 0.894 -1.217 537 HG23 ILE 82 3HG2 ILE 82 1.077 0.176 -2.613 538 HD11 ILE 82 3HD1 ILE 82 -1.252 -1.190 -1.148 539 HD12 ILE 82 1HD1 ILE 82 -1.439 -2.950 -1.128 540 HD13 ILE 82 2HD1 ILE 82 -0.667 -2.129 0.244 541 H GLY 83 H GLY 83 4.689 0.296 -2.587 542 HA2 GLY 83 1HA GLY 83 6.009 0.840 0.043 543 HA3 GLY 83 2HA GLY 83 6.738 1.046 -1.541 544 H SER 84 H SER 84 6.380 2.974 0.721 545 HA SER 84 HA SER 84 5.681 5.370 -0.656 546 HB3 SER 84 2HB SER 84 3.745 4.339 1.483 547 HG SER 84 HG SER 84 2.787 6.229 1.383 548 HA PRO 85 HA PRO 85 8.404 6.409 2.811 549 HB3 PRO 85 2HB PRO 85 9.021 8.280 1.568 550 HG3 PRO 85 2HG PRO 85 7.385 9.588 0.413 551 HD3 PRO 85 2HD PRO 85 7.077 7.398 -0.383 552 H VAL 86 H VAL 86 8.457 7.692 4.942 553 HA VAL 86 HA VAL 86 5.909 8.362 6.180 554 HB VAL 86 HB VAL 86 7.848 6.749 7.840 555 HG11 VAL 86 1HG1 VAL 86 4.835 7.159 7.960 556 HG12 VAL 86 2HG1 VAL 86 5.799 6.207 9.115 557 HG13 VAL 86 3HG1 VAL 86 6.069 7.932 8.992 558 HG21 VAL 86 3HG2 VAL 86 6.634 4.663 7.432 559 HG22 VAL 86 1HG2 VAL 86 5.772 5.454 6.080 560 HG23 VAL 86 2HG2 VAL 86 7.551 5.274 6.045 561 H TRP 87 H TRP 87 6.424 9.996 7.820 562 HA TRP 87 HA TRP 87 9.172 9.964 8.840 563 HB3 TRP 87 2HB TRP 87 8.049 12.597 7.865 564 HD1 TRP 87 HD TRP 87 11.273 11.937 6.421 565 HE1 TRP 87 1HE TRP 87 13.120 13.291 7.528 566 HE3 TRP 87 3HE TRP 87 8.830 13.347 10.712 567 HZ2 TRP 87 2HZ TRP 87 13.523 14.799 9.940 568 HZ3 TRP 87 3HZ TRP 87 9.961 14.802 12.364 569 HH2 TRP 87 HH TRP 87 12.287 15.558 11.987 570 H SER 88 H SER 88 6.138 11.455 9.006 571 HA SER 88 HA SER 88 6.422 11.521 11.909 572 HB3 SER 88 2HB SER 88 4.951 13.497 11.821 573 HG SER 88 HG SER 88 6.733 14.384 11.195 574 H GLY 89 H GLY 89 5.551 9.126 10.648 575 HA2 GLY 89 1HA GLY 89 4.130 7.462 11.460 576 HA3 GLY 89 2HA GLY 89 3.040 8.690 12.105 577 H TYR 90 H TYR 90 2.379 10.229 9.806 578 HA TYR 90 HA TYR 90 1.836 8.463 7.561 579 HB3 TYR 90 2HB TYR 90 0.041 7.654 8.594 580 HD1 TYR 90 1HD TYR 90 0.310 11.115 10.103 581 HD2 TYR 90 2HD TYR 90 -1.771 7.332 10.050 582 HE1 TYR 90 1HE TYR 90 -0.580 11.570 12.358 583 HE2 TYR 90 2HE TYR 90 -2.623 7.753 12.292 584 HH TYR 90 HH TYR 90 -2.866 9.302 13.982 585 HA PRO 91 HA PRO 91 1.908 13.000 6.544 586 HB3 PRO 91 2HB PRO 91 3.969 13.628 6.987 587 HG3 PRO 91 2HG PRO 91 5.607 12.073 7.398 588 HD3 PRO 91 2HD PRO 91 3.987 10.818 8.411 589 H ALA 92 H ALA 92 1.435 10.167 4.726 590 HA ALA 92 HA ALA 92 0.826 11.772 2.375 591 HB1 ALA 92 1HB ALA 92 2.246 9.070 2.119 592 HB2 ALA 92 2HB ALA 92 1.870 10.238 0.840 593 HB3 ALA 92 3HB ALA 92 3.111 10.621 2.016 594 H THR 93 H THR 93 -0.871 10.674 1.081 595 HA THR 93 HA THR 93 -2.114 8.255 2.241 596 HB THR 93 HB THR 93 -4.372 9.442 1.604 597 HG1 THR 93 1HG THR 93 -3.524 11.225 0.644 598 HG21 THR 93 3HG2 THR 93 -2.847 10.227 4.075 599 HG22 THR 93 1HG2 THR 93 -4.006 8.890 3.854 600 HG23 THR 93 2HG2 THR 93 -4.574 10.556 3.768 601 HA PRO 94 HA PRO 94 -2.103 7.873 -2.393 602 HB3 PRO 94 2HB PRO 94 0.179 7.997 -2.951 603 HG3 PRO 94 2HG PRO 94 1.853 7.650 -1.260 604 HD3 PRO 94 2HD PRO 94 0.453 9.270 -0.362 605 H ILE 95 H ILE 95 -0.899 5.819 0.329 606 HA ILE 95 HA ILE 95 -2.618 3.626 -0.562 607 HB ILE 95 HB ILE 95 -1.185 3.432 2.033 608 HG13 ILE 95 2HG1 ILE 95 0.960 2.778 1.053 609 HG21 ILE 95 1HG2 ILE 95 -1.561 1.591 -0.359 610 HG22 ILE 95 2HG2 ILE 95 -0.813 1.135 1.187 611 HG23 ILE 95 3HG2 ILE 95 -2.517 1.616 1.120 612 HD11 ILE 95 3HD1 ILE 95 0.165 2.661 -1.422 613 HD12 ILE 95 1HD1 ILE 95 0.365 4.411 -1.426 614 HD13 ILE 95 2HD1 ILE 95 1.744 3.389 -1.069 615 H LYS 96 H LYS 96 -4.318 5.145 -0.356 616 HA LYS 96 HA LYS 96 -5.826 4.410 2.020 617 HB3 LYS 96 2HB LYS 96 -6.407 7.279 1.458 618 HG3 LYS 96 2HG LYS 96 -6.434 7.380 3.921 619 HD3 LYS 96 2HD LYS 96 -7.805 4.808 2.986 620 HE3 LYS 96 2HE LYS 96 -8.375 6.685 5.313 621 HZ1 LYS 96 3HZ LYS 96 -9.851 4.339 4.303 622 HZ2 LYS 96 1HZ LYS 96 -10.381 5.907 4.387 623 HZ3 LYS 96 2HZ LYS 96 -10.113 5.045 5.758 624 H THR 97 H THR 97 -6.255 6.664 -0.829 625 HA THR 97 HA THR 97 -8.814 5.759 -1.409 626 HB THR 97 HB THR 97 -6.830 6.637 -3.510 627 HG1 THR 97 1HG THR 97 -7.270 8.814 -2.683 628 HG21 THR 97 3HG2 THR 97 -9.719 7.420 -2.921 629 HG22 THR 97 1HG2 THR 97 -9.186 6.314 -4.208 630 HG23 THR 97 2HG2 THR 97 -8.753 8.030 -4.280 631 H LEU 98 H LEU 98 -5.648 4.418 -2.414 632 HA LEU 98 HA LEU 98 -6.548 2.636 -4.359 633 HB3 LEU 98 2HB LEU 98 -4.307 1.788 -2.523 634 HG LEU 98 HG LEU 98 -3.129 1.312 -4.496 635 HD11 LEU 98 1HD1 LEU 98 -5.918 0.438 -5.299 636 HD12 LEU 98 2HD1 LEU 98 -4.960 -0.347 -4.016 637 HD13 LEU 98 3HD1 LEU 98 -4.380 -0.320 -5.682 638 HD21 LEU 98 3HD2 LEU 98 -5.274 2.683 -6.127 639 HD22 LEU 98 1HD2 LEU 98 -3.786 1.941 -6.741 640 HD23 LEU 98 2HD2 LEU 98 -3.680 3.368 -5.710 641 H LEU 99 H LEU 99 -6.231 2.031 -0.815 642 HA LEU 99 HA LEU 99 -6.963 -0.654 -0.691 643 HB3 LEU 99 2HB LEU 99 -7.972 0.006 1.525 644 HG LEU 99 HG LEU 99 -6.064 -0.058 2.513 645 HD11 LEU 99 1HD1 LEU 99 -5.339 -1.338 0.591 646 HD12 LEU 99 2HD1 LEU 99 -4.001 -0.548 1.427 647 HD13 LEU 99 3HD1 LEU 99 -4.610 0.129 -0.103 648 HD21 LEU 99 3HD2 LEU 99 -5.955 2.380 2.569 649 HD22 LEU 99 1HD2 LEU 99 -5.015 2.352 1.058 650 HD23 LEU 99 2HD2 LEU 99 -4.368 1.642 2.574 651 H ASP 100 H ASP 100 -9.049 2.249 -1.087 652 HA ASP 100 HA ASP 100 -11.459 0.671 -0.816 653 HB3 ASP 100 2HB ASP 100 -11.717 3.264 -2.234 654 H GLN 101 H GLN 101 -9.330 1.336 -3.528 655 HA GLN 101 HA GLN 101 -11.275 0.522 -5.567 656 HB3 GLN 101 2HB GLN 101 -9.410 0.493 -7.086 657 HG3 GLN 101 2HG GLN 101 -8.905 2.896 -5.299 658 HE21 GLN 101 1HE2 GLN 101 -9.002 4.796 -7.382 659 HE22 GLN 101 2HE2 GLN 101 -7.664 4.554 -8.442 660 H MET 102 H MET 102 -9.424 -1.153 -3.148 661 HA MET 102 HA MET 102 -8.858 -3.495 -4.824 662 HB3 MET 102 2HB MET 102 -7.740 -4.255 -2.647 663 HG3 MET 102 2HG MET 102 -6.048 -2.240 -2.812 664 HE1 MET 102 3HE MET 102 -5.696 -5.178 -2.586 665 HE2 MET 102 1HE MET 102 -4.290 -5.508 -3.624 666 HE3 MET 102 2HE MET 102 -4.343 -4.036 -2.634 667 H LYS 103 H LYS 103 -11.749 -2.713 -3.714 668 HA LYS 103 HA LYS 103 -12.370 -4.603 -1.749 669 HB3 LYS 103 2HB LYS 103 -14.693 -4.301 -2.233 670 HG3 LYS 103 2HG LYS 103 -15.085 -1.963 -2.324 671 HD3 LYS 103 2HD LYS 103 -13.399 -0.870 -0.945 672 HE3 LYS 103 2HE LYS 103 -15.064 -2.464 0.144 673 HZ1 LYS 103 3HZ LYS 103 -13.938 -4.302 1.321 674 HZ2 LYS 103 1HZ LYS 103 -12.593 -4.072 0.447 675 HZ3 LYS 103 2HZ LYS 103 -14.026 -4.623 -0.264 676 H ASN 104 H ASN 104 -11.659 -5.481 -4.984 677 HA ASN 104 HA ASN 104 -13.148 -8.069 -4.717 678 HB3 ASN 104 2HB ASN 104 -12.805 -8.196 -7.238 679 HD21 ASN 104 1HD2 ASN 104 -14.123 -5.024 -6.096 680 HD22 ASN 104 2HD2 ASN 104 -15.735 -5.648 -5.934 681 H TYR 105 H TYR 105 -10.224 -6.906 -3.916 682 HA TYR 105 HA TYR 105 -8.464 -8.541 -5.499 683 HB3 TYR 105 2HB TYR 105 -8.107 -7.078 -2.854 684 HD1 TYR 105 1HD TYR 105 -6.200 -8.451 -5.824 685 HD2 TYR 105 2HD TYR 105 -6.224 -7.691 -1.573 686 HE1 TYR 105 1HE TYR 105 -4.034 -9.577 -5.624 687 HE2 TYR 105 2HE TYR 105 -3.997 -8.726 -1.387 688 HH TYR 105 HH TYR 105 -2.166 -9.570 -2.580 689 H ARG 106 H ARG 106 -8.000 -10.592 -5.274 690 HA ARG 106 HA ARG 106 -8.508 -12.011 -2.691 691 HB3 ARG 106 2HB ARG 106 -8.611 -14.050 -4.204 692 HG3 ARG 106 2HG ARG 106 -10.975 -12.694 -5.194 693 HD3 ARG 106 2HD ARG 106 -12.005 -13.908 -3.210 694 HE ARG 106 HE ARG 106 -10.396 -15.451 -5.182 695 HH11 ARG 106 1HH1 ARG 106 -13.476 -15.080 -3.342 696 HH12 ARG 106 2HH1 ARG 106 -14.155 -16.516 -4.065 697 HH21 ARG 106 1HH2 ARG 106 -11.610 -17.034 -6.383 698 HH22 ARG 106 2HH2 ARG 106 -13.149 -17.562 -5.824 699 H GLY 107 H GLY 107 -6.540 -12.222 -1.732 700 HA2 GLY 107 1HA GLY 107 -4.316 -13.495 -2.531 701 HA3 GLY 107 2HA GLY 107 -4.142 -11.932 -3.340 702 H GLU 108 H GLU 108 -2.315 -11.568 -1.990 703 HA GLU 108 HA GLU 108 -2.828 -11.121 0.932 704 HB3 GLU 108 2HB GLU 108 -0.320 -11.761 1.021 705 HG3 GLU 108 2HG GLU 108 -2.450 -13.793 0.262 706 H VAL 109 H VAL 109 -1.731 -9.351 1.901 707 HA VAL 109 HA VAL 109 -0.394 -7.520 -0.045 708 HB VAL 109 HB VAL 109 -1.940 -6.555 2.371 709 HG11 VAL 109 1HG1 VAL 109 -0.973 -5.243 -0.220 710 HG12 VAL 109 2HG1 VAL 109 -1.894 -4.425 1.039 711 HG13 VAL 109 3HG1 VAL 109 -0.284 -5.003 1.399 712 HG21 VAL 109 3HG2 VAL 109 -3.828 -5.974 0.935 713 HG22 VAL 109 1HG2 VAL 109 -3.038 -6.751 -0.471 714 HG23 VAL 109 2HG2 VAL 109 -3.598 -7.706 0.922 715 H ALA 110 H ALA 110 1.494 -6.542 0.564 716 HA ALA 110 HA ALA 110 2.039 -6.350 3.394 717 HB1 ALA 110 1HB ALA 110 4.555 -6.820 2.888 718 HB2 ALA 110 2HB ALA 110 3.465 -8.173 3.158 719 HB3 ALA 110 3HB ALA 110 3.954 -7.757 1.510 720 H SER 111 H SER 111 3.923 -4.738 3.739 721 HA SER 111 HA SER 111 3.970 -2.789 1.536 722 HB3 SER 111 2HB SER 111 2.087 -2.463 3.393 723 HG SER 111 HG SER 111 4.043 -0.674 4.282 724 H PHE 112 H PHE 112 5.711 -1.498 1.411 725 HA PHE 112 HA PHE 112 8.045 -2.209 3.116 726 HB3 PHE 112 2HB PHE 112 7.962 -3.640 1.163 727 HD1 PHE 112 1HD PHE 112 6.070 -3.017 -0.524 728 HD2 PHE 112 2HD PHE 112 10.074 -1.419 -0.638 729 HE1 PHE 112 1HE PHE 112 5.772 -2.374 -2.919 730 HE2 PHE 112 2HE PHE 112 9.733 -0.714 -2.970 731 HZ PHE 112 HZ PHE 112 7.583 -1.187 -4.126 732 H PHE 113 H PHE 113 7.900 -0.141 4.203 733 HA PHE 113 HA PHE 113 7.714 2.260 2.498 734 HB3 PHE 113 2HB PHE 113 6.456 2.549 4.400 735 HD1 PHE 113 2HD PHE 113 6.015 0.517 5.749 736 HD2 PHE 113 1HD PHE 113 9.421 3.061 6.470 737 HE1 PHE 113 2HE PHE 113 6.317 -0.539 7.943 738 HE2 PHE 113 1HE PHE 113 9.709 1.994 8.724 739 HZ PHE 113 HZ PHE 113 8.154 0.146 9.423 740 H THR 114 H THR 114 9.243 4.129 2.699 741 HA THR 114 HA THR 114 11.978 3.097 2.405 742 HB THR 114 HB THR 114 12.134 5.397 1.183 743 HG1 THR 114 1HG THR 114 10.152 6.193 0.456 744 HG21 THR 114 3HG2 THR 114 11.375 4.426 -0.882 745 HG22 THR 114 1HG2 THR 114 10.336 3.264 -0.012 746 HG23 THR 114 2HG2 THR 114 12.095 3.125 0.064 747 H SER 115 H SER 115 10.329 4.893 4.802 748 HA SER 115 HA SER 115 12.832 6.028 5.863 749 HB3 SER 115 2HB SER 115 11.449 8.214 6.126 750 HG SER 115 HG SER 115 12.434 8.991 4.417 751 H ALA 116 H ALA 116 12.496 6.751 8.097 752 HA ALA 116 HA ALA 116 9.943 6.185 9.408 753 HB1 ALA 116 1HB ALA 116 10.715 4.405 10.820 754 HB2 ALA 116 2HB ALA 116 10.994 3.914 9.146 755 HB3 ALA 116 3HB ALA 116 12.359 4.483 10.148 756 H GLY 117 H GLY 117 12.049 8.363 9.074 757 HA2 GLY 117 1HA GLY 117 14.013 8.529 10.770 758 HA3 GLY 117 2HA GLY 117 13.149 9.988 10.284 759 H THR 118 H THR 118 10.774 9.859 11.810 760 HA THR 118 HA THR 118 11.779 9.607 14.609 761 HB THR 118 HB THR 118 10.501 11.544 15.184 762 HG1 THR 118 1HG THR 118 10.067 12.243 12.504 763 HG21 THR 118 3HG2 THR 118 11.853 13.280 14.155 764 HG22 THR 118 1HG2 THR 118 12.306 12.211 12.818 765 HG23 THR 118 2HG2 THR 118 12.860 11.863 14.465 766 H ASN 119 H ASN 119 10.003 7.939 12.597 767 HA ASN 119 HA ASN 119 8.009 7.043 14.540 768 HB3 ASN 119 2HB ASN 119 6.340 7.215 12.429 769 HD21 ASN 119 1HD2 ASN 119 5.573 7.093 14.898 770 HD22 ASN 119 2HD2 ASN 119 4.772 8.617 15.211 771 H HIS 120 H HIS 120 8.442 4.917 14.447 772 HA HIS 120 HA HIS 120 8.464 3.597 11.781 773 HB3 HIS 120 2HB HIS 120 9.985 2.863 14.320 774 HD1 HIS 120 1HD HIS 120 11.275 0.562 14.220 775 HD2 HIS 120 2HD HIS 120 9.098 1.604 10.778 776 HE1 HIS 120 1HE HIS 120 11.454 -1.434 12.624 777 H LYS 121 H LYS 121 8.045 2.626 15.223 778 HA LYS 121 HA LYS 121 6.239 0.572 14.594 779 HB3 LYS 121 2HB LYS 121 5.746 1.534 17.278 780 HG3 LYS 121 2HG LYS 121 7.785 -0.431 17.368 781 HD3 LYS 121 2HD LYS 121 5.855 -0.446 18.873 782 HE3 LYS 121 2HE LYS 121 4.338 -1.344 16.380 783 HZ1 LYS 121 3HZ LYS 121 3.446 -1.240 19.209 784 HZ2 LYS 121 1HZ LYS 121 3.500 -2.583 18.250 785 HZ3 LYS 121 2HZ LYS 121 2.437 -1.378 17.946 786 H ALA 122 H ALA 122 5.470 4.024 15.184 787 HA ALA 122 HA ALA 122 2.701 3.743 15.544 788 HB1 ALA 122 1HB ALA 122 4.031 5.853 15.729 789 HB2 ALA 122 2HB ALA 122 4.112 5.912 13.945 790 HB3 ALA 122 3HB ALA 122 2.547 6.022 14.784 791 H TYR 123 H TYR 123 4.601 3.763 12.474 792 HA TYR 123 HA TYR 123 2.424 4.129 10.711 793 HB3 TYR 123 2HB TYR 123 5.033 2.640 10.247 794 HD1 TYR 123 2HD TYR 123 3.468 5.344 8.240 795 HD2 TYR 123 1HD TYR 123 4.144 1.083 8.550 796 HE1 TYR 123 2HE TYR 123 2.668 5.039 5.920 797 HE2 TYR 123 1HE TYR 123 3.353 0.795 6.215 798 HH TYR 123 HH TYR 123 2.994 3.522 4.146 799 H VAL 124 H VAL 124 3.868 1.181 12.089 800 HA VAL 124 HA VAL 124 2.409 -0.719 10.587 801 HB VAL 124 HB VAL 124 3.544 -0.987 13.407 802 HG11 VAL 124 1HG1 VAL 124 3.933 -3.346 12.687 803 HG12 VAL 124 2HG1 VAL 124 2.231 -2.874 12.703 804 HG13 VAL 124 3HG1 VAL 124 3.091 -2.986 11.159 805 HG21 VAL 124 3HG2 VAL 124 5.042 -1.207 10.758 806 HG22 VAL 124 1HG2 VAL 124 5.353 -0.033 12.057 807 HG23 VAL 124 2HG2 VAL 124 5.666 -1.744 12.324 808 H SER 125 H SER 125 1.492 1.132 13.442 809 HA SER 125 HA SER 125 -1.018 -0.360 13.864 810 HB3 SER 125 2HB SER 125 0.175 2.200 14.957 811 HG SER 125 HG SER 125 -2.293 0.921 15.529 812 H HIS 126 H HIS 126 0.000 2.815 12.597 813 HA HIS 126 HA HIS 126 -2.461 3.888 11.869 814 HB3 HIS 126 2HB HIS 126 -1.201 5.198 10.193 815 HD1 HIS 126 1HD HIS 126 1.162 6.735 11.029 816 HD2 HIS 126 2HD HIS 126 -1.401 4.865 13.772 817 HE1 HIS 126 1HE HIS 126 1.309 8.086 13.230 818 H PHE 127 H PHE 127 -0.306 2.098 9.577 819 HA PHE 127 HA PHE 127 -2.146 2.270 7.443 820 HB3 PHE 127 2HB PHE 127 0.196 0.418 7.968 821 HD1 PHE 127 1HD PHE 127 -1.922 1.818 5.134 822 HD2 PHE 127 2HD PHE 127 0.551 -1.392 6.575 823 HE1 PHE 127 1HE PHE 127 -2.372 0.526 3.074 824 HE2 PHE 127 2HE PHE 127 0.100 -2.686 4.517 825 HZ PHE 127 HZ PHE 127 -1.358 -1.708 2.729 826 H ASN 128 H ASN 128 -1.910 -0.129 10.085 827 HA ASN 128 HA ASN 128 -3.625 -2.091 8.897 828 HB3 ASN 128 2HB ASN 128 -4.159 -2.412 11.526 829 HD21 ASN 128 1HD2 ASN 128 -1.440 -3.151 12.618 830 HD22 ASN 128 2HD2 ASN 128 -1.063 -4.567 11.684 831 H GLU 129 H GLU 129 -4.411 0.970 10.594 832 HA GLU 129 HA GLU 129 -7.240 0.223 10.757 833 HB3 GLU 129 2HB GLU 129 -7.507 2.543 11.497 834 HG3 GLU 129 2HG GLU 129 -6.272 2.560 13.537 835 H TRP 130 H TRP 130 -5.112 1.944 8.532 836 HA TRP 130 HA TRP 130 -7.321 3.016 6.950 837 HB3 TRP 130 2HB TRP 130 -5.463 3.797 5.497 838 HD1 TRP 130 HD TRP 130 -6.486 4.331 9.078 839 HE1 TRP 130 1HE TRP 130 -5.850 6.658 9.840 840 HE3 TRP 130 3HE TRP 130 -3.449 5.651 5.167 841 HZ2 TRP 130 2HZ TRP 130 -4.232 8.844 8.901 842 HZ3 TRP 130 3HZ TRP 130 -2.344 7.878 5.159 843 HH2 TRP 130 HH TRP 130 -2.772 9.495 6.985 844 H ALA 131 H ALA 131 -5.847 -0.023 7.128 845 HA ALA 131 HA ALA 131 -6.859 -0.811 4.451 846 HB1 ALA 131 1HB ALA 131 -4.916 -2.149 4.154 847 HB2 ALA 131 2HB ALA 131 -4.379 -0.497 4.478 848 HB3 ALA 131 3HB ALA 131 -4.269 -1.723 5.765 849 H ASP 132 H ASP 132 -8.355 -0.922 6.783 850 HA ASP 132 HA ASP 132 -8.277 -3.585 8.006 851 HB3 ASP 132 2HB ASP 132 -10.295 -1.327 7.971 852 H GLY 133 H GLY 133 -9.023 -5.305 7.051 853 HA2 GLY 133 1HA GLY 133 -10.971 -6.417 6.154 854 HA3 GLY 133 2HA GLY 133 -11.223 -5.067 5.067 855 H LEU 134 H LEU 134 -7.922 -5.665 4.851 856 HA LEU 134 HA LEU 134 -8.170 -7.860 2.859 857 HB3 LEU 134 2HB LEU 134 -6.393 -6.695 1.534 858 HG LEU 134 HG LEU 134 -8.998 -5.162 1.947 859 HD11 LEU 134 1HD1 LEU 134 -6.854 -4.566 -0.119 860 HD12 LEU 134 2HD1 LEU 134 -7.304 -3.547 1.271 861 HD13 LEU 134 3HD1 LEU 134 -8.480 -3.832 -0.012 862 HD21 LEU 134 3HD2 LEU 134 -8.984 -7.444 0.830 863 HD22 LEU 134 1HD2 LEU 134 -8.023 -6.738 -0.464 864 HD23 LEU 134 2HD2 LEU 134 -9.654 -6.102 -0.156 865 H ASN 135 H ASN 135 -6.183 -9.096 2.629 866 HA ASN 135 HA ASN 135 -5.430 -9.804 5.331 867 HB3 ASN 135 2HB ASN 135 -4.686 -11.133 2.696 868 HD21 ASN 135 1HD2 ASN 135 -3.015 -12.576 3.209 869 HD22 ASN 135 2HD2 ASN 135 -2.981 -13.561 4.662 870 H VAL 136 H VAL 136 -3.768 -8.648 6.260 871 HA VAL 136 HA VAL 136 -1.432 -7.974 4.626 872 HB VAL 136 HB VAL 136 -1.906 -7.399 7.575 873 HG11 VAL 136 1HG1 VAL 136 0.437 -7.123 6.888 874 HG12 VAL 136 2HG1 VAL 136 -0.051 -6.128 5.496 875 HG13 VAL 136 3HG1 VAL 136 -0.303 -5.546 7.153 876 HG21 VAL 136 3HG2 VAL 136 -3.724 -6.347 6.296 877 HG22 VAL 136 1HG2 VAL 136 -2.620 -5.146 6.916 878 HG23 VAL 136 2HG2 VAL 136 -2.529 -5.614 5.197 879 H ILE 137 H ILE 137 0.381 -9.140 4.604 880 HA ILE 137 HA ILE 137 0.981 -11.028 6.817 881 HB ILE 137 HB ILE 137 2.020 -12.531 5.071 882 HG13 ILE 137 2HG1 ILE 137 0.341 -10.843 3.149 883 HG21 ILE 137 1HG2 ILE 137 -0.081 -13.002 6.241 884 HG22 ILE 137 2HG2 ILE 137 -0.988 -12.080 5.026 885 HG23 ILE 137 3HG2 ILE 137 -0.150 -13.580 4.575 886 HD11 ILE 137 3HD1 ILE 137 2.308 -10.804 1.742 887 HD12 ILE 137 1HD1 ILE 137 2.775 -10.198 3.337 888 HD13 ILE 137 2HD1 ILE 137 3.188 -11.862 2.865 889 H GLY 138 H GLY 138 1.906 -8.142 5.752 890 HA2 GLY 138 1HA GLY 138 3.529 -8.042 7.830 891 HA3 GLY 138 2HA GLY 138 4.722 -8.442 6.600 892 H VAL 139 H VAL 139 4.781 -6.065 8.110 893 HA VAL 139 HA VAL 139 4.568 -3.959 6.041 894 HB VAL 139 HB VAL 139 3.274 -3.952 8.804 895 HG11 VAL 139 1HG1 VAL 139 2.679 -1.617 8.501 896 HG12 VAL 139 2HG1 VAL 139 4.424 -1.815 8.636 897 HG13 VAL 139 3HG1 VAL 139 3.677 -1.514 7.047 898 HG21 VAL 139 3HG2 VAL 139 1.278 -3.248 7.475 899 HG22 VAL 139 1HG2 VAL 139 2.210 -3.455 5.984 900 HG23 VAL 139 2HG2 VAL 139 1.861 -4.838 7.041 901 H ALA 140 H ALA 140 6.690 -3.403 5.873 902 HA ALA 140 HA ALA 140 8.283 -2.971 8.315 903 HB1 ALA 140 1HB ALA 140 9.077 -4.866 6.057 904 HB2 ALA 140 2HB ALA 140 10.087 -4.435 7.453 905 HB3 ALA 140 3HB ALA 140 8.594 -5.364 7.684 906 H ARG 141 H ARG 141 10.464 -2.003 7.616 907 HA ARG 141 HA ARG 141 10.123 -0.168 5.322 908 HB3 ARG 141 2HB ARG 141 11.221 0.782 7.335 909 HG3 ARG 141 2HG ARG 141 13.393 -1.281 6.825 910 HD3 ARG 141 2HD ARG 141 13.252 1.109 8.630 911 HE ARG 141 HE ARG 141 13.444 -1.310 9.779 912 HH11 ARG 141 1HH1 ARG 141 16.159 1.023 9.295 913 HH12 ARG 141 2HH1 ARG 141 16.968 0.387 10.679 914 HH21 ARG 141 1HH2 ARG 141 14.551 -2.011 11.444 915 HH22 ARG 141 2HH2 ARG 141 16.044 -1.264 11.979 916 H ASP 142 H ASP 142 11.667 -0.193 3.701 917 HA ASP 142 HA ASP 142 12.927 -1.026 2.028 918 HB3 ASP 142 2HB ASP 142 15.084 -1.958 2.672 919 H ASP 143 H ASP 143 14.383 -3.631 1.994 920 HA ASP 143 HA ASP 143 12.100 -5.281 1.102 921 HB3 ASP 143 2HB ASP 143 13.478 -4.421 -0.651 922 H SER 144 H SER 144 13.560 -5.154 3.836 923 HA SER 144 HA SER 144 15.213 -7.449 4.182 924 HB3 SER 144 2HB SER 144 13.537 -5.942 6.238 925 HG SER 144 HG SER 144 14.636 -7.809 6.972 926 H GLU 145 H GLU 145 11.714 -7.183 3.982 927 HA GLU 145 HA GLU 145 11.458 -9.927 5.105 928 HB3 GLU 145 2HB GLU 145 9.285 -9.294 5.966 929 HG3 GLU 145 2HG GLU 145 11.033 -7.013 6.921 930 H VAL 146 H VAL 146 11.685 -8.652 2.171 931 HA VAL 146 HA VAL 146 9.232 -9.432 0.876 932 HB VAL 146 HB VAL 146 12.105 -9.301 -0.115 933 HG11 VAL 146 1HG1 VAL 146 9.518 -9.414 -1.730 934 HG12 VAL 146 2HG1 VAL 146 11.171 -9.185 -2.387 935 HG13 VAL 146 3HG1 VAL 146 10.718 -10.708 -1.639 936 HG21 VAL 146 3HG2 VAL 146 11.117 -7.144 0.701 937 HG22 VAL 146 1HG2 VAL 146 11.435 -7.129 -1.037 938 HG23 VAL 146 2HG2 VAL 146 9.774 -7.353 -0.428 939 H ASP 147 H ASP 147 11.979 -11.199 2.051 940 HA ASP 147 HA ASP 147 11.707 -13.560 0.583 941 HB3 ASP 147 2HB ASP 147 12.872 -13.563 3.334 942 H LYS 148 H LYS 148 9.548 -12.506 2.826 943 HA LYS 148 HA LYS 148 8.516 -15.221 3.464 944 HB3 LYS 148 2HB LYS 148 8.909 -14.198 5.584 945 HG3 LYS 148 2HG LYS 148 7.722 -11.733 4.411 946 HD3 LYS 148 2HD LYS 148 6.391 -12.034 6.341 947 HE3 LYS 148 2HE LYS 148 9.006 -12.099 7.924 948 HZ1 LYS 148 3HZ LYS 148 7.309 -10.891 9.062 949 HZ2 LYS 148 1HZ LYS 148 7.418 -12.369 9.786 950 HZ3 LYS 148 2HZ LYS 148 6.175 -12.069 8.757 951 H TRP 149 H TRP 149 7.843 -11.947 2.173 952 HA TRP 149 HA TRP 149 5.087 -12.471 1.511 953 HB3 TRP 149 2HB TRP 149 5.173 -10.328 0.494 954 HD1 TRP 149 HD TRP 149 5.150 -11.163 3.690 955 HE1 TRP 149 1HE TRP 149 5.645 -9.368 5.395 956 HE3 TRP 149 3HE TRP 149 7.616 -7.877 0.657 957 HZ2 TRP 149 2HZ TRP 149 6.919 -6.715 5.441 958 HZ3 TRP 149 3HZ TRP 149 8.487 -5.752 1.557 959 HH2 TRP 149 HH TRP 149 8.103 -5.138 3.930 960 H SER 150 H SER 150 6.614 -14.530 0.589 961 HA SER 150 HA SER 150 6.192 -14.656 -2.242 962 HB3 SER 150 2HB SER 150 9.120 -14.876 -1.414 963 HG SER 150 HG SER 150 7.894 -13.975 -3.795 964 H LYS 151 H LYS 151 6.848 -16.142 0.833 965 HA LYS 151 HA LYS 151 7.016 -18.812 -0.538 966 HB3 LYS 151 2HB LYS 151 8.523 -19.508 1.252 967 HG3 LYS 151 2HG LYS 151 9.495 -16.941 -0.095 968 HD3 LYS 151 2HD LYS 151 11.209 -19.290 0.752 969 HE3 LYS 151 2HE LYS 151 11.685 -16.345 0.121 970 HZ1 LYS 151 3HZ LYS 151 13.053 -17.190 1.947 971 HZ2 LYS 151 1HZ LYS 151 13.928 -16.708 0.662 972 HZ3 LYS 151 2HZ LYS 151 13.711 -18.322 0.963 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -6.615 -22.437 -13.080 2 HA2 GLY 1 1HA GLY 1 -4.065 -23.539 -14.120 3 HA3 GLY 1 2HA GLY 1 -4.707 -21.917 -14.498 4 H MET 2 H MET 2 -2.154 -21.962 -13.455 5 HA MET 2 HA MET 2 -2.596 -20.459 -11.031 6 HB3 MET 2 2HB MET 2 -2.392 -22.483 -9.849 7 HG3 MET 2 2HG MET 2 -0.216 -23.244 -11.808 8 HE1 MET 2 3HE MET 2 1.970 -23.020 -10.607 9 HE2 MET 2 1HE MET 2 1.244 -22.289 -9.165 10 HE3 MET 2 2HE MET 2 2.349 -23.671 -8.998 11 H ALA 3 H ALA 3 -1.467 -18.681 -11.370 12 HA ALA 3 HA ALA 3 1.410 -18.933 -11.764 13 HB1 ALA 3 1HB ALA 3 1.480 -16.924 -13.213 14 HB2 ALA 3 2HB ALA 3 0.795 -18.344 -14.045 15 HB3 ALA 3 3HB ALA 3 -0.277 -17.045 -13.454 16 H LYS 4 H LYS 4 1.857 -18.280 -9.766 17 HA LYS 4 HA LYS 4 0.168 -16.378 -8.317 18 HB3 LYS 4 2HB LYS 4 1.792 -16.451 -6.558 19 HG3 LYS 4 2HG LYS 4 1.583 -19.364 -7.382 20 HD3 LYS 4 2HD LYS 4 1.194 -18.028 -4.700 21 HE3 LYS 4 2HE LYS 4 2.493 -20.664 -5.498 22 HZ1 LYS 4 3HZ LYS 4 3.524 -19.488 -3.619 23 HZ2 LYS 4 1HZ LYS 4 2.919 -20.922 -3.170 24 HZ3 LYS 4 2HZ LYS 4 2.098 -19.518 -2.810 25 H LYS 5 H LYS 5 0.265 -14.389 -9.407 26 HA LYS 5 HA LYS 5 2.972 -13.338 -10.114 27 HB3 LYS 5 2HB LYS 5 1.856 -11.534 -11.255 28 HG3 LYS 5 2HG LYS 5 0.343 -14.062 -11.715 29 HD3 LYS 5 2HD LYS 5 1.190 -11.853 -13.557 30 HE3 LYS 5 2HE LYS 5 1.363 -14.692 -13.932 31 HZ1 LYS 5 3HZ LYS 5 -0.710 -13.590 -15.699 32 HZ2 LYS 5 1HZ LYS 5 -0.974 -14.678 -14.470 33 HZ3 LYS 5 2HZ LYS 5 -0.008 -15.066 -15.761 34 H THR 6 H THR 6 3.295 -11.144 -9.687 35 HA THR 6 HA THR 6 2.324 -10.201 -7.025 36 HB THR 6 HB THR 6 5.207 -10.211 -7.977 37 HG1 THR 6 1HG THR 6 4.676 -12.157 -7.055 38 HG21 THR 6 3HG2 THR 6 5.702 -9.221 -5.720 39 HG22 THR 6 1HG2 THR 6 3.968 -8.899 -5.533 40 HG23 THR 6 2HG2 THR 6 4.890 -8.116 -6.831 41 H LEU 7 H LEU 7 1.930 -7.935 -6.966 42 HA LEU 7 HA LEU 7 2.928 -6.378 -9.276 43 HB3 LEU 7 2HB LEU 7 0.300 -5.848 -7.845 44 HG LEU 7 HG LEU 7 1.387 -3.830 -8.876 45 HD11 LEU 7 1HD1 LEU 7 2.668 -4.710 -10.714 46 HD12 LEU 7 2HD1 LEU 7 1.405 -3.716 -11.420 47 HD13 LEU 7 3HD1 LEU 7 1.239 -5.484 -11.433 48 HD21 LEU 7 3HD2 LEU 7 -0.554 -3.186 -10.271 49 HD22 LEU 7 1HD2 LEU 7 -1.049 -4.004 -8.790 50 HD23 LEU 7 2HD2 LEU 7 -1.058 -4.896 -10.325 51 H ILE 8 H ILE 8 4.163 -4.699 -8.588 52 HA ILE 8 HA ILE 8 4.072 -3.957 -5.698 53 HB ILE 8 HB ILE 8 6.368 -3.672 -7.636 54 HG13 ILE 8 2HG1 ILE 8 5.591 -6.019 -6.102 55 HG21 ILE 8 1HG2 ILE 8 7.718 -3.120 -5.675 56 HG22 ILE 8 2HG2 ILE 8 6.426 -1.947 -5.976 57 HG23 ILE 8 3HG2 ILE 8 6.255 -3.161 -4.676 58 HD11 ILE 8 3HD1 ILE 8 6.738 -6.073 -8.382 59 HD12 ILE 8 1HD1 ILE 8 8.272 -5.710 -7.537 60 HD13 ILE 8 2HD1 ILE 8 7.386 -7.177 -7.167 61 H LEU 9 H LEU 9 2.899 -2.184 -5.452 62 HA LEU 9 HA LEU 9 2.722 -0.152 -7.618 63 HB3 LEU 9 2HB LEU 9 0.715 0.608 -6.231 64 HG LEU 9 HG LEU 9 0.470 -2.164 -7.455 65 HD11 LEU 9 1HD1 LEU 9 -1.404 -1.582 -5.978 66 HD12 LEU 9 2HD1 LEU 9 -1.915 -1.566 -7.663 67 HD13 LEU 9 3HD1 LEU 9 -1.608 -0.026 -6.830 68 HD21 LEU 9 3HD2 LEU 9 -0.420 -0.871 -9.437 69 HD22 LEU 9 1HD2 LEU 9 1.299 -0.636 -9.136 70 HD23 LEU 9 2HD2 LEU 9 0.139 0.633 -8.676 71 H TYR 10 H TYR 10 3.771 1.703 -7.319 72 HA TYR 10 HA TYR 10 4.448 2.567 -4.567 73 HB3 TYR 10 2HB TYR 10 6.173 1.018 -5.251 74 HD1 TYR 10 2HD TYR 10 5.456 0.268 -7.817 75 HD2 TYR 10 1HD TYR 10 8.316 3.336 -6.769 76 HE1 TYR 10 2HE TYR 10 6.404 0.157 -10.058 77 HE2 TYR 10 1HE TYR 10 9.310 3.156 -8.969 78 HH TYR 10 HH TYR 10 7.913 1.187 -11.625 79 H TYR 11 H TYR 11 4.551 4.743 -4.291 80 HA TYR 11 HA TYR 11 4.077 6.458 -6.678 81 HB3 TYR 11 2HB TYR 11 2.641 6.235 -4.020 82 HD1 TYR 11 1HD TYR 11 3.114 8.526 -3.150 83 HD2 TYR 11 2HD TYR 11 1.298 7.890 -7.024 84 HE1 TYR 11 1HE TYR 11 2.301 10.856 -3.144 85 HE2 TYR 11 2HE TYR 11 0.512 10.202 -7.028 86 HH TYR 11 HH TYR 11 0.555 12.277 -5.910 87 H SER 12 H SER 12 5.753 7.756 -6.950 88 HA SER 12 HA SER 12 6.032 9.914 -5.228 89 HB3 SER 12 2HB SER 12 8.717 8.521 -5.595 90 HG SER 12 HG SER 12 7.779 10.243 -3.534 91 H TRP 13 H TRP 13 7.752 11.452 -6.166 92 HA TRP 13 HA TRP 13 8.300 11.009 -9.072 93 HB3 TRP 13 2HB TRP 13 9.077 13.504 -8.804 94 HD1 TRP 13 HD TRP 13 7.929 12.628 -11.174 95 HE1 TRP 13 1HE TRP 13 5.730 13.340 -12.219 96 HE3 TRP 13 3HE TRP 13 5.592 14.389 -6.978 97 HZ2 TRP 13 2HZ TRP 13 3.122 14.269 -11.304 98 HZ3 TRP 13 3HZ TRP 13 3.200 15.079 -7.075 99 HH2 TRP 13 HH TRP 13 1.954 14.979 -9.214 100 H SER 14 H SER 14 9.616 11.326 -5.803 101 HA SER 14 HA SER 14 12.336 11.811 -6.736 102 HB3 SER 14 2HB SER 14 12.804 11.798 -4.298 103 HG SER 14 HG SER 14 12.103 13.702 -5.132 104 H GLY 15 H GLY 15 14.097 10.402 -5.902 105 HA2 GLY 15 1HA GLY 15 13.623 7.602 -6.559 106 HA3 GLY 15 2HA GLY 15 15.162 8.402 -6.204 107 H GLU 16 H GLU 16 12.126 8.188 -4.287 108 HA GLU 16 HA GLU 16 13.601 6.983 -1.972 109 HB3 GLU 16 2HB GLU 16 11.325 7.031 -0.897 110 HG3 GLU 16 2HG GLU 16 11.141 9.447 -0.539 111 H THR 17 H THR 17 10.544 6.238 -3.744 112 HA THR 17 HA THR 17 10.514 3.601 -2.872 113 HB THR 17 HB THR 17 8.723 3.448 -4.667 114 HG1 THR 17 1HG THR 17 8.184 5.389 -5.740 115 HG21 THR 17 3HG2 THR 17 8.522 5.747 -2.673 116 HG22 THR 17 1HG2 THR 17 8.222 4.034 -2.326 117 HG23 THR 17 2HG2 THR 17 7.154 4.913 -3.443 118 H LYS 18 H LYS 18 11.919 4.887 -5.863 119 HA LYS 18 HA LYS 18 11.654 2.889 -7.593 120 HB3 LYS 18 2HB LYS 18 14.445 4.039 -7.540 121 HG3 LYS 18 2HG LYS 18 13.365 2.786 -9.491 122 HD3 LYS 18 2HD LYS 18 11.187 4.350 -9.214 123 HE3 LYS 18 2HE LYS 18 11.104 6.051 -10.931 124 HZ1 LYS 18 3HZ LYS 18 12.361 7.729 -9.887 125 HZ2 LYS 18 1HZ LYS 18 13.476 6.691 -9.312 126 HZ3 LYS 18 2HZ LYS 18 11.936 6.685 -8.687 127 H LYS 19 H LYS 19 14.666 2.968 -5.618 128 HA LYS 19 HA LYS 19 15.559 0.423 -6.410 129 HB3 LYS 19 2HB LYS 19 17.167 1.657 -5.206 130 HG3 LYS 19 2HG LYS 19 15.014 2.145 -3.135 131 HD3 LYS 19 2HD LYS 19 17.985 2.339 -2.565 132 HE3 LYS 19 2HE LYS 19 16.963 2.920 -0.243 133 HZ1 LYS 19 3HZ LYS 19 16.887 4.829 -2.492 134 HZ2 LYS 19 1HZ LYS 19 17.982 4.700 -1.315 135 HZ3 LYS 19 2HZ LYS 19 16.499 5.261 -0.938 136 H MET 20 H MET 20 13.380 1.208 -3.719 137 HA MET 20 HA MET 20 13.323 -1.468 -2.722 138 HB3 MET 20 2HB MET 20 11.074 0.291 -1.986 139 HG3 MET 20 2HG MET 20 12.262 -1.570 -0.566 140 HE1 MET 20 3HE MET 20 15.058 -1.708 -1.575 141 HE2 MET 20 1HE MET 20 15.926 -1.830 -0.021 142 HE3 MET 20 2HE MET 20 14.321 -2.568 -0.206 143 H ALA 21 H ALA 21 11.853 -0.217 -5.537 144 HA ALA 21 HA ALA 21 9.789 -2.361 -5.466 145 HB1 ALA 21 1HB ALA 21 10.122 0.002 -7.371 146 HB2 ALA 21 2HB ALA 21 8.846 -1.228 -7.445 147 HB3 ALA 21 3HB ALA 21 8.929 -0.123 -6.054 148 H GLU 22 H GLU 22 12.443 -0.969 -7.473 149 HA GLU 22 HA GLU 22 12.273 -2.973 -9.496 150 HB3 GLU 22 2HB GLU 22 14.397 -2.014 -10.296 151 HG3 GLU 22 2HG GLU 22 13.554 0.585 -9.736 152 H LYS 23 H LYS 23 14.051 -2.870 -6.425 153 HA LYS 23 HA LYS 23 15.867 -5.054 -6.845 154 HB3 LYS 23 2HB LYS 23 15.222 -5.286 -4.252 155 HG3 LYS 23 2HG LYS 23 17.395 -4.976 -5.075 156 HD3 LYS 23 2HD LYS 23 18.317 -2.766 -4.853 157 HE3 LYS 23 2HE LYS 23 16.544 -3.066 -7.310 158 HZ1 LYS 23 3HZ LYS 23 18.276 -2.095 -8.488 159 HZ2 LYS 23 1HZ LYS 23 19.216 -1.828 -7.145 160 HZ3 LYS 23 2HZ LYS 23 17.786 -1.013 -7.383 161 H ILE 24 H ILE 24 12.834 -5.096 -5.093 162 HA ILE 24 HA ILE 24 12.352 -7.819 -4.929 163 HB ILE 24 HB ILE 24 10.271 -5.562 -5.188 164 HG13 ILE 24 2HG1 ILE 24 11.895 -4.737 -3.619 165 HG21 ILE 24 1HG2 ILE 24 8.873 -6.935 -3.717 166 HG22 ILE 24 2HG2 ILE 24 9.365 -7.866 -5.120 167 HG23 ILE 24 3HG2 ILE 24 10.187 -8.128 -3.564 168 HD11 ILE 24 3HD1 ILE 24 9.530 -4.503 -2.828 169 HD12 ILE 24 1HD1 ILE 24 9.762 -5.963 -1.838 170 HD13 ILE 24 2HD1 ILE 24 10.755 -4.525 -1.541 171 H ASN 25 H ASN 25 11.369 -5.587 -7.622 172 HA ASN 25 HA ASN 25 9.846 -7.433 -9.086 173 HB3 ASN 25 2HB ASN 25 11.837 -5.403 -10.125 174 HD21 ASN 25 1HD2 ASN 25 9.105 -7.675 -10.958 175 HD22 ASN 25 2HD2 ASN 25 9.238 -7.400 -12.666 176 H SER 26 H SER 26 13.423 -6.945 -9.222 177 HA SER 26 HA SER 26 13.770 -9.072 -11.121 178 HB3 SER 26 2HB SER 26 15.844 -7.709 -9.360 179 HG SER 26 HG SER 26 16.462 -9.571 -10.583 180 H GLU 27 H GLU 27 13.178 -9.264 -7.670 181 HA GLU 27 HA GLU 27 14.520 -11.852 -7.508 182 HB3 GLU 27 2HB GLU 27 15.532 -10.604 -5.886 183 HG3 GLU 27 2HG GLU 27 12.788 -9.890 -5.205 184 H ILE 28 H ILE 28 11.490 -10.787 -8.322 185 HA ILE 28 HA ILE 28 10.340 -13.228 -7.043 186 HB ILE 28 HB ILE 28 8.916 -10.595 -7.435 187 HG13 ILE 28 2HG1 ILE 28 10.414 -10.588 -5.464 188 HG21 ILE 28 1HG2 ILE 28 7.022 -11.862 -6.330 189 HG22 ILE 28 2HG2 ILE 28 7.435 -12.494 -7.906 190 HG23 ILE 28 3HG2 ILE 28 7.992 -13.336 -6.446 191 HD11 ILE 28 3HD1 ILE 28 8.911 -10.023 -3.796 192 HD12 ILE 28 1HD1 ILE 28 8.000 -9.701 -5.276 193 HD13 ILE 28 2HD1 ILE 28 7.681 -11.173 -4.323 194 H LYS 29 H LYS 29 9.733 -14.653 -8.344 195 HA LYS 29 HA LYS 29 9.688 -14.519 -11.119 196 HB3 LYS 29 2HB LYS 29 7.741 -16.464 -10.149 197 HG3 LYS 29 2HG LYS 29 9.589 -16.444 -12.075 198 HD3 LYS 29 2HD LYS 29 10.900 -18.234 -10.019 199 HE3 LYS 29 2HE LYS 29 12.833 -18.121 -11.318 200 HZ1 LYS 29 3HZ LYS 29 10.954 -17.807 -13.515 201 HZ2 LYS 29 1HZ LYS 29 10.797 -19.132 -12.516 202 HZ3 LYS 29 2HZ LYS 29 12.199 -18.879 -13.344 203 H ASP 30 H ASP 30 8.298 -13.820 -12.589 204 HA ASP 30 HA ASP 30 6.502 -12.875 -13.535 205 HB3 ASP 30 2HB ASP 30 4.693 -14.599 -11.845 206 H SER 31 H SER 31 7.522 -11.469 -11.181 207 HA SER 31 HA SER 31 5.187 -10.130 -10.100 208 HB3 SER 31 2HB SER 31 7.275 -10.319 -8.824 209 HG SER 31 HG SER 31 8.990 -10.165 -10.117 210 H GLU 32 H GLU 32 4.864 -7.783 -10.494 211 HA GLU 32 HA GLU 32 5.974 -6.646 -12.933 212 HB3 GLU 32 2HB GLU 32 3.265 -5.851 -12.891 213 HG3 GLU 32 2HG GLU 32 4.815 -6.820 -14.829 214 H LEU 33 H LEU 33 5.590 -4.399 -13.106 215 HA LEU 33 HA LEU 33 5.649 -3.125 -10.432 216 HB3 LEU 33 2HB LEU 33 7.643 -1.996 -12.283 217 HG LEU 33 HG LEU 33 7.640 -2.009 -9.777 218 HD11 LEU 33 1HD1 LEU 33 6.966 -4.277 -9.470 219 HD12 LEU 33 2HD1 LEU 33 8.613 -4.141 -8.864 220 HD13 LEU 33 3HD1 LEU 33 8.180 -4.928 -10.464 221 HD21 LEU 33 3HD2 LEU 33 10.087 -2.318 -9.640 222 HD22 LEU 33 1HD2 LEU 33 9.640 -1.366 -11.058 223 HD23 LEU 33 2HD2 LEU 33 10.097 -3.063 -11.259 224 H LYS 34 H LYS 34 4.220 -1.445 -10.360 225 HA LYS 34 HA LYS 34 3.768 0.108 -12.861 226 HB3 LYS 34 2HB LYS 34 1.438 0.191 -11.211 227 HG3 LYS 34 2HG LYS 34 1.533 0.560 -13.686 228 HD3 LYS 34 2HD LYS 34 1.466 -2.491 -13.694 229 HE3 LYS 34 2HE LYS 34 0.349 -0.427 -15.620 230 HZ1 LYS 34 3HZ LYS 34 1.741 -1.784 -16.949 231 HZ2 LYS 34 1HZ LYS 34 0.186 -2.157 -17.283 232 HZ3 LYS 34 2HZ LYS 34 1.104 -3.183 -16.379 233 H GLU 35 H GLU 35 4.157 2.107 -12.514 234 HA GLU 35 HA GLU 35 4.326 3.202 -9.744 235 HB3 GLU 35 2HB GLU 35 6.085 4.053 -11.133 236 HG3 GLU 35 2HG GLU 35 3.890 4.850 -13.031 237 H VAL 36 H VAL 36 2.801 4.637 -8.979 238 HA VAL 36 HA VAL 36 0.111 4.467 -10.213 239 HB VAL 36 HB VAL 36 1.178 5.285 -7.489 240 HG11 VAL 36 1HG1 VAL 36 -0.855 6.495 -7.678 241 HG12 VAL 36 2HG1 VAL 36 -1.702 5.126 -8.449 242 HG13 VAL 36 3HG1 VAL 36 -1.235 5.070 -6.742 243 HG21 VAL 36 3HG2 VAL 36 -0.392 2.816 -8.309 244 HG22 VAL 36 1HG2 VAL 36 1.353 2.840 -7.936 245 HG23 VAL 36 2HG2 VAL 36 0.182 3.204 -6.677 246 H LYS 37 H LYS 37 -1.175 6.683 -10.323 247 HA LYS 37 HA LYS 37 0.513 9.098 -9.919 248 HB3 LYS 37 2HB LYS 37 -1.294 10.056 -11.668 249 HG3 LYS 37 2HG LYS 37 0.137 9.548 -13.595 250 HD3 LYS 37 2HD LYS 37 1.974 10.269 -11.315 251 HE3 LYS 37 2HE LYS 37 2.588 12.118 -12.876 252 HZ1 LYS 37 3HZ LYS 37 2.688 9.450 -14.150 253 HZ2 LYS 37 1HZ LYS 37 3.899 10.190 -13.273 254 HZ3 LYS 37 2HZ LYS 37 3.450 10.789 -14.711 255 H VAL 38 H VAL 38 -1.014 10.976 -9.602 256 HA VAL 38 HA VAL 38 -3.357 10.277 -7.911 257 HB VAL 38 HB VAL 38 -3.122 12.809 -7.252 258 HG11 VAL 38 1HG1 VAL 38 -1.856 12.156 -5.253 259 HG12 VAL 38 2HG1 VAL 38 -3.150 11.037 -5.671 260 HG13 VAL 38 3HG1 VAL 38 -1.485 10.582 -6.020 261 HG21 VAL 38 3HG2 VAL 38 -1.212 13.362 -8.701 262 HG22 VAL 38 1HG2 VAL 38 -0.869 13.639 -6.994 263 HG23 VAL 38 2HG2 VAL 38 -0.185 12.222 -7.816 264 H SER 39 H SER 39 -5.218 11.846 -8.255 265 HA SER 39 HA SER 39 -5.464 12.833 -11.004 266 HB3 SER 39 2HB SER 39 -7.882 12.850 -10.102 267 HG SER 39 HG SER 39 -7.949 10.563 -10.429 268 H GLU 40 H GLU 40 -7.283 14.741 -10.794 269 HA GLU 40 HA GLU 40 -6.215 16.833 -9.000 270 HB3 GLU 40 2HB GLU 40 -5.424 17.167 -11.324 271 HG3 GLU 40 2HG GLU 40 -8.186 18.149 -12.069 272 H GLY 41 H GLY 41 -8.286 18.726 -9.659 273 HA2 GLY 41 1HA GLY 41 -10.814 17.554 -9.774 274 HA3 GLY 41 2HA GLY 41 -10.470 17.782 -8.053 275 H THR 42 H THR 42 -9.570 19.998 -7.477 276 HA THR 42 HA THR 42 -10.941 22.197 -8.866 277 HB THR 42 HB THR 42 -12.219 22.546 -6.607 278 HG1 THR 42 1HG THR 42 -12.761 20.653 -5.577 279 HG21 THR 42 3HG2 THR 42 -13.195 20.329 -8.456 280 HG22 THR 42 1HG2 THR 42 -13.332 22.060 -8.794 281 HG23 THR 42 2HG2 THR 42 -14.175 21.354 -7.405 282 H PHE 43 H PHE 43 -9.665 21.213 -5.654 283 HA PHE 43 HA PHE 43 -8.213 22.136 -4.235 284 HB3 PHE 43 2HB PHE 43 -6.037 22.703 -5.160 285 HD1 PHE 43 2HD PHE 43 -7.062 20.220 -4.028 286 HD2 PHE 43 1HD PHE 43 -5.855 21.082 -8.083 287 HE1 PHE 43 2HE PHE 43 -6.525 17.850 -4.361 288 HE2 PHE 43 1HE PHE 43 -5.249 18.723 -8.397 289 HZ PHE 43 HZ PHE 43 -5.595 17.067 -6.548 290 H ASP 44 H ASP 44 -10.356 23.899 -4.850 291 HA ASP 44 HA ASP 44 -11.093 25.946 -4.614 292 HB3 ASP 44 2HB ASP 44 -8.557 26.817 -3.203 293 H ALA 45 H ALA 45 -9.848 25.337 -6.978 294 HA ALA 45 HA ALA 45 -9.587 26.132 -8.993 295 HB1 ALA 45 1HB ALA 45 -9.380 28.965 -7.933 296 HB2 ALA 45 2HB ALA 45 -9.450 28.463 -9.624 297 HB3 ALA 45 3HB ALA 45 -10.842 28.172 -8.580 298 H ASP 46 H ASP 46 -7.724 24.698 -8.366 299 HA ASP 46 HA ASP 46 -5.544 26.049 -9.645 300 HB3 ASP 46 2HB ASP 46 -4.617 24.375 -7.312 301 H MET 47 H MET 47 -3.887 24.330 -10.339 302 HA MET 47 HA MET 47 -5.561 22.267 -11.611 303 HB3 MET 47 2HB MET 47 -2.679 22.998 -12.266 304 HG3 MET 47 2HG MET 47 -4.930 21.576 -13.730 305 HE1 MET 47 3HE MET 47 -4.593 23.969 -16.661 306 HE2 MET 47 1HE MET 47 -5.650 23.108 -15.532 307 HE3 MET 47 2HE MET 47 -4.663 24.475 -14.961 308 H TYR 48 H TYR 48 -2.269 22.244 -10.173 309 HA TYR 48 HA TYR 48 -2.823 19.539 -9.046 310 HB3 TYR 48 2HB TYR 48 -0.261 19.593 -8.695 311 HD1 TYR 48 1HD TYR 48 -1.011 20.260 -12.269 312 HD2 TYR 48 2HD TYR 48 -0.617 17.284 -9.178 313 HE1 TYR 48 1HE TYR 48 -1.130 18.464 -13.994 314 HE2 TYR 48 2HE TYR 48 -0.766 15.482 -10.867 315 HH TYR 48 HH TYR 48 -0.827 16.210 -14.350 316 H LYS 49 H LYS 49 -2.398 19.419 -6.755 317 HA LYS 49 HA LYS 49 -1.297 21.800 -5.500 318 HB3 LYS 49 2HB LYS 49 -4.080 21.016 -4.574 319 HG3 LYS 49 2HG LYS 49 -2.712 22.544 -3.156 320 HD3 LYS 49 2HD LYS 49 -3.091 24.608 -5.372 321 HE3 LYS 49 2HE LYS 49 -1.307 25.750 -3.892 322 HZ1 LYS 49 3HZ LYS 49 -2.961 26.474 -2.262 323 HZ2 LYS 49 1HZ LYS 49 -4.023 25.351 -2.797 324 HZ3 LYS 49 2HZ LYS 49 -3.511 26.551 -3.816 325 H THR 50 H THR 50 -2.140 18.456 -5.403 326 HA THR 50 HA THR 50 -1.625 18.213 -2.525 327 HB THR 50 HB THR 50 -2.699 16.445 -4.745 328 HG1 THR 50 1HG THR 50 -4.150 17.965 -4.134 329 HG21 THR 50 3HG2 THR 50 -3.554 15.063 -2.659 330 HG22 THR 50 1HG2 THR 50 -2.193 15.804 -1.810 331 HG23 THR 50 2HG2 THR 50 -1.921 14.778 -3.241 332 H SER 51 H SER 51 0.665 18.926 -2.809 333 HA SER 51 HA SER 51 2.293 16.565 -2.708 334 HB3 SER 51 2HB SER 51 4.140 17.553 -4.089 335 HG SER 51 HG SER 51 2.046 17.434 -5.851 336 H ASP 52 H ASP 52 4.453 17.158 -1.874 337 HA ASP 52 HA ASP 52 5.780 17.947 -0.337 338 HB3 ASP 52 2HB ASP 52 4.782 20.758 -0.847 339 H ILE 53 H ILE 53 5.594 19.730 1.714 340 HA ILE 53 HA ILE 53 5.187 19.686 3.806 341 HB ILE 53 HB ILE 53 3.349 21.171 2.961 342 HG13 ILE 53 2HG1 ILE 53 2.727 20.034 5.709 343 HG21 ILE 53 1HG2 ILE 53 1.525 18.841 3.696 344 HG22 ILE 53 2HG2 ILE 53 0.993 20.518 3.439 345 HG23 ILE 53 3HG2 ILE 53 1.705 19.614 2.111 346 HD11 ILE 53 3HD1 ILE 53 5.103 20.633 5.743 347 HD12 ILE 53 1HD1 ILE 53 4.770 22.127 4.826 348 HD13 ILE 53 2HD1 ILE 53 4.167 21.932 6.479 349 H ALA 54 H ALA 54 3.483 18.492 5.628 350 HA ALA 54 HA ALA 54 3.283 15.631 5.083 351 HB1 ALA 54 1HB ALA 54 4.886 15.162 7.101 352 HB2 ALA 54 2HB ALA 54 5.610 15.573 5.562 353 HB3 ALA 54 3HB ALA 54 5.480 16.804 6.841 354 H LEU 55 H LEU 55 1.729 18.064 6.057 355 HA LEU 55 HA LEU 55 0.493 16.978 8.495 356 HB3 LEU 55 2HB LEU 55 0.386 19.366 9.346 357 HG LEU 55 HG LEU 55 2.179 17.403 9.811 358 HD11 LEU 55 1HD1 LEU 55 3.904 18.432 8.281 359 HD12 LEU 55 2HD1 LEU 55 4.414 18.102 9.934 360 HD13 LEU 55 3HD1 LEU 55 4.029 19.760 9.444 361 HD21 LEU 55 3HD2 LEU 55 2.820 18.598 11.843 362 HD22 LEU 55 1HD2 LEU 55 1.101 18.808 11.501 363 HD23 LEU 55 2HD2 LEU 55 2.231 20.127 11.147 364 H ASP 56 H ASP 56 0.003 17.318 5.400 365 HA ASP 56 HA ASP 56 -2.654 18.531 5.465 366 HB3 ASP 56 2HB ASP 56 -1.294 18.746 3.428 367 H GLN 57 H GLN 57 -4.254 16.815 4.483 368 HA GLN 57 HA GLN 57 -5.709 15.326 5.136 369 HB3 GLN 57 2HB GLN 57 -3.929 13.052 4.592 370 HG3 GLN 57 2HG GLN 57 -5.422 12.833 2.643 371 HE21 GLN 57 1HE2 GLN 57 -6.120 11.070 4.002 372 HE22 GLN 57 2HE2 GLN 57 -7.518 11.191 5.048 373 H ILE 58 H ILE 58 -3.923 15.893 7.599 374 HA ILE 58 HA ILE 58 -4.599 13.389 9.118 375 HB ILE 58 HB ILE 58 -2.378 15.396 9.474 376 HG13 ILE 58 2HG1 ILE 58 -2.177 13.411 7.772 377 HG21 ILE 58 1HG2 ILE 58 -3.282 14.765 11.715 378 HG22 ILE 58 2HG2 ILE 58 -3.110 13.061 11.301 379 HG23 ILE 58 3HG2 ILE 58 -1.681 14.105 11.478 380 HD11 ILE 58 3HD1 ILE 58 -0.248 14.738 8.521 381 HD12 ILE 58 1HD1 ILE 58 -0.118 13.712 9.978 382 HD13 ILE 58 2HD1 ILE 58 0.147 13.017 8.387 383 H GLN 59 H GLN 59 -4.178 16.958 9.612 384 HA GLN 59 HA GLN 59 -6.139 16.891 11.783 385 HB3 GLN 59 2HB GLN 59 -4.094 16.613 12.871 386 HG3 GLN 59 2HG GLN 59 -2.752 18.903 11.416 387 HE21 GLN 59 1HE2 GLN 59 -0.638 16.403 11.384 388 HE22 GLN 59 2HE2 GLN 59 0.137 16.628 12.932 389 H GLY 60 H GLY 60 -7.711 17.951 10.660 390 HA2 GLY 60 1HA GLY 60 -8.769 20.072 10.385 391 HA3 GLY 60 2HA GLY 60 -7.211 20.823 10.052 392 H ASN 61 H ASN 61 -6.200 18.822 8.241 393 HA ASN 61 HA ASN 61 -7.667 19.910 5.899 394 HB3 ASN 61 2HB ASN 61 -5.121 18.349 5.706 395 HD21 ASN 61 1HD2 ASN 61 -3.810 20.497 4.249 396 HD22 ASN 61 2HD2 ASN 61 -4.628 20.616 2.745 397 H LYS 62 H LYS 62 -8.755 18.679 4.390 398 HA LYS 62 HA LYS 62 -9.289 15.847 5.154 399 HB3 LYS 62 2HB LYS 62 -11.791 16.620 4.933 400 HG3 LYS 62 2HG LYS 62 -10.055 17.436 7.302 401 HD3 LYS 62 2HD LYS 62 -13.077 17.279 7.108 402 HE3 LYS 62 2HE LYS 62 -11.193 17.231 9.494 403 HZ1 LYS 62 3HZ LYS 62 -12.924 18.669 10.092 404 HZ2 LYS 62 1HZ LYS 62 -13.288 17.226 10.777 405 HZ3 LYS 62 2HZ LYS 62 -14.095 17.741 9.417 406 H ASP 63 H ASP 63 -10.534 14.696 3.609 407 HA ASP 63 HA ASP 63 -10.794 13.719 1.667 408 HB3 ASP 63 2HB ASP 63 -11.137 15.211 -0.459 409 H PHE 64 H PHE 64 -9.784 13.485 -0.647 410 HA PHE 64 HA PHE 64 -7.177 14.666 -1.017 411 HB3 PHE 64 2HB PHE 64 -6.316 12.923 0.255 412 HD1 PHE 64 1HD PHE 64 -8.264 10.764 -2.151 413 HD2 PHE 64 2HD PHE 64 -7.284 11.643 1.929 414 HE1 PHE 64 1HE PHE 64 -9.518 8.763 -1.424 415 HE2 PHE 64 2HE PHE 64 -8.504 9.612 2.681 416 HZ PHE 64 HZ PHE 64 -9.672 8.184 0.994 417 HA PRO 65 HA PRO 65 -8.606 13.758 -5.236 418 HB3 PRO 65 2HB PRO 65 -6.795 14.966 -6.044 419 HG3 PRO 65 2HG PRO 65 -4.631 14.754 -5.066 420 HD3 PRO 65 2HD PRO 65 -6.040 15.301 -3.242 421 H GLU 66 H GLU 66 -8.957 11.926 -6.662 422 HA GLU 66 HA GLU 66 -8.490 9.301 -5.775 423 HB3 GLU 66 2HB GLU 66 -8.944 9.765 -8.656 424 HG3 GLU 66 2HG GLU 66 -11.215 8.748 -7.983 425 H ILE 67 H ILE 67 -7.520 7.939 -7.966 426 HA ILE 67 HA ILE 67 -4.685 8.776 -8.207 427 HB ILE 67 HB ILE 67 -4.211 6.305 -8.447 428 HG13 ILE 67 2HG1 ILE 67 -6.572 5.584 -8.808 429 HG21 ILE 67 1HG2 ILE 67 -5.122 7.303 -5.732 430 HG22 ILE 67 2HG2 ILE 67 -3.970 5.982 -6.032 431 HG23 ILE 67 3HG2 ILE 67 -3.566 7.631 -6.496 432 HD11 ILE 67 3HD1 ILE 67 -5.448 4.249 -6.330 433 HD12 ILE 67 1HD1 ILE 67 -6.498 3.543 -7.570 434 HD13 ILE 67 2HD1 ILE 67 -4.822 3.962 -7.978 435 H GLN 68 H GLN 68 -3.695 7.670 -10.162 436 HA GLN 68 HA GLN 68 -5.631 7.133 -12.298 437 HB3 GLN 68 2HB GLN 68 -3.698 8.198 -13.826 438 HG3 GLN 68 2HG GLN 68 -6.026 9.592 -12.460 439 HE21 GLN 68 1HE2 GLN 68 -4.222 11.450 -12.127 440 HE22 GLN 68 2HE2 GLN 68 -4.259 12.611 -13.417 441 H LEU 69 H LEU 69 -5.142 5.408 -13.408 442 HA LEU 69 HA LEU 69 -2.606 4.246 -13.689 443 HB3 LEU 69 2HB LEU 69 -3.044 3.598 -11.288 444 HG LEU 69 HG LEU 69 -4.846 1.434 -12.386 445 HD11 LEU 69 1HD1 LEU 69 -5.070 0.832 -10.038 446 HD12 LEU 69 2HD1 LEU 69 -4.121 2.249 -9.546 447 HD13 LEU 69 3HD1 LEU 69 -3.357 0.938 -10.470 448 HD21 LEU 69 3HD2 LEU 69 -6.294 3.421 -12.366 449 HD22 LEU 69 1HD2 LEU 69 -5.736 3.854 -10.733 450 HD23 LEU 69 2HD2 LEU 69 -6.707 2.390 -11.004 451 H ASP 70 H ASP 70 -3.175 1.770 -14.373 452 HA ASP 70 HA ASP 70 -4.673 1.964 -16.878 453 HB3 ASP 70 2HB ASP 70 -3.625 -0.590 -15.786 454 H ASN 71 H ASN 71 -6.000 -0.335 -17.264 455 HA ASN 71 HA ASN 71 -7.866 -0.727 -14.954 456 HB3 ASN 71 2HB ASN 71 -7.897 -2.195 -17.578 457 HD21 ASN 71 1HD2 ASN 71 -8.260 -4.049 -15.926 458 HD22 ASN 71 2HD2 ASN 71 -9.865 -4.166 -15.178 459 H ILE 72 H ILE 72 -6.341 -1.464 -13.579 460 HA ILE 72 HA ILE 72 -4.898 -4.014 -14.193 461 HB ILE 72 HB ILE 72 -4.677 -2.406 -11.646 462 HG13 ILE 72 2HG1 ILE 72 -3.936 -0.960 -13.470 463 HG21 ILE 72 1HG2 ILE 72 -2.849 -4.522 -12.842 464 HG22 ILE 72 2HG2 ILE 72 -2.728 -3.753 -11.240 465 HG23 ILE 72 3HG2 ILE 72 -4.068 -4.830 -11.581 466 HD11 ILE 72 3HD1 ILE 72 -2.646 -1.146 -11.241 467 HD12 ILE 72 1HD1 ILE 72 -1.401 -1.964 -12.210 468 HD13 ILE 72 2HD1 ILE 72 -1.920 -0.306 -12.611 469 H ASP 73 H ASP 73 -5.873 -5.822 -13.655 470 HA ASP 73 HA ASP 73 -8.232 -5.655 -11.851 471 HB3 ASP 73 2HB ASP 73 -7.572 -7.927 -13.729 472 H TYR 74 H TYR 74 -7.768 -6.220 -9.800 473 HA TYR 74 HA TYR 74 -5.096 -7.017 -9.237 474 HB3 TYR 74 2HB TYR 74 -5.765 -6.860 -6.904 475 HD1 TYR 74 2HD TYR 74 -4.445 -4.901 -8.386 476 HD2 TYR 74 1HD TYR 74 -8.573 -4.835 -7.159 477 HE1 TYR 74 2HE TYR 74 -4.484 -2.425 -8.646 478 HE2 TYR 74 1HE TYR 74 -8.627 -2.382 -7.429 479 HH TYR 74 HH TYR 74 -6.704 -0.734 -9.232 480 H ASN 75 H ASN 75 -8.036 -8.898 -9.589 481 HA ASN 75 HA ASN 75 -7.326 -11.175 -8.024 482 HB3 ASN 75 2HB ASN 75 -8.970 -12.395 -9.341 483 HD21 ASN 75 1HD2 ASN 75 -9.362 -10.784 -6.993 484 HD22 ASN 75 2HD2 ASN 75 -10.922 -9.995 -7.188 485 H ASN 76 H ASN 76 -6.296 -10.075 -11.226 486 HA ASN 76 HA ASN 76 -5.330 -12.580 -12.244 487 HB3 ASN 76 2HB ASN 76 -3.818 -11.104 -13.650 488 HD21 ASN 76 1HD2 ASN 76 -5.364 -8.799 -14.712 489 HD22 ASN 76 2HD2 ASN 76 -6.740 -9.501 -15.531 490 H TYR 77 H TYR 77 -4.202 -10.817 -9.527 491 HA TYR 77 HA TYR 77 -1.513 -12.012 -9.764 492 HB3 TYR 77 2HB TYR 77 -0.641 -10.107 -8.502 493 HD1 TYR 77 2HD TYR 77 -3.454 -8.466 -10.339 494 HD2 TYR 77 1HD TYR 77 0.667 -9.731 -10.546 495 HE1 TYR 77 2HE TYR 77 -3.185 -7.222 -12.426 496 HE2 TYR 77 1HE TYR 77 0.944 -8.527 -12.657 497 HH TYR 77 HH TYR 77 -0.100 -7.219 -14.275 498 H ASP 78 H ASP 78 -0.568 -12.557 -7.630 499 HA ASP 78 HA ASP 78 -2.693 -13.439 -5.702 500 HB3 ASP 78 2HB ASP 78 -0.008 -14.757 -5.966 501 H LEU 79 H LEU 79 0.209 -11.578 -6.081 502 HA LEU 79 HA LEU 79 0.421 -11.037 -3.164 503 HB3 LEU 79 2HB LEU 79 2.891 -10.438 -4.222 504 HG LEU 79 HG LEU 79 1.994 -13.136 -3.155 505 HD11 LEU 79 1HD1 LEU 79 4.051 -13.376 -4.584 506 HD12 LEU 79 2HD1 LEU 79 4.322 -13.654 -2.843 507 HD13 LEU 79 3HD1 LEU 79 4.844 -12.135 -3.569 508 HD21 LEU 79 3HD2 LEU 79 3.606 -10.822 -1.994 509 HD22 LEU 79 1HD2 LEU 79 3.352 -12.366 -1.185 510 HD23 LEU 79 2HD2 LEU 79 1.953 -11.319 -1.532 511 H ILE 80 H ILE 80 0.430 -8.848 -2.638 512 HA ILE 80 HA ILE 80 0.679 -6.848 -4.826 513 HB ILE 80 HB ILE 80 -1.646 -7.014 -2.870 514 HG13 ILE 80 2HG1 ILE 80 -1.833 -8.472 -4.879 515 HG21 ILE 80 1HG2 ILE 80 -0.885 -4.680 -3.059 516 HG22 ILE 80 2HG2 ILE 80 -0.840 -4.803 -4.828 517 HG23 ILE 80 3HG2 ILE 80 -2.384 -4.866 -3.957 518 HD11 ILE 80 3HD1 ILE 80 -3.868 -7.802 -5.850 519 HD12 ILE 80 1HD1 ILE 80 -3.938 -7.315 -4.151 520 HD13 ILE 80 2HD1 ILE 80 -3.642 -6.108 -5.437 521 H LEU 81 H LEU 81 2.482 -5.850 -4.275 522 HA LEU 81 HA LEU 81 3.165 -5.241 -1.463 523 HB3 LEU 81 2HB LEU 81 5.241 -4.280 -2.865 524 HG LEU 81 HG LEU 81 6.344 -6.515 -3.023 525 HD11 LEU 81 1HD1 LEU 81 6.382 -6.797 -0.544 526 HD12 LEU 81 2HD1 LEU 81 5.076 -5.605 -0.424 527 HD13 LEU 81 3HD1 LEU 81 6.659 -5.143 -1.099 528 HD21 LEU 81 3HD2 LEU 81 4.379 -7.951 -3.375 529 HD22 LEU 81 1HD2 LEU 81 3.766 -7.522 -1.764 530 HD23 LEU 81 2HD2 LEU 81 5.264 -8.434 -1.926 531 H ILE 82 H ILE 82 3.017 -3.214 -0.696 532 HA ILE 82 HA ILE 82 2.352 -1.007 -2.597 533 HB ILE 82 HB ILE 82 1.226 -1.560 0.182 534 HG13 ILE 82 2HG1 ILE 82 0.299 -3.128 -1.455 535 HG21 ILE 82 1HG2 ILE 82 0.599 0.618 -1.866 536 HG22 ILE 82 2HG2 ILE 82 -0.218 0.374 -0.298 537 HG23 ILE 82 3HG2 ILE 82 1.462 0.841 -0.313 538 HD11 ILE 82 3HD1 ILE 82 -1.783 -0.935 -1.199 539 HD12 ILE 82 1HD1 ILE 82 -2.018 -2.666 -1.447 540 HD13 ILE 82 2HD1 ILE 82 -1.366 -2.075 0.108 541 H GLY 83 H GLY 83 3.659 0.710 -2.516 542 HA2 GLY 83 1HA GLY 83 5.485 1.018 -0.169 543 HA3 GLY 83 2HA GLY 83 5.970 1.262 -1.845 544 H SER 84 H SER 84 5.561 2.970 0.842 545 HA SER 84 HA SER 84 4.896 5.429 -0.590 546 HB3 SER 84 2HB SER 84 2.732 4.909 0.195 547 HG SER 84 HG SER 84 3.123 3.272 1.663 548 HA PRO 85 HA PRO 85 7.907 6.845 2.481 549 HB3 PRO 85 2HB PRO 85 8.241 8.565 0.914 550 HG3 PRO 85 2HG PRO 85 6.402 9.747 -0.019 551 HD3 PRO 85 2HD PRO 85 5.890 7.555 -0.587 552 H VAL 86 H VAL 86 8.099 8.249 4.501 553 HA VAL 86 HA VAL 86 5.661 8.723 6.044 554 HB VAL 86 HB VAL 86 7.819 6.935 7.231 555 HG11 VAL 86 1HG1 VAL 86 4.888 7.382 7.950 556 HG12 VAL 86 2HG1 VAL 86 6.005 6.285 8.781 557 HG13 VAL 86 3HG1 VAL 86 6.291 8.018 8.840 558 HG21 VAL 86 3HG2 VAL 86 5.363 5.961 5.784 559 HG22 VAL 86 1HG2 VAL 86 7.060 5.661 5.350 560 HG23 VAL 86 2HG2 VAL 86 6.395 4.960 6.842 561 H TRP 87 H TRP 87 6.225 10.135 7.913 562 HA TRP 87 HA TRP 87 9.012 10.549 8.450 563 HB3 TRP 87 2HB TRP 87 7.699 13.103 7.554 564 HD1 TRP 87 HD TRP 87 10.748 11.487 5.985 565 HE1 TRP 87 1HE TRP 87 12.897 12.722 6.669 566 HE3 TRP 87 3HE TRP 87 8.735 14.757 9.341 567 HZ2 TRP 87 2HZ TRP 87 13.669 14.678 8.677 568 HZ3 TRP 87 3HZ TRP 87 10.192 16.307 10.628 569 HH2 TRP 87 HH TRP 87 12.656 16.248 10.318 570 H SER 88 H SER 88 5.823 11.343 9.262 571 HA SER 88 HA SER 88 6.802 11.994 11.966 572 HB3 SER 88 2HB SER 88 6.495 14.096 10.971 573 HG SER 88 HG SER 88 5.120 14.589 9.524 574 H GLY 89 H GLY 89 5.372 9.578 10.823 575 HA2 GLY 89 1HA GLY 89 3.807 8.319 12.238 576 HA3 GLY 89 2HA GLY 89 2.696 9.694 12.170 577 H TYR 90 H TYR 90 2.010 10.372 9.854 578 HA TYR 90 HA TYR 90 1.793 8.237 7.870 579 HB3 TYR 90 2HB TYR 90 0.149 7.471 9.310 580 HD1 TYR 90 1HD TYR 90 0.221 11.126 9.888 581 HD2 TYR 90 2HD TYR 90 -2.153 7.581 10.472 582 HE1 TYR 90 1HE TYR 90 -0.704 12.086 11.920 583 HE2 TYR 90 2HE TYR 90 -3.066 8.515 12.526 584 HH TYR 90 HH TYR 90 -3.085 10.324 13.948 585 HA PRO 91 HA PRO 91 1.513 12.854 6.829 586 HB3 PRO 91 2HB PRO 91 3.745 13.263 6.985 587 HG3 PRO 91 2HG PRO 91 5.364 11.622 6.482 588 HD3 PRO 91 2HD PRO 91 3.929 10.738 8.154 589 H ALA 92 H ALA 92 2.394 10.229 4.505 590 HA ALA 92 HA ALA 92 1.233 11.786 2.321 591 HB1 ALA 92 1HB ALA 92 3.387 10.433 2.183 592 HB2 ALA 92 2HB ALA 92 2.405 8.952 2.306 593 HB3 ALA 92 3HB ALA 92 2.215 10.055 0.932 594 H THR 93 H THR 93 -0.595 10.933 1.033 595 HA THR 93 HA THR 93 -2.005 8.557 2.159 596 HB THR 93 HB THR 93 -4.179 9.885 1.537 597 HG1 THR 93 1HG THR 93 -2.347 11.959 2.190 598 HG21 THR 93 3HG2 THR 93 -3.757 9.063 3.745 599 HG22 THR 93 1HG2 THR 93 -4.377 10.711 3.829 600 HG23 THR 93 2HG2 THR 93 -2.651 10.421 4.097 601 HA PRO 94 HA PRO 94 -1.935 7.925 -2.353 602 HB3 PRO 94 2HB PRO 94 0.293 8.253 -2.858 603 HG3 PRO 94 2HG PRO 94 2.055 7.842 -1.250 604 HD3 PRO 94 2HD PRO 94 0.615 9.491 -0.406 605 H ILE 95 H ILE 95 -1.382 6.327 0.772 606 HA ILE 95 HA ILE 95 -2.544 3.841 -0.369 607 HB ILE 95 HB ILE 95 -1.131 3.967 2.285 608 HG13 ILE 95 2HG1 ILE 95 0.895 3.015 1.239 609 HG21 ILE 95 1HG2 ILE 95 -2.427 2.036 2.086 610 HG22 ILE 95 2HG2 ILE 95 -1.949 1.750 0.399 611 HG23 ILE 95 3HG2 ILE 95 -0.790 1.521 1.721 612 HD11 ILE 95 3HD1 ILE 95 -0.234 2.799 -1.185 613 HD12 ILE 95 1HD1 ILE 95 0.308 4.482 -1.316 614 HD13 ILE 95 2HD1 ILE 95 1.485 3.223 -0.987 615 H LYS 96 H LYS 96 -4.259 5.459 -0.241 616 HA LYS 96 HA LYS 96 -6.077 4.712 1.970 617 HB3 LYS 96 2HB LYS 96 -7.027 7.232 0.999 618 HG3 LYS 96 2HG LYS 96 -6.357 8.065 3.305 619 HD3 LYS 96 2HD LYS 96 -7.949 5.463 3.265 620 HE3 LYS 96 2HE LYS 96 -7.802 7.906 5.076 621 HZ1 LYS 96 3HZ LYS 96 -10.108 7.405 4.640 622 HZ2 LYS 96 1HZ LYS 96 -9.707 7.158 6.176 623 HZ3 LYS 96 2HZ LYS 96 -9.937 5.855 5.197 624 H THR 97 H THR 97 -5.806 6.326 -1.231 625 HA THR 97 HA THR 97 -8.246 5.713 -2.196 626 HB THR 97 HB THR 97 -5.809 6.035 -3.973 627 HG1 THR 97 1HG THR 97 -5.590 8.242 -3.262 628 HG21 THR 97 3HG2 THR 97 -8.013 6.323 -4.941 629 HG22 THR 97 1HG2 THR 97 -7.142 7.860 -4.950 630 HG23 THR 97 2HG2 THR 97 -8.419 7.590 -3.750 631 H LEU 98 H LEU 98 -5.303 3.754 -2.594 632 HA LEU 98 HA LEU 98 -6.352 1.995 -4.617 633 HB3 LEU 98 2HB LEU 98 -4.391 0.830 -2.693 634 HG LEU 98 HG LEU 98 -2.952 0.525 -4.588 635 HD11 LEU 98 1HD1 LEU 98 -5.794 -0.271 -5.338 636 HD12 LEU 98 2HD1 LEU 98 -4.729 -1.143 -4.212 637 HD13 LEU 98 3HD1 LEU 98 -4.299 -1.002 -5.921 638 HD21 LEU 98 3HD2 LEU 98 -5.018 1.883 -6.330 639 HD22 LEU 98 1HD2 LEU 98 -3.471 1.235 -6.835 640 HD23 LEU 98 2HD2 LEU 98 -3.515 2.672 -5.781 641 H LEU 99 H LEU 99 -6.244 1.859 -1.011 642 HA LEU 99 HA LEU 99 -7.313 -0.715 -0.654 643 HB3 LEU 99 2HB LEU 99 -8.148 0.283 1.501 644 HG LEU 99 HG LEU 99 -6.203 0.006 2.461 645 HD11 LEU 99 1HD1 LEU 99 -4.950 -0.539 -0.196 646 HD12 LEU 99 2HD1 LEU 99 -5.889 -1.675 0.795 647 HD13 LEU 99 3HD1 LEU 99 -4.364 -1.045 1.403 648 HD21 LEU 99 3HD2 LEU 99 -4.689 1.473 2.766 649 HD22 LEU 99 1HD2 LEU 99 -5.541 2.481 1.624 650 HD23 LEU 99 2HD2 LEU 99 -4.180 1.407 1.101 651 H ASP 100 H ASP 100 -8.908 2.421 -1.191 652 HA ASP 100 HA ASP 100 -11.562 1.626 -0.760 653 HB3 ASP 100 2HB ASP 100 -10.880 3.699 -2.792 654 H GLN 101 H GLN 101 -9.419 0.890 -3.343 655 HA GLN 101 HA GLN 101 -11.569 0.229 -5.288 656 HB3 GLN 101 2HB GLN 101 -9.763 0.014 -6.906 657 HG3 GLN 101 2HG GLN 101 -9.081 2.659 -5.659 658 HE21 GLN 101 1HE2 GLN 101 -9.352 4.571 -7.375 659 HE22 GLN 101 2HE2 GLN 101 -9.084 4.046 -8.995 660 H MET 102 H MET 102 -9.604 -1.253 -2.837 661 HA MET 102 HA MET 102 -9.918 -3.863 -4.202 662 HB3 MET 102 2HB MET 102 -8.089 -4.780 -3.245 663 HG3 MET 102 2HG MET 102 -6.745 -2.147 -3.387 664 HE1 MET 102 3HE MET 102 -6.049 -5.823 -2.770 665 HE2 MET 102 1HE MET 102 -4.328 -5.401 -2.833 666 HE3 MET 102 2HE MET 102 -5.466 -4.349 -1.968 667 H LYS 103 H LYS 103 -12.163 -2.938 -2.731 668 HA LYS 103 HA LYS 103 -11.915 -3.815 0.022 669 HB3 LYS 103 2HB LYS 103 -14.284 -3.297 0.299 670 HG3 LYS 103 2HG LYS 103 -14.616 -1.115 -0.707 671 HD3 LYS 103 2HD LYS 103 -12.244 -0.106 -0.187 672 HE3 LYS 103 2HE LYS 103 -12.527 -0.661 2.311 673 HZ1 LYS 103 3HZ LYS 103 -13.337 1.382 1.574 674 HZ2 LYS 103 1HZ LYS 103 -14.536 0.696 2.425 675 HZ3 LYS 103 2HZ LYS 103 -14.608 0.758 0.756 676 H ASN 104 H ASN 104 -12.732 -5.780 -2.756 677 HA ASN 104 HA ASN 104 -13.546 -7.923 -0.838 678 HB3 ASN 104 2HB ASN 104 -15.049 -8.655 -2.946 679 HD21 ASN 104 1HD2 ASN 104 -15.114 -6.223 -0.257 680 HD22 ASN 104 2HD2 ASN 104 -16.714 -6.680 0.261 681 H TYR 105 H TYR 105 -10.984 -7.467 -1.683 682 HA TYR 105 HA TYR 105 -10.352 -9.583 -3.702 683 HB3 TYR 105 2HB TYR 105 -8.028 -8.448 -3.509 684 HD1 TYR 105 1HD TYR 105 -10.518 -5.966 -3.352 685 HD2 TYR 105 2HD TYR 105 -8.626 -8.711 -5.953 686 HE1 TYR 105 1HE TYR 105 -11.788 -4.907 -5.340 687 HE2 TYR 105 2HE TYR 105 -9.780 -7.710 -7.930 688 HH TYR 105 HH TYR 105 -10.954 -5.879 -8.645 689 H ARG 106 H ARG 106 -8.355 -10.735 -3.344 690 HA ARG 106 HA ARG 106 -7.864 -11.683 -0.587 691 HB3 ARG 106 2HB ARG 106 -7.632 -13.957 -1.455 692 HG3 ARG 106 2HG ARG 106 -10.422 -13.205 -2.280 693 HD3 ARG 106 2HD ARG 106 -9.604 -15.072 -0.040 694 HE ARG 106 HE ARG 106 -11.527 -15.530 -2.283 695 HH11 ARG 106 1HH1 ARG 106 -11.025 -15.445 1.264 696 HH12 ARG 106 2HH1 ARG 106 -12.624 -15.961 1.623 697 HH21 ARG 106 1HH2 ARG 106 -13.483 -16.439 -1.810 698 HH22 ARG 106 2HH2 ARG 106 -14.044 -16.657 -0.181 699 H GLY 107 H GLY 107 -5.740 -13.393 -1.357 700 HA2 GLY 107 1HA GLY 107 -3.676 -13.362 -2.589 701 HA3 GLY 107 2HA GLY 107 -3.832 -11.605 -2.787 702 H GLU 108 H GLU 108 -1.522 -11.879 -1.818 703 HA GLU 108 HA GLU 108 -1.509 -11.946 1.118 704 HB3 GLU 108 2HB GLU 108 0.240 -12.954 -1.163 705 HG3 GLU 108 2HG GLU 108 0.876 -12.973 1.788 706 H VAL 109 H VAL 109 -1.421 -9.813 1.795 707 HA VAL 109 HA VAL 109 -0.280 -7.885 -0.142 708 HB VAL 109 HB VAL 109 -2.276 -7.404 2.083 709 HG11 VAL 109 1HG1 VAL 109 -2.829 -5.437 0.743 710 HG12 VAL 109 2HG1 VAL 109 -1.130 -5.381 1.225 711 HG13 VAL 109 3HG1 VAL 109 -1.564 -5.827 -0.443 712 HG21 VAL 109 3HG2 VAL 109 -2.718 -8.160 -0.859 713 HG22 VAL 109 1HG2 VAL 109 -3.354 -8.993 0.578 714 HG23 VAL 109 2HG2 VAL 109 -3.964 -7.401 0.144 715 H ALA 110 H ALA 110 1.643 -6.995 0.303 716 HA ALA 110 HA ALA 110 2.481 -6.656 3.144 717 HB1 ALA 110 1HB ALA 110 3.789 -8.389 2.109 718 HB2 ALA 110 2HB ALA 110 4.131 -7.360 0.708 719 HB3 ALA 110 3HB ALA 110 4.780 -6.932 2.301 720 H SER 111 H SER 111 3.887 -4.893 3.577 721 HA SER 111 HA SER 111 3.623 -2.591 1.712 722 HB3 SER 111 2HB SER 111 3.135 -1.197 3.722 723 HG SER 111 HG SER 111 1.242 -3.297 3.475 724 H PHE 112 H PHE 112 5.500 -1.576 1.387 725 HA PHE 112 HA PHE 112 7.816 -2.189 3.161 726 HB3 PHE 112 2HB PHE 112 7.863 -3.514 1.101 727 HD1 PHE 112 2HD PHE 112 5.862 -2.962 -0.528 728 HD2 PHE 112 1HD PHE 112 9.644 -0.886 -0.548 729 HE1 PHE 112 2HE PHE 112 5.362 -2.045 -2.755 730 HE2 PHE 112 1HE PHE 112 9.127 -0.033 -2.856 731 HZ PHE 112 HZ PHE 112 6.991 -0.613 -3.927 732 H PHE 113 H PHE 113 8.909 -0.325 3.885 733 HA PHE 113 HA PHE 113 8.482 2.166 2.320 734 HB3 PHE 113 2HB PHE 113 6.898 2.064 4.314 735 HD1 PHE 113 1HD PHE 113 8.091 0.281 5.977 736 HD2 PHE 113 2HD PHE 113 8.836 4.508 5.932 737 HE1 PHE 113 1HE PHE 113 8.897 0.136 8.304 738 HE2 PHE 113 2HE PHE 113 9.486 4.408 8.310 739 HZ PHE 113 HZ PHE 113 9.609 2.233 9.490 740 H THR 114 H THR 114 10.039 3.902 2.803 741 HA THR 114 HA THR 114 12.734 2.732 3.251 742 HB THR 114 HB THR 114 13.402 4.339 1.482 743 HG1 THR 114 1HG THR 114 10.617 4.696 0.985 744 HG21 THR 114 3HG2 THR 114 12.541 3.113 -0.400 745 HG22 THR 114 1HG2 THR 114 11.185 2.472 0.555 746 HG23 THR 114 2HG2 THR 114 12.848 2.007 0.956 747 H SER 115 H SER 115 10.758 4.628 4.910 748 HA SER 115 HA SER 115 12.487 7.029 5.092 749 HB3 SER 115 2HB SER 115 10.521 8.238 5.041 750 HG SER 115 HG SER 115 11.034 7.274 2.975 751 H ALA 116 H ALA 116 12.726 4.976 6.932 752 HA ALA 116 HA ALA 116 11.074 5.445 9.272 753 HB1 ALA 116 1HB ALA 116 11.933 3.166 8.408 754 HB2 ALA 116 2HB ALA 116 13.452 3.593 9.224 755 HB3 ALA 116 3HB ALA 116 11.949 3.464 10.150 756 H GLY 117 H GLY 117 12.814 7.726 8.657 757 HA2 GLY 117 1HA GLY 117 15.065 7.974 10.367 758 HA3 GLY 117 2HA GLY 117 14.044 9.307 9.804 759 H THR 118 H THR 118 11.660 8.985 10.924 760 HA THR 118 HA THR 118 12.199 8.878 13.858 761 HB THR 118 HB THR 118 10.146 10.735 12.673 762 HG1 THR 118 1HG THR 118 11.908 11.233 11.437 763 HG21 THR 118 3HG2 THR 118 10.807 12.131 14.538 764 HG22 THR 118 1HG2 THR 118 12.185 11.056 14.924 765 HG23 THR 118 2HG2 THR 118 10.509 10.512 15.166 766 H ASN 119 H ASN 119 10.626 6.992 11.649 767 HA ASN 119 HA ASN 119 8.368 6.414 13.493 768 HB3 ASN 119 2HB ASN 119 6.890 6.202 11.439 769 HD21 ASN 119 1HD2 ASN 119 6.310 6.952 13.810 770 HD22 ASN 119 2HD2 ASN 119 5.979 8.635 14.012 771 H HIS 120 H HIS 120 8.006 4.335 13.691 772 HA HIS 120 HA HIS 120 8.093 2.639 11.367 773 HB3 HIS 120 2HB HIS 120 9.598 1.670 13.852 774 HD1 HIS 120 1HD HIS 120 10.903 -0.745 13.298 775 HD2 HIS 120 2HD HIS 120 7.970 0.540 10.531 776 HE1 HIS 120 1HE HIS 120 10.503 -2.659 11.713 777 H LYS 121 H LYS 121 7.920 2.143 14.922 778 HA LYS 121 HA LYS 121 5.759 0.530 15.111 779 HB3 LYS 121 2HB LYS 121 5.396 1.658 17.398 780 HG3 LYS 121 2HG LYS 121 8.229 0.809 16.659 781 HD3 LYS 121 2HD LYS 121 6.732 0.771 19.319 782 HE3 LYS 121 2HE LYS 121 9.366 -0.410 18.371 783 HZ1 LYS 121 3HZ LYS 121 8.674 0.323 21.154 784 HZ2 LYS 121 1HZ LYS 121 9.927 0.877 20.245 785 HZ3 LYS 121 2HZ LYS 121 9.922 -0.695 20.710 786 H ALA 122 H ALA 122 5.456 4.153 15.084 787 HA ALA 122 HA ALA 122 2.647 4.136 15.449 788 HB1 ALA 122 1HB ALA 122 2.767 6.427 14.550 789 HB2 ALA 122 2HB ALA 122 4.041 6.135 15.730 790 HB3 ALA 122 3HB ALA 122 4.435 6.141 13.993 791 H TYR 123 H TYR 123 4.595 3.977 12.441 792 HA TYR 123 HA TYR 123 2.453 4.548 10.646 793 HB3 TYR 123 2HB TYR 123 5.141 3.208 10.276 794 HD1 TYR 123 1HD TYR 123 3.377 5.539 7.965 795 HD2 TYR 123 2HD TYR 123 4.508 1.454 8.720 796 HE1 TYR 123 1HE TYR 123 3.005 4.993 5.577 797 HE2 TYR 123 2HE TYR 123 4.141 0.902 6.328 798 HH TYR 123 HH TYR 123 3.154 3.352 3.911 799 H VAL 124 H VAL 124 3.627 1.488 12.084 800 HA VAL 124 HA VAL 124 2.205 -0.330 10.445 801 HB VAL 124 HB VAL 124 2.750 -0.465 13.446 802 HG11 VAL 124 1HG1 VAL 124 1.186 -2.239 12.724 803 HG12 VAL 124 2HG1 VAL 124 2.349 -2.759 11.471 804 HG13 VAL 124 3HG1 VAL 124 2.747 -2.907 13.188 805 HG21 VAL 124 3HG2 VAL 124 4.467 -1.230 11.015 806 HG22 VAL 124 1HG2 VAL 124 4.884 -0.109 12.321 807 HG23 VAL 124 2HG2 VAL 124 4.767 -1.837 12.652 808 H SER 125 H SER 125 1.213 1.174 13.580 809 HA SER 125 HA SER 125 -1.409 0.132 13.581 810 HB3 SER 125 2HB SER 125 -1.562 2.182 15.221 811 HG SER 125 HG SER 125 -0.373 0.923 16.712 812 H HIS 126 H HIS 126 -0.104 3.289 12.485 813 HA HIS 126 HA HIS 126 -2.538 4.422 11.750 814 HB3 HIS 126 2HB HIS 126 -1.132 5.755 10.144 815 HD1 HIS 126 1HD HIS 126 1.538 6.854 11.313 816 HD2 HIS 126 2HD HIS 126 -1.895 5.826 13.526 817 HE1 HIS 126 1HE HIS 126 1.575 8.280 13.477 818 H PHE 127 H PHE 127 -0.335 2.307 9.825 819 HA PHE 127 HA PHE 127 -1.825 2.487 7.380 820 HB3 PHE 127 2HB PHE 127 0.187 0.472 8.441 821 HD1 PHE 127 1HD PHE 127 -1.211 1.704 5.158 822 HD2 PHE 127 2HD PHE 127 -0.056 -1.672 7.554 823 HE1 PHE 127 1HE PHE 127 -1.709 0.177 3.254 824 HE2 PHE 127 2HE PHE 127 -0.608 -3.200 5.677 825 HZ PHE 127 HZ PHE 127 -1.396 -2.259 3.516 826 H ASN 128 H ASN 128 -1.910 0.212 10.151 827 HA ASN 128 HA ASN 128 -3.813 -1.603 9.037 828 HB3 ASN 128 2HB ASN 128 -4.567 -1.699 11.596 829 HD21 ASN 128 1HD2 ASN 128 -1.746 -2.534 12.790 830 HD22 ASN 128 2HD2 ASN 128 -1.696 -4.134 12.081 831 H GLU 129 H GLU 129 -4.341 1.394 10.994 832 HA GLU 129 HA GLU 129 -7.152 1.377 10.865 833 HB3 GLU 129 2HB GLU 129 -6.875 3.908 11.107 834 HG3 GLU 129 2HG GLU 129 -5.242 2.108 12.936 835 H TRP 130 H TRP 130 -4.872 2.183 8.300 836 HA TRP 130 HA TRP 130 -7.039 3.435 6.723 837 HB3 TRP 130 2HB TRP 130 -5.196 4.241 5.315 838 HD1 TRP 130 HD TRP 130 -6.397 4.833 8.838 839 HE1 TRP 130 1HE TRP 130 -5.798 7.136 9.657 840 HE3 TRP 130 3HE TRP 130 -3.129 6.246 5.117 841 HZ2 TRP 130 2HZ TRP 130 -4.074 9.264 8.934 842 HZ3 TRP 130 3HZ TRP 130 -1.990 8.443 5.277 843 HH2 TRP 130 HH TRP 130 -2.534 10.019 7.134 844 H ALA 131 H ALA 131 -5.940 0.341 7.199 845 HA ALA 131 HA ALA 131 -6.622 -0.456 4.419 846 HB1 ALA 131 1HB ALA 131 -4.149 -0.012 4.587 847 HB2 ALA 131 2HB ALA 131 -4.042 -1.304 5.797 848 HB3 ALA 131 3HB ALA 131 -4.550 -1.672 4.137 849 H ASP 132 H ASP 132 -7.422 -1.045 7.505 850 HA ASP 132 HA ASP 132 -7.174 -3.844 7.818 851 HB3 ASP 132 2HB ASP 132 -9.165 -1.935 8.948 852 H GLY 133 H GLY 133 -7.859 -4.372 5.662 853 HA2 GLY 133 1HA GLY 133 -10.214 -5.996 6.187 854 HA3 GLY 133 2HA GLY 133 -10.406 -5.043 4.702 855 H LEU 134 H LEU 134 -7.619 -5.042 3.892 856 HA LEU 134 HA LEU 134 -7.669 -7.537 2.507 857 HB3 LEU 134 2HB LEU 134 -5.626 -6.669 1.446 858 HG LEU 134 HG LEU 134 -6.292 -4.586 0.549 859 HD11 LEU 134 1HD1 LEU 134 -8.970 -5.774 0.483 860 HD12 LEU 134 2HD1 LEU 134 -7.685 -6.962 0.159 861 HD13 LEU 134 3HD1 LEU 134 -7.868 -5.543 -0.865 862 HD21 LEU 134 3HD2 LEU 134 -7.188 -3.471 2.523 863 HD22 LEU 134 1HD2 LEU 134 -8.722 -4.361 2.271 864 HD23 LEU 134 2HD2 LEU 134 -8.126 -3.249 1.030 865 H ASN 135 H ASN 135 -6.303 -9.188 2.611 866 HA ASN 135 HA ASN 135 -5.307 -10.105 5.111 867 HB3 ASN 135 2HB ASN 135 -4.774 -11.088 2.293 868 HD21 ASN 135 1HD2 ASN 135 -3.042 -12.258 2.191 869 HD22 ASN 135 2HD2 ASN 135 -2.362 -13.423 3.306 870 H VAL 136 H VAL 136 -3.737 -8.818 6.084 871 HA VAL 136 HA VAL 136 -1.314 -8.159 4.639 872 HB VAL 136 HB VAL 136 -2.012 -7.923 7.606 873 HG11 VAL 136 1HG1 VAL 136 -0.128 -6.267 7.680 874 HG12 VAL 136 2HG1 VAL 136 0.403 -7.922 7.448 875 HG13 VAL 136 3HG1 VAL 136 0.360 -6.792 6.064 876 HG21 VAL 136 3HG2 VAL 136 -2.031 -5.864 5.358 877 HG22 VAL 136 1HG2 VAL 136 -3.424 -6.471 6.279 878 HG23 VAL 136 2HG2 VAL 136 -2.212 -5.472 7.080 879 H ILE 137 H ILE 137 0.611 -9.254 4.654 880 HA ILE 137 HA ILE 137 1.062 -11.188 6.888 881 HB ILE 137 HB ILE 137 2.261 -12.683 5.581 882 HG13 ILE 137 2HG1 ILE 137 2.743 -12.530 3.233 883 HG21 ILE 137 1HG2 ILE 137 -0.161 -13.015 5.477 884 HG22 ILE 137 2HG2 ILE 137 -0.259 -12.074 3.982 885 HG23 ILE 137 3HG2 ILE 137 0.650 -13.591 4.028 886 HD11 ILE 137 3HD1 ILE 137 0.970 -10.882 2.487 887 HD12 ILE 137 1HD1 ILE 137 1.938 -9.602 3.296 888 HD13 ILE 137 2HD1 ILE 137 2.620 -10.525 1.953 889 H GLY 138 H GLY 138 2.052 -8.193 5.667 890 HA2 GLY 138 1HA GLY 138 3.902 -8.049 7.763 891 HA3 GLY 138 2HA GLY 138 4.825 -8.243 6.273 892 H VAL 139 H VAL 139 4.936 -6.066 7.943 893 HA VAL 139 HA VAL 139 4.367 -3.809 6.187 894 HB VAL 139 HB VAL 139 3.363 -3.905 9.079 895 HG11 VAL 139 1HG1 VAL 139 3.226 -1.653 7.021 896 HG12 VAL 139 2HG1 VAL 139 2.415 -1.666 8.608 897 HG13 VAL 139 3HG1 VAL 139 4.176 -1.666 8.520 898 HG21 VAL 139 3HG2 VAL 139 1.113 -3.520 8.035 899 HG22 VAL 139 1HG2 VAL 139 1.829 -3.803 6.448 900 HG23 VAL 139 2HG2 VAL 139 1.790 -5.088 7.685 901 H ALA 140 H ALA 140 6.616 -3.879 5.875 902 HA ALA 140 HA ALA 140 8.380 -3.717 8.278 903 HB1 ALA 140 1HB ALA 140 9.017 -5.118 5.647 904 HB2 ALA 140 2HB ALA 140 9.936 -5.180 7.151 905 HB3 ALA 140 3HB ALA 140 8.360 -5.965 7.057 906 H ARG 141 H ARG 141 10.505 -2.675 7.746 907 HA ARG 141 HA ARG 141 10.361 -0.529 5.726 908 HB3 ARG 141 2HB ARG 141 12.644 -1.453 7.517 909 HG3 ARG 141 2HG ARG 141 12.108 1.302 6.372 910 HD3 ARG 141 2HD ARG 141 14.513 -0.027 7.664 911 HE ARG 141 HE ARG 141 14.712 2.206 6.145 912 HH11 ARG 141 1HH1 ARG 141 15.267 1.255 9.511 913 HH12 ARG 141 2HH1 ARG 141 16.392 2.518 9.858 914 HH21 ARG 141 1HH2 ARG 141 16.080 4.024 6.631 915 HH22 ARG 141 2HH2 ARG 141 16.706 4.245 8.249 916 H ASP 142 H ASP 142 11.792 -0.588 3.996 917 HA ASP 142 HA ASP 142 12.866 -1.485 2.241 918 HB3 ASP 142 2HB ASP 142 14.628 -0.980 3.796 919 H ASP 143 H ASP 143 14.386 -4.109 2.245 920 HA ASP 143 HA ASP 143 12.115 -5.679 1.207 921 HB3 ASP 143 2HB ASP 143 13.285 -4.790 -0.592 922 H SER 144 H SER 144 13.909 -5.639 3.852 923 HA SER 144 HA SER 144 15.063 -8.214 4.063 924 HB3 SER 144 2HB SER 144 14.011 -6.304 6.189 925 HG SER 144 HG SER 144 14.671 -8.519 6.784 926 H GLU 145 H GLU 145 11.706 -7.717 3.679 927 HA GLU 145 HA GLU 145 11.237 -10.331 5.036 928 HB3 GLU 145 2HB GLU 145 8.941 -9.683 5.474 929 HG3 GLU 145 2HG GLU 145 10.534 -7.401 6.623 930 H VAL 146 H VAL 146 11.771 -9.118 2.045 931 HA VAL 146 HA VAL 146 9.556 -10.143 0.572 932 HB VAL 146 HB VAL 146 12.480 -9.845 -0.198 933 HG11 VAL 146 1HG1 VAL 146 11.616 -9.863 -2.557 934 HG12 VAL 146 2HG1 VAL 146 11.414 -11.426 -1.755 935 HG13 VAL 146 3HG1 VAL 146 10.021 -10.345 -1.918 936 HG21 VAL 146 3HG2 VAL 146 11.748 -7.792 -1.268 937 HG22 VAL 146 1HG2 VAL 146 10.054 -8.090 -0.792 938 HG23 VAL 146 2HG2 VAL 146 11.280 -7.722 0.432 939 H ASP 147 H ASP 147 12.420 -11.755 1.944 940 HA ASP 147 HA ASP 147 12.110 -14.309 0.761 941 HB3 ASP 147 2HB ASP 147 13.182 -14.888 3.218 942 H LYS 148 H LYS 148 9.873 -12.889 2.737 943 HA LYS 148 HA LYS 148 8.671 -15.522 3.370 944 HB3 LYS 148 2HB LYS 148 9.424 -14.598 5.475 945 HG3 LYS 148 2HG LYS 148 7.678 -12.227 4.797 946 HD3 LYS 148 2HD LYS 148 7.756 -13.246 7.336 947 HE3 LYS 148 2HE LYS 148 10.051 -11.263 6.954 948 HZ1 LYS 148 3HZ LYS 148 8.675 -10.822 8.914 949 HZ2 LYS 148 1HZ LYS 148 10.240 -11.204 9.265 950 HZ3 LYS 148 2HZ LYS 148 9.103 -12.350 9.495 951 H TRP 149 H TRP 149 8.365 -12.581 1.688 952 HA TRP 149 HA TRP 149 5.429 -12.948 1.465 953 HB3 TRP 149 2HB TRP 149 5.376 -10.719 0.488 954 HD1 TRP 149 HD TRP 149 5.540 -11.696 3.709 955 HE1 TRP 149 1HE TRP 149 5.822 -9.856 5.412 956 HE3 TRP 149 3HE TRP 149 7.630 -8.221 0.669 957 HZ2 TRP 149 2HZ TRP 149 6.598 -6.968 5.369 958 HZ3 TRP 149 3HZ TRP 149 8.067 -5.921 1.438 959 HH2 TRP 149 HH TRP 149 7.517 -5.260 3.798 960 H SER 150 H SER 150 7.092 -14.816 0.296 961 HA SER 150 HA SER 150 5.953 -14.670 -2.362 962 HB3 SER 150 2HB SER 150 8.952 -14.898 -2.014 963 HG SER 150 HG SER 150 7.329 -15.122 -4.376 964 H LYS 151 H LYS 151 8.232 -16.420 -0.310 965 HA LYS 151 HA LYS 151 8.527 -18.714 -0.033 966 HB3 LYS 151 2HB LYS 151 6.606 -19.594 1.346 967 HG3 LYS 151 2HG LYS 151 7.354 -16.817 2.242 968 HD3 LYS 151 2HD LYS 151 6.994 -19.491 3.681 969 HE3 LYS 151 2HE LYS 151 7.113 -16.656 4.756 970 HZ1 LYS 151 3HZ LYS 151 7.013 -19.171 6.296 971 HZ2 LYS 151 1HZ LYS 151 5.678 -18.302 5.920 972 HZ3 LYS 151 2HZ LYS 151 6.877 -17.621 6.848 Start of MODEL 10 1 H1 GLY 1 H GLY 1 -7.309 -23.575 -9.226 2 HA2 GLY 1 1HA GLY 1 -5.424 -23.555 -10.787 3 HA3 GLY 1 2HA GLY 1 -5.664 -21.966 -10.032 4 H MET 2 H MET 2 -3.203 -22.836 -11.144 5 HA MET 2 HA MET 2 -1.412 -22.820 -8.774 6 HB3 MET 2 2HB MET 2 0.194 -24.227 -10.114 7 HG3 MET 2 2HG MET 2 -1.331 -26.379 -10.148 8 HE1 MET 2 3HE MET 2 -1.829 -24.373 -6.801 9 HE2 MET 2 1HE MET 2 -0.411 -24.860 -5.851 10 HE3 MET 2 2HE MET 2 -0.210 -23.743 -7.212 11 H ALA 3 H ALA 3 -0.915 -20.713 -8.855 12 HA ALA 3 HA ALA 3 1.050 -19.630 -10.368 13 HB1 ALA 3 1HB ALA 3 -0.206 -17.770 -11.577 14 HB2 ALA 3 2HB ALA 3 -0.324 -19.343 -12.365 15 HB3 ALA 3 3HB ALA 3 -1.697 -18.728 -11.402 16 H LYS 4 H LYS 4 1.813 -18.195 -8.933 17 HA LYS 4 HA LYS 4 -0.163 -16.466 -7.594 18 HB3 LYS 4 2HB LYS 4 0.456 -18.172 -6.008 19 HG3 LYS 4 2HG LYS 4 3.079 -17.957 -6.829 20 HD3 LYS 4 2HD LYS 4 2.918 -15.730 -5.233 21 HE3 LYS 4 2HE LYS 4 2.261 -17.271 -3.278 22 HZ1 LYS 4 3HZ LYS 4 4.190 -18.352 -2.267 23 HZ2 LYS 4 1HZ LYS 4 5.159 -17.941 -3.457 24 HZ3 LYS 4 2HZ LYS 4 3.977 -19.027 -3.755 25 H LYS 5 H LYS 5 0.163 -14.835 -9.093 26 HA LYS 5 HA LYS 5 2.949 -13.871 -9.442 27 HB3 LYS 5 2HB LYS 5 2.134 -12.180 -10.883 28 HG3 LYS 5 2HG LYS 5 0.199 -14.328 -11.484 29 HD3 LYS 5 2HD LYS 5 2.255 -12.890 -13.202 30 HE3 LYS 5 2HE LYS 5 -0.155 -14.276 -14.333 31 HZ1 LYS 5 3HZ LYS 5 2.720 -14.366 -15.015 32 HZ2 LYS 5 1HZ LYS 5 1.639 -13.351 -15.733 33 HZ3 LYS 5 2HZ LYS 5 1.481 -14.954 -15.954 34 H THR 6 H THR 6 3.153 -11.594 -9.207 35 HA THR 6 HA THR 6 2.147 -10.610 -6.576 36 HB THR 6 HB THR 6 5.061 -10.786 -7.380 37 HG1 THR 6 1HG THR 6 4.808 -12.148 -5.268 38 HG21 THR 6 3HG2 THR 6 5.482 -10.139 -4.998 39 HG22 THR 6 1HG2 THR 6 3.753 -9.785 -4.819 40 HG23 THR 6 2HG2 THR 6 4.754 -8.848 -5.956 41 H LEU 7 H LEU 7 1.823 -8.302 -6.586 42 HA LEU 7 HA LEU 7 2.857 -6.797 -8.971 43 HB3 LEU 7 2HB LEU 7 0.316 -6.324 -7.387 44 HG LEU 7 HG LEU 7 1.207 -4.196 -8.338 45 HD11 LEU 7 1HD1 LEU 7 2.516 -5.001 -10.268 46 HD12 LEU 7 2HD1 LEU 7 1.241 -3.913 -10.819 47 HD13 LEU 7 3HD1 LEU 7 1.048 -5.661 -11.013 48 HD21 LEU 7 3HD2 LEU 7 -1.225 -5.291 -9.798 49 HD22 LEU 7 1HD2 LEU 7 -0.821 -3.577 -9.561 50 HD23 LEU 7 2HD2 LEU 7 -1.215 -4.592 -8.165 51 H ILE 8 H ILE 8 3.768 -4.747 -8.566 52 HA ILE 8 HA ILE 8 4.222 -3.960 -5.735 53 HB ILE 8 HB ILE 8 6.134 -3.960 -8.093 54 HG13 ILE 8 2HG1 ILE 8 5.783 -6.064 -6.467 55 HG21 ILE 8 1HG2 ILE 8 6.440 -1.853 -6.881 56 HG22 ILE 8 2HG2 ILE 8 6.538 -2.729 -5.342 57 HG23 ILE 8 3HG2 ILE 8 7.807 -2.919 -6.566 58 HD11 ILE 8 3HD1 ILE 8 8.053 -6.745 -6.865 59 HD12 ILE 8 1HD1 ILE 8 7.542 -5.809 -8.274 60 HD13 ILE 8 2HD1 ILE 8 8.600 -5.062 -7.054 61 H LEU 9 H LEU 9 3.110 -2.062 -5.446 62 HA LEU 9 HA LEU 9 2.786 -0.145 -7.705 63 HB3 LEU 9 2HB LEU 9 0.880 0.648 -6.097 64 HG LEU 9 HG LEU 9 0.847 -1.875 -7.765 65 HD11 LEU 9 1HD1 LEU 9 -1.525 -0.678 -6.280 66 HD12 LEU 9 2HD1 LEU 9 -0.783 -2.272 -5.994 67 HD13 LEU 9 3HD1 LEU 9 -1.610 -1.945 -7.525 68 HD21 LEU 9 3HD2 LEU 9 0.953 0.540 -8.737 69 HD22 LEU 9 1HD2 LEU 9 -0.706 0.705 -8.174 70 HD23 LEU 9 2HD2 LEU 9 -0.310 -0.549 -9.355 71 H TYR 10 H TYR 10 4.361 1.365 -7.564 72 HA TYR 10 HA TYR 10 4.977 2.500 -4.887 73 HB3 TYR 10 2HB TYR 10 7.022 2.072 -5.772 74 HD1 TYR 10 2HD TYR 10 6.370 4.343 -8.641 75 HD2 TYR 10 1HD TYR 10 7.118 0.336 -7.326 76 HE1 TYR 10 2HE TYR 10 6.896 3.698 -10.983 77 HE2 TYR 10 1HE TYR 10 7.732 -0.314 -9.668 78 HH TYR 10 HH TYR 10 7.526 1.952 -12.439 79 H TYR 11 H TYR 11 3.884 4.229 -4.333 80 HA TYR 11 HA TYR 11 2.923 6.144 -6.396 81 HB3 TYR 11 2HB TYR 11 2.462 5.968 -3.400 82 HD1 TYR 11 2HD TYR 11 0.808 7.691 -6.282 83 HD2 TYR 11 1HD TYR 11 2.937 8.190 -2.560 84 HE1 TYR 11 2HE TYR 11 0.561 10.159 -6.442 85 HE2 TYR 11 1HE TYR 11 2.585 10.644 -2.690 86 HH TYR 11 HH TYR 11 1.071 12.293 -3.948 87 H SER 12 H SER 12 3.792 8.130 -6.563 88 HA SER 12 HA SER 12 5.380 9.615 -6.889 89 HB3 SER 12 2HB SER 12 6.888 10.302 -4.999 90 HG SER 12 HG SER 12 5.005 11.026 -3.753 91 H TRP 13 H TRP 13 7.028 9.463 -8.263 92 HA TRP 13 HA TRP 13 8.480 6.895 -8.172 93 HB3 TRP 13 2HB TRP 13 7.759 8.540 -10.607 94 HD1 TRP 13 HD TRP 13 8.815 5.061 -9.328 95 HE1 TRP 13 1HE TRP 13 9.942 3.759 -11.195 96 HE3 TRP 13 3HE TRP 13 7.661 8.155 -13.234 97 HZ2 TRP 13 2HZ TRP 13 10.360 4.053 -14.018 98 HZ3 TRP 13 3HZ TRP 13 8.411 7.593 -15.525 99 HH2 TRP 13 HH TRP 13 9.763 5.551 -15.947 100 H SER 14 H SER 14 9.466 9.260 -6.813 101 HA SER 14 HA SER 14 11.667 10.496 -8.154 102 HB3 SER 14 2HB SER 14 11.249 10.195 -5.169 103 HG SER 14 HG SER 14 11.911 12.584 -5.721 104 H GLY 15 H GLY 15 13.507 10.074 -5.938 105 HA2 GLY 15 1HA GLY 15 14.919 7.584 -6.596 106 HA3 GLY 15 2HA GLY 15 15.281 8.708 -5.276 107 H GLU 16 H GLU 16 14.875 7.867 -3.326 108 HA GLU 16 HA GLU 16 14.344 6.440 -1.697 109 HB3 GLU 16 2HB GLU 16 11.969 6.616 -1.016 110 HG3 GLU 16 2HG GLU 16 13.123 9.315 -1.806 111 H THR 17 H THR 17 11.355 5.622 -3.470 112 HA THR 17 HA THR 17 11.561 2.871 -2.732 113 HB THR 17 HB THR 17 9.451 2.828 -4.230 114 HG1 THR 17 1HG THR 17 9.573 4.610 -5.435 115 HG21 THR 17 3HG2 THR 17 8.074 4.041 -2.563 116 HG22 THR 17 1HG2 THR 17 9.528 4.765 -1.864 117 HG23 THR 17 2HG2 THR 17 9.278 2.995 -1.785 118 H LYS 18 H LYS 18 12.688 4.705 -5.511 119 HA LYS 18 HA LYS 18 12.386 2.861 -7.538 120 HB3 LYS 18 2HB LYS 18 14.898 4.571 -7.189 121 HG3 LYS 18 2HG LYS 18 13.536 3.197 -9.534 122 HD3 LYS 18 2HD LYS 18 15.371 4.716 -10.790 123 HE3 LYS 18 2HE LYS 18 12.898 6.289 -10.651 124 HZ1 LYS 18 3HZ LYS 18 13.805 4.382 -12.726 125 HZ2 LYS 18 1HZ LYS 18 14.335 5.925 -12.641 126 HZ3 LYS 18 2HZ LYS 18 12.761 5.636 -12.950 127 H LYS 19 H LYS 19 14.832 2.691 -4.984 128 HA LYS 19 HA LYS 19 16.192 0.404 -6.228 129 HB3 LYS 19 2HB LYS 19 17.297 0.112 -4.077 130 HG3 LYS 19 2HG LYS 19 17.371 3.083 -4.715 131 HD3 LYS 19 2HD LYS 19 19.826 2.713 -4.690 132 HE3 LYS 19 2HE LYS 19 18.084 2.195 -2.354 133 HZ1 LYS 19 3HZ LYS 19 20.930 1.425 -2.155 134 HZ2 LYS 19 1HZ LYS 19 19.653 0.383 -2.115 135 HZ3 LYS 19 2HZ LYS 19 19.805 1.484 -0.939 136 H MET 20 H MET 20 13.981 0.728 -3.446 137 HA MET 20 HA MET 20 13.233 -2.018 -3.275 138 HB3 MET 20 2HB MET 20 11.389 -0.847 -1.835 139 HG3 MET 20 2HG MET 20 13.543 -1.798 -0.854 140 HE1 MET 20 3HE MET 20 15.452 -1.415 -2.390 141 HE2 MET 20 1HE MET 20 16.869 -0.546 -1.743 142 HE3 MET 20 2HE MET 20 16.016 -1.757 -0.753 143 H ALA 21 H ALA 21 12.854 -1.001 -5.924 144 HA ALA 21 HA ALA 21 10.028 -1.734 -6.422 145 HB1 ALA 21 1HB ALA 21 9.909 -0.067 -8.256 146 HB2 ALA 21 2HB ALA 21 10.115 0.746 -6.696 147 HB3 ALA 21 3HB ALA 21 11.485 0.596 -7.794 148 H GLU 22 H GLU 22 12.997 -0.733 -8.113 149 HA GLU 22 HA GLU 22 12.703 -2.648 -10.175 150 HB3 GLU 22 2HB GLU 22 14.977 -1.804 -10.833 151 HG3 GLU 22 2HG GLU 22 14.515 0.646 -10.729 152 H LYS 23 H LYS 23 14.587 -2.669 -7.127 153 HA LYS 23 HA LYS 23 15.981 -5.161 -7.730 154 HB3 LYS 23 2HB LYS 23 15.667 -5.225 -5.037 155 HG3 LYS 23 2HG LYS 23 17.840 -5.038 -6.511 156 HD3 LYS 23 2HD LYS 23 19.015 -3.031 -5.385 157 HE3 LYS 23 2HE LYS 23 18.492 -1.406 -7.223 158 HZ1 LYS 23 3HZ LYS 23 18.776 -4.180 -8.215 159 HZ2 LYS 23 1HZ LYS 23 20.021 -3.247 -7.649 160 HZ3 LYS 23 2HZ LYS 23 19.196 -2.819 -8.993 161 H ILE 24 H ILE 24 13.102 -4.388 -5.727 162 HA ILE 24 HA ILE 24 12.495 -6.966 -5.011 163 HB ILE 24 HB ILE 24 10.504 -4.699 -5.416 164 HG13 ILE 24 2HG1 ILE 24 12.314 -3.927 -4.020 165 HG21 ILE 24 1HG2 ILE 24 10.363 -7.102 -3.546 166 HG22 ILE 24 2HG2 ILE 24 9.111 -5.855 -3.774 167 HG23 ILE 24 3HG2 ILE 24 9.475 -6.976 -5.069 168 HD11 ILE 24 3HD1 ILE 24 9.914 -3.609 -3.084 169 HD12 ILE 24 1HD1 ILE 24 10.356 -4.890 -1.929 170 HD13 ILE 24 2HD1 ILE 24 11.279 -3.384 -1.970 171 H ASN 25 H ASN 25 11.283 -5.238 -7.938 172 HA ASN 25 HA ASN 25 9.616 -7.262 -8.933 173 HB3 ASN 25 2HB ASN 25 11.400 -5.243 -10.379 174 HD21 ASN 25 1HD2 ASN 25 8.380 -7.283 -10.789 175 HD22 ASN 25 2HD2 ASN 25 8.717 -7.494 -12.501 176 H SER 26 H SER 26 13.117 -7.065 -9.100 177 HA SER 26 HA SER 26 13.388 -9.340 -10.946 178 HB3 SER 26 2HB SER 26 15.608 -7.855 -9.509 179 HG SER 26 HG SER 26 15.451 -8.650 -12.228 180 H GLU 27 H GLU 27 13.169 -8.830 -7.490 181 HA GLU 27 HA GLU 27 14.808 -11.135 -6.697 182 HB3 GLU 27 2HB GLU 27 13.581 -10.726 -4.482 183 HG3 GLU 27 2HG GLU 27 14.479 -8.365 -4.075 184 H ILE 28 H ILE 28 11.598 -10.625 -7.888 185 HA ILE 28 HA ILE 28 10.542 -13.076 -6.581 186 HB ILE 28 HB ILE 28 9.189 -10.529 -7.478 187 HG13 ILE 28 2HG1 ILE 28 10.603 -10.227 -5.427 188 HG21 ILE 28 1HG2 ILE 28 7.161 -11.401 -6.354 189 HG22 ILE 28 2HG2 ILE 28 7.651 -12.521 -7.583 190 HG23 ILE 28 3HG2 ILE 28 8.031 -12.852 -5.866 191 HD11 ILE 28 3HD1 ILE 28 9.009 -9.108 -4.123 192 HD12 ILE 28 1HD1 ILE 28 8.358 -9.034 -5.765 193 HD13 ILE 28 2HD1 ILE 28 7.714 -10.201 -4.581 194 H LYS 29 H LYS 29 9.301 -14.516 -7.808 195 HA LYS 29 HA LYS 29 9.819 -14.485 -10.705 196 HB3 LYS 29 2HB LYS 29 8.058 -16.633 -9.884 197 HG3 LYS 29 2HG LYS 29 9.771 -16.693 -11.703 198 HD3 LYS 29 2HD LYS 29 11.974 -17.664 -10.061 199 HE3 LYS 29 2HE LYS 29 11.804 -15.248 -11.920 200 HZ1 LYS 29 3HZ LYS 29 14.083 -15.625 -12.285 201 HZ2 LYS 29 1HZ LYS 29 14.112 -17.027 -11.433 202 HZ3 LYS 29 2HZ LYS 29 13.940 -15.615 -10.634 203 H ASP 30 H ASP 30 8.275 -14.318 -12.248 204 HA ASP 30 HA ASP 30 6.461 -13.621 -13.311 205 HB3 ASP 30 2HB ASP 30 4.416 -14.510 -11.405 206 H SER 31 H SER 31 7.488 -11.826 -10.946 207 HA SER 31 HA SER 31 5.319 -10.244 -10.148 208 HB3 SER 31 2HB SER 31 7.533 -8.586 -10.037 209 HG SER 31 HG SER 31 6.525 -9.025 -8.249 210 H GLU 32 H GLU 32 5.160 -7.937 -10.552 211 HA GLU 32 HA GLU 32 6.097 -6.745 -13.037 212 HB3 GLU 32 2HB GLU 32 3.572 -5.644 -12.971 213 HG3 GLU 32 2HG GLU 32 4.402 -8.124 -14.480 214 H LEU 33 H LEU 33 6.123 -4.344 -12.812 215 HA LEU 33 HA LEU 33 5.515 -3.353 -10.136 216 HB3 LEU 33 2HB LEU 33 7.959 -3.954 -10.587 217 HG LEU 33 HG LEU 33 7.901 -1.306 -12.113 218 HD11 LEU 33 1HD1 LEU 33 10.285 -2.918 -11.112 219 HD12 LEU 33 2HD1 LEU 33 9.680 -1.420 -10.370 220 HD13 LEU 33 3HD1 LEU 33 10.331 -1.388 -12.010 221 HD21 LEU 33 3HD2 LEU 33 8.867 -4.070 -12.933 222 HD22 LEU 33 1HD2 LEU 33 9.258 -2.578 -13.813 223 HD23 LEU 33 2HD2 LEU 33 7.578 -3.131 -13.694 224 H LYS 34 H LYS 34 4.545 -1.400 -10.070 225 HA LYS 34 HA LYS 34 3.823 -0.056 -12.616 226 HB3 LYS 34 2HB LYS 34 1.581 -0.056 -10.885 227 HG3 LYS 34 2HG LYS 34 1.389 -0.219 -13.312 228 HD3 LYS 34 2HD LYS 34 2.042 -3.176 -12.948 229 HE3 LYS 34 2HE LYS 34 1.022 -1.479 -15.254 230 HZ1 LYS 34 3HZ LYS 34 2.979 -2.668 -16.050 231 HZ2 LYS 34 1HZ LYS 34 1.589 -3.259 -16.734 232 HZ3 LYS 34 2HZ LYS 34 2.319 -4.118 -15.580 233 H GLU 35 H GLU 35 3.419 2.091 -12.391 234 HA GLU 35 HA GLU 35 4.208 3.439 -9.883 235 HB3 GLU 35 2HB GLU 35 3.392 4.506 -12.625 236 HG3 GLU 35 2HG GLU 35 5.050 6.391 -11.550 237 H VAL 36 H VAL 36 2.796 4.896 -8.852 238 HA VAL 36 HA VAL 36 -0.050 4.889 -9.623 239 HB VAL 36 HB VAL 36 0.988 4.938 -6.769 240 HG11 VAL 36 1HG1 VAL 36 -0.989 6.336 -6.906 241 HG12 VAL 36 2HG1 VAL 36 -1.831 5.143 -7.923 242 HG13 VAL 36 3HG1 VAL 36 -1.484 4.796 -6.224 243 HG21 VAL 36 3HG2 VAL 36 -0.305 2.813 -6.557 244 HG22 VAL 36 1HG2 VAL 36 -0.553 2.854 -8.322 245 HG23 VAL 36 2HG2 VAL 36 1.086 2.683 -7.636 246 H LYS 37 H LYS 37 -0.881 7.185 -9.482 247 HA LYS 37 HA LYS 37 0.834 9.274 -8.347 248 HB3 LYS 37 2HB LYS 37 1.367 9.473 -10.633 249 HG3 LYS 37 2HG LYS 37 -1.599 9.158 -11.162 250 HD3 LYS 37 2HD LYS 37 0.595 10.194 -12.970 251 HE3 LYS 37 2HE LYS 37 -2.205 9.648 -13.961 252 HZ1 LYS 37 3HZ LYS 37 -0.619 10.621 -15.455 253 HZ2 LYS 37 1HZ LYS 37 -0.903 9.083 -15.940 254 HZ3 LYS 37 2HZ LYS 37 0.492 9.415 -15.135 255 H VAL 38 H VAL 38 -0.956 11.450 -8.794 256 HA VAL 38 HA VAL 38 -3.448 10.569 -7.462 257 HB VAL 38 HB VAL 38 -3.258 12.754 -6.134 258 HG11 VAL 38 1HG1 VAL 38 -3.220 10.667 -5.022 259 HG12 VAL 38 2HG1 VAL 38 -1.547 10.341 -5.496 260 HG13 VAL 38 3HG1 VAL 38 -1.909 11.648 -4.347 261 HG21 VAL 38 3HG2 VAL 38 -0.287 12.445 -6.728 262 HG22 VAL 38 1HG2 VAL 38 -1.342 13.730 -7.345 263 HG23 VAL 38 2HG2 VAL 38 -1.046 13.587 -5.606 264 H SER 39 H SER 39 -5.214 12.211 -7.518 265 HA SER 39 HA SER 39 -5.327 13.449 -10.136 266 HB3 SER 39 2HB SER 39 -7.787 13.455 -9.347 267 HG SER 39 HG SER 39 -7.804 11.107 -9.734 268 H GLU 40 H GLU 40 -6.385 15.533 -10.317 269 HA GLU 40 HA GLU 40 -5.470 17.619 -8.549 270 HB3 GLU 40 2HB GLU 40 -5.852 17.802 -11.037 271 HG3 GLU 40 2HG GLU 40 -8.808 18.101 -10.323 272 H GLY 41 H GLY 41 -7.109 19.247 -7.652 273 HA2 GLY 41 1HA GLY 41 -9.368 19.721 -6.972 274 HA3 GLY 41 2HA GLY 41 -9.644 18.012 -6.663 275 H THR 42 H THR 42 -10.375 18.982 -4.586 276 HA THR 42 HA THR 42 -10.395 20.301 -2.886 277 HB THR 42 HB THR 42 -9.372 18.335 -1.853 278 HG1 THR 42 1HG THR 42 -10.361 20.109 -0.818 279 HG21 THR 42 3HG2 THR 42 -6.961 18.555 -2.447 280 HG22 THR 42 1HG2 THR 42 -7.243 18.501 -0.708 281 HG23 THR 42 2HG2 THR 42 -6.879 20.045 -1.490 282 H PHE 43 H PHE 43 -10.119 21.478 -4.963 283 HA PHE 43 HA PHE 43 -9.339 23.026 -6.330 284 HB3 PHE 43 2HB PHE 43 -10.482 24.437 -4.838 285 HD1 PHE 43 2HD PHE 43 -10.526 23.420 -2.512 286 HD2 PHE 43 1HD PHE 43 -7.471 26.187 -3.806 287 HE1 PHE 43 2HE PHE 43 -9.799 23.712 -0.188 288 HE2 PHE 43 1HE PHE 43 -6.824 26.570 -1.451 289 HZ PHE 43 HZ PHE 43 -7.940 25.280 0.385 290 H ASP 44 H ASP 44 -7.338 24.993 -6.209 291 HA ASP 44 HA ASP 44 -4.871 23.832 -5.406 292 HB3 ASP 44 2HB ASP 44 -5.276 22.965 -7.851 293 H ALA 45 H ALA 45 -3.152 25.635 -5.823 294 HA ALA 45 HA ALA 45 -4.471 28.320 -5.585 295 HB1 ALA 45 1HB ALA 45 -2.842 28.926 -3.892 296 HB2 ALA 45 2HB ALA 45 -3.711 27.473 -3.392 297 HB3 ALA 45 3HB ALA 45 -2.046 27.348 -4.029 298 H ASP 46 H ASP 46 -2.740 26.608 -7.656 299 HA ASP 46 HA ASP 46 -2.273 28.322 -9.456 300 HB3 ASP 46 2HB ASP 46 0.583 28.150 -9.104 301 H MET 47 H MET 47 -0.819 25.661 -7.720 302 HA MET 47 HA MET 47 -0.732 23.862 -10.015 303 HB3 MET 47 2HB MET 47 1.615 23.165 -9.372 304 HG3 MET 47 2HG MET 47 1.231 26.033 -10.252 305 HE1 MET 47 3HE MET 47 3.112 27.017 -11.880 306 HE2 MET 47 1HE MET 47 2.714 27.769 -10.317 307 HE3 MET 47 2HE MET 47 4.400 27.632 -10.822 308 H TYR 48 H TYR 48 0.058 21.636 -8.980 309 HA TYR 48 HA TYR 48 -1.635 20.801 -6.904 310 HB3 TYR 48 2HB TYR 48 -0.225 18.812 -6.786 311 HD1 TYR 48 1HD TYR 48 -2.455 18.466 -8.168 312 HD2 TYR 48 2HD TYR 48 1.408 19.412 -9.880 313 HE1 TYR 48 1HE TYR 48 -3.101 17.335 -10.297 314 HE2 TYR 48 2HE TYR 48 0.761 18.323 -11.974 315 HH TYR 48 HH TYR 48 -0.722 16.858 -12.893 316 H LYS 49 H LYS 49 -1.189 20.215 -4.729 317 HA LYS 49 HA LYS 49 1.148 21.505 -3.389 318 HB3 LYS 49 2HB LYS 49 -0.699 22.176 -1.610 319 HG3 LYS 49 2HG LYS 49 -0.317 23.689 -4.231 320 HD3 LYS 49 2HD LYS 49 -1.434 24.495 -1.536 321 HE3 LYS 49 2HE LYS 49 -0.741 26.894 -2.352 322 HZ1 LYS 49 3HZ LYS 49 1.547 26.503 -1.300 323 HZ2 LYS 49 1HZ LYS 49 1.009 24.962 -1.013 324 HZ3 LYS 49 2HZ LYS 49 0.194 26.231 -0.396 325 H THR 50 H THR 50 -0.076 18.695 -4.077 326 HA THR 50 HA THR 50 -0.052 17.566 -1.325 327 HB THR 50 HB THR 50 -1.777 16.813 -3.682 328 HG1 THR 50 1HG THR 50 -2.635 18.599 -3.176 329 HG21 THR 50 3HG2 THR 50 -3.182 15.717 -1.887 330 HG22 THR 50 1HG2 THR 50 -1.913 16.084 -0.703 331 HG23 THR 50 2HG2 THR 50 -1.592 14.956 -2.038 332 H SER 51 H SER 51 2.361 17.577 -2.113 333 HA SER 51 HA SER 51 2.899 14.776 -2.553 334 HB3 SER 51 2HB SER 51 3.233 15.460 -4.810 335 HG SER 51 HG SER 51 3.506 17.681 -4.651 336 H ASP 52 H ASP 52 3.708 14.402 -0.610 337 HA ASP 52 HA ASP 52 4.589 14.633 1.439 338 HB3 ASP 52 2HB ASP 52 6.985 15.364 -0.260 339 H ILE 53 H ILE 53 3.062 16.657 1.780 340 HA ILE 53 HA ILE 53 4.650 19.015 2.513 341 HB ILE 53 HB ILE 53 2.363 19.396 1.854 342 HG13 ILE 53 2HG1 ILE 53 2.897 20.081 4.747 343 HG21 ILE 53 1HG2 ILE 53 1.337 17.232 2.685 344 HG22 ILE 53 2HG2 ILE 53 1.394 17.933 4.308 345 HG23 ILE 53 3HG2 ILE 53 0.414 18.688 3.052 346 HD11 ILE 53 3HD1 ILE 53 3.250 22.320 3.813 347 HD12 ILE 53 1HD1 ILE 53 4.403 21.174 3.107 348 HD13 ILE 53 2HD1 ILE 53 2.975 21.699 2.177 349 H ALA 54 H ALA 54 3.078 16.332 4.158 350 HA ALA 54 HA ALA 54 3.142 15.391 6.175 351 HB1 ALA 54 1HB ALA 54 5.594 15.640 6.449 352 HB2 ALA 54 2HB ALA 54 5.333 17.283 7.092 353 HB3 ALA 54 3HB ALA 54 4.694 15.880 7.950 354 H LEU 55 H LEU 55 1.617 15.725 7.735 355 HA LEU 55 HA LEU 55 -0.242 16.456 8.370 356 HB3 LEU 55 2HB LEU 55 0.547 19.295 8.646 357 HG LEU 55 HG LEU 55 -1.161 17.264 9.902 358 HD11 LEU 55 1HD1 LEU 55 0.833 18.525 11.781 359 HD12 LEU 55 2HD1 LEU 55 0.783 16.831 11.290 360 HD13 LEU 55 3HD1 LEU 55 -0.574 17.522 12.224 361 HD21 LEU 55 3HD2 LEU 55 -0.761 20.208 10.496 362 HD22 LEU 55 1HD2 LEU 55 -2.037 19.196 11.210 363 HD23 LEU 55 2HD2 LEU 55 -2.012 19.467 9.466 364 H ASP 56 H ASP 56 -1.367 19.094 7.913 365 HA ASP 56 HA ASP 56 -3.164 19.666 6.883 366 HB3 ASP 56 2HB ASP 56 -1.715 20.061 4.309 367 H GLN 57 H GLN 57 -2.467 16.688 6.233 368 HA GLN 57 HA GLN 57 -4.792 16.244 4.426 369 HB3 GLN 57 2HB GLN 57 -2.680 14.165 4.410 370 HG3 GLN 57 2HG GLN 57 -4.458 14.409 2.670 371 HE21 GLN 57 1HE2 GLN 57 -1.819 16.883 2.118 372 HE22 GLN 57 2HE2 GLN 57 -2.912 18.005 1.306 373 H ILE 58 H ILE 58 -4.396 16.155 7.542 374 HA ILE 58 HA ILE 58 -4.985 13.239 7.970 375 HB ILE 58 HB ILE 58 -2.820 14.981 9.204 376 HG13 ILE 58 2HG1 ILE 58 -2.941 12.544 7.429 377 HG21 ILE 58 1HG2 ILE 58 -3.653 12.249 10.262 378 HG22 ILE 58 2HG2 ILE 58 -2.304 13.264 10.816 379 HG23 ILE 58 3HG2 ILE 58 -3.959 13.792 11.088 380 HD11 ILE 58 3HD1 ILE 58 -1.896 14.888 6.846 381 HD12 ILE 58 1HD1 ILE 58 -0.546 14.337 7.849 382 HD13 ILE 58 2HD1 ILE 58 -1.023 13.419 6.413 383 H GLN 59 H GLN 59 -4.856 16.420 9.716 384 HA GLN 59 HA GLN 59 -7.110 15.520 11.382 385 HB3 GLN 59 2HB GLN 59 -5.291 15.146 12.749 386 HG3 GLN 59 2HG GLN 59 -3.971 17.772 11.944 387 HE21 GLN 59 1HE2 GLN 59 -2.964 14.547 13.227 388 HE22 GLN 59 2HE2 GLN 59 -2.180 15.193 14.653 389 H GLY 60 H GLY 60 -8.776 16.880 10.913 390 HA2 GLY 60 1HA GLY 60 -9.896 18.852 10.939 391 HA3 GLY 60 2HA GLY 60 -8.393 19.763 11.043 392 H ASN 61 H ASN 61 -7.283 18.255 8.621 393 HA ASN 61 HA ASN 61 -9.250 19.062 6.549 394 HB3 ASN 61 2HB ASN 61 -6.309 18.525 6.037 395 HD21 ASN 61 1HD2 ASN 61 -5.757 18.875 3.743 396 HD22 ASN 61 2HD2 ASN 61 -6.998 18.994 2.522 397 H LYS 62 H LYS 62 -9.568 17.353 4.946 398 HA LYS 62 HA LYS 62 -8.795 14.680 5.587 399 HB3 LYS 62 2HB LYS 62 -11.792 15.043 5.730 400 HG3 LYS 62 2HG LYS 62 -9.890 13.374 7.443 401 HD3 LYS 62 2HD LYS 62 -12.720 12.755 6.482 402 HE3 LYS 62 2HE LYS 62 -11.060 11.618 8.773 403 HZ1 LYS 62 3HZ LYS 62 -12.603 9.843 8.650 404 HZ2 LYS 62 1HZ LYS 62 -13.372 10.464 7.341 405 HZ3 LYS 62 2HZ LYS 62 -13.484 11.252 8.779 406 H ASP 63 H ASP 63 -10.906 13.449 4.105 407 HA ASP 63 HA ASP 63 -11.655 13.046 2.024 408 HB3 ASP 63 2HB ASP 63 -12.381 14.852 0.606 409 H PHE 64 H PHE 64 -9.651 11.960 2.130 410 HA PHE 64 HA PHE 64 -7.197 13.039 1.175 411 HB3 PHE 64 2HB PHE 64 -6.476 10.659 1.057 412 HD1 PHE 64 2HD PHE 64 -7.493 12.887 3.560 413 HD2 PHE 64 1HD PHE 64 -6.856 8.685 2.863 414 HE1 PHE 64 2HE PHE 64 -7.195 12.534 5.965 415 HE2 PHE 64 1HE PHE 64 -6.542 8.325 5.308 416 HZ PHE 64 HZ PHE 64 -6.727 10.246 6.865 417 HA PRO 65 HA PRO 65 -7.978 13.274 -3.047 418 HB3 PRO 65 2HB PRO 65 -5.907 14.225 -3.380 419 HG3 PRO 65 2HG PRO 65 -4.004 13.444 -2.203 420 HD3 PRO 65 2HD PRO 65 -5.752 13.952 -0.644 421 H GLU 66 H GLU 66 -8.606 12.178 -4.819 422 HA GLU 66 HA GLU 66 -8.570 9.282 -4.790 423 HB3 GLU 66 2HB GLU 66 -9.560 9.487 -7.019 424 HG3 GLU 66 2HG GLU 66 -10.930 9.690 -4.795 425 H ILE 67 H ILE 67 -7.528 8.065 -6.529 426 HA ILE 67 HA ILE 67 -4.811 9.176 -7.006 427 HB ILE 67 HB ILE 67 -4.060 6.835 -6.861 428 HG13 ILE 67 2HG1 ILE 67 -6.335 5.824 -7.463 429 HG21 ILE 67 1HG2 ILE 67 -5.580 7.868 -4.410 430 HG22 ILE 67 2HG2 ILE 67 -4.221 6.721 -4.407 431 HG23 ILE 67 3HG2 ILE 67 -3.969 8.375 -4.939 432 HD11 ILE 67 3HD1 ILE 67 -5.038 4.723 -4.935 433 HD12 ILE 67 1HD1 ILE 67 -6.108 3.861 -6.039 434 HD13 ILE 67 2HD1 ILE 67 -4.514 4.405 -6.607 435 H GLN 68 H GLN 68 -3.671 8.006 -8.857 436 HA GLN 68 HA GLN 68 -5.490 7.191 -11.029 437 HB3 GLN 68 2HB GLN 68 -3.517 8.516 -12.405 438 HG3 GLN 68 2HG GLN 68 -6.185 9.621 -11.500 439 HE21 GLN 68 1HE2 GLN 68 -6.121 11.812 -11.627 440 HE22 GLN 68 2HE2 GLN 68 -5.202 12.751 -12.791 441 H LEU 69 H LEU 69 -4.567 5.652 -12.303 442 HA LEU 69 HA LEU 69 -1.843 5.066 -12.450 443 HB3 LEU 69 2HB LEU 69 -2.451 3.912 -10.228 444 HG LEU 69 HG LEU 69 -3.718 1.884 -12.098 445 HD11 LEU 69 1HD1 LEU 69 -2.226 1.017 -10.277 446 HD12 LEU 69 2HD1 LEU 69 -3.905 0.475 -10.163 447 HD13 LEU 69 3HD1 LEU 69 -3.315 1.760 -9.085 448 HD21 LEU 69 3HD2 LEU 69 -5.028 3.480 -9.850 449 HD22 LEU 69 1HD2 LEU 69 -5.750 2.059 -10.642 450 HD23 LEU 69 2HD2 LEU 69 -5.455 3.518 -11.583 451 H ASP 70 H ASP 70 -1.847 2.896 -13.856 452 HA ASP 70 HA ASP 70 -3.394 3.429 -16.203 453 HB3 ASP 70 2HB ASP 70 -2.078 0.813 -15.712 454 H ASN 71 H ASN 71 -4.474 1.215 -17.297 455 HA ASN 71 HA ASN 71 -6.602 0.332 -15.403 456 HB3 ASN 71 2HB ASN 71 -6.268 -0.184 -18.332 457 HD21 ASN 71 1HD2 ASN 71 -8.635 -0.322 -15.477 458 HD22 ASN 71 2HD2 ASN 71 -9.448 -1.693 -16.174 459 H ILE 72 H ILE 72 -5.050 -0.709 -14.181 460 HA ILE 72 HA ILE 72 -3.963 -3.310 -15.172 461 HB ILE 72 HB ILE 72 -3.823 -2.035 -12.402 462 HG13 ILE 72 2HG1 ILE 72 -2.301 -1.466 -14.878 463 HG21 ILE 72 1HG2 ILE 72 -3.412 -4.357 -12.082 464 HG22 ILE 72 2HG2 ILE 72 -2.300 -4.430 -13.477 465 HG23 ILE 72 3HG2 ILE 72 -1.867 -3.541 -11.997 466 HD11 ILE 72 3HD1 ILE 72 -1.227 0.257 -13.490 467 HD12 ILE 72 1HD1 ILE 72 -2.981 0.237 -13.243 468 HD13 ILE 72 2HD1 ILE 72 -1.903 -0.484 -12.026 469 H ASP 73 H ASP 73 -4.568 -5.247 -13.817 470 HA ASP 73 HA ASP 73 -7.151 -4.967 -12.398 471 HB3 ASP 73 2HB ASP 73 -6.295 -7.426 -13.958 472 H TYR 74 H TYR 74 -6.949 -5.751 -10.324 473 HA TYR 74 HA TYR 74 -4.323 -6.696 -9.432 474 HB3 TYR 74 2HB TYR 74 -5.388 -6.639 -7.212 475 HD1 TYR 74 2HD TYR 74 -3.693 -4.714 -8.893 476 HD2 TYR 74 1HD TYR 74 -7.623 -4.254 -7.172 477 HE1 TYR 74 2HE TYR 74 -3.420 -2.265 -8.932 478 HE2 TYR 74 1HE TYR 74 -7.316 -1.794 -7.170 479 HH TYR 74 HH TYR 74 -5.917 0.050 -7.893 480 H ASN 75 H ASN 75 -7.309 -8.105 -10.588 481 HA ASN 75 HA ASN 75 -7.214 -10.404 -8.924 482 HB3 ASN 75 2HB ASN 75 -8.930 -11.322 -10.571 483 HD21 ASN 75 1HD2 ASN 75 -8.966 -10.666 -7.995 484 HD22 ASN 75 2HD2 ASN 75 -10.173 -9.442 -7.647 485 H ASN 76 H ASN 76 -5.398 -9.822 -11.883 486 HA ASN 76 HA ASN 76 -5.027 -12.684 -12.252 487 HB3 ASN 76 2HB ASN 76 -5.021 -11.198 -14.186 488 HD21 ASN 76 1HD2 ASN 76 -4.900 -8.964 -14.249 489 HD22 ASN 76 2HD2 ASN 76 -3.493 -8.023 -13.862 490 H TYR 77 H TYR 77 -3.870 -10.559 -9.874 491 HA TYR 77 HA TYR 77 -1.383 -12.121 -9.517 492 HB3 TYR 77 2HB TYR 77 -0.626 -10.353 -8.045 493 HD1 TYR 77 2HD TYR 77 0.943 -10.396 -10.065 494 HD2 TYR 77 1HD TYR 77 -2.688 -8.076 -10.000 495 HE1 TYR 77 2HE TYR 77 1.682 -9.211 -12.087 496 HE2 TYR 77 1HE TYR 77 -1.918 -6.816 -11.964 497 HH TYR 77 HH TYR 77 0.934 -7.736 -13.893 498 H ASP 78 H ASP 78 -0.906 -12.841 -7.389 499 HA ASP 78 HA ASP 78 -3.308 -13.457 -5.696 500 HB3 ASP 78 2HB ASP 78 -0.760 -15.050 -6.007 501 H LEU 79 H LEU 79 -0.493 -11.587 -5.807 502 HA LEU 79 HA LEU 79 -0.574 -11.171 -2.918 503 HB3 LEU 79 2HB LEU 79 2.210 -11.329 -3.885 504 HG LEU 79 HG LEU 79 0.605 -12.566 -1.597 505 HD11 LEU 79 1HD1 LEU 79 2.888 -13.326 -0.773 506 HD12 LEU 79 2HD1 LEU 79 3.475 -12.980 -2.423 507 HD13 LEU 79 3HD1 LEU 79 2.231 -14.201 -2.161 508 HD21 LEU 79 3HD2 LEU 79 2.074 -11.155 -0.175 509 HD22 LEU 79 1HD2 LEU 79 1.114 -10.171 -1.278 510 HD23 LEU 79 2HD2 LEU 79 2.832 -10.476 -1.630 511 H ILE 80 H ILE 80 -0.073 -8.949 -2.425 512 HA ILE 80 HA ILE 80 0.942 -7.291 -4.672 513 HB ILE 80 HB ILE 80 -1.533 -6.587 -3.080 514 HG13 ILE 80 2HG1 ILE 80 -2.035 -8.299 -4.697 515 HG21 ILE 80 1HG2 ILE 80 -0.077 -5.074 -5.309 516 HG22 ILE 80 2HG2 ILE 80 -1.610 -4.588 -4.557 517 HG23 ILE 80 3HG2 ILE 80 -0.149 -4.591 -3.603 518 HD11 ILE 80 3HD1 ILE 80 -3.490 -7.306 -6.311 519 HD12 ILE 80 1HD1 ILE 80 -3.662 -6.404 -4.795 520 HD13 ILE 80 2HD1 ILE 80 -2.736 -5.718 -6.155 521 H LEU 81 H LEU 81 2.278 -5.656 -4.099 522 HA LEU 81 HA LEU 81 3.090 -5.384 -1.254 523 HB3 LEU 81 2HB LEU 81 5.380 -5.325 -2.050 524 HG LEU 81 HG LEU 81 4.040 -7.736 -3.343 525 HD11 LEU 81 1HD1 LEU 81 6.952 -7.199 -2.650 526 HD12 LEU 81 2HD1 LEU 81 6.262 -7.310 -4.286 527 HD13 LEU 81 3HD1 LEU 81 6.288 -8.726 -3.232 528 HD21 LEU 81 3HD2 LEU 81 3.638 -7.701 -0.926 529 HD22 LEU 81 1HD2 LEU 81 5.364 -7.373 -0.618 530 HD23 LEU 81 2HD2 LEU 81 4.850 -8.927 -1.314 531 H ILE 82 H ILE 82 3.296 -3.199 -0.635 532 HA ILE 82 HA ILE 82 3.124 -1.107 -2.759 533 HB ILE 82 HB ILE 82 1.499 -1.022 -0.217 534 HG13 ILE 82 2HG1 ILE 82 0.795 -3.084 -1.973 535 HG21 ILE 82 1HG2 ILE 82 0.174 0.582 -1.510 536 HG22 ILE 82 2HG2 ILE 82 1.880 1.021 -1.605 537 HG23 ILE 82 3HG2 ILE 82 1.127 0.187 -2.967 538 HD11 ILE 82 3HD1 ILE 82 -1.426 -2.936 -0.927 539 HD12 ILE 82 1HD1 ILE 82 -0.082 -2.889 0.233 540 HD13 ILE 82 2HD1 ILE 82 -0.951 -1.397 -0.170 541 H GLY 83 H GLY 83 4.383 0.823 -2.275 542 HA2 GLY 83 1HA GLY 83 5.090 1.098 0.638 543 HA3 GLY 83 2HA GLY 83 6.265 1.420 -0.635 544 H SER 84 H SER 84 5.944 3.241 1.318 545 HA SER 84 HA SER 84 5.130 5.553 -0.105 546 HB3 SER 84 2HB SER 84 3.603 4.734 2.439 547 HG SER 84 HG SER 84 3.886 6.945 2.506 548 HA PRO 85 HA PRO 85 8.207 7.000 2.877 549 HB3 PRO 85 2HB PRO 85 8.681 8.767 1.427 550 HG3 PRO 85 2HG PRO 85 6.942 9.823 0.175 551 HD3 PRO 85 2HD PRO 85 6.812 7.507 -0.315 552 H VAL 86 H VAL 86 8.306 8.190 4.934 553 HA VAL 86 HA VAL 86 5.854 8.954 6.253 554 HB VAL 86 HB VAL 86 5.612 6.582 6.252 555 HG11 VAL 86 1HG1 VAL 86 6.916 5.008 7.483 556 HG12 VAL 86 2HG1 VAL 86 7.826 5.688 6.160 557 HG13 VAL 86 3HG1 VAL 86 8.152 6.244 7.821 558 HG21 VAL 86 3HG2 VAL 86 5.194 6.320 8.689 559 HG22 VAL 86 1HG2 VAL 86 6.299 7.644 9.031 560 HG23 VAL 86 2HG2 VAL 86 4.776 7.939 8.150 561 H TRP 87 H TRP 87 6.316 10.431 7.697 562 HA TRP 87 HA TRP 87 8.894 10.503 9.153 563 HB3 TRP 87 2HB TRP 87 7.961 12.805 7.390 564 HD1 TRP 87 HD TRP 87 11.209 11.406 9.036 565 HE1 TRP 87 1HE TRP 87 12.694 13.366 9.736 566 HE3 TRP 87 3HE TRP 87 8.379 15.286 7.212 567 HZ2 TRP 87 2HZ TRP 87 12.648 16.239 9.598 568 HZ3 TRP 87 3HZ TRP 87 9.150 17.637 7.523 569 HH2 TRP 87 HH TRP 87 11.262 18.107 8.745 570 H SER 88 H SER 88 5.598 11.098 9.213 571 HA SER 88 HA SER 88 5.894 12.136 11.916 572 HB3 SER 88 2HB SER 88 4.159 13.869 11.592 573 HG SER 88 HG SER 88 6.315 14.493 11.139 574 H GLY 89 H GLY 89 5.363 9.527 11.187 575 HA2 GLY 89 1HA GLY 89 3.924 7.831 11.775 576 HA3 GLY 89 2HA GLY 89 2.682 9.011 12.238 577 H TYR 90 H TYR 90 2.103 10.407 10.065 578 HA TYR 90 HA TYR 90 1.722 8.761 7.656 579 HB3 TYR 90 2HB TYR 90 -0.137 7.991 8.749 580 HD1 TYR 90 1HD TYR 90 0.300 11.501 10.082 581 HD2 TYR 90 2HD TYR 90 -2.036 7.856 10.241 582 HE1 TYR 90 1HE TYR 90 -0.555 12.140 12.280 583 HE2 TYR 90 2HE TYR 90 -2.847 8.492 12.450 584 HH TYR 90 HH TYR 90 -2.788 10.067 14.156 585 HA PRO 91 HA PRO 91 2.117 13.376 6.868 586 HB3 PRO 91 2HB PRO 91 4.446 13.406 6.894 587 HG3 PRO 91 2HG PRO 91 5.712 11.478 6.275 588 HD3 PRO 91 2HD PRO 91 4.259 11.021 8.155 589 H ALA 92 H ALA 92 1.855 10.399 5.001 590 HA ALA 92 HA ALA 92 0.828 11.880 2.651 591 HB1 ALA 92 1HB ALA 92 1.985 9.071 2.614 592 HB2 ALA 92 2HB ALA 92 1.845 10.246 1.290 593 HB3 ALA 92 3HB ALA 92 3.043 10.493 2.562 594 H THR 93 H THR 93 -0.884 10.624 1.406 595 HA THR 93 HA THR 93 -2.158 8.419 2.922 596 HB THR 93 HB THR 93 -4.417 9.279 2.378 597 HG1 THR 93 1HG THR 93 -4.489 11.617 2.045 598 HG21 THR 93 3HG2 THR 93 -4.553 11.157 4.057 599 HG22 THR 93 1HG2 THR 93 -2.794 11.248 4.102 600 HG23 THR 93 2HG2 THR 93 -3.637 9.792 4.655 601 HA PRO 94 HA PRO 94 -2.099 7.495 -1.625 602 HB3 PRO 94 2HB PRO 94 0.128 8.051 -2.086 603 HG3 PRO 94 2HG PRO 94 1.895 7.664 -0.484 604 HD3 PRO 94 2HD PRO 94 0.318 9.123 0.410 605 H ILE 95 H ILE 95 -1.819 5.869 1.349 606 HA ILE 95 HA ILE 95 -2.753 3.342 0.038 607 HB ILE 95 HB ILE 95 -1.535 3.263 2.741 608 HG13 ILE 95 2HG1 ILE 95 0.749 2.985 2.131 609 HG21 ILE 95 1HG2 ILE 95 -0.699 1.058 1.950 610 HG22 ILE 95 2HG2 ILE 95 -2.450 1.218 1.794 611 HG23 ILE 95 3HG2 ILE 95 -1.415 1.372 0.368 612 HD11 ILE 95 3HD1 ILE 95 -0.143 3.168 -0.722 613 HD12 ILE 95 1HD1 ILE 95 1.332 4.035 -0.302 614 HD13 ILE 95 2HD1 ILE 95 1.215 2.313 0.037 615 H LYS 96 H LYS 96 -4.531 5.008 0.197 616 HA LYS 96 HA LYS 96 -6.316 3.776 2.209 617 HB3 LYS 96 2HB LYS 96 -6.334 6.759 1.614 618 HG3 LYS 96 2HG LYS 96 -8.643 5.986 1.899 619 HD3 LYS 96 2HD LYS 96 -8.198 3.920 3.281 620 HE3 LYS 96 2HE LYS 96 -6.745 5.458 5.000 621 HZ1 LYS 96 3HZ LYS 96 -9.450 5.184 6.189 622 HZ2 LYS 96 1HZ LYS 96 -8.644 6.584 6.028 623 HZ3 LYS 96 2HZ LYS 96 -8.090 5.465 7.063 624 H THR 97 H THR 97 -6.354 5.946 -0.750 625 HA THR 97 HA THR 97 -8.918 5.096 -1.515 626 HB THR 97 HB THR 97 -6.747 6.077 -3.371 627 HG1 THR 97 1HG THR 97 -7.366 8.239 -2.536 628 HG21 THR 97 3HG2 THR 97 -9.696 6.795 -3.197 629 HG22 THR 97 1HG2 THR 97 -9.024 5.558 -4.282 630 HG23 THR 97 2HG2 THR 97 -8.551 7.235 -4.479 631 H LEU 98 H LEU 98 -5.673 3.830 -2.370 632 HA LEU 98 HA LEU 98 -6.468 2.071 -4.436 633 HB3 LEU 98 2HB LEU 98 -4.273 1.452 -2.421 634 HG LEU 98 HG LEU 98 -3.037 0.574 -4.239 635 HD11 LEU 98 1HD1 LEU 98 -4.959 -0.957 -3.831 636 HD12 LEU 98 2HD1 LEU 98 -4.213 -1.069 -5.437 637 HD13 LEU 98 3HD1 LEU 98 -5.748 -0.230 -5.256 638 HD21 LEU 98 3HD2 LEU 98 -3.307 2.529 -5.667 639 HD22 LEU 98 1HD2 LEU 98 -4.882 1.891 -6.196 640 HD23 LEU 98 2HD2 LEU 98 -3.396 1.008 -6.565 641 H LEU 99 H LEU 99 -6.226 1.380 -0.922 642 HA LEU 99 HA LEU 99 -6.949 -1.315 -0.874 643 HB3 LEU 99 2HB LEU 99 -7.968 -0.766 1.343 644 HG LEU 99 HG LEU 99 -6.038 -0.784 2.345 645 HD11 LEU 99 1HD1 LEU 99 -5.298 -2.150 0.511 646 HD12 LEU 99 2HD1 LEU 99 -3.979 -1.239 1.242 647 HD13 LEU 99 3HD1 LEU 99 -4.646 -0.705 -0.315 648 HD21 LEU 99 3HD2 LEU 99 -4.457 0.915 2.481 649 HD22 LEU 99 1HD2 LEU 99 -5.984 1.712 2.214 650 HD23 LEU 99 2HD2 LEU 99 -4.856 1.537 0.839 651 H ASP 100 H ASP 100 -9.087 1.517 -1.270 652 HA ASP 100 HA ASP 100 -11.602 0.099 -0.992 653 HB3 ASP 100 2HB ASP 100 -10.924 2.691 -2.400 654 H GLN 101 H GLN 101 -9.374 0.577 -3.676 655 HA GLN 101 HA GLN 101 -11.233 -0.245 -5.771 656 HB3 GLN 101 2HB GLN 101 -9.220 -0.375 -7.155 657 HG3 GLN 101 2HG GLN 101 -8.982 2.086 -5.392 658 HE21 GLN 101 1HE2 GLN 101 -8.830 3.905 -7.565 659 HE22 GLN 101 2HE2 GLN 101 -7.323 3.570 -8.409 660 H MET 102 H MET 102 -9.152 -1.863 -3.417 661 HA MET 102 HA MET 102 -8.909 -4.354 -4.897 662 HB3 MET 102 2HB MET 102 -7.827 -5.151 -2.781 663 HG3 MET 102 2HG MET 102 -6.876 -2.461 -3.803 664 HE1 MET 102 3HE MET 102 -5.668 -5.812 -1.647 665 HE2 MET 102 1HE MET 102 -5.237 -5.858 -3.368 666 HE3 MET 102 2HE MET 102 -3.969 -5.628 -2.149 667 H LYS 103 H LYS 103 -11.750 -3.360 -4.012 668 HA LYS 103 HA LYS 103 -12.617 -5.139 -1.957 669 HB3 LYS 103 2HB LYS 103 -14.975 -4.557 -2.977 670 HG3 LYS 103 2HG LYS 103 -14.708 -2.103 -2.374 671 HD3 LYS 103 2HD LYS 103 -13.722 -4.225 -0.399 672 HE3 LYS 103 2HE LYS 103 -14.834 -1.438 0.069 673 HZ1 LYS 103 3HZ LYS 103 -13.577 -3.258 2.027 674 HZ2 LYS 103 1HZ LYS 103 -15.207 -3.211 1.820 675 HZ3 LYS 103 2HZ LYS 103 -14.371 -1.888 2.334 676 H ASN 104 H ASN 104 -11.910 -6.020 -5.235 677 HA ASN 104 HA ASN 104 -13.383 -8.565 -4.763 678 HB3 ASN 104 2HB ASN 104 -13.417 -8.814 -7.218 679 HD21 ASN 104 1HD2 ASN 104 -14.377 -5.522 -7.457 680 HD22 ASN 104 2HD2 ASN 104 -16.028 -5.729 -6.935 681 H TYR 105 H TYR 105 -10.491 -7.450 -4.102 682 HA TYR 105 HA TYR 105 -8.778 -9.180 -5.680 683 HB3 TYR 105 2HB TYR 105 -8.400 -7.606 -3.099 684 HD1 TYR 105 1HD TYR 105 -6.291 -8.741 -6.027 685 HD2 TYR 105 2HD TYR 105 -6.788 -8.528 -1.740 686 HE1 TYR 105 1HE TYR 105 -4.083 -9.822 -5.712 687 HE2 TYR 105 2HE TYR 105 -4.593 -9.584 -1.421 688 HH TYR 105 HH TYR 105 -2.531 -10.016 -2.528 689 H ARG 106 H ARG 106 -7.762 -11.035 -5.016 690 HA ARG 106 HA ARG 106 -8.507 -12.420 -2.495 691 HB3 ARG 106 2HB ARG 106 -8.441 -14.531 -3.930 692 HG3 ARG 106 2HG ARG 106 -10.824 -13.559 -5.104 693 HD3 ARG 106 2HD ARG 106 -11.913 -14.529 -3.048 694 HE ARG 106 HE ARG 106 -10.027 -15.977 -4.732 695 HH11 ARG 106 1HH1 ARG 106 -12.262 -16.504 -1.988 696 HH12 ARG 106 2HH1 ARG 106 -12.501 -18.179 -2.360 697 HH21 ARG 106 1HH2 ARG 106 -10.467 -18.174 -5.262 698 HH22 ARG 106 2HH2 ARG 106 -11.609 -19.084 -4.343 699 H GLY 107 H GLY 107 -6.429 -12.757 -1.502 700 HA2 GLY 107 1HA GLY 107 -4.357 -14.210 -2.559 701 HA3 GLY 107 2HA GLY 107 -4.008 -12.556 -3.097 702 H GLU 108 H GLU 108 -2.400 -11.804 -1.719 703 HA GLU 108 HA GLU 108 -3.239 -11.345 1.046 704 HB3 GLU 108 2HB GLU 108 -1.072 -11.857 2.028 705 HG3 GLU 108 2HG GLU 108 -1.766 -14.430 0.628 706 H VAL 109 H VAL 109 -1.763 -9.582 2.004 707 HA VAL 109 HA VAL 109 -0.618 -7.851 -0.135 708 HB VAL 109 HB VAL 109 -2.403 -6.698 2.002 709 HG11 VAL 109 1HG1 VAL 109 -1.681 -5.895 -0.869 710 HG12 VAL 109 2HG1 VAL 109 -2.718 -4.956 0.222 711 HG13 VAL 109 3HG1 VAL 109 -1.000 -5.191 0.610 712 HG21 VAL 109 3HG2 VAL 109 -3.930 -8.311 0.945 713 HG22 VAL 109 1HG2 VAL 109 -4.332 -6.668 0.459 714 HG23 VAL 109 2HG2 VAL 109 -3.449 -7.715 -0.669 715 H ALA 110 H ALA 110 1.307 -6.875 0.464 716 HA ALA 110 HA ALA 110 1.838 -6.479 3.376 717 HB1 ALA 110 1HB ALA 110 4.192 -6.898 3.033 718 HB2 ALA 110 2HB ALA 110 3.290 -8.327 2.494 719 HB3 ALA 110 3HB ALA 110 3.945 -7.180 1.307 720 H SER 111 H SER 111 3.358 -4.669 3.795 721 HA SER 111 HA SER 111 3.618 -2.805 1.556 722 HB3 SER 111 2HB SER 111 2.692 -1.969 4.333 723 HG SER 111 HG SER 111 3.282 -0.562 1.947 724 H PHE 112 H PHE 112 5.447 -1.475 1.621 725 HA PHE 112 HA PHE 112 7.538 -2.142 3.581 726 HB3 PHE 112 2HB PHE 112 7.812 -3.650 1.722 727 HD1 PHE 112 2HD PHE 112 9.234 -0.695 -0.033 728 HD2 PHE 112 1HD PHE 112 6.224 -3.788 -0.122 729 HE1 PHE 112 2HE PHE 112 8.758 -0.146 -2.365 730 HE2 PHE 112 1HE PHE 112 5.766 -3.202 -2.514 731 HZ PHE 112 HZ PHE 112 6.953 -1.381 -3.597 732 H PHE 113 H PHE 113 8.610 -0.223 4.210 733 HA PHE 113 HA PHE 113 8.170 2.178 2.454 734 HB3 PHE 113 2HB PHE 113 6.811 2.592 4.272 735 HD1 PHE 113 2HD PHE 113 6.181 0.650 5.603 736 HD2 PHE 113 1HD PHE 113 9.771 2.859 6.497 737 HE1 PHE 113 2HE PHE 113 6.340 -0.476 7.808 738 HE2 PHE 113 1HE PHE 113 9.909 1.774 8.679 739 HZ PHE 113 HZ PHE 113 8.162 0.063 9.357 740 H THR 114 H THR 114 9.799 3.707 2.336 741 HA THR 114 HA THR 114 12.526 2.713 3.038 742 HB THR 114 HB THR 114 13.216 4.053 0.986 743 HG1 THR 114 1HG THR 114 11.112 5.136 0.708 744 HG21 THR 114 3HG2 THR 114 13.031 1.576 1.083 745 HG22 THR 114 1HG2 THR 114 12.705 2.269 -0.521 746 HG23 THR 114 2HG2 THR 114 11.358 1.707 0.491 747 H SER 115 H SER 115 10.731 4.331 4.696 748 HA SER 115 HA SER 115 12.395 6.746 5.158 749 HB3 SER 115 2HB SER 115 10.158 7.842 5.730 750 HG SER 115 HG SER 115 11.273 8.156 3.700 751 H ALA 116 H ALA 116 13.314 6.296 6.935 752 HA ALA 116 HA ALA 116 11.945 4.863 9.177 753 HB1 ALA 116 1HB ALA 116 14.623 4.171 7.889 754 HB2 ALA 116 2HB ALA 116 13.916 3.370 9.301 755 HB3 ALA 116 3HB ALA 116 13.105 3.265 7.717 756 H GLY 117 H GLY 117 13.386 7.724 8.548 757 HA2 GLY 117 1HA GLY 117 15.628 7.779 10.364 758 HA3 GLY 117 2HA GLY 117 14.781 9.178 9.672 759 H THR 118 H THR 118 12.227 8.887 10.573 760 HA THR 118 HA THR 118 12.586 9.208 13.513 761 HB THR 118 HB THR 118 10.759 10.981 11.918 762 HG1 THR 118 1HG THR 118 12.868 12.311 11.806 763 HG21 THR 118 3HG2 THR 118 10.929 11.190 14.411 764 HG22 THR 118 1HG2 THR 118 11.520 12.636 13.594 765 HG23 THR 118 2HG2 THR 118 12.676 11.468 14.253 766 H ASN 119 H ASN 119 11.134 7.076 11.597 767 HA ASN 119 HA ASN 119 8.891 6.615 13.438 768 HB3 ASN 119 2HB ASN 119 7.517 6.018 11.284 769 HD21 ASN 119 1HD2 ASN 119 6.944 7.231 13.731 770 HD22 ASN 119 2HD2 ASN 119 6.085 8.689 13.397 771 H HIS 120 H HIS 120 8.394 4.478 13.616 772 HA HIS 120 HA HIS 120 8.990 2.676 11.445 773 HB3 HIS 120 2HB HIS 120 10.018 2.014 14.249 774 HD1 HIS 120 1HD HIS 120 10.434 -0.585 14.521 775 HD2 HIS 120 2HD HIS 120 9.824 0.733 10.553 776 HE1 HIS 120 1HE HIS 120 10.493 -2.660 13.016 777 H LYS 121 H LYS 121 8.082 2.424 14.925 778 HA LYS 121 HA LYS 121 6.008 0.570 14.496 779 HB3 LYS 121 2HB LYS 121 5.427 2.067 16.880 780 HG3 LYS 121 2HG LYS 121 6.571 0.207 18.066 781 HD3 LYS 121 2HD LYS 121 5.270 -1.693 17.317 782 HE3 LYS 121 2HE LYS 121 3.620 0.828 16.874 783 HZ1 LYS 121 3HZ LYS 121 2.837 -1.734 18.097 784 HZ2 LYS 121 1HZ LYS 121 2.445 -1.314 16.550 785 HZ3 LYS 121 2HZ LYS 121 1.874 -0.426 17.800 786 H ALA 122 H ALA 122 5.867 4.182 14.485 787 HA ALA 122 HA ALA 122 3.068 4.316 14.744 788 HB1 ALA 122 1HB ALA 122 3.290 6.593 13.927 789 HB2 ALA 122 2HB ALA 122 4.651 6.246 15.003 790 HB3 ALA 122 3HB ALA 122 4.878 6.224 13.228 791 H TYR 123 H TYR 123 5.091 3.987 11.756 792 HA TYR 123 HA TYR 123 2.984 4.437 9.914 793 HB3 TYR 123 2HB TYR 123 5.368 2.569 9.588 794 HD1 TYR 123 1HD TYR 123 4.006 5.199 7.259 795 HD2 TYR 123 2HD TYR 123 4.262 0.970 8.110 796 HE1 TYR 123 1HE TYR 123 3.224 4.693 4.986 797 HE2 TYR 123 2HE TYR 123 3.433 0.462 5.831 798 HH TYR 123 HH TYR 123 2.877 1.327 3.740 799 H VAL 124 H VAL 124 4.197 1.372 11.382 800 HA VAL 124 HA VAL 124 2.441 -0.356 10.083 801 HB VAL 124 HB VAL 124 3.576 -0.599 12.903 802 HG11 VAL 124 1HG1 VAL 124 3.395 -3.029 12.530 803 HG12 VAL 124 2HG1 VAL 124 1.813 -2.257 12.523 804 HG13 VAL 124 3HG1 VAL 124 2.554 -2.742 10.991 805 HG21 VAL 124 3HG2 VAL 124 5.423 -0.236 11.371 806 HG22 VAL 124 1HG2 VAL 124 5.362 -1.962 11.728 807 HG23 VAL 124 2HG2 VAL 124 4.738 -1.366 10.188 808 H SER 125 H SER 125 1.902 1.353 13.182 809 HA SER 125 HA SER 125 -0.629 0.201 13.704 810 HB3 SER 125 2HB SER 125 0.288 2.960 14.570 811 HG SER 125 HG SER 125 -1.613 2.371 15.532 812 H HIS 126 H HIS 126 0.241 3.343 12.165 813 HA HIS 126 HA HIS 126 -2.483 4.202 11.708 814 HB3 HIS 126 2HB HIS 126 -1.300 5.881 10.287 815 HD1 HIS 126 1HD HIS 126 -2.759 6.093 12.974 816 HD2 HIS 126 2HD HIS 126 1.378 6.628 12.441 817 HE1 HIS 126 1HE HIS 126 -1.909 7.303 15.073 818 H PHE 127 H PHE 127 -0.152 2.331 9.768 819 HA PHE 127 HA PHE 127 -1.650 2.444 7.306 820 HB3 PHE 127 2HB PHE 127 0.544 0.672 8.423 821 HD1 PHE 127 1HD PHE 127 -1.040 1.343 5.071 822 HD2 PHE 127 2HD PHE 127 0.180 -1.559 8.008 823 HE1 PHE 127 1HE PHE 127 -1.729 -0.513 3.546 824 HE2 PHE 127 2HE PHE 127 -0.581 -3.379 6.523 825 HZ PHE 127 HZ PHE 127 -1.564 -2.844 4.325 826 H ASN 128 H ASN 128 -1.406 0.027 9.973 827 HA ASN 128 HA ASN 128 -3.102 -1.902 8.906 828 HB3 ASN 128 2HB ASN 128 -3.687 -2.155 11.552 829 HD21 ASN 128 1HD2 ASN 128 -0.973 -2.751 12.642 830 HD22 ASN 128 2HD2 ASN 128 -0.454 -4.153 11.734 831 H GLU 129 H GLU 129 -4.020 0.941 10.849 832 HA GLU 129 HA GLU 129 -6.829 0.410 10.859 833 HB3 GLU 129 2HB GLU 129 -6.878 2.995 11.214 834 HG3 GLU 129 2HG GLU 129 -5.695 2.941 13.389 835 H TRP 130 H TRP 130 -4.762 1.612 8.303 836 HA TRP 130 HA TRP 130 -7.083 2.777 6.885 837 HB3 TRP 130 2HB TRP 130 -5.205 3.689 5.417 838 HD1 TRP 130 HD TRP 130 -6.385 4.190 9.012 839 HE1 TRP 130 1HE TRP 130 -6.166 6.561 9.689 840 HE3 TRP 130 3HE TRP 130 -3.516 5.751 5.122 841 HZ2 TRP 130 2HZ TRP 130 -4.554 8.932 8.810 842 HZ3 TRP 130 3HZ TRP 130 -2.417 7.975 5.208 843 HH2 TRP 130 HH TRP 130 -2.965 9.581 7.023 844 H ALA 131 H ALA 131 -5.587 -0.163 7.115 845 HA ALA 131 HA ALA 131 -6.449 -0.933 4.384 846 HB1 ALA 131 1HB ALA 131 -3.987 -0.906 4.557 847 HB2 ALA 131 2HB ALA 131 -4.063 -1.973 5.982 848 HB3 ALA 131 3HB ALA 131 -4.594 -2.559 4.385 849 H ASP 132 H ASP 132 -7.797 -0.851 7.070 850 HA ASP 132 HA ASP 132 -7.913 -3.463 8.200 851 HB3 ASP 132 2HB ASP 132 -9.804 -1.079 8.440 852 H GLY 133 H GLY 133 -8.881 -5.152 7.396 853 HA2 GLY 133 1HA GLY 133 -10.944 -6.223 6.668 854 HA3 GLY 133 2HA GLY 133 -11.239 -4.876 5.576 855 H LEU 134 H LEU 134 -7.996 -5.325 5.117 856 HA LEU 134 HA LEU 134 -8.346 -7.515 3.108 857 HB3 LEU 134 2HB LEU 134 -6.523 -6.294 1.839 858 HG LEU 134 HG LEU 134 -9.152 -4.802 2.262 859 HD11 LEU 134 1HD1 LEU 134 -7.000 -4.333 0.163 860 HD12 LEU 134 2HD1 LEU 134 -7.407 -3.260 1.524 861 HD13 LEU 134 3HD1 LEU 134 -8.598 -3.547 0.252 862 HD21 LEU 134 3HD2 LEU 134 -9.775 -5.703 0.036 863 HD22 LEU 134 1HD2 LEU 134 -9.446 -7.006 1.186 864 HD23 LEU 134 2HD2 LEU 134 -8.236 -6.585 -0.050 865 H ASN 135 H ASN 135 -6.268 -8.678 2.676 866 HA ASN 135 HA ASN 135 -5.592 -9.704 5.314 867 HB3 ASN 135 2HB ASN 135 -4.813 -10.774 2.584 868 HD21 ASN 135 1HD2 ASN 135 -2.941 -11.836 3.301 869 HD22 ASN 135 2HD2 ASN 135 -2.998 -13.213 4.348 870 H VAL 136 H VAL 136 -4.198 -8.084 6.137 871 HA VAL 136 HA VAL 136 -1.685 -7.392 4.878 872 HB VAL 136 HB VAL 136 -2.757 -6.926 7.698 873 HG11 VAL 136 1HG1 VAL 136 -0.311 -6.806 7.766 874 HG12 VAL 136 2HG1 VAL 136 -0.282 -5.763 6.325 875 HG13 VAL 136 3HG1 VAL 136 -0.976 -5.188 7.860 876 HG21 VAL 136 3HG2 VAL 136 -4.063 -5.736 5.975 877 HG22 VAL 136 1HG2 VAL 136 -3.105 -4.600 6.906 878 HG23 VAL 136 2HG2 VAL 136 -2.570 -5.067 5.280 879 H ILE 137 H ILE 137 0.029 -8.879 4.784 880 HA ILE 137 HA ILE 137 0.577 -10.384 7.301 881 HB ILE 137 HB ILE 137 1.397 -12.180 6.126 882 HG13 ILE 137 2HG1 ILE 137 1.402 -12.383 3.643 883 HG21 ILE 137 1HG2 ILE 137 -1.063 -11.999 6.304 884 HG22 ILE 137 2HG2 ILE 137 -1.110 -11.374 4.640 885 HG23 ILE 137 3HG2 ILE 137 -0.499 -13.009 4.966 886 HD11 ILE 137 3HD1 ILE 137 1.620 -9.383 3.576 887 HD12 ILE 137 1HD1 ILE 137 1.783 -10.522 2.223 888 HD13 ILE 137 2HD1 ILE 137 0.195 -10.291 3.007 889 H GLY 138 H GLY 138 1.667 -7.683 5.861 890 HA2 GLY 138 1HA GLY 138 4.332 -7.976 7.063 891 HA3 GLY 138 2HA GLY 138 4.246 -7.832 5.296 892 H VAL 139 H VAL 139 5.011 -6.014 7.802 893 HA VAL 139 HA VAL 139 4.501 -3.632 6.230 894 HB VAL 139 HB VAL 139 3.809 -3.320 9.147 895 HG11 VAL 139 1HG1 VAL 139 4.294 -1.367 7.697 896 HG12 VAL 139 2HG1 VAL 139 2.998 -1.869 6.595 897 HG13 VAL 139 3HG1 VAL 139 2.602 -1.357 8.234 898 HG21 VAL 139 3HG2 VAL 139 1.676 -3.956 7.095 899 HG22 VAL 139 1HG2 VAL 139 2.136 -4.994 8.467 900 HG23 VAL 139 2HG2 VAL 139 1.426 -3.412 8.761 901 H ALA 140 H ALA 140 6.791 -3.577 5.877 902 HA ALA 140 HA ALA 140 8.504 -3.289 8.306 903 HB1 ALA 140 1HB ALA 140 8.519 -5.682 7.496 904 HB2 ALA 140 2HB ALA 140 9.213 -5.103 5.966 905 HB3 ALA 140 3HB ALA 140 10.106 -4.890 7.479 906 H ARG 141 H ARG 141 10.933 -2.697 7.442 907 HA ARG 141 HA ARG 141 10.529 -0.588 5.422 908 HB3 ARG 141 2HB ARG 141 11.328 -0.121 7.905 909 HG3 ARG 141 2HG ARG 141 13.986 -0.586 6.465 910 HD3 ARG 141 2HD ARG 141 13.251 1.238 8.465 911 HE ARG 141 HE ARG 141 14.887 -0.999 9.551 912 HH11 ARG 141 1HH1 ARG 141 12.845 1.819 10.255 913 HH12 ARG 141 2HH1 ARG 141 12.354 1.245 11.817 914 HH21 ARG 141 1HH2 ARG 141 14.435 -1.613 11.703 915 HH22 ARG 141 2HH2 ARG 141 13.217 -0.827 12.622 916 H ASP 142 H ASP 142 12.325 -0.222 3.996 917 HA ASP 142 HA ASP 142 13.472 -0.946 2.190 918 HB3 ASP 142 2HB ASP 142 15.587 -2.245 2.744 919 H ASP 143 H ASP 143 14.783 -3.592 1.752 920 HA ASP 143 HA ASP 143 12.373 -5.148 1.072 921 HB3 ASP 143 2HB ASP 143 13.160 -4.203 -0.924 922 H SER 144 H SER 144 12.929 -5.837 3.334 923 HA SER 144 HA SER 144 14.990 -8.000 3.424 924 HB3 SER 144 2HB SER 144 14.298 -6.858 6.024 925 HG SER 144 HG SER 144 16.626 -6.112 5.523 926 H GLU 145 H GLU 145 11.617 -7.424 3.576 927 HA GLU 145 HA GLU 145 11.243 -10.118 4.771 928 HB3 GLU 145 2HB GLU 145 9.096 -9.413 5.642 929 HG3 GLU 145 2HG GLU 145 11.195 -7.437 6.643 930 H VAL 146 H VAL 146 11.597 -8.888 1.936 931 HA VAL 146 HA VAL 146 9.219 -9.361 0.431 932 HB VAL 146 HB VAL 146 12.164 -9.676 -0.356 933 HG11 VAL 146 1HG1 VAL 146 11.442 -9.145 -2.639 934 HG12 VAL 146 2HG1 VAL 146 10.605 -10.584 -2.066 935 HG13 VAL 146 3HG1 VAL 146 9.756 -9.027 -2.079 936 HG21 VAL 146 3HG2 VAL 146 11.961 -7.319 -1.190 937 HG22 VAL 146 1HG2 VAL 146 10.391 -7.200 -0.367 938 HG23 VAL 146 2HG2 VAL 146 11.879 -7.453 0.567 939 H ASP 147 H ASP 147 11.848 -11.448 1.527 940 HA ASP 147 HA ASP 147 11.402 -13.696 -0.065 941 HB3 ASP 147 2HB ASP 147 12.431 -14.849 2.180 942 H LYS 148 H LYS 148 9.533 -12.709 2.664 943 HA LYS 148 HA LYS 148 8.314 -15.406 3.020 944 HB3 LYS 148 2HB LYS 148 8.773 -14.598 5.172 945 HG3 LYS 148 2HG LYS 148 7.602 -11.949 4.297 946 HD3 LYS 148 2HD LYS 148 7.281 -12.889 6.817 947 HE3 LYS 148 2HE LYS 148 9.907 -11.338 6.683 948 HZ1 LYS 148 3HZ LYS 148 8.580 -10.343 8.355 949 HZ2 LYS 148 1HZ LYS 148 9.693 -11.282 9.108 950 HZ3 LYS 148 2HZ LYS 148 8.112 -11.788 8.990 951 H TRP 149 H TRP 149 7.680 -12.018 1.980 952 HA TRP 149 HA TRP 149 4.851 -12.534 1.561 953 HB3 TRP 149 2HB TRP 149 4.779 -10.287 0.761 954 HD1 TRP 149 HD TRP 149 4.982 -11.434 3.855 955 HE1 TRP 149 1HE TRP 149 5.649 -9.789 5.675 956 HE3 TRP 149 3HE TRP 149 7.162 -7.874 0.928 957 HZ2 TRP 149 2HZ TRP 149 6.761 -7.071 5.821 958 HZ3 TRP 149 3HZ TRP 149 7.910 -5.754 1.871 959 HH2 TRP 149 HH TRP 149 7.657 -5.287 4.319 960 H SER 150 H SER 150 6.892 -14.252 0.009 961 HA SER 150 HA SER 150 5.075 -14.454 -2.170 962 HB3 SER 150 2HB SER 150 7.551 -14.722 -3.522 963 HG SER 150 HG SER 150 6.101 -13.926 -4.809 964 H LYS 151 H LYS 151 6.521 -15.883 0.370 965 HA LYS 151 HA LYS 151 7.695 -18.180 -0.912 966 HB3 LYS 151 2HB LYS 151 7.006 -18.222 1.990 967 HG3 LYS 151 2HG LYS 151 9.578 -18.574 0.366 968 HD3 LYS 151 2HD LYS 151 10.306 -19.892 2.334 969 HE3 LYS 151 2HE LYS 151 9.835 -16.947 2.913 970 HZ1 LYS 151 3HZ LYS 151 11.748 -18.888 4.051 971 HZ2 LYS 151 1HZ LYS 151 10.544 -18.137 4.874 972 HZ3 LYS 151 2HZ LYS 151 11.799 -17.251 4.297 Start of MODEL 11 1 H1 GLY 1 H GLY 1 -7.496 -21.074 -10.249 2 HA2 GLY 1 1HA GLY 1 -6.512 -22.622 -12.584 3 HA3 GLY 1 2HA GLY 1 -6.232 -20.880 -12.336 4 H MET 2 H MET 2 -3.888 -21.510 -12.440 5 HA MET 2 HA MET 2 -2.856 -21.867 -9.760 6 HB3 MET 2 2HB MET 2 -1.129 -23.526 -10.477 7 HG3 MET 2 2HG MET 2 -3.901 -24.735 -10.651 8 HE1 MET 2 3HE MET 2 -0.035 -25.198 -9.258 9 HE2 MET 2 1HE MET 2 -1.200 -24.648 -8.043 10 HE3 MET 2 2HE MET 2 -0.528 -26.298 -7.957 11 H ALA 3 H ALA 3 -1.869 -19.930 -9.734 12 HA ALA 3 HA ALA 3 0.419 -19.283 -11.221 13 HB1 ALA 3 1HB ALA 3 -0.478 -17.219 -12.291 14 HB2 ALA 3 2HB ALA 3 -1.200 -18.669 -13.016 15 HB3 ALA 3 3HB ALA 3 -2.134 -17.699 -11.854 16 H LYS 4 H LYS 4 1.483 -18.304 -9.507 17 HA LYS 4 HA LYS 4 -0.095 -16.382 -7.877 18 HB3 LYS 4 2HB LYS 4 0.514 -18.234 -6.494 19 HG3 LYS 4 2HG LYS 4 3.153 -18.135 -7.653 20 HD3 LYS 4 2HD LYS 4 3.022 -17.563 -4.671 21 HE3 LYS 4 2HE LYS 4 5.625 -17.065 -5.641 22 HZ1 LYS 4 3HZ LYS 4 6.345 -18.622 -4.094 23 HZ2 LYS 4 1HZ LYS 4 4.988 -19.508 -4.126 24 HZ3 LYS 4 2HZ LYS 4 4.977 -18.031 -3.424 25 H LYS 5 H LYS 5 0.174 -14.725 -9.383 26 HA LYS 5 HA LYS 5 2.939 -13.817 -9.981 27 HB3 LYS 5 2HB LYS 5 1.991 -11.937 -11.085 28 HG3 LYS 5 2HG LYS 5 -0.426 -13.177 -11.825 29 HD3 LYS 5 2HD LYS 5 0.970 -11.861 -13.375 30 HE3 LYS 5 2HE LYS 5 2.898 -13.996 -12.594 31 HZ1 LYS 5 3HZ LYS 5 4.016 -13.944 -14.645 32 HZ2 LYS 5 1HZ LYS 5 2.883 -12.991 -15.351 33 HZ3 LYS 5 2HZ LYS 5 2.516 -14.557 -14.886 34 H THR 6 H THR 6 3.199 -11.450 -9.540 35 HA THR 6 HA THR 6 2.275 -10.587 -6.891 36 HB THR 6 HB THR 6 5.203 -11.061 -7.548 37 HG1 THR 6 1HG THR 6 4.962 -12.473 -5.734 38 HG21 THR 6 3HG2 THR 6 3.957 -9.433 -5.289 39 HG22 THR 6 1HG2 THR 6 5.184 -8.907 -6.452 40 HG23 THR 6 2HG2 THR 6 5.595 -10.093 -5.222 41 H LEU 7 H LEU 7 2.295 -8.270 -6.718 42 HA LEU 7 HA LEU 7 3.427 -6.786 -9.034 43 HB3 LEU 7 2HB LEU 7 1.189 -5.372 -7.883 44 HG LEU 7 HG LEU 7 0.839 -6.795 -10.512 45 HD11 LEU 7 1HD1 LEU 7 -0.885 -5.331 -9.400 46 HD12 LEU 7 2HD1 LEU 7 -0.418 -4.766 -11.019 47 HD13 LEU 7 3HD1 LEU 7 0.223 -3.975 -9.568 48 HD21 LEU 7 3HD2 LEU 7 3.022 -5.961 -10.872 49 HD22 LEU 7 1HD2 LEU 7 2.658 -4.380 -10.115 50 HD23 LEU 7 2HD2 LEU 7 1.948 -4.872 -11.670 51 H ILE 8 H ILE 8 4.220 -4.765 -8.633 52 HA ILE 8 HA ILE 8 4.113 -3.837 -5.818 53 HB ILE 8 HB ILE 8 6.590 -3.647 -7.542 54 HG13 ILE 8 2HG1 ILE 8 5.820 -5.915 -5.831 55 HG21 ILE 8 1HG2 ILE 8 7.515 -2.981 -5.227 56 HG22 ILE 8 2HG2 ILE 8 6.481 -1.844 -6.070 57 HG23 ILE 8 3HG2 ILE 8 5.826 -2.835 -4.739 58 HD11 ILE 8 3HD1 ILE 8 6.801 -6.145 -8.213 59 HD12 ILE 8 1HD1 ILE 8 8.400 -5.821 -7.517 60 HD13 ILE 8 2HD1 ILE 8 7.471 -7.194 -6.962 61 H LEU 9 H LEU 9 3.415 -1.739 -5.681 62 HA LEU 9 HA LEU 9 3.531 0.070 -7.996 63 HB3 LEU 9 2HB LEU 9 1.646 1.151 -6.540 64 HG LEU 9 HG LEU 9 -0.166 -0.452 -7.377 65 HD11 LEU 9 1HD1 LEU 9 1.831 0.850 -9.250 66 HD12 LEU 9 2HD1 LEU 9 0.390 1.600 -8.528 67 HD13 LEU 9 3HD1 LEU 9 0.214 0.331 -9.744 68 HD21 LEU 9 3HD2 LEU 9 1.223 -2.491 -7.642 69 HD22 LEU 9 1HD2 LEU 9 2.034 -1.693 -9.028 70 HD23 LEU 9 2HD2 LEU 9 0.293 -1.981 -9.054 71 H TYR 10 H TYR 10 4.807 1.906 -7.516 72 HA TYR 10 HA TYR 10 5.893 2.039 -4.718 73 HB3 TYR 10 2HB TYR 10 7.488 0.964 -5.963 74 HD1 TYR 10 1HD TYR 10 6.672 -0.224 -7.915 75 HD2 TYR 10 2HD TYR 10 7.947 3.899 -8.221 76 HE1 TYR 10 1HE TYR 10 6.608 -0.389 -10.348 77 HE2 TYR 10 2HE TYR 10 7.908 3.733 -10.663 78 HH TYR 10 HH TYR 10 6.955 2.403 -12.447 79 H TYR 11 H TYR 11 4.264 3.814 -4.222 80 HA TYR 11 HA TYR 11 4.280 6.031 -6.042 81 HB3 TYR 11 2HB TYR 11 2.483 5.320 -3.869 82 HD1 TYR 11 1HD TYR 11 3.277 7.283 -2.093 83 HD2 TYR 11 2HD TYR 11 1.531 8.117 -5.948 84 HE1 TYR 11 1HE TYR 11 3.014 9.662 -1.463 85 HE2 TYR 11 2HE TYR 11 1.174 10.440 -5.247 86 HH TYR 11 HH TYR 11 2.285 11.804 -2.167 87 H SER 12 H SER 12 6.327 6.849 -6.134 88 HA SER 12 HA SER 12 6.506 9.126 -4.486 89 HB3 SER 12 2HB SER 12 9.128 7.612 -4.382 90 HG SER 12 HG SER 12 9.152 9.693 -3.542 91 H TRP 13 H TRP 13 6.061 10.045 -6.467 92 HA TRP 13 HA TRP 13 6.579 11.086 -8.368 93 HB3 TRP 13 2HB TRP 13 9.510 11.058 -7.663 94 HD1 TRP 13 HD TRP 13 10.554 12.965 -9.070 95 HE1 TRP 13 1HE TRP 13 9.777 15.257 -10.001 96 HE3 TRP 13 3HE TRP 13 5.700 12.993 -7.405 97 HZ2 TRP 13 2HZ TRP 13 7.350 16.726 -10.244 98 HZ3 TRP 13 3HZ TRP 13 4.198 14.869 -7.988 99 HH2 TRP 13 HH TRP 13 4.994 16.713 -9.435 100 H SER 14 H SER 14 8.895 11.042 -10.020 101 HA SER 14 HA SER 14 8.700 8.322 -11.268 102 HB3 SER 14 2HB SER 14 9.252 9.353 -13.340 103 HG SER 14 HG SER 14 7.113 9.725 -12.957 104 H GLY 15 H GLY 15 10.293 8.738 -8.916 105 HA2 GLY 15 1HA GLY 15 12.817 7.786 -9.793 106 HA3 GLY 15 2HA GLY 15 12.980 9.403 -9.124 107 H GLU 16 H GLU 16 13.406 9.330 -6.972 108 HA GLU 16 HA GLU 16 13.623 8.631 -4.807 109 HB3 GLU 16 2HB GLU 16 11.210 8.422 -3.793 110 HG3 GLU 16 2HG GLU 16 10.729 10.878 -4.288 111 H THR 17 H THR 17 10.768 6.512 -5.375 112 HA THR 17 HA THR 17 11.836 4.366 -3.833 113 HB THR 17 HB THR 17 9.645 3.329 -4.852 114 HG1 THR 17 1HG THR 17 8.261 4.816 -5.736 115 HG21 THR 17 3HG2 THR 17 9.653 5.670 -2.898 116 HG22 THR 17 1HG2 THR 17 9.791 3.941 -2.517 117 HG23 THR 17 2HG2 THR 17 8.267 4.576 -3.158 118 H LYS 18 H LYS 18 12.316 5.260 -7.050 119 HA LYS 18 HA LYS 18 11.909 2.964 -8.464 120 HB3 LYS 18 2HB LYS 18 14.208 4.909 -9.003 121 HG3 LYS 18 2HG LYS 18 12.353 3.239 -10.734 122 HD3 LYS 18 2HD LYS 18 14.443 5.226 -11.708 123 HE3 LYS 18 2HE LYS 18 13.604 3.283 -13.183 124 HZ1 LYS 18 3HZ LYS 18 11.232 5.031 -13.344 125 HZ2 LYS 18 1HZ LYS 18 11.282 3.471 -12.705 126 HZ3 LYS 18 2HZ LYS 18 11.535 3.719 -14.291 127 H LYS 19 H LYS 19 14.695 3.357 -6.278 128 HA LYS 19 HA LYS 19 15.984 1.020 -7.526 129 HB3 LYS 19 2HB LYS 19 17.410 1.154 -5.321 130 HG3 LYS 19 2HG LYS 19 17.593 3.292 -7.496 131 HD3 LYS 19 2HD LYS 19 20.062 2.960 -7.121 132 HE3 LYS 19 2HE LYS 19 18.470 4.105 -4.785 133 HZ1 LYS 19 3HZ LYS 19 20.393 5.606 -4.680 134 HZ2 LYS 19 1HZ LYS 19 21.227 4.618 -5.704 135 HZ3 LYS 19 2HZ LYS 19 20.771 4.095 -4.224 136 H MET 20 H MET 20 14.179 1.801 -4.553 137 HA MET 20 HA MET 20 13.817 -0.946 -3.794 138 HB3 MET 20 2HB MET 20 11.899 0.795 -2.524 139 HG3 MET 20 2HG MET 20 13.553 -1.179 -1.645 140 HE1 MET 20 3HE MET 20 17.190 -0.697 -1.213 141 HE2 MET 20 1HE MET 20 15.869 -1.700 -0.591 142 HE3 MET 20 2HE MET 20 15.903 -1.261 -2.329 143 H ALA 21 H ALA 21 13.188 -0.688 -6.398 144 HA ALA 21 HA ALA 21 10.481 -1.760 -6.392 145 HB1 ALA 21 1HB ALA 21 9.861 -0.691 -8.512 146 HB2 ALA 21 2HB ALA 21 10.186 0.535 -7.278 147 HB3 ALA 21 3HB ALA 21 11.393 0.213 -8.541 148 H GLU 22 H GLU 22 13.244 -1.077 -8.633 149 HA GLU 22 HA GLU 22 12.821 -3.443 -10.158 150 HB3 GLU 22 2HB GLU 22 15.169 -3.000 -11.023 151 HG3 GLU 22 2HG GLU 22 14.744 -0.627 -11.688 152 H LYS 23 H LYS 23 14.851 -2.859 -7.331 153 HA LYS 23 HA LYS 23 16.442 -5.234 -7.504 154 HB3 LYS 23 2HB LYS 23 16.277 -4.782 -4.822 155 HG3 LYS 23 2HG LYS 23 18.317 -4.675 -6.468 156 HD3 LYS 23 2HD LYS 23 19.195 -2.314 -6.097 157 HE3 LYS 23 2HE LYS 23 17.068 -2.710 -8.241 158 HZ1 LYS 23 3HZ LYS 23 17.661 -0.396 -8.225 159 HZ2 LYS 23 1HZ LYS 23 18.405 -1.107 -9.470 160 HZ3 LYS 23 2HZ LYS 23 19.278 -0.733 -8.146 161 H ILE 24 H ILE 24 13.525 -4.743 -5.438 162 HA ILE 24 HA ILE 24 13.082 -7.435 -4.901 163 HB ILE 24 HB ILE 24 11.341 -4.971 -5.069 164 HG13 ILE 24 2HG1 ILE 24 13.187 -5.446 -3.238 165 HG21 ILE 24 1HG2 ILE 24 9.539 -6.143 -3.756 166 HG22 ILE 24 2HG2 ILE 24 9.716 -6.823 -5.373 167 HG23 ILE 24 3HG2 ILE 24 10.429 -7.657 -3.983 168 HD11 ILE 24 3HD1 ILE 24 10.403 -4.661 -2.301 169 HD12 ILE 24 1HD1 ILE 24 11.954 -4.099 -1.659 170 HD13 ILE 24 2HD1 ILE 24 11.427 -3.588 -3.264 171 H ASN 25 H ASN 25 11.883 -5.599 -7.773 172 HA ASN 25 HA ASN 25 10.060 -7.565 -8.729 173 HB3 ASN 25 2HB ASN 25 11.908 -5.690 -10.176 174 HD21 ASN 25 1HD2 ASN 25 9.114 -7.980 -10.617 175 HD22 ASN 25 2HD2 ASN 25 9.299 -8.089 -12.321 176 H SER 26 H SER 26 13.584 -7.425 -8.851 177 HA SER 26 HA SER 26 13.931 -9.718 -10.553 178 HB3 SER 26 2HB SER 26 16.303 -9.083 -9.231 179 HG SER 26 HG SER 26 16.734 -8.952 -11.258 180 H GLU 27 H GLU 27 13.502 -9.264 -7.030 181 HA GLU 27 HA GLU 27 14.901 -11.760 -6.485 182 HB3 GLU 27 2HB GLU 27 15.343 -9.621 -5.246 183 HG3 GLU 27 2HG GLU 27 13.088 -10.830 -3.608 184 H ILE 28 H ILE 28 11.717 -10.705 -7.123 185 HA ILE 28 HA ILE 28 10.510 -12.999 -5.721 186 HB ILE 28 HB ILE 28 9.378 -10.512 -7.064 187 HG13 ILE 28 2HG1 ILE 28 10.471 -10.070 -4.910 188 HG21 ILE 28 1HG2 ILE 28 7.183 -11.298 -6.140 189 HG22 ILE 28 2HG2 ILE 28 7.793 -12.377 -7.372 190 HG23 ILE 28 3HG2 ILE 28 7.972 -12.800 -5.667 191 HD11 ILE 28 3HD1 ILE 28 7.561 -10.289 -4.156 192 HD12 ILE 28 1HD1 ILE 28 8.748 -9.118 -3.620 193 HD13 ILE 28 2HD1 ILE 28 8.153 -9.037 -5.291 194 H LYS 29 H LYS 29 9.170 -14.449 -6.859 195 HA LYS 29 HA LYS 29 10.085 -15.043 -9.602 196 HB3 LYS 29 2HB LYS 29 7.798 -16.670 -8.686 197 HG3 LYS 29 2HG LYS 29 9.571 -17.139 -10.483 198 HD3 LYS 29 2HD LYS 29 11.131 -18.323 -8.156 199 HE3 LYS 29 2HE LYS 29 11.838 -17.512 -11.004 200 HZ1 LYS 29 3HZ LYS 29 13.999 -18.248 -10.539 201 HZ2 LYS 29 1HZ LYS 29 13.600 -18.888 -9.082 202 HZ3 LYS 29 2HZ LYS 29 13.634 -17.240 -9.326 203 H ASP 30 H ASP 30 9.133 -14.326 -11.344 204 HA ASP 30 HA ASP 30 7.615 -13.586 -12.804 205 HB3 ASP 30 2HB ASP 30 5.479 -15.157 -11.343 206 H SER 31 H SER 31 8.051 -11.800 -10.698 207 HA SER 31 HA SER 31 5.442 -10.640 -9.999 208 HB3 SER 31 2HB SER 31 7.245 -10.560 -8.350 209 HG SER 31 HG SER 31 9.144 -10.213 -9.498 210 H GLU 32 H GLU 32 5.018 -8.303 -10.438 211 HA GLU 32 HA GLU 32 6.392 -7.194 -12.794 212 HB3 GLU 32 2HB GLU 32 3.904 -6.338 -13.291 213 HG3 GLU 32 2HG GLU 32 5.392 -8.111 -14.592 214 H LEU 33 H LEU 33 5.930 -5.000 -13.162 215 HA LEU 33 HA LEU 33 5.842 -3.447 -10.631 216 HB3 LEU 33 2HB LEU 33 7.828 -2.383 -12.484 217 HG LEU 33 HG LEU 33 7.853 -2.190 -10.023 218 HD11 LEU 33 1HD1 LEU 33 8.795 -4.245 -8.881 219 HD12 LEU 33 2HD1 LEU 33 8.234 -5.185 -10.353 220 HD13 LEU 33 3HD1 LEU 33 7.120 -4.320 -9.368 221 HD21 LEU 33 3HD2 LEU 33 10.273 -3.470 -11.365 222 HD22 LEU 33 1HD2 LEU 33 10.288 -2.597 -9.818 223 HD23 LEU 33 2HD2 LEU 33 9.868 -1.735 -11.309 224 H LYS 34 H LYS 34 4.271 -2.009 -10.751 225 HA LYS 34 HA LYS 34 3.499 -0.894 -13.410 226 HB3 LYS 34 2HB LYS 34 1.292 -1.059 -11.516 227 HG3 LYS 34 2HG LYS 34 1.397 -0.654 -14.152 228 HD3 LYS 34 2HD LYS 34 2.226 -3.047 -14.620 229 HE3 LYS 34 2HE LYS 34 -0.668 -3.628 -13.777 230 HZ1 LYS 34 3HZ LYS 34 1.225 -5.341 -15.319 231 HZ2 LYS 34 1HZ LYS 34 -0.319 -4.891 -15.688 232 HZ3 LYS 34 2HZ LYS 34 -0.054 -5.930 -14.489 233 H GLU 35 H GLU 35 2.089 1.159 -13.024 234 HA GLU 35 HA GLU 35 3.652 2.742 -11.068 235 HB3 GLU 35 2HB GLU 35 3.935 3.218 -13.521 236 HG3 GLU 35 2HG GLU 35 1.086 4.268 -13.387 237 H VAL 36 H VAL 36 2.699 4.479 -10.076 238 HA VAL 36 HA VAL 36 -0.205 4.329 -9.468 239 HB VAL 36 HB VAL 36 1.054 3.496 -7.441 240 HG11 VAL 36 1HG1 VAL 36 2.945 5.730 -7.634 241 HG12 VAL 36 2HG1 VAL 36 2.850 4.270 -6.558 242 HG13 VAL 36 3HG1 VAL 36 3.266 4.073 -8.196 243 HG21 VAL 36 3HG2 VAL 36 0.419 6.385 -6.965 244 HG22 VAL 36 1HG2 VAL 36 -0.812 5.125 -7.173 245 HG23 VAL 36 2HG2 VAL 36 0.339 4.999 -5.847 246 H LYS 37 H LYS 37 -1.279 6.380 -9.745 247 HA LYS 37 HA LYS 37 0.474 8.703 -10.329 248 HB3 LYS 37 2HB LYS 37 -1.006 9.311 -12.089 249 HG3 LYS 37 2HG LYS 37 -0.789 6.295 -12.372 250 HD3 LYS 37 2HD LYS 37 -0.377 8.286 -14.600 251 HE3 LYS 37 2HE LYS 37 -1.640 5.506 -14.572 252 HZ1 LYS 37 3HZ LYS 37 -0.922 5.413 -16.791 253 HZ2 LYS 37 1HZ LYS 37 -0.022 6.754 -16.701 254 HZ3 LYS 37 2HZ LYS 37 -1.694 6.836 -16.619 255 H VAL 38 H VAL 38 -1.047 10.770 -10.167 256 HA VAL 38 HA VAL 38 -2.818 10.493 -7.790 257 HB VAL 38 HB VAL 38 -2.258 12.907 -7.359 258 HG11 VAL 38 1HG1 VAL 38 0.056 10.962 -7.071 259 HG12 VAL 38 2HG1 VAL 38 -0.383 12.330 -5.994 260 HG13 VAL 38 3HG1 VAL 38 -1.420 10.909 -6.075 261 HG21 VAL 38 3HG2 VAL 38 -0.082 13.756 -8.063 262 HG22 VAL 38 1HG2 VAL 38 0.169 12.364 -9.129 263 HG23 VAL 38 2HG2 VAL 38 -1.148 13.526 -9.456 264 H SER 39 H SER 39 -4.743 11.702 -7.788 265 HA SER 39 HA SER 39 -5.808 12.529 -10.398 266 HB3 SER 39 2HB SER 39 -7.451 13.046 -8.027 267 HG SER 39 HG SER 39 -8.321 12.786 -10.108 268 H GLU 40 H GLU 40 -7.116 14.585 -10.130 269 HA GLU 40 HA GLU 40 -5.458 16.895 -9.636 270 HB3 GLU 40 2HB GLU 40 -6.921 16.780 -11.568 271 HG3 GLU 40 2HG GLU 40 -9.450 17.250 -10.959 272 H GLY 41 H GLY 41 -7.503 18.636 -8.636 273 HA2 GLY 41 1HA GLY 41 -6.876 18.301 -5.820 274 HA3 GLY 41 2HA GLY 41 -7.592 19.704 -6.632 275 H THR 42 H THR 42 -8.973 19.769 -4.738 276 HA THR 42 HA THR 42 -11.355 18.011 -4.903 277 HB THR 42 HB THR 42 -11.201 17.976 -2.337 278 HG1 THR 42 1HG THR 42 -9.251 18.459 -1.435 279 HG21 THR 42 3HG2 THR 42 -8.987 16.498 -3.844 280 HG22 THR 42 1HG2 THR 42 -10.665 15.964 -3.708 281 HG23 THR 42 2HG2 THR 42 -9.654 16.062 -2.262 282 H PHE 43 H PHE 43 -10.449 20.379 -2.448 283 HA PHE 43 HA PHE 43 -12.671 22.191 -3.278 284 HB3 PHE 43 2HB PHE 43 -12.057 23.344 -1.088 285 HD1 PHE 43 1HD PHE 43 -14.529 23.013 -1.443 286 HD2 PHE 43 2HD PHE 43 -11.985 19.882 0.096 287 HE1 PHE 43 1HE PHE 43 -16.518 21.838 -0.529 288 HE2 PHE 43 2HE PHE 43 -13.990 18.670 0.911 289 HZ PHE 43 HZ PHE 43 -16.253 19.649 0.605 290 H ASP 44 H ASP 44 -9.437 22.818 -1.873 291 HA ASP 44 HA ASP 44 -8.867 25.008 -3.699 292 HB3 ASP 44 2HB ASP 44 -6.501 24.678 -2.753 293 H ALA 45 H ALA 45 -9.227 24.021 -5.741 294 HA ALA 45 HA ALA 45 -7.610 21.820 -6.709 295 HB1 ALA 45 1HB ALA 45 -8.942 24.109 -8.212 296 HB2 ALA 45 2HB ALA 45 -8.290 22.629 -8.931 297 HB3 ALA 45 3HB ALA 45 -9.681 22.539 -7.846 298 H ASP 46 H ASP 46 -6.995 25.086 -6.005 299 HA ASP 46 HA ASP 46 -6.106 26.261 -7.987 300 HB3 ASP 46 2HB ASP 46 -4.655 26.665 -5.371 301 H MET 47 H MET 47 -3.595 24.334 -6.221 302 HA MET 47 HA MET 47 -2.362 23.907 -8.818 303 HB3 MET 47 2HB MET 47 -0.526 25.032 -6.688 304 HG3 MET 47 2HG MET 47 0.125 25.389 -9.534 305 HE1 MET 47 3HE MET 47 2.638 24.246 -10.213 306 HE2 MET 47 1HE MET 47 3.721 23.557 -8.980 307 HE3 MET 47 2HE MET 47 2.204 22.729 -9.388 308 H TYR 48 H TYR 48 -3.756 22.255 -7.102 309 HA TYR 48 HA TYR 48 -3.747 20.213 -6.094 310 HB3 TYR 48 2HB TYR 48 -2.118 18.583 -6.611 311 HD1 TYR 48 1HD TYR 48 -3.806 18.246 -8.510 312 HD2 TYR 48 2HD TYR 48 -0.317 20.754 -8.884 313 HE1 TYR 48 1HE TYR 48 -3.948 18.081 -10.990 314 HE2 TYR 48 2HE TYR 48 -0.458 20.606 -11.332 315 HH TYR 48 HH TYR 48 -2.652 18.420 -13.023 316 H LYS 49 H LYS 49 -2.632 18.848 -4.315 317 HA LYS 49 HA LYS 49 -0.464 20.026 -2.861 318 HB3 LYS 49 2HB LYS 49 -1.967 21.494 -1.798 319 HG3 LYS 49 2HG LYS 49 -3.805 20.456 -0.284 320 HD3 LYS 49 2HD LYS 49 -4.581 20.672 -3.219 321 HE3 LYS 49 2HE LYS 49 -6.647 21.609 -2.192 322 HZ1 LYS 49 3HZ LYS 49 -6.656 19.223 -2.600 323 HZ2 LYS 49 1HZ LYS 49 -7.466 19.527 -1.206 324 HZ3 LYS 49 2HZ LYS 49 -5.975 18.918 -1.163 325 H THR 50 H THR 50 0.165 17.898 -3.768 326 HA THR 50 HA THR 50 -0.491 15.747 -1.818 327 HB THR 50 HB THR 50 -1.836 15.390 -3.765 328 HG1 THR 50 1HG THR 50 0.379 13.715 -3.329 329 HG21 THR 50 3HG2 THR 50 -0.968 14.817 -5.940 330 HG22 THR 50 1HG2 THR 50 0.697 15.193 -5.428 331 HG23 THR 50 2HG2 THR 50 -0.531 16.480 -5.541 332 H SER 51 H SER 51 1.903 17.699 -2.226 333 HA SER 51 HA SER 51 3.701 15.611 -1.388 334 HB3 SER 51 2HB SER 51 4.918 17.619 -3.290 335 HG SER 51 HG SER 51 6.336 16.121 -2.274 336 H ASP 52 H ASP 52 5.562 16.660 -0.290 337 HA ASP 52 HA ASP 52 6.468 17.917 1.282 338 HB3 ASP 52 2HB ASP 52 6.305 20.339 1.268 339 H ILE 53 H ILE 53 5.972 19.327 3.250 340 HA ILE 53 HA ILE 53 4.972 19.718 5.192 341 HB ILE 53 HB ILE 53 2.251 19.022 4.019 342 HG13 ILE 53 2HG1 ILE 53 3.321 20.686 2.522 343 HG21 ILE 53 1HG2 ILE 53 1.432 20.598 5.755 344 HG22 ILE 53 2HG2 ILE 53 2.312 19.283 6.478 345 HG23 ILE 53 3HG2 ILE 53 3.099 20.879 6.283 346 HD11 ILE 53 3HD1 ILE 53 1.369 22.208 4.257 347 HD12 ILE 53 1HD1 ILE 53 1.788 22.465 2.571 348 HD13 ILE 53 2HD1 ILE 53 0.907 20.999 3.024 349 H ALA 54 H ALA 54 4.290 18.560 7.105 350 HA ALA 54 HA ALA 54 4.606 15.625 6.868 351 HB1 ALA 54 1HB ALA 54 4.688 15.798 9.394 352 HB2 ALA 54 2HB ALA 54 5.981 16.668 8.545 353 HB3 ALA 54 3HB ALA 54 4.596 17.560 9.231 354 H LEU 55 H LEU 55 2.505 17.345 9.183 355 HA LEU 55 HA LEU 55 0.096 15.862 8.287 356 HB3 LEU 55 2HB LEU 55 -0.925 17.333 10.090 357 HG LEU 55 HG LEU 55 -0.144 14.758 10.095 358 HD11 LEU 55 1HD1 LEU 55 1.222 14.196 12.022 359 HD12 LEU 55 2HD1 LEU 55 1.443 15.902 12.420 360 HD13 LEU 55 3HD1 LEU 55 2.161 15.229 10.941 361 HD21 LEU 55 3HD2 LEU 55 -2.060 15.758 11.214 362 HD22 LEU 55 1HD2 LEU 55 -1.032 16.285 12.560 363 HD23 LEU 55 2HD2 LEU 55 -1.272 14.547 12.241 364 H ASP 56 H ASP 56 -0.316 16.731 6.270 365 HA ASP 56 HA ASP 56 -1.493 19.471 6.477 366 HB3 ASP 56 2HB ASP 56 -0.734 17.944 3.971 367 H GLN 57 H GLN 57 -2.279 16.780 4.425 368 HA GLN 57 HA GLN 57 -4.989 16.684 5.016 369 HB3 GLN 57 2HB GLN 57 -4.216 16.243 2.853 370 HG3 GLN 57 2HG GLN 57 -3.181 14.026 2.273 371 HE21 GLN 57 1HE2 GLN 57 -0.492 14.459 4.241 372 HE22 GLN 57 2HE2 GLN 57 0.280 15.645 3.252 373 H ILE 58 H ILE 58 -4.170 16.321 7.513 374 HA ILE 58 HA ILE 58 -5.232 13.609 8.126 375 HB ILE 58 HB ILE 58 -2.693 14.775 9.335 376 HG13 ILE 58 2HG1 ILE 58 -3.351 12.345 7.676 377 HG21 ILE 58 1HG2 ILE 58 -4.522 12.589 10.406 378 HG22 ILE 58 2HG2 ILE 58 -2.803 12.715 10.866 379 HG23 ILE 58 3HG2 ILE 58 -3.907 13.999 11.263 380 HD11 ILE 58 3HD1 ILE 58 -1.948 14.469 6.862 381 HD12 ILE 58 1HD1 ILE 58 -0.680 13.747 7.855 382 HD13 ILE 58 2HD1 ILE 58 -1.398 12.831 6.512 383 H GLN 59 H GLN 59 -3.994 16.187 10.328 384 HA GLN 59 HA GLN 59 -6.596 16.154 11.639 385 HB3 GLN 59 2HB GLN 59 -5.387 17.963 13.068 386 HG3 GLN 59 2HG GLN 59 -4.229 15.146 13.079 387 HE21 GLN 59 1HE2 GLN 59 -2.881 14.785 14.847 388 HE22 GLN 59 2HE2 GLN 59 -2.753 15.840 16.229 389 H GLY 60 H GLY 60 -8.238 17.482 11.194 390 HA2 GLY 60 1HA GLY 60 -9.414 19.326 10.577 391 HA3 GLY 60 2HA GLY 60 -7.911 20.246 10.516 392 H ASN 61 H ASN 61 -7.354 17.635 8.484 393 HA ASN 61 HA ASN 61 -8.641 18.823 6.103 394 HB3 ASN 61 2HB ASN 61 -6.495 18.397 4.936 395 HD21 ASN 61 1HD2 ASN 61 -4.853 19.827 7.518 396 HD22 ASN 61 2HD2 ASN 61 -5.150 21.504 7.129 397 H LYS 62 H LYS 62 -10.084 17.003 6.655 398 HA LYS 62 HA LYS 62 -8.993 14.275 6.604 399 HB3 LYS 62 2HB LYS 62 -10.928 14.495 7.963 400 HG3 LYS 62 2HG LYS 62 -13.196 14.939 6.602 401 HD3 LYS 62 2HD LYS 62 -11.482 17.120 7.878 402 HE3 LYS 62 2HE LYS 62 -14.433 17.054 7.134 403 HZ1 LYS 62 3HZ LYS 62 -12.893 19.152 8.548 404 HZ2 LYS 62 1HZ LYS 62 -14.081 18.207 9.215 405 HZ3 LYS 62 2HZ LYS 62 -14.431 19.289 8.022 406 H ASP 63 H ASP 63 -9.976 16.627 4.309 407 HA ASP 63 HA ASP 63 -10.843 14.872 2.200 408 HB3 ASP 63 2HB ASP 63 -10.963 16.970 0.903 409 H PHE 64 H PHE 64 -8.942 13.454 2.200 410 HA PHE 64 HA PHE 64 -6.332 14.501 1.600 411 HB3 PHE 64 2HB PHE 64 -6.281 12.578 2.860 412 HD1 PHE 64 2HD PHE 64 -7.716 11.038 -0.295 413 HD2 PHE 64 1HD PHE 64 -7.741 11.185 4.018 414 HE1 PHE 64 2HE PHE 64 -9.306 9.155 -0.235 415 HE2 PHE 64 1HE PHE 64 -9.285 9.242 4.071 416 HZ PHE 64 HZ PHE 64 -10.094 8.239 1.932 417 HA PRO 65 HA PRO 65 -6.375 14.444 -2.850 418 HB3 PRO 65 2HB PRO 65 -4.392 15.627 -2.691 419 HG3 PRO 65 2HG PRO 65 -2.769 15.113 -1.080 420 HD3 PRO 65 2HD PRO 65 -4.604 15.130 0.340 421 H GLU 66 H GLU 66 -6.963 12.903 -4.282 422 HA GLU 66 HA GLU 66 -6.746 10.115 -3.472 423 HB3 GLU 66 2HB GLU 66 -8.332 9.808 -5.405 424 HG3 GLU 66 2HG GLU 66 -9.099 12.012 -3.457 425 H ILE 67 H ILE 67 -6.218 8.447 -4.956 426 HA ILE 67 HA ILE 67 -3.850 9.076 -6.625 427 HB ILE 67 HB ILE 67 -3.565 6.631 -6.825 428 HG13 ILE 67 2HG1 ILE 67 -6.187 6.559 -5.364 429 HG21 ILE 67 1HG2 ILE 67 -2.437 7.931 -5.087 430 HG22 ILE 67 2HG2 ILE 67 -3.777 7.620 -3.972 431 HG23 ILE 67 3HG2 ILE 67 -2.788 6.273 -4.566 432 HD11 ILE 67 3HD1 ILE 67 -4.810 4.718 -7.312 433 HD12 ILE 67 1HD1 ILE 67 -6.310 4.311 -6.432 434 HD13 ILE 67 2HD1 ILE 67 -6.287 5.677 -7.571 435 H GLN 68 H GLN 68 -3.692 7.862 -8.697 436 HA GLN 68 HA GLN 68 -6.209 7.196 -10.059 437 HB3 GLN 68 2HB GLN 68 -4.782 8.055 -12.175 438 HG3 GLN 68 2HG GLN 68 -6.345 10.048 -10.509 439 HE21 GLN 68 1HE2 GLN 68 -4.728 11.588 -11.632 440 HE22 GLN 68 2HE2 GLN 68 -5.005 11.996 -13.290 441 H LEU 69 H LEU 69 -5.804 5.585 -11.693 442 HA LEU 69 HA LEU 69 -3.299 4.943 -12.686 443 HB3 LEU 69 2HB LEU 69 -3.031 3.672 -10.496 444 HG LEU 69 HG LEU 69 -4.831 1.592 -11.790 445 HD11 LEU 69 1HD1 LEU 69 -4.341 0.344 -9.740 446 HD12 LEU 69 2HD1 LEU 69 -3.381 1.708 -9.125 447 HD13 LEU 69 3HD1 LEU 69 -2.837 0.821 -10.551 448 HD21 LEU 69 3HD2 LEU 69 -5.413 3.268 -9.302 449 HD22 LEU 69 1HD2 LEU 69 -6.318 1.824 -9.787 450 HD23 LEU 69 2HD2 LEU 69 -6.359 3.251 -10.806 451 H ASP 70 H ASP 70 -3.588 2.867 -14.080 452 HA ASP 70 HA ASP 70 -5.773 3.320 -15.853 453 HB3 ASP 70 2HB ASP 70 -4.677 0.729 -16.333 454 H ASN 71 H ASN 71 -6.991 1.222 -16.692 455 HA ASN 71 HA ASN 71 -8.758 0.375 -14.518 456 HB3 ASN 71 2HB ASN 71 -8.824 -0.526 -17.412 457 HD21 ASN 71 1HD2 ASN 71 -9.525 -2.533 -16.066 458 HD22 ASN 71 2HD2 ASN 71 -11.180 -2.546 -15.502 459 H ILE 72 H ILE 72 -7.413 -0.749 -13.314 460 HA ILE 72 HA ILE 72 -6.182 -3.280 -14.355 461 HB ILE 72 HB ILE 72 -5.324 -1.650 -11.973 462 HG13 ILE 72 2HG1 ILE 72 -4.936 -0.399 -14.095 463 HG21 ILE 72 1HG2 ILE 72 -4.737 -3.944 -11.695 464 HG22 ILE 72 2HG2 ILE 72 -3.923 -3.979 -13.295 465 HG23 ILE 72 3HG2 ILE 72 -3.308 -2.989 -11.949 466 HD11 ILE 72 3HD1 ILE 72 -2.610 -0.015 -14.180 467 HD12 ILE 72 1HD1 ILE 72 -3.050 -0.287 -12.483 468 HD13 ILE 72 2HD1 ILE 72 -2.255 -1.577 -13.432 469 H ASP 73 H ASP 73 -7.063 -5.018 -13.700 470 HA ASP 73 HA ASP 73 -8.731 -5.287 -11.280 471 HB3 ASP 73 2HB ASP 73 -7.996 -7.865 -12.149 472 H TYR 74 H TYR 74 -7.784 -5.517 -9.338 473 HA TYR 74 HA TYR 74 -5.005 -6.184 -8.991 474 HB3 TYR 74 2HB TYR 74 -5.425 -6.142 -6.659 475 HD1 TYR 74 1HD TYR 74 -4.272 -4.126 -7.987 476 HD2 TYR 74 2HD TYR 74 -8.412 -4.228 -6.822 477 HE1 TYR 74 1HE TYR 74 -4.442 -1.738 -8.463 478 HE2 TYR 74 2HE TYR 74 -8.610 -1.810 -7.264 479 HH TYR 74 HH TYR 74 -7.524 0.126 -8.001 480 H ASN 75 H ASN 75 -7.921 -8.145 -9.143 481 HA ASN 75 HA ASN 75 -7.136 -10.391 -7.704 482 HB3 ASN 75 2HB ASN 75 -8.785 -11.652 -8.935 483 HD21 ASN 75 1HD2 ASN 75 -10.247 -11.071 -7.166 484 HD22 ASN 75 2HD2 ASN 75 -11.044 -9.488 -7.161 485 H ASN 76 H ASN 76 -5.999 -9.466 -10.896 486 HA ASN 76 HA ASN 76 -5.549 -12.138 -11.858 487 HB3 ASN 76 2HB ASN 76 -4.285 -11.088 -13.656 488 HD21 ASN 76 1HD2 ASN 76 -5.562 -8.196 -14.094 489 HD22 ASN 76 2HD2 ASN 76 -7.153 -8.649 -14.614 490 H TYR 77 H TYR 77 -4.055 -10.748 -9.285 491 HA TYR 77 HA TYR 77 -1.517 -12.145 -9.658 492 HB3 TYR 77 2HB TYR 77 -0.350 -10.273 -8.576 493 HD1 TYR 77 2HD TYR 77 -3.186 -8.522 -10.261 494 HD2 TYR 77 1HD TYR 77 0.873 -9.920 -10.692 495 HE1 TYR 77 2HE TYR 77 -3.079 -7.515 -12.529 496 HE2 TYR 77 1HE TYR 77 1.024 -8.843 -12.883 497 HH TYR 77 HH TYR 77 -1.548 -8.081 -14.688 498 H ASP 78 H ASP 78 -0.665 -12.834 -7.501 499 HA ASP 78 HA ASP 78 -2.903 -13.429 -5.627 500 HB3 ASP 78 2HB ASP 78 -0.243 -14.824 -6.009 501 H LEU 79 H LEU 79 -0.055 -11.547 -5.961 502 HA LEU 79 HA LEU 79 0.087 -11.006 -3.035 503 HB3 LEU 79 2HB LEU 79 2.703 -10.936 -4.174 504 HG LEU 79 HG LEU 79 1.338 -12.984 -2.391 505 HD11 LEU 79 1HD1 LEU 79 3.644 -13.775 -1.857 506 HD12 LEU 79 2HD1 LEU 79 4.256 -12.742 -3.153 507 HD13 LEU 79 3HD1 LEU 79 3.174 -14.083 -3.540 508 HD21 LEU 79 3HD2 LEU 79 2.433 -10.339 -1.979 509 HD22 LEU 79 1HD2 LEU 79 3.434 -11.484 -1.094 510 HD23 LEU 79 2HD2 LEU 79 1.714 -11.402 -0.775 511 H ILE 80 H ILE 80 0.314 -8.834 -2.576 512 HA ILE 80 HA ILE 80 0.883 -6.935 -4.815 513 HB ILE 80 HB ILE 80 -1.542 -6.902 -3.008 514 HG13 ILE 80 2HG1 ILE 80 -1.769 -8.375 -4.952 515 HG21 ILE 80 1HG2 ILE 80 -0.584 -4.607 -3.256 516 HG22 ILE 80 2HG2 ILE 80 -0.592 -4.835 -5.027 517 HG23 ILE 80 3HG2 ILE 80 -2.108 -4.766 -4.102 518 HD11 ILE 80 3HD1 ILE 80 -3.150 -5.804 -5.820 519 HD12 ILE 80 1HD1 ILE 80 -3.569 -7.474 -6.204 520 HD13 ILE 80 2HD1 ILE 80 -3.759 -6.897 -4.541 521 H LEU 81 H LEU 81 2.650 -5.861 -4.244 522 HA LEU 81 HA LEU 81 3.124 -5.128 -1.401 523 HB3 LEU 81 2HB LEU 81 5.433 -4.677 -2.123 524 HG LEU 81 HG LEU 81 4.412 -7.410 -2.997 525 HD11 LEU 81 1HD1 LEU 81 6.424 -7.279 -4.174 526 HD12 LEU 81 2HD1 LEU 81 6.880 -8.038 -2.655 527 HD13 LEU 81 3HD1 LEU 81 7.233 -6.318 -2.912 528 HD21 LEU 81 3HD2 LEU 81 5.409 -8.090 -0.835 529 HD22 LEU 81 1HD2 LEU 81 4.131 -6.896 -0.648 530 HD23 LEU 81 2HD2 LEU 81 5.839 -6.400 -0.490 531 H ILE 82 H ILE 82 3.755 -2.986 -0.879 532 HA ILE 82 HA ILE 82 2.993 -0.840 -2.784 533 HB ILE 82 HB ILE 82 1.858 -1.099 0.039 534 HG13 ILE 82 2HG1 ILE 82 0.896 -2.961 -1.321 535 HG21 ILE 82 1HG2 ILE 82 0.390 0.700 -0.736 536 HG22 ILE 82 2HG2 ILE 82 2.060 1.180 -0.967 537 HG23 ILE 82 3HG2 ILE 82 1.097 0.626 -2.358 538 HD11 ILE 82 3HD1 ILE 82 -0.471 -1.820 0.435 539 HD12 ILE 82 1HD1 ILE 82 -1.219 -0.855 -0.864 540 HD13 ILE 82 2HD1 ILE 82 -1.383 -2.611 -0.862 541 H GLY 83 H GLY 83 4.607 0.709 -2.710 542 HA2 GLY 83 1HA GLY 83 6.054 1.193 -0.132 543 HA3 GLY 83 2HA GLY 83 6.665 1.560 -1.738 544 H SER 84 H SER 84 6.081 3.263 0.745 545 HA SER 84 HA SER 84 5.298 5.667 -0.622 546 HB3 SER 84 2HB SER 84 3.061 4.924 -0.172 547 HG SER 84 HG SER 84 2.682 4.600 2.280 548 HA PRO 85 HA PRO 85 7.894 7.064 2.719 549 HB3 PRO 85 2HB PRO 85 8.084 8.930 1.300 550 HG3 PRO 85 2HG PRO 85 6.126 10.114 0.553 551 HD3 PRO 85 2HD PRO 85 5.864 7.902 -0.235 552 H VAL 86 H VAL 86 8.074 8.193 4.933 553 HA VAL 86 HA VAL 86 5.632 9.066 6.228 554 HB VAL 86 HB VAL 86 5.507 6.663 6.503 555 HG11 VAL 86 1HG1 VAL 86 7.545 5.724 6.608 556 HG12 VAL 86 2HG1 VAL 86 8.134 6.765 7.948 557 HG13 VAL 86 3HG1 VAL 86 6.924 5.494 8.224 558 HG21 VAL 86 3HG2 VAL 86 4.480 8.163 8.185 559 HG22 VAL 86 1HG2 VAL 86 4.983 6.657 8.906 560 HG23 VAL 86 2HG2 VAL 86 5.976 8.095 9.159 561 H TRP 87 H TRP 87 6.118 10.476 8.049 562 HA TRP 87 HA TRP 87 8.584 10.000 9.457 563 HB3 TRP 87 2HB TRP 87 8.390 12.774 8.269 564 HD1 TRP 87 HD TRP 87 10.657 10.377 10.243 565 HE1 TRP 87 1HE TRP 87 12.591 11.691 11.240 566 HE3 TRP 87 3HE TRP 87 9.709 14.900 8.046 567 HZ2 TRP 87 2HZ TRP 87 13.743 14.365 10.938 568 HZ3 TRP 87 3HZ TRP 87 11.303 16.757 8.312 569 HH2 TRP 87 HH TRP 87 13.348 16.476 9.718 570 H SER 88 H SER 88 5.415 11.108 9.607 571 HA SER 88 HA SER 88 5.965 11.968 12.380 572 HB3 SER 88 2HB SER 88 5.541 13.984 11.301 573 HG SER 88 HG SER 88 4.977 13.519 9.275 574 H GLY 89 H GLY 89 4.944 9.322 11.062 575 HA2 GLY 89 1HA GLY 89 3.509 7.831 12.302 576 HA3 GLY 89 2HA GLY 89 2.316 9.132 12.470 577 H TYR 90 H TYR 90 1.833 10.213 10.131 578 HA TYR 90 HA TYR 90 1.539 8.315 7.980 579 HB3 TYR 90 2HB TYR 90 -0.165 7.343 9.186 580 HD1 TYR 90 1HD TYR 90 -0.171 10.882 10.353 581 HD2 TYR 90 2HD TYR 90 -2.357 7.173 10.374 582 HE1 TYR 90 1HE TYR 90 -1.256 11.561 12.425 583 HE2 TYR 90 2HE TYR 90 -3.468 7.828 12.429 584 HH TYR 90 HH TYR 90 -2.976 11.109 13.917 585 HA PRO 91 HA PRO 91 1.356 12.909 7.195 586 HB3 PRO 91 2HB PRO 91 3.654 13.160 7.257 587 HG3 PRO 91 2HG PRO 91 5.118 11.413 6.582 588 HD3 PRO 91 2HD PRO 91 3.741 10.394 8.198 589 H ALA 92 H ALA 92 1.757 10.129 4.968 590 HA ALA 92 HA ALA 92 0.682 11.736 2.740 591 HB1 ALA 92 1HB ALA 92 1.875 8.938 2.618 592 HB2 ALA 92 2HB ALA 92 1.751 10.151 1.333 593 HB3 ALA 92 3HB ALA 92 2.900 10.402 2.635 594 H THR 93 H THR 93 -1.071 10.731 1.421 595 HA THR 93 HA THR 93 -2.498 8.443 2.692 596 HB THR 93 HB THR 93 -4.614 9.891 1.818 597 HG1 THR 93 1HG THR 93 -2.862 11.851 2.828 598 HG21 THR 93 3HG2 THR 93 -4.534 9.099 4.057 599 HG22 THR 93 1HG2 THR 93 -4.931 10.810 4.082 600 HG23 THR 93 2HG2 THR 93 -3.287 10.297 4.513 601 HA PRO 94 HA PRO 94 -2.213 8.000 -1.964 602 HB3 PRO 94 2HB PRO 94 0.114 8.488 -2.213 603 HG3 PRO 94 2HG PRO 94 1.709 7.745 -0.497 604 HD3 PRO 94 2HD PRO 94 0.161 9.289 0.301 605 H ILE 95 H ILE 95 -1.731 6.006 0.852 606 HA ILE 95 HA ILE 95 -2.824 3.674 -0.635 607 HB ILE 95 HB ILE 95 -1.442 3.351 1.977 608 HG13 ILE 95 2HG1 ILE 95 0.706 2.766 0.976 609 HG21 ILE 95 1HG2 ILE 95 -2.707 1.514 0.973 610 HG22 ILE 95 2HG2 ILE 95 -1.725 1.596 -0.493 611 HG23 ILE 95 3HG2 ILE 95 -0.993 1.105 1.057 612 HD11 ILE 95 3HD1 ILE 95 -0.043 2.829 -1.519 613 HD12 ILE 95 1HD1 ILE 95 0.123 4.580 -1.375 614 HD13 ILE 95 2HD1 ILE 95 1.514 3.566 -1.076 615 H LYS 96 H LYS 96 -4.424 5.639 -0.092 616 HA LYS 96 HA LYS 96 -6.142 4.526 2.048 617 HB3 LYS 96 2HB LYS 96 -7.093 7.166 1.409 618 HG3 LYS 96 2HG LYS 96 -6.638 7.594 3.808 619 HD3 LYS 96 2HD LYS 96 -7.913 4.834 3.530 620 HE3 LYS 96 2HE LYS 96 -8.143 7.151 5.482 621 HZ1 LYS 96 3HZ LYS 96 -10.075 5.907 6.353 622 HZ2 LYS 96 1HZ LYS 96 -10.178 5.066 4.944 623 HZ3 LYS 96 2HZ LYS 96 -10.393 6.674 4.941 624 H THR 97 H THR 97 -6.466 6.598 -0.888 625 HA THR 97 HA THR 97 -9.000 5.744 -1.639 626 HB THR 97 HB THR 97 -6.697 6.671 -3.362 627 HG1 THR 97 1HG THR 97 -8.517 8.336 -2.019 628 HG21 THR 97 3HG2 THR 97 -9.569 7.488 -3.792 629 HG22 THR 97 1HG2 THR 97 -8.901 6.023 -4.543 630 HG23 THR 97 2HG2 THR 97 -8.213 7.608 -4.900 631 H LEU 98 H LEU 98 -5.784 4.487 -2.819 632 HA LEU 98 HA LEU 98 -6.880 2.686 -4.681 633 HB3 LEU 98 2HB LEU 98 -4.333 2.211 -3.079 634 HG LEU 98 HG LEU 98 -3.322 1.363 -5.045 635 HD11 LEU 98 1HD1 LEU 98 -5.938 -0.135 -5.068 636 HD12 LEU 98 2HD1 LEU 98 -4.711 -0.299 -3.777 637 HD13 LEU 98 3HD1 LEU 98 -4.331 -0.727 -5.465 638 HD21 LEU 98 3HD2 LEU 98 -5.860 1.929 -6.576 639 HD22 LEU 98 1HD2 LEU 98 -4.484 0.996 -7.175 640 HD23 LEU 98 2HD2 LEU 98 -4.257 2.692 -6.762 641 H LEU 99 H LEU 99 -6.017 1.966 -1.226 642 HA LEU 99 HA LEU 99 -6.991 -0.746 -1.259 643 HB3 LEU 99 2HB LEU 99 -7.368 -0.110 1.297 644 HG LEU 99 HG LEU 99 -4.594 -0.142 0.070 645 HD11 LEU 99 1HD1 LEU 99 -5.522 -0.226 2.964 646 HD12 LEU 99 2HD1 LEU 99 -4.528 1.015 2.231 647 HD13 LEU 99 3HD1 LEU 99 -3.886 -0.630 2.438 648 HD21 LEU 99 3HD2 LEU 99 -6.170 -2.267 1.600 649 HD22 LEU 99 1HD2 LEU 99 -4.511 -2.431 0.989 650 HD23 LEU 99 2HD2 LEU 99 -5.862 -2.291 -0.148 651 H ASP 100 H ASP 100 -8.642 2.405 -0.848 652 HA ASP 100 HA ASP 100 -11.162 1.347 0.087 653 HB3 ASP 100 2HB ASP 100 -10.879 3.915 -1.486 654 H GLN 101 H GLN 101 -9.596 1.436 -3.017 655 HA GLN 101 HA GLN 101 -12.066 0.880 -4.531 656 HB3 GLN 101 2HB GLN 101 -10.541 0.573 -6.439 657 HG3 GLN 101 2HG GLN 101 -9.866 3.112 -4.923 658 HE21 GLN 101 1HE2 GLN 101 -9.743 4.979 -6.542 659 HE22 GLN 101 2HE2 GLN 101 -8.809 4.691 -7.982 660 H MET 102 H MET 102 -9.209 -0.797 -3.131 661 HA MET 102 HA MET 102 -9.822 -3.284 -4.364 662 HB3 MET 102 2HB MET 102 -8.107 -4.311 -3.115 663 HG3 MET 102 2HG MET 102 -7.219 -1.537 -3.805 664 HE1 MET 102 3HE MET 102 -5.921 -5.198 -2.690 665 HE2 MET 102 1HE MET 102 -5.269 -4.858 -4.317 666 HE3 MET 102 2HE MET 102 -4.173 -4.926 -2.918 667 H LYS 103 H LYS 103 -12.238 -2.346 -2.723 668 HA LYS 103 HA LYS 103 -12.102 -3.814 -0.237 669 HB3 LYS 103 2HB LYS 103 -14.664 -3.379 -0.253 670 HG3 LYS 103 2HG LYS 103 -14.343 -0.829 -0.423 671 HD3 LYS 103 2HD LYS 103 -13.310 -2.762 1.570 672 HE3 LYS 103 2HE LYS 103 -11.965 -0.110 1.164 673 HZ1 LYS 103 3HZ LYS 103 -12.993 0.043 3.299 674 HZ2 LYS 103 1HZ LYS 103 -11.387 -0.099 3.489 675 HZ3 LYS 103 2HZ LYS 103 -12.334 -1.400 3.798 676 H ASN 104 H ASN 104 -12.680 -5.125 -3.339 677 HA ASN 104 HA ASN 104 -14.064 -7.496 -2.156 678 HB3 ASN 104 2HB ASN 104 -14.495 -7.782 -4.821 679 HD21 ASN 104 1HD2 ASN 104 -15.828 -4.861 -3.308 680 HD22 ASN 104 2HD2 ASN 104 -17.210 -5.629 -2.571 681 H TYR 105 H TYR 105 -11.034 -6.927 -2.328 682 HA TYR 105 HA TYR 105 -10.247 -9.000 -4.290 683 HB3 TYR 105 2HB TYR 105 -8.058 -7.638 -4.236 684 HD1 TYR 105 1HD TYR 105 -10.728 -5.392 -3.901 685 HD2 TYR 105 2HD TYR 105 -8.755 -7.803 -6.724 686 HE1 TYR 105 1HE TYR 105 -11.965 -4.110 -5.766 687 HE2 TYR 105 2HE TYR 105 -9.792 -6.504 -8.608 688 HH TYR 105 HH TYR 105 -10.811 -4.219 -8.951 689 H ARG 106 H ARG 106 -8.193 -10.036 -3.829 690 HA ARG 106 HA ARG 106 -7.820 -10.995 -1.140 691 HB3 ARG 106 2HB ARG 106 -9.514 -12.166 -1.308 692 HG3 ARG 106 2HG ARG 106 -8.931 -13.643 -3.780 693 HD3 ARG 106 2HD ARG 106 -11.389 -12.354 -2.507 694 HE ARG 106 HE ARG 106 -11.676 -14.929 -3.863 695 HH11 ARG 106 1HH1 ARG 106 -12.164 -11.376 -4.322 696 HH12 ARG 106 2HH1 ARG 106 -12.811 -11.640 -5.924 697 HH21 ARG 106 1HH2 ARG 106 -12.635 -15.081 -5.973 698 HH22 ARG 106 2HH2 ARG 106 -13.146 -13.597 -6.754 699 H GLY 107 H GLY 107 -6.038 -12.883 -1.498 700 HA2 GLY 107 1HA GLY 107 -3.891 -13.293 -2.564 701 HA3 GLY 107 2HA GLY 107 -4.007 -11.698 -3.334 702 H GLU 108 H GLU 108 -1.833 -11.862 -1.985 703 HA GLU 108 HA GLU 108 -2.235 -11.331 0.910 704 HB3 GLU 108 2HB GLU 108 0.176 -12.202 0.917 705 HG3 GLU 108 2HG GLU 108 -2.135 -13.966 0.011 706 H VAL 109 H VAL 109 -2.226 -9.265 1.392 707 HA VAL 109 HA VAL 109 -0.685 -7.430 -0.357 708 HB VAL 109 HB VAL 109 -2.738 -6.795 1.778 709 HG11 VAL 109 1HG1 VAL 109 -2.904 -4.609 0.598 710 HG12 VAL 109 2HG1 VAL 109 -1.282 -4.868 1.256 711 HG13 VAL 109 3HG1 VAL 109 -1.570 -5.101 -0.483 712 HG21 VAL 109 3HG2 VAL 109 -3.836 -8.092 0.021 713 HG22 VAL 109 1HG2 VAL 109 -4.303 -6.401 -0.122 714 HG23 VAL 109 2HG2 VAL 109 -3.092 -7.079 -1.237 715 H ALA 110 H ALA 110 1.225 -6.439 0.289 716 HA ALA 110 HA ALA 110 1.533 -5.964 3.200 717 HB1 ALA 110 1HB ALA 110 3.804 -6.963 1.430 718 HB2 ALA 110 2HB ALA 110 3.929 -6.566 3.130 719 HB3 ALA 110 3HB ALA 110 2.953 -7.945 2.609 720 H SER 111 H SER 111 3.477 -4.423 3.604 721 HA SER 111 HA SER 111 3.808 -2.493 1.431 722 HB3 SER 111 2HB SER 111 2.932 -1.558 4.200 723 HG SER 111 HG SER 111 3.367 -0.373 1.660 724 H PHE 112 H PHE 112 5.709 -1.241 1.588 725 HA PHE 112 HA PHE 112 7.667 -1.999 3.632 726 HB3 PHE 112 2HB PHE 112 7.686 -3.735 1.877 727 HD1 PHE 112 1HD PHE 112 6.155 -2.951 -0.203 728 HD2 PHE 112 2HD PHE 112 10.402 -2.243 0.206 729 HE1 PHE 112 1HE PHE 112 6.353 -2.562 -2.615 730 HE2 PHE 112 2HE PHE 112 10.560 -1.770 -2.180 731 HZ PHE 112 HZ PHE 112 8.577 -2.001 -3.629 732 H PHE 113 H PHE 113 8.231 0.024 4.362 733 HA PHE 113 HA PHE 113 8.417 2.235 2.375 734 HB3 PHE 113 2HB PHE 113 6.764 2.391 4.257 735 HD1 PHE 113 1HD PHE 113 7.213 0.495 6.023 736 HD2 PHE 113 2HD PHE 113 9.248 4.255 5.956 737 HE1 PHE 113 1HE PHE 113 8.181 0.004 8.241 738 HE2 PHE 113 2HE PHE 113 10.046 3.882 8.291 739 HZ PHE 113 HZ PHE 113 9.612 1.730 9.384 740 H THR 114 H THR 114 10.208 3.742 2.477 741 HA THR 114 HA THR 114 12.625 2.795 3.939 742 HB THR 114 HB THR 114 14.022 3.547 2.183 743 HG1 THR 114 1HG THR 114 12.490 5.235 1.537 744 HG21 THR 114 3HG2 THR 114 13.456 2.131 0.315 745 HG22 THR 114 1HG2 THR 114 11.786 1.959 0.867 746 HG23 THR 114 2HG2 THR 114 13.126 1.275 1.835 747 H SER 115 H SER 115 11.231 4.161 5.480 748 HA SER 115 HA SER 115 12.265 6.960 5.466 749 HB3 SER 115 2HB SER 115 10.071 7.818 5.863 750 HG SER 115 HG SER 115 10.499 7.415 3.644 751 H ALA 116 H ALA 116 12.953 4.583 6.923 752 HA ALA 116 HA ALA 116 11.685 4.547 9.544 753 HB1 ALA 116 1HB ALA 116 12.507 2.484 8.395 754 HB2 ALA 116 2HB ALA 116 14.169 3.042 8.692 755 HB3 ALA 116 3HB ALA 116 13.099 2.687 10.049 756 H GLY 117 H GLY 117 13.732 6.845 8.391 757 HA2 GLY 117 1HA GLY 117 15.771 7.276 10.162 758 HA3 GLY 117 2HA GLY 117 14.741 8.553 9.496 759 H THR 118 H THR 118 12.262 7.895 10.874 760 HA THR 118 HA THR 118 13.005 7.956 13.742 761 HB THR 118 HB THR 118 11.433 10.313 12.678 762 HG1 THR 118 1HG THR 118 14.202 9.874 12.642 763 HG21 THR 118 3HG2 THR 118 12.505 11.441 14.624 764 HG22 THR 118 1HG2 THR 118 13.301 9.912 15.053 765 HG23 THR 118 2HG2 THR 118 11.527 10.058 15.123 766 H ASN 119 H ASN 119 10.655 7.146 11.370 767 HA ASN 119 HA ASN 119 8.535 6.561 13.417 768 HB3 ASN 119 2HB ASN 119 7.849 6.840 10.551 769 HD21 ASN 119 1HD2 ASN 119 7.094 8.201 13.882 770 HD22 ASN 119 2HD2 ASN 119 5.409 7.871 13.687 771 H HIS 120 H HIS 120 8.152 4.366 13.530 772 HA HIS 120 HA HIS 120 8.272 2.825 11.060 773 HB3 HIS 120 2HB HIS 120 9.899 1.875 13.467 774 HD1 HIS 120 1HD HIS 120 11.181 -0.633 12.849 775 HD2 HIS 120 2HD HIS 120 7.824 0.539 10.545 776 HE1 HIS 120 1HE HIS 120 10.550 -2.579 11.450 777 H LYS 121 H LYS 121 8.092 2.081 14.595 778 HA LYS 121 HA LYS 121 6.003 0.268 14.319 779 HB3 LYS 121 2HB LYS 121 6.357 1.886 16.821 780 HG3 LYS 121 2HG LYS 121 6.656 -0.595 17.665 781 HD3 LYS 121 2HD LYS 121 3.872 0.388 16.884 782 HE3 LYS 121 2HE LYS 121 3.348 -0.840 19.069 783 HZ1 LYS 121 3HZ LYS 121 4.157 -2.514 16.763 784 HZ2 LYS 121 1HZ LYS 121 2.718 -1.784 16.976 785 HZ3 LYS 121 2HZ LYS 121 3.178 -2.989 18.012 786 H ALA 122 H ALA 122 5.772 3.881 14.644 787 HA ALA 122 HA ALA 122 2.954 3.986 14.951 788 HB1 ALA 122 1HB ALA 122 4.410 5.921 15.248 789 HB2 ALA 122 2HB ALA 122 5.002 5.738 13.586 790 HB3 ALA 122 3HB ALA 122 3.323 6.252 13.884 791 H TYR 123 H TYR 123 4.914 4.187 11.905 792 HA TYR 123 HA TYR 123 2.911 4.354 10.031 793 HB3 TYR 123 2HB TYR 123 5.558 2.851 9.843 794 HD1 TYR 123 1HD TYR 123 4.012 5.215 7.418 795 HD2 TYR 123 2HD TYR 123 4.917 1.078 8.286 796 HE1 TYR 123 1HE TYR 123 3.315 4.586 5.149 797 HE2 TYR 123 2HE TYR 123 4.146 0.432 6.035 798 HH TYR 123 HH TYR 123 3.282 1.205 3.948 799 H VAL 124 H VAL 124 4.169 1.370 11.527 800 HA VAL 124 HA VAL 124 2.871 -0.507 9.851 801 HB VAL 124 HB VAL 124 3.754 -0.625 12.754 802 HG11 VAL 124 1HG1 VAL 124 3.001 -2.934 10.913 803 HG12 VAL 124 2HG1 VAL 124 3.858 -3.132 12.450 804 HG13 VAL 124 3HG1 VAL 124 2.209 -2.492 12.428 805 HG21 VAL 124 3HG2 VAL 124 5.595 -0.207 11.068 806 HG22 VAL 124 1HG2 VAL 124 5.780 -1.748 11.909 807 HG23 VAL 124 2HG2 VAL 124 5.149 -1.711 10.256 808 H SER 125 H SER 125 1.963 0.938 12.935 809 HA SER 125 HA SER 125 -0.536 -0.362 13.314 810 HB3 SER 125 2HB SER 125 -0.317 2.282 14.487 811 HG SER 125 HG SER 125 -1.230 0.338 15.463 812 H HIS 126 H HIS 126 0.311 2.931 12.062 813 HA HIS 126 HA HIS 126 -2.330 3.735 11.439 814 HB3 HIS 126 2HB HIS 126 -1.236 5.372 9.963 815 HD1 HIS 126 1HD HIS 126 1.595 6.249 11.540 816 HD2 HIS 126 2HD HIS 126 -2.271 5.480 12.998 817 HE1 HIS 126 1HE HIS 126 1.404 7.461 13.825 818 H PHE 127 H PHE 127 -0.049 1.758 9.485 819 HA PHE 127 HA PHE 127 -1.602 1.962 7.085 820 HB3 PHE 127 2HB PHE 127 0.281 -0.246 8.021 821 HD1 PHE 127 2HD PHE 127 -1.458 1.300 5.018 822 HD2 PHE 127 1HD PHE 127 0.486 -2.142 6.696 823 HE1 PHE 127 2HE PHE 127 -1.879 0.039 2.934 824 HE2 PHE 127 1HE PHE 127 0.038 -3.424 4.618 825 HZ PHE 127 HZ PHE 127 -1.147 -2.328 2.730 826 H ASN 128 H ASN 128 -1.468 -0.405 9.755 827 HA ASN 128 HA ASN 128 -3.438 -2.210 8.842 828 HB3 ASN 128 2HB ASN 128 -3.899 -2.426 11.416 829 HD21 ASN 128 1HD2 ASN 128 -0.379 -2.407 10.778 830 HD22 ASN 128 2HD2 ASN 128 -0.281 -4.162 10.608 831 H GLU 129 H GLU 129 -3.879 0.847 10.809 832 HA GLU 129 HA GLU 129 -6.585 0.612 11.176 833 HB3 GLU 129 2HB GLU 129 -6.706 3.017 11.312 834 HG3 GLU 129 2HG GLU 129 -5.067 3.705 12.805 835 H TRP 130 H TRP 130 -4.944 1.800 8.239 836 HA TRP 130 HA TRP 130 -7.559 2.533 7.009 837 HB3 TRP 130 2HB TRP 130 -6.049 3.512 5.320 838 HD1 TRP 130 HD TRP 130 -7.159 4.081 8.732 839 HE1 TRP 130 1HE TRP 130 -6.924 6.510 9.432 840 HE3 TRP 130 3HE TRP 130 -3.757 5.618 5.229 841 HZ2 TRP 130 2HZ TRP 130 -5.483 8.820 8.584 842 HZ3 TRP 130 3HZ TRP 130 -2.856 7.944 5.311 843 HH2 TRP 130 HH TRP 130 -3.788 9.590 6.959 844 H ALA 131 H ALA 131 -5.749 -0.308 7.367 845 HA ALA 131 HA ALA 131 -6.443 -1.264 4.599 846 HB1 ALA 131 1HB ALA 131 -4.130 -2.191 6.335 847 HB2 ALA 131 2HB ALA 131 -4.460 -2.618 4.636 848 HB3 ALA 131 3HB ALA 131 -4.001 -0.959 5.056 849 H ASP 132 H ASP 132 -7.254 -1.737 7.803 850 HA ASP 132 HA ASP 132 -7.526 -4.518 8.037 851 HB3 ASP 132 2HB ASP 132 -9.200 -2.407 9.297 852 H GLY 133 H GLY 133 -8.356 -4.897 5.901 853 HA2 GLY 133 1HA GLY 133 -10.811 -6.204 6.193 854 HA3 GLY 133 2HA GLY 133 -11.166 -4.799 5.183 855 H LEU 134 H LEU 134 -8.079 -5.268 4.152 856 HA LEU 134 HA LEU 134 -8.625 -7.554 2.359 857 HB3 LEU 134 2HB LEU 134 -6.411 -6.677 1.446 858 HG LEU 134 HG LEU 134 -7.167 -4.492 0.703 859 HD11 LEU 134 1HD1 LEU 134 -9.438 -6.246 -0.217 860 HD12 LEU 134 2HD1 LEU 134 -7.817 -6.967 -0.356 861 HD13 LEU 134 3HD1 LEU 134 -8.225 -5.475 -1.181 862 HD21 LEU 134 3HD2 LEU 134 -9.380 -3.668 0.645 863 HD22 LEU 134 1HD2 LEU 134 -8.760 -3.733 2.308 864 HD23 LEU 134 2HD2 LEU 134 -9.929 -4.957 1.728 865 H ASN 135 H ASN 135 -6.772 -9.042 2.176 866 HA ASN 135 HA ASN 135 -5.897 -10.097 4.754 867 HB3 ASN 135 2HB ASN 135 -5.408 -10.920 1.894 868 HD21 ASN 135 1HD2 ASN 135 -3.758 -12.190 1.625 869 HD22 ASN 135 2HD2 ASN 135 -3.102 -13.345 2.789 870 H VAL 136 H VAL 136 -4.319 -8.794 5.693 871 HA VAL 136 HA VAL 136 -2.087 -7.986 3.937 872 HB VAL 136 HB VAL 136 -3.130 -6.663 6.462 873 HG11 VAL 136 1HG1 VAL 136 -1.460 -4.877 6.070 874 HG12 VAL 136 2HG1 VAL 136 -0.693 -6.415 6.456 875 HG13 VAL 136 3HG1 VAL 136 -0.727 -5.849 4.771 876 HG21 VAL 136 3HG2 VAL 136 -4.430 -6.211 4.345 877 HG22 VAL 136 1HG2 VAL 136 -3.678 -4.775 5.054 878 HG23 VAL 136 2HG2 VAL 136 -2.945 -5.544 3.630 879 H ILE 137 H ILE 137 -0.424 -9.359 4.103 880 HA ILE 137 HA ILE 137 -0.050 -10.847 6.639 881 HB ILE 137 HB ILE 137 0.947 -12.542 5.412 882 HG13 ILE 137 2HG1 ILE 137 1.384 -12.526 2.982 883 HG21 ILE 137 1HG2 ILE 137 -0.713 -13.260 3.859 884 HG22 ILE 137 2HG2 ILE 137 -1.497 -12.415 5.198 885 HG23 ILE 137 3HG2 ILE 137 -1.314 -11.602 3.632 886 HD11 ILE 137 3HD1 ILE 137 1.571 -9.525 3.232 887 HD12 ILE 137 1HD1 ILE 137 1.939 -10.524 1.819 888 HD13 ILE 137 2HD1 ILE 137 0.259 -10.363 2.378 889 H GLY 138 H GLY 138 1.216 -8.023 5.413 890 HA2 GLY 138 1HA GLY 138 3.837 -8.381 6.719 891 HA3 GLY 138 2HA GLY 138 3.766 -8.168 4.961 892 H VAL 139 H VAL 139 4.574 -6.472 7.553 893 HA VAL 139 HA VAL 139 4.096 -3.985 6.151 894 HB VAL 139 HB VAL 139 3.247 -4.057 9.066 895 HG11 VAL 139 1HG1 VAL 139 2.881 -2.079 6.766 896 HG12 VAL 139 2HG1 VAL 139 2.197 -1.879 8.392 897 HG13 VAL 139 3HG1 VAL 139 3.963 -1.886 8.161 898 HG21 VAL 139 3HG2 VAL 139 1.312 -4.205 6.738 899 HG22 VAL 139 1HG2 VAL 139 1.547 -5.419 8.007 900 HG23 VAL 139 2HG2 VAL 139 0.897 -3.843 8.424 901 H ALA 140 H ALA 140 6.360 -3.969 5.866 902 HA ALA 140 HA ALA 140 7.983 -3.616 8.316 903 HB1 ALA 140 1HB ALA 140 8.169 -6.035 7.667 904 HB2 ALA 140 2HB ALA 140 8.849 -5.522 6.108 905 HB3 ALA 140 3HB ALA 140 9.696 -5.150 7.610 906 H ARG 141 H ARG 141 10.502 -3.453 6.803 907 HA ARG 141 HA ARG 141 10.062 -1.049 5.178 908 HB3 ARG 141 2HB ARG 141 10.500 -0.423 7.545 909 HG3 ARG 141 2HG ARG 141 13.168 -1.811 7.220 910 HD3 ARG 141 2HD ARG 141 11.875 -0.380 9.558 911 HE ARG 141 HE ARG 141 13.688 -2.539 9.633 912 HH11 ARG 141 1HH1 ARG 141 13.815 0.782 10.781 913 HH12 ARG 141 2HH1 ARG 141 14.788 0.401 12.173 914 HH21 ARG 141 1HH2 ARG 141 14.682 -3.076 11.511 915 HH22 ARG 141 2HH2 ARG 141 15.221 -1.921 12.701 916 H ASP 142 H ASP 142 11.876 -0.560 3.948 917 HA ASP 142 HA ASP 142 13.488 -0.980 2.393 918 HB3 ASP 142 2HB ASP 142 15.073 -2.772 4.168 919 H ASP 143 H ASP 143 15.173 -3.423 2.057 920 HA ASP 143 HA ASP 143 13.102 -5.369 1.430 921 HB3 ASP 143 2HB ASP 143 13.473 -5.385 -0.684 922 H SER 144 H SER 144 13.303 -6.306 3.331 923 HA SER 144 HA SER 144 15.532 -8.201 3.515 924 HB3 SER 144 2HB SER 144 14.727 -6.610 5.967 925 HG SER 144 HG SER 144 16.562 -7.474 6.823 926 H GLU 145 H GLU 145 12.121 -7.447 3.934 927 HA GLU 145 HA GLU 145 11.724 -10.158 5.086 928 HB3 GLU 145 2HB GLU 145 9.800 -9.532 6.172 929 HG3 GLU 145 2HG GLU 145 11.555 -7.095 6.649 930 H VAL 146 H VAL 146 11.976 -9.038 2.166 931 HA VAL 146 HA VAL 146 9.471 -9.378 0.897 932 HB VAL 146 HB VAL 146 12.254 -10.048 -0.155 933 HG11 VAL 146 1HG1 VAL 146 10.558 -10.822 -1.719 934 HG12 VAL 146 2HG1 VAL 146 9.675 -9.278 -1.584 935 HG13 VAL 146 3HG1 VAL 146 11.277 -9.344 -2.373 936 HG21 VAL 146 3HG2 VAL 146 12.443 -7.781 -0.919 937 HG22 VAL 146 1HG2 VAL 146 10.791 -7.396 -0.371 938 HG23 VAL 146 2HG2 VAL 146 12.113 -7.683 0.789 939 H ASP 147 H ASP 147 11.796 -11.705 2.047 940 HA ASP 147 HA ASP 147 11.069 -13.943 0.592 941 HB3 ASP 147 2HB ASP 147 11.739 -14.657 3.366 942 H LYS 148 H LYS 148 9.597 -12.840 3.641 943 HA LYS 148 HA LYS 148 7.755 -15.096 3.829 944 HB3 LYS 148 2HB LYS 148 8.160 -14.008 5.920 945 HG3 LYS 148 2HG LYS 148 7.484 -11.492 4.395 946 HD3 LYS 148 2HD LYS 148 6.124 -11.411 6.499 947 HE3 LYS 148 2HE LYS 148 8.932 -11.499 7.662 948 HZ1 LYS 148 3HZ LYS 148 6.490 -10.376 8.852 949 HZ2 LYS 148 1HZ LYS 148 7.975 -9.623 8.584 950 HZ3 LYS 148 2HZ LYS 148 7.872 -10.790 9.700 951 H TRP 149 H TRP 149 7.801 -12.055 2.038 952 HA TRP 149 HA TRP 149 4.972 -12.394 1.317 953 HB3 TRP 149 2HB TRP 149 5.043 -10.274 0.378 954 HD1 TRP 149 HD TRP 149 4.854 -11.059 3.471 955 HE1 TRP 149 1HE TRP 149 5.596 -9.407 5.285 956 HE3 TRP 149 3HE TRP 149 7.629 -7.827 0.624 957 HZ2 TRP 149 2HZ TRP 149 6.858 -6.842 5.447 958 HZ3 TRP 149 3HZ TRP 149 8.544 -5.779 1.633 959 HH2 TRP 149 HH TRP 149 8.139 -5.227 4.007 960 H SER 150 H SER 150 7.425 -14.234 0.346 961 HA SER 150 HA SER 150 6.293 -14.347 -2.382 962 HB3 SER 150 2HB SER 150 9.296 -14.061 -1.910 963 HG SER 150 HG SER 150 8.975 -15.157 -3.771 964 H LYS 151 H LYS 151 7.703 -15.975 0.335 965 HA LYS 151 HA LYS 151 8.503 -18.380 -0.794 966 HB3 LYS 151 2HB LYS 151 8.990 -17.938 1.426 967 HG3 LYS 151 2HG LYS 151 6.960 -16.501 2.026 968 HD3 LYS 151 2HD LYS 151 5.797 -19.224 2.763 969 HE3 LYS 151 2HE LYS 151 4.019 -17.895 3.856 970 HZ1 LYS 151 3HZ LYS 151 6.650 -17.089 4.986 971 HZ2 LYS 151 1HZ LYS 151 5.967 -18.556 5.213 972 HZ3 LYS 151 2HZ LYS 151 5.231 -17.209 5.784 Start of MODEL 12 1 H1 GLY 1 H GLY 1 -5.596 -20.491 -13.525 2 HA2 GLY 1 1HA GLY 1 -4.915 -23.366 -13.211 3 HA3 GLY 1 2HA GLY 1 -4.138 -22.273 -14.372 4 H MET 2 H MET 2 -2.156 -23.134 -13.100 5 HA MET 2 HA MET 2 -1.844 -21.740 -10.480 6 HB3 MET 2 2HB MET 2 -1.617 -24.075 -10.225 7 HG3 MET 2 2HG MET 2 0.412 -23.954 -12.480 8 HE1 MET 2 3HE MET 2 2.295 -24.111 -10.734 9 HE2 MET 2 1HE MET 2 1.543 -24.704 -9.247 10 HE3 MET 2 2HE MET 2 2.837 -25.651 -10.010 11 H ALA 3 H ALA 3 -0.765 -19.963 -10.428 12 HA ALA 3 HA ALA 3 1.875 -19.693 -11.132 13 HB1 ALA 3 1HB ALA 3 1.221 -19.142 -13.455 14 HB2 ALA 3 2HB ALA 3 0.004 -17.984 -12.863 15 HB3 ALA 3 3HB ALA 3 1.733 -17.667 -12.616 16 H LYS 4 H LYS 4 2.464 -18.509 -9.322 17 HA LYS 4 HA LYS 4 0.451 -16.741 -8.018 18 HB3 LYS 4 2HB LYS 4 1.855 -16.736 -6.124 19 HG3 LYS 4 2HG LYS 4 1.898 -19.688 -6.773 20 HD3 LYS 4 2HD LYS 4 0.782 -18.024 -4.507 21 HE3 LYS 4 2HE LYS 4 1.808 -20.463 -3.515 22 HZ1 LYS 4 3HZ LYS 4 -0.145 -19.243 -2.731 23 HZ2 LYS 4 1HZ LYS 4 -0.468 -20.852 -2.901 24 HZ3 LYS 4 2HZ LYS 4 -1.012 -19.755 -4.020 25 H LYS 5 H LYS 5 0.599 -14.780 -9.218 26 HA LYS 5 HA LYS 5 3.365 -13.730 -9.647 27 HB3 LYS 5 2HB LYS 5 2.374 -12.031 -11.019 28 HG3 LYS 5 2HG LYS 5 0.959 -14.558 -11.711 29 HD3 LYS 5 2HD LYS 5 2.547 -12.517 -13.293 30 HE3 LYS 5 2HE LYS 5 0.831 -14.614 -14.577 31 HZ1 LYS 5 3HZ LYS 5 3.566 -13.688 -15.155 32 HZ2 LYS 5 1HZ LYS 5 2.230 -12.914 -15.755 33 HZ3 LYS 5 2HZ LYS 5 2.578 -14.466 -16.207 34 H THR 6 H THR 6 3.433 -11.397 -9.424 35 HA THR 6 HA THR 6 2.286 -10.446 -6.853 36 HB THR 6 HB THR 6 5.235 -10.506 -7.558 37 HG1 THR 6 1HG THR 6 5.285 -11.867 -5.703 38 HG21 THR 6 3HG2 THR 6 4.865 -8.462 -6.325 39 HG22 THR 6 1HG2 THR 6 5.534 -9.641 -5.195 40 HG23 THR 6 2HG2 THR 6 3.798 -9.279 -5.159 41 H LEU 7 H LEU 7 2.087 -8.163 -6.727 42 HA LEU 7 HA LEU 7 2.877 -6.554 -9.097 43 HB3 LEU 7 2HB LEU 7 0.374 -6.123 -7.415 44 HG LEU 7 HG LEU 7 1.300 -4.077 -8.745 45 HD11 LEU 7 1HD1 LEU 7 0.264 -5.681 -11.106 46 HD12 LEU 7 2HD1 LEU 7 1.977 -5.425 -10.771 47 HD13 LEU 7 3HD1 LEU 7 0.925 -4.046 -11.125 48 HD21 LEU 7 3HD2 LEU 7 -0.869 -3.394 -9.519 49 HD22 LEU 7 1HD2 LEU 7 -1.077 -4.294 -8.002 50 HD23 LEU 7 2HD2 LEU 7 -1.455 -5.067 -9.552 51 H ILE 8 H ILE 8 3.723 -4.521 -8.438 52 HA ILE 8 HA ILE 8 4.049 -3.999 -5.530 53 HB ILE 8 HB ILE 8 6.193 -3.750 -7.599 54 HG13 ILE 8 2HG1 ILE 8 5.696 -6.208 -6.582 55 HG21 ILE 8 1HG2 ILE 8 6.676 -2.057 -6.109 56 HG22 ILE 8 2HG2 ILE 8 5.980 -2.930 -4.751 57 HG23 ILE 8 3HG2 ILE 8 7.599 -3.369 -5.365 58 HD11 ILE 8 3HD1 ILE 8 8.068 -6.683 -7.142 59 HD12 ILE 8 1HD1 ILE 8 7.278 -5.632 -8.358 60 HD13 ILE 8 2HD1 ILE 8 8.406 -4.945 -7.166 61 H LEU 9 H LEU 9 2.421 -2.492 -5.760 62 HA LEU 9 HA LEU 9 2.655 -0.295 -7.775 63 HB3 LEU 9 2HB LEU 9 0.637 0.584 -6.410 64 HG LEU 9 HG LEU 9 0.571 -2.019 -7.952 65 HD11 LEU 9 1HD1 LEU 9 -1.874 -1.762 -8.042 66 HD12 LEU 9 2HD1 LEU 9 -1.780 -0.438 -6.857 67 HD13 LEU 9 3HD1 LEU 9 -1.295 -2.102 -6.408 68 HD21 LEU 9 3HD2 LEU 9 -0.404 -0.685 -9.715 69 HD22 LEU 9 1HD2 LEU 9 1.083 0.110 -9.213 70 HD23 LEU 9 2HD2 LEU 9 -0.483 0.749 -8.683 71 H TYR 10 H TYR 10 3.691 1.602 -7.339 72 HA TYR 10 HA TYR 10 4.126 2.331 -4.520 73 HB3 TYR 10 2HB TYR 10 6.436 3.124 -6.023 74 HD1 TYR 10 2HD TYR 10 5.689 3.478 -3.197 75 HD2 TYR 10 1HD TYR 10 7.814 0.277 -5.170 76 HE1 TYR 10 2HE TYR 10 6.930 2.986 -1.109 77 HE2 TYR 10 1HE TYR 10 9.032 -0.179 -3.093 78 HH TYR 10 HH TYR 10 7.947 0.465 -0.167 79 H TYR 11 H TYR 11 4.181 4.575 -4.181 80 HA TYR 11 HA TYR 11 3.501 6.354 -6.468 81 HB3 TYR 11 2HB TYR 11 2.536 6.305 -3.588 82 HD1 TYR 11 2HD TYR 11 1.003 7.984 -6.618 83 HD2 TYR 11 1HD TYR 11 2.668 8.477 -2.661 84 HE1 TYR 11 2HE TYR 11 0.541 10.358 -6.724 85 HE2 TYR 11 1HE TYR 11 2.011 10.865 -2.698 86 HH TYR 11 HH TYR 11 0.463 12.399 -4.004 87 H SER 12 H SER 12 5.785 6.673 -6.839 88 HA SER 12 HA SER 12 6.385 9.108 -5.445 89 HB3 SER 12 2HB SER 12 7.966 7.489 -4.354 90 HG SER 12 HG SER 12 8.623 6.140 -5.901 91 H TRP 13 H TRP 13 8.020 10.317 -6.947 92 HA TRP 13 HA TRP 13 8.323 9.165 -9.592 93 HB3 TRP 13 2HB TRP 13 7.208 11.876 -9.932 94 HD1 TRP 13 HD TRP 13 6.029 8.261 -10.766 95 HE1 TRP 13 1HE TRP 13 5.584 8.045 -13.249 96 HE3 TRP 13 3HE TRP 13 7.612 12.901 -12.177 97 HZ2 TRP 13 2HZ TRP 13 5.811 9.791 -15.602 98 HZ3 TRP 13 3HZ TRP 13 7.507 13.582 -14.581 99 HH2 TRP 13 HH TRP 13 6.553 12.053 -16.273 100 H SER 14 H SER 14 9.095 11.600 -7.226 101 HA SER 14 HA SER 14 11.387 12.713 -8.583 102 HB3 SER 14 2HB SER 14 11.037 12.760 -5.596 103 HG SER 14 HG SER 14 11.056 15.118 -6.858 104 H GLY 15 H GLY 15 11.045 9.676 -8.233 105 HA2 GLY 15 1HA GLY 15 12.600 8.041 -8.407 106 HA3 GLY 15 2HA GLY 15 13.839 9.138 -7.799 107 H GLU 16 H GLU 16 11.624 9.396 -5.431 108 HA GLU 16 HA GLU 16 13.228 8.362 -3.522 109 HB3 GLU 16 2HB GLU 16 11.301 8.329 -1.969 110 HG3 GLU 16 2HG GLU 16 11.045 10.754 -3.769 111 H THR 17 H THR 17 10.232 6.594 -4.591 112 HA THR 17 HA THR 17 11.245 4.249 -3.172 113 HB THR 17 HB THR 17 9.182 3.183 -3.786 114 HG1 THR 17 1HG THR 17 7.744 4.045 -5.090 115 HG21 THR 17 3HG2 THR 17 8.889 4.416 -1.777 116 HG22 THR 17 1HG2 THR 17 7.496 4.840 -2.756 117 HG23 THR 17 2HG2 THR 17 8.832 5.993 -2.618 118 H LYS 18 H LYS 18 11.342 5.431 -6.489 119 HA LYS 18 HA LYS 18 11.074 3.030 -7.879 120 HB3 LYS 18 2HB LYS 18 12.899 5.342 -8.667 121 HG3 LYS 18 2HG LYS 18 11.605 3.061 -10.227 122 HD3 LYS 18 2HD LYS 18 13.230 5.386 -11.335 123 HE3 LYS 18 2HE LYS 18 11.941 2.914 -12.573 124 HZ1 LYS 18 3HZ LYS 18 13.042 3.636 -14.577 125 HZ2 LYS 18 1HZ LYS 18 13.507 5.048 -13.895 126 HZ3 LYS 18 2HZ LYS 18 11.909 4.757 -14.131 127 H LYS 19 H LYS 19 14.218 4.438 -6.717 128 HA LYS 19 HA LYS 19 15.776 2.297 -7.538 129 HB3 LYS 19 2HB LYS 19 16.382 3.808 -4.965 130 HG3 LYS 19 2HG LYS 19 18.147 4.622 -6.883 131 HD3 LYS 19 2HD LYS 19 19.682 2.683 -6.022 132 HE3 LYS 19 2HE LYS 19 19.535 3.510 -3.588 133 HZ1 LYS 19 3HZ LYS 19 19.819 5.619 -5.648 134 HZ2 LYS 19 1HZ LYS 19 20.982 4.532 -5.199 135 HZ3 LYS 19 2HZ LYS 19 20.395 5.641 -4.117 136 H MET 20 H MET 20 13.457 2.252 -4.860 137 HA MET 20 HA MET 20 14.570 -0.245 -3.836 138 HB3 MET 20 2HB MET 20 13.401 0.570 -1.814 139 HG3 MET 20 2HG MET 20 14.788 2.415 -1.093 140 HE1 MET 20 3HE MET 20 15.220 -1.011 -1.740 141 HE2 MET 20 1HE MET 20 16.605 -1.025 -0.634 142 HE3 MET 20 2HE MET 20 15.186 -0.060 -0.227 143 H ALA 21 H ALA 21 12.935 0.134 -6.204 144 HA ALA 21 HA ALA 21 10.441 -1.318 -5.465 145 HB1 ALA 21 1HB ALA 21 9.293 -0.222 -7.282 146 HB2 ALA 21 2HB ALA 21 9.853 0.962 -6.087 147 HB3 ALA 21 3HB ALA 21 10.713 0.777 -7.628 148 H GLU 22 H GLU 22 12.776 -0.284 -8.003 149 HA GLU 22 HA GLU 22 12.558 -2.351 -9.904 150 HB3 GLU 22 2HB GLU 22 14.904 -1.496 -10.502 151 HG3 GLU 22 2HG GLU 22 14.225 0.953 -10.722 152 H LYS 23 H LYS 23 14.571 -2.151 -6.965 153 HA LYS 23 HA LYS 23 16.144 -4.442 -7.660 154 HB3 LYS 23 2HB LYS 23 15.929 -4.383 -4.825 155 HG3 LYS 23 2HG LYS 23 18.020 -4.152 -6.738 156 HD3 LYS 23 2HD LYS 23 19.418 -2.507 -5.415 157 HE3 LYS 23 2HE LYS 23 17.049 -1.485 -7.044 158 HZ1 LYS 23 3HZ LYS 23 18.611 0.385 -7.443 159 HZ2 LYS 23 1HZ LYS 23 19.519 -0.138 -6.177 160 HZ3 LYS 23 2HZ LYS 23 17.933 0.323 -5.935 161 H ILE 24 H ILE 24 13.488 -4.317 -5.230 162 HA ILE 24 HA ILE 24 13.106 -6.999 -4.860 163 HB ILE 24 HB ILE 24 11.176 -4.661 -4.937 164 HG13 ILE 24 2HG1 ILE 24 13.008 -4.964 -3.120 165 HG21 ILE 24 1HG2 ILE 24 9.735 -6.592 -5.397 166 HG22 ILE 24 2HG2 ILE 24 10.469 -7.472 -4.041 167 HG23 ILE 24 3HG2 ILE 24 9.457 -6.042 -3.761 168 HD11 ILE 24 3HD1 ILE 24 11.000 -3.573 -2.692 169 HD12 ILE 24 1HD1 ILE 24 10.153 -4.980 -1.991 170 HD13 ILE 24 2HD1 ILE 24 11.594 -4.345 -1.213 171 H ASN 25 H ASN 25 11.765 -5.154 -7.670 172 HA ASN 25 HA ASN 25 10.165 -7.227 -8.731 173 HB3 ASN 25 2HB ASN 25 11.789 -5.069 -10.090 174 HD21 ASN 25 1HD2 ASN 25 8.812 -7.078 -10.755 175 HD22 ASN 25 2HD2 ASN 25 9.369 -7.590 -12.322 176 H SER 26 H SER 26 13.709 -6.880 -8.922 177 HA SER 26 HA SER 26 13.996 -9.092 -10.787 178 HB3 SER 26 2HB SER 26 16.474 -8.358 -9.566 179 HG SER 26 HG SER 26 15.698 -8.868 -11.912 180 H GLU 27 H GLU 27 13.431 -8.967 -7.348 181 HA GLU 27 HA GLU 27 14.754 -11.506 -6.944 182 HB3 GLU 27 2HB GLU 27 15.943 -10.214 -5.613 183 HG3 GLU 27 2HG GLU 27 13.653 -8.823 -4.408 184 H ILE 28 H ILE 28 11.867 -10.631 -7.885 185 HA ILE 28 HA ILE 28 10.578 -12.756 -6.286 186 HB ILE 28 HB ILE 28 9.190 -10.223 -7.150 187 HG13 ILE 28 2HG1 ILE 28 10.587 -9.898 -5.097 188 HG21 ILE 28 1HG2 ILE 28 7.800 -12.377 -7.278 189 HG22 ILE 28 2HG2 ILE 28 8.103 -12.599 -5.550 190 HG23 ILE 28 3HG2 ILE 28 7.174 -11.206 -6.147 191 HD11 ILE 28 3HD1 ILE 28 7.632 -9.987 -4.413 192 HD12 ILE 28 1HD1 ILE 28 8.862 -8.996 -3.677 193 HD13 ILE 28 2HD1 ILE 28 8.405 -8.697 -5.367 194 H LYS 29 H LYS 29 9.866 -14.304 -7.550 195 HA LYS 29 HA LYS 29 10.274 -14.071 -10.389 196 HB3 LYS 29 2HB LYS 29 8.562 -16.247 -9.151 197 HG3 LYS 29 2HG LYS 29 10.830 -16.402 -11.164 198 HD3 LYS 29 2HD LYS 29 8.342 -18.110 -10.737 199 HE3 LYS 29 2HE LYS 29 10.662 -18.306 -12.719 200 HZ1 LYS 29 3HZ LYS 29 8.154 -19.864 -12.574 201 HZ2 LYS 29 1HZ LYS 29 9.652 -20.439 -12.126 202 HZ3 LYS 29 2HZ LYS 29 9.354 -20.026 -13.682 203 H ASP 30 H ASP 30 8.877 -13.666 -11.961 204 HA ASP 30 HA ASP 30 7.027 -13.144 -13.132 205 HB3 ASP 30 2HB ASP 30 5.188 -14.593 -11.249 206 H SER 31 H SER 31 7.863 -11.483 -10.791 207 HA SER 31 HA SER 31 5.499 -10.153 -9.815 208 HB3 SER 31 2HB SER 31 8.427 -9.327 -9.632 209 HG SER 31 HG SER 31 7.635 -8.724 -7.515 210 H GLU 32 H GLU 32 5.689 -7.584 -9.938 211 HA GLU 32 HA GLU 32 6.366 -6.583 -12.583 212 HB3 GLU 32 2HB GLU 32 3.435 -6.358 -12.077 213 HG3 GLU 32 2HG GLU 32 3.473 -8.067 -14.179 214 H LEU 33 H LEU 33 5.470 -4.435 -13.071 215 HA LEU 33 HA LEU 33 5.975 -2.920 -10.609 216 HB3 LEU 33 2HB LEU 33 7.880 -2.276 -12.803 217 HG LEU 33 HG LEU 33 8.062 -1.486 -10.448 218 HD11 LEU 33 1HD1 LEU 33 7.300 -3.182 -9.152 219 HD12 LEU 33 2HD1 LEU 33 8.992 -3.469 -8.946 220 HD13 LEU 33 3HD1 LEU 33 8.002 -4.481 -10.132 221 HD21 LEU 33 3HD2 LEU 33 10.310 -3.271 -11.472 222 HD22 LEU 33 1HD2 LEU 33 10.442 -2.044 -10.172 223 HD23 LEU 33 2HD2 LEU 33 10.068 -1.552 -11.831 224 H LYS 34 H LYS 34 4.516 -1.403 -10.577 225 HA LYS 34 HA LYS 34 3.646 -0.013 -13.039 226 HB3 LYS 34 2HB LYS 34 1.250 -0.302 -11.874 227 HG3 LYS 34 2HG LYS 34 0.907 -2.556 -12.825 228 HD3 LYS 34 2HD LYS 34 1.932 -2.142 -15.202 229 HE3 LYS 34 2HE LYS 34 -0.175 -0.262 -14.085 230 HZ1 LYS 34 3HZ LYS 34 -1.106 -0.794 -16.357 231 HZ2 LYS 34 1HZ LYS 34 0.359 -1.318 -16.792 232 HZ3 LYS 34 2HZ LYS 34 0.172 0.260 -16.365 233 H GLU 35 H GLU 35 2.582 1.985 -12.555 234 HA GLU 35 HA GLU 35 3.773 3.244 -10.121 235 HB3 GLU 35 2HB GLU 35 4.856 4.030 -12.142 236 HG3 GLU 35 2HG GLU 35 2.073 4.732 -13.089 237 H VAL 36 H VAL 36 2.558 4.744 -8.940 238 HA VAL 36 HA VAL 36 -0.368 4.831 -9.547 239 HB VAL 36 HB VAL 36 1.119 5.072 -6.914 240 HG11 VAL 36 1HG1 VAL 36 -0.904 6.510 -6.909 241 HG12 VAL 36 2HG1 VAL 36 -1.886 5.142 -7.471 242 HG13 VAL 36 3HG1 VAL 36 -1.113 5.115 -5.868 243 HG21 VAL 36 3HG2 VAL 36 -0.060 2.993 -6.294 244 HG22 VAL 36 1HG2 VAL 36 -0.760 2.905 -7.927 245 HG23 VAL 36 2HG2 VAL 36 0.996 2.737 -7.687 246 H LYS 37 H LYS 37 -1.282 6.835 -9.765 247 HA LYS 37 HA LYS 37 0.449 9.258 -9.605 248 HB3 LYS 37 2HB LYS 37 -1.097 10.117 -11.398 249 HG3 LYS 37 2HG LYS 37 0.153 7.498 -12.307 250 HD3 LYS 37 2HD LYS 37 -1.202 9.052 -13.889 251 HE3 LYS 37 2HE LYS 37 1.426 10.606 -13.788 252 HZ1 LYS 37 3HZ LYS 37 0.302 12.134 -15.134 253 HZ2 LYS 37 1HZ LYS 37 -1.175 11.442 -14.919 254 HZ3 LYS 37 2HZ LYS 37 -0.060 10.669 -15.806 255 H VAL 38 H VAL 38 -1.174 11.234 -9.476 256 HA VAL 38 HA VAL 38 -3.495 10.585 -7.778 257 HB VAL 38 HB VAL 38 -3.161 12.978 -6.821 258 HG11 VAL 38 1HG1 VAL 38 -1.615 10.544 -5.887 259 HG12 VAL 38 2HG1 VAL 38 -1.892 12.017 -4.925 260 HG13 VAL 38 3HG1 VAL 38 -3.257 11.027 -5.445 261 HG21 VAL 38 3HG2 VAL 38 -0.847 13.641 -6.429 262 HG22 VAL 38 1HG2 VAL 38 -0.244 12.290 -7.392 263 HG23 VAL 38 2HG2 VAL 38 -1.154 13.586 -8.172 264 H SER 39 H SER 39 -5.177 12.516 -7.945 265 HA SER 39 HA SER 39 -5.170 13.677 -10.686 266 HB3 SER 39 2HB SER 39 -7.756 13.208 -9.354 267 HG SER 39 HG SER 39 -8.428 12.711 -11.296 268 H GLU 40 H GLU 40 -6.730 15.655 -10.696 269 HA GLU 40 HA GLU 40 -6.852 16.998 -8.107 270 HB3 GLU 40 2HB GLU 40 -4.861 17.887 -8.903 271 HG3 GLU 40 2HG GLU 40 -5.140 19.291 -11.200 272 H GLY 41 H GLY 41 -8.393 18.596 -7.906 273 HA2 GLY 41 1HA GLY 41 -10.642 18.538 -9.862 274 HA3 GLY 41 2HA GLY 41 -10.831 18.603 -8.098 275 H THR 42 H THR 42 -10.277 20.604 -6.970 276 HA THR 42 HA THR 42 -10.079 22.983 -8.741 277 HB THR 42 HB THR 42 -11.721 23.924 -7.033 278 HG1 THR 42 1HG THR 42 -12.878 21.693 -6.284 279 HG21 THR 42 3HG2 THR 42 -13.607 22.996 -8.163 280 HG22 THR 42 1HG2 THR 42 -12.741 21.494 -8.560 281 HG23 THR 42 2HG2 THR 42 -12.261 23.015 -9.328 282 H PHE 43 H PHE 43 -7.760 21.788 -7.344 283 HA PHE 43 HA PHE 43 -7.079 24.063 -5.523 284 HB3 PHE 43 2HB PHE 43 -6.125 22.487 -3.901 285 HD1 PHE 43 2HD PHE 43 -7.920 24.051 -2.925 286 HD2 PHE 43 1HD PHE 43 -8.876 20.265 -4.751 287 HE1 PHE 43 2HE PHE 43 -10.144 24.081 -1.836 288 HE2 PHE 43 1HE PHE 43 -11.110 20.319 -3.690 289 HZ PHE 43 HZ PHE 43 -11.739 22.209 -2.201 290 H ASP 44 H ASP 44 -6.122 22.210 -8.185 291 HA ASP 44 HA ASP 44 -3.269 22.230 -7.905 292 HB3 ASP 44 2HB ASP 44 -4.743 20.889 -9.553 293 H ALA 45 H ALA 45 -1.896 23.481 -9.434 294 HA ALA 45 HA ALA 45 -2.657 26.344 -9.729 295 HB1 ALA 45 1HB ALA 45 -0.133 25.279 -8.366 296 HB2 ALA 45 2HB ALA 45 -0.547 26.986 -8.640 297 HB3 ALA 45 3HB ALA 45 -1.516 26.013 -7.523 298 H ASP 46 H ASP 46 -0.630 23.573 -10.648 299 HA ASP 46 HA ASP 46 -0.410 24.176 -13.337 300 HB3 ASP 46 2HB ASP 46 1.952 25.199 -11.728 301 H MET 47 H MET 47 -0.543 22.079 -13.821 302 HA MET 47 HA MET 47 -0.185 19.892 -14.039 303 HB3 MET 47 2HB MET 47 2.256 19.096 -13.871 304 HG3 MET 47 2HG MET 47 1.809 21.532 -15.583 305 HE1 MET 47 3HE MET 47 2.228 19.549 -18.233 306 HE2 MET 47 1HE MET 47 2.851 21.220 -18.213 307 HE3 MET 47 2HE MET 47 3.932 19.877 -18.618 308 H TYR 48 H TYR 48 0.913 17.854 -12.979 309 HA TYR 48 HA TYR 48 -0.319 17.159 -10.639 310 HB3 TYR 48 2HB TYR 48 0.571 15.579 -12.242 311 HD1 TYR 48 2HD TYR 48 2.237 16.745 -13.895 312 HD2 TYR 48 1HD TYR 48 3.428 14.881 -10.198 313 HE1 TYR 48 2HE TYR 48 4.556 16.724 -14.670 314 HE2 TYR 48 1HE TYR 48 5.738 14.770 -10.971 315 HH TYR 48 HH TYR 48 7.087 14.968 -12.888 316 H LYS 49 H LYS 49 -0.208 18.385 -8.853 317 HA LYS 49 HA LYS 49 2.429 18.692 -7.494 318 HB3 LYS 49 2HB LYS 49 0.492 20.950 -7.226 319 HG3 LYS 49 2HG LYS 49 2.983 20.685 -6.312 320 HD3 LYS 49 2HD LYS 49 3.405 21.901 -9.074 321 HE3 LYS 49 2HE LYS 49 5.404 20.720 -7.104 322 HZ1 LYS 49 3HZ LYS 49 5.797 21.205 -9.641 323 HZ2 LYS 49 1HZ LYS 49 6.953 21.486 -8.500 324 HZ3 LYS 49 2HZ LYS 49 6.034 22.742 -9.081 325 H THR 50 H THR 50 -0.972 18.022 -7.255 326 HA THR 50 HA THR 50 -1.436 18.360 -4.530 327 HB THR 50 HB THR 50 -2.927 18.039 -6.549 328 HG1 THR 50 1HG THR 50 -3.866 18.127 -4.593 329 HG21 THR 50 3HG2 THR 50 -1.839 15.878 -7.311 330 HG22 THR 50 1HG2 THR 50 -3.595 15.939 -7.302 331 HG23 THR 50 2HG2 THR 50 -2.754 15.087 -5.978 332 H SER 51 H SER 51 1.100 16.647 -5.416 333 HA SER 51 HA SER 51 1.157 14.396 -3.672 334 HB3 SER 51 2HB SER 51 3.035 14.385 -4.866 335 HG SER 51 HG SER 51 3.404 17.175 -4.911 336 H ASP 52 H ASP 52 2.170 14.439 -1.573 337 HA ASP 52 HA ASP 52 0.692 16.362 0.102 338 HB3 ASP 52 2HB ASP 52 0.173 14.426 1.077 339 H ILE 53 H ILE 53 3.823 14.758 0.655 340 HA ILE 53 HA ILE 53 5.878 15.514 1.322 341 HB ILE 53 HB ILE 53 5.132 18.073 -0.115 342 HG13 ILE 53 2HG1 ILE 53 6.126 17.089 -2.130 343 HG21 ILE 53 1HG2 ILE 53 7.220 18.297 1.136 344 HG22 ILE 53 2HG2 ILE 53 7.875 16.860 0.315 345 HG23 ILE 53 3HG2 ILE 53 7.494 18.318 -0.607 346 HD11 ILE 53 3HD1 ILE 53 7.467 15.203 -1.227 347 HD12 ILE 53 1HD1 ILE 53 5.971 14.413 -0.668 348 HD13 ILE 53 2HD1 ILE 53 6.256 14.648 -2.388 349 H ALA 54 H ALA 54 5.851 15.506 3.475 350 HA ALA 54 HA ALA 54 6.037 16.146 5.547 351 HB1 ALA 54 1HB ALA 54 5.676 19.048 4.779 352 HB2 ALA 54 2HB ALA 54 6.374 18.388 6.271 353 HB3 ALA 54 3HB ALA 54 7.218 18.136 4.745 354 H LEU 55 H LEU 55 4.544 18.248 6.967 355 HA LEU 55 HA LEU 55 2.086 16.825 7.670 356 HB3 LEU 55 2HB LEU 55 1.821 19.170 8.887 357 HG LEU 55 HG LEU 55 3.509 18.701 10.614 358 HD11 LEU 55 1HD1 LEU 55 1.194 17.918 10.769 359 HD12 LEU 55 2HD1 LEU 55 2.314 16.771 11.538 360 HD13 LEU 55 3HD1 LEU 55 1.635 16.415 9.942 361 HD21 LEU 55 3HD2 LEU 55 4.088 16.131 9.141 362 HD22 LEU 55 1HD2 LEU 55 4.682 16.619 10.745 363 HD23 LEU 55 2HD2 LEU 55 5.199 17.519 9.305 364 H ASP 56 H ASP 56 1.261 16.736 5.408 365 HA ASP 56 HA ASP 56 -0.434 19.124 4.900 366 HB3 ASP 56 2HB ASP 56 0.747 17.261 2.809 367 H GLN 57 H GLN 57 -2.422 18.622 5.435 368 HA GLN 57 HA GLN 57 -4.392 17.695 5.553 369 HB3 GLN 57 2HB GLN 57 -3.800 15.363 3.776 370 HG3 GLN 57 2HG GLN 57 -6.146 16.116 4.252 371 HE21 GLN 57 1HE2 GLN 57 -7.922 17.596 2.856 372 HE22 GLN 57 2HE2 GLN 57 -7.527 19.299 3.034 373 H ILE 58 H ILE 58 -2.218 16.681 7.401 374 HA ILE 58 HA ILE 58 -3.494 14.121 8.305 375 HB ILE 58 HB ILE 58 -0.834 15.397 8.878 376 HG13 ILE 58 2HG1 ILE 58 -1.498 12.505 8.057 377 HG21 ILE 58 1HG2 ILE 58 -2.073 13.045 10.389 378 HG22 ILE 58 2HG2 ILE 58 -0.357 13.499 10.474 379 HG23 ILE 58 3HG2 ILE 58 -1.578 14.596 11.088 380 HD11 ILE 58 3HD1 ILE 58 -0.292 14.698 6.328 381 HD12 ILE 58 1HD1 ILE 58 -0.423 12.987 5.887 382 HD13 ILE 58 2HD1 ILE 58 -1.888 13.919 6.053 383 H GLN 59 H GLN 59 -2.192 17.160 9.841 384 HA GLN 59 HA GLN 59 -3.697 16.401 12.233 385 HB3 GLN 59 2HB GLN 59 -2.725 18.540 13.165 386 HG3 GLN 59 2HG GLN 59 -0.525 16.763 12.067 387 HE21 GLN 59 1HE2 GLN 59 1.078 18.381 12.762 388 HE22 GLN 59 2HE2 GLN 59 1.173 18.929 14.400 389 H GLY 60 H GLY 60 -5.800 16.852 12.462 390 HA2 GLY 60 1HA GLY 60 -7.729 18.107 12.567 391 HA3 GLY 60 2HA GLY 60 -6.874 19.512 11.905 392 H ASN 61 H ASN 61 -6.103 17.018 9.791 393 HA ASN 61 HA ASN 61 -8.584 17.367 8.164 394 HB3 ASN 61 2HB ASN 61 -6.974 16.756 6.234 395 HD21 ASN 61 1HD2 ASN 61 -8.636 18.481 5.627 396 HD22 ASN 61 2HD2 ASN 61 -8.139 20.146 5.846 397 H LYS 62 H LYS 62 -8.571 15.316 6.570 398 HA LYS 62 HA LYS 62 -7.958 12.810 7.710 399 HB3 LYS 62 2HB LYS 62 -10.815 12.816 8.110 400 HG3 LYS 62 2HG LYS 62 -9.420 12.905 10.643 401 HD3 LYS 62 2HD LYS 62 -11.454 11.563 10.158 402 HE3 LYS 62 2HE LYS 62 -9.976 10.673 7.920 403 HZ1 LYS 62 3HZ LYS 62 -10.570 8.438 9.740 404 HZ2 LYS 62 1HZ LYS 62 -9.031 8.914 9.335 405 HZ3 LYS 62 2HZ LYS 62 -10.084 8.311 8.186 406 H ASP 63 H ASP 63 -10.056 14.823 5.765 407 HA ASP 63 HA ASP 63 -10.548 12.920 3.658 408 HB3 ASP 63 2HB ASP 63 -11.854 15.052 4.083 409 H PHE 64 H PHE 64 -9.524 13.591 1.428 410 HA PHE 64 HA PHE 64 -6.797 14.451 1.304 411 HB3 PHE 64 2HB PHE 64 -6.122 12.459 2.236 412 HD1 PHE 64 1HD PHE 64 -8.578 11.151 -0.339 413 HD2 PHE 64 2HD PHE 64 -6.923 10.803 3.628 414 HE1 PHE 64 1HE PHE 64 -10.146 9.354 0.149 415 HE2 PHE 64 2HE PHE 64 -8.399 8.878 4.074 416 HZ PHE 64 HZ PHE 64 -10.068 8.154 2.365 417 HA PRO 65 HA PRO 65 -8.236 14.382 -3.017 418 HB3 PRO 65 2HB PRO 65 -6.341 15.672 -3.450 419 HG3 PRO 65 2HG PRO 65 -4.177 15.064 -2.636 420 HD3 PRO 65 2HD PRO 65 -5.554 15.310 -0.739 421 H GLU 66 H GLU 66 -8.389 13.004 -4.955 422 HA GLU 66 HA GLU 66 -8.303 10.175 -4.427 423 HB3 GLU 66 2HB GLU 66 -10.098 11.382 -5.703 424 HG3 GLU 66 2HG GLU 66 -8.168 11.229 -8.038 425 H ILE 67 H ILE 67 -7.529 8.697 -6.271 426 HA ILE 67 HA ILE 67 -4.671 9.247 -6.848 427 HB ILE 67 HB ILE 67 -4.480 6.813 -7.184 428 HG13 ILE 67 2HG1 ILE 67 -6.973 6.488 -7.766 429 HG21 ILE 67 1HG2 ILE 67 -4.503 6.213 -4.815 430 HG22 ILE 67 2HG2 ILE 67 -3.955 7.877 -5.021 431 HG23 ILE 67 3HG2 ILE 67 -5.600 7.566 -4.459 432 HD11 ILE 67 3HD1 ILE 67 -5.762 4.582 -5.745 433 HD12 ILE 67 1HD1 ILE 67 -7.086 4.231 -6.864 434 HD13 ILE 67 2HD1 ILE 67 -5.470 4.581 -7.500 435 H GLN 68 H GLN 68 -3.946 8.038 -8.928 436 HA GLN 68 HA GLN 68 -5.999 7.515 -10.907 437 HB3 GLN 68 2HB GLN 68 -4.182 8.600 -12.591 438 HG3 GLN 68 2HG GLN 68 -6.296 10.267 -11.196 439 HE21 GLN 68 1HE2 GLN 68 -4.034 11.693 -11.937 440 HE22 GLN 68 2HE2 GLN 68 -4.377 12.493 -13.443 441 H LEU 69 H LEU 69 -5.197 6.017 -12.511 442 HA LEU 69 HA LEU 69 -2.538 5.337 -12.854 443 HB3 LEU 69 2HB LEU 69 -2.879 4.128 -10.639 444 HG LEU 69 HG LEU 69 -4.142 1.938 -12.254 445 HD11 LEU 69 1HD1 LEU 69 -3.960 2.400 -9.262 446 HD12 LEU 69 2HD1 LEU 69 -2.718 1.547 -10.199 447 HD13 LEU 69 3HD1 LEU 69 -4.366 0.886 -10.097 448 HD21 LEU 69 3HD2 LEU 69 -6.274 2.256 -10.928 449 HD22 LEU 69 1HD2 LEU 69 -6.015 3.532 -12.105 450 HD23 LEU 69 2HD2 LEU 69 -5.668 3.832 -10.383 451 H ASP 70 H ASP 70 -2.844 2.840 -14.004 452 HA ASP 70 HA ASP 70 -4.481 3.399 -16.381 453 HB3 ASP 70 2HB ASP 70 -2.790 0.997 -15.930 454 H ASN 71 H ASN 71 -5.309 1.060 -17.260 455 HA ASN 71 HA ASN 71 -7.415 0.115 -15.486 456 HB3 ASN 71 2HB ASN 71 -6.538 -0.894 -18.198 457 HD21 ASN 71 1HD2 ASN 71 -8.213 -2.203 -15.768 458 HD22 ASN 71 2HD2 ASN 71 -9.736 -2.582 -16.534 459 H ILE 72 H ILE 72 -5.438 -0.483 -14.019 460 HA ILE 72 HA ILE 72 -4.294 -3.167 -14.547 461 HB ILE 72 HB ILE 72 -4.520 -1.767 -11.841 462 HG13 ILE 72 2HG1 ILE 72 -3.582 -0.086 -13.287 463 HG21 ILE 72 1HG2 ILE 72 -3.717 -4.115 -11.776 464 HG22 ILE 72 2HG2 ILE 72 -2.450 -3.724 -12.967 465 HG23 ILE 72 3HG2 ILE 72 -2.430 -3.031 -11.327 466 HD11 ILE 72 3HD1 ILE 72 -2.386 -0.523 -11.081 467 HD12 ILE 72 1HD1 ILE 72 -1.114 -1.290 -12.062 468 HD13 ILE 72 2HD1 ILE 72 -1.527 0.420 -12.328 469 H ASP 73 H ASP 73 -4.773 -5.042 -13.567 470 HA ASP 73 HA ASP 73 -7.483 -5.315 -12.374 471 HB3 ASP 73 2HB ASP 73 -5.891 -7.196 -14.162 472 H TYR 74 H TYR 74 -7.309 -5.857 -10.252 473 HA TYR 74 HA TYR 74 -4.709 -6.547 -9.208 474 HB3 TYR 74 2HB TYR 74 -5.790 -6.496 -7.015 475 HD1 TYR 74 1HD TYR 74 -4.080 -4.570 -7.974 476 HD2 TYR 74 2HD TYR 74 -8.387 -4.340 -7.945 477 HE1 TYR 74 1HE TYR 74 -3.972 -2.096 -8.220 478 HE2 TYR 74 2HE TYR 74 -8.269 -1.891 -8.244 479 HH TYR 74 HH TYR 74 -6.359 -0.269 -9.333 480 H ASN 75 H ASN 75 -7.376 -8.430 -10.397 481 HA ASN 75 HA ASN 75 -7.404 -10.513 -8.411 482 HB3 ASN 75 2HB ASN 75 -8.469 -11.864 -10.370 483 HD21 ASN 75 1HD2 ASN 75 -9.367 -8.402 -9.760 484 HD22 ASN 75 2HD2 ASN 75 -10.870 -8.855 -8.993 485 H ASN 76 H ASN 76 -5.843 -10.208 -11.573 486 HA ASN 76 HA ASN 76 -4.947 -12.917 -11.479 487 HB3 ASN 76 2HB ASN 76 -5.647 -11.588 -13.507 488 HD21 ASN 76 1HD2 ASN 76 -5.071 -9.274 -13.349 489 HD22 ASN 76 2HD2 ASN 76 -3.715 -8.692 -14.281 490 H TYR 77 H TYR 77 -3.787 -10.997 -9.384 491 HA TYR 77 HA TYR 77 -1.080 -12.192 -9.536 492 HB3 TYR 77 2HB TYR 77 -0.073 -10.339 -8.418 493 HD1 TYR 77 2HD TYR 77 -2.668 -8.392 -10.214 494 HD2 TYR 77 1HD TYR 77 1.216 -10.230 -10.577 495 HE1 TYR 77 2HE TYR 77 -2.147 -6.931 -12.065 496 HE2 TYR 77 1HE TYR 77 1.682 -8.865 -12.574 497 HH TYR 77 HH TYR 77 0.917 -6.825 -13.877 498 H ASP 78 H ASP 78 -0.592 -13.385 -7.755 499 HA ASP 78 HA ASP 78 -2.696 -13.934 -5.790 500 HB3 ASP 78 2HB ASP 78 0.088 -15.129 -5.984 501 H LEU 79 H LEU 79 0.076 -11.860 -5.971 502 HA LEU 79 HA LEU 79 -0.098 -11.344 -3.048 503 HB3 LEU 79 2HB LEU 79 2.528 -10.996 -4.408 504 HG LEU 79 HG LEU 79 3.535 -11.598 -2.485 505 HD11 LEU 79 1HD1 LEU 79 0.949 -10.657 -1.208 506 HD12 LEU 79 2HD1 LEU 79 2.151 -9.593 -1.982 507 HD13 LEU 79 3HD1 LEU 79 2.596 -10.547 -0.569 508 HD21 LEU 79 3HD2 LEU 79 1.096 -13.222 -1.664 509 HD22 LEU 79 1HD2 LEU 79 2.576 -13.029 -0.683 510 HD23 LEU 79 2HD2 LEU 79 2.644 -13.842 -2.249 511 H ILE 80 H ILE 80 -0.158 -9.117 -2.583 512 HA ILE 80 HA ILE 80 0.564 -7.246 -4.792 513 HB ILE 80 HB ILE 80 -1.863 -6.932 -2.988 514 HG13 ILE 80 2HG1 ILE 80 -2.141 -8.658 -4.797 515 HG21 ILE 80 1HG2 ILE 80 -0.712 -4.781 -3.535 516 HG22 ILE 80 2HG2 ILE 80 -0.729 -5.209 -5.268 517 HG23 ILE 80 3HG2 ILE 80 -2.250 -4.882 -4.394 518 HD11 ILE 80 3HD1 ILE 80 -4.075 -7.814 -5.921 519 HD12 ILE 80 1HD1 ILE 80 -4.115 -7.245 -4.253 520 HD13 ILE 80 2HD1 ILE 80 -3.656 -6.142 -5.572 521 H LEU 81 H LEU 81 2.365 -6.379 -4.166 522 HA LEU 81 HA LEU 81 2.860 -5.492 -1.417 523 HB3 LEU 81 2HB LEU 81 4.953 -4.632 -2.752 524 HG LEU 81 HG LEU 81 5.489 -6.198 -1.206 525 HD11 LEU 81 1HD1 LEU 81 3.490 -7.588 -1.113 526 HD12 LEU 81 2HD1 LEU 81 4.937 -8.598 -1.196 527 HD13 LEU 81 3HD1 LEU 81 3.953 -8.361 -2.649 528 HD21 LEU 81 3HD2 LEU 81 7.067 -6.303 -3.066 529 HD22 LEU 81 1HD2 LEU 81 6.072 -7.554 -3.863 530 HD23 LEU 81 2HD2 LEU 81 6.905 -7.910 -2.331 531 H ILE 82 H ILE 82 3.031 -3.337 -0.980 532 HA ILE 82 HA ILE 82 2.142 -1.308 -2.928 533 HB ILE 82 HB ILE 82 1.253 -1.401 -0.025 534 HG13 ILE 82 2HG1 ILE 82 0.282 -3.459 -0.898 535 HG21 ILE 82 1HG2 ILE 82 1.151 0.723 -1.410 536 HG22 ILE 82 2HG2 ILE 82 -0.122 -0.084 -2.376 537 HG23 ILE 82 3HG2 ILE 82 -0.349 0.227 -0.642 538 HD11 ILE 82 3HD1 ILE 82 -2.050 -3.112 -0.513 539 HD12 ILE 82 1HD1 ILE 82 -1.160 -2.064 0.611 540 HD13 ILE 82 2HD1 ILE 82 -1.939 -1.389 -0.839 541 H GLY 83 H GLY 83 3.414 0.851 -2.373 542 HA2 GLY 83 1HA GLY 83 4.483 0.819 0.377 543 HA3 GLY 83 2HA GLY 83 5.600 1.006 -0.905 544 H SER 84 H SER 84 5.223 2.899 1.086 545 HA SER 84 HA SER 84 4.595 5.324 -0.423 546 HB3 SER 84 2HB SER 84 3.292 4.406 2.170 547 HG SER 84 HG SER 84 3.995 6.515 2.558 548 HA PRO 85 HA PRO 85 8.120 6.457 2.363 549 HB3 PRO 85 2HB PRO 85 8.476 8.247 0.873 550 HG3 PRO 85 2HG PRO 85 6.639 9.590 0.082 551 HD3 PRO 85 2HD PRO 85 6.221 7.372 -0.629 552 H VAL 86 H VAL 86 8.341 7.948 4.447 553 HA VAL 86 HA VAL 86 5.928 8.727 5.777 554 HB VAL 86 HB VAL 86 6.005 6.275 6.246 555 HG11 VAL 86 1HG1 VAL 86 8.455 6.001 6.470 556 HG12 VAL 86 2HG1 VAL 86 8.394 6.837 8.024 557 HG13 VAL 86 3HG1 VAL 86 7.524 5.309 7.802 558 HG21 VAL 86 3HG2 VAL 86 5.553 6.532 8.669 559 HG22 VAL 86 1HG2 VAL 86 6.279 8.123 8.667 560 HG23 VAL 86 2HG2 VAL 86 4.802 7.812 7.711 561 H TRP 87 H TRP 87 6.443 10.166 7.522 562 HA TRP 87 HA TRP 87 9.027 10.146 8.696 563 HB3 TRP 87 2HB TRP 87 8.320 12.811 7.461 564 HD1 TRP 87 HD TRP 87 11.243 10.647 8.823 565 HE1 TRP 87 1HE TRP 87 13.021 12.128 9.782 566 HE3 TRP 87 3HE TRP 87 9.224 15.210 7.577 567 HZ2 TRP 87 2HZ TRP 87 13.692 14.958 9.755 568 HZ3 TRP 87 3HZ TRP 87 10.454 17.281 8.138 569 HH2 TRP 87 HH TRP 87 12.706 17.173 9.179 570 H SER 88 H SER 88 6.010 11.691 8.565 571 HA SER 88 HA SER 88 6.136 11.850 11.533 572 HB3 SER 88 2HB SER 88 4.738 13.845 9.711 573 HG SER 88 HG SER 88 5.186 14.059 12.514 574 H GLY 89 H GLY 89 5.414 9.602 11.254 575 HA2 GLY 89 1HA GLY 89 3.844 8.124 11.849 576 HA3 GLY 89 2HA GLY 89 2.619 9.395 11.843 577 H TYR 90 H TYR 90 2.162 10.236 9.585 578 HA TYR 90 HA TYR 90 2.052 8.313 7.400 579 HB3 TYR 90 2HB TYR 90 0.364 7.267 8.515 580 HD1 TYR 90 1HD TYR 90 0.116 10.786 9.772 581 HD2 TYR 90 2HD TYR 90 -1.836 6.953 9.570 582 HE1 TYR 90 1HE TYR 90 -1.033 11.263 11.882 583 HE2 TYR 90 2HE TYR 90 -2.957 7.392 11.709 584 HH TYR 90 HH TYR 90 -3.336 8.923 13.383 585 HA PRO 91 HA PRO 91 1.749 12.983 6.678 586 HB3 PRO 91 2HB PRO 91 3.997 13.246 7.270 587 HG3 PRO 91 2HG PRO 91 5.635 11.643 6.496 588 HD3 PRO 91 2HD PRO 91 4.108 10.615 8.027 589 H ALA 92 H ALA 92 1.237 10.311 4.858 590 HA ALA 92 HA ALA 92 0.673 11.877 2.470 591 HB1 ALA 92 1HB ALA 92 2.934 10.700 2.077 592 HB2 ALA 92 2HB ALA 92 2.064 9.154 2.243 593 HB3 ALA 92 3HB ALA 92 1.660 10.281 0.942 594 H THR 93 H THR 93 -1.115 10.779 1.276 595 HA THR 93 HA THR 93 -2.329 8.445 2.659 596 HB THR 93 HB THR 93 -4.557 9.504 2.296 597 HG1 THR 93 1HG THR 93 -3.125 11.441 1.099 598 HG21 THR 93 3HG2 THR 93 -2.807 11.166 4.153 599 HG22 THR 93 1HG2 THR 93 -3.575 9.618 4.540 600 HG23 THR 93 2HG2 THR 93 -4.566 11.022 4.190 601 HA PRO 94 HA PRO 94 -2.560 7.995 -2.006 602 HB3 PRO 94 2HB PRO 94 -0.291 8.155 -2.623 603 HG3 PRO 94 2HG PRO 94 1.448 7.635 -1.065 604 HD3 PRO 94 2HD PRO 94 0.076 9.319 -0.142 605 H ILE 95 H ILE 95 -1.744 6.034 0.877 606 HA ILE 95 HA ILE 95 -2.923 3.639 -0.360 607 HB ILE 95 HB ILE 95 -1.709 3.703 2.366 608 HG13 ILE 95 2HG1 ILE 95 0.509 3.184 1.492 609 HG21 ILE 95 1HG2 ILE 95 -1.906 1.642 0.129 610 HG22 ILE 95 2HG2 ILE 95 -1.041 1.375 1.664 611 HG23 ILE 95 3HG2 ILE 95 -2.793 1.664 1.650 612 HD11 ILE 95 3HD1 ILE 95 -0.423 4.270 -1.185 613 HD12 ILE 95 1HD1 ILE 95 1.224 3.831 -0.734 614 HD13 ILE 95 2HD1 ILE 95 -0.025 2.583 -0.877 615 H LYS 96 H LYS 96 -4.752 5.392 -0.148 616 HA LYS 96 HA LYS 96 -6.543 4.190 1.928 617 HB3 LYS 96 2HB LYS 96 -7.584 6.770 1.415 618 HG3 LYS 96 2HG LYS 96 -6.602 7.265 3.729 619 HD3 LYS 96 2HD LYS 96 -8.237 4.693 3.432 620 HE3 LYS 96 2HE LYS 96 -7.466 6.469 5.720 621 HZ1 LYS 96 3HZ LYS 96 -9.673 7.081 5.817 622 HZ2 LYS 96 1HZ LYS 96 -9.623 5.741 6.771 623 HZ3 LYS 96 2HZ LYS 96 -10.250 5.653 5.250 624 H THR 97 H THR 97 -6.665 6.108 -1.157 625 HA THR 97 HA THR 97 -9.235 4.920 -1.780 626 HB THR 97 HB THR 97 -7.309 6.440 -3.609 627 HG1 THR 97 1HG THR 97 -7.516 7.765 -1.923 628 HG21 THR 97 3HG2 THR 97 -9.357 5.500 -4.712 629 HG22 THR 97 1HG2 THR 97 -9.338 7.273 -4.697 630 HG23 THR 97 2HG2 THR 97 -10.350 6.392 -3.538 631 H LEU 98 H LEU 98 -5.885 4.252 -2.947 632 HA LEU 98 HA LEU 98 -6.532 2.364 -4.916 633 HB3 LEU 98 2HB LEU 98 -4.179 2.037 -3.026 634 HG LEU 98 HG LEU 98 -2.877 1.388 -4.839 635 HD11 LEU 98 1HD1 LEU 98 -3.902 -0.495 -5.945 636 HD12 LEU 98 2HD1 LEU 98 -5.515 0.129 -5.685 637 HD13 LEU 98 3HD1 LEU 98 -4.547 -0.418 -4.296 638 HD21 LEU 98 3HD2 LEU 98 -3.433 1.618 -7.171 639 HD22 LEU 98 1HD2 LEU 98 -3.580 3.191 -6.373 640 HD23 LEU 98 2HD2 LEU 98 -5.043 2.243 -6.780 641 H LEU 99 H LEU 99 -6.056 1.891 -1.435 642 HA LEU 99 HA LEU 99 -6.342 -0.873 -1.207 643 HB3 LEU 99 2HB LEU 99 -7.620 -0.213 1.046 644 HG LEU 99 HG LEU 99 -4.755 0.689 0.529 645 HD11 LEU 99 1HD1 LEU 99 -4.628 0.674 3.071 646 HD12 LEU 99 2HD1 LEU 99 -6.391 0.447 3.086 647 HD13 LEU 99 3HD1 LEU 99 -5.706 1.917 2.432 648 HD21 LEU 99 3HD2 LEU 99 -5.139 -1.778 0.296 649 HD22 LEU 99 1HD2 LEU 99 -5.912 -1.797 1.896 650 HD23 LEU 99 2HD2 LEU 99 -4.184 -1.404 1.741 651 H ASP 100 H ASP 100 -9.019 1.544 -1.460 652 HA ASP 100 HA ASP 100 -11.002 -0.540 -1.145 653 HB3 ASP 100 2HB ASP 100 -11.594 2.155 -2.347 654 H GLN 101 H GLN 101 -9.169 0.650 -3.836 655 HA GLN 101 HA GLN 101 -11.040 -0.230 -5.902 656 HB3 GLN 101 2HB GLN 101 -9.297 -0.020 -7.458 657 HG3 GLN 101 2HG GLN 101 -8.861 2.413 -5.732 658 HE21 GLN 101 1HE2 GLN 101 -10.049 4.375 -7.201 659 HE22 GLN 101 2HE2 GLN 101 -9.523 4.244 -8.862 660 H MET 102 H MET 102 -8.509 -1.726 -3.862 661 HA MET 102 HA MET 102 -8.258 -4.128 -5.443 662 HB3 MET 102 2HB MET 102 -6.896 -4.949 -3.630 663 HG3 MET 102 2HG MET 102 -6.380 -2.045 -4.270 664 HE1 MET 102 3HE MET 102 -5.178 -5.035 -1.836 665 HE2 MET 102 1HE MET 102 -4.319 -5.211 -3.381 666 HE3 MET 102 2HE MET 102 -3.426 -4.737 -1.924 667 H LYS 103 H LYS 103 -11.092 -3.369 -4.298 668 HA LYS 103 HA LYS 103 -11.823 -5.066 -2.258 669 HB3 LYS 103 2HB LYS 103 -14.119 -5.123 -3.787 670 HG3 LYS 103 2HG LYS 103 -14.562 -2.724 -3.062 671 HD3 LYS 103 2HD LYS 103 -13.603 -4.741 -0.985 672 HE3 LYS 103 2HE LYS 103 -15.496 -2.387 -0.698 673 HZ1 LYS 103 3HZ LYS 103 -15.470 -2.879 1.533 674 HZ2 LYS 103 1HZ LYS 103 -14.125 -3.829 1.449 675 HZ3 LYS 103 2HZ LYS 103 -15.577 -4.375 0.865 676 H ASN 104 H ASN 104 -11.068 -6.137 -5.502 677 HA ASN 104 HA ASN 104 -12.096 -8.861 -4.862 678 HB3 ASN 104 2HB ASN 104 -12.275 -9.177 -7.300 679 HD21 ASN 104 1HD2 ASN 104 -13.388 -5.810 -7.032 680 HD22 ASN 104 2HD2 ASN 104 -15.042 -6.234 -6.646 681 H TYR 105 H TYR 105 -9.562 -7.831 -3.921 682 HA TYR 105 HA TYR 105 -7.470 -8.938 -5.547 683 HB3 TYR 105 2HB TYR 105 -7.298 -7.287 -3.584 684 HD1 TYR 105 1HD TYR 105 -9.375 -7.706 -1.943 685 HD2 TYR 105 2HD TYR 105 -5.700 -9.983 -1.848 686 HE1 TYR 105 1HE TYR 105 -9.885 -8.444 0.335 687 HE2 TYR 105 2HE TYR 105 -6.183 -10.663 0.445 688 HH TYR 105 HH TYR 105 -8.242 -10.990 1.858 689 H ARG 106 H ARG 106 -6.591 -11.009 -5.459 690 HA ARG 106 HA ARG 106 -8.245 -13.198 -4.298 691 HB3 ARG 106 2HB ARG 106 -7.758 -14.420 -6.486 692 HG3 ARG 106 2HG ARG 106 -9.074 -12.779 -8.015 693 HD3 ARG 106 2HD ARG 106 -10.333 -14.542 -7.275 694 HE ARG 106 HE ARG 106 -10.155 -13.541 -4.468 695 HH11 ARG 106 1HH1 ARG 106 -11.127 -16.188 -6.603 696 HH12 ARG 106 2HH1 ARG 106 -10.772 -17.448 -5.481 697 HH21 ARG 106 1HH2 ARG 106 -9.459 -15.235 -3.003 698 HH22 ARG 106 2HH2 ARG 106 -9.873 -16.877 -3.364 699 H GLY 107 H GLY 107 -5.890 -11.927 -3.251 700 HA2 GLY 107 1HA GLY 107 -3.937 -14.133 -3.184 701 HA3 GLY 107 2HA GLY 107 -3.494 -12.514 -3.797 702 H GLU 108 H GLU 108 -2.032 -12.306 -1.997 703 HA GLU 108 HA GLU 108 -3.346 -11.689 0.637 704 HB3 GLU 108 2HB GLU 108 -0.986 -11.902 1.490 705 HG3 GLU 108 2HG GLU 108 -2.126 -14.390 0.159 706 H VAL 109 H VAL 109 -2.595 -9.718 1.777 707 HA VAL 109 HA VAL 109 -1.282 -7.775 -0.078 708 HB VAL 109 HB VAL 109 -3.087 -7.009 2.222 709 HG11 VAL 109 1HG1 VAL 109 -3.266 -4.906 0.895 710 HG12 VAL 109 2HG1 VAL 109 -1.589 -5.261 1.307 711 HG13 VAL 109 3HG1 VAL 109 -2.160 -5.597 -0.324 712 HG21 VAL 109 3HG2 VAL 109 -3.871 -7.538 -0.697 713 HG22 VAL 109 1HG2 VAL 109 -4.549 -8.317 0.754 714 HG23 VAL 109 2HG2 VAL 109 -4.868 -6.610 0.447 715 H ALA 110 H ALA 110 0.598 -6.908 0.485 716 HA ALA 110 HA ALA 110 1.343 -6.692 3.310 717 HB1 ALA 110 1HB ALA 110 3.199 -7.788 1.156 718 HB2 ALA 110 2HB ALA 110 3.624 -7.483 2.851 719 HB3 ALA 110 3HB ALA 110 2.477 -8.750 2.435 720 H SER 111 H SER 111 3.008 -4.783 3.536 721 HA SER 111 HA SER 111 2.979 -3.054 1.166 722 HB3 SER 111 2HB SER 111 1.326 -2.655 3.680 723 HG SER 111 HG SER 111 1.966 -0.679 3.399 724 H PHE 112 H PHE 112 4.918 -2.122 1.125 725 HA PHE 112 HA PHE 112 6.550 -2.198 3.573 726 HB3 PHE 112 2HB PHE 112 6.868 -4.092 1.852 727 HD1 PHE 112 2HD PHE 112 5.823 -3.550 -0.393 728 HD2 PHE 112 1HD PHE 112 9.696 -2.099 0.846 729 HE1 PHE 112 2HE PHE 112 6.431 -3.126 -2.736 730 HE2 PHE 112 1HE PHE 112 10.304 -1.712 -1.525 731 HZ PHE 112 HZ PHE 112 8.712 -2.352 -3.333 732 H PHE 113 H PHE 113 7.645 -0.444 4.075 733 HA PHE 113 HA PHE 113 7.764 1.871 2.200 734 HB3 PHE 113 2HB PHE 113 6.261 2.078 4.248 735 HD1 PHE 113 1HD PHE 113 7.092 0.146 5.996 736 HD2 PHE 113 2HD PHE 113 8.797 4.072 5.606 737 HE1 PHE 113 1HE PHE 113 8.217 -0.136 8.169 738 HE2 PHE 113 2HE PHE 113 9.789 3.868 7.863 739 HZ PHE 113 HZ PHE 113 9.604 1.751 9.104 740 H THR 114 H THR 114 9.717 3.105 2.311 741 HA THR 114 HA THR 114 12.128 1.617 3.200 742 HB THR 114 HB THR 114 13.006 2.699 1.015 743 HG1 THR 114 1HG THR 114 11.090 2.958 -0.461 744 HG21 THR 114 3HG2 THR 114 12.019 0.936 -0.379 745 HG22 THR 114 1HG2 THR 114 10.767 0.624 0.824 746 HG23 THR 114 2HG2 THR 114 12.479 0.296 1.195 747 H SER 115 H SER 115 10.650 3.752 4.630 748 HA SER 115 HA SER 115 12.646 5.971 4.668 749 HB3 SER 115 2HB SER 115 10.506 7.335 5.243 750 HG SER 115 HG SER 115 11.485 7.529 3.252 751 H ALA 116 H ALA 116 13.113 3.910 6.341 752 HA ALA 116 HA ALA 116 11.644 4.052 8.837 753 HB1 ALA 116 1HB ALA 116 14.401 2.882 8.368 754 HB2 ALA 116 2HB ALA 116 13.291 2.520 9.697 755 HB3 ALA 116 3HB ALA 116 12.874 2.040 8.033 756 H GLY 117 H GLY 117 13.866 6.324 7.618 757 HA2 GLY 117 1HA GLY 117 15.767 6.489 9.588 758 HA3 GLY 117 2HA GLY 117 15.337 7.800 8.489 759 H THR 118 H THR 118 12.483 7.831 9.992 760 HA THR 118 HA THR 118 13.368 8.380 12.703 761 HB THR 118 HB THR 118 11.810 10.700 11.625 762 HG1 THR 118 1HG THR 118 14.440 10.092 10.892 763 HG21 THR 118 3HG2 THR 118 12.557 10.513 14.019 764 HG22 THR 118 1HG2 THR 118 13.297 11.901 13.202 765 HG23 THR 118 2HG2 THR 118 14.222 10.402 13.468 766 H ASN 119 H ASN 119 11.228 6.717 11.003 767 HA ASN 119 HA ASN 119 9.148 6.657 13.075 768 HB3 ASN 119 2HB ASN 119 8.282 7.402 10.270 769 HD21 ASN 119 1HD2 ASN 119 7.572 8.420 13.719 770 HD22 ASN 119 2HD2 ASN 119 5.878 8.054 13.572 771 H HIS 120 H HIS 120 8.769 4.506 13.220 772 HA HIS 120 HA HIS 120 8.442 2.895 10.772 773 HB3 HIS 120 2HB HIS 120 10.545 2.382 12.894 774 HD1 HIS 120 1HD HIS 120 11.378 -0.035 13.334 775 HD2 HIS 120 2HD HIS 120 8.397 0.301 10.367 776 HE1 HIS 120 1HE HIS 120 10.656 -2.398 12.747 777 H LYS 121 H LYS 121 8.713 2.443 14.366 778 HA LYS 121 HA LYS 121 6.703 0.461 14.521 779 HB3 LYS 121 2HB LYS 121 7.115 2.428 16.755 780 HG3 LYS 121 2HG LYS 121 7.397 0.254 18.054 781 HD3 LYS 121 2HD LYS 121 4.626 0.674 16.847 782 HE3 LYS 121 2HE LYS 121 3.950 -0.496 19.019 783 HZ1 LYS 121 3HZ LYS 121 5.178 -1.970 16.777 784 HZ2 LYS 121 1HZ LYS 121 3.593 -1.794 17.121 785 HZ3 LYS 121 2HZ LYS 121 4.477 -2.773 18.040 786 H ALA 122 H ALA 122 6.422 4.065 14.544 787 HA ALA 122 HA ALA 122 3.699 4.326 15.108 788 HB1 ALA 122 1HB ALA 122 4.110 6.385 13.604 789 HB2 ALA 122 2HB ALA 122 5.227 6.176 14.975 790 HB3 ALA 122 3HB ALA 122 5.721 5.711 13.336 791 H TYR 123 H TYR 123 5.223 4.164 11.866 792 HA TYR 123 HA TYR 123 2.985 4.221 10.287 793 HB3 TYR 123 2HB TYR 123 5.623 2.790 9.801 794 HD1 TYR 123 1HD TYR 123 3.848 5.425 7.796 795 HD2 TYR 123 2HD TYR 123 4.989 1.251 8.073 796 HE1 TYR 123 1HE TYR 123 3.334 5.119 5.402 797 HE2 TYR 123 2HE TYR 123 4.445 0.964 5.681 798 HH TYR 123 HH TYR 123 2.729 2.503 3.914 799 H VAL 124 H VAL 124 4.589 1.272 11.606 800 HA VAL 124 HA VAL 124 2.944 -0.674 10.342 801 HB VAL 124 HB VAL 124 4.456 -0.653 12.987 802 HG11 VAL 124 1HG1 VAL 124 3.290 -2.980 11.426 803 HG12 VAL 124 2HG1 VAL 124 4.573 -3.202 12.630 804 HG13 VAL 124 3HG1 VAL 124 2.996 -2.549 13.115 805 HG21 VAL 124 3HG2 VAL 124 6.302 -1.705 11.801 806 HG22 VAL 124 1HG2 VAL 124 5.335 -1.907 10.337 807 HG23 VAL 124 2HG2 VAL 124 5.854 -0.293 10.844 808 H SER 125 H SER 125 2.122 1.481 12.985 809 HA SER 125 HA SER 125 -0.235 -0.221 13.728 810 HB3 SER 125 2HB SER 125 0.629 2.280 15.166 811 HG SER 125 HG SER 125 -1.119 0.987 16.023 812 H HIS 126 H HIS 126 0.694 3.114 12.736 813 HA HIS 126 HA HIS 126 -1.845 4.206 12.321 814 HB3 HIS 126 2HB HIS 126 -0.585 5.615 10.642 815 HD1 HIS 126 1HD HIS 126 -1.092 5.873 14.049 816 HD2 HIS 126 2HD HIS 126 2.313 6.457 11.668 817 HE1 HIS 126 1HE HIS 126 0.398 7.428 15.318 818 H PHE 127 H PHE 127 0.145 2.334 9.916 819 HA PHE 127 HA PHE 127 -1.693 2.660 7.759 820 HB3 PHE 127 2HB PHE 127 0.390 0.545 8.395 821 HD1 PHE 127 1HD PHE 127 -1.602 1.939 5.451 822 HD2 PHE 127 2HD PHE 127 0.367 -1.453 7.242 823 HE1 PHE 127 1HE PHE 127 -2.208 0.518 3.502 824 HE2 PHE 127 2HE PHE 127 -0.313 -2.865 5.328 825 HZ PHE 127 HZ PHE 127 -1.525 -1.843 3.411 826 H ASN 128 H ASN 128 -1.476 0.220 10.355 827 HA ASN 128 HA ASN 128 -3.442 -1.539 9.319 828 HB3 ASN 128 2HB ASN 128 -3.806 -2.064 11.878 829 HD21 ASN 128 1HD2 ASN 128 -1.096 -2.880 12.928 830 HD22 ASN 128 2HD2 ASN 128 -0.702 -4.174 11.824 831 H GLU 129 H GLU 129 -3.860 1.459 11.234 832 HA GLU 129 HA GLU 129 -6.679 1.131 11.603 833 HB3 GLU 129 2HB GLU 129 -6.658 3.509 12.109 834 HG3 GLU 129 2HG GLU 129 -5.092 3.764 13.840 835 H TRP 130 H TRP 130 -4.788 2.267 8.952 836 HA TRP 130 HA TRP 130 -7.108 3.516 7.610 837 HB3 TRP 130 2HB TRP 130 -5.343 4.174 5.950 838 HD1 TRP 130 HD TRP 130 -6.424 4.996 9.392 839 HE1 TRP 130 1HE TRP 130 -5.968 7.443 9.890 840 HE3 TRP 130 3HE TRP 130 -3.138 5.966 5.602 841 HZ2 TRP 130 2HZ TRP 130 -4.202 9.532 8.920 842 HZ3 TRP 130 3HZ TRP 130 -2.043 8.175 5.461 843 HH2 TRP 130 HH TRP 130 -2.588 9.980 7.090 844 H ALA 131 H ALA 131 -5.733 0.431 7.778 845 HA ALA 131 HA ALA 131 -6.628 -0.184 4.989 846 HB1 ALA 131 1HB ALA 131 -4.833 -1.848 4.934 847 HB2 ALA 131 2HB ALA 131 -4.192 -0.229 5.280 848 HB3 ALA 131 3HB ALA 131 -4.380 -1.398 6.598 849 H ASP 132 H ASP 132 -7.400 -0.686 8.055 850 HA ASP 132 HA ASP 132 -7.790 -3.139 8.872 851 HB3 ASP 132 2HB ASP 132 -9.860 -1.043 9.363 852 H GLY 133 H GLY 133 -8.492 -3.789 6.369 853 HA2 GLY 133 1HA GLY 133 -10.912 -5.341 6.987 854 HA3 GLY 133 2HA GLY 133 -11.030 -4.324 5.541 855 H LEU 134 H LEU 134 -8.629 -4.436 4.392 856 HA LEU 134 HA LEU 134 -8.641 -6.866 2.927 857 HB3 LEU 134 2HB LEU 134 -6.349 -6.020 2.160 858 HG LEU 134 HG LEU 134 -6.982 -3.840 1.238 859 HD11 LEU 134 1HD1 LEU 134 -8.982 -6.077 0.652 860 HD12 LEU 134 2HD1 LEU 134 -7.388 -5.908 -0.089 861 HD13 LEU 134 3HD1 LEU 134 -8.658 -4.735 -0.433 862 HD21 LEU 134 3HD2 LEU 134 -9.757 -4.228 2.326 863 HD22 LEU 134 1HD2 LEU 134 -9.168 -2.925 1.277 864 HD23 LEU 134 2HD2 LEU 134 -8.549 -3.054 2.921 865 H ASN 135 H ASN 135 -7.415 -8.756 3.102 866 HA ASN 135 HA ASN 135 -6.371 -9.562 5.598 867 HB3 ASN 135 2HB ASN 135 -5.810 -10.667 2.829 868 HD21 ASN 135 1HD2 ASN 135 -4.263 -12.132 2.827 869 HD22 ASN 135 2HD2 ASN 135 -3.629 -13.096 4.135 870 H VAL 136 H VAL 136 -4.671 -8.566 6.543 871 HA VAL 136 HA VAL 136 -2.301 -7.931 4.902 872 HB VAL 136 HB VAL 136 -3.094 -7.299 7.780 873 HG11 VAL 136 1HG1 VAL 136 -0.647 -7.371 7.702 874 HG12 VAL 136 2HG1 VAL 136 -0.631 -6.327 6.253 875 HG13 VAL 136 3HG1 VAL 136 -1.192 -5.697 7.815 876 HG21 VAL 136 3HG2 VAL 136 -4.059 -6.073 5.482 877 HG22 VAL 136 1HG2 VAL 136 -3.942 -5.329 7.081 878 HG23 VAL 136 2HG2 VAL 136 -2.662 -5.082 5.879 879 H ILE 137 H ILE 137 -0.597 -9.207 4.913 880 HA ILE 137 HA ILE 137 -0.120 -10.982 7.280 881 HB ILE 137 HB ILE 137 0.878 -12.650 5.748 882 HG13 ILE 137 2HG1 ILE 137 -0.370 -10.975 3.521 883 HG21 ILE 137 1HG2 ILE 137 -2.041 -12.011 5.238 884 HG22 ILE 137 2HG2 ILE 137 -1.251 -13.592 5.031 885 HG23 ILE 137 3HG2 ILE 137 -1.398 -12.887 6.643 886 HD11 ILE 137 3HD1 ILE 137 1.818 -11.376 2.389 887 HD12 ILE 137 1HD1 ILE 137 2.000 -10.378 3.842 888 HD13 ILE 137 2HD1 ILE 137 2.435 -12.099 3.893 889 H GLY 138 H GLY 138 1.103 -8.272 5.696 890 HA2 GLY 138 1HA GLY 138 3.796 -8.795 6.807 891 HA3 GLY 138 2HA GLY 138 3.633 -8.613 5.079 892 H VAL 139 H VAL 139 4.216 -6.977 7.888 893 HA VAL 139 HA VAL 139 4.480 -4.571 6.293 894 HB VAL 139 HB VAL 139 3.143 -4.294 9.013 895 HG11 VAL 139 1HG1 VAL 139 2.922 -1.920 8.329 896 HG12 VAL 139 2HG1 VAL 139 4.630 -2.411 8.314 897 HG13 VAL 139 3HG1 VAL 139 3.744 -2.284 6.799 898 HG21 VAL 139 3HG2 VAL 139 1.910 -3.944 6.241 899 HG22 VAL 139 1HG2 VAL 139 1.450 -5.164 7.460 900 HG23 VAL 139 2HG2 VAL 139 1.167 -3.461 7.776 901 H ALA 140 H ALA 140 6.496 -4.123 6.443 902 HA ALA 140 HA ALA 140 8.013 -4.209 8.983 903 HB1 ALA 140 1HB ALA 140 9.073 -5.441 6.404 904 HB2 ALA 140 2HB ALA 140 9.670 -5.655 8.057 905 HB3 ALA 140 3HB ALA 140 8.163 -6.424 7.571 906 H ARG 141 H ARG 141 10.537 -3.498 7.820 907 HA ARG 141 HA ARG 141 9.977 -1.109 6.171 908 HB3 ARG 141 2HB ARG 141 10.626 -0.520 8.448 909 HG3 ARG 141 2HG ARG 141 13.309 -1.780 7.754 910 HD3 ARG 141 2HD ARG 141 12.173 -0.578 10.314 911 HE ARG 141 HE ARG 141 14.994 -1.138 10.071 912 HH11 ARG 141 1HH1 ARG 141 11.937 -2.847 10.785 913 HH12 ARG 141 2HH1 ARG 141 12.687 -4.106 11.668 914 HH21 ARG 141 1HH2 ARG 141 15.970 -2.813 11.233 915 HH22 ARG 141 2HH2 ARG 141 15.077 -4.030 12.056 916 H ASP 142 H ASP 142 11.686 -0.696 4.634 917 HA ASP 142 HA ASP 142 13.098 -1.219 2.955 918 HB3 ASP 142 2HB ASP 142 15.264 -1.895 3.611 919 H ASP 143 H ASP 143 14.757 -3.579 2.594 920 HA ASP 143 HA ASP 143 12.697 -5.554 1.817 921 HB3 ASP 143 2HB ASP 143 13.444 -5.028 -0.295 922 H SER 144 H SER 144 12.868 -6.413 3.890 923 HA SER 144 HA SER 144 15.257 -8.140 4.291 924 HB3 SER 144 2HB SER 144 13.836 -7.242 6.732 925 HG SER 144 HG SER 144 15.813 -8.273 6.881 926 H GLU 145 H GLU 145 11.756 -7.804 4.226 927 HA GLU 145 HA GLU 145 11.480 -10.640 5.067 928 HB3 GLU 145 2HB GLU 145 9.475 -10.170 6.157 929 HG3 GLU 145 2HG GLU 145 11.176 -7.759 6.896 930 H VAL 146 H VAL 146 11.959 -9.390 2.309 931 HA VAL 146 HA VAL 146 9.418 -9.436 0.939 932 HB VAL 146 HB VAL 146 12.238 -9.676 -0.148 933 HG11 VAL 146 1HG1 VAL 146 9.675 -8.808 -1.554 934 HG12 VAL 146 2HG1 VAL 146 11.323 -8.813 -2.250 935 HG13 VAL 146 3HG1 VAL 146 10.577 -10.325 -1.847 936 HG21 VAL 146 3HG2 VAL 146 11.904 -7.583 1.182 937 HG22 VAL 146 1HG2 VAL 146 12.119 -7.248 -0.525 938 HG23 VAL 146 2HG2 VAL 146 10.491 -7.191 0.187 939 H ASP 147 H ASP 147 11.886 -11.854 1.644 940 HA ASP 147 HA ASP 147 11.028 -13.852 -0.176 941 HB3 ASP 147 2HB ASP 147 12.088 -15.486 1.281 942 H LYS 148 H LYS 148 9.834 -13.044 3.140 943 HA LYS 148 HA LYS 148 8.211 -15.458 3.308 944 HB3 LYS 148 2HB LYS 148 8.826 -14.444 5.418 945 HG3 LYS 148 2HG LYS 148 7.518 -12.010 4.248 946 HD3 LYS 148 2HD LYS 148 6.299 -12.444 6.379 947 HE3 LYS 148 2HE LYS 148 9.132 -12.124 7.434 948 HZ1 LYS 148 3HZ LYS 148 6.644 -11.344 8.828 949 HZ2 LYS 148 1HZ LYS 148 7.914 -10.355 8.434 950 HZ3 LYS 148 2HZ LYS 148 8.134 -11.511 9.540 951 H TRP 149 H TRP 149 7.721 -12.319 1.753 952 HA TRP 149 HA TRP 149 4.852 -12.953 1.319 953 HB3 TRP 149 2HB TRP 149 4.744 -10.749 0.347 954 HD1 TRP 149 HD TRP 149 4.571 -11.615 3.445 955 HE1 TRP 149 1HE TRP 149 5.352 -10.052 5.312 956 HE3 TRP 149 3HE TRP 149 7.460 -8.430 0.680 957 HZ2 TRP 149 2HZ TRP 149 6.986 -7.679 5.582 958 HZ3 TRP 149 3HZ TRP 149 8.697 -6.571 1.798 959 HH2 TRP 149 HH TRP 149 8.464 -6.225 4.244 960 H SER 150 H SER 150 7.060 -14.732 0.202 961 HA SER 150 HA SER 150 5.903 -14.824 -2.497 962 HB3 SER 150 2HB SER 150 8.902 -14.495 -2.058 963 HG SER 150 HG SER 150 7.332 -14.697 -4.449 964 H LYS 151 H LYS 151 7.935 -16.322 0.030 965 HA LYS 151 HA LYS 151 8.001 -18.944 -1.212 966 HB3 LYS 151 2HB LYS 151 8.817 -19.624 1.039 967 HG3 LYS 151 2HG LYS 151 10.777 -18.089 1.321 968 HD3 LYS 151 2HD LYS 151 10.352 -18.976 -1.555 969 HE3 LYS 151 2HE LYS 151 12.196 -17.324 -1.080 970 HZ1 LYS 151 3HZ LYS 151 12.779 -18.488 1.145 971 HZ2 LYS 151 1HZ LYS 151 13.994 -17.907 0.216 972 HZ3 LYS 151 2HZ LYS 151 13.648 -19.512 0.248 Start of MODEL 13 1 H1 GLY 1 H GLY 1 -4.579 -25.911 -12.195 2 HA2 GLY 1 1HA GLY 1 -2.220 -25.174 -12.546 3 HA3 GLY 1 2HA GLY 1 -3.383 -23.847 -12.356 4 H MET 2 H MET 2 -0.558 -23.725 -11.837 5 HA MET 2 HA MET 2 -0.721 -22.377 -9.272 6 HB3 MET 2 2HB MET 2 1.613 -23.153 -8.717 7 HG3 MET 2 2HG MET 2 -0.450 -25.383 -8.673 8 HE1 MET 2 3HE MET 2 2.862 -23.753 -7.006 9 HE2 MET 2 1HE MET 2 1.504 -23.548 -5.883 10 HE3 MET 2 2HE MET 2 2.835 -24.660 -5.484 11 H ALA 3 H ALA 3 -0.052 -20.342 -9.754 12 HA ALA 3 HA ALA 3 2.584 -19.925 -10.661 13 HB1 ALA 3 1HB ALA 3 0.424 -18.802 -12.500 14 HB2 ALA 3 2HB ALA 3 2.121 -18.264 -12.414 15 HB3 ALA 3 3HB ALA 3 1.739 -19.909 -12.948 16 H LYS 4 H LYS 4 2.934 -18.758 -8.813 17 HA LYS 4 HA LYS 4 0.911 -16.845 -7.878 18 HB3 LYS 4 2HB LYS 4 2.490 -16.459 -6.028 19 HG3 LYS 4 2HG LYS 4 1.918 -19.439 -6.477 20 HD3 LYS 4 2HD LYS 4 2.191 -17.562 -4.160 21 HE3 LYS 4 2HE LYS 4 0.129 -18.775 -3.747 22 HZ1 LYS 4 3HZ LYS 4 1.786 -21.191 -4.145 23 HZ2 LYS 4 1HZ LYS 4 0.384 -20.787 -4.947 24 HZ3 LYS 4 2HZ LYS 4 0.332 -21.219 -3.380 25 H LYS 5 H LYS 5 0.809 -15.193 -9.250 26 HA LYS 5 HA LYS 5 3.211 -13.725 -10.155 27 HB3 LYS 5 2HB LYS 5 1.790 -12.190 -11.243 28 HG3 LYS 5 2HG LYS 5 1.616 -14.625 -12.186 29 HD3 LYS 5 2HD LYS 5 -1.282 -13.997 -11.579 30 HE3 LYS 5 2HE LYS 5 -1.641 -16.368 -12.065 31 HZ1 LYS 5 3HZ LYS 5 -1.125 -16.310 -14.378 32 HZ2 LYS 5 1HZ LYS 5 0.015 -15.127 -14.197 33 HZ3 LYS 5 2HZ LYS 5 -1.583 -14.821 -13.951 34 H THR 6 H THR 6 3.171 -11.468 -9.790 35 HA THR 6 HA THR 6 2.290 -10.598 -7.109 36 HB THR 6 HB THR 6 5.200 -10.368 -7.913 37 HG1 THR 6 1HG THR 6 5.016 -12.144 -6.009 38 HG21 THR 6 3HG2 THR 6 3.817 -9.907 -5.248 39 HG22 THR 6 1HG2 THR 6 4.653 -8.717 -6.247 40 HG23 THR 6 2HG2 THR 6 5.570 -10.014 -5.476 41 H LEU 7 H LEU 7 2.121 -8.217 -6.907 42 HA LEU 7 HA LEU 7 2.992 -6.626 -9.246 43 HB3 LEU 7 2HB LEU 7 0.207 -6.624 -8.045 44 HG LEU 7 HG LEU 7 -0.384 -5.182 -10.008 45 HD11 LEU 7 1HD1 LEU 7 -0.200 -3.111 -8.890 46 HD12 LEU 7 2HD1 LEU 7 1.143 -3.682 -7.889 47 HD13 LEU 7 3HD1 LEU 7 -0.471 -4.383 -7.689 48 HD21 LEU 7 3HD2 LEU 7 1.166 -3.556 -10.930 49 HD22 LEU 7 1HD2 LEU 7 1.651 -5.224 -11.323 50 HD23 LEU 7 2HD2 LEU 7 2.516 -4.297 -10.077 51 H ILE 8 H ILE 8 3.778 -4.669 -8.700 52 HA ILE 8 HA ILE 8 3.882 -3.888 -5.837 53 HB ILE 8 HB ILE 8 6.008 -3.700 -8.015 54 HG13 ILE 8 2HG1 ILE 8 5.564 -6.052 -6.886 55 HG21 ILE 8 1HG2 ILE 8 6.168 -1.791 -6.468 56 HG22 ILE 8 2HG2 ILE 8 6.127 -2.908 -5.074 57 HG23 ILE 8 3HG2 ILE 8 7.508 -2.893 -6.190 58 HD11 ILE 8 3HD1 ILE 8 8.370 -4.896 -6.818 59 HD12 ILE 8 1HD1 ILE 8 7.901 -6.608 -6.857 60 HD13 ILE 8 2HD1 ILE 8 7.543 -5.569 -8.248 61 H LEU 9 H LEU 9 3.152 -1.823 -5.489 62 HA LEU 9 HA LEU 9 3.455 0.183 -7.668 63 HB3 LEU 9 2HB LEU 9 1.467 1.327 -6.515 64 HG LEU 9 HG LEU 9 0.921 -1.342 -7.845 65 HD11 LEU 9 1HD1 LEU 9 -0.981 0.967 -7.279 66 HD12 LEU 9 2HD1 LEU 9 -0.943 -0.599 -6.432 67 HD13 LEU 9 3HD1 LEU 9 -1.365 -0.548 -8.144 68 HD21 LEU 9 3HD2 LEU 9 2.072 0.217 -9.337 69 HD22 LEU 9 1HD2 LEU 9 0.856 1.480 -9.043 70 HD23 LEU 9 2HD2 LEU 9 0.405 -0.032 -9.837 71 H TYR 10 H TYR 10 3.821 2.343 -6.937 72 HA TYR 10 HA TYR 10 4.385 2.822 -4.130 73 HB3 TYR 10 2HB TYR 10 6.562 1.988 -4.926 74 HD1 TYR 10 1HD TYR 10 6.582 5.350 -6.640 75 HD2 TYR 10 2HD TYR 10 6.953 1.078 -7.105 76 HE1 TYR 10 1HE TYR 10 7.561 5.694 -8.857 77 HE2 TYR 10 2HE TYR 10 7.917 1.402 -9.318 78 HH TYR 10 HH TYR 10 8.140 4.544 -10.963 79 H TYR 11 H TYR 11 4.609 5.136 -3.715 80 HA TYR 11 HA TYR 11 4.050 7.006 -5.944 81 HB3 TYR 11 2HB TYR 11 2.541 6.801 -3.323 82 HD1 TYR 11 1HD TYR 11 1.423 8.661 -6.325 83 HD2 TYR 11 2HD TYR 11 3.037 9.025 -2.335 84 HE1 TYR 11 1HE TYR 11 0.789 11.051 -6.274 85 HE2 TYR 11 2HE TYR 11 2.361 11.379 -2.265 86 HH TYR 11 HH TYR 11 0.926 13.097 -5.048 87 H SER 12 H SER 12 6.246 7.468 -5.905 88 HA SER 12 HA SER 12 6.841 9.774 -4.477 89 HB3 SER 12 2HB SER 12 9.061 8.003 -3.709 90 HG SER 12 HG SER 12 8.927 9.243 -1.861 91 H TRP 13 H TRP 13 6.470 8.931 -7.102 92 HA TRP 13 HA TRP 13 7.210 8.986 -9.150 93 HB3 TRP 13 2HB TRP 13 9.395 10.896 -8.499 94 HD1 TRP 13 HD TRP 13 5.801 11.386 -9.779 95 HE1 TRP 13 1HE TRP 13 5.866 12.677 -12.014 96 HE3 TRP 13 3HE TRP 13 10.859 11.435 -10.598 97 HZ2 TRP 13 2HZ TRP 13 7.824 13.617 -13.868 98 HZ3 TRP 13 3HZ TRP 13 11.797 12.660 -12.521 99 HH2 TRP 13 HH TRP 13 10.291 13.766 -14.165 100 H SER 14 H SER 14 9.472 9.361 -10.506 101 HA SER 14 HA SER 14 10.550 6.694 -10.516 102 HB3 SER 14 2HB SER 14 11.515 7.447 -12.630 103 HG SER 14 HG SER 14 9.648 7.879 -13.615 104 H GLY 15 H GLY 15 11.449 8.169 -8.111 105 HA2 GLY 15 1HA GLY 15 14.328 7.709 -8.513 106 HA3 GLY 15 2HA GLY 15 13.873 9.333 -7.980 107 H GLU 16 H GLU 16 12.371 9.404 -6.045 108 HA GLU 16 HA GLU 16 13.648 8.413 -3.878 109 HB3 GLU 16 2HB GLU 16 11.072 8.863 -2.939 110 HG3 GLU 16 2HG GLU 16 11.878 11.313 -2.809 111 H THR 17 H THR 17 10.430 6.978 -4.901 112 HA THR 17 HA THR 17 11.081 4.643 -3.235 113 HB THR 17 HB THR 17 8.846 3.857 -4.318 114 HG1 THR 17 1HG THR 17 8.764 5.496 -5.924 115 HG21 THR 17 3HG2 THR 17 7.531 5.258 -2.695 116 HG22 THR 17 1HG2 THR 17 9.052 6.142 -2.328 117 HG23 THR 17 2HG2 THR 17 8.922 4.424 -2.018 118 H LYS 18 H LYS 18 12.009 5.460 -6.366 119 HA LYS 18 HA LYS 18 11.128 3.225 -7.899 120 HB3 LYS 18 2HB LYS 18 13.548 5.046 -8.288 121 HG3 LYS 18 2HG LYS 18 12.103 3.244 -10.270 122 HD3 LYS 18 2HD LYS 18 14.241 5.372 -10.669 123 HE3 LYS 18 2HE LYS 18 14.670 3.305 -12.014 124 HZ1 LYS 18 3HZ LYS 18 13.192 2.917 -13.875 125 HZ2 LYS 18 1HZ LYS 18 12.097 4.018 -13.336 126 HZ3 LYS 18 2HZ LYS 18 12.426 2.623 -12.497 127 H LYS 19 H LYS 19 14.235 3.744 -6.151 128 HA LYS 19 HA LYS 19 15.619 1.544 -6.994 129 HB3 LYS 19 2HB LYS 19 16.096 1.978 -4.170 130 HG3 LYS 19 2HG LYS 19 17.849 3.717 -5.240 131 HD3 LYS 19 2HD LYS 19 19.387 1.802 -5.819 132 HE3 LYS 19 2HE LYS 19 19.147 0.621 -3.534 133 HZ1 LYS 19 3HZ LYS 19 19.326 3.557 -3.781 134 HZ2 LYS 19 1HZ LYS 19 20.467 2.506 -3.311 135 HZ3 LYS 19 2HZ LYS 19 19.252 2.849 -2.293 136 H MET 20 H MET 20 13.737 1.654 -3.943 137 HA MET 20 HA MET 20 14.094 -0.993 -3.300 138 HB3 MET 20 2HB MET 20 11.489 0.266 -2.563 139 HG3 MET 20 2HG MET 20 11.967 -0.107 -0.316 140 HE1 MET 20 3HE MET 20 14.515 -3.096 -0.328 141 HE2 MET 20 1HE MET 20 14.143 -3.666 -1.982 142 HE3 MET 20 2HE MET 20 14.672 -1.995 -1.694 143 H ALA 21 H ALA 21 11.492 0.463 -5.245 144 HA ALA 21 HA ALA 21 9.819 -1.856 -5.412 145 HB1 ALA 21 1HB ALA 21 8.685 -0.617 -7.137 146 HB2 ALA 21 2HB ALA 21 9.066 0.444 -5.776 147 HB3 ALA 21 3HB ALA 21 10.042 0.537 -7.259 148 H GLU 22 H GLU 22 12.298 -0.498 -7.669 149 HA GLU 22 HA GLU 22 12.166 -2.530 -9.670 150 HB3 GLU 22 2HB GLU 22 14.472 -1.669 -10.270 151 HG3 GLU 22 2HG GLU 22 13.614 0.890 -10.251 152 H LYS 23 H LYS 23 13.967 -2.309 -6.612 153 HA LYS 23 HA LYS 23 15.606 -4.650 -6.967 154 HB3 LYS 23 2HB LYS 23 14.992 -4.635 -4.257 155 HG3 LYS 23 2HG LYS 23 17.258 -4.489 -5.507 156 HD3 LYS 23 2HD LYS 23 18.246 -2.296 -4.631 157 HE3 LYS 23 2HE LYS 23 17.452 -0.993 -6.761 158 HZ1 LYS 23 3HZ LYS 23 18.822 -3.570 -6.759 159 HZ2 LYS 23 1HZ LYS 23 19.399 -2.085 -7.148 160 HZ3 LYS 23 2HZ LYS 23 18.394 -2.901 -8.195 161 H ILE 24 H ILE 24 12.565 -4.390 -5.043 162 HA ILE 24 HA ILE 24 12.421 -7.166 -4.672 163 HB ILE 24 HB ILE 24 10.303 -5.000 -4.545 164 HG13 ILE 24 2HG1 ILE 24 12.215 -4.790 -2.964 165 HG21 ILE 24 1HG2 ILE 24 9.155 -7.196 -4.806 166 HG22 ILE 24 2HG2 ILE 24 10.107 -7.851 -3.464 167 HG23 ILE 24 3HG2 ILE 24 8.903 -6.582 -3.196 168 HD11 ILE 24 3HD1 ILE 24 11.228 -4.951 -0.747 169 HD12 ILE 24 1HD1 ILE 24 10.076 -4.218 -1.872 170 HD13 ILE 24 2HD1 ILE 24 9.886 -5.915 -1.345 171 H ASN 25 H ASN 25 11.043 -5.236 -7.344 172 HA ASN 25 HA ASN 25 9.503 -7.210 -8.640 173 HB3 ASN 25 2HB ASN 25 11.250 -4.979 -9.663 174 HD21 ASN 25 1HD2 ASN 25 8.460 -7.077 -10.799 175 HD22 ASN 25 2HD2 ASN 25 9.215 -7.406 -12.328 176 H SER 26 H SER 26 13.053 -6.686 -8.973 177 HA SER 26 HA SER 26 13.412 -8.727 -10.927 178 HB3 SER 26 2HB SER 26 15.341 -7.375 -8.983 179 HG SER 26 HG SER 26 16.359 -9.059 -9.926 180 H GLU 27 H GLU 27 13.240 -8.875 -7.430 181 HA GLU 27 HA GLU 27 14.833 -11.306 -7.163 182 HB3 GLU 27 2HB GLU 27 14.320 -11.046 -4.764 183 HG3 GLU 27 2HG GLU 27 14.689 -8.522 -4.410 184 H ILE 28 H ILE 28 11.715 -10.753 -8.161 185 HA ILE 28 HA ILE 28 10.589 -13.283 -6.988 186 HB ILE 28 HB ILE 28 9.216 -10.636 -7.605 187 HG13 ILE 28 2HG1 ILE 28 10.663 -10.582 -5.536 188 HG21 ILE 28 1HG2 ILE 28 8.088 -13.164 -6.336 189 HG22 ILE 28 2HG2 ILE 28 7.223 -11.640 -6.558 190 HG23 ILE 28 3HG2 ILE 28 7.707 -12.543 -7.961 191 HD11 ILE 28 3HD1 ILE 28 8.414 -9.397 -5.535 192 HD12 ILE 28 1HD1 ILE 28 7.796 -10.791 -4.603 193 HD13 ILE 28 2HD1 ILE 28 9.112 -9.814 -3.957 194 H LYS 29 H LYS 29 9.634 -14.727 -8.368 195 HA LYS 29 HA LYS 29 9.887 -14.346 -11.239 196 HB3 LYS 29 2HB LYS 29 8.085 -16.475 -10.618 197 HG3 LYS 29 2HG LYS 29 10.020 -16.406 -12.269 198 HD3 LYS 29 2HD LYS 29 11.537 -17.490 -9.853 199 HE3 LYS 29 2HE LYS 29 12.732 -16.667 -12.491 200 HZ1 LYS 29 3HZ LYS 29 14.001 -17.493 -10.486 201 HZ2 LYS 29 1HZ LYS 29 14.327 -18.225 -11.934 202 HZ3 LYS 29 2HZ LYS 29 13.401 -18.998 -10.822 203 H ASP 30 H ASP 30 8.232 -13.827 -12.650 204 HA ASP 30 HA ASP 30 6.177 -13.305 -13.446 205 HB3 ASP 30 2HB ASP 30 4.869 -14.758 -11.160 206 H SER 31 H SER 31 7.472 -11.588 -11.190 207 HA SER 31 HA SER 31 5.297 -10.195 -9.965 208 HB3 SER 31 2HB SER 31 7.485 -10.290 -8.939 209 HG SER 31 HG SER 31 9.350 -9.761 -10.051 210 H GLU 32 H GLU 32 4.999 -7.799 -10.428 211 HA GLU 32 HA GLU 32 5.887 -6.776 -13.002 212 HB3 GLU 32 2HB GLU 32 3.292 -5.824 -12.916 213 HG3 GLU 32 2HG GLU 32 4.739 -7.873 -14.485 214 H LEU 33 H LEU 33 5.771 -4.431 -13.008 215 HA LEU 33 HA LEU 33 5.713 -3.177 -10.361 216 HB3 LEU 33 2HB LEU 33 8.047 -3.797 -11.073 217 HG LEU 33 HG LEU 33 7.629 -1.695 -13.276 218 HD11 LEU 33 1HD1 LEU 33 10.216 -2.825 -12.163 219 HD12 LEU 33 2HD1 LEU 33 9.618 -1.148 -12.028 220 HD13 LEU 33 3HD1 LEU 33 10.042 -1.778 -13.588 221 HD21 LEU 33 3HD2 LEU 33 7.167 -3.930 -14.167 222 HD22 LEU 33 1HD2 LEU 33 8.650 -4.577 -13.422 223 HD23 LEU 33 2HD2 LEU 33 8.739 -3.397 -14.737 224 H LYS 34 H LYS 34 4.544 -1.318 -10.412 225 HA LYS 34 HA LYS 34 4.200 0.171 -12.961 226 HB3 LYS 34 2HB LYS 34 1.703 0.436 -11.930 227 HG3 LYS 34 2HG LYS 34 2.287 -0.404 -14.282 228 HD3 LYS 34 2HD LYS 34 2.509 -2.952 -12.812 229 HE3 LYS 34 2HE LYS 34 0.086 -3.009 -13.702 230 HZ1 LYS 34 3HZ LYS 34 -0.250 -3.353 -15.926 231 HZ2 LYS 34 1HZ LYS 34 1.287 -3.766 -16.272 232 HZ3 LYS 34 2HZ LYS 34 0.894 -2.191 -16.043 233 H GLU 35 H GLU 35 3.202 2.465 -12.270 234 HA GLU 35 HA GLU 35 4.177 3.186 -9.554 235 HB3 GLU 35 2HB GLU 35 5.724 3.989 -11.344 236 HG3 GLU 35 2HG GLU 35 3.312 5.433 -12.303 237 H VAL 36 H VAL 36 3.143 5.174 -8.625 238 HA VAL 36 HA VAL 36 0.358 5.499 -9.607 239 HB VAL 36 HB VAL 36 1.273 5.392 -6.710 240 HG11 VAL 36 1HG1 VAL 36 -1.501 5.487 -7.987 241 HG12 VAL 36 2HG1 VAL 36 -1.177 5.112 -6.303 242 HG13 VAL 36 3HG1 VAL 36 -0.762 6.697 -6.901 243 HG21 VAL 36 3HG2 VAL 36 -0.154 3.330 -8.437 244 HG22 VAL 36 1HG2 VAL 36 1.473 3.184 -7.713 245 HG23 VAL 36 2HG2 VAL 36 0.055 3.224 -6.677 246 H LYS 37 H LYS 37 -0.582 7.561 -9.096 247 HA LYS 37 HA LYS 37 1.094 9.914 -8.480 248 HB3 LYS 37 2HB LYS 37 0.175 10.931 -10.596 249 HG3 LYS 37 2HG LYS 37 1.283 9.417 -12.301 250 HD3 LYS 37 2HD LYS 37 3.618 9.466 -10.770 251 HE3 LYS 37 2HE LYS 37 4.151 11.567 -11.848 252 HZ1 LYS 37 3HZ LYS 37 3.919 10.901 -14.043 253 HZ2 LYS 37 1HZ LYS 37 2.456 10.187 -13.809 254 HZ3 LYS 37 2HZ LYS 37 3.818 9.463 -13.246 255 H VAL 38 H VAL 38 -0.892 11.872 -8.806 256 HA VAL 38 HA VAL 38 -3.314 10.735 -7.483 257 HB VAL 38 HB VAL 38 -3.601 13.027 -6.441 258 HG11 VAL 38 1HG1 VAL 38 -3.170 11.036 -5.144 259 HG12 VAL 38 2HG1 VAL 38 -1.430 11.144 -5.449 260 HG13 VAL 38 3HG1 VAL 38 -2.245 12.391 -4.478 261 HG21 VAL 38 3HG2 VAL 38 -0.585 13.195 -6.788 262 HG22 VAL 38 1HG2 VAL 38 -1.757 14.195 -7.667 263 HG23 VAL 38 2HG2 VAL 38 -1.636 14.324 -5.909 264 H SER 39 H SER 39 -5.283 11.490 -8.031 265 HA SER 39 HA SER 39 -5.808 12.354 -10.676 266 HB3 SER 39 2HB SER 39 -7.601 12.406 -8.208 267 HG SER 39 HG SER 39 -9.074 12.587 -9.618 268 H GLU 40 H GLU 40 -7.710 14.180 -10.529 269 HA GLU 40 HA GLU 40 -6.446 16.793 -10.106 270 HB3 GLU 40 2HB GLU 40 -9.236 17.075 -10.578 271 HG3 GLU 40 2HG GLU 40 -8.646 17.593 -12.903 272 H GLY 41 H GLY 41 -8.046 18.373 -8.978 273 HA2 GLY 41 1HA GLY 41 -9.975 18.596 -7.633 274 HA3 GLY 41 2HA GLY 41 -9.618 17.079 -6.815 275 H THR 42 H THR 42 -7.341 19.839 -7.351 276 HA THR 42 HA THR 42 -7.167 20.157 -4.404 277 HB THR 42 HB THR 42 -4.931 21.042 -6.197 278 HG1 THR 42 1HG THR 42 -4.070 18.850 -5.989 279 HG21 THR 42 3HG2 THR 42 -4.881 21.201 -3.679 280 HG22 THR 42 1HG2 THR 42 -3.575 20.188 -4.335 281 HG23 THR 42 2HG2 THR 42 -5.028 19.424 -3.627 282 H PHE 43 H PHE 43 -6.541 22.404 -3.683 283 HA PHE 43 HA PHE 43 -7.831 24.598 -5.108 284 HB3 PHE 43 2HB PHE 43 -6.605 25.999 -3.466 285 HD1 PHE 43 2HD PHE 43 -9.438 24.928 -3.561 286 HD2 PHE 43 1HD PHE 43 -6.276 24.397 -0.670 287 HE1 PHE 43 2HE PHE 43 -11.118 24.565 -1.780 288 HE2 PHE 43 1HE PHE 43 -7.965 24.050 1.115 289 HZ PHE 43 HZ PHE 43 -10.392 24.131 0.561 290 H ASP 44 H ASP 44 -6.566 26.412 -5.944 291 HA ASP 44 HA ASP 44 -5.202 25.766 -8.202 292 HB3 ASP 44 2HB ASP 44 -4.781 28.069 -8.535 293 H ALA 45 H ALA 45 -3.165 24.928 -8.615 294 HA ALA 45 HA ALA 45 -0.886 25.745 -6.932 295 HB1 ALA 45 1HB ALA 45 -1.835 22.860 -7.282 296 HB2 ALA 45 2HB ALA 45 -0.333 23.375 -6.485 297 HB3 ALA 45 3HB ALA 45 -1.910 23.815 -5.784 298 H ASP 46 H ASP 46 1.108 25.381 -7.791 299 HA ASP 46 HA ASP 46 1.537 24.696 -10.583 300 HB3 ASP 46 2HB ASP 46 3.993 24.775 -9.752 301 H MET 47 H MET 47 0.258 22.545 -10.007 302 HA MET 47 HA MET 47 0.247 20.281 -9.901 303 HB3 MET 47 2HB MET 47 2.355 19.075 -10.639 304 HG3 MET 47 2HG MET 47 1.186 21.270 -12.354 305 HE1 MET 47 3HE MET 47 2.591 19.487 -15.812 306 HE2 MET 47 1HE MET 47 1.374 18.726 -14.768 307 HE3 MET 47 2HE MET 47 1.235 20.445 -15.187 308 H TYR 48 H TYR 48 3.552 20.568 -8.614 309 HA TYR 48 HA TYR 48 3.137 18.413 -6.748 310 HB3 TYR 48 2HB TYR 48 5.517 19.077 -6.109 311 HD1 TYR 48 2HD TYR 48 4.970 16.651 -6.798 312 HD2 TYR 48 1HD TYR 48 5.981 19.756 -9.608 313 HE1 TYR 48 2HE TYR 48 5.445 14.933 -8.541 314 HE2 TYR 48 1HE TYR 48 6.478 18.047 -11.329 315 HH TYR 48 HH TYR 48 6.360 15.750 -11.873 316 H LYS 49 H LYS 49 1.511 19.003 -5.318 317 HA LYS 49 HA LYS 49 2.203 21.103 -3.326 318 HB3 LYS 49 2HB LYS 49 -0.585 20.849 -4.476 319 HG3 LYS 49 2HG LYS 49 -0.038 22.429 -2.537 320 HD3 LYS 49 2HD LYS 49 1.230 24.071 -4.769 321 HE3 LYS 49 2HE LYS 49 -0.073 25.330 -3.014 322 HZ1 LYS 49 3HZ LYS 49 1.110 25.484 -0.835 323 HZ2 LYS 49 1HZ LYS 49 2.034 24.217 -1.250 324 HZ3 LYS 49 2HZ LYS 49 0.440 23.996 -1.052 325 H THR 50 H THR 50 1.419 17.935 -3.776 326 HA THR 50 HA THR 50 0.202 17.647 -1.073 327 HB THR 50 HB THR 50 -0.692 16.624 -3.774 328 HG1 THR 50 1HG THR 50 -1.917 18.043 -1.650 329 HG21 THR 50 3HG2 THR 50 -1.669 15.600 -1.077 330 HG22 THR 50 1HG2 THR 50 -0.909 14.661 -2.388 331 HG23 THR 50 2HG2 THR 50 -2.510 15.368 -2.625 332 H SER 51 H SER 51 2.285 16.151 -3.690 333 HA SER 51 HA SER 51 3.022 13.972 -1.917 334 HB3 SER 51 2HB SER 51 3.535 13.279 -4.006 335 HG SER 51 HG SER 51 4.391 14.742 -5.613 336 H ASP 52 H ASP 52 5.120 13.847 -0.984 337 HA ASP 52 HA ASP 52 7.101 14.391 -0.151 338 HB3 ASP 52 2HB ASP 52 8.505 15.975 -1.214 339 H ILE 53 H ILE 53 4.480 16.010 0.767 340 HA ILE 53 HA ILE 53 5.843 17.898 2.622 341 HB ILE 53 HB ILE 53 2.900 17.585 1.943 342 HG13 ILE 53 2HG1 ILE 53 4.679 18.569 0.097 343 HG21 ILE 53 1HG2 ILE 53 3.021 18.763 4.036 344 HG22 ILE 53 2HG2 ILE 53 4.407 19.750 3.503 345 HG23 ILE 53 3HG2 ILE 53 2.778 19.974 2.847 346 HD11 ILE 53 3HD1 ILE 53 2.285 18.343 -0.251 347 HD12 ILE 53 1HD1 ILE 53 1.964 19.775 0.739 348 HD13 ILE 53 2HD1 ILE 53 2.845 19.935 -0.782 349 H ALA 54 H ALA 54 4.269 17.842 4.823 350 HA ALA 54 HA ALA 54 3.414 15.225 5.587 351 HB1 ALA 54 1HB ALA 54 5.781 15.176 6.422 352 HB2 ALA 54 2HB ALA 54 5.502 16.702 7.274 353 HB3 ALA 54 3HB ALA 54 4.628 15.244 7.765 354 H LEU 55 H LEU 55 2.079 15.514 7.720 355 HA LEU 55 HA LEU 55 0.498 16.485 8.932 356 HB3 LEU 55 2HB LEU 55 0.977 18.474 9.923 357 HG LEU 55 HG LEU 55 3.701 17.253 9.929 358 HD11 LEU 55 1HD1 LEU 55 1.629 17.988 12.023 359 HD12 LEU 55 2HD1 LEU 55 2.937 19.067 11.483 360 HD13 LEU 55 3HD1 LEU 55 3.336 17.581 12.373 361 HD21 LEU 55 3HD2 LEU 55 1.236 15.791 10.990 362 HD22 LEU 55 1HD2 LEU 55 2.890 15.441 11.483 363 HD23 LEU 55 2HD2 LEU 55 2.410 15.174 9.808 364 H ASP 56 H ASP 56 0.474 17.037 5.768 365 HA ASP 56 HA ASP 56 -1.090 19.508 5.672 366 HB3 ASP 56 2HB ASP 56 -0.264 17.657 3.412 367 H GLN 57 H GLN 57 -1.667 16.097 5.654 368 HA GLN 57 HA GLN 57 -4.489 16.443 4.792 369 HB3 GLN 57 2HB GLN 57 -3.105 15.739 2.928 370 HG3 GLN 57 2HG GLN 57 -2.733 12.965 3.961 371 HE21 GLN 57 1HE2 GLN 57 -2.666 12.461 1.622 372 HE22 GLN 57 2HE2 GLN 57 -1.336 13.097 0.628 373 H ILE 58 H ILE 58 -3.497 16.201 7.520 374 HA ILE 58 HA ILE 58 -4.297 13.439 8.337 375 HB ILE 58 HB ILE 58 -2.597 15.532 9.719 376 HG13 ILE 58 2HG1 ILE 58 -1.640 12.781 8.772 377 HG21 ILE 58 1HG2 ILE 58 -3.858 14.196 11.405 378 HG22 ILE 58 2HG2 ILE 58 -3.277 12.701 10.648 379 HG23 ILE 58 3HG2 ILE 58 -2.146 13.795 11.467 380 HD11 ILE 58 3HD1 ILE 58 -1.192 15.532 7.613 381 HD12 ILE 58 1HD1 ILE 58 0.064 14.289 7.505 382 HD13 ILE 58 2HD1 ILE 58 -1.522 13.990 6.780 383 H GLN 59 H GLN 59 -4.235 16.733 9.787 384 HA GLN 59 HA GLN 59 -6.528 16.065 11.517 385 HB3 GLN 59 2HB GLN 59 -6.089 18.469 12.294 386 HG3 GLN 59 2HG GLN 59 -3.793 16.488 12.499 387 HE21 GLN 59 1HE2 GLN 59 -1.995 17.290 13.524 388 HE22 GLN 59 2HE2 GLN 59 -1.895 18.836 14.325 389 H GLY 60 H GLY 60 -8.601 16.444 10.787 390 HA2 GLY 60 1HA GLY 60 -10.372 17.708 10.073 391 HA3 GLY 60 2HA GLY 60 -9.282 19.050 9.738 392 H ASN 61 H ASN 61 -7.587 17.261 7.897 393 HA ASN 61 HA ASN 61 -8.991 17.611 5.396 394 HB3 ASN 61 2HB ASN 61 -6.635 15.834 6.168 395 HD21 ASN 61 1HD2 ASN 61 -7.815 14.255 4.631 396 HD22 ASN 61 2HD2 ASN 61 -7.835 14.615 2.912 397 H LYS 62 H LYS 62 -11.018 16.540 5.275 398 HA LYS 62 HA LYS 62 -11.196 14.012 6.766 399 HB3 LYS 62 2HB LYS 62 -13.606 15.386 5.628 400 HG3 LYS 62 2HG LYS 62 -13.017 13.430 7.735 401 HD3 LYS 62 2HD LYS 62 -14.683 14.409 9.334 402 HE3 LYS 62 2HE LYS 62 -12.026 15.878 8.937 403 HZ1 LYS 62 3HZ LYS 62 -12.261 16.093 11.426 404 HZ2 LYS 62 1HZ LYS 62 -13.840 15.696 11.239 405 HZ3 LYS 62 2HZ LYS 62 -13.290 17.055 10.556 406 H ASP 63 H ASP 63 -10.832 14.753 3.453 407 HA ASP 63 HA ASP 63 -11.319 11.934 3.066 408 HB3 ASP 63 2HB ASP 63 -11.990 12.742 0.568 409 H PHE 64 H PHE 64 -9.718 11.021 1.852 410 HA PHE 64 HA PHE 64 -7.376 12.744 1.456 411 HB3 PHE 64 2HB PHE 64 -6.207 10.613 1.233 412 HD1 PHE 64 1HD PHE 64 -6.466 12.392 3.546 413 HD2 PHE 64 2HD PHE 64 -8.138 8.455 2.956 414 HE1 PHE 64 1HE PHE 64 -6.624 12.087 5.986 415 HE2 PHE 64 2HE PHE 64 -8.217 8.127 5.386 416 HZ PHE 64 HZ PHE 64 -7.451 9.938 6.935 417 HA PRO 65 HA PRO 65 -7.903 13.275 -2.787 418 HB3 PRO 65 2HB PRO 65 -6.093 14.709 -2.710 419 HG3 PRO 65 2HG PRO 65 -4.109 14.132 -1.490 420 HD3 PRO 65 2HD PRO 65 -5.963 13.995 -0.015 421 H GLU 66 H GLU 66 -8.414 12.057 -4.532 422 HA GLU 66 HA GLU 66 -7.864 9.292 -4.606 423 HB3 GLU 66 2HB GLU 66 -8.954 9.384 -6.847 424 HG3 GLU 66 2HG GLU 66 -10.190 9.675 -4.435 425 H ILE 67 H ILE 67 -6.946 8.075 -6.403 426 HA ILE 67 HA ILE 67 -4.175 9.013 -6.790 427 HB ILE 67 HB ILE 67 -3.747 6.587 -7.217 428 HG13 ILE 67 2HG1 ILE 67 -6.169 6.070 -7.913 429 HG21 ILE 67 1HG2 ILE 67 -3.969 5.971 -4.816 430 HG22 ILE 67 2HG2 ILE 67 -3.381 7.619 -5.035 431 HG23 ILE 67 3HG2 ILE 67 -5.064 7.339 -4.570 432 HD11 ILE 67 3HD1 ILE 67 -5.084 4.234 -5.745 433 HD12 ILE 67 1HD1 ILE 67 -6.163 3.806 -7.082 434 HD13 ILE 67 2HD1 ILE 67 -4.482 4.265 -7.422 435 H GLN 68 H GLN 68 -3.094 8.156 -8.842 436 HA GLN 68 HA GLN 68 -4.910 7.395 -11.001 437 HB3 GLN 68 2HB GLN 68 -3.275 8.476 -12.661 438 HG3 GLN 68 2HG GLN 68 -4.300 10.674 -12.640 439 HE21 GLN 68 1HE2 GLN 68 -6.880 9.322 -10.826 440 HE22 GLN 68 2HE2 GLN 68 -7.826 8.733 -12.163 441 H LEU 69 H LEU 69 -3.992 5.923 -12.309 442 HA LEU 69 HA LEU 69 -1.336 5.068 -12.265 443 HB3 LEU 69 2HB LEU 69 -2.015 4.108 -10.010 444 HG LEU 69 HG LEU 69 -3.188 1.815 -11.612 445 HD11 LEU 69 1HD1 LEU 69 -3.017 2.374 -8.629 446 HD12 LEU 69 2HD1 LEU 69 -1.889 1.362 -9.560 447 HD13 LEU 69 3HD1 LEU 69 -3.588 0.882 -9.412 448 HD21 LEU 69 3HD2 LEU 69 -4.961 3.494 -11.623 449 HD22 LEU 69 1HD2 LEU 69 -4.727 3.801 -9.875 450 HD23 LEU 69 2HD2 LEU 69 -5.332 2.219 -10.457 451 H ASP 70 H ASP 70 -1.395 2.625 -13.256 452 HA ASP 70 HA ASP 70 -2.534 2.973 -15.883 453 HB3 ASP 70 2HB ASP 70 -1.485 0.344 -15.005 454 H ASN 71 H ASN 71 -3.622 0.820 -16.810 455 HA ASN 71 HA ASN 71 -6.103 0.496 -15.204 456 HB3 ASN 71 2HB ASN 71 -5.633 -0.854 -17.852 457 HD21 ASN 71 1HD2 ASN 71 -7.123 -2.448 -16.503 458 HD22 ASN 71 2HD2 ASN 71 -8.800 -2.013 -16.376 459 H ILE 72 H ILE 72 -5.245 -0.586 -13.530 460 HA ILE 72 HA ILE 72 -4.134 -3.342 -13.953 461 HB ILE 72 HB ILE 72 -4.078 -1.750 -11.347 462 HG13 ILE 72 2HG1 ILE 72 -2.859 -0.447 -13.046 463 HG21 ILE 72 1HG2 ILE 72 -2.289 -3.342 -10.726 464 HG22 ILE 72 2HG2 ILE 72 -3.758 -4.196 -11.137 465 HG23 ILE 72 3HG2 ILE 72 -2.428 -4.134 -12.316 466 HD11 ILE 72 3HD1 ILE 72 -0.707 -1.835 -11.458 467 HD12 ILE 72 1HD1 ILE 72 -0.816 -0.141 -11.988 468 HD13 ILE 72 2HD1 ILE 72 -1.889 -0.731 -10.707 469 H ASP 73 H ASP 73 -5.097 -5.061 -13.417 470 HA ASP 73 HA ASP 73 -7.576 -5.076 -11.761 471 HB3 ASP 73 2HB ASP 73 -6.327 -7.239 -13.521 472 H TYR 74 H TYR 74 -7.132 -5.707 -9.653 473 HA TYR 74 HA TYR 74 -4.439 -6.632 -8.947 474 HB3 TYR 74 2HB TYR 74 -5.213 -6.470 -6.666 475 HD1 TYR 74 1HD TYR 74 -3.602 -4.574 -7.592 476 HD2 TYR 74 2HD TYR 74 -7.901 -4.263 -7.467 477 HE1 TYR 74 1HE TYR 74 -3.442 -2.101 -7.903 478 HE2 TYR 74 2HE TYR 74 -7.752 -1.842 -7.819 479 HH TYR 74 HH TYR 74 -5.945 -0.288 -9.024 480 H ASN 75 H ASN 75 -7.668 -7.940 -9.408 481 HA ASN 75 HA ASN 75 -7.675 -10.249 -7.850 482 HB3 ASN 75 2HB ASN 75 -8.884 -10.517 -10.572 483 HD21 ASN 75 1HD2 ASN 75 -11.306 -9.313 -8.934 484 HD22 ASN 75 2HD2 ASN 75 -11.928 -10.738 -8.110 485 H ASN 76 H ASN 76 -6.448 -9.841 -11.138 486 HA ASN 76 HA ASN 76 -5.830 -12.569 -11.493 487 HB3 ASN 76 2HB ASN 76 -6.218 -10.997 -13.336 488 HD21 ASN 76 1HD2 ASN 76 -5.152 -9.628 -15.086 489 HD22 ASN 76 2HD2 ASN 76 -4.103 -8.364 -14.461 490 H TYR 77 H TYR 77 -4.194 -10.627 -9.268 491 HA TYR 77 HA TYR 77 -1.611 -12.050 -9.769 492 HB3 TYR 77 2HB TYR 77 -0.621 -10.480 -8.128 493 HD1 TYR 77 1HD TYR 77 0.531 -10.456 -10.458 494 HD2 TYR 77 2HD TYR 77 -2.791 -7.929 -9.425 495 HE1 TYR 77 1HE TYR 77 1.015 -9.066 -12.412 496 HE2 TYR 77 2HE TYR 77 -2.245 -6.443 -11.310 497 HH TYR 77 HH TYR 77 0.349 -7.265 -13.681 498 H ASP 78 H ASP 78 -0.488 -13.012 -7.808 499 HA ASP 78 HA ASP 78 -2.507 -14.213 -5.958 500 HB3 ASP 78 2HB ASP 78 0.321 -15.187 -6.086 501 H LEU 79 H LEU 79 0.109 -11.923 -6.079 502 HA LEU 79 HA LEU 79 0.286 -11.696 -3.129 503 HB3 LEU 79 2HB LEU 79 2.651 -11.753 -5.038 504 HG LEU 79 HG LEU 79 4.066 -12.213 -3.288 505 HD11 LEU 79 1HD1 LEU 79 1.878 -10.819 -1.750 506 HD12 LEU 79 2HD1 LEU 79 3.106 -9.982 -2.765 507 HD13 LEU 79 3HD1 LEU 79 3.582 -10.853 -1.310 508 HD21 LEU 79 3HD2 LEU 79 2.967 -14.232 -2.529 509 HD22 LEU 79 1HD2 LEU 79 1.700 -13.293 -1.723 510 HD23 LEU 79 2HD2 LEU 79 3.385 -13.209 -1.127 511 H ILE 80 H ILE 80 0.442 -9.422 -2.535 512 HA ILE 80 HA ILE 80 1.195 -7.512 -4.691 513 HB ILE 80 HB ILE 80 -1.292 -7.489 -2.955 514 HG13 ILE 80 2HG1 ILE 80 -1.493 -8.663 -5.040 515 HG21 ILE 80 1HG2 ILE 80 -1.758 -5.214 -3.681 516 HG22 ILE 80 2HG2 ILE 80 -0.277 -5.227 -2.765 517 HG23 ILE 80 3HG2 ILE 80 -0.199 -5.133 -4.542 518 HD11 ILE 80 3HD1 ILE 80 -3.091 -7.483 -6.370 519 HD12 ILE 80 1HD1 ILE 80 -3.405 -7.080 -4.670 520 HD13 ILE 80 2HD1 ILE 80 -2.583 -5.914 -5.736 521 H LEU 81 H LEU 81 2.482 -5.901 -4.168 522 HA LEU 81 HA LEU 81 3.132 -5.245 -1.352 523 HB3 LEU 81 2HB LEU 81 5.176 -4.217 -2.743 524 HG LEU 81 HG LEU 81 6.519 -6.234 -2.721 525 HD11 LEU 81 1HD1 LEU 81 6.433 -6.593 -0.271 526 HD12 LEU 81 2HD1 LEU 81 4.871 -5.758 -0.207 527 HD13 LEU 81 3HD1 LEU 81 6.338 -4.887 -0.712 528 HD21 LEU 81 3HD2 LEU 81 4.129 -7.779 -1.667 529 HD22 LEU 81 1HD2 LEU 81 5.780 -8.362 -1.918 530 HD23 LEU 81 2HD2 LEU 81 4.795 -7.919 -3.313 531 H ILE 82 H ILE 82 3.057 -3.053 -0.829 532 HA ILE 82 HA ILE 82 2.551 -1.057 -2.964 533 HB ILE 82 HB ILE 82 1.022 -0.894 -0.347 534 HG13 ILE 82 2HG1 ILE 82 0.338 -3.114 -1.188 535 HG21 ILE 82 1HG2 ILE 82 1.230 1.036 -1.925 536 HG22 ILE 82 2HG2 ILE 82 0.459 0.044 -3.185 537 HG23 ILE 82 3HG2 ILE 82 -0.442 0.525 -1.733 538 HD11 ILE 82 3HD1 ILE 82 -1.397 -1.654 -0.121 539 HD12 ILE 82 1HD1 ILE 82 -1.918 -1.165 -1.756 540 HD13 ILE 82 2HD1 ILE 82 -2.020 -2.859 -1.262 541 H GLY 83 H GLY 83 3.606 1.075 -2.392 542 HA2 GLY 83 1HA GLY 83 4.570 1.277 0.406 543 HA3 GLY 83 2HA GLY 83 5.805 1.154 -0.846 544 H SER 84 H SER 84 5.665 3.148 1.010 545 HA SER 84 HA SER 84 5.260 5.652 -0.447 546 HB3 SER 84 2HB SER 84 3.053 5.326 0.133 547 HG SER 84 HG SER 84 3.677 4.245 2.696 548 HA PRO 85 HA PRO 85 8.183 6.982 2.714 549 HB3 PRO 85 2HB PRO 85 8.365 8.921 1.432 550 HG3 PRO 85 2HG PRO 85 6.415 10.053 0.601 551 HD3 PRO 85 2HD PRO 85 6.330 7.855 -0.221 552 H VAL 86 H VAL 86 8.416 8.100 4.874 553 HA VAL 86 HA VAL 86 6.059 8.714 6.393 554 HB VAL 86 HB VAL 86 5.903 6.384 6.616 555 HG11 VAL 86 1HG1 VAL 86 7.499 4.978 7.840 556 HG12 VAL 86 2HG1 VAL 86 8.052 5.487 6.255 557 HG13 VAL 86 3HG1 VAL 86 8.698 6.288 7.711 558 HG21 VAL 86 3HG2 VAL 86 5.389 7.871 8.558 559 HG22 VAL 86 1HG2 VAL 86 5.865 6.230 9.062 560 HG23 VAL 86 2HG2 VAL 86 7.018 7.558 9.197 561 H TRP 87 H TRP 87 6.625 10.531 7.567 562 HA TRP 87 HA TRP 87 9.099 10.366 9.184 563 HB3 TRP 87 2HB TRP 87 8.575 12.417 7.045 564 HD1 TRP 87 HD TRP 87 11.375 11.523 9.596 565 HE1 TRP 87 1HE TRP 87 12.690 13.639 10.223 566 HE3 TRP 87 3HE TRP 87 9.005 14.876 6.559 567 HZ2 TRP 87 2HZ TRP 87 12.612 16.453 9.602 568 HZ3 TRP 87 3HZ TRP 87 9.741 17.260 6.510 569 HH2 TRP 87 HH TRP 87 11.496 18.049 8.078 570 H SER 88 H SER 88 5.858 11.296 8.989 571 HA SER 88 HA SER 88 6.122 12.257 11.760 572 HB3 SER 88 2HB SER 88 4.773 14.174 11.488 573 HG SER 88 HG SER 88 6.983 14.330 10.611 574 H GLY 89 H GLY 89 5.528 9.739 11.074 575 HA2 GLY 89 1HA GLY 89 3.986 8.096 11.669 576 HA3 GLY 89 2HA GLY 89 2.767 9.335 11.957 577 H TYR 90 H TYR 90 2.203 10.596 9.854 578 HA TYR 90 HA TYR 90 1.977 8.920 7.438 579 HB3 TYR 90 2HB TYR 90 -0.027 8.251 8.083 580 HD1 TYR 90 1HD TYR 90 0.254 11.573 9.934 581 HD2 TYR 90 2HD TYR 90 -1.694 7.726 9.609 582 HE1 TYR 90 1HE TYR 90 -0.665 11.837 12.201 583 HE2 TYR 90 2HE TYR 90 -2.614 7.980 11.866 584 HH TYR 90 HH TYR 90 -2.498 9.208 13.839 585 HA PRO 91 HA PRO 91 2.842 13.332 6.523 586 HB3 PRO 91 2HB PRO 91 5.149 12.873 6.493 587 HG3 PRO 91 2HG PRO 91 5.984 10.793 5.648 588 HD3 PRO 91 2HD PRO 91 4.585 10.381 7.557 589 H ALA 92 H ALA 92 1.507 10.598 4.900 590 HA ALA 92 HA ALA 92 0.648 12.174 2.593 591 HB1 ALA 92 1HB ALA 92 2.925 10.952 2.153 592 HB2 ALA 92 2HB ALA 92 1.978 9.443 2.222 593 HB3 ALA 92 3HB ALA 92 1.633 10.704 1.007 594 H THR 93 H THR 93 -1.041 10.730 1.360 595 HA THR 93 HA THR 93 -1.936 8.379 2.834 596 HB THR 93 HB THR 93 -4.378 9.037 2.247 597 HG1 THR 93 1HG THR 93 -4.697 11.272 2.527 598 HG21 THR 93 3HG2 THR 93 -2.920 10.328 4.580 599 HG22 THR 93 1HG2 THR 93 -3.592 8.682 4.489 600 HG23 THR 93 2HG2 THR 93 -4.657 10.073 4.460 601 HA PRO 94 HA PRO 94 -1.886 7.541 -1.731 602 HB3 PRO 94 2HB PRO 94 0.356 8.234 -2.089 603 HG3 PRO 94 2HG PRO 94 2.043 7.896 -0.380 604 HD3 PRO 94 2HD PRO 94 0.334 9.286 0.394 605 H ILE 95 H ILE 95 -1.631 5.921 1.273 606 HA ILE 95 HA ILE 95 -2.564 3.450 -0.133 607 HB ILE 95 HB ILE 95 -1.375 3.221 2.565 608 HG13 ILE 95 2HG1 ILE 95 0.874 2.771 1.853 609 HG21 ILE 95 1HG2 ILE 95 -2.470 1.316 1.577 610 HG22 ILE 95 2HG2 ILE 95 -1.460 1.420 0.123 611 HG23 ILE 95 3HG2 ILE 95 -0.727 0.981 1.673 612 HD11 ILE 95 3HD1 ILE 95 0.928 4.436 -0.559 613 HD12 ILE 95 1HD1 ILE 95 1.774 2.937 -0.204 614 HD13 ILE 95 2HD1 ILE 95 0.121 2.875 -0.839 615 H LYS 96 H LYS 96 -4.357 4.843 -0.072 616 HA LYS 96 HA LYS 96 -6.153 3.910 2.021 617 HB3 LYS 96 2HB LYS 96 -6.990 6.637 1.447 618 HG3 LYS 96 2HG LYS 96 -6.577 6.810 3.969 619 HD3 LYS 96 2HD LYS 96 -8.225 4.453 2.930 620 HE3 LYS 96 2HE LYS 96 -8.263 5.879 5.631 621 HZ1 LYS 96 3HZ LYS 96 -10.445 5.226 5.031 622 HZ2 LYS 96 1HZ LYS 96 -9.873 4.087 6.103 623 HZ3 LYS 96 2HZ LYS 96 -9.972 3.746 4.500 624 H THR 97 H THR 97 -6.168 5.985 -0.996 625 HA THR 97 HA THR 97 -8.800 5.039 -1.588 626 HB THR 97 HB THR 97 -6.706 6.473 -3.268 627 HG1 THR 97 1HG THR 97 -7.201 7.900 -1.698 628 HG21 THR 97 3HG2 THR 97 -8.667 7.346 -4.545 629 HG22 THR 97 1HG2 THR 97 -9.724 6.270 -3.625 630 HG23 THR 97 2HG2 THR 97 -8.494 5.607 -4.736 631 H LEU 98 H LEU 98 -5.675 3.712 -2.506 632 HA LEU 98 HA LEU 98 -6.471 2.015 -4.649 633 HB3 LEU 98 2HB LEU 98 -4.240 1.623 -2.548 634 HG LEU 98 HG LEU 98 -2.860 0.756 -4.264 635 HD11 LEU 98 1HD1 LEU 98 -3.862 -1.200 -5.186 636 HD12 LEU 98 2HD1 LEU 98 -5.482 -0.576 -5.002 637 HD13 LEU 98 3HD1 LEU 98 -4.508 -0.975 -3.555 638 HD21 LEU 98 3HD2 LEU 98 -3.423 2.359 -6.007 639 HD22 LEU 98 1HD2 LEU 98 -4.977 1.534 -6.306 640 HD23 LEU 98 2HD2 LEU 98 -3.454 0.714 -6.658 641 H LEU 99 H LEU 99 -6.301 1.467 -1.066 642 HA LEU 99 HA LEU 99 -6.910 -1.237 -0.993 643 HB3 LEU 99 2HB LEU 99 -7.998 -0.565 1.226 644 HG LEU 99 HG LEU 99 -5.999 -0.812 2.127 645 HD11 LEU 99 1HD1 LEU 99 -4.959 -1.544 0.080 646 HD12 LEU 99 2HD1 LEU 99 -3.857 -0.641 1.114 647 HD13 LEU 99 3HD1 LEU 99 -4.528 0.153 -0.336 648 HD21 LEU 99 3HD2 LEU 99 -6.299 1.650 2.576 649 HD22 LEU 99 1HD2 LEU 99 -5.181 1.944 1.266 650 HD23 LEU 99 2HD2 LEU 99 -4.660 1.063 2.706 651 H ASP 100 H ASP 100 -9.173 1.535 -1.159 652 HA ASP 100 HA ASP 100 -11.586 0.088 -1.057 653 HB3 ASP 100 2HB ASP 100 -10.949 2.572 -2.676 654 H GLN 101 H GLN 101 -9.424 0.598 -3.837 655 HA GLN 101 HA GLN 101 -11.290 -0.442 -5.798 656 HB3 GLN 101 2HB GLN 101 -9.377 -0.284 -7.333 657 HG3 GLN 101 2HG GLN 101 -9.364 2.063 -5.433 658 HE21 GLN 101 1HE2 GLN 101 -9.510 4.146 -6.496 659 HE22 GLN 101 2HE2 GLN 101 -8.744 4.450 -8.021 660 H MET 102 H MET 102 -8.753 -1.804 -3.758 661 HA MET 102 HA MET 102 -8.502 -4.344 -5.029 662 HB3 MET 102 2HB MET 102 -7.403 -4.993 -2.868 663 HG3 MET 102 2HG MET 102 -5.960 -2.653 -2.825 664 HE1 MET 102 3HE MET 102 -5.404 -5.652 -2.106 665 HE2 MET 102 1HE MET 102 -3.760 -5.869 -2.726 666 HE3 MET 102 2HE MET 102 -4.196 -4.358 -1.893 667 H LYS 103 H LYS 103 -11.341 -3.337 -3.754 668 HA LYS 103 HA LYS 103 -12.141 -5.207 -1.846 669 HB3 LYS 103 2HB LYS 103 -14.537 -4.424 -2.964 670 HG3 LYS 103 2HG LYS 103 -14.072 -2.144 -1.897 671 HD3 LYS 103 2HD LYS 103 -13.870 -4.839 -0.511 672 HE3 LYS 103 2HE LYS 103 -12.614 -3.074 0.832 673 HZ1 LYS 103 3HZ LYS 103 -15.376 -2.042 1.149 674 HZ2 LYS 103 1HZ LYS 103 -14.018 -1.183 0.748 675 HZ3 LYS 103 2HZ LYS 103 -14.149 -1.805 2.230 676 H ASN 104 H ASN 104 -11.153 -6.390 -4.619 677 HA ASN 104 HA ASN 104 -12.901 -8.710 -4.579 678 HB3 ASN 104 2HB ASN 104 -13.844 -7.490 -6.379 679 HD21 ASN 104 1HD2 ASN 104 -12.720 -5.258 -6.106 680 HD22 ASN 104 2HD2 ASN 104 -11.555 -4.704 -7.266 681 H TYR 105 H TYR 105 -9.799 -7.403 -4.310 682 HA TYR 105 HA TYR 105 -8.203 -9.262 -5.777 683 HB3 TYR 105 2HB TYR 105 -7.722 -7.616 -3.248 684 HD1 TYR 105 1HD TYR 105 -5.964 -9.227 -6.156 685 HD2 TYR 105 2HD TYR 105 -5.833 -8.226 -1.958 686 HE1 TYR 105 1HE TYR 105 -3.818 -10.369 -5.981 687 HE2 TYR 105 2HE TYR 105 -3.638 -9.351 -1.783 688 HH TYR 105 HH TYR 105 -2.058 -10.923 -4.582 689 H ARG 106 H ARG 106 -7.173 -11.157 -4.941 690 HA ARG 106 HA ARG 106 -8.545 -12.471 -2.645 691 HB3 ARG 106 2HB ARG 106 -8.673 -14.464 -4.361 692 HG3 ARG 106 2HG ARG 106 -10.620 -12.717 -5.496 693 HD3 ARG 106 2HD ARG 106 -12.104 -13.812 -3.715 694 HE ARG 106 HE ARG 106 -11.734 -14.818 -5.914 695 HH11 ARG 106 1HH1 ARG 106 -9.992 -16.457 -3.252 696 HH12 ARG 106 2HH1 ARG 106 -10.219 -18.035 -3.863 697 HH21 ARG 106 1HH2 ARG 106 -12.032 -16.912 -6.767 698 HH22 ARG 106 2HH2 ARG 106 -11.238 -18.280 -6.058 699 H GLY 107 H GLY 107 -5.720 -11.408 -2.946 700 HA2 GLY 107 1HA GLY 107 -4.326 -13.951 -2.296 701 HA3 GLY 107 2HA GLY 107 -3.561 -12.748 -3.321 702 H GLU 108 H GLU 108 -1.916 -11.995 -1.874 703 HA GLU 108 HA GLU 108 -2.725 -11.501 0.953 704 HB3 GLU 108 2HB GLU 108 -0.209 -11.919 1.280 705 HG3 GLU 108 2HG GLU 108 -0.254 -14.303 1.240 706 H VAL 109 H VAL 109 -1.978 -9.638 1.827 707 HA VAL 109 HA VAL 109 -0.690 -7.704 -0.079 708 HB VAL 109 HB VAL 109 -2.415 -6.808 2.189 709 HG11 VAL 109 1HG1 VAL 109 -1.474 -5.532 -0.417 710 HG12 VAL 109 2HG1 VAL 109 -2.622 -4.781 0.686 711 HG13 VAL 109 3HG1 VAL 109 -0.976 -5.087 1.221 712 HG21 VAL 109 3HG2 VAL 109 -3.921 -8.177 0.771 713 HG22 VAL 109 1HG2 VAL 109 -4.271 -6.464 0.522 714 HG23 VAL 109 2HG2 VAL 109 -3.302 -7.354 -0.697 715 H ALA 110 H ALA 110 1.046 -6.652 0.455 716 HA ALA 110 HA ALA 110 2.146 -6.629 3.194 717 HB1 ALA 110 1HB ALA 110 3.508 -7.505 0.597 718 HB2 ALA 110 2HB ALA 110 4.389 -7.137 2.086 719 HB3 ALA 110 3HB ALA 110 3.257 -8.490 2.039 720 H SER 111 H SER 111 3.787 -4.877 3.283 721 HA SER 111 HA SER 111 3.714 -2.986 1.066 722 HB3 SER 111 2HB SER 111 2.732 -2.308 3.863 723 HG SER 111 HG SER 111 3.270 -0.702 1.585 724 H PHE 112 H PHE 112 5.457 -1.543 1.018 725 HA PHE 112 HA PHE 112 7.684 -2.151 2.869 726 HB3 PHE 112 2HB PHE 112 7.965 -3.408 0.797 727 HD1 PHE 112 1HD PHE 112 5.816 -2.583 -0.743 728 HD2 PHE 112 2HD PHE 112 9.812 -0.956 -0.891 729 HE1 PHE 112 1HE PHE 112 5.383 -1.717 -3.011 730 HE2 PHE 112 2HE PHE 112 9.386 -0.193 -3.209 731 HZ PHE 112 HZ PHE 112 7.159 -0.541 -4.260 732 H PHE 113 H PHE 113 8.916 -0.342 3.441 733 HA PHE 113 HA PHE 113 8.271 2.199 2.106 734 HB3 PHE 113 2HB PHE 113 6.897 2.482 3.941 735 HD1 PHE 113 2HD PHE 113 6.364 0.363 4.995 736 HD2 PHE 113 1HD PHE 113 9.707 2.721 6.307 737 HE1 PHE 113 2HE PHE 113 6.576 -1.084 6.997 738 HE2 PHE 113 1HE PHE 113 9.917 1.304 8.322 739 HZ PHE 113 HZ PHE 113 8.427 -0.666 8.621 740 H THR 114 H THR 114 9.929 3.844 2.561 741 HA THR 114 HA THR 114 12.639 2.639 2.761 742 HB THR 114 HB THR 114 13.150 4.372 0.950 743 HG1 THR 114 1HG THR 114 10.351 4.293 0.456 744 HG21 THR 114 3HG2 THR 114 12.331 3.002 -0.869 745 HG22 THR 114 1HG2 THR 114 11.197 2.155 0.218 746 HG23 THR 114 2HG2 THR 114 12.961 1.988 0.456 747 H SER 115 H SER 115 10.875 4.249 4.754 748 HA SER 115 HA SER 115 12.615 6.630 5.215 749 HB3 SER 115 2HB SER 115 10.387 7.738 5.847 750 HG SER 115 HG SER 115 10.542 8.511 3.892 751 H ALA 116 H ALA 116 13.383 6.516 7.307 752 HA ALA 116 HA ALA 116 11.836 4.992 9.355 753 HB1 ALA 116 1HB ALA 116 14.781 4.618 8.690 754 HB2 ALA 116 2HB ALA 116 13.862 3.760 9.944 755 HB3 ALA 116 3HB ALA 116 13.470 3.502 8.230 756 H GLY 117 H GLY 117 13.614 7.879 8.736 757 HA2 GLY 117 1HA GLY 117 15.441 8.034 10.686 758 HA3 GLY 117 2HA GLY 117 14.611 9.438 10.024 759 H THR 118 H THR 118 11.966 8.704 11.291 760 HA THR 118 HA THR 118 12.623 9.127 14.179 761 HB THR 118 HB THR 118 10.863 10.987 14.039 762 HG1 THR 118 1HG THR 118 10.596 11.892 12.038 763 HG21 THR 118 3HG2 THR 118 13.409 11.534 12.447 764 HG22 THR 118 1HG2 THR 118 13.323 11.459 14.224 765 HG23 THR 118 2HG2 THR 118 12.421 12.695 13.339 766 H ASN 119 H ASN 119 10.392 7.889 11.774 767 HA ASN 119 HA ASN 119 8.357 7.149 13.859 768 HB3 ASN 119 2HB ASN 119 7.097 8.023 11.419 769 HD21 ASN 119 1HD2 ASN 119 5.662 7.353 13.269 770 HD22 ASN 119 2HD2 ASN 119 4.963 8.682 14.164 771 H HIS 120 H HIS 120 8.939 5.048 13.812 772 HA HIS 120 HA HIS 120 8.336 3.551 11.317 773 HB3 HIS 120 2HB HIS 120 10.171 2.802 13.631 774 HD1 HIS 120 1HD HIS 120 10.249 0.118 13.967 775 HD2 HIS 120 2HD HIS 120 8.765 1.485 10.251 776 HE1 HIS 120 1HE HIS 120 9.509 -1.915 12.711 777 H LYS 121 H LYS 121 8.354 2.740 14.821 778 HA LYS 121 HA LYS 121 6.430 0.766 14.336 779 HB3 LYS 121 2HB LYS 121 6.993 1.967 17.036 780 HG3 LYS 121 2HG LYS 121 7.210 -0.775 17.216 781 HD3 LYS 121 2HD LYS 121 4.936 1.091 17.843 782 HE3 LYS 121 2HE LYS 121 3.884 -1.067 18.907 783 HZ1 LYS 121 3HZ LYS 121 2.936 -1.542 16.536 784 HZ2 LYS 121 1HZ LYS 121 3.628 -0.077 16.182 785 HZ3 LYS 121 2HZ LYS 121 2.512 -0.195 17.392 786 H ALA 122 H ALA 122 5.807 4.177 14.830 787 HA ALA 122 HA ALA 122 3.032 3.930 15.519 788 HB1 ALA 122 1HB ALA 122 4.507 6.100 13.961 789 HB2 ALA 122 2HB ALA 122 2.915 6.245 14.729 790 HB3 ALA 122 3HB ALA 122 4.366 6.028 15.724 791 H TYR 123 H TYR 123 4.746 3.931 12.380 792 HA TYR 123 HA TYR 123 2.607 4.333 10.589 793 HB3 TYR 123 2HB TYR 123 5.078 2.606 10.257 794 HD1 TYR 123 1HD TYR 123 3.992 1.095 8.570 795 HD2 TYR 123 2HD TYR 123 4.159 5.377 8.042 796 HE1 TYR 123 1HE TYR 123 3.617 0.833 6.134 797 HE2 TYR 123 2HE TYR 123 3.946 5.095 5.607 798 HH TYR 123 HH TYR 123 2.925 2.172 4.150 799 H VAL 124 H VAL 124 3.859 1.352 12.073 800 HA VAL 124 HA VAL 124 2.330 -0.501 10.678 801 HB VAL 124 HB VAL 124 3.207 -0.682 13.596 802 HG11 VAL 124 1HG1 VAL 124 1.660 -2.496 12.888 803 HG12 VAL 124 2HG1 VAL 124 2.693 -2.851 11.493 804 HG13 VAL 124 3HG1 VAL 124 3.292 -3.127 13.141 805 HG21 VAL 124 3HG2 VAL 124 4.728 -1.326 11.034 806 HG22 VAL 124 1HG2 VAL 124 5.159 -0.091 12.244 807 HG23 VAL 124 2HG2 VAL 124 5.251 -1.798 12.650 808 H SER 125 H SER 125 1.312 1.510 13.464 809 HA SER 125 HA SER 125 -1.264 0.177 13.714 810 HB3 SER 125 2HB SER 125 -0.147 2.823 14.674 811 HG SER 125 HG SER 125 -2.018 2.817 16.060 812 H HIS 126 H HIS 126 -0.138 3.343 12.453 813 HA HIS 126 HA HIS 126 -2.499 4.338 11.508 814 HB3 HIS 126 2HB HIS 126 -1.130 5.665 9.941 815 HD1 HIS 126 1HD HIS 126 -1.642 5.683 13.354 816 HD2 HIS 126 2HD HIS 126 1.730 6.578 11.021 817 HE1 HIS 126 1HE HIS 126 -0.267 7.331 14.693 818 H PHE 127 H PHE 127 -0.259 2.331 9.583 819 HA PHE 127 HA PHE 127 -1.834 2.336 7.219 820 HB3 PHE 127 2HB PHE 127 0.353 0.525 8.269 821 HD1 PHE 127 1HD PHE 127 -1.725 1.336 5.206 822 HD2 PHE 127 2HD PHE 127 1.188 -1.275 7.037 823 HE1 PHE 127 1HE PHE 127 -1.912 -0.239 3.303 824 HE2 PHE 127 2HE PHE 127 0.968 -2.839 5.117 825 HZ PHE 127 HZ PHE 127 -0.520 -2.278 3.233 826 H ASN 128 H ASN 128 -1.753 0.087 10.026 827 HA ASN 128 HA ASN 128 -3.370 -1.965 8.839 828 HB3 ASN 128 2HB ASN 128 -4.066 -2.265 11.380 829 HD21 ASN 128 1HD2 ASN 128 -0.801 -2.322 11.954 830 HD22 ASN 128 2HD2 ASN 128 -0.495 -3.969 11.444 831 H GLU 129 H GLU 129 -4.275 0.933 10.809 832 HA GLU 129 HA GLU 129 -7.038 0.266 10.656 833 HB3 GLU 129 2HB GLU 129 -7.435 2.525 11.419 834 HG3 GLU 129 2HG GLU 129 -6.155 2.789 13.321 835 H TRP 130 H TRP 130 -4.930 2.231 8.562 836 HA TRP 130 HA TRP 130 -7.122 3.290 7.071 837 HB3 TRP 130 2HB TRP 130 -5.157 4.002 5.597 838 HD1 TRP 130 HD TRP 130 -6.688 4.655 8.906 839 HE1 TRP 130 1HE TRP 130 -6.361 7.093 9.483 840 HE3 TRP 130 3HE TRP 130 -2.570 5.583 6.048 841 HZ2 TRP 130 2HZ TRP 130 -4.654 9.294 8.635 842 HZ3 TRP 130 3HZ TRP 130 -1.564 7.886 5.993 843 HH2 TRP 130 HH TRP 130 -2.687 9.746 7.209 844 H ALA 131 H ALA 131 -5.555 0.220 6.942 845 HA ALA 131 HA ALA 131 -6.455 -0.273 4.155 846 HB1 ALA 131 1HB ALA 131 -4.084 -0.739 4.703 847 HB2 ALA 131 2HB ALA 131 -4.596 -1.831 6.011 848 HB3 ALA 131 3HB ALA 131 -4.960 -2.233 4.313 849 H ASP 132 H ASP 132 -7.705 -0.548 7.206 850 HA ASP 132 HA ASP 132 -7.796 -3.174 7.707 851 HB3 ASP 132 2HB ASP 132 -9.823 -1.145 8.657 852 H GLY 133 H GLY 133 -8.620 -4.807 6.801 853 HA2 GLY 133 1HA GLY 133 -10.843 -6.015 6.900 854 HA3 GLY 133 2HA GLY 133 -11.345 -4.913 5.621 855 H LEU 134 H LEU 134 -8.555 -4.924 4.422 856 HA LEU 134 HA LEU 134 -8.649 -7.423 2.862 857 HB3 LEU 134 2HB LEU 134 -6.356 -6.544 2.091 858 HG LEU 134 HG LEU 134 -8.793 -4.783 1.738 859 HD11 LEU 134 1HD1 LEU 134 -7.607 -3.623 -0.032 860 HD12 LEU 134 2HD1 LEU 134 -6.140 -4.608 0.249 861 HD13 LEU 134 3HD1 LEU 134 -6.707 -3.457 1.476 862 HD21 LEU 134 3HD2 LEU 134 -8.936 -7.031 0.692 863 HD22 LEU 134 1HD2 LEU 134 -7.436 -6.721 -0.190 864 HD23 LEU 134 2HD2 LEU 134 -8.898 -5.740 -0.512 865 H ASN 135 H ASN 135 -6.745 -8.887 2.875 866 HA ASN 135 HA ASN 135 -5.980 -9.629 5.602 867 HB3 ASN 135 2HB ASN 135 -5.062 -10.701 2.891 868 HD21 ASN 135 1HD2 ASN 135 -3.599 -12.394 3.135 869 HD22 ASN 135 2HD2 ASN 135 -3.052 -13.034 4.592 870 H VAL 136 H VAL 136 -3.695 -9.669 6.308 871 HA VAL 136 HA VAL 136 -1.792 -8.291 4.542 872 HB VAL 136 HB VAL 136 -1.832 -7.645 7.491 873 HG11 VAL 136 1HG1 VAL 136 -0.778 -6.299 4.954 874 HG12 VAL 136 2HG1 VAL 136 -0.749 -5.520 6.542 875 HG13 VAL 136 3HG1 VAL 136 0.165 -6.994 6.282 876 HG21 VAL 136 3HG2 VAL 136 -3.484 -6.150 5.432 877 HG22 VAL 136 1HG2 VAL 136 -4.073 -6.975 6.880 878 HG23 VAL 136 2HG2 VAL 136 -3.076 -5.545 7.060 879 H ILE 137 H ILE 137 0.262 -9.036 4.676 880 HA ILE 137 HA ILE 137 1.001 -10.929 6.878 881 HB ILE 137 HB ILE 137 2.223 -12.363 5.252 882 HG13 ILE 137 2HG1 ILE 137 0.774 -10.693 3.163 883 HG21 ILE 137 1HG2 ILE 137 0.109 -12.943 6.261 884 HG22 ILE 137 2HG2 ILE 137 -0.782 -12.180 4.905 885 HG23 ILE 137 3HG2 ILE 137 0.236 -13.609 4.639 886 HD11 ILE 137 3HD1 ILE 137 2.771 -11.137 1.838 887 HD12 ILE 137 1HD1 ILE 137 3.202 -10.306 3.358 888 HD13 ILE 137 2HD1 ILE 137 3.475 -12.058 3.179 889 H GLY 138 H GLY 138 1.870 -8.007 5.560 890 HA2 GLY 138 1HA GLY 138 4.229 -8.149 7.253 891 HA3 GLY 138 2HA GLY 138 4.615 -7.941 5.541 892 H VAL 139 H VAL 139 5.093 -6.167 7.798 893 HA VAL 139 HA VAL 139 4.604 -3.762 6.272 894 HB VAL 139 HB VAL 139 3.917 -3.935 9.269 895 HG11 VAL 139 1HG1 VAL 139 3.665 -1.546 7.394 896 HG12 VAL 139 2HG1 VAL 139 3.274 -1.598 9.108 897 HG13 VAL 139 3HG1 VAL 139 4.956 -1.761 8.602 898 HG21 VAL 139 3HG2 VAL 139 1.617 -3.192 8.596 899 HG22 VAL 139 1HG2 VAL 139 2.067 -3.501 6.896 900 HG23 VAL 139 2HG2 VAL 139 2.024 -4.823 8.083 901 H ALA 140 H ALA 140 6.921 -3.709 5.815 902 HA ALA 140 HA ALA 140 8.641 -3.209 8.122 903 HB1 ALA 140 1HB ALA 140 9.285 -5.481 6.174 904 HB2 ALA 140 2HB ALA 140 10.286 -4.914 7.520 905 HB3 ALA 140 3HB ALA 140 8.746 -5.709 7.858 906 H ARG 141 H ARG 141 10.723 -2.190 7.407 907 HA ARG 141 HA ARG 141 10.372 -0.768 4.885 908 HB3 ARG 141 2HB ARG 141 11.414 0.359 6.847 909 HG3 ARG 141 2HG ARG 141 13.935 -1.240 6.246 910 HD3 ARG 141 2HD ARG 141 13.217 1.183 7.910 911 HE ARG 141 HE ARG 141 14.269 -0.348 9.447 912 HH11 ARG 141 1HH1 ARG 141 16.599 0.972 7.046 913 HH12 ARG 141 2HH1 ARG 141 17.893 1.012 8.192 914 HH21 ARG 141 1HH2 ARG 141 15.952 -0.314 10.820 915 HH22 ARG 141 2HH2 ARG 141 17.516 0.330 10.424 916 H ASP 142 H ASP 142 11.980 -0.750 3.227 917 HA ASP 142 HA ASP 142 13.201 -1.732 1.629 918 HB3 ASP 142 2HB ASP 142 15.335 -2.986 2.702 919 H ASP 143 H ASP 143 14.698 -4.323 1.914 920 HA ASP 143 HA ASP 143 12.560 -6.156 1.130 921 HB3 ASP 143 2HB ASP 143 13.807 -5.450 -0.756 922 H SER 144 H SER 144 13.259 -6.064 3.863 923 HA SER 144 HA SER 144 15.326 -8.072 4.484 924 HB3 SER 144 2HB SER 144 13.261 -6.680 6.237 925 HG SER 144 HG SER 144 15.417 -7.084 7.588 926 H GLU 145 H GLU 145 11.839 -7.987 3.889 927 HA GLU 145 HA GLU 145 11.521 -10.734 5.037 928 HB3 GLU 145 2HB GLU 145 9.148 -10.019 5.300 929 HG3 GLU 145 2HG GLU 145 10.656 -7.839 6.702 930 H VAL 146 H VAL 146 12.146 -9.764 2.059 931 HA VAL 146 HA VAL 146 9.861 -10.296 0.482 932 HB VAL 146 HB VAL 146 12.782 -10.808 -0.215 933 HG11 VAL 146 1HG1 VAL 146 12.080 -10.440 -2.559 934 HG12 VAL 146 2HG1 VAL 146 11.240 -11.829 -1.875 935 HG13 VAL 146 3HG1 VAL 146 10.392 -10.277 -2.037 936 HG21 VAL 146 3HG2 VAL 146 12.463 -8.489 0.520 937 HG22 VAL 146 1HG2 VAL 146 12.695 -8.538 -1.229 938 HG23 VAL 146 2HG2 VAL 146 11.062 -8.306 -0.562 939 H ASP 147 H ASP 147 12.321 -12.541 1.736 940 HA ASP 147 HA ASP 147 11.508 -14.953 0.612 941 HB3 ASP 147 2HB ASP 147 12.720 -15.984 2.531 942 H LYS 148 H LYS 148 9.693 -13.110 2.863 943 HA LYS 148 HA LYS 148 8.070 -15.511 3.545 944 HB3 LYS 148 2HB LYS 148 9.171 -14.863 5.550 945 HG3 LYS 148 2HG LYS 148 8.104 -12.095 4.952 946 HD3 LYS 148 2HD LYS 148 9.297 -11.804 7.363 947 HE3 LYS 148 2HE LYS 148 7.144 -10.842 6.599 948 HZ1 LYS 148 3HZ LYS 148 5.792 -12.793 6.114 949 HZ2 LYS 148 1HZ LYS 148 5.138 -12.037 7.407 950 HZ3 LYS 148 2HZ LYS 148 6.044 -13.394 7.594 951 H TRP 149 H TRP 149 8.098 -12.705 1.770 952 HA TRP 149 HA TRP 149 5.094 -12.681 1.767 953 HB3 TRP 149 2HB TRP 149 5.198 -10.525 0.748 954 HD1 TRP 149 HD TRP 149 5.463 -11.383 3.931 955 HE1 TRP 149 1HE TRP 149 6.174 -9.566 5.548 956 HE3 TRP 149 3HE TRP 149 7.792 -8.234 0.650 957 HZ2 TRP 149 2HZ TRP 149 7.442 -6.974 5.444 958 HZ3 TRP 149 3HZ TRP 149 8.630 -6.019 1.406 959 HH2 TRP 149 HH TRP 149 8.392 -5.342 3.815 960 H SER 150 H SER 150 6.338 -14.848 0.646 961 HA SER 150 HA SER 150 5.285 -14.742 -2.040 962 HB3 SER 150 2HB SER 150 8.313 -15.137 -1.767 963 HG SER 150 HG SER 150 7.603 -16.362 -3.434 964 H LYS 151 H LYS 151 7.420 -16.523 0.152 965 HA LYS 151 HA LYS 151 7.578 -18.972 -0.845 966 HB3 LYS 151 2HB LYS 151 8.790 -18.176 1.071 967 HG3 LYS 151 2HG LYS 151 6.419 -17.380 2.239 968 HD3 LYS 151 2HD LYS 151 7.420 -19.414 4.189 969 HE3 LYS 151 2HE LYS 151 5.609 -17.489 4.428 970 HZ1 LYS 151 3HZ LYS 151 4.290 -18.448 2.565 971 HZ2 LYS 151 1HZ LYS 151 3.417 -18.231 3.947 972 HZ3 LYS 151 2HZ LYS 151 3.936 -19.727 3.514 Start of MODEL 14 1 H1 GLY 1 H GLY 1 -6.786 -25.453 -12.776 2 HA2 GLY 1 1HA GLY 1 -4.641 -24.370 -13.068 3 HA3 GLY 1 2HA GLY 1 -5.951 -23.175 -13.086 4 H MET 2 H MET 2 -2.916 -23.274 -12.101 5 HA MET 2 HA MET 2 -3.367 -21.626 -9.728 6 HB3 MET 2 2HB MET 2 -3.201 -23.654 -8.544 7 HG3 MET 2 2HG MET 2 -1.174 -24.522 -10.614 8 HE1 MET 2 3HE MET 2 0.731 -23.991 -8.699 9 HE2 MET 2 1HE MET 2 1.477 -25.524 -8.180 10 HE3 MET 2 2HE MET 2 1.094 -25.257 -9.890 11 H ALA 3 H ALA 3 -1.952 -20.020 -9.586 12 HA ALA 3 HA ALA 3 0.757 -20.137 -10.249 13 HB1 ALA 3 1HB ALA 3 -0.968 -18.361 -12.055 14 HB2 ALA 3 2HB ALA 3 0.804 -18.300 -11.929 15 HB3 ALA 3 3HB ALA 3 0.017 -19.753 -12.570 16 H LYS 4 H LYS 4 1.414 -19.017 -8.390 17 HA LYS 4 HA LYS 4 -0.232 -16.848 -7.294 18 HB3 LYS 4 2HB LYS 4 1.382 -16.725 -5.547 19 HG3 LYS 4 2HG LYS 4 1.443 -19.722 -5.909 20 HD3 LYS 4 2HD LYS 4 0.301 -19.564 -3.645 21 HE3 LYS 4 2HE LYS 4 2.949 -19.624 -4.015 22 HZ1 LYS 4 3HZ LYS 4 3.274 -17.211 -3.955 23 HZ2 LYS 4 1HZ LYS 4 3.929 -17.956 -2.639 24 HZ3 LYS 4 2HZ LYS 4 2.531 -17.109 -2.482 25 H LYS 5 H LYS 5 0.301 -14.701 -7.668 26 HA LYS 5 HA LYS 5 2.866 -14.104 -9.054 27 HB3 LYS 5 2HB LYS 5 1.823 -12.657 -10.575 28 HG3 LYS 5 2HG LYS 5 -0.590 -14.334 -10.313 29 HD3 LYS 5 2HD LYS 5 -0.010 -12.925 -12.350 30 HE3 LYS 5 2HE LYS 5 1.941 -15.288 -12.606 31 HZ1 LYS 5 3HZ LYS 5 2.797 -14.000 -14.487 32 HZ2 LYS 5 1HZ LYS 5 1.459 -13.012 -14.462 33 HZ3 LYS 5 2HZ LYS 5 1.315 -14.653 -14.760 34 H THR 6 H THR 6 2.995 -11.675 -9.108 35 HA THR 6 HA THR 6 2.271 -10.493 -6.502 36 HB THR 6 HB THR 6 5.150 -10.592 -7.427 37 HG1 THR 6 1HG THR 6 3.917 -12.125 -5.380 38 HG21 THR 6 3HG2 THR 6 3.847 -9.599 -4.854 39 HG22 THR 6 1HG2 THR 6 4.832 -8.684 -6.012 40 HG23 THR 6 2HG2 THR 6 5.575 -9.932 -5.005 41 H LEU 7 H LEU 7 2.187 -8.177 -6.526 42 HA LEU 7 HA LEU 7 3.099 -6.850 -9.005 43 HB3 LEU 7 2HB LEU 7 0.448 -6.009 -7.894 44 HG LEU 7 HG LEU 7 1.136 -6.507 -10.816 45 HD11 LEU 7 1HD1 LEU 7 -1.191 -6.221 -10.280 46 HD12 LEU 7 2HD1 LEU 7 -0.617 -4.777 -11.119 47 HD13 LEU 7 3HD1 LEU 7 -0.861 -4.741 -9.358 48 HD21 LEU 7 3HD2 LEU 7 2.887 -5.012 -10.308 49 HD22 LEU 7 1HD2 LEU 7 1.871 -4.022 -9.270 50 HD23 LEU 7 2HD2 LEU 7 1.614 -4.042 -11.027 51 H ILE 8 H ILE 8 4.310 -5.146 -8.431 52 HA ILE 8 HA ILE 8 4.255 -4.080 -5.683 53 HB ILE 8 HB ILE 8 6.138 -3.767 -8.053 54 HG13 ILE 8 2HG1 ILE 8 5.997 -5.987 -6.641 55 HG21 ILE 8 1HG2 ILE 8 6.259 -1.681 -6.820 56 HG22 ILE 8 2HG2 ILE 8 6.380 -2.557 -5.277 57 HG23 ILE 8 3HG2 ILE 8 7.702 -2.628 -6.463 58 HD11 ILE 8 3HD1 ILE 8 7.748 -5.530 -8.249 59 HD12 ILE 8 1HD1 ILE 8 8.678 -4.638 -6.998 60 HD13 ILE 8 2HD1 ILE 8 8.365 -6.377 -6.820 61 H LEU 9 H LEU 9 2.614 -2.596 -5.424 62 HA LEU 9 HA LEU 9 2.194 -0.485 -7.446 63 HB3 LEU 9 2HB LEU 9 0.328 -0.040 -5.541 64 HG LEU 9 HG LEU 9 -1.241 -1.628 -6.698 65 HD11 LEU 9 1HD1 LEU 9 -1.050 0.656 -7.444 66 HD12 LEU 9 2HD1 LEU 9 -1.173 -0.397 -8.851 67 HD13 LEU 9 3HD1 LEU 9 0.401 0.294 -8.423 68 HD21 LEU 9 3HD2 LEU 9 0.393 -3.342 -7.417 69 HD22 LEU 9 1HD2 LEU 9 1.069 -2.154 -8.573 70 HD23 LEU 9 2HD2 LEU 9 -0.605 -2.693 -8.740 71 H TYR 10 H TYR 10 3.836 1.001 -7.119 72 HA TYR 10 HA TYR 10 4.180 1.967 -4.299 73 HB3 TYR 10 2HB TYR 10 6.221 0.950 -5.365 74 HD1 TYR 10 1HD TYR 10 6.665 4.553 -5.967 75 HD2 TYR 10 2HD TYR 10 6.541 0.658 -7.808 76 HE1 TYR 10 1HE TYR 10 7.713 5.496 -7.984 77 HE2 TYR 10 2HE TYR 10 7.656 1.563 -9.815 78 HH TYR 10 HH TYR 10 7.968 5.000 -10.379 79 H TYR 11 H TYR 11 4.294 4.275 -3.982 80 HA TYR 11 HA TYR 11 3.661 5.945 -6.345 81 HB3 TYR 11 2HB TYR 11 2.298 6.024 -3.634 82 HD1 TYR 11 2HD TYR 11 1.478 7.962 -6.699 83 HD2 TYR 11 1HD TYR 11 3.132 8.173 -2.708 84 HE1 TYR 11 2HE TYR 11 1.388 10.417 -6.792 85 HE2 TYR 11 1HE TYR 11 2.968 10.642 -2.774 86 HH TYR 11 HH TYR 11 1.678 12.431 -5.590 87 H SER 12 H SER 12 4.913 7.632 -6.516 88 HA SER 12 HA SER 12 5.434 9.335 -4.459 89 HB3 SER 12 2HB SER 12 7.886 9.681 -4.745 90 HG SER 12 HG SER 12 6.763 7.395 -3.652 91 H TRP 13 H TRP 13 6.472 11.413 -5.672 92 HA TRP 13 HA TRP 13 5.385 11.509 -8.437 93 HB3 TRP 13 2HB TRP 13 6.226 13.550 -6.388 94 HD1 TRP 13 HD TRP 13 4.891 13.743 -10.015 95 HE1 TRP 13 1HE TRP 13 5.606 15.951 -11.050 96 HE3 TRP 13 3HE TRP 13 7.749 15.490 -6.150 97 HZ2 TRP 13 2HZ TRP 13 7.124 18.307 -10.217 98 HZ3 TRP 13 3HZ TRP 13 8.778 17.747 -6.274 99 HH2 TRP 13 HH TRP 13 8.425 19.179 -8.281 100 H SER 14 H SER 14 8.349 12.733 -6.851 101 HA SER 14 HA SER 14 9.983 12.024 -9.193 102 HB3 SER 14 2HB SER 14 11.850 12.845 -7.779 103 HG SER 14 HG SER 14 9.708 14.680 -7.591 104 H GLY 15 H GLY 15 11.828 10.521 -8.899 105 HA2 GLY 15 1HA GLY 15 10.558 8.026 -8.357 106 HA3 GLY 15 2HA GLY 15 12.152 8.290 -9.056 107 H GLU 16 H GLU 16 11.088 9.314 -5.759 108 HA GLU 16 HA GLU 16 13.580 8.426 -4.690 109 HB3 GLU 16 2HB GLU 16 12.391 10.336 -3.809 110 HG3 GLU 16 2HG GLU 16 10.398 8.350 -2.641 111 H THR 17 H THR 17 10.572 6.664 -5.090 112 HA THR 17 HA THR 17 11.389 4.484 -3.273 113 HB THR 17 HB THR 17 9.048 3.695 -4.290 114 HG1 THR 17 1HG THR 17 8.409 6.375 -4.359 115 HG21 THR 17 3HG2 THR 17 9.372 4.247 -1.924 116 HG22 THR 17 1HG2 THR 17 7.846 4.906 -2.524 117 HG23 THR 17 2HG2 THR 17 9.251 5.982 -2.284 118 H LYS 18 H LYS 18 11.878 5.338 -6.538 119 HA LYS 18 HA LYS 18 10.987 3.067 -7.934 120 HB3 LYS 18 2HB LYS 18 13.280 4.933 -8.666 121 HG3 LYS 18 2HG LYS 18 11.451 3.146 -10.309 122 HD3 LYS 18 2HD LYS 18 12.601 4.170 -12.311 123 HE3 LYS 18 2HE LYS 18 10.786 5.946 -10.621 124 HZ1 LYS 18 3HZ LYS 18 11.703 7.120 -12.552 125 HZ2 LYS 18 1HZ LYS 18 10.084 6.881 -12.633 126 HZ3 LYS 18 2HZ LYS 18 11.081 5.968 -13.556 127 H LYS 19 H LYS 19 14.237 3.684 -6.546 128 HA LYS 19 HA LYS 19 15.599 1.448 -7.426 129 HB3 LYS 19 2HB LYS 19 16.664 3.145 -6.159 130 HG3 LYS 19 2HG LYS 19 14.562 3.110 -4.289 131 HD3 LYS 19 2HD LYS 19 15.931 1.161 -3.181 132 HE3 LYS 19 2HE LYS 19 17.562 3.640 -2.466 133 HZ1 LYS 19 3HZ LYS 19 18.889 2.305 -1.234 134 HZ2 LYS 19 1HZ LYS 19 18.199 0.876 -1.668 135 HZ3 LYS 19 2HZ LYS 19 17.394 1.924 -0.671 136 H MET 20 H MET 20 13.495 1.546 -4.494 137 HA MET 20 HA MET 20 13.868 -1.184 -3.813 138 HB3 MET 20 2HB MET 20 11.227 -0.212 -3.063 139 HG3 MET 20 2HG MET 20 12.968 -1.644 -1.698 140 HE1 MET 20 3HE MET 20 16.382 -0.416 -0.791 141 HE2 MET 20 1HE MET 20 15.249 -1.776 -0.726 142 HE3 MET 20 2HE MET 20 15.523 -0.931 -2.266 143 H ALA 21 H ALA 21 11.763 0.399 -6.156 144 HA ALA 21 HA ALA 21 9.934 -1.869 -6.418 145 HB1 ALA 21 1HB ALA 21 10.357 0.483 -8.317 146 HB2 ALA 21 2HB ALA 21 9.012 -0.662 -8.339 147 HB3 ALA 21 3HB ALA 21 9.198 0.451 -6.970 148 H GLU 22 H GLU 22 12.602 -0.547 -8.405 149 HA GLU 22 HA GLU 22 12.505 -2.658 -10.313 150 HB3 GLU 22 2HB GLU 22 14.812 -1.729 -10.928 151 HG3 GLU 22 2HG GLU 22 13.902 0.744 -11.053 152 H LYS 23 H LYS 23 14.229 -2.326 -7.260 153 HA LYS 23 HA LYS 23 15.944 -4.655 -7.598 154 HB3 LYS 23 2HB LYS 23 15.527 -4.548 -4.945 155 HG3 LYS 23 2HG LYS 23 17.693 -4.032 -6.350 156 HD3 LYS 23 2HD LYS 23 18.481 -1.841 -5.315 157 HE3 LYS 23 2HE LYS 23 17.329 -0.343 -7.072 158 HZ1 LYS 23 3HZ LYS 23 18.583 -2.807 -8.112 159 HZ2 LYS 23 1HZ LYS 23 19.405 -1.527 -7.497 160 HZ3 LYS 23 2HZ LYS 23 18.464 -1.341 -8.850 161 H ILE 24 H ILE 24 12.998 -4.309 -5.516 162 HA ILE 24 HA ILE 24 12.896 -7.003 -4.948 163 HB ILE 24 HB ILE 24 10.698 -4.914 -4.916 164 HG13 ILE 24 2HG1 ILE 24 12.762 -4.557 -3.540 165 HG21 ILE 24 1HG2 ILE 24 9.488 -6.378 -3.310 166 HG22 ILE 24 2HG2 ILE 24 9.616 -7.147 -4.880 167 HG23 ILE 24 3HG2 ILE 24 10.695 -7.659 -3.568 168 HD11 ILE 24 3HD1 ILE 24 10.574 -5.294 -1.607 169 HD12 ILE 24 1HD1 ILE 24 11.862 -4.095 -1.465 170 HD13 ILE 24 2HD1 ILE 24 10.549 -3.815 -2.614 171 H ASN 25 H ASN 25 11.410 -5.227 -7.694 172 HA ASN 25 HA ASN 25 9.709 -7.284 -8.670 173 HB3 ASN 25 2HB ASN 25 11.170 -5.039 -10.090 174 HD21 ASN 25 1HD2 ASN 25 8.128 -7.134 -10.256 175 HD22 ASN 25 2HD2 ASN 25 8.499 -7.460 -11.938 176 H SER 26 H SER 26 13.175 -6.887 -8.965 177 HA SER 26 HA SER 26 13.532 -8.893 -11.043 178 HB3 SER 26 2HB SER 26 15.896 -8.174 -9.499 179 HG SER 26 HG SER 26 14.957 -7.430 -12.083 180 H GLU 27 H GLU 27 12.929 -8.940 -7.665 181 HA GLU 27 HA GLU 27 14.599 -11.321 -7.082 182 HB3 GLU 27 2HB GLU 27 14.347 -10.442 -4.716 183 HG3 GLU 27 2HG GLU 27 15.622 -8.584 -6.760 184 H ILE 28 H ILE 28 11.573 -10.853 -8.077 185 HA ILE 28 HA ILE 28 10.417 -12.999 -6.374 186 HB ILE 28 HB ILE 28 9.143 -10.355 -7.157 187 HG13 ILE 28 2HG1 ILE 28 10.477 -10.193 -5.117 188 HG21 ILE 28 1HG2 ILE 28 7.766 -12.736 -5.856 189 HG22 ILE 28 2HG2 ILE 28 7.051 -11.175 -6.246 190 HG23 ILE 28 3HG2 ILE 28 7.541 -12.244 -7.543 191 HD11 ILE 28 3HD1 ILE 28 8.915 -9.509 -3.465 192 HD12 ILE 28 1HD1 ILE 28 8.167 -9.133 -5.032 193 HD13 ILE 28 2HD1 ILE 28 7.650 -10.563 -4.097 194 H LYS 29 H LYS 29 9.729 -14.598 -7.645 195 HA LYS 29 HA LYS 29 9.867 -14.362 -10.532 196 HB3 LYS 29 2HB LYS 29 9.031 -16.512 -8.592 197 HG3 LYS 29 2HG LYS 29 7.380 -16.911 -10.333 198 HD3 LYS 29 2HD LYS 29 9.348 -15.991 -12.231 199 HE3 LYS 29 2HE LYS 29 9.029 -17.966 -13.843 200 HZ1 LYS 29 3HZ LYS 29 11.144 -17.553 -13.028 201 HZ2 LYS 29 1HZ LYS 29 10.937 -19.189 -12.877 202 HZ3 LYS 29 2HZ LYS 29 10.888 -18.210 -11.555 203 H ASP 30 H ASP 30 8.359 -13.965 -11.929 204 HA ASP 30 HA ASP 30 6.438 -13.323 -12.893 205 HB3 ASP 30 2HB ASP 30 4.431 -14.621 -11.286 206 H SER 31 H SER 31 7.580 -11.717 -10.692 207 HA SER 31 HA SER 31 5.460 -10.181 -9.549 208 HB3 SER 31 2HB SER 31 8.359 -9.429 -10.187 209 HG SER 31 HG SER 31 7.864 -8.532 -7.929 210 H GLU 32 H GLU 32 5.220 -7.939 -10.124 211 HA GLU 32 HA GLU 32 5.912 -6.915 -12.749 212 HB3 GLU 32 2HB GLU 32 3.419 -5.880 -12.570 213 HG3 GLU 32 2HG GLU 32 4.168 -8.534 -13.813 214 H LEU 33 H LEU 33 5.606 -4.461 -12.604 215 HA LEU 33 HA LEU 33 5.218 -3.410 -9.945 216 HB3 LEU 33 2HB LEU 33 7.667 -3.653 -10.390 217 HG LEU 33 HG LEU 33 7.329 -1.401 -12.431 218 HD11 LEU 33 1HD1 LEU 33 9.232 -1.278 -10.841 219 HD12 LEU 33 2HD1 LEU 33 9.764 -1.499 -12.520 220 HD13 LEU 33 3HD1 LEU 33 9.793 -2.871 -11.394 221 HD21 LEU 33 3HD2 LEU 33 6.901 -3.402 -13.731 222 HD22 LEU 33 1HD2 LEU 33 8.235 -4.273 -12.943 223 HD23 LEU 33 2HD2 LEU 33 8.559 -2.909 -14.039 224 H LYS 34 H LYS 34 3.977 -1.524 -10.033 225 HA LYS 34 HA LYS 34 3.776 -0.067 -12.537 226 HB3 LYS 34 2HB LYS 34 1.139 0.017 -11.822 227 HG3 LYS 34 2HG LYS 34 2.348 -0.479 -14.114 228 HD3 LYS 34 2HD LYS 34 2.405 -3.135 -13.280 229 HE3 LYS 34 2HE LYS 34 -0.169 -2.557 -14.776 230 HZ1 LYS 34 3HZ LYS 34 -0.309 -4.824 -15.323 231 HZ2 LYS 34 1HZ LYS 34 1.174 -5.203 -14.772 232 HZ3 LYS 34 2HZ LYS 34 0.970 -4.230 -16.108 233 H GLU 35 H GLU 35 3.209 2.133 -12.175 234 HA GLU 35 HA GLU 35 3.713 2.867 -9.357 235 HB3 GLU 35 2HB GLU 35 5.489 3.185 -11.217 236 HG3 GLU 35 2HG GLU 35 5.573 5.425 -12.145 237 H VAL 36 H VAL 36 2.124 3.821 -8.344 238 HA VAL 36 HA VAL 36 -0.362 4.598 -9.628 239 HB VAL 36 HB VAL 36 0.698 5.141 -6.842 240 HG11 VAL 36 1HG1 VAL 36 -1.307 6.426 -7.288 241 HG12 VAL 36 2HG1 VAL 36 -2.143 4.980 -7.920 242 HG13 VAL 36 3HG1 VAL 36 -1.694 5.110 -6.199 243 HG21 VAL 36 3HG2 VAL 36 -0.584 3.069 -6.178 244 HG22 VAL 36 1HG2 VAL 36 -0.741 2.721 -7.914 245 HG23 VAL 36 2HG2 VAL 36 0.859 2.749 -7.129 246 H LYS 37 H LYS 37 -1.031 6.940 -9.916 247 HA LYS 37 HA LYS 37 1.060 9.003 -9.478 248 HB3 LYS 37 2HB LYS 37 0.354 10.071 -11.470 249 HG3 LYS 37 2HG LYS 37 0.109 7.132 -12.271 250 HD3 LYS 37 2HD LYS 37 1.089 9.581 -13.781 251 HE3 LYS 37 2HE LYS 37 0.363 6.772 -14.744 252 HZ1 LYS 37 3HZ LYS 37 1.659 9.069 -16.086 253 HZ2 LYS 37 1HZ LYS 37 0.151 8.507 -16.382 254 HZ3 LYS 37 2HZ LYS 37 1.484 7.593 -16.756 255 H VAL 38 H VAL 38 -0.299 11.265 -9.551 256 HA VAL 38 HA VAL 38 -2.752 10.914 -7.887 257 HB VAL 38 HB VAL 38 -2.345 13.437 -7.379 258 HG11 VAL 38 1HG1 VAL 38 -0.712 11.195 -6.123 259 HG12 VAL 38 2HG1 VAL 38 -1.002 12.795 -5.392 260 HG13 VAL 38 3HG1 VAL 38 -2.353 11.699 -5.698 261 HG21 VAL 38 3HG2 VAL 38 -0.075 14.182 -7.305 262 HG22 VAL 38 1HG2 VAL 38 0.548 12.631 -7.874 263 HG23 VAL 38 2HG2 VAL 38 -0.402 13.682 -8.960 264 H SER 39 H SER 39 -4.487 12.389 -8.367 265 HA SER 39 HA SER 39 -4.919 12.965 -11.190 266 HB3 SER 39 2HB SER 39 -6.656 13.783 -8.854 267 HG SER 39 HG SER 39 -8.247 13.673 -10.351 268 H GLU 40 H GLU 40 -6.281 15.410 -10.765 269 HA GLU 40 HA GLU 40 -4.099 17.259 -11.160 270 HB3 GLU 40 2HB GLU 40 -5.948 17.114 -12.638 271 HG3 GLU 40 2HG GLU 40 -7.736 16.666 -10.897 272 H GLY 41 H GLY 41 -5.214 19.727 -10.202 273 HA2 GLY 41 1HA GLY 41 -5.044 19.436 -7.269 274 HA3 GLY 41 2HA GLY 41 -3.747 20.285 -8.125 275 H THR 42 H THR 42 -6.859 20.542 -6.753 276 HA THR 42 HA THR 42 -7.145 23.313 -7.786 277 HB THR 42 HB THR 42 -8.558 21.640 -8.939 278 HG1 THR 42 1HG THR 42 -10.479 23.104 -7.722 279 HG21 THR 42 3HG2 THR 42 -10.535 20.708 -7.873 280 HG22 THR 42 1HG2 THR 42 -10.023 21.344 -6.290 281 HG23 THR 42 2HG2 THR 42 -9.073 20.093 -7.107 282 H PHE 43 H PHE 43 -6.540 21.609 -4.957 283 HA PHE 43 HA PHE 43 -8.327 23.379 -3.320 284 HB3 PHE 43 2HB PHE 43 -7.524 20.492 -2.843 285 HD1 PHE 43 1HD PHE 43 -10.402 22.715 -1.866 286 HD2 PHE 43 2HD PHE 43 -7.135 20.252 -0.493 287 HE1 PHE 43 1HE PHE 43 -11.183 22.969 0.467 288 HE2 PHE 43 2HE PHE 43 -7.919 20.509 1.833 289 HZ PHE 43 HZ PHE 43 -9.924 21.897 2.331 290 H ASP 44 H ASP 44 -5.229 21.524 -3.222 291 HA ASP 44 HA ASP 44 -4.395 23.025 -0.821 292 HB3 ASP 44 2HB ASP 44 -3.052 20.823 -2.441 293 H ALA 45 H ALA 45 -3.375 22.546 -4.171 294 HA ALA 45 HA ALA 45 -2.675 25.281 -4.546 295 HB1 ALA 45 1HB ALA 45 -0.412 23.227 -4.784 296 HB2 ALA 45 2HB ALA 45 -0.334 24.928 -5.285 297 HB3 ALA 45 3HB ALA 45 -0.506 24.523 -3.572 298 H ASP 46 H ASP 46 -2.061 25.601 -6.820 299 HA ASP 46 HA ASP 46 -3.619 24.050 -8.714 300 HB3 ASP 46 2HB ASP 46 -3.485 26.587 -8.575 301 H MET 47 H MET 47 -0.389 23.877 -7.609 302 HA MET 47 HA MET 47 0.734 23.347 -10.293 303 HB3 MET 47 2HB MET 47 2.397 23.597 -7.792 304 HG3 MET 47 2HG MET 47 2.676 24.753 -10.600 305 HE1 MET 47 3HE MET 47 3.174 26.647 -7.957 306 HE2 MET 47 1HE MET 47 4.699 27.399 -8.464 307 HE3 MET 47 2HE MET 47 3.398 27.156 -9.647 308 H TYR 48 H TYR 48 2.348 21.576 -10.524 309 HA TYR 48 HA TYR 48 1.693 19.032 -9.315 310 HB3 TYR 48 2HB TYR 48 3.967 18.418 -10.333 311 HD1 TYR 48 1HD TYR 48 2.254 16.742 -11.031 312 HD2 TYR 48 2HD TYR 48 2.679 20.549 -13.008 313 HE1 TYR 48 1HE TYR 48 1.090 15.838 -13.027 314 HE2 TYR 48 2HE TYR 48 1.469 19.646 -15.003 315 HH TYR 48 HH TYR 48 0.342 17.777 -15.950 316 H LYS 49 H LYS 49 1.766 19.499 -7.054 317 HA LYS 49 HA LYS 49 4.477 19.660 -5.870 318 HB3 LYS 49 2HB LYS 49 2.262 21.663 -5.244 319 HG3 LYS 49 2HG LYS 49 5.098 21.281 -4.198 320 HD3 LYS 49 2HD LYS 49 4.758 23.455 -3.038 321 HE3 LYS 49 2HE LYS 49 5.311 24.977 -4.915 322 HZ1 LYS 49 3HZ LYS 49 6.701 22.394 -5.252 323 HZ2 LYS 49 1HZ LYS 49 7.017 23.463 -4.021 324 HZ3 LYS 49 2HZ LYS 49 7.263 23.889 -5.593 325 H THR 50 H THR 50 1.311 18.295 -5.675 326 HA THR 50 HA THR 50 0.929 18.306 -2.966 327 HB THR 50 HB THR 50 -0.625 17.913 -4.940 328 HG1 THR 50 1HG THR 50 -0.821 16.738 -2.445 329 HG21 THR 50 3HG2 THR 50 -1.237 15.699 -5.569 330 HG22 THR 50 1HG2 THR 50 -0.044 14.973 -4.480 331 HG23 THR 50 2HG2 THR 50 0.492 15.916 -5.888 332 H SER 51 H SER 51 3.645 17.158 -3.654 333 HA SER 51 HA SER 51 3.770 14.990 -1.710 334 HB3 SER 51 2HB SER 51 3.712 13.433 -3.340 335 HG SER 51 HG SER 51 4.485 15.497 -5.127 336 H ASP 52 H ASP 52 4.641 16.705 -0.553 337 HA ASP 52 HA ASP 52 7.360 16.342 -0.454 338 HB3 ASP 52 2HB ASP 52 7.544 18.272 -2.076 339 H ILE 53 H ILE 53 4.549 18.137 0.719 340 HA ILE 53 HA ILE 53 5.793 18.826 3.227 341 HB ILE 53 HB ILE 53 4.110 20.139 1.901 342 HG13 ILE 53 2HG1 ILE 53 4.798 20.519 4.309 343 HG21 ILE 53 1HG2 ILE 53 2.469 18.335 1.431 344 HG22 ILE 53 2HG2 ILE 53 2.030 18.285 3.155 345 HG23 ILE 53 3HG2 ILE 53 1.719 19.731 2.181 346 HD11 ILE 53 3HD1 ILE 53 3.141 22.254 4.688 347 HD12 ILE 53 1HD1 ILE 53 3.639 22.220 2.984 348 HD13 ILE 53 2HD1 ILE 53 2.077 21.535 3.458 349 H ALA 54 H ALA 54 4.683 18.192 5.394 350 HA ALA 54 HA ALA 54 3.823 15.325 5.339 351 HB1 ALA 54 1HB ALA 54 6.049 15.568 6.317 352 HB2 ALA 54 2HB ALA 54 5.463 16.826 7.427 353 HB3 ALA 54 3HB ALA 54 4.874 15.161 7.582 354 H LEU 55 H LEU 55 3.133 18.596 6.546 355 HA LEU 55 HA LEU 55 0.963 17.713 8.252 356 HB3 LEU 55 2HB LEU 55 0.821 20.459 8.101 357 HG LEU 55 HG LEU 55 2.590 20.618 9.769 358 HD11 LEU 55 1HD1 LEU 55 0.620 18.353 10.346 359 HD12 LEU 55 2HD1 LEU 55 0.212 20.081 10.335 360 HD13 LEU 55 3HD1 LEU 55 1.359 19.458 11.521 361 HD21 LEU 55 3HD2 LEU 55 2.884 17.602 9.580 362 HD22 LEU 55 1HD2 LEU 55 3.581 18.663 10.791 363 HD23 LEU 55 2HD2 LEU 55 4.108 18.807 9.107 364 H ASP 56 H ASP 56 -0.900 19.597 7.803 365 HA ASP 56 HA ASP 56 -2.475 20.584 6.718 366 HB3 ASP 56 2HB ASP 56 -2.086 21.264 4.363 367 H GLN 57 H GLN 57 -1.951 17.383 5.869 368 HA GLN 57 HA GLN 57 -4.888 17.188 5.237 369 HB3 GLN 57 2HB GLN 57 -4.264 14.824 4.472 370 HG3 GLN 57 2HG GLN 57 -4.802 16.565 2.801 371 HE21 GLN 57 1HE2 GLN 57 -1.135 16.232 3.136 372 HE22 GLN 57 2HE2 GLN 57 -0.862 17.816 2.438 373 H ILE 58 H ILE 58 -2.765 17.037 7.799 374 HA ILE 58 HA ILE 58 -3.617 14.370 8.762 375 HB ILE 58 HB ILE 58 -1.329 16.188 9.529 376 HG13 ILE 58 2HG1 ILE 58 -1.339 13.231 8.733 377 HG21 ILE 58 1HG2 ILE 58 -0.694 14.421 11.216 378 HG22 ILE 58 2HG2 ILE 58 -2.116 15.337 11.676 379 HG23 ILE 58 3HG2 ILE 58 -2.319 13.711 10.996 380 HD11 ILE 58 3HD1 ILE 58 -0.641 15.661 7.037 381 HD12 ILE 58 1HD1 ILE 58 -0.114 14.002 6.687 382 HD13 ILE 58 2HD1 ILE 58 -1.831 14.383 6.677 383 H GLN 59 H GLN 59 -3.358 17.741 10.183 384 HA GLN 59 HA GLN 59 -4.253 16.592 12.659 385 HB3 GLN 59 2HB GLN 59 -3.691 18.764 13.572 386 HG3 GLN 59 2HG GLN 59 -1.624 18.081 11.453 387 HE21 GLN 59 1HE2 GLN 59 -0.406 18.522 14.542 388 HE22 GLN 59 2HE2 GLN 59 -0.017 20.250 14.438 389 H GLY 60 H GLY 60 -6.509 16.129 11.426 390 HA2 GLY 60 1HA GLY 60 -8.782 16.580 11.423 391 HA3 GLY 60 2HA GLY 60 -8.501 17.963 12.497 392 H ASN 61 H ASN 61 -6.528 18.081 9.722 393 HA ASN 61 HA ASN 61 -8.415 19.644 8.045 394 HB3 ASN 61 2HB ASN 61 -6.637 19.305 6.272 395 HD21 ASN 61 1HD2 ASN 61 -7.662 21.610 7.538 396 HD22 ASN 61 2HD2 ASN 61 -6.292 22.563 8.033 397 H LYS 62 H LYS 62 -8.834 18.476 5.782 398 HA LYS 62 HA LYS 62 -8.799 15.602 6.013 399 HB3 LYS 62 2HB LYS 62 -11.500 16.853 5.437 400 HG3 LYS 62 2HG LYS 62 -11.286 14.360 5.214 401 HD3 LYS 62 2HD LYS 62 -10.550 14.589 8.158 402 HE3 LYS 62 2HE LYS 62 -11.333 12.136 6.524 403 HZ1 LYS 62 3HZ LYS 62 -10.268 12.396 9.265 404 HZ2 LYS 62 1HZ LYS 62 -9.570 11.597 7.982 405 HZ3 LYS 62 2HZ LYS 62 -10.962 11.038 8.682 406 H ASP 63 H ASP 63 -10.127 14.807 4.014 407 HA ASP 63 HA ASP 63 -10.147 14.426 1.822 408 HB3 ASP 63 2HB ASP 63 -9.960 16.127 0.134 409 H PHE 64 H PHE 64 -8.502 14.283 -0.099 410 HA PHE 64 HA PHE 64 -5.782 14.957 0.346 411 HB3 PHE 64 2HB PHE 64 -5.456 13.135 1.687 412 HD1 PHE 64 2HD PHE 64 -7.433 11.450 -1.091 413 HD2 PHE 64 1HD PHE 64 -6.501 11.667 3.113 414 HE1 PHE 64 2HE PHE 64 -9.079 9.707 -0.644 415 HE2 PHE 64 1HE PHE 64 -8.154 9.871 3.576 416 HZ PHE 64 HZ PHE 64 -9.456 8.877 1.697 417 HA PRO 65 HA PRO 65 -6.247 14.561 -4.031 418 HB3 PRO 65 2HB PRO 65 -4.140 15.451 -4.320 419 HG3 PRO 65 2HG PRO 65 -2.310 14.732 -2.967 420 HD3 PRO 65 2HD PRO 65 -3.987 15.330 -1.411 421 H GLU 66 H GLU 66 -7.510 13.057 -5.039 422 HA GLU 66 HA GLU 66 -7.317 10.295 -4.788 423 HB3 GLU 66 2HB GLU 66 -8.509 10.483 -7.105 424 HG3 GLU 66 2HG GLU 66 -9.648 10.152 -5.004 425 H ILE 67 H ILE 67 -6.808 8.848 -6.612 426 HA ILE 67 HA ILE 67 -4.030 9.396 -7.441 427 HB ILE 67 HB ILE 67 -3.824 6.981 -7.681 428 HG13 ILE 67 2HG1 ILE 67 -6.188 6.482 -8.308 429 HG21 ILE 67 1HG2 ILE 67 -3.364 8.199 -5.549 430 HG22 ILE 67 2HG2 ILE 67 -4.976 7.758 -4.970 431 HG23 ILE 67 3HG2 ILE 67 -3.753 6.499 -5.321 432 HD11 ILE 67 3HD1 ILE 67 -4.799 4.636 -7.610 433 HD12 ILE 67 1HD1 ILE 67 -5.229 4.903 -5.898 434 HD13 ILE 67 2HD1 ILE 67 -6.466 4.404 -7.048 435 H GLN 68 H GLN 68 -3.388 8.257 -9.501 436 HA GLN 68 HA GLN 68 -5.525 7.772 -11.451 437 HB3 GLN 68 2HB GLN 68 -3.742 8.700 -13.174 438 HG3 GLN 68 2HG GLN 68 -5.459 10.673 -11.593 439 HE21 GLN 68 1HE2 GLN 68 -3.291 11.919 -12.387 440 HE22 GLN 68 2HE2 GLN 68 -3.620 12.803 -13.848 441 H LEU 69 H LEU 69 -5.111 5.865 -12.347 442 HA LEU 69 HA LEU 69 -2.471 5.000 -13.120 443 HB3 LEU 69 2HB LEU 69 -4.275 3.520 -11.168 444 HG LEU 69 HG LEU 69 -3.015 1.815 -12.433 445 HD11 LEU 69 1HD1 LEU 69 -0.594 3.451 -11.563 446 HD12 LEU 69 2HD1 LEU 69 -1.065 3.115 -13.233 447 HD13 LEU 69 3HD1 LEU 69 -0.505 1.799 -12.195 448 HD21 LEU 69 3HD2 LEU 69 -1.930 0.980 -10.323 449 HD22 LEU 69 1HD2 LEU 69 -3.581 1.622 -10.129 450 HD23 LEU 69 2HD2 LEU 69 -2.210 2.594 -9.613 451 H ASP 70 H ASP 70 -2.842 2.828 -14.228 452 HA ASP 70 HA ASP 70 -4.880 2.878 -16.276 453 HB3 ASP 70 2HB ASP 70 -3.334 0.490 -15.431 454 H ASN 71 H ASN 71 -6.041 0.704 -16.557 455 HA ASN 71 HA ASN 71 -7.532 -0.013 -14.060 456 HB3 ASN 71 2HB ASN 71 -8.092 -0.747 -16.922 457 HD21 ASN 71 1HD2 ASN 71 -9.620 -0.557 -13.650 458 HD22 ASN 71 2HD2 ASN 71 -10.497 -2.076 -13.826 459 H ILE 72 H ILE 72 -5.699 -0.883 -13.291 460 HA ILE 72 HA ILE 72 -4.621 -3.532 -14.204 461 HB ILE 72 HB ILE 72 -4.408 -2.017 -11.565 462 HG13 ILE 72 2HG1 ILE 72 -3.346 -0.696 -13.306 463 HG21 ILE 72 1HG2 ILE 72 -4.024 -4.498 -11.389 464 HG22 ILE 72 2HG2 ILE 72 -2.658 -4.302 -12.513 465 HG23 ILE 72 3HG2 ILE 72 -2.653 -3.520 -10.915 466 HD11 ILE 72 3HD1 ILE 72 -1.199 -0.412 -12.490 467 HD12 ILE 72 1HD1 ILE 72 -2.112 -1.044 -11.097 468 HD13 ILE 72 2HD1 ILE 72 -1.027 -2.116 -12.004 469 H ASP 73 H ASP 73 -5.678 -5.252 -13.850 470 HA ASP 73 HA ASP 73 -7.926 -5.379 -11.898 471 HB3 ASP 73 2HB ASP 73 -7.176 -7.855 -13.373 472 H TYR 74 H TYR 74 -7.071 -5.531 -9.954 473 HA TYR 74 HA TYR 74 -4.447 -6.648 -9.361 474 HB3 TYR 74 2HB TYR 74 -4.983 -6.241 -7.043 475 HD1 TYR 74 2HD TYR 74 -3.398 -4.430 -7.970 476 HD2 TYR 74 1HD TYR 74 -7.691 -4.075 -8.049 477 HE1 TYR 74 2HE TYR 74 -3.193 -2.017 -8.530 478 HE2 TYR 74 1HE TYR 74 -7.508 -1.709 -8.642 479 HH TYR 74 HH TYR 74 -5.880 -0.361 -9.867 480 H ASN 75 H ASN 75 -7.496 -8.005 -9.891 481 HA ASN 75 HA ASN 75 -7.755 -9.901 -7.901 482 HB3 ASN 75 2HB ASN 75 -9.562 -10.788 -9.286 483 HD21 ASN 75 1HD2 ASN 75 -11.419 -9.698 -8.629 484 HD22 ASN 75 2HD2 ASN 75 -11.671 -7.965 -8.836 485 H ASN 76 H ASN 76 -5.783 -10.130 -10.826 486 HA ASN 76 HA ASN 76 -5.732 -13.049 -10.640 487 HB3 ASN 76 2HB ASN 76 -6.224 -12.079 -12.794 488 HD21 ASN 76 1HD2 ASN 76 -5.978 -9.760 -13.165 489 HD22 ASN 76 2HD2 ASN 76 -4.557 -9.113 -13.905 490 H TYR 77 H TYR 77 -4.263 -11.056 -8.702 491 HA TYR 77 HA TYR 77 -1.652 -12.454 -8.883 492 HB3 TYR 77 2HB TYR 77 -0.586 -10.500 -7.852 493 HD1 TYR 77 1HD TYR 77 -3.217 -8.972 -9.995 494 HD2 TYR 77 2HD TYR 77 0.802 -10.571 -9.907 495 HE1 TYR 77 1HE TYR 77 -2.905 -8.338 -12.348 496 HE2 TYR 77 2HE TYR 77 1.171 -9.804 -12.185 497 HH TYR 77 HH TYR 77 0.177 -8.644 -14.082 498 H ASP 78 H ASP 78 -0.790 -13.161 -6.903 499 HA ASP 78 HA ASP 78 -2.895 -13.646 -4.867 500 HB3 ASP 78 2HB ASP 78 -0.406 -15.308 -5.183 501 H LEU 79 H LEU 79 -0.372 -11.647 -5.351 502 HA LEU 79 HA LEU 79 0.155 -11.189 -2.491 503 HB3 LEU 79 2HB LEU 79 2.412 -11.293 -4.497 504 HG LEU 79 HG LEU 79 3.898 -11.470 -2.847 505 HD11 LEU 79 1HD1 LEU 79 3.524 -10.057 -0.940 506 HD12 LEU 79 2HD1 LEU 79 1.777 -10.077 -1.194 507 HD13 LEU 79 3HD1 LEU 79 2.867 -9.317 -2.399 508 HD21 LEU 79 3HD2 LEU 79 1.794 -12.806 -1.135 509 HD22 LEU 79 1HD2 LEU 79 3.415 -12.416 -0.542 510 HD23 LEU 79 2HD2 LEU 79 3.207 -13.536 -1.896 511 H ILE 80 H ILE 80 0.005 -8.940 -2.261 512 HA ILE 80 HA ILE 80 0.934 -7.270 -4.581 513 HB ILE 80 HB ILE 80 -1.426 -6.557 -2.805 514 HG13 ILE 80 2HG1 ILE 80 -1.991 -8.438 -4.309 515 HG21 ILE 80 1HG2 ILE 80 -0.183 -4.581 -3.621 516 HG22 ILE 80 2HG2 ILE 80 -0.208 -5.224 -5.280 517 HG23 ILE 80 3HG2 ILE 80 -1.702 -4.706 -4.494 518 HD11 ILE 80 3HD1 ILE 80 -3.723 -6.653 -4.032 519 HD12 ILE 80 1HD1 ILE 80 -3.173 -5.979 -5.593 520 HD13 ILE 80 2HD1 ILE 80 -3.828 -7.620 -5.517 521 H LEU 81 H LEU 81 2.199 -5.501 -4.102 522 HA LEU 81 HA LEU 81 3.092 -5.239 -1.261 523 HB3 LEU 81 2HB LEU 81 5.333 -4.789 -2.159 524 HG LEU 81 HG LEU 81 4.191 -7.438 -3.162 525 HD11 LEU 81 1HD1 LEU 81 6.257 -7.017 -4.330 526 HD12 LEU 81 2HD1 LEU 81 6.506 -8.269 -3.110 527 HD13 LEU 81 3HD1 LEU 81 7.087 -6.620 -2.810 528 HD21 LEU 81 3HD2 LEU 81 5.301 -8.304 -1.077 529 HD22 LEU 81 1HD2 LEU 81 3.930 -7.245 -0.771 530 HD23 LEU 81 2HD2 LEU 81 5.595 -6.629 -0.583 531 H ILE 82 H ILE 82 3.254 -3.194 -0.492 532 HA ILE 82 HA ILE 82 2.362 -0.939 -2.231 533 HB ILE 82 HB ILE 82 1.376 -1.859 0.514 534 HG13 ILE 82 2HG1 ILE 82 0.448 -3.227 -1.244 535 HG21 ILE 82 1HG2 ILE 82 -0.185 0.033 0.439 536 HG22 ILE 82 2HG2 ILE 82 1.467 0.604 0.437 537 HG23 ILE 82 3HG2 ILE 82 0.545 0.594 -1.085 538 HD11 ILE 82 3HD1 ILE 82 -1.717 -1.163 -0.748 539 HD12 ILE 82 1HD1 ILE 82 -1.888 -2.868 -1.171 540 HD13 ILE 82 2HD1 ILE 82 -1.245 -2.423 0.424 541 H GLY 83 H GLY 83 3.814 0.887 -1.998 542 HA2 GLY 83 1HA GLY 83 5.280 1.032 0.599 543 HA3 GLY 83 2HA GLY 83 6.149 1.129 -0.928 544 H SER 84 H SER 84 5.983 3.062 1.240 545 HA SER 84 HA SER 84 5.334 5.537 -0.056 546 HB3 SER 84 2HB SER 84 3.474 5.927 1.850 547 HG SER 84 HG SER 84 3.259 4.519 -0.605 548 HA PRO 85 HA PRO 85 8.054 6.854 3.122 549 HB3 PRO 85 2HB PRO 85 7.982 8.912 2.022 550 HG3 PRO 85 2HG PRO 85 5.892 9.974 1.511 551 HD3 PRO 85 2HD PRO 85 5.806 7.877 0.444 552 H VAL 86 H VAL 86 8.359 7.658 5.384 553 HA VAL 86 HA VAL 86 5.965 8.203 6.891 554 HB VAL 86 HB VAL 86 6.304 5.650 7.005 555 HG11 VAL 86 1HG1 VAL 86 7.720 4.731 8.718 556 HG12 VAL 86 2HG1 VAL 86 8.743 5.574 7.562 557 HG13 VAL 86 3HG1 VAL 86 8.371 6.327 9.121 558 HG21 VAL 86 3HG2 VAL 86 4.737 6.879 8.353 559 HG22 VAL 86 1HG2 VAL 86 5.558 5.725 9.412 560 HG23 VAL 86 2HG2 VAL 86 6.017 7.430 9.450 561 H TRP 87 H TRP 87 6.369 9.820 8.342 562 HA TRP 87 HA TRP 87 8.994 9.985 9.624 563 HB3 TRP 87 2HB TRP 87 7.912 12.373 8.114 564 HD1 TRP 87 HD TRP 87 11.536 11.195 8.692 565 HE1 TRP 87 1HE TRP 87 12.891 13.090 9.762 566 HE3 TRP 87 3HE TRP 87 7.812 14.654 9.263 567 HZ2 TRP 87 2HZ TRP 87 12.391 15.668 10.926 568 HZ3 TRP 87 3HZ TRP 87 8.302 16.856 10.295 569 HH2 TRP 87 HH TRP 87 10.589 17.371 11.121 570 H SER 88 H SER 88 5.869 11.281 9.405 571 HA SER 88 HA SER 88 5.942 11.593 12.356 572 HB3 SER 88 2HB SER 88 4.463 13.642 12.016 573 HG SER 88 HG SER 88 6.794 13.817 12.064 574 H GLY 89 H GLY 89 5.076 9.165 11.619 575 HA2 GLY 89 1HA GLY 89 3.347 7.755 12.036 576 HA3 GLY 89 2HA GLY 89 2.229 9.118 12.224 577 H TYR 90 H TYR 90 1.992 10.424 10.075 578 HA TYR 90 HA TYR 90 1.781 8.720 7.670 579 HB3 TYR 90 2HB TYR 90 -0.190 8.047 8.502 580 HD1 TYR 90 1HD TYR 90 0.124 11.544 9.965 581 HD2 TYR 90 2HD TYR 90 -1.978 7.762 10.021 582 HE1 TYR 90 1HE TYR 90 -0.940 12.168 12.070 583 HE2 TYR 90 2HE TYR 90 -3.117 8.437 12.076 584 HH TYR 90 HH TYR 90 -2.510 11.621 13.652 585 HA PRO 91 HA PRO 91 2.569 13.199 6.727 586 HB3 PRO 91 2HB PRO 91 4.879 12.902 6.815 587 HG3 PRO 91 2HG PRO 91 5.891 10.811 6.177 588 HD3 PRO 91 2HD PRO 91 4.366 10.462 7.990 589 H ALA 92 H ALA 92 1.509 10.414 4.976 590 HA ALA 92 HA ALA 92 0.777 12.012 2.601 591 HB1 ALA 92 1HB ALA 92 3.031 10.664 2.399 592 HB2 ALA 92 2HB ALA 92 1.997 9.215 2.416 593 HB3 ALA 92 3HB ALA 92 1.822 10.444 1.145 594 H THR 93 H THR 93 -1.005 10.910 1.343 595 HA THR 93 HA THR 93 -2.147 8.510 2.597 596 HB THR 93 HB THR 93 -4.463 9.627 1.942 597 HG1 THR 93 1HG THR 93 -2.924 11.874 2.818 598 HG21 THR 93 3HG2 THR 93 -4.774 10.429 4.234 599 HG22 THR 93 1HG2 THR 93 -3.030 10.316 4.521 600 HG23 THR 93 2HG2 THR 93 -3.993 8.851 4.179 601 HA PRO 94 HA PRO 94 -2.098 8.043 -2.024 602 HB3 PRO 94 2HB PRO 94 0.182 8.553 -2.381 603 HG3 PRO 94 2HG PRO 94 1.863 7.977 -0.716 604 HD3 PRO 94 2HD PRO 94 0.305 9.484 0.177 605 H ILE 95 H ILE 95 -2.020 6.322 0.892 606 HA ILE 95 HA ILE 95 -2.763 3.790 -0.506 607 HB ILE 95 HB ILE 95 -1.866 3.951 2.335 608 HG13 ILE 95 2HG1 ILE 95 0.401 3.178 1.748 609 HG21 ILE 95 1HG2 ILE 95 -2.965 1.918 1.729 610 HG22 ILE 95 2HG2 ILE 95 -1.974 1.725 0.268 611 HG23 ILE 95 3HG2 ILE 95 -1.235 1.568 1.872 612 HD11 ILE 95 3HD1 ILE 95 1.331 3.182 -0.332 613 HD12 ILE 95 1HD1 ILE 95 -0.325 2.851 -0.869 614 HD13 ILE 95 2HD1 ILE 95 0.325 4.505 -0.918 615 H LYS 96 H LYS 96 -4.587 5.560 -0.581 616 HA LYS 96 HA LYS 96 -6.602 4.576 1.374 617 HB3 LYS 96 2HB LYS 96 -7.438 7.207 0.720 618 HG3 LYS 96 2HG LYS 96 -6.694 7.783 3.057 619 HD3 LYS 96 2HD LYS 96 -8.074 5.055 2.802 620 HE3 LYS 96 2HE LYS 96 -8.216 7.126 5.030 621 HZ1 LYS 96 3HZ LYS 96 -10.126 5.617 4.826 622 HZ2 LYS 96 1HZ LYS 96 -9.286 5.346 6.197 623 HZ3 LYS 96 2HZ LYS 96 -9.136 4.303 4.964 624 H THR 97 H THR 97 -6.420 6.477 -1.720 625 HA THR 97 HA THR 97 -8.966 5.600 -2.564 626 HB THR 97 HB THR 97 -6.810 6.344 -4.512 627 HG1 THR 97 1HG THR 97 -7.759 8.460 -2.976 628 HG21 THR 97 3HG2 THR 97 -9.165 6.326 -5.210 629 HG22 THR 97 1HG2 THR 97 -8.494 7.953 -5.326 630 HG23 THR 97 2HG2 THR 97 -9.562 7.537 -3.970 631 H LEU 98 H LEU 98 -5.686 4.321 -3.117 632 HA LEU 98 HA LEU 98 -6.325 2.496 -5.162 633 HB3 LEU 98 2HB LEU 98 -4.120 2.001 -3.105 634 HG LEU 98 HG LEU 98 -2.684 1.535 -4.961 635 HD11 LEU 98 1HD1 LEU 98 -4.175 -0.358 -4.236 636 HD12 LEU 98 2HD1 LEU 98 -3.503 -0.493 -5.877 637 HD13 LEU 98 3HD1 LEU 98 -5.182 -0.016 -5.672 638 HD21 LEU 98 3HD2 LEU 98 -3.464 3.134 -6.560 639 HD22 LEU 98 1HD2 LEU 98 -4.963 2.204 -6.817 640 HD23 LEU 98 2HD2 LEU 98 -3.402 1.533 -7.307 641 H LEU 99 H LEU 99 -6.153 1.795 -1.589 642 HA LEU 99 HA LEU 99 -6.766 -0.858 -1.434 643 HB3 LEU 99 2HB LEU 99 -8.265 0.042 0.560 644 HG LEU 99 HG LEU 99 -6.414 -0.518 1.590 645 HD11 LEU 99 1HD1 LEU 99 -4.539 0.963 -0.240 646 HD12 LEU 99 2HD1 LEU 99 -4.903 -0.785 -0.286 647 HD13 LEU 99 3HD1 LEU 99 -4.141 -0.090 1.151 648 HD21 LEU 99 3HD2 LEU 99 -5.318 1.420 2.668 649 HD22 LEU 99 1HD2 LEU 99 -7.041 1.719 2.438 650 HD23 LEU 99 2HD2 LEU 99 -5.871 2.450 1.335 651 H ASP 100 H ASP 100 -9.119 1.776 -1.892 652 HA ASP 100 HA ASP 100 -11.512 0.277 -1.878 653 HB3 ASP 100 2HB ASP 100 -10.982 2.657 -3.671 654 H GLN 101 H GLN 101 -9.172 0.906 -4.496 655 HA GLN 101 HA GLN 101 -10.904 -0.200 -6.583 656 HB3 GLN 101 2HB GLN 101 -8.942 0.076 -8.028 657 HG3 GLN 101 2HG GLN 101 -8.995 2.570 -6.330 658 HE21 GLN 101 1HE2 GLN 101 -8.906 4.598 -7.688 659 HE22 GLN 101 2HE2 GLN 101 -8.244 4.444 -9.277 660 H MET 102 H MET 102 -8.488 -1.424 -4.301 661 HA MET 102 HA MET 102 -8.287 -4.012 -5.694 662 HB3 MET 102 2HB MET 102 -6.714 -4.607 -4.062 663 HG3 MET 102 2HG MET 102 -5.919 -1.769 -4.165 664 HE1 MET 102 3HE MET 102 -4.879 -4.710 -2.786 665 HE2 MET 102 1HE MET 102 -3.158 -4.298 -2.799 666 HE3 MET 102 2HE MET 102 -4.362 -3.063 -2.372 667 H LYS 103 H LYS 103 -10.878 -2.847 -4.189 668 HA LYS 103 HA LYS 103 -11.470 -4.401 -1.978 669 HB3 LYS 103 2HB LYS 103 -13.925 -4.258 -3.097 670 HG3 LYS 103 2HG LYS 103 -13.800 -1.682 -2.578 671 HD3 LYS 103 2HD LYS 103 -13.246 -3.881 -0.552 672 HE3 LYS 103 2HE LYS 103 -14.177 -1.022 -0.029 673 HZ1 LYS 103 3HZ LYS 103 -13.360 -3.196 1.814 674 HZ2 LYS 103 1HZ LYS 103 -14.908 -2.697 1.567 675 HZ3 LYS 103 2HZ LYS 103 -13.812 -1.702 2.256 676 H ASN 104 H ASN 104 -11.018 -5.726 -5.186 677 HA ASN 104 HA ASN 104 -12.178 -8.306 -4.256 678 HB3 ASN 104 2HB ASN 104 -12.865 -8.655 -6.594 679 HD21 ASN 104 1HD2 ASN 104 -13.621 -5.213 -6.191 680 HD22 ASN 104 2HD2 ASN 104 -15.229 -5.500 -5.506 681 H TYR 105 H TYR 105 -9.384 -7.230 -4.058 682 HA TYR 105 HA TYR 105 -7.774 -8.676 -5.892 683 HB3 TYR 105 2HB TYR 105 -7.204 -6.862 -4.028 684 HD1 TYR 105 1HD TYR 105 -9.019 -8.197 -2.108 685 HD2 TYR 105 2HD TYR 105 -4.739 -8.669 -2.604 686 HE1 TYR 105 1HE TYR 105 -8.859 -9.080 0.165 687 HE2 TYR 105 2HE TYR 105 -4.587 -9.515 -0.290 688 HH TYR 105 HH TYR 105 -7.260 -10.566 1.483 689 H ARG 106 H ARG 106 -6.473 -10.736 -5.305 690 HA ARG 106 HA ARG 106 -8.025 -12.657 -3.645 691 HB3 ARG 106 2HB ARG 106 -7.434 -14.246 -5.569 692 HG3 ARG 106 2HG ARG 106 -8.970 -13.159 -7.289 693 HD3 ARG 106 2HD ARG 106 -10.059 -13.514 -4.456 694 HE ARG 106 HE ARG 106 -11.571 -13.038 -6.616 695 HH11 ARG 106 1HH1 ARG 106 -11.078 -15.973 -4.642 696 HH12 ARG 106 2HH1 ARG 106 -12.498 -16.770 -5.239 697 HH21 ARG 106 1HH2 ARG 106 -13.568 -14.018 -7.237 698 HH22 ARG 106 2HH2 ARG 106 -14.039 -15.513 -6.454 699 H GLY 107 H GLY 107 -6.086 -11.955 -2.024 700 HA2 GLY 107 1HA GLY 107 -4.464 -14.157 -1.793 701 HA3 GLY 107 2HA GLY 107 -3.527 -13.064 -2.812 702 H GLU 108 H GLU 108 -2.011 -12.062 -1.635 703 HA GLU 108 HA GLU 108 -2.569 -11.468 1.228 704 HB3 GLU 108 2HB GLU 108 -0.030 -11.895 1.290 705 HG3 GLU 108 2HG GLU 108 -1.663 -14.321 0.444 706 H VAL 109 H VAL 109 -1.032 -9.708 2.094 707 HA VAL 109 HA VAL 109 -0.147 -7.818 0.038 708 HB VAL 109 HB VAL 109 -1.689 -6.812 2.415 709 HG11 VAL 109 1HG1 VAL 109 -1.203 -5.523 -0.296 710 HG12 VAL 109 2HG1 VAL 109 -1.846 -4.764 1.188 711 HG13 VAL 109 3HG1 VAL 109 -0.176 -5.265 1.123 712 HG21 VAL 109 3HG2 VAL 109 -3.685 -6.455 1.051 713 HG22 VAL 109 1HG2 VAL 109 -2.957 -7.374 -0.292 714 HG23 VAL 109 2HG2 VAL 109 -3.362 -8.160 1.258 715 H ALA 110 H ALA 110 1.709 -6.700 0.676 716 HA ALA 110 HA ALA 110 2.339 -6.575 3.550 717 HB1 ALA 110 1HB ALA 110 3.770 -8.383 2.614 718 HB2 ALA 110 2HB ALA 110 4.443 -7.217 1.461 719 HB3 ALA 110 3HB ALA 110 4.689 -6.985 3.193 720 H SER 111 H SER 111 3.950 -4.783 3.967 721 HA SER 111 HA SER 111 3.475 -2.537 2.098 722 HB3 SER 111 2HB SER 111 1.690 -2.420 3.565 723 HG SER 111 HG SER 111 2.424 -3.824 5.212 724 H PHE 112 H PHE 112 5.352 -1.499 1.610 725 HA PHE 112 HA PHE 112 7.672 -1.931 3.405 726 HB3 PHE 112 2HB PHE 112 7.785 -3.223 1.377 727 HD1 PHE 112 1HD PHE 112 5.926 -2.887 -0.326 728 HD2 PHE 112 2HD PHE 112 9.397 -0.349 -0.153 729 HE1 PHE 112 1HE PHE 112 5.418 -2.026 -2.603 730 HE2 PHE 112 2HE PHE 112 8.886 0.516 -2.424 731 HZ PHE 112 HZ PHE 112 6.889 -0.346 -3.657 732 H PHE 113 H PHE 113 7.763 -0.136 4.635 733 HA PHE 113 HA PHE 113 7.564 2.543 3.437 734 HB3 PHE 113 2HB PHE 113 6.815 2.514 5.653 735 HD1 PHE 113 1HD PHE 113 6.543 0.131 6.471 736 HD2 PHE 113 2HD PHE 113 10.146 2.405 7.116 737 HE1 PHE 113 1HE PHE 113 7.243 -1.460 8.245 738 HE2 PHE 113 2HE PHE 113 10.829 0.778 8.882 739 HZ PHE 113 HZ PHE 113 9.396 -1.158 9.414 740 H THR 114 H THR 114 9.382 3.741 2.691 741 HA THR 114 HA THR 114 12.019 2.450 3.122 742 HB THR 114 HB THR 114 12.784 2.921 0.994 743 HG1 THR 114 1HG THR 114 10.517 4.548 0.661 744 HG21 THR 114 3HG2 THR 114 11.260 0.966 1.119 745 HG22 THR 114 1HG2 THR 114 11.305 1.711 -0.491 746 HG23 THR 114 2HG2 THR 114 9.913 1.989 0.569 747 H SER 115 H SER 115 11.377 3.809 5.114 748 HA SER 115 HA SER 115 12.712 6.449 4.993 749 HB3 SER 115 2HB SER 115 10.681 7.288 6.320 750 HG SER 115 HG SER 115 10.492 8.147 4.415 751 H ALA 116 H ALA 116 13.894 6.761 6.852 752 HA ALA 116 HA ALA 116 13.061 5.520 9.375 753 HB1 ALA 116 1HB ALA 116 15.861 5.141 8.227 754 HB2 ALA 116 2HB ALA 116 15.301 4.669 9.848 755 HB3 ALA 116 3HB ALA 116 14.639 3.872 8.419 756 H GLY 117 H GLY 117 12.751 7.416 10.426 757 HA2 GLY 117 1HA GLY 117 15.039 9.302 10.694 758 HA3 GLY 117 2HA GLY 117 13.480 9.913 10.127 759 H THR 118 H THR 118 11.622 8.612 11.728 760 HA THR 118 HA THR 118 12.465 8.861 14.545 761 HB THR 118 HB THR 118 10.180 10.641 13.720 762 HG1 THR 118 1HG THR 118 12.899 11.312 13.382 763 HG21 THR 118 3HG2 THR 118 12.442 11.045 15.729 764 HG22 THR 118 1HG2 THR 118 10.865 10.331 16.129 765 HG23 THR 118 2HG2 THR 118 10.950 11.999 15.573 766 H ASN 119 H ASN 119 10.831 6.970 12.455 767 HA ASN 119 HA ASN 119 8.447 6.402 14.163 768 HB3 ASN 119 2HB ASN 119 8.049 7.288 11.305 769 HD21 ASN 119 1HD2 ASN 119 6.794 8.107 14.664 770 HD22 ASN 119 2HD2 ASN 119 5.150 7.865 14.142 771 H HIS 120 H HIS 120 8.184 4.272 14.094 772 HA HIS 120 HA HIS 120 8.407 2.812 11.538 773 HB3 HIS 120 2HB HIS 120 9.862 2.129 14.101 774 HD1 HIS 120 1HD HIS 120 10.498 -0.394 14.619 775 HD2 HIS 120 2HD HIS 120 8.186 0.198 11.125 776 HE1 HIS 120 1HE HIS 120 9.712 -2.678 13.886 777 H LYS 121 H LYS 121 7.751 2.125 15.054 778 HA LYS 121 HA LYS 121 5.816 0.197 14.460 779 HB3 LYS 121 2HB LYS 121 5.309 1.636 16.997 780 HG3 LYS 121 2HG LYS 121 5.738 -0.452 18.056 781 HD3 LYS 121 2HD LYS 121 4.375 -1.282 15.468 782 HE3 LYS 121 2HE LYS 121 3.930 -2.114 18.369 783 HZ1 LYS 121 3HZ LYS 121 2.850 -3.976 17.371 784 HZ2 LYS 121 1HZ LYS 121 3.221 -3.484 15.855 785 HZ3 LYS 121 2HZ LYS 121 2.138 -2.615 16.780 786 H ALA 122 H ALA 122 5.466 3.734 14.708 787 HA ALA 122 HA ALA 122 2.650 3.896 14.867 788 HB1 ALA 122 1HB ALA 122 3.042 6.101 13.801 789 HB2 ALA 122 2HB ALA 122 4.182 5.796 15.132 790 HB3 ALA 122 3HB ALA 122 4.707 5.594 13.442 791 H TYR 123 H TYR 123 4.783 3.348 11.994 792 HA TYR 123 HA TYR 123 2.865 3.881 9.983 793 HB3 TYR 123 2HB TYR 123 5.132 1.841 9.912 794 HD1 TYR 123 1HD TYR 123 4.310 4.655 7.605 795 HD2 TYR 123 2HD TYR 123 4.203 0.385 8.173 796 HE1 TYR 123 1HE TYR 123 4.068 4.348 5.167 797 HE2 TYR 123 2HE TYR 123 3.864 0.071 5.747 798 HH TYR 123 HH TYR 123 3.070 1.464 3.706 799 H VAL 124 H VAL 124 3.680 0.875 11.745 800 HA VAL 124 HA VAL 124 2.032 -0.923 10.340 801 HB VAL 124 HB VAL 124 2.669 -0.938 13.328 802 HG11 VAL 124 1HG1 VAL 124 2.138 -3.220 11.390 803 HG12 VAL 124 2HG1 VAL 124 2.565 -3.387 13.099 804 HG13 VAL 124 3HG1 VAL 124 1.038 -2.632 12.653 805 HG21 VAL 124 3HG2 VAL 124 4.669 -2.420 12.481 806 HG22 VAL 124 1HG2 VAL 124 4.436 -1.597 10.947 807 HG23 VAL 124 2HG2 VAL 124 4.839 -0.663 12.392 808 H SER 125 H SER 125 1.320 0.960 13.351 809 HA SER 125 HA SER 125 -1.297 -0.030 13.634 810 HB3 SER 125 2HB SER 125 -1.361 2.142 15.047 811 HG SER 125 HG SER 125 -0.462 1.077 16.637 812 H HIS 126 H HIS 126 -0.019 3.062 12.211 813 HA HIS 126 HA HIS 126 -2.546 4.163 11.571 814 HB3 HIS 126 2HB HIS 126 -1.218 5.591 9.993 815 HD1 HIS 126 1HD HIS 126 -2.473 6.104 12.851 816 HD2 HIS 126 2HD HIS 126 1.584 6.325 11.798 817 HE1 HIS 126 1HE HIS 126 -1.356 7.601 14.593 818 H PHE 127 H PHE 127 -0.298 2.179 9.544 819 HA PHE 127 HA PHE 127 -1.845 2.235 7.180 820 HB3 PHE 127 2HB PHE 127 -0.064 0.021 8.291 821 HD1 PHE 127 2HD PHE 127 -1.634 1.480 5.148 822 HD2 PHE 127 1HD PHE 127 0.312 -1.912 6.998 823 HE1 PHE 127 2HE PHE 127 -2.121 0.098 3.172 824 HE2 PHE 127 1HE PHE 127 -0.210 -3.274 5.042 825 HZ PHE 127 HZ PHE 127 -1.400 -2.284 3.082 826 H ASN 128 H ASN 128 -1.870 -0.046 9.961 827 HA ASN 128 HA ASN 128 -3.802 -1.826 8.959 828 HB3 ASN 128 2HB ASN 128 -4.438 -1.826 11.634 829 HD21 ASN 128 1HD2 ASN 128 -1.456 -2.767 12.346 830 HD22 ASN 128 2HD2 ASN 128 -1.515 -4.375 11.645 831 H GLU 129 H GLU 129 -4.333 1.259 10.735 832 HA GLU 129 HA GLU 129 -7.190 0.834 10.718 833 HB3 GLU 129 2HB GLU 129 -7.251 3.243 11.387 834 HG3 GLU 129 2HG GLU 129 -6.198 3.215 13.499 835 H TRP 130 H TRP 130 -4.959 2.228 8.445 836 HA TRP 130 HA TRP 130 -7.088 3.693 7.031 837 HB3 TRP 130 2HB TRP 130 -5.120 4.443 5.661 838 HD1 TRP 130 HD TRP 130 -6.480 4.875 9.095 839 HE1 TRP 130 1HE TRP 130 -6.044 7.241 9.925 840 HE3 TRP 130 3HE TRP 130 -2.810 6.186 5.808 841 HZ2 TRP 130 2HZ TRP 130 -4.494 9.546 9.060 842 HZ3 TRP 130 3HZ TRP 130 -1.968 8.532 5.765 843 HH2 TRP 130 HH TRP 130 -2.904 10.239 7.328 844 H ALA 131 H ALA 131 -5.832 0.558 6.956 845 HA ALA 131 HA ALA 131 -6.708 0.115 4.132 846 HB1 ALA 131 1HB ALA 131 -4.223 0.280 4.429 847 HB2 ALA 131 2HB ALA 131 -4.301 -1.118 5.527 848 HB3 ALA 131 3HB ALA 131 -4.796 -1.285 3.825 849 H ASP 132 H ASP 132 -7.727 -0.516 7.089 850 HA ASP 132 HA ASP 132 -7.879 -3.327 7.401 851 HB3 ASP 132 2HB ASP 132 -9.825 -1.207 8.200 852 H GLY 133 H GLY 133 -8.387 -4.149 5.428 853 HA2 GLY 133 1HA GLY 133 -11.097 -5.005 5.098 854 HA3 GLY 133 2HA GLY 133 -10.697 -3.854 3.811 855 H LEU 134 H LEU 134 -7.779 -4.709 3.831 856 HA LEU 134 HA LEU 134 -7.942 -7.293 2.464 857 HB3 LEU 134 2HB LEU 134 -5.978 -6.506 1.355 858 HG LEU 134 HG LEU 134 -6.352 -4.328 0.492 859 HD11 LEU 134 1HD1 LEU 134 -7.556 -6.097 -0.619 860 HD12 LEU 134 2HD1 LEU 134 -8.517 -4.638 -0.672 861 HD13 LEU 134 3HD1 LEU 134 -8.935 -5.920 0.501 862 HD21 LEU 134 3HD2 LEU 134 -7.904 -2.737 0.891 863 HD22 LEU 134 1HD2 LEU 134 -7.116 -3.152 2.421 864 HD23 LEU 134 2HD2 LEU 134 -8.757 -3.732 2.082 865 H ASN 135 H ASN 135 -5.959 -8.577 2.723 866 HA ASN 135 HA ASN 135 -5.514 -9.248 5.506 867 HB3 ASN 135 2HB ASN 135 -4.047 -10.307 3.055 868 HD21 ASN 135 1HD2 ASN 135 -3.008 -12.365 3.430 869 HD22 ASN 135 2HD2 ASN 135 -2.913 -13.086 5.023 870 H VAL 136 H VAL 136 -3.218 -9.652 6.341 871 HA VAL 136 HA VAL 136 -1.144 -7.964 5.155 872 HB VAL 136 HB VAL 136 -1.876 -7.711 8.120 873 HG11 VAL 136 1HG1 VAL 136 0.359 -6.337 6.561 874 HG12 VAL 136 2HG1 VAL 136 -0.111 -5.970 8.228 875 HG13 VAL 136 3HG1 VAL 136 0.556 -7.550 7.853 876 HG21 VAL 136 3HG2 VAL 136 -3.435 -6.356 6.804 877 HG22 VAL 136 1HG2 VAL 136 -2.318 -5.321 7.682 878 HG23 VAL 136 2HG2 VAL 136 -2.065 -5.592 5.953 879 H ILE 137 H ILE 137 0.592 -9.173 4.908 880 HA ILE 137 HA ILE 137 1.387 -11.077 7.043 881 HB ILE 137 HB ILE 137 2.216 -12.597 5.216 882 HG13 ILE 137 2HG1 ILE 137 0.430 -10.893 3.436 883 HG21 ILE 137 1HG2 ILE 137 -0.767 -12.181 5.445 884 HG22 ILE 137 2HG2 ILE 137 0.045 -13.664 4.894 885 HG23 ILE 137 3HG2 ILE 137 0.278 -13.105 6.550 886 HD11 ILE 137 3HD1 ILE 137 2.826 -10.209 3.345 887 HD12 ILE 137 1HD1 ILE 137 3.255 -11.893 2.957 888 HD13 ILE 137 2HD1 ILE 137 2.267 -10.946 1.837 889 H GLY 138 H GLY 138 2.148 -8.218 5.988 890 HA2 GLY 138 1HA GLY 138 4.892 -8.530 6.833 891 HA3 GLY 138 2HA GLY 138 4.751 -8.079 5.131 892 H VAL 139 H VAL 139 5.342 -6.739 7.990 893 HA VAL 139 HA VAL 139 4.968 -4.222 6.644 894 HB VAL 139 HB VAL 139 4.434 -4.228 9.633 895 HG11 VAL 139 1HG1 VAL 139 4.071 -2.223 7.365 896 HG12 VAL 139 2HG1 VAL 139 3.417 -1.982 8.982 897 HG13 VAL 139 3HG1 VAL 139 5.174 -2.113 8.748 898 HG21 VAL 139 3HG2 VAL 139 2.510 -5.462 8.686 899 HG22 VAL 139 1HG2 VAL 139 2.061 -3.855 9.243 900 HG23 VAL 139 2HG2 VAL 139 2.245 -4.140 7.521 901 H ALA 140 H ALA 140 7.096 -3.878 6.236 902 HA ALA 140 HA ALA 140 9.119 -3.889 8.333 903 HB1 ALA 140 1HB ALA 140 9.281 -5.734 5.899 904 HB2 ALA 140 2HB ALA 140 10.555 -5.477 7.105 905 HB3 ALA 140 3HB ALA 140 9.042 -6.266 7.573 906 H ARG 141 H ARG 141 11.250 -3.000 7.281 907 HA ARG 141 HA ARG 141 10.409 -0.916 5.369 908 HB3 ARG 141 2HB ARG 141 11.985 -0.581 7.455 909 HG3 ARG 141 2HG ARG 141 14.247 -0.046 6.684 910 HD3 ARG 141 2HD ARG 141 15.072 -2.534 6.453 911 HE ARG 141 HE ARG 141 14.361 -0.981 8.706 912 HH11 ARG 141 1HH1 ARG 141 15.521 -4.265 7.873 913 HH12 ARG 141 2HH1 ARG 141 15.676 -4.745 9.519 914 HH21 ARG 141 1HH2 ARG 141 14.846 -1.544 10.804 915 HH22 ARG 141 2HH2 ARG 141 15.387 -3.167 11.213 916 H ASP 142 H ASP 142 11.598 -0.472 3.503 917 HA ASP 142 HA ASP 142 12.382 -0.970 1.396 918 HB3 ASP 142 2HB ASP 142 14.810 -1.589 1.481 919 H ASP 143 H ASP 143 14.060 -3.694 2.644 920 HA ASP 143 HA ASP 143 12.519 -5.481 0.981 921 HB3 ASP 143 2HB ASP 143 14.046 -4.695 -0.667 922 H SER 144 H SER 144 13.060 -5.169 3.893 923 HA SER 144 HA SER 144 15.244 -6.758 4.864 924 HB3 SER 144 2HB SER 144 12.643 -5.646 6.024 925 HG SER 144 HG SER 144 13.198 -7.144 7.495 926 H GLU 145 H GLU 145 12.074 -7.435 3.663 927 HA GLU 145 HA GLU 145 12.216 -10.290 4.309 928 HB3 GLU 145 2HB GLU 145 10.116 -10.372 5.334 929 HG3 GLU 145 2HG GLU 145 11.137 -7.727 6.447 930 H VAL 146 H VAL 146 12.908 -10.013 2.001 931 HA VAL 146 HA VAL 146 10.441 -9.870 0.288 932 HB VAL 146 HB VAL 146 13.366 -10.263 -0.455 933 HG11 VAL 146 1HG1 VAL 146 12.594 -9.812 -2.791 934 HG12 VAL 146 2HG1 VAL 146 11.922 -11.315 -2.146 935 HG13 VAL 146 3HG1 VAL 146 10.908 -9.862 -2.208 936 HG21 VAL 146 3HG2 VAL 146 11.535 -7.843 -0.776 937 HG22 VAL 146 1HG2 VAL 146 12.906 -7.975 0.342 938 HG23 VAL 146 2HG2 VAL 146 13.196 -7.983 -1.398 939 H ASP 147 H ASP 147 12.495 -12.266 1.844 940 HA ASP 147 HA ASP 147 11.844 -14.376 0.036 941 HB3 ASP 147 2HB ASP 147 12.653 -14.965 2.874 942 H LYS 148 H LYS 148 9.815 -13.000 2.307 943 HA LYS 148 HA LYS 148 8.208 -15.511 2.662 944 HB3 LYS 148 2HB LYS 148 8.925 -14.650 4.851 945 HG3 LYS 148 2HG LYS 148 7.486 -12.175 3.935 946 HD3 LYS 148 2HD LYS 148 6.630 -12.736 6.161 947 HE3 LYS 148 2HE LYS 148 9.564 -12.319 6.842 948 HZ1 LYS 148 3HZ LYS 148 8.888 -12.006 9.091 949 HZ2 LYS 148 1HZ LYS 148 7.287 -12.042 8.703 950 HZ3 LYS 148 2HZ LYS 148 8.258 -10.827 8.135 951 H TRP 149 H TRP 149 8.355 -12.535 0.993 952 HA TRP 149 HA TRP 149 5.397 -12.559 0.571 953 HB3 TRP 149 2HB TRP 149 5.704 -10.379 -0.436 954 HD1 TRP 149 HD TRP 149 5.424 -11.557 2.740 955 HE1 TRP 149 1HE TRP 149 5.906 -9.946 4.672 956 HE3 TRP 149 3HE TRP 149 7.736 -7.802 0.127 957 HZ2 TRP 149 2HZ TRP 149 7.377 -7.494 5.081 958 HZ3 TRP 149 3HZ TRP 149 8.710 -5.871 1.337 959 HH2 TRP 149 HH TRP 149 8.518 -5.685 3.788 960 H SER 150 H SER 150 7.170 -14.643 -0.509 961 HA SER 150 HA SER 150 6.133 -14.534 -3.235 962 HB3 SER 150 2HB SER 150 9.128 -14.755 -2.774 963 HG SER 150 HG SER 150 8.009 -15.737 -4.750 964 H LYS 151 H LYS 151 7.668 -16.392 -0.579 965 HA LYS 151 HA LYS 151 7.588 -18.889 -2.071 966 HB3 LYS 151 2HB LYS 151 7.943 -19.860 0.265 967 HG3 LYS 151 2HG LYS 151 10.100 -17.853 -0.297 968 HD3 LYS 151 2HD LYS 151 11.482 -19.876 0.080 969 HE3 LYS 151 2HE LYS 151 10.659 -18.447 2.065 970 HZ1 LYS 151 3HZ LYS 151 9.147 -20.983 2.469 971 HZ2 LYS 151 1HZ LYS 151 8.509 -19.488 2.524 972 HZ3 LYS 151 2HZ LYS 151 9.546 -20.014 3.698 Start of MODEL 15 1 H1 GLY 1 H GLY 1 -5.945 -21.951 -15.090 2 HA2 GLY 1 1HA GLY 1 -6.170 -22.993 -12.914 3 HA3 GLY 1 2HA GLY 1 -4.619 -23.477 -13.640 4 H MET 2 H MET 2 -3.306 -23.618 -11.807 5 HA MET 2 HA MET 2 -3.175 -21.559 -9.746 6 HB3 MET 2 2HB MET 2 -0.772 -22.976 -9.668 7 HG3 MET 2 2HG MET 2 -1.980 -24.493 -8.066 8 HE1 MET 2 3HE MET 2 -2.780 -24.054 -5.686 9 HE2 MET 2 1HE MET 2 -3.028 -22.451 -4.961 10 HE3 MET 2 2HE MET 2 -4.154 -23.049 -6.195 11 H ALA 3 H ALA 3 -1.873 -19.816 -9.675 12 HA ALA 3 HA ALA 3 0.761 -19.795 -10.594 13 HB1 ALA 3 1HB ALA 3 0.664 -17.770 -12.070 14 HB2 ALA 3 2HB ALA 3 -0.032 -19.193 -12.849 15 HB3 ALA 3 3HB ALA 3 -1.103 -17.944 -12.173 16 H LYS 4 H LYS 4 1.504 -18.836 -8.653 17 HA LYS 4 HA LYS 4 -0.119 -16.647 -7.500 18 HB3 LYS 4 2HB LYS 4 1.158 -16.765 -5.581 19 HG3 LYS 4 2HG LYS 4 0.813 -19.679 -6.299 20 HD3 LYS 4 2HD LYS 4 0.112 -18.215 -3.762 21 HE3 LYS 4 2HE LYS 4 0.741 -20.310 -2.660 22 HZ1 LYS 4 3HZ LYS 4 -1.004 -21.019 -4.926 23 HZ2 LYS 4 1HZ LYS 4 -1.498 -20.090 -3.691 24 HZ3 LYS 4 2HZ LYS 4 -1.055 -21.647 -3.393 25 H LYS 5 H LYS 5 0.408 -14.550 -7.938 26 HA LYS 5 HA LYS 5 3.100 -13.888 -8.996 27 HB3 LYS 5 2HB LYS 5 2.289 -12.471 -10.625 28 HG3 LYS 5 2HG LYS 5 1.527 -14.847 -11.286 29 HD3 LYS 5 2HD LYS 5 -1.013 -13.394 -10.504 30 HE3 LYS 5 2HE LYS 5 -2.273 -15.107 -11.826 31 HZ1 LYS 5 3HZ LYS 5 -1.994 -12.915 -12.767 32 HZ2 LYS 5 1HZ LYS 5 -1.944 -14.044 -13.968 33 HZ3 LYS 5 2HZ LYS 5 -0.567 -13.343 -13.485 34 H THR 6 H THR 6 3.283 -11.381 -8.911 35 HA THR 6 HA THR 6 2.394 -10.433 -6.269 36 HB THR 6 HB THR 6 5.233 -11.288 -6.850 37 HG1 THR 6 1HG THR 6 4.741 -13.020 -5.786 38 HG21 THR 6 3HG2 THR 6 5.473 -10.751 -4.321 39 HG22 THR 6 1HG2 THR 6 3.992 -9.787 -4.500 40 HG23 THR 6 2HG2 THR 6 5.435 -9.387 -5.448 41 H LEU 7 H LEU 7 1.689 -8.466 -7.045 42 HA LEU 7 HA LEU 7 3.342 -6.918 -8.952 43 HB3 LEU 7 2HB LEU 7 0.616 -6.338 -7.743 44 HG LEU 7 HG LEU 7 1.715 -4.272 -8.647 45 HD11 LEU 7 1HD1 LEU 7 1.984 -4.031 -11.111 46 HD12 LEU 7 2HD1 LEU 7 1.692 -5.768 -11.298 47 HD13 LEU 7 3HD1 LEU 7 3.122 -5.178 -10.417 48 HD21 LEU 7 3HD2 LEU 7 -0.680 -4.475 -8.667 49 HD22 LEU 7 1HD2 LEU 7 -0.612 -5.323 -10.251 50 HD23 LEU 7 2HD2 LEU 7 -0.146 -3.617 -10.113 51 H ILE 8 H ILE 8 4.113 -4.769 -8.460 52 HA ILE 8 HA ILE 8 4.305 -3.964 -5.595 53 HB ILE 8 HB ILE 8 6.353 -3.967 -7.835 54 HG13 ILE 8 2HG1 ILE 8 5.820 -6.184 -6.483 55 HG21 ILE 8 1HG2 ILE 8 6.825 -3.077 -4.981 56 HG22 ILE 8 2HG2 ILE 8 8.017 -3.103 -6.285 57 HG23 ILE 8 3HG2 ILE 8 6.677 -1.966 -6.369 58 HD11 ILE 8 3HD1 ILE 8 8.675 -5.226 -6.728 59 HD12 ILE 8 1HD1 ILE 8 8.088 -6.894 -6.640 60 HD13 ILE 8 2HD1 ILE 8 7.676 -5.885 -8.045 61 H LEU 9 H LEU 9 3.127 -2.031 -5.356 62 HA LEU 9 HA LEU 9 3.256 -0.025 -7.588 63 HB3 LEU 9 2HB LEU 9 1.449 1.071 -6.105 64 HG LEU 9 HG LEU 9 -0.429 -0.470 -6.800 65 HD11 LEU 9 1HD1 LEU 9 1.487 0.585 -8.890 66 HD12 LEU 9 2HD1 LEU 9 0.108 1.418 -8.137 67 HD13 LEU 9 3HD1 LEU 9 -0.185 0.063 -9.206 68 HD21 LEU 9 3HD2 LEU 9 -0.069 -2.180 -8.374 69 HD22 LEU 9 1HD2 LEU 9 0.868 -2.592 -6.934 70 HD23 LEU 9 2HD2 LEU 9 1.694 -1.945 -8.372 71 H TYR 10 H TYR 10 4.550 1.714 -7.283 72 HA TYR 10 HA TYR 10 5.489 2.354 -4.531 73 HB3 TYR 10 2HB TYR 10 7.153 1.005 -5.592 74 HD1 TYR 10 1HD TYR 10 6.122 0.176 -7.899 75 HD2 TYR 10 2HD TYR 10 8.610 3.670 -7.461 76 HE1 TYR 10 1HE TYR 10 6.625 0.124 -10.314 77 HE2 TYR 10 2HE TYR 10 9.194 3.564 -9.840 78 HH TYR 10 HH TYR 10 7.715 1.291 -12.168 79 H TYR 11 H TYR 11 4.115 4.066 -4.261 80 HA TYR 11 HA TYR 11 3.653 6.026 -6.360 81 HB3 TYR 11 2HB TYR 11 2.344 5.382 -3.818 82 HD1 TYR 11 2HD TYR 11 1.586 8.035 -6.290 83 HD2 TYR 11 1HD TYR 11 2.684 7.399 -2.194 84 HE1 TYR 11 2HE TYR 11 1.460 10.442 -5.915 85 HE2 TYR 11 1HE TYR 11 2.401 9.839 -1.759 86 HH TYR 11 HH TYR 11 2.186 12.094 -4.416 87 H SER 12 H SER 12 5.738 7.186 -6.579 88 HA SER 12 HA SER 12 6.309 9.396 -5.103 89 HB3 SER 12 2HB SER 12 8.665 8.719 -4.222 90 HG SER 12 HG SER 12 7.934 8.486 -2.206 91 H TRP 13 H TRP 13 5.986 9.234 -7.557 92 HA TRP 13 HA TRP 13 6.652 9.476 -9.635 93 HB3 TRP 13 2HB TRP 13 9.117 10.945 -9.053 94 HD1 TRP 13 HD TRP 13 9.111 12.395 -11.143 95 HE1 TRP 13 1HE TRP 13 7.537 14.103 -12.209 96 HE3 TRP 13 3HE TRP 13 4.920 11.513 -8.322 97 HZ2 TRP 13 2HZ TRP 13 4.860 15.089 -11.786 98 HZ3 TRP 13 3HZ TRP 13 2.906 12.932 -8.610 99 HH2 TRP 13 HH TRP 13 2.879 14.749 -10.294 100 H SER 14 H SER 14 8.908 9.772 -11.054 101 HA SER 14 HA SER 14 9.527 7.043 -11.569 102 HB3 SER 14 2HB SER 14 10.555 7.964 -13.576 103 HG SER 14 HG SER 14 8.298 8.062 -13.479 104 H GLY 15 H GLY 15 10.920 8.447 -9.049 105 HA2 GLY 15 1HA GLY 15 13.539 7.216 -9.478 106 HA3 GLY 15 2HA GLY 15 13.574 8.966 -9.542 107 H GLU 16 H GLU 16 11.282 8.796 -7.136 108 HA GLU 16 HA GLU 16 13.360 8.897 -5.119 109 HB3 GLU 16 2HB GLU 16 10.873 8.637 -3.815 110 HG3 GLU 16 2HG GLU 16 12.851 10.358 -3.543 111 H THR 17 H THR 17 10.703 6.555 -5.896 112 HA THR 17 HA THR 17 11.811 4.647 -3.946 113 HB THR 17 HB THR 17 9.544 3.530 -4.626 114 HG1 THR 17 1HG THR 17 8.058 5.039 -5.401 115 HG21 THR 17 3HG2 THR 17 9.862 4.423 -2.439 116 HG22 THR 17 1HG2 THR 17 8.359 5.105 -3.018 117 HG23 THR 17 2HG2 THR 17 9.817 6.108 -3.025 118 H LYS 18 H LYS 18 12.144 5.161 -7.254 119 HA LYS 18 HA LYS 18 11.732 2.723 -8.487 120 HB3 LYS 18 2HB LYS 18 13.907 4.806 -8.936 121 HG3 LYS 18 2HG LYS 18 13.076 2.541 -10.804 122 HD3 LYS 18 2HD LYS 18 15.021 3.682 -12.153 123 HE3 LYS 18 2HE LYS 18 12.189 4.789 -12.028 124 HZ1 LYS 18 3HZ LYS 18 14.313 5.199 -14.016 125 HZ2 LYS 18 1HZ LYS 18 13.358 6.328 -13.295 126 HZ3 LYS 18 2HZ LYS 18 12.722 5.282 -14.413 127 H LYS 19 H LYS 19 14.781 3.679 -6.824 128 HA LYS 19 HA LYS 19 16.170 1.297 -7.231 129 HB3 LYS 19 2HB LYS 19 17.066 3.420 -6.362 130 HG3 LYS 19 2HG LYS 19 15.162 3.608 -4.436 131 HD3 LYS 19 2HD LYS 19 17.623 2.595 -2.950 132 HE3 LYS 19 2HE LYS 19 14.943 3.661 -1.954 133 HZ1 LYS 19 3HZ LYS 19 17.097 2.220 -0.546 134 HZ2 LYS 19 1HZ LYS 19 15.510 2.024 -0.321 135 HZ3 LYS 19 2HZ LYS 19 16.225 3.345 0.253 136 H MET 20 H MET 20 13.576 1.745 -5.171 137 HA MET 20 HA MET 20 14.176 -0.819 -3.810 138 HB3 MET 20 2HB MET 20 12.199 0.903 -2.443 139 HG3 MET 20 2HG MET 20 13.261 0.223 -0.518 140 HE1 MET 20 3HE MET 20 15.860 -1.433 -2.641 141 HE2 MET 20 1HE MET 20 16.044 -1.868 -0.915 142 HE3 MET 20 2HE MET 20 15.734 -3.148 -2.120 143 H ALA 21 H ALA 21 12.579 0.163 -6.307 144 HA ALA 21 HA ALA 21 10.233 -1.644 -5.841 145 HB1 ALA 21 1HB ALA 21 9.293 -0.675 -7.873 146 HB2 ALA 21 2HB ALA 21 9.679 0.604 -6.703 147 HB3 ALA 21 3HB ALA 21 10.735 0.338 -8.108 148 H GLU 22 H GLU 22 12.936 -0.884 -8.172 149 HA GLU 22 HA GLU 22 12.211 -3.117 -9.810 150 HB3 GLU 22 2HB GLU 22 14.331 -2.705 -10.972 151 HG3 GLU 22 2HG GLU 22 13.053 -0.041 -10.296 152 H LYS 23 H LYS 23 14.549 -2.782 -7.193 153 HA LYS 23 HA LYS 23 15.956 -5.211 -7.529 154 HB3 LYS 23 2HB LYS 23 16.091 -4.910 -4.913 155 HG3 LYS 23 2HG LYS 23 17.860 -4.432 -6.764 156 HD3 LYS 23 2HD LYS 23 17.993 -1.636 -5.960 157 HE3 LYS 23 2HE LYS 23 18.031 -1.184 -8.412 158 HZ1 LYS 23 3HZ LYS 23 20.046 -1.922 -7.196 159 HZ2 LYS 23 1HZ LYS 23 20.079 -2.211 -8.796 160 HZ3 LYS 23 2HZ LYS 23 19.802 -3.450 -7.754 161 H ILE 24 H ILE 24 13.194 -4.533 -5.332 162 HA ILE 24 HA ILE 24 12.710 -7.151 -4.475 163 HB ILE 24 HB ILE 24 10.795 -4.801 -4.955 164 HG13 ILE 24 2HG1 ILE 24 12.593 -4.184 -3.446 165 HG21 ILE 24 1HG2 ILE 24 10.322 -7.194 -3.142 166 HG22 ILE 24 2HG2 ILE 24 9.217 -5.819 -3.428 167 HG23 ILE 24 3HG2 ILE 24 9.546 -6.944 -4.717 168 HD11 ILE 24 3HD1 ILE 24 10.249 -3.507 -2.742 169 HD12 ILE 24 1HD1 ILE 24 10.286 -4.880 -1.603 170 HD13 ILE 24 2HD1 ILE 24 11.467 -3.591 -1.453 171 H ASN 25 H ASN 25 11.369 -5.466 -7.368 172 HA ASN 25 HA ASN 25 9.692 -7.560 -8.227 173 HB3 ASN 25 2HB ASN 25 11.190 -5.437 -9.822 174 HD21 ASN 25 1HD2 ASN 25 8.283 -7.672 -9.832 175 HD22 ASN 25 2HD2 ASN 25 8.525 -7.959 -11.530 176 H SER 26 H SER 26 13.115 -7.434 -8.384 177 HA SER 26 HA SER 26 13.423 -9.519 -10.372 178 HB3 SER 26 2HB SER 26 15.833 -9.008 -9.024 179 HG SER 26 HG SER 26 16.032 -7.614 -10.975 180 H GLU 27 H GLU 27 13.238 -9.283 -6.848 181 HA GLU 27 HA GLU 27 14.682 -11.783 -6.349 182 HB3 GLU 27 2HB GLU 27 14.271 -11.161 -3.965 183 HG3 GLU 27 2HG GLU 27 15.207 -8.656 -5.334 184 H ILE 28 H ILE 28 11.702 -11.360 -7.559 185 HA ILE 28 HA ILE 28 10.345 -13.379 -5.828 186 HB ILE 28 HB ILE 28 9.297 -10.785 -6.996 187 HG13 ILE 28 2HG1 ILE 28 10.686 -10.534 -4.887 188 HG21 ILE 28 1HG2 ILE 28 7.857 -12.882 -5.312 189 HG22 ILE 28 2HG2 ILE 28 7.171 -11.358 -5.881 190 HG23 ILE 28 3HG2 ILE 28 7.572 -12.591 -7.038 191 HD11 ILE 28 3HD1 ILE 28 9.164 -9.114 -3.756 192 HD12 ILE 28 1HD1 ILE 28 8.768 -9.008 -5.483 193 HD13 ILE 28 2HD1 ILE 28 7.758 -9.962 -4.372 194 H LYS 29 H LYS 29 9.159 -14.921 -6.950 195 HA LYS 29 HA LYS 29 9.529 -15.149 -9.821 196 HB3 LYS 29 2HB LYS 29 7.576 -16.986 -8.890 197 HG3 LYS 29 2HG LYS 29 9.511 -17.389 -10.475 198 HD3 LYS 29 2HD LYS 29 11.074 -17.930 -7.913 199 HE3 LYS 29 2HE LYS 29 11.957 -17.644 -10.821 200 HZ1 LYS 29 3HZ LYS 29 14.016 -18.407 -10.039 201 HZ2 LYS 29 1HZ LYS 29 13.432 -18.794 -8.555 202 HZ3 LYS 29 2HZ LYS 29 13.592 -17.207 -8.991 203 H ASP 30 H ASP 30 8.140 -14.678 -11.369 204 HA ASP 30 HA ASP 30 6.381 -14.042 -12.557 205 HB3 ASP 30 2HB ASP 30 4.294 -14.766 -10.563 206 H SER 31 H SER 31 7.607 -12.210 -10.426 207 HA SER 31 HA SER 31 5.498 -10.555 -9.469 208 HB3 SER 31 2HB SER 31 8.463 -9.970 -9.758 209 HG SER 31 HG SER 31 6.426 -8.822 -8.144 210 H GLU 32 H GLU 32 5.269 -8.245 -9.933 211 HA GLU 32 HA GLU 32 6.361 -7.153 -12.374 212 HB3 GLU 32 2HB GLU 32 3.896 -5.991 -12.580 213 HG3 GLU 32 2HG GLU 32 4.386 -8.595 -13.931 214 H LEU 33 H LEU 33 5.854 -4.717 -12.350 215 HA LEU 33 HA LEU 33 5.220 -3.678 -9.735 216 HB3 LEU 33 2HB LEU 33 7.700 -3.703 -10.095 217 HG LEU 33 HG LEU 33 7.165 -1.420 -12.060 218 HD11 LEU 33 1HD1 LEU 33 9.008 -1.088 -10.412 219 HD12 LEU 33 2HD1 LEU 33 9.609 -1.209 -12.069 220 HD13 LEU 33 3HD1 LEU 33 9.762 -2.597 -10.965 221 HD21 LEU 33 3HD2 LEU 33 7.036 -3.489 -13.367 222 HD22 LEU 33 1HD2 LEU 33 8.513 -4.103 -12.594 223 HD23 LEU 33 2HD2 LEU 33 8.565 -2.691 -13.671 224 H LYS 34 H LYS 34 4.295 -1.418 -9.969 225 HA LYS 34 HA LYS 34 3.437 -0.586 -12.660 226 HB3 LYS 34 2HB LYS 34 1.061 -0.353 -11.207 227 HG3 LYS 34 2HG LYS 34 0.248 -2.405 -12.427 228 HD3 LYS 34 2HD LYS 34 1.729 -0.394 -14.154 229 HE3 LYS 34 2HE LYS 34 -0.415 -0.605 -15.531 230 HZ1 LYS 34 3HZ LYS 34 1.003 -3.179 -15.520 231 HZ2 LYS 34 1HZ LYS 34 1.711 -1.779 -16.089 232 HZ3 LYS 34 2HZ LYS 34 0.333 -2.342 -16.761 233 H GLU 35 H GLU 35 2.210 1.562 -12.494 234 HA GLU 35 HA GLU 35 3.673 3.213 -10.539 235 HB3 GLU 35 2HB GLU 35 4.136 3.688 -12.863 236 HG3 GLU 35 2HG GLU 35 1.181 4.442 -13.141 237 H VAL 36 H VAL 36 2.731 4.806 -9.344 238 HA VAL 36 HA VAL 36 -0.165 5.111 -9.162 239 HB VAL 36 HB VAL 36 0.380 3.416 -7.546 240 HG11 VAL 36 1HG1 VAL 36 2.018 3.697 -5.790 241 HG12 VAL 36 2HG1 VAL 36 2.269 2.906 -7.321 242 HG13 VAL 36 3HG1 VAL 36 2.876 4.501 -7.216 243 HG21 VAL 36 3HG2 VAL 36 -0.121 6.012 -6.212 244 HG22 VAL 36 1HG2 VAL 36 -1.305 4.852 -6.799 245 HG23 VAL 36 2HG2 VAL 36 -0.261 4.418 -5.448 246 H LYS 37 H LYS 37 -0.798 7.196 -8.777 247 HA LYS 37 HA LYS 37 1.124 9.319 -8.103 248 HB3 LYS 37 2HB LYS 37 -0.021 10.601 -10.066 249 HG3 LYS 37 2HG LYS 37 1.974 8.366 -10.664 250 HD3 LYS 37 2HD LYS 37 1.184 10.904 -12.126 251 HE3 LYS 37 2HE LYS 37 3.390 8.917 -12.815 252 HZ1 LYS 37 3HZ LYS 37 4.017 10.754 -14.275 253 HZ2 LYS 37 1HZ LYS 37 2.691 11.594 -13.845 254 HZ3 LYS 37 2HZ LYS 37 2.490 10.176 -14.664 255 H VAL 38 H VAL 38 -0.588 11.476 -8.248 256 HA VAL 38 HA VAL 38 -3.024 10.660 -6.796 257 HB VAL 38 HB VAL 38 -2.648 12.768 -5.388 258 HG11 VAL 38 1HG1 VAL 38 -1.332 11.486 -3.721 259 HG12 VAL 38 2HG1 VAL 38 -2.643 10.543 -4.449 260 HG13 VAL 38 3HG1 VAL 38 -0.970 10.267 -4.959 261 HG21 VAL 38 3HG2 VAL 38 -0.311 13.374 -4.920 262 HG22 VAL 38 1HG2 VAL 38 0.273 12.303 -6.190 263 HG23 VAL 38 2HG2 VAL 38 -0.711 13.713 -6.611 264 H SER 39 H SER 39 -4.806 11.971 -7.110 265 HA SER 39 HA SER 39 -5.088 13.480 -9.564 266 HB3 SER 39 2HB SER 39 -6.913 13.120 -7.171 267 HG SER 39 HG SER 39 -8.434 13.967 -8.298 268 H GLU 40 H GLU 40 -5.158 15.599 -9.720 269 HA GLU 40 HA GLU 40 -4.090 17.241 -7.453 270 HB3 GLU 40 2HB GLU 40 -3.120 18.679 -9.317 271 HG3 GLU 40 2HG GLU 40 -2.098 15.833 -9.067 272 H GLY 41 H GLY 41 -4.532 19.720 -8.053 273 HA2 GLY 41 1HA GLY 41 -6.043 21.125 -9.339 274 HA3 GLY 41 2HA GLY 41 -7.370 20.045 -8.913 275 H THR 42 H THR 42 -7.189 22.851 -8.405 276 HA THR 42 HA THR 42 -8.478 22.939 -5.994 277 HB THR 42 HB THR 42 -6.238 22.809 -4.901 278 HG1 THR 42 1HG THR 42 -6.524 24.705 -3.631 279 HG21 THR 42 3HG2 THR 42 -5.655 25.515 -6.167 280 HG22 THR 42 1HG2 THR 42 -4.874 23.991 -6.639 281 HG23 THR 42 2HG2 THR 42 -4.665 24.617 -4.996 282 H PHE 43 H PHE 43 -8.889 25.392 -5.497 283 HA PHE 43 HA PHE 43 -8.573 27.193 -7.792 284 HB3 PHE 43 2HB PHE 43 -11.000 27.793 -7.770 285 HD1 PHE 43 1HD PHE 43 -10.232 27.528 -10.100 286 HD2 PHE 43 2HD PHE 43 -11.362 24.138 -7.679 287 HE1 PHE 43 1HE PHE 43 -10.474 26.132 -12.149 288 HE2 PHE 43 2HE PHE 43 -11.587 22.763 -9.713 289 HZ PHE 43 HZ PHE 43 -11.149 23.772 -11.968 290 H ASP 44 H ASP 44 -7.367 27.051 -5.149 291 HA ASP 44 HA ASP 44 -8.157 29.692 -4.224 292 HB3 ASP 44 2HB ASP 44 -7.745 27.491 -2.174 293 H ALA 45 H ALA 45 -6.261 29.908 -2.193 294 HA ALA 45 HA ALA 45 -3.865 30.242 -3.751 295 HB1 ALA 45 1HB ALA 45 -4.334 30.529 -0.746 296 HB2 ALA 45 2HB ALA 45 -2.973 31.183 -1.675 297 HB3 ALA 45 3HB ALA 45 -4.601 31.806 -1.953 298 H ASP 46 H ASP 46 -1.725 29.512 -2.594 299 HA ASP 46 HA ASP 46 -0.300 27.816 -2.844 300 HB3 ASP 46 2HB ASP 46 -0.655 26.082 -0.862 301 H MET 47 H MET 47 -0.846 27.357 -4.817 302 HA MET 47 HA MET 47 -2.895 25.609 -5.665 303 HB3 MET 47 2HB MET 47 -0.463 26.524 -7.243 304 HG3 MET 47 2HG MET 47 -3.257 25.631 -7.902 305 HE1 MET 47 3HE MET 47 -4.510 29.037 -9.074 306 HE2 MET 47 1HE MET 47 -4.871 27.511 -8.243 307 HE3 MET 47 2HE MET 47 -3.709 28.651 -7.536 308 H TYR 48 H TYR 48 -0.415 24.580 -3.958 309 HA TYR 48 HA TYR 48 -0.106 21.962 -5.259 310 HB3 TYR 48 2HB TYR 48 2.039 22.882 -5.570 311 HD1 TYR 48 2HD TYR 48 2.394 22.877 -1.870 312 HD2 TYR 48 1HD TYR 48 2.506 25.257 -5.466 313 HE1 TYR 48 2HE TYR 48 3.017 24.837 -0.530 314 HE2 TYR 48 1HE TYR 48 3.288 27.225 -4.110 315 HH TYR 48 HH TYR 48 2.672 27.337 -0.812 316 H LYS 49 H LYS 49 -1.640 20.910 -4.076 317 HA LYS 49 HA LYS 49 -1.399 20.901 -1.148 318 HB3 LYS 49 2HB LYS 49 -2.957 22.700 -1.424 319 HG3 LYS 49 2HG LYS 49 -4.184 21.093 -3.547 320 HD3 LYS 49 2HD LYS 49 -5.826 20.484 -1.844 321 HE3 LYS 49 2HE LYS 49 -6.629 23.402 -1.579 322 HZ1 LYS 49 3HZ LYS 49 -7.101 21.039 0.128 323 HZ2 LYS 49 1HZ LYS 49 -8.230 21.710 -0.897 324 HZ3 LYS 49 2HZ LYS 49 -7.690 22.508 0.419 325 H THR 50 H THR 50 -0.462 18.926 -2.561 326 HA THR 50 HA THR 50 -2.464 16.762 -2.547 327 HB THR 50 HB THR 50 -1.127 17.613 -5.152 328 HG1 THR 50 1HG THR 50 -3.521 18.352 -3.976 329 HG21 THR 50 3HG2 THR 50 -2.635 16.045 -6.216 330 HG22 THR 50 1HG2 THR 50 -3.406 15.661 -4.658 331 HG23 THR 50 2HG2 THR 50 -1.727 15.199 -4.976 332 H SER 51 H SER 51 0.963 17.722 -3.276 333 HA SER 51 HA SER 51 1.753 14.876 -2.991 334 HB3 SER 51 2HB SER 51 3.161 17.078 -4.535 335 HG SER 51 HG SER 51 4.104 14.825 -4.033 336 H ASP 52 H ASP 52 1.414 16.709 -0.672 337 HA ASP 52 HA ASP 52 4.200 17.309 0.056 338 HB3 ASP 52 2HB ASP 52 2.696 17.874 2.308 339 H ILE 53 H ILE 53 5.120 16.479 1.975 340 HA ILE 53 HA ILE 53 3.843 14.126 3.249 341 HB ILE 53 HB ILE 53 5.970 12.915 3.277 342 HG13 ILE 53 2HG1 ILE 53 7.341 15.153 2.565 343 HG21 ILE 53 1HG2 ILE 53 4.224 12.417 1.631 344 HG22 ILE 53 2HG2 ILE 53 4.991 13.557 0.486 345 HG23 ILE 53 3HG2 ILE 53 5.852 12.093 0.977 346 HD11 ILE 53 3HD1 ILE 53 8.402 13.054 3.323 347 HD12 ILE 53 1HD1 ILE 53 8.143 12.339 1.711 348 HD13 ILE 53 2HD1 ILE 53 9.227 13.730 1.904 349 H ALA 54 H ALA 54 3.552 16.441 4.511 350 HA ALA 54 HA ALA 54 4.927 15.702 6.961 351 HB1 ALA 54 1HB ALA 54 5.718 17.996 7.520 352 HB2 ALA 54 2HB ALA 54 6.625 17.243 6.211 353 HB3 ALA 54 3HB ALA 54 5.402 18.485 5.845 354 H LEU 55 H LEU 55 2.759 15.097 7.484 355 HA LEU 55 HA LEU 55 0.868 15.236 8.500 356 HB3 LEU 55 2HB LEU 55 1.452 17.920 9.685 357 HG LEU 55 HG LEU 55 0.435 15.241 10.536 358 HD11 LEU 55 1HD1 LEU 55 2.602 15.273 11.752 359 HD12 LEU 55 2HD1 LEU 55 1.206 15.360 12.840 360 HD13 LEU 55 3HD1 LEU 55 2.150 16.821 12.475 361 HD21 LEU 55 3HD2 LEU 55 0.102 18.044 11.698 362 HD22 LEU 55 1HD2 LEU 55 -0.730 16.596 12.282 363 HD23 LEU 55 2HD2 LEU 55 -1.064 17.212 10.660 364 H ASP 56 H ASP 56 1.016 17.013 5.808 365 HA ASP 56 HA ASP 56 -0.976 18.942 6.495 366 HB3 ASP 56 2HB ASP 56 0.039 18.565 3.683 367 H GLN 57 H GLN 57 -1.536 15.832 5.839 368 HA GLN 57 HA GLN 57 -4.220 16.457 4.685 369 HB3 GLN 57 2HB GLN 57 -2.923 13.788 4.140 370 HG3 GLN 57 2HG GLN 57 -5.256 14.418 3.371 371 HE21 GLN 57 1HE2 GLN 57 -6.470 16.255 2.915 372 HE22 GLN 57 2HE2 GLN 57 -5.860 17.597 1.935 373 H ILE 58 H ILE 58 -3.421 16.255 7.530 374 HA ILE 58 HA ILE 58 -5.021 13.860 8.304 375 HB ILE 58 HB ILE 58 -2.338 14.531 9.591 376 HG13 ILE 58 2HG1 ILE 58 -3.070 12.461 7.499 377 HG21 ILE 58 1HG2 ILE 58 -4.017 12.022 9.897 378 HG22 ILE 58 2HG2 ILE 58 -2.732 12.652 10.944 379 HG23 ILE 58 3HG2 ILE 58 -4.313 13.424 10.949 380 HD11 ILE 58 3HD1 ILE 58 -0.321 13.562 8.007 381 HD12 ILE 58 1HD1 ILE 58 -1.031 12.993 6.486 382 HD13 ILE 58 2HD1 ILE 58 -1.467 14.582 7.136 383 H GLN 59 H GLN 59 -3.218 16.312 10.240 384 HA GLN 59 HA GLN 59 -5.642 16.348 11.903 385 HB3 GLN 59 2HB GLN 59 -4.163 17.315 13.639 386 HG3 GLN 59 2HG GLN 59 -3.036 14.818 12.295 387 HE21 GLN 59 1HE2 GLN 59 -3.261 16.391 15.595 388 HE22 GLN 59 2HE2 GLN 59 -1.621 15.876 15.995 389 H GLY 60 H GLY 60 -6.956 17.613 10.814 390 HA2 GLY 60 1HA GLY 60 -7.715 20.073 11.063 391 HA3 GLY 60 2HA GLY 60 -6.140 20.447 10.340 392 H ASN 61 H ASN 61 -5.682 18.569 8.525 393 HA ASN 61 HA ASN 61 -7.630 19.525 6.483 394 HB3 ASN 61 2HB ASN 61 -5.970 18.695 4.833 395 HD21 ASN 61 1HD2 ASN 61 -3.494 19.970 4.857 396 HD22 ASN 61 2HD2 ASN 61 -3.638 21.611 5.454 397 H LYS 62 H LYS 62 -9.312 18.298 7.207 398 HA LYS 62 HA LYS 62 -9.407 15.397 6.993 399 HB3 LYS 62 2HB LYS 62 -11.929 15.898 6.834 400 HG3 LYS 62 2HG LYS 62 -10.399 16.862 9.284 401 HD3 LYS 62 2HD LYS 62 -13.316 16.187 8.761 402 HE3 LYS 62 2HE LYS 62 -12.637 14.759 10.631 403 HZ1 LYS 62 3HZ LYS 62 -11.981 15.812 12.688 404 HZ2 LYS 62 1HZ LYS 62 -11.872 17.256 12.024 405 HZ3 LYS 62 2HZ LYS 62 -10.787 16.060 11.574 406 H ASP 63 H ASP 63 -10.382 14.260 5.309 407 HA ASP 63 HA ASP 63 -10.767 13.577 3.244 408 HB3 ASP 63 2HB ASP 63 -10.778 16.391 2.108 409 H PHE 64 H PHE 64 -9.566 13.449 1.054 410 HA PHE 64 HA PHE 64 -6.830 14.402 1.095 411 HB3 PHE 64 2HB PHE 64 -6.257 12.665 2.508 412 HD1 PHE 64 1HD PHE 64 -8.077 10.534 0.057 413 HD2 PHE 64 2HD PHE 64 -7.500 11.638 4.168 414 HE1 PHE 64 1HE PHE 64 -9.707 8.776 0.765 415 HE2 PHE 64 2HE PHE 64 -9.105 9.875 4.890 416 HZ PHE 64 HZ PHE 64 -10.273 8.495 3.168 417 HA PRO 65 HA PRO 65 -7.612 13.898 -3.171 418 HB3 PRO 65 2HB PRO 65 -5.708 15.186 -3.528 419 HG3 PRO 65 2HG PRO 65 -3.744 14.845 -2.272 420 HD3 PRO 65 2HD PRO 65 -5.374 15.001 -0.557 421 H GLU 66 H GLU 66 -7.749 12.336 -4.966 422 HA GLU 66 HA GLU 66 -7.768 9.616 -4.134 423 HB3 GLU 66 2HB GLU 66 -8.593 11.460 -6.399 424 HG3 GLU 66 2HG GLU 66 -8.215 8.490 -6.668 425 H ILE 67 H ILE 67 -6.612 8.072 -5.427 426 HA ILE 67 HA ILE 67 -3.911 8.899 -6.260 427 HB ILE 67 HB ILE 67 -3.483 6.459 -6.474 428 HG13 ILE 67 2HG1 ILE 67 -6.364 6.246 -5.751 429 HG21 ILE 67 1HG2 ILE 67 -3.110 6.158 -4.088 430 HG22 ILE 67 2HG2 ILE 67 -2.729 7.813 -4.580 431 HG23 ILE 67 3HG2 ILE 67 -4.241 7.474 -3.707 432 HD11 ILE 67 3HD1 ILE 67 -4.291 4.159 -6.477 433 HD12 ILE 67 1HD1 ILE 67 -6.064 3.965 -6.476 434 HD13 ILE 67 2HD1 ILE 67 -5.288 5.059 -7.636 435 H GLN 68 H GLN 68 -3.383 8.870 -8.280 436 HA GLN 68 HA GLN 68 -5.380 8.315 -10.438 437 HB3 GLN 68 2HB GLN 68 -3.409 9.197 -11.899 438 HG3 GLN 68 2HG GLN 68 -4.887 11.217 -10.187 439 HE21 GLN 68 1HE2 GLN 68 -3.154 12.846 -10.489 440 HE22 GLN 68 2HE2 GLN 68 -2.754 13.394 -12.088 441 H LEU 69 H LEU 69 -5.041 6.550 -11.735 442 HA LEU 69 HA LEU 69 -2.446 5.567 -12.175 443 HB3 LEU 69 2HB LEU 69 -2.964 4.492 -9.905 444 HG LEU 69 HG LEU 69 -4.410 2.383 -11.509 445 HD11 LEU 69 1HD1 LEU 69 -3.042 1.907 -9.403 446 HD12 LEU 69 2HD1 LEU 69 -4.739 1.381 -9.344 447 HD13 LEU 69 3HD1 LEU 69 -4.223 2.861 -8.510 448 HD21 LEU 69 3HD2 LEU 69 -6.487 2.952 -10.159 449 HD22 LEU 69 1HD2 LEU 69 -6.107 4.128 -11.414 450 HD23 LEU 69 2HD2 LEU 69 -5.723 4.498 -9.728 451 H ASP 70 H ASP 70 -2.462 3.519 -13.379 452 HA ASP 70 HA ASP 70 -3.800 3.850 -15.863 453 HB3 ASP 70 2HB ASP 70 -2.522 1.271 -15.172 454 H ASN 71 H ASN 71 -4.683 1.495 -16.821 455 HA ASN 71 HA ASN 71 -6.948 0.771 -15.009 456 HB3 ASN 71 2HB ASN 71 -6.712 -0.495 -17.705 457 HD21 ASN 71 1HD2 ASN 71 -7.957 -2.130 -16.155 458 HD22 ASN 71 2HD2 ASN 71 -9.599 -1.705 -15.750 459 H ILE 72 H ILE 72 -5.793 -0.147 -13.479 460 HA ILE 72 HA ILE 72 -4.129 -2.548 -13.993 461 HB ILE 72 HB ILE 72 -4.745 -1.105 -11.364 462 HG13 ILE 72 2HG1 ILE 72 -3.529 0.460 -12.760 463 HG21 ILE 72 1HG2 ILE 72 -2.811 -2.349 -10.453 464 HG22 ILE 72 2HG2 ILE 72 -4.083 -3.391 -10.964 465 HG23 ILE 72 3HG2 ILE 72 -2.641 -3.217 -12.008 466 HD11 ILE 72 3HD1 ILE 72 -1.254 -0.830 -11.259 467 HD12 ILE 72 1HD1 ILE 72 -1.500 0.882 -11.657 468 HD13 ILE 72 2HD1 ILE 72 -2.529 0.082 -10.442 469 H ASP 73 H ASP 73 -4.718 -4.432 -12.766 470 HA ASP 73 HA ASP 73 -7.551 -4.734 -11.993 471 HB3 ASP 73 2HB ASP 73 -5.868 -6.592 -13.718 472 H TYR 74 H TYR 74 -7.488 -5.358 -9.882 473 HA TYR 74 HA TYR 74 -5.012 -6.227 -8.574 474 HB3 TYR 74 2HB TYR 74 -6.305 -6.162 -6.570 475 HD1 TYR 74 1HD TYR 74 -4.611 -4.128 -7.214 476 HD2 TYR 74 2HD TYR 74 -8.884 -4.072 -7.837 477 HE1 TYR 74 1HE TYR 74 -4.570 -1.668 -7.265 478 HE2 TYR 74 2HE TYR 74 -8.841 -1.624 -7.935 479 HH TYR 74 HH TYR 74 -7.397 0.358 -8.036 480 H ASN 75 H ASN 75 -7.942 -7.653 -9.862 481 HA ASN 75 HA ASN 75 -8.013 -9.892 -8.237 482 HB3 ASN 75 2HB ASN 75 -9.053 -9.962 -11.092 483 HD21 ASN 75 1HD2 ASN 75 -10.446 -9.621 -7.860 484 HD22 ASN 75 2HD2 ASN 75 -11.144 -11.249 -7.745 485 H ASN 76 H ASN 76 -6.385 -9.539 -11.352 486 HA ASN 76 HA ASN 76 -5.802 -12.341 -11.494 487 HB3 ASN 76 2HB ASN 76 -6.137 -10.761 -13.479 488 HD21 ASN 76 1HD2 ASN 76 -5.308 -8.536 -12.723 489 HD22 ASN 76 2HD2 ASN 76 -3.717 -8.032 -13.256 490 H TYR 77 H TYR 77 -4.424 -10.346 -9.308 491 HA TYR 77 HA TYR 77 -1.820 -11.782 -9.560 492 HB3 TYR 77 2HB TYR 77 -0.709 -10.095 -8.285 493 HD1 TYR 77 2HD TYR 77 0.438 -10.371 -10.582 494 HD2 TYR 77 1HD TYR 77 -2.925 -7.730 -9.959 495 HE1 TYR 77 2HE TYR 77 1.008 -9.173 -12.649 496 HE2 TYR 77 1HE TYR 77 -2.318 -6.495 -12.038 497 HH TYR 77 HH TYR 77 0.611 -7.274 -13.957 498 H ASP 78 H ASP 78 -0.920 -12.564 -7.530 499 HA ASP 78 HA ASP 78 -3.127 -13.620 -5.811 500 HB3 ASP 78 2HB ASP 78 -0.261 -14.621 -5.967 501 H LEU 79 H LEU 79 -0.168 -11.714 -5.770 502 HA LEU 79 HA LEU 79 -0.476 -10.994 -2.912 503 HB3 LEU 79 2HB LEU 79 2.270 -10.951 -3.761 504 HG LEU 79 HG LEU 79 0.743 -12.766 -1.883 505 HD11 LEU 79 1HD1 LEU 79 2.514 -14.155 -2.659 506 HD12 LEU 79 2HD1 LEU 79 3.045 -13.508 -1.104 507 HD13 LEU 79 3HD1 LEU 79 3.684 -12.816 -2.611 508 HD21 LEU 79 3HD2 LEU 79 1.984 -11.530 -0.172 509 HD22 LEU 79 1HD2 LEU 79 1.141 -10.365 -1.200 510 HD23 LEU 79 2HD2 LEU 79 2.888 -10.635 -1.406 511 H ILE 80 H ILE 80 -0.138 -8.748 -2.600 512 HA ILE 80 HA ILE 80 0.879 -7.170 -4.899 513 HB ILE 80 HB ILE 80 -1.821 -6.724 -3.570 514 HG13 ILE 80 2HG1 ILE 80 -1.960 -8.465 -5.234 515 HG21 ILE 80 1HG2 ILE 80 -2.003 -4.725 -4.971 516 HG22 ILE 80 2HG2 ILE 80 -0.541 -4.604 -4.022 517 HG23 ILE 80 3HG2 ILE 80 -0.424 -5.064 -5.733 518 HD11 ILE 80 3HD1 ILE 80 -2.933 -5.948 -6.643 519 HD12 ILE 80 1HD1 ILE 80 -3.531 -7.601 -6.818 520 HD13 ILE 80 2HD1 ILE 80 -3.792 -6.730 -5.294 521 H LEU 81 H LEU 81 2.255 -5.733 -4.289 522 HA LEU 81 HA LEU 81 2.740 -5.226 -1.412 523 HB3 LEU 81 2HB LEU 81 5.071 -5.121 -2.054 524 HG LEU 81 HG LEU 81 3.759 -7.522 -3.428 525 HD11 LEU 81 1HD1 LEU 81 6.664 -6.853 -2.957 526 HD12 LEU 81 2HD1 LEU 81 5.850 -7.394 -4.429 527 HD13 LEU 81 3HD1 LEU 81 6.091 -8.527 -3.093 528 HD21 LEU 81 3HD2 LEU 81 3.347 -7.450 -1.020 529 HD22 LEU 81 1HD2 LEU 81 5.099 -7.227 -0.722 530 HD23 LEU 81 2HD2 LEU 81 4.483 -8.740 -1.418 531 H ILE 82 H ILE 82 3.645 -3.042 -0.863 532 HA ILE 82 HA ILE 82 2.874 -0.853 -2.703 533 HB ILE 82 HB ILE 82 1.948 -1.048 0.202 534 HG13 ILE 82 2HG1 ILE 82 0.781 -2.868 -0.934 535 HG21 ILE 82 1HG2 ILE 82 0.415 0.786 -0.601 536 HG22 ILE 82 2HG2 ILE 82 2.104 1.200 -0.615 537 HG23 ILE 82 3HG2 ILE 82 1.286 0.776 -2.141 538 HD11 ILE 82 3HD1 ILE 82 -1.386 -2.416 -0.264 539 HD12 ILE 82 1HD1 ILE 82 -0.444 -1.272 0.713 540 HD13 ILE 82 2HD1 ILE 82 -1.309 -0.718 -0.742 541 H GLY 83 H GLY 83 4.366 1.014 -2.402 542 HA2 GLY 83 1HA GLY 83 5.544 1.150 0.345 543 HA3 GLY 83 2HA GLY 83 6.449 1.586 -1.076 544 H SER 84 H SER 84 6.201 3.308 1.075 545 HA SER 84 HA SER 84 5.461 5.683 -0.270 546 HB3 SER 84 2HB SER 84 3.884 6.422 1.720 547 HG SER 84 HG SER 84 3.154 4.666 -0.373 548 HA PRO 85 HA PRO 85 8.357 7.132 2.838 549 HB3 PRO 85 2HB PRO 85 8.620 8.988 1.450 550 HG3 PRO 85 2HG PRO 85 6.757 10.056 0.441 551 HD3 PRO 85 2HD PRO 85 6.498 7.837 -0.222 552 H VAL 86 H VAL 86 8.443 8.385 4.992 553 HA VAL 86 HA VAL 86 5.972 8.942 6.344 554 HB VAL 86 HB VAL 86 6.096 6.485 6.388 555 HG11 VAL 86 1HG1 VAL 86 8.551 6.632 8.105 556 HG12 VAL 86 2HG1 VAL 86 7.530 5.215 7.761 557 HG13 VAL 86 3HG1 VAL 86 8.405 5.976 6.454 558 HG21 VAL 86 3HG2 VAL 86 6.417 7.778 9.152 559 HG22 VAL 86 1HG2 VAL 86 4.918 7.769 8.190 560 HG23 VAL 86 2HG2 VAL 86 5.574 6.262 8.802 561 H TRP 87 H TRP 87 6.409 10.400 7.954 562 HA TRP 87 HA TRP 87 8.939 10.343 9.304 563 HB3 TRP 87 2HB TRP 87 8.548 12.943 7.799 564 HD1 TRP 87 HD TRP 87 10.872 10.832 10.025 565 HE1 TRP 87 1HE TRP 87 12.542 12.349 11.162 566 HE3 TRP 87 3HE TRP 87 10.031 15.114 7.309 567 HZ2 TRP 87 2HZ TRP 87 13.699 14.980 10.689 568 HZ3 TRP 87 3HZ TRP 87 11.523 17.060 7.627 569 HH2 TRP 87 HH TRP 87 13.354 17.000 9.291 570 H SER 88 H SER 88 5.723 11.334 9.342 571 HA SER 88 HA SER 88 6.095 11.996 12.179 572 HB3 SER 88 2HB SER 88 4.481 13.956 11.921 573 HG SER 88 HG SER 88 6.356 14.809 12.162 574 H GLY 89 H GLY 89 5.375 9.702 11.805 575 HA2 GLY 89 1HA GLY 89 3.786 8.188 12.442 576 HA3 GLY 89 2HA GLY 89 2.582 9.476 12.494 577 H TYR 90 H TYR 90 2.147 10.391 10.120 578 HA TYR 90 HA TYR 90 2.012 8.426 7.998 579 HB3 TYR 90 2HB TYR 90 0.275 7.411 9.057 580 HD1 TYR 90 1HD TYR 90 -0.050 10.934 10.287 581 HD2 TYR 90 2HD TYR 90 -1.906 7.059 10.058 582 HE1 TYR 90 1HE TYR 90 -1.459 11.460 12.279 583 HE2 TYR 90 2HE TYR 90 -3.300 7.587 11.977 584 HH TYR 90 HH TYR 90 -3.105 10.661 13.806 585 HA PRO 91 HA PRO 91 1.763 13.002 7.091 586 HB3 PRO 91 2HB PRO 91 4.084 13.203 7.402 587 HG3 PRO 91 2HG PRO 91 5.582 11.504 6.588 588 HD3 PRO 91 2HD PRO 91 4.107 10.641 8.280 589 H ALA 92 H ALA 92 1.102 10.363 5.174 590 HA ALA 92 HA ALA 92 0.527 11.986 2.792 591 HB1 ALA 92 1HB ALA 92 1.506 10.360 1.297 592 HB2 ALA 92 2HB ALA 92 2.754 10.658 2.498 593 HB3 ALA 92 3HB ALA 92 1.764 9.182 2.593 594 H THR 93 H THR 93 -1.346 10.875 1.580 595 HA THR 93 HA THR 93 -2.414 8.510 3.005 596 HB THR 93 HB THR 93 -4.745 9.541 2.497 597 HG1 THR 93 1HG THR 93 -3.778 11.292 1.239 598 HG21 THR 93 3HG2 THR 93 -4.852 10.905 4.527 599 HG22 THR 93 1HG2 THR 93 -3.083 10.909 4.658 600 HG23 THR 93 2HG2 THR 93 -4.000 9.385 4.810 601 HA PRO 94 HA PRO 94 -2.619 8.242 -1.707 602 HB3 PRO 94 2HB PRO 94 -0.365 8.530 -2.223 603 HG3 PRO 94 2HG PRO 94 1.343 7.976 -0.610 604 HD3 PRO 94 2HD PRO 94 -0.128 9.440 0.383 605 H ILE 95 H ILE 95 -1.333 5.888 0.652 606 HA ILE 95 HA ILE 95 -2.741 3.681 -0.600 607 HB ILE 95 HB ILE 95 -1.291 3.536 2.018 608 HG13 ILE 95 2HG1 ILE 95 0.827 2.942 0.810 609 HG21 ILE 95 1HG2 ILE 95 -0.773 1.260 1.242 610 HG22 ILE 95 2HG2 ILE 95 -2.501 1.558 1.248 611 HG23 ILE 95 3HG2 ILE 95 -1.644 1.595 -0.291 612 HD11 ILE 95 3HD1 ILE 95 -0.018 2.972 -1.594 613 HD12 ILE 95 1HD1 ILE 95 -0.160 4.732 -1.445 614 HD13 ILE 95 2HD1 ILE 95 1.401 3.984 -1.285 615 H LYS 96 H LYS 96 -4.556 5.455 0.003 616 HA LYS 96 HA LYS 96 -6.220 3.930 1.971 617 HB3 LYS 96 2HB LYS 96 -6.107 6.935 1.502 618 HG3 LYS 96 2HG LYS 96 -8.500 6.328 1.463 619 HD3 LYS 96 2HD LYS 96 -8.217 4.305 3.187 620 HE3 LYS 96 2HE LYS 96 -8.594 6.784 4.930 621 HZ1 LYS 96 3HZ LYS 96 -9.093 3.963 5.706 622 HZ2 LYS 96 1HZ LYS 96 -10.235 5.099 5.463 623 HZ3 LYS 96 2HZ LYS 96 -9.185 5.293 6.682 624 H THR 97 H THR 97 -6.658 6.272 -0.838 625 HA THR 97 HA THR 97 -9.129 5.274 -1.484 626 HB THR 97 HB THR 97 -7.066 6.416 -3.399 627 HG1 THR 97 1HG THR 97 -8.774 8.203 -2.255 628 HG21 THR 97 3HG2 THR 97 -10.110 6.602 -3.380 629 HG22 THR 97 1HG2 THR 97 -9.125 5.696 -4.541 630 HG23 THR 97 2HG2 THR 97 -9.027 7.459 -4.504 631 H LEU 98 H LEU 98 -5.958 4.059 -2.671 632 HA LEU 98 HA LEU 98 -6.796 2.238 -4.661 633 HB3 LEU 98 2HB LEU 98 -4.592 1.782 -2.671 634 HG LEU 98 HG LEU 98 -5.525 0.174 -4.765 635 HD11 LEU 98 1HD1 LEU 98 -4.000 0.502 -6.659 636 HD12 LEU 98 2HD1 LEU 98 -3.407 2.015 -5.942 637 HD13 LEU 98 3HD1 LEU 98 -5.118 1.843 -6.452 638 HD21 LEU 98 3HD2 LEU 98 -3.325 -0.829 -4.721 639 HD22 LEU 98 1HD2 LEU 98 -3.946 -0.437 -3.105 640 HD23 LEU 98 2HD2 LEU 98 -2.698 0.595 -3.829 641 H LEU 99 H LEU 99 -6.440 1.582 -1.118 642 HA LEU 99 HA LEU 99 -7.142 -1.106 -1.191 643 HB3 LEU 99 2HB LEU 99 -7.896 -0.624 1.189 644 HG LEU 99 HG LEU 99 -5.868 -0.865 1.900 645 HD11 LEU 99 1HD1 LEU 99 -3.909 -1.031 0.676 646 HD12 LEU 99 2HD1 LEU 99 -4.592 -0.158 -0.721 647 HD13 LEU 99 3HD1 LEU 99 -5.208 -1.763 -0.256 648 HD21 LEU 99 3HD2 LEU 99 -4.945 1.758 0.768 649 HD22 LEU 99 1HD2 LEU 99 -4.334 0.887 2.209 650 HD23 LEU 99 2HD2 LEU 99 -5.923 1.627 2.237 651 H ASP 100 H ASP 100 -9.289 1.740 -1.281 652 HA ASP 100 HA ASP 100 -11.733 0.260 -0.699 653 HB3 ASP 100 2HB ASP 100 -11.380 2.966 -2.000 654 H GLN 101 H GLN 101 -9.826 1.022 -3.560 655 HA GLN 101 HA GLN 101 -11.822 0.060 -5.470 656 HB3 GLN 101 2HB GLN 101 -10.024 0.056 -7.057 657 HG3 GLN 101 2HG GLN 101 -9.556 2.556 -5.402 658 HE21 GLN 101 1HE2 GLN 101 -9.454 4.547 -7.152 659 HE22 GLN 101 2HE2 GLN 101 -8.361 4.146 -8.445 660 H MET 102 H MET 102 -8.999 -1.247 -3.717 661 HA MET 102 HA MET 102 -9.077 -3.868 -4.816 662 HB3 MET 102 2HB MET 102 -7.608 -4.433 -2.878 663 HG3 MET 102 2HG MET 102 -6.841 -1.854 -4.266 664 HE1 MET 102 3HE MET 102 -5.598 -5.308 -2.460 665 HE2 MET 102 1HE MET 102 -5.283 -5.312 -4.212 666 HE3 MET 102 2HE MET 102 -3.934 -5.223 -3.063 667 H LYS 103 H LYS 103 -11.627 -2.749 -3.081 668 HA LYS 103 HA LYS 103 -11.881 -4.370 -0.819 669 HB3 LYS 103 2HB LYS 103 -14.440 -4.083 -1.313 670 HG3 LYS 103 2HG LYS 103 -14.294 -1.569 -1.043 671 HD3 LYS 103 2HD LYS 103 -13.777 -3.535 0.814 672 HE3 LYS 103 2HE LYS 103 -11.641 -1.403 1.186 673 HZ1 LYS 103 3HZ LYS 103 -12.535 -2.450 3.187 674 HZ2 LYS 103 1HZ LYS 103 -10.979 -2.869 2.975 675 HZ3 LYS 103 2HZ LYS 103 -12.178 -3.947 2.598 676 H ASN 104 H ASN 104 -12.156 -5.532 -4.110 677 HA ASN 104 HA ASN 104 -13.242 -8.115 -3.111 678 HB3 ASN 104 2HB ASN 104 -14.919 -7.166 -4.491 679 HD21 ASN 104 1HD2 ASN 104 -14.351 -4.869 -5.020 680 HD22 ASN 104 2HD2 ASN 104 -13.710 -4.483 -6.595 681 H TYR 105 H TYR 105 -10.407 -7.039 -3.274 682 HA TYR 105 HA TYR 105 -8.977 -8.652 -5.189 683 HB3 TYR 105 2HB TYR 105 -8.303 -7.291 -2.557 684 HD1 TYR 105 2HD TYR 105 -6.652 -8.677 -5.677 685 HD2 TYR 105 1HD TYR 105 -6.317 -7.728 -1.465 686 HE1 TYR 105 2HE TYR 105 -4.434 -9.705 -5.628 687 HE2 TYR 105 1HE TYR 105 -4.033 -8.686 -1.444 688 HH TYR 105 HH TYR 105 -2.785 -10.593 -4.117 689 H ARG 106 H ARG 106 -7.934 -10.693 -4.807 690 HA ARG 106 HA ARG 106 -8.923 -12.305 -2.498 691 HB3 ARG 106 2HB ARG 106 -9.170 -14.133 -4.263 692 HG3 ARG 106 2HG ARG 106 -11.187 -12.898 -5.477 693 HD3 ARG 106 2HD ARG 106 -12.512 -13.040 -3.261 694 HE ARG 106 HE ARG 106 -12.303 -14.895 -4.884 695 HH11 ARG 106 1HH1 ARG 106 -10.859 -15.291 -1.626 696 HH12 ARG 106 2HH1 ARG 106 -11.082 -17.006 -1.607 697 HH21 ARG 106 1HH2 ARG 106 -12.508 -17.196 -4.833 698 HH22 ARG 106 2HH2 ARG 106 -12.082 -18.056 -3.358 699 H GLY 107 H GLY 107 -6.621 -11.308 -1.939 700 HA2 GLY 107 1HA GLY 107 -4.656 -13.376 -2.280 701 HA3 GLY 107 2HA GLY 107 -4.321 -11.930 -3.236 702 H GLU 108 H GLU 108 -2.408 -11.548 -1.823 703 HA GLU 108 HA GLU 108 -3.031 -10.894 1.008 704 HB3 GLU 108 2HB GLU 108 -0.514 -11.473 1.225 705 HG3 GLU 108 2HG GLU 108 -2.873 -13.141 1.228 706 H VAL 109 H VAL 109 -2.205 -9.152 1.876 707 HA VAL 109 HA VAL 109 -0.905 -7.160 0.076 708 HB VAL 109 HB VAL 109 -2.246 -6.672 2.792 709 HG11 VAL 109 1HG1 VAL 109 -2.260 -4.293 1.648 710 HG12 VAL 109 2HG1 VAL 109 -0.791 -4.889 2.439 711 HG13 VAL 109 3HG1 VAL 109 -0.926 -4.922 0.679 712 HG21 VAL 109 3HG2 VAL 109 -3.362 -6.468 -0.038 713 HG22 VAL 109 1HG2 VAL 109 -3.976 -7.427 1.316 714 HG23 VAL 109 2HG2 VAL 109 -4.063 -5.663 1.376 715 H ALA 110 H ALA 110 1.115 -6.270 0.508 716 HA ALA 110 HA ALA 110 1.928 -6.324 3.242 717 HB1 ALA 110 1HB ALA 110 3.935 -7.268 1.163 718 HB2 ALA 110 2HB ALA 110 4.331 -6.861 2.824 719 HB3 ALA 110 3HB ALA 110 3.274 -8.240 2.478 720 H SER 111 H SER 111 3.841 -4.679 3.531 721 HA SER 111 HA SER 111 3.716 -2.564 1.476 722 HB3 SER 111 2HB SER 111 3.686 -1.894 4.408 723 HG SER 111 HG SER 111 2.152 -0.310 2.951 724 H PHE 112 H PHE 112 5.526 -1.013 1.707 725 HA PHE 112 HA PHE 112 7.859 -1.898 3.260 726 HB3 PHE 112 2HB PHE 112 8.005 -3.208 1.332 727 HD1 PHE 112 2HD PHE 112 8.791 0.034 -0.405 728 HD2 PHE 112 1HD PHE 112 6.461 -3.584 -0.415 729 HE1 PHE 112 2HE PHE 112 8.267 0.370 -2.788 730 HE2 PHE 112 1HE PHE 112 5.813 -3.125 -2.770 731 HZ PHE 112 HZ PHE 112 6.684 -1.112 -3.943 732 H PHE 113 H PHE 113 8.538 -0.053 4.347 733 HA PHE 113 HA PHE 113 7.943 2.582 3.085 734 HB3 PHE 113 2HB PHE 113 6.988 2.357 5.276 735 HD1 PHE 113 2HD PHE 113 10.585 3.000 6.167 736 HD2 PHE 113 1HD PHE 113 7.004 0.795 7.089 737 HE1 PHE 113 2HE PHE 113 11.659 2.091 8.186 738 HE2 PHE 113 1HE PHE 113 8.146 -0.258 9.005 739 HZ PHE 113 HZ PHE 113 10.500 0.394 9.547 740 H THR 114 H THR 114 9.571 3.831 2.304 741 HA THR 114 HA THR 114 12.326 2.806 2.537 742 HB THR 114 HB THR 114 12.797 4.522 0.809 743 HG1 THR 114 1HG THR 114 11.343 6.077 1.178 744 HG21 THR 114 3HG2 THR 114 12.142 2.253 0.127 745 HG22 THR 114 1HG2 THR 114 11.627 3.477 -1.040 746 HG23 THR 114 2HG2 THR 114 10.438 2.755 0.067 747 H SER 115 H SER 115 10.630 4.594 4.681 748 HA SER 115 HA SER 115 12.761 6.634 5.091 749 HB3 SER 115 2HB SER 115 9.981 7.311 5.898 750 HG SER 115 HG SER 115 10.987 9.191 4.444 751 H ALA 116 H ALA 116 13.603 6.638 7.026 752 HA ALA 116 HA ALA 116 12.387 4.873 9.144 753 HB1 ALA 116 1HB ALA 116 14.809 4.567 9.854 754 HB2 ALA 116 2HB ALA 116 14.399 3.869 8.283 755 HB3 ALA 116 3HB ALA 116 15.289 5.412 8.383 756 H GLY 117 H GLY 117 12.738 8.072 8.489 757 HA2 GLY 117 1HA GLY 117 14.585 9.211 9.949 758 HA3 GLY 117 2HA GLY 117 13.043 10.023 9.758 759 H THR 118 H THR 118 11.299 9.071 11.555 760 HA THR 118 HA THR 118 12.638 8.558 14.119 761 HB THR 118 HB THR 118 10.490 10.534 14.364 762 HG1 THR 118 1HG THR 118 11.250 12.187 13.364 763 HG21 THR 118 3HG2 THR 118 13.449 10.536 15.071 764 HG22 THR 118 1HG2 THR 118 12.104 10.017 16.120 765 HG23 THR 118 2HG2 THR 118 12.260 11.717 15.655 766 H ASN 119 H ASN 119 10.609 7.254 12.044 767 HA ASN 119 HA ASN 119 8.523 6.410 13.992 768 HB3 ASN 119 2HB ASN 119 7.010 6.515 11.862 769 HD21 ASN 119 1HD2 ASN 119 6.158 6.830 14.263 770 HD22 ASN 119 2HD2 ASN 119 5.725 8.462 14.608 771 H HIS 120 H HIS 120 8.621 4.280 14.106 772 HA HIS 120 HA HIS 120 8.923 2.711 11.605 773 HB3 HIS 120 2HB HIS 120 10.233 2.032 14.239 774 HD1 HIS 120 1HD HIS 120 12.133 -0.053 13.750 775 HD2 HIS 120 2HD HIS 120 8.692 0.212 11.308 776 HE1 HIS 120 1HE HIS 120 11.858 -2.301 12.625 777 H LYS 121 H LYS 121 8.007 2.318 15.107 778 HA LYS 121 HA LYS 121 6.127 0.309 14.719 779 HB3 LYS 121 2HB LYS 121 4.937 1.696 16.762 780 HG3 LYS 121 2HG LYS 121 6.745 0.724 18.312 781 HD3 LYS 121 2HD LYS 121 5.236 -0.971 16.292 782 HE3 LYS 121 2HE LYS 121 6.557 -1.911 18.874 783 HZ1 LYS 121 3HZ LYS 121 6.133 -4.065 17.819 784 HZ2 LYS 121 1HZ LYS 121 5.262 -3.326 16.623 785 HZ3 LYS 121 2HZ LYS 121 4.722 -3.264 18.188 786 H ALA 122 H ALA 122 5.521 3.825 14.440 787 HA ALA 122 HA ALA 122 2.808 3.839 14.439 788 HB1 ALA 122 1HB ALA 122 4.592 5.560 12.656 789 HB2 ALA 122 2HB ALA 122 2.973 5.935 13.279 790 HB3 ALA 122 3HB ALA 122 4.332 5.793 14.396 791 H TYR 123 H TYR 123 4.772 3.622 11.441 792 HA TYR 123 HA TYR 123 2.657 3.768 9.631 793 HB3 TYR 123 2HB TYR 123 5.368 2.412 9.352 794 HD1 TYR 123 2HD TYR 123 4.397 0.775 7.674 795 HD2 TYR 123 1HD TYR 123 4.400 5.058 7.053 796 HE1 TYR 123 2HE TYR 123 4.189 0.450 5.201 797 HE2 TYR 123 1HE TYR 123 4.256 4.715 4.628 798 HH TYR 123 HH TYR 123 4.120 1.407 3.161 799 H VAL 124 H VAL 124 3.961 0.941 11.304 800 HA VAL 124 HA VAL 124 2.721 -1.118 9.766 801 HB VAL 124 HB VAL 124 3.460 -1.049 12.727 802 HG11 VAL 124 1HG1 VAL 124 3.720 -3.481 12.521 803 HG12 VAL 124 2HG1 VAL 124 2.076 -2.992 12.106 804 HG13 VAL 124 3HG1 VAL 124 3.224 -3.412 10.828 805 HG21 VAL 124 3HG2 VAL 124 5.648 -2.131 11.806 806 HG22 VAL 124 1HG2 VAL 124 5.136 -1.533 10.210 807 HG23 VAL 124 2HG2 VAL 124 5.458 -0.404 11.534 808 H SER 125 H SER 125 1.740 0.554 12.759 809 HA SER 125 HA SER 125 -0.802 -0.767 13.085 810 HB3 SER 125 2HB SER 125 -0.920 1.374 14.637 811 HG SER 125 HG SER 125 0.462 -0.993 14.808 812 H HIS 126 H HIS 126 0.225 2.459 11.817 813 HA HIS 126 HA HIS 126 -2.370 3.397 11.296 814 HB3 HIS 126 2HB HIS 126 -1.155 4.976 9.733 815 HD1 HIS 126 1HD HIS 126 1.382 6.352 11.031 816 HD2 HIS 126 2HD HIS 126 -1.947 4.756 13.081 817 HE1 HIS 126 1HE HIS 126 1.226 7.569 13.280 818 H PHE 127 H PHE 127 -0.135 1.463 9.258 819 HA PHE 127 HA PHE 127 -1.711 1.652 6.897 820 HB3 PHE 127 2HB PHE 127 0.310 -0.425 7.800 821 HD1 PHE 127 1HD PHE 127 -1.535 1.012 4.829 822 HD2 PHE 127 2HD PHE 127 0.804 -2.247 6.390 823 HE1 PHE 127 1HE PHE 127 -1.943 -0.268 2.766 824 HE2 PHE 127 2HE PHE 127 0.346 -3.550 4.327 825 HZ PHE 127 HZ PHE 127 -1.017 -2.540 2.529 826 H ASN 128 H ASN 128 -1.616 -0.762 9.522 827 HA ASN 128 HA ASN 128 -3.402 -2.702 8.531 828 HB3 ASN 128 2HB ASN 128 -4.042 -2.730 11.148 829 HD21 ASN 128 1HD2 ASN 128 -0.538 -2.805 10.524 830 HD22 ASN 128 2HD2 ASN 128 -0.467 -4.572 10.462 831 H GLU 129 H GLU 129 -4.207 0.455 10.104 832 HA GLU 129 HA GLU 129 -6.983 0.108 10.254 833 HB3 GLU 129 2HB GLU 129 -4.648 1.999 10.754 834 HG3 GLU 129 2HG GLU 129 -7.428 2.814 10.382 835 H TRP 130 H TRP 130 -4.769 2.038 8.149 836 HA TRP 130 HA TRP 130 -7.087 3.092 6.739 837 HB3 TRP 130 2HB TRP 130 -5.284 4.133 5.286 838 HD1 TRP 130 HD TRP 130 -6.910 4.343 8.556 839 HE1 TRP 130 1HE TRP 130 -6.786 6.751 9.462 840 HE3 TRP 130 3HE TRP 130 -2.900 6.069 5.863 841 HZ2 TRP 130 2HZ TRP 130 -5.098 9.088 9.127 842 HZ3 TRP 130 3HZ TRP 130 -2.059 8.379 6.183 843 HH2 TRP 130 HH TRP 130 -3.167 9.896 7.805 844 H ALA 131 H ALA 131 -5.601 0.112 6.506 845 HA ALA 131 HA ALA 131 -6.600 -0.348 3.746 846 HB1 ALA 131 1HB ALA 131 -4.446 -1.828 5.300 847 HB2 ALA 131 2HB ALA 131 -4.896 -2.059 3.601 848 HB3 ALA 131 3HB ALA 131 -4.122 -0.549 4.118 849 H ASP 132 H ASP 132 -7.873 -0.640 6.668 850 HA ASP 132 HA ASP 132 -8.231 -3.101 7.595 851 HB3 ASP 132 2HB ASP 132 -10.392 -1.003 7.268 852 H GLY 133 H GLY 133 -8.931 -4.955 7.017 853 HA2 GLY 133 1HA GLY 133 -10.589 -6.448 6.321 854 HA3 GLY 133 2HA GLY 133 -11.241 -5.257 5.202 855 H LEU 134 H LEU 134 -7.986 -5.272 4.548 856 HA LEU 134 HA LEU 134 -8.232 -7.460 2.497 857 HB3 LEU 134 2HB LEU 134 -6.361 -6.522 1.375 858 HG LEU 134 HG LEU 134 -8.057 -4.127 2.222 859 HD11 LEU 134 1HD1 LEU 134 -7.254 -3.114 0.152 860 HD12 LEU 134 2HD1 LEU 134 -6.252 -4.543 -0.190 861 HD13 LEU 134 3HD1 LEU 134 -5.897 -3.527 1.224 862 HD21 LEU 134 3HD2 LEU 134 -9.291 -4.479 0.106 863 HD22 LEU 134 1HD2 LEU 134 -9.488 -5.853 1.194 864 HD23 LEU 134 2HD2 LEU 134 -8.384 -5.972 -0.189 865 H ASN 135 H ASN 135 -6.628 -9.131 2.491 866 HA ASN 135 HA ASN 135 -5.776 -9.926 5.146 867 HB3 ASN 135 2HB ASN 135 -5.197 -11.164 2.414 868 HD21 ASN 135 1HD2 ASN 135 -3.501 -12.566 2.709 869 HD22 ASN 135 2HD2 ASN 135 -3.279 -13.640 4.058 870 H VAL 136 H VAL 136 -3.996 -8.763 5.992 871 HA VAL 136 HA VAL 136 -1.716 -8.332 4.140 872 HB VAL 136 HB VAL 136 -2.765 -6.348 4.722 873 HG11 VAL 136 1HG1 VAL 136 -2.560 -7.007 7.618 874 HG12 VAL 136 2HG1 VAL 136 -2.981 -5.419 6.902 875 HG13 VAL 136 3HG1 VAL 136 -3.993 -6.801 6.558 876 HG21 VAL 136 3HG2 VAL 136 -0.215 -6.462 6.384 877 HG22 VAL 136 1HG2 VAL 136 -0.260 -6.327 4.615 878 HG23 VAL 136 2HG2 VAL 136 -0.934 -5.042 5.611 879 H ILE 137 H ILE 137 0.093 -9.220 4.414 880 HA ILE 137 HA ILE 137 0.805 -10.568 6.959 881 HB ILE 137 HB ILE 137 1.674 -12.385 5.507 882 HG13 ILE 137 2HG1 ILE 137 0.226 -10.915 3.246 883 HG21 ILE 137 1HG2 ILE 137 -1.277 -11.781 4.991 884 HG22 ILE 137 2HG2 ILE 137 -0.492 -13.366 5.088 885 HG23 ILE 137 3HG2 ILE 137 -0.634 -12.368 6.546 886 HD11 ILE 137 3HD1 ILE 137 3.103 -11.883 3.407 887 HD12 ILE 137 1HD1 ILE 137 2.285 -11.271 1.956 888 HD13 ILE 137 2HD1 ILE 137 2.569 -10.184 3.315 889 H GLY 138 H GLY 138 1.733 -7.871 5.425 890 HA2 GLY 138 1HA GLY 138 4.390 -8.015 6.608 891 HA3 GLY 138 2HA GLY 138 4.360 -7.937 4.835 892 H VAL 139 H VAL 139 5.382 -5.954 6.760 893 HA VAL 139 HA VAL 139 4.898 -3.634 5.314 894 HB VAL 139 HB VAL 139 2.865 -3.476 6.205 895 HG11 VAL 139 1HG1 VAL 139 2.269 -3.482 8.625 896 HG12 VAL 139 2HG1 VAL 139 2.645 -5.033 7.876 897 HG13 VAL 139 3HG1 VAL 139 3.869 -4.257 8.913 898 HG21 VAL 139 3HG2 VAL 139 4.483 -1.711 8.046 899 HG22 VAL 139 1HG2 VAL 139 4.002 -1.341 6.389 900 HG23 VAL 139 2HG2 VAL 139 2.768 -1.491 7.607 901 H ALA 140 H ALA 140 7.149 -3.793 5.151 902 HA ALA 140 HA ALA 140 8.686 -3.463 7.681 903 HB1 ALA 140 1HB ALA 140 9.598 -5.163 5.341 904 HB2 ALA 140 2HB ALA 140 10.354 -5.002 6.937 905 HB3 ALA 140 3HB ALA 140 8.789 -5.804 6.787 906 H ARG 141 H ARG 141 11.303 -3.098 6.685 907 HA ARG 141 HA ARG 141 11.081 -0.524 5.267 908 HB3 ARG 141 2HB ARG 141 13.066 -1.744 7.235 909 HG3 ARG 141 2HG ARG 141 13.248 0.913 5.773 910 HD3 ARG 141 2HD ARG 141 15.049 -0.465 7.802 911 HE ARG 141 HE ARG 141 15.818 1.299 5.732 912 HH11 ARG 141 1HH1 ARG 141 16.427 0.764 9.196 913 HH12 ARG 141 2HH1 ARG 141 17.838 1.770 9.223 914 HH21 ARG 141 1HH2 ARG 141 17.876 2.374 5.773 915 HH22 ARG 141 2HH2 ARG 141 18.692 2.654 7.251 916 H ASP 142 H ASP 142 12.141 -0.278 3.438 917 HA ASP 142 HA ASP 142 12.959 -0.723 1.380 918 HB3 ASP 142 2HB ASP 142 15.296 -1.753 1.347 919 H ASP 143 H ASP 143 14.408 -3.723 2.472 920 HA ASP 143 HA ASP 143 12.388 -5.169 0.864 921 HB3 ASP 143 2HB ASP 143 14.186 -4.557 -0.607 922 H SER 144 H SER 144 13.526 -5.108 3.896 923 HA SER 144 HA SER 144 15.140 -7.358 4.185 924 HB3 SER 144 2HB SER 144 14.591 -6.902 6.688 925 HG SER 144 HG SER 144 15.483 -4.654 6.299 926 H GLU 145 H GLU 145 11.809 -7.600 3.703 927 HA GLU 145 HA GLU 145 11.732 -10.232 5.074 928 HB3 GLU 145 2HB GLU 145 9.663 -9.823 6.136 929 HG3 GLU 145 2HG GLU 145 11.152 -7.215 6.636 930 H VAL 146 H VAL 146 11.891 -9.078 2.180 931 HA VAL 146 HA VAL 146 9.406 -9.642 0.889 932 HB VAL 146 HB VAL 146 12.292 -9.339 -0.045 933 HG11 VAL 146 1HG1 VAL 146 11.442 -9.232 -2.389 934 HG12 VAL 146 2HG1 VAL 146 11.321 -10.844 -1.695 935 HG13 VAL 146 3HG1 VAL 146 9.871 -9.850 -1.806 936 HG21 VAL 146 3HG2 VAL 146 9.821 -7.619 -0.522 937 HG22 VAL 146 1HG2 VAL 146 11.014 -7.319 0.754 938 HG23 VAL 146 2HG2 VAL 146 11.510 -7.229 -0.939 939 H ASP 147 H ASP 147 12.222 -11.669 1.583 940 HA ASP 147 HA ASP 147 11.600 -13.958 0.101 941 HB3 ASP 147 2HB ASP 147 12.891 -13.575 2.812 942 H LYS 148 H LYS 148 10.339 -13.151 3.415 943 HA LYS 148 HA LYS 148 8.809 -15.609 3.454 944 HB3 LYS 148 2HB LYS 148 9.341 -14.653 5.596 945 HG3 LYS 148 2HG LYS 148 7.622 -12.300 4.741 946 HD3 LYS 148 2HD LYS 148 8.807 -12.540 7.499 947 HE3 LYS 148 2HE LYS 148 6.175 -11.306 6.626 948 HZ1 LYS 148 3HZ LYS 148 7.229 -11.305 9.016 949 HZ2 LYS 148 1HZ LYS 148 6.409 -9.996 8.461 950 HZ3 LYS 148 2HZ LYS 148 8.035 -9.980 8.432 951 H TRP 149 H TRP 149 8.191 -12.475 1.995 952 HA TRP 149 HA TRP 149 5.349 -13.031 1.657 953 HB3 TRP 149 2HB TRP 149 5.267 -10.848 0.582 954 HD1 TRP 149 HD TRP 149 5.295 -11.595 3.784 955 HE1 TRP 149 1HE TRP 149 5.644 -9.684 5.378 956 HE3 TRP 149 3HE TRP 149 7.530 -8.323 0.580 957 HZ2 TRP 149 2HZ TRP 149 6.972 -7.027 5.351 958 HZ3 TRP 149 3HZ TRP 149 8.281 -6.086 1.369 959 HH2 TRP 149 HH TRP 149 7.980 -5.398 3.684 960 H SER 150 H SER 150 7.745 -14.647 0.242 961 HA SER 150 HA SER 150 5.881 -15.041 -2.008 962 HB3 SER 150 2HB SER 150 8.861 -14.807 -2.582 963 HG SER 150 HG SER 150 6.739 -14.554 -4.442 964 H LYS 151 H LYS 151 8.572 -16.153 -0.031 965 HA LYS 151 HA LYS 151 9.652 -18.109 0.207 966 HB3 LYS 151 2HB LYS 151 8.047 -19.896 1.032 967 HG3 LYS 151 2HG LYS 151 7.324 -17.186 2.149 968 HD3 LYS 151 2HD LYS 151 8.101 -19.794 3.510 969 HE3 LYS 151 2HE LYS 151 8.367 -17.611 4.790 970 HZ1 LYS 151 3HZ LYS 151 5.411 -17.673 4.786 971 HZ2 LYS 151 1HZ LYS 151 6.301 -16.527 4.003 972 HZ3 LYS 151 2HZ LYS 151 6.385 -16.674 5.653 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -4.787 -26.133 -13.048 2 HA2 GLY 1 1HA GLY 1 -4.619 -23.697 -12.895 3 HA3 GLY 1 2HA GLY 1 -5.667 -24.347 -11.619 4 H MET 2 H MET 2 -2.315 -23.227 -12.308 5 HA MET 2 HA MET 2 -2.299 -21.873 -9.729 6 HB3 MET 2 2HB MET 2 0.134 -22.578 -9.350 7 HG3 MET 2 2HG MET 2 -1.917 -24.744 -8.846 8 HE1 MET 2 3HE MET 2 1.524 -23.689 -5.920 9 HE2 MET 2 1HE MET 2 1.165 -22.687 -7.343 10 HE3 MET 2 2HE MET 2 -0.032 -22.852 -6.040 11 H ALA 3 H ALA 3 -1.839 -19.883 -10.306 12 HA ALA 3 HA ALA 3 0.753 -19.332 -11.362 13 HB1 ALA 3 1HB ALA 3 -0.003 -17.516 -12.896 14 HB2 ALA 3 2HB ALA 3 -0.371 -19.133 -13.521 15 HB3 ALA 3 3HB ALA 3 -1.659 -18.135 -12.811 16 H LYS 4 H LYS 4 1.357 -18.281 -9.545 17 HA LYS 4 HA LYS 4 -0.632 -16.535 -8.156 18 HB3 LYS 4 2HB LYS 4 -0.055 -18.382 -6.810 19 HG3 LYS 4 2HG LYS 4 2.571 -18.279 -7.653 20 HD3 LYS 4 2HD LYS 4 2.679 -17.611 -4.705 21 HE3 LYS 4 2HE LYS 4 4.930 -16.762 -5.311 22 HZ1 LYS 4 3HZ LYS 4 4.554 -19.485 -6.390 23 HZ2 LYS 4 1HZ LYS 4 4.762 -19.114 -4.792 24 HZ3 LYS 4 2HZ LYS 4 5.955 -18.813 -5.832 25 H LYS 5 H LYS 5 -0.338 -14.700 -9.347 26 HA LYS 5 HA LYS 5 2.424 -13.889 -10.042 27 HB3 LYS 5 2HB LYS 5 1.433 -12.145 -11.358 28 HG3 LYS 5 2HG LYS 5 -0.785 -14.001 -11.727 29 HD3 LYS 5 2HD LYS 5 0.028 -12.372 -13.515 30 HE3 LYS 5 2HE LYS 5 2.284 -14.442 -13.517 31 HZ1 LYS 5 3HZ LYS 5 3.119 -13.152 -15.382 32 HZ2 LYS 5 1HZ LYS 5 1.717 -12.287 -15.446 33 HZ3 LYS 5 2HZ LYS 5 1.705 -13.906 -15.767 34 H THR 6 H THR 6 2.516 -11.353 -9.870 35 HA THR 6 HA THR 6 1.880 -10.445 -7.140 36 HB THR 6 HB THR 6 4.741 -10.616 -8.156 37 HG1 THR 6 1HG THR 6 3.318 -12.131 -6.232 38 HG21 THR 6 3HG2 THR 6 4.578 -8.712 -6.712 39 HG22 THR 6 1HG2 THR 6 5.275 -10.010 -5.747 40 HG23 THR 6 2HG2 THR 6 3.571 -9.584 -5.550 41 H LEU 7 H LEU 7 1.924 -8.112 -6.969 42 HA LEU 7 HA LEU 7 2.912 -6.661 -9.314 43 HB3 LEU 7 2HB LEU 7 0.211 -6.014 -8.093 44 HG LEU 7 HG LEU 7 1.345 -4.114 -9.245 45 HD11 LEU 7 1HD1 LEU 7 1.309 -5.881 -11.712 46 HD12 LEU 7 2HD1 LEU 7 2.749 -5.259 -10.870 47 HD13 LEU 7 3HD1 LEU 7 1.676 -4.142 -11.668 48 HD21 LEU 7 3HD2 LEU 7 -1.036 -5.268 -10.751 49 HD22 LEU 7 1HD2 LEU 7 -0.472 -3.595 -10.863 50 HD23 LEU 7 2HD2 LEU 7 -1.091 -4.203 -9.322 51 H ILE 8 H ILE 8 3.791 -4.725 -8.827 52 HA ILE 8 HA ILE 8 3.978 -3.873 -5.976 53 HB ILE 8 HB ILE 8 6.116 -4.112 -8.119 54 HG13 ILE 8 2HG1 ILE 8 5.317 -6.222 -6.660 55 HG21 ILE 8 1HG2 ILE 8 6.298 -2.986 -5.313 56 HG22 ILE 8 2HG2 ILE 8 7.714 -3.343 -6.332 57 HG23 ILE 8 3HG2 ILE 8 6.570 -2.099 -6.838 58 HD11 ILE 8 3HD1 ILE 8 8.220 -5.464 -6.989 59 HD12 ILE 8 1HD1 ILE 8 7.555 -7.109 -6.825 60 HD13 ILE 8 2HD1 ILE 8 7.178 -6.121 -8.265 61 H LEU 9 H LEU 9 2.636 -2.103 -6.096 62 HA LEU 9 HA LEU 9 3.097 -0.097 -8.225 63 HB3 LEU 9 2HB LEU 9 1.222 1.042 -6.706 64 HG LEU 9 HG LEU 9 -0.602 -0.126 -7.819 65 HD11 LEU 9 1HD1 LEU 9 0.574 1.743 -8.945 66 HD12 LEU 9 2HD1 LEU 9 -0.033 0.563 -10.109 67 HD13 LEU 9 3HD1 LEU 9 1.690 0.597 -9.685 68 HD21 LEU 9 3HD2 LEU 9 1.489 -1.832 -9.196 69 HD22 LEU 9 1HD2 LEU 9 -0.260 -1.770 -9.519 70 HD23 LEU 9 2HD2 LEU 9 0.317 -2.394 -7.971 71 H TYR 10 H TYR 10 4.113 1.808 -7.853 72 HA TYR 10 HA TYR 10 4.522 2.669 -5.065 73 HB3 TYR 10 2HB TYR 10 6.655 1.746 -5.718 74 HD1 TYR 10 1HD TYR 10 6.536 0.624 -7.938 75 HD2 TYR 10 2HD TYR 10 7.242 4.854 -7.571 76 HE1 TYR 10 1HE TYR 10 7.142 0.707 -10.330 77 HE2 TYR 10 2HE TYR 10 7.875 4.967 -9.966 78 HH TYR 10 HH TYR 10 8.214 2.116 -12.071 79 H TYR 11 H TYR 11 4.022 4.715 -4.733 80 HA TYR 11 HA TYR 11 2.983 6.361 -6.976 81 HB3 TYR 11 2HB TYR 11 2.674 7.023 -4.052 82 HD1 TYR 11 2HD TYR 11 2.048 8.579 -7.085 83 HD2 TYR 11 1HD TYR 11 -0.296 6.596 -4.025 84 HE1 TYR 11 2HE TYR 11 0.230 10.077 -7.487 85 HE2 TYR 11 1HE TYR 11 -2.125 8.193 -4.409 86 HH TYR 11 HH TYR 11 -2.727 10.160 -5.445 87 H SER 12 H SER 12 3.427 8.844 -5.672 88 HA SER 12 HA SER 12 4.844 10.524 -5.730 89 HB3 SER 12 2HB SER 12 5.393 9.486 -3.572 90 HG SER 12 HG SER 12 6.639 7.718 -4.771 91 H TRP 13 H TRP 13 7.428 11.174 -6.224 92 HA TRP 13 HA TRP 13 7.624 10.613 -9.039 93 HB3 TRP 13 2HB TRP 13 9.938 11.766 -8.699 94 HD1 TRP 13 HD TRP 13 7.449 12.346 -10.429 95 HE1 TRP 13 1HE TRP 13 6.656 14.701 -10.819 96 HE3 TRP 13 3HE TRP 13 9.555 14.566 -6.311 97 HZ2 TRP 13 2HZ TRP 13 6.873 17.293 -9.499 98 HZ3 TRP 13 3HZ TRP 13 9.291 17.011 -5.945 99 HH2 TRP 13 HH TRP 13 7.933 18.376 -7.528 100 H SER 14 H SER 14 9.102 9.497 -10.223 101 HA SER 14 HA SER 14 9.871 6.925 -9.217 102 HB3 SER 14 2HB SER 14 10.848 6.855 -11.631 103 HG SER 14 HG SER 14 8.374 7.383 -12.283 104 H GLY 15 H GLY 15 11.259 7.761 -7.477 105 HA2 GLY 15 1HA GLY 15 14.052 7.378 -8.213 106 HA3 GLY 15 2HA GLY 15 13.713 9.026 -7.680 107 H GLU 16 H GLU 16 11.778 8.592 -5.710 108 HA GLU 16 HA GLU 16 13.368 7.800 -3.475 109 HB3 GLU 16 2HB GLU 16 11.137 8.060 -2.240 110 HG3 GLU 16 2HG GLU 16 10.762 10.482 -2.938 111 H THR 17 H THR 17 10.113 6.352 -4.077 112 HA THR 17 HA THR 17 10.891 3.926 -2.788 113 HB THR 17 HB THR 17 8.531 3.312 -3.585 114 HG1 THR 17 1HG THR 17 7.328 5.150 -4.312 115 HG21 THR 17 3HG2 THR 17 8.896 5.919 -2.035 116 HG22 THR 17 1HG2 THR 17 9.067 4.291 -1.356 117 HG23 THR 17 2HG2 THR 17 7.494 4.830 -1.965 118 H LYS 18 H LYS 18 10.978 5.035 -6.059 119 HA LYS 18 HA LYS 18 10.835 2.764 -7.592 120 HB3 LYS 18 2HB LYS 18 12.747 5.134 -7.724 121 HG3 LYS 18 2HG LYS 18 12.241 3.166 -9.987 122 HD3 LYS 18 2HD LYS 18 13.897 5.733 -9.799 123 HE3 LYS 18 2HE LYS 18 13.488 3.714 -12.033 124 HZ1 LYS 18 3HZ LYS 18 14.489 6.494 -12.154 125 HZ2 LYS 18 1HZ LYS 18 13.356 5.776 -13.093 126 HZ3 LYS 18 2HZ LYS 18 14.927 5.356 -13.242 127 H LYS 19 H LYS 19 13.780 3.897 -5.852 128 HA LYS 19 HA LYS 19 15.378 1.675 -6.708 129 HB3 LYS 19 2HB LYS 19 16.917 2.426 -4.842 130 HG3 LYS 19 2HG LYS 19 15.833 4.875 -6.286 131 HD3 LYS 19 2HD LYS 19 18.197 5.625 -6.033 132 HE3 LYS 19 2HE LYS 19 18.419 5.825 -3.539 133 HZ1 LYS 19 3HZ LYS 19 15.741 6.511 -4.611 134 HZ2 LYS 19 1HZ LYS 19 17.105 7.429 -4.672 135 HZ3 LYS 19 2HZ LYS 19 16.387 7.100 -3.218 136 H MET 20 H MET 20 12.802 1.636 -4.520 137 HA MET 20 HA MET 20 13.857 -0.682 -3.044 138 HB3 MET 20 2HB MET 20 12.244 0.277 -1.244 139 HG3 MET 20 2HG MET 20 13.634 2.453 -0.833 140 HE1 MET 20 3HE MET 20 16.511 -1.122 -0.446 141 HE2 MET 20 1HE MET 20 15.162 -1.290 -1.550 142 HE3 MET 20 2HE MET 20 16.378 -0.035 -1.858 143 H ALA 21 H ALA 21 12.245 -0.197 -5.652 144 HA ALA 21 HA ALA 21 9.960 -1.979 -5.017 145 HB1 ALA 21 1HB ALA 21 9.109 0.319 -5.252 146 HB2 ALA 21 2HB ALA 21 9.961 0.499 -6.798 147 HB3 ALA 21 3HB ALA 21 8.628 -0.665 -6.648 148 H GLU 22 H GLU 22 12.161 -0.570 -7.540 149 HA GLU 22 HA GLU 22 11.757 -2.528 -9.547 150 HB3 GLU 22 2HB GLU 22 14.185 -1.786 -10.144 151 HG3 GLU 22 2HG GLU 22 13.495 0.673 -10.423 152 H LYS 23 H LYS 23 13.811 -2.455 -6.685 153 HA LYS 23 HA LYS 23 15.279 -4.868 -6.882 154 HB3 LYS 23 2HB LYS 23 15.105 -4.673 -4.352 155 HG3 LYS 23 2HG LYS 23 16.056 -2.421 -4.004 156 HD3 LYS 23 2HD LYS 23 17.429 -4.422 -4.932 157 HE3 LYS 23 2HE LYS 23 16.601 -3.584 -7.357 158 HZ1 LYS 23 3HZ LYS 23 19.197 -2.211 -7.048 159 HZ2 LYS 23 1HZ LYS 23 17.765 -1.453 -7.161 160 HZ3 LYS 23 2HZ LYS 23 18.297 -2.337 -8.434 161 H ILE 24 H ILE 24 12.195 -4.351 -5.099 162 HA ILE 24 HA ILE 24 11.776 -7.028 -4.546 163 HB ILE 24 HB ILE 24 9.645 -4.889 -4.972 164 HG13 ILE 24 2HG1 ILE 24 11.392 -4.041 -3.477 165 HG21 ILE 24 1HG2 ILE 24 8.294 -6.169 -3.396 166 HG22 ILE 24 2HG2 ILE 24 8.762 -7.225 -4.716 167 HG23 ILE 24 3HG2 ILE 24 9.609 -7.351 -3.167 168 HD11 ILE 24 3HD1 ILE 24 9.162 -4.968 -1.657 169 HD12 ILE 24 1HD1 ILE 24 10.228 -3.568 -1.483 170 HD13 ILE 24 2HD1 ILE 24 9.034 -3.602 -2.801 171 H ASN 25 H ASN 25 10.855 -5.253 -7.514 172 HA ASN 25 HA ASN 25 9.320 -7.401 -8.638 173 HB3 ASN 25 2HB ASN 25 10.782 -5.064 -9.923 174 HD21 ASN 25 1HD2 ASN 25 7.965 -7.379 -10.518 175 HD22 ASN 25 2HD2 ASN 25 8.627 -7.757 -12.088 176 H SER 26 H SER 26 12.872 -6.858 -8.611 177 HA SER 26 HA SER 26 13.518 -8.842 -10.537 178 HB3 SER 26 2HB SER 26 15.690 -8.344 -9.083 179 HG SER 26 HG SER 26 15.937 -6.499 -10.444 180 H GLU 27 H GLU 27 12.538 -8.864 -7.173 181 HA GLU 27 HA GLU 27 14.242 -11.199 -6.474 182 HB3 GLU 27 2HB GLU 27 13.833 -10.381 -4.156 183 HG3 GLU 27 2HG GLU 27 14.639 -7.904 -4.615 184 H ILE 28 H ILE 28 11.250 -10.721 -7.551 185 HA ILE 28 HA ILE 28 10.096 -13.080 -6.112 186 HB ILE 28 HB ILE 28 8.600 -10.622 -7.077 187 HG13 ILE 28 2HG1 ILE 28 9.831 -10.214 -4.979 188 HG21 ILE 28 1HG2 ILE 28 7.569 -13.135 -5.694 189 HG22 ILE 28 2HG2 ILE 28 6.594 -11.749 -6.177 190 HG23 ILE 28 3HG2 ILE 28 7.323 -12.753 -7.407 191 HD11 ILE 28 3HD1 ILE 28 7.493 -9.303 -5.186 192 HD12 ILE 28 1HD1 ILE 28 6.947 -10.691 -4.198 193 HD13 ILE 28 2HD1 ILE 28 8.085 -9.521 -3.531 194 H LYS 29 H LYS 29 9.479 -14.704 -7.388 195 HA LYS 29 HA LYS 29 10.079 -14.695 -10.167 196 HB3 LYS 29 2HB LYS 29 8.927 -16.612 -8.174 197 HG3 LYS 29 2HG LYS 29 9.124 -18.279 -10.257 198 HD3 LYS 29 2HD LYS 29 6.445 -16.978 -9.600 199 HE3 LYS 29 2HE LYS 29 7.414 -19.686 -10.584 200 HZ1 LYS 29 3HZ LYS 29 5.704 -20.114 -8.989 201 HZ2 LYS 29 1HZ LYS 29 5.126 -20.376 -10.517 202 HZ3 LYS 29 2HZ LYS 29 4.691 -19.009 -9.729 203 H ASP 30 H ASP 30 8.949 -14.369 -11.900 204 HA ASP 30 HA ASP 30 7.396 -13.795 -13.317 205 HB3 ASP 30 2HB ASP 30 5.087 -14.884 -11.760 206 H SER 31 H SER 31 7.736 -12.011 -10.820 207 HA SER 31 HA SER 31 5.324 -10.705 -10.261 208 HB3 SER 31 2HB SER 31 8.234 -9.780 -10.050 209 HG SER 31 HG SER 31 7.326 -8.941 -8.020 210 H GLU 32 H GLU 32 4.980 -8.395 -10.552 211 HA GLU 32 HA GLU 32 6.084 -6.975 -12.889 212 HB3 GLU 32 2HB GLU 32 3.659 -6.023 -13.094 213 HG3 GLU 32 2HG GLU 32 4.193 -8.816 -14.062 214 H LEU 33 H LEU 33 5.599 -4.832 -12.713 215 HA LEU 33 HA LEU 33 5.000 -3.743 -10.124 216 HB3 LEU 33 2HB LEU 33 7.289 -3.630 -10.132 217 HG LEU 33 HG LEU 33 8.117 -4.101 -12.133 218 HD11 LEU 33 1HD1 LEU 33 6.603 -3.528 -13.794 219 HD12 LEU 33 2HD1 LEU 33 8.082 -2.680 -14.197 220 HD13 LEU 33 3HD1 LEU 33 6.748 -1.773 -13.449 221 HD21 LEU 33 3HD2 LEU 33 8.815 -1.173 -11.776 222 HD22 LEU 33 1HD2 LEU 33 9.833 -2.397 -12.535 223 HD23 LEU 33 2HD2 LEU 33 9.492 -2.522 -10.810 224 H LYS 34 H LYS 34 4.853 -1.333 -10.726 225 HA LYS 34 HA LYS 34 4.021 -0.269 -13.180 226 HB3 LYS 34 2HB LYS 34 1.495 0.011 -11.862 227 HG3 LYS 34 2HG LYS 34 2.197 -0.264 -14.459 228 HD3 LYS 34 2HD LYS 34 1.409 -2.988 -13.495 229 HE3 LYS 34 2HE LYS 34 -0.522 -1.712 -14.968 230 HZ1 LYS 34 3HZ LYS 34 -0.401 -2.896 -17.078 231 HZ2 LYS 34 1HZ LYS 34 1.175 -3.271 -16.813 232 HZ3 LYS 34 2HZ LYS 34 0.686 -1.672 -16.969 233 H GLU 35 H GLU 35 2.770 2.081 -12.525 234 HA GLU 35 HA GLU 35 3.590 2.756 -9.767 235 HB3 GLU 35 2HB GLU 35 5.205 3.541 -11.683 236 HG3 GLU 35 2HG GLU 35 4.822 5.979 -12.067 237 H VAL 36 H VAL 36 2.546 4.909 -9.100 238 HA VAL 36 HA VAL 36 -0.304 4.953 -10.003 239 HB VAL 36 HB VAL 36 0.814 5.843 -7.341 240 HG11 VAL 36 1HG1 VAL 36 -1.331 6.904 -7.918 241 HG12 VAL 36 2HG1 VAL 36 -2.043 5.314 -8.278 242 HG13 VAL 36 3HG1 VAL 36 -1.582 5.743 -6.615 243 HG21 VAL 36 3HG2 VAL 36 -0.624 3.224 -7.802 244 HG22 VAL 36 1HG2 VAL 36 1.115 3.414 -7.412 245 HG23 VAL 36 2HG2 VAL 36 -0.112 3.899 -6.253 246 H LYS 37 H LYS 37 -1.144 7.061 -10.575 247 HA LYS 37 HA LYS 37 0.802 9.280 -10.394 248 HB3 LYS 37 2HB LYS 37 0.991 9.232 -12.595 249 HG3 LYS 37 2HG LYS 37 -0.794 8.457 -14.183 250 HD3 LYS 37 2HD LYS 37 -0.337 5.982 -12.657 251 HE3 LYS 37 2HE LYS 37 -0.688 6.293 -15.214 252 HZ1 LYS 37 3HZ LYS 37 1.376 6.519 -16.419 253 HZ2 LYS 37 1HZ LYS 37 2.250 6.594 -15.057 254 HZ3 LYS 37 2HZ LYS 37 1.241 7.838 -15.461 255 H VAL 38 H VAL 38 -0.285 11.392 -10.247 256 HA VAL 38 HA VAL 38 -2.597 11.161 -8.483 257 HB VAL 38 HB VAL 38 -2.521 13.759 -8.593 258 HG11 VAL 38 1HG1 VAL 38 -0.735 13.802 -6.914 259 HG12 VAL 38 2HG1 VAL 38 -1.943 12.521 -6.697 260 HG13 VAL 38 3HG1 VAL 38 -0.328 12.127 -7.339 261 HG21 VAL 38 3HG2 VAL 38 -1.060 13.957 -10.601 262 HG22 VAL 38 1HG2 VAL 38 -0.501 14.832 -9.190 263 HG23 VAL 38 2HG2 VAL 38 0.298 13.307 -9.633 264 H SER 39 H SER 39 -4.273 13.245 -9.258 265 HA SER 39 HA SER 39 -4.770 13.111 -12.132 266 HB3 SER 39 2HB SER 39 -7.050 13.172 -10.172 267 HG SER 39 HG SER 39 -8.138 13.155 -11.879 268 H GLU 40 H GLU 40 -6.586 15.023 -12.379 269 HA GLU 40 HA GLU 40 -5.526 17.547 -11.486 270 HB3 GLU 40 2HB GLU 40 -8.199 16.674 -12.692 271 HG3 GLU 40 2HG GLU 40 -7.431 19.242 -11.937 272 H GLY 41 H GLY 41 -6.328 18.726 -9.596 273 HA2 GLY 41 1HA GLY 41 -8.946 18.496 -8.655 274 HA3 GLY 41 2HA GLY 41 -7.971 17.407 -7.661 275 H THR 42 H THR 42 -9.282 19.683 -6.574 276 HA THR 42 HA THR 42 -7.402 21.860 -6.347 277 HB THR 42 HB THR 42 -9.034 22.605 -4.540 278 HG1 THR 42 1HG THR 42 -10.222 20.974 -3.925 279 HG21 THR 42 3HG2 THR 42 -10.123 22.066 -7.317 280 HG22 THR 42 1HG2 THR 42 -9.041 23.406 -6.847 281 HG23 THR 42 2HG2 THR 42 -10.667 23.297 -6.149 282 H PHE 43 H PHE 43 -5.916 22.211 -4.922 283 HA PHE 43 HA PHE 43 -5.934 21.130 -2.293 284 HB3 PHE 43 2HB PHE 43 -3.512 20.417 -4.008 285 HD1 PHE 43 2HD PHE 43 -1.932 21.437 -2.327 286 HD2 PHE 43 1HD PHE 43 -4.799 18.405 -1.212 287 HE1 PHE 43 2HE PHE 43 -0.677 21.014 -0.244 288 HE2 PHE 43 1HE PHE 43 -3.527 17.990 0.878 289 HZ PHE 43 HZ PHE 43 -1.472 19.297 1.369 290 H ASP 44 H ASP 44 -4.096 22.836 -4.907 291 HA ASP 44 HA ASP 44 -3.810 25.193 -3.215 292 HB3 ASP 44 2HB ASP 44 -1.312 23.640 -4.021 293 H ALA 45 H ALA 45 -2.339 23.569 -6.099 294 HA ALA 45 HA ALA 45 -3.068 25.801 -7.860 295 HB1 ALA 45 1HB ALA 45 -0.205 24.822 -7.374 296 HB2 ALA 45 2HB ALA 45 -0.706 26.011 -8.593 297 HB3 ALA 45 3HB ALA 45 -0.842 26.403 -6.872 298 H ASP 46 H ASP 46 -2.394 25.180 -10.119 299 HA ASP 46 HA ASP 46 -2.656 22.290 -10.749 300 HB3 ASP 46 2HB ASP 46 -2.350 24.768 -12.483 301 H MET 47 H MET 47 -0.750 21.724 -9.463 302 HA MET 47 HA MET 47 1.290 21.166 -11.248 303 HB3 MET 47 2HB MET 47 2.838 22.397 -9.064 304 HG3 MET 47 2HG MET 47 2.727 22.771 -12.084 305 HE1 MET 47 3HE MET 47 6.466 23.850 -12.658 306 HE2 MET 47 1HE MET 47 5.832 22.211 -12.428 307 HE3 MET 47 2HE MET 47 4.945 23.365 -13.445 308 H TYR 48 H TYR 48 3.013 19.745 -10.067 309 HA TYR 48 HA TYR 48 1.659 17.896 -8.379 310 HB3 TYR 48 2HB TYR 48 4.152 17.072 -8.103 311 HD1 TYR 48 1HD TYR 48 1.585 17.614 -10.831 312 HD2 TYR 48 2HD TYR 48 4.651 15.046 -9.176 313 HE1 TYR 48 1HE TYR 48 0.820 15.795 -12.261 314 HE2 TYR 48 2HE TYR 48 3.935 13.232 -10.683 315 HH TYR 48 HH TYR 48 0.949 13.402 -12.559 316 H LYS 49 H LYS 49 0.883 18.922 -6.571 317 HA LYS 49 HA LYS 49 2.781 19.569 -4.397 318 HB3 LYS 49 2HB LYS 49 0.655 21.626 -4.837 319 HG3 LYS 49 2HG LYS 49 2.629 23.178 -4.663 320 HD3 LYS 49 2HD LYS 49 2.555 21.207 -2.338 321 HE3 LYS 49 2HE LYS 49 3.379 24.122 -2.627 322 HZ1 LYS 49 3HZ LYS 49 2.212 23.908 -0.587 323 HZ2 LYS 49 1HZ LYS 49 3.831 23.941 -0.252 324 HZ3 LYS 49 2HZ LYS 49 3.004 22.522 -0.172 325 H THR 50 H THR 50 0.119 17.789 -5.230 326 HA THR 50 HA THR 50 -1.749 18.673 -3.286 327 HB THR 50 HB THR 50 -2.304 17.727 -5.475 328 HG1 THR 50 1HG THR 50 -3.365 16.530 -3.168 329 HG21 THR 50 3HG2 THR 50 -1.616 15.011 -4.277 330 HG22 THR 50 1HG2 THR 50 -0.741 15.830 -5.580 331 HG23 THR 50 2HG2 THR 50 -2.424 15.326 -5.831 332 H SER 51 H SER 51 0.869 17.844 -2.062 333 HA SER 51 HA SER 51 -0.376 16.752 0.247 334 HB3 SER 51 2HB SER 51 0.283 14.612 -0.587 335 HG SER 51 HG SER 51 2.918 15.603 -0.932 336 H ASP 52 H ASP 52 1.060 17.231 2.166 337 HA ASP 52 HA ASP 52 2.847 19.504 1.493 338 HB3 ASP 52 2HB ASP 52 1.582 19.157 4.195 339 H ILE 53 H ILE 53 4.073 19.677 4.035 340 HA ILE 53 HA ILE 53 6.164 17.723 3.649 341 HB ILE 53 HB ILE 53 7.331 18.885 5.394 342 HG13 ILE 53 2HG1 ILE 53 5.557 19.237 7.048 343 HG21 ILE 53 1HG2 ILE 53 7.076 19.878 3.066 344 HG22 ILE 53 2HG2 ILE 53 5.860 20.966 3.745 345 HG23 ILE 53 3HG2 ILE 53 7.530 21.049 4.314 346 HD11 ILE 53 3HD1 ILE 53 7.490 20.727 7.254 347 HD12 ILE 53 1HD1 ILE 53 6.684 21.936 6.220 348 HD13 ILE 53 2HD1 ILE 53 5.972 21.499 7.769 349 H ALA 54 H ALA 54 3.366 17.928 5.753 350 HA ALA 54 HA ALA 54 3.759 15.305 6.765 351 HB1 ALA 54 1HB ALA 54 4.250 17.563 8.772 352 HB2 ALA 54 2HB ALA 54 4.001 15.846 9.159 353 HB3 ALA 54 3HB ALA 54 5.428 16.337 8.252 354 H LEU 55 H LEU 55 2.387 18.291 8.162 355 HA LEU 55 HA LEU 55 -0.219 17.254 8.720 356 HB3 LEU 55 2HB LEU 55 -0.326 20.076 8.660 357 HG LEU 55 HG LEU 55 0.512 20.071 10.990 358 HD11 LEU 55 1HD1 LEU 55 -1.853 19.792 10.421 359 HD12 LEU 55 2HD1 LEU 55 -1.461 18.942 11.903 360 HD13 LEU 55 3HD1 LEU 55 -1.672 18.030 10.374 361 HD21 LEU 55 3HD2 LEU 55 0.694 17.034 10.750 362 HD22 LEU 55 1HD2 LEU 55 0.841 18.021 12.214 363 HD23 LEU 55 2HD2 LEU 55 2.061 18.150 10.938 364 H ASP 56 H ASP 56 -2.062 18.938 7.910 365 HA ASP 56 HA ASP 56 -3.344 19.847 6.371 366 HB3 ASP 56 2HB ASP 56 -2.415 20.855 4.348 367 H GLN 57 H GLN 57 -2.273 16.864 6.108 368 HA GLN 57 HA GLN 57 -4.371 16.096 4.150 369 HB3 GLN 57 2HB GLN 57 -1.617 14.817 4.438 370 HG3 GLN 57 2HG GLN 57 -4.002 14.175 2.758 371 HE21 GLN 57 1HE2 GLN 57 -3.802 15.466 0.868 372 HE22 GLN 57 2HE2 GLN 57 -2.483 15.299 -0.287 373 H ILE 58 H ILE 58 -4.011 16.296 7.276 374 HA ILE 58 HA ILE 58 -4.878 13.516 7.912 375 HB ILE 58 HB ILE 58 -2.799 15.073 9.497 376 HG13 ILE 58 2HG1 ILE 58 -2.672 12.763 7.541 377 HG21 ILE 58 1HG2 ILE 58 -3.976 12.289 9.953 378 HG22 ILE 58 2HG2 ILE 58 -2.769 13.091 10.968 379 HG23 ILE 58 3HG2 ILE 58 -4.423 13.694 10.921 380 HD11 ILE 58 3HD1 ILE 58 -0.546 14.718 8.482 381 HD12 ILE 58 1HD1 ILE 58 -0.491 13.661 7.051 382 HD13 ILE 58 2HD1 ILE 58 -1.584 15.046 7.089 383 H GLN 59 H GLN 59 -4.437 16.487 9.987 384 HA GLN 59 HA GLN 59 -7.058 15.781 11.186 385 HB3 GLN 59 2HB GLN 59 -6.334 17.536 12.883 386 HG3 GLN 59 2HG GLN 59 -4.434 15.180 12.639 387 HE21 GLN 59 1HE2 GLN 59 -2.841 15.896 14.040 388 HE22 GLN 59 2HE2 GLN 59 -3.149 16.319 15.711 389 H GLY 60 H GLY 60 -8.604 16.612 9.805 390 HA2 GLY 60 1HA GLY 60 -10.074 18.569 9.660 391 HA3 GLY 60 2HA GLY 60 -8.654 19.597 9.498 392 H ASN 61 H ASN 61 -7.285 17.630 7.757 393 HA ASN 61 HA ASN 61 -8.795 17.974 5.190 394 HB3 ASN 61 2HB ASN 61 -6.369 18.145 4.258 395 HD21 ASN 61 1HD2 ASN 61 -7.769 19.429 3.062 396 HD22 ASN 61 2HD2 ASN 61 -8.020 21.125 3.416 397 H LYS 62 H LYS 62 -9.162 15.672 6.708 398 HA LYS 62 HA LYS 62 -7.258 13.630 5.897 399 HB3 LYS 62 2HB LYS 62 -10.065 13.017 6.871 400 HG3 LYS 62 2HG LYS 62 -7.306 11.817 7.147 401 HD3 LYS 62 2HD LYS 62 -8.389 11.846 9.392 402 HE3 LYS 62 2HE LYS 62 -10.777 11.404 8.532 403 HZ1 LYS 62 3HZ LYS 62 -10.372 9.490 7.142 404 HZ2 LYS 62 1HZ LYS 62 -11.260 8.988 8.452 405 HZ3 LYS 62 2HZ LYS 62 -9.665 8.659 8.364 406 H ASP 63 H ASP 63 -9.725 15.254 4.193 407 HA ASP 63 HA ASP 63 -10.400 12.963 2.490 408 HB3 ASP 63 2HB ASP 63 -10.930 15.813 1.685 409 H PHE 64 H PHE 64 -9.079 12.290 0.891 410 HA PHE 64 HA PHE 64 -6.643 13.881 0.351 411 HB3 PHE 64 2HB PHE 64 -6.029 12.028 1.568 412 HD1 PHE 64 1HD PHE 64 -7.661 10.162 -1.253 413 HD2 PHE 64 2HD PHE 64 -7.216 10.613 3.001 414 HE1 PHE 64 1HE PHE 64 -9.179 8.227 -0.885 415 HE2 PHE 64 2HE PHE 64 -8.716 8.682 3.373 416 HZ PHE 64 HZ PHE 64 -9.792 7.540 1.420 417 HA PRO 65 HA PRO 65 -7.546 14.094 -3.870 418 HB3 PRO 65 2HB PRO 65 -5.523 15.095 -4.259 419 HG3 PRO 65 2HG PRO 65 -3.569 14.419 -3.094 420 HD3 PRO 65 2HD PRO 65 -5.245 14.748 -1.444 421 H GLU 66 H GLU 66 -7.772 12.950 -5.947 422 HA GLU 66 HA GLU 66 -8.040 10.055 -5.678 423 HB3 GLU 66 2HB GLU 66 -9.820 11.307 -6.718 424 HG3 GLU 66 2HG GLU 66 -8.774 11.900 -9.233 425 H ILE 67 H ILE 67 -7.376 9.027 -8.086 426 HA ILE 67 HA ILE 67 -4.489 9.550 -8.480 427 HB ILE 67 HB ILE 67 -4.011 7.161 -8.385 428 HG13 ILE 67 2HG1 ILE 67 -6.220 6.272 -9.048 429 HG21 ILE 67 1HG2 ILE 67 -3.821 8.575 -6.357 430 HG22 ILE 67 2HG2 ILE 67 -5.370 7.949 -5.778 431 HG23 ILE 67 3HG2 ILE 67 -3.984 6.852 -6.009 432 HD11 ILE 67 3HD1 ILE 67 -4.617 4.752 -7.910 433 HD12 ILE 67 1HD1 ILE 67 -5.442 5.100 -6.364 434 HD13 ILE 67 2HD1 ILE 67 -6.322 4.318 -7.682 435 H GLN 68 H GLN 68 -3.742 8.301 -10.396 436 HA GLN 68 HA GLN 68 -5.814 7.503 -12.387 437 HB3 GLN 68 2HB GLN 68 -3.908 8.231 -14.043 438 HG3 GLN 68 2HG GLN 68 -5.447 10.438 -12.607 439 HE21 GLN 68 1HE2 GLN 68 -3.500 11.677 -13.170 440 HE22 GLN 68 2HE2 GLN 68 -3.431 12.472 -14.709 441 H LEU 69 H LEU 69 -5.000 5.867 -13.893 442 HA LEU 69 HA LEU 69 -2.452 4.710 -13.764 443 HB3 LEU 69 2HB LEU 69 -3.531 3.803 -11.603 444 HG LEU 69 HG LEU 69 -4.698 1.708 -13.393 445 HD11 LEU 69 1HD1 LEU 69 -5.676 0.905 -11.315 446 HD12 LEU 69 2HD1 LEU 69 -4.995 2.277 -10.426 447 HD13 LEU 69 3HD1 LEU 69 -3.926 1.067 -11.188 448 HD21 LEU 69 3HD2 LEU 69 -6.284 3.536 -13.742 449 HD22 LEU 69 1HD2 LEU 69 -6.187 4.008 -12.024 450 HD23 LEU 69 2HD2 LEU 69 -6.977 2.501 -12.520 451 H ASP 70 H ASP 70 -2.825 2.318 -14.896 452 HA ASP 70 HA ASP 70 -4.158 2.712 -17.470 453 HB3 ASP 70 2HB ASP 70 -2.728 0.285 -16.516 454 H ASN 71 H ASN 71 -4.907 0.250 -18.218 455 HA ASN 71 HA ASN 71 -7.122 -0.731 -16.581 456 HB3 ASN 71 2HB ASN 71 -6.407 -2.643 -18.462 457 HD21 ASN 71 1HD2 ASN 71 -8.708 -2.524 -17.350 458 HD22 ASN 71 2HD2 ASN 71 -9.917 -1.880 -18.452 459 H ILE 72 H ILE 72 -6.090 -1.081 -14.717 460 HA ILE 72 HA ILE 72 -4.430 -3.594 -14.687 461 HB ILE 72 HB ILE 72 -4.705 -1.738 -12.307 462 HG13 ILE 72 2HG1 ILE 72 -3.601 -0.349 -13.944 463 HG21 ILE 72 1HG2 ILE 72 -2.747 -2.951 -11.427 464 HG22 ILE 72 2HG2 ILE 72 -4.024 -4.064 -11.797 465 HG23 ILE 72 3HG2 ILE 72 -2.656 -3.918 -12.918 466 HD11 ILE 72 3HD1 ILE 72 -2.431 -0.496 -11.660 467 HD12 ILE 72 1HD1 ILE 72 -1.218 -1.496 -12.483 468 HD13 ILE 72 2HD1 ILE 72 -1.514 0.171 -13.023 469 H ASP 73 H ASP 73 -5.244 -5.234 -13.224 470 HA ASP 73 HA ASP 73 -7.647 -4.570 -11.714 471 HB3 ASP 73 2HB ASP 73 -7.610 -7.170 -13.273 472 H TYR 74 H TYR 74 -7.448 -5.422 -9.723 473 HA TYR 74 HA TYR 74 -4.889 -6.531 -8.975 474 HB3 TYR 74 2HB TYR 74 -5.709 -6.249 -6.706 475 HD1 TYR 74 1HD TYR 74 -4.062 -4.378 -7.902 476 HD2 TYR 74 2HD TYR 74 -8.367 -4.054 -7.501 477 HE1 TYR 74 1HE TYR 74 -3.943 -1.988 -8.460 478 HE2 TYR 74 2HE TYR 74 -8.226 -1.685 -8.037 479 HH TYR 74 HH TYR 74 -6.660 -0.334 -9.550 480 H ASN 75 H ASN 75 -7.979 -7.888 -9.813 481 HA ASN 75 HA ASN 75 -8.080 -10.060 -8.010 482 HB3 ASN 75 2HB ASN 75 -9.253 -10.295 -10.796 483 HD21 ASN 75 1HD2 ASN 75 -10.851 -9.388 -7.770 484 HD22 ASN 75 2HD2 ASN 75 -11.765 -10.887 -7.605 485 H ASN 76 H ASN 76 -6.340 -9.736 -11.059 486 HA ASN 76 HA ASN 76 -5.998 -12.626 -11.264 487 HB3 ASN 76 2HB ASN 76 -6.687 -11.364 -13.189 488 HD21 ASN 76 1HD2 ASN 76 -6.639 -9.447 -14.155 489 HD22 ASN 76 2HD2 ASN 76 -5.236 -8.616 -14.744 490 H TYR 77 H TYR 77 -4.585 -10.890 -9.158 491 HA TYR 77 HA TYR 77 -1.963 -12.207 -9.538 492 HB3 TYR 77 2HB TYR 77 -0.904 -10.426 -8.213 493 HD1 TYR 77 1HD TYR 77 -3.426 -8.402 -10.041 494 HD2 TYR 77 2HD TYR 77 0.420 -10.347 -10.316 495 HE1 TYR 77 1HE TYR 77 -2.875 -7.054 -12.002 496 HE2 TYR 77 2HE TYR 77 0.950 -9.066 -12.312 497 HH TYR 77 HH TYR 77 0.179 -7.592 -13.888 498 H ASP 78 H ASP 78 -0.954 -12.760 -7.386 499 HA ASP 78 HA ASP 78 -3.045 -13.558 -5.411 500 HB3 ASP 78 2HB ASP 78 -0.199 -14.585 -5.697 501 H LEU 79 H LEU 79 -0.156 -11.601 -5.881 502 HA LEU 79 HA LEU 79 0.006 -10.986 -2.967 503 HB3 LEU 79 2HB LEU 79 2.096 -11.846 -4.962 504 HG LEU 79 HG LEU 79 3.093 -10.091 -3.416 505 HD11 LEU 79 1HD1 LEU 79 1.752 -10.378 -1.395 506 HD12 LEU 79 2HD1 LEU 79 3.435 -10.783 -1.020 507 HD13 LEU 79 3HD1 LEU 79 2.270 -12.079 -1.260 508 HD21 LEU 79 3HD2 LEU 79 4.967 -11.543 -2.711 509 HD22 LEU 79 1HD2 LEU 79 4.420 -12.009 -4.324 510 HD23 LEU 79 2HD2 LEU 79 3.929 -12.971 -2.923 511 H ILE 80 H ILE 80 -0.145 -8.808 -2.601 512 HA ILE 80 HA ILE 80 0.682 -6.978 -4.827 513 HB ILE 80 HB ILE 80 -1.866 -6.808 -3.180 514 HG13 ILE 80 2HG1 ILE 80 -1.949 -8.503 -4.995 515 HG21 ILE 80 1HG2 ILE 80 -2.350 -4.776 -4.459 516 HG22 ILE 80 2HG2 ILE 80 -0.794 -4.552 -3.693 517 HG23 ILE 80 3HG2 ILE 80 -0.897 -4.986 -5.430 518 HD11 ILE 80 3HD1 ILE 80 -3.796 -7.733 -6.279 519 HD12 ILE 80 1HD1 ILE 80 -3.956 -6.980 -4.679 520 HD13 ILE 80 2HD1 ILE 80 -3.369 -6.031 -6.049 521 H LEU 81 H LEU 81 2.197 -5.696 -4.257 522 HA LEU 81 HA LEU 81 2.755 -5.225 -1.357 523 HB3 LEU 81 2HB LEU 81 5.105 -5.208 -2.077 524 HG LEU 81 HG LEU 81 3.702 -7.633 -3.311 525 HD11 LEU 81 1HD1 LEU 81 6.542 -7.304 -2.281 526 HD12 LEU 81 2HD1 LEU 81 6.048 -7.412 -3.994 527 HD13 LEU 81 3HD1 LEU 81 5.797 -8.789 -2.910 528 HD21 LEU 81 3HD2 LEU 81 4.295 -8.678 -1.062 529 HD22 LEU 81 1HD2 LEU 81 3.005 -7.472 -0.999 530 HD23 LEU 81 2HD2 LEU 81 4.645 -7.032 -0.500 531 H ILE 82 H ILE 82 3.132 -3.086 -0.667 532 HA ILE 82 HA ILE 82 2.932 -0.956 -2.770 533 HB ILE 82 HB ILE 82 1.403 -0.987 -0.129 534 HG13 ILE 82 2HG1 ILE 82 0.514 -2.857 -1.516 535 HG21 ILE 82 1HG2 ILE 82 0.151 0.852 -1.326 536 HG22 ILE 82 2HG2 ILE 82 1.863 1.208 -1.096 537 HG23 ILE 82 3HG2 ILE 82 1.277 0.665 -2.671 538 HD11 ILE 82 3HD1 ILE 82 -1.502 -0.599 -1.585 539 HD12 ILE 82 1HD1 ILE 82 -1.780 -2.339 -1.471 540 HD13 ILE 82 2HD1 ILE 82 -1.055 -1.480 -0.101 541 H GLY 83 H GLY 83 4.466 0.719 -2.473 542 HA2 GLY 83 1HA GLY 83 5.812 0.850 0.205 543 HA3 GLY 83 2HA GLY 83 6.525 1.322 -1.328 544 H SER 84 H SER 84 6.576 2.966 0.984 545 HA SER 84 HA SER 84 5.408 5.507 0.072 546 HB3 SER 84 2HB SER 84 4.648 4.262 2.735 547 HG SER 84 HG SER 84 4.743 6.452 2.906 548 HA PRO 85 HA PRO 85 8.779 6.511 3.153 549 HB3 PRO 85 2HB PRO 85 9.278 8.332 1.707 550 HG3 PRO 85 2HG PRO 85 7.550 9.695 0.826 551 HD3 PRO 85 2HD PRO 85 6.850 7.613 -0.002 552 H VAL 86 H VAL 86 8.657 7.975 5.263 553 HA VAL 86 HA VAL 86 6.106 8.767 6.251 554 HB VAL 86 HB VAL 86 5.792 6.412 6.580 555 HG11 VAL 86 1HG1 VAL 86 7.944 5.429 6.778 556 HG12 VAL 86 2HG1 VAL 86 8.228 6.221 8.346 557 HG13 VAL 86 3HG1 VAL 86 6.957 5.006 8.157 558 HG21 VAL 86 3HG2 VAL 86 5.152 6.512 8.944 559 HG22 VAL 86 1HG2 VAL 86 6.271 7.848 9.233 560 HG23 VAL 86 2HG2 VAL 86 4.845 8.054 8.176 561 H TRP 87 H TRP 87 6.588 10.523 7.442 562 HA TRP 87 HA TRP 87 9.187 10.519 8.937 563 HB3 TRP 87 2HB TRP 87 7.991 12.896 7.512 564 HD1 TRP 87 HD TRP 87 11.517 11.736 8.610 565 HE1 TRP 87 1HE TRP 87 12.663 13.608 9.952 566 HE3 TRP 87 3HE TRP 87 7.735 15.188 8.578 567 HZ2 TRP 87 2HZ TRP 87 11.926 16.131 11.110 568 HZ3 TRP 87 3HZ TRP 87 7.978 17.293 9.844 569 HH2 TRP 87 HH TRP 87 10.064 17.747 11.142 570 H SER 88 H SER 88 5.970 11.596 9.001 571 HA SER 88 HA SER 88 6.224 11.716 11.943 572 HB3 SER 88 2HB SER 88 4.803 13.993 10.538 573 HG SER 88 HG SER 88 6.327 13.750 12.946 574 H GLY 89 H GLY 89 5.192 9.826 11.978 575 HA2 GLY 89 1HA GLY 89 3.533 8.390 12.405 576 HA3 GLY 89 2HA GLY 89 2.396 9.697 12.357 577 H TYR 90 H TYR 90 2.233 10.495 9.869 578 HA TYR 90 HA TYR 90 1.864 8.546 7.876 579 HB3 TYR 90 2HB TYR 90 0.136 7.557 8.953 580 HD1 TYR 90 2HD TYR 90 -0.030 11.069 10.254 581 HD2 TYR 90 1HD TYR 90 -2.003 7.242 10.097 582 HE1 TYR 90 2HE TYR 90 -1.108 11.530 12.406 583 HE2 TYR 90 1HE TYR 90 -3.021 7.655 12.289 584 HH TYR 90 HH TYR 90 -2.616 8.925 14.277 585 HA PRO 91 HA PRO 91 1.822 13.120 7.155 586 HB3 PRO 91 2HB PRO 91 4.148 13.124 7.365 587 HG3 PRO 91 2HG PRO 91 5.473 11.362 6.479 588 HD3 PRO 91 2HD PRO 91 4.007 10.379 8.024 589 H ALA 92 H ALA 92 1.351 10.492 4.998 590 HA ALA 92 HA ALA 92 0.655 12.246 2.711 591 HB1 ALA 92 1HB ALA 92 2.197 9.578 2.447 592 HB2 ALA 92 2HB ALA 92 1.933 10.833 1.219 593 HB3 ALA 92 3HB ALA 92 3.023 11.141 2.548 594 H THR 93 H THR 93 -0.929 11.028 1.226 595 HA THR 93 HA THR 93 -2.201 8.618 2.491 596 HB THR 93 HB THR 93 -4.363 9.646 1.512 597 HG1 THR 93 1HG THR 93 -3.286 11.309 0.319 598 HG21 THR 93 3HG2 THR 93 -4.238 9.572 3.867 599 HG22 THR 93 1HG2 THR 93 -4.730 11.208 3.441 600 HG23 THR 93 2HG2 THR 93 -3.057 10.908 3.946 601 HA PRO 94 HA PRO 94 -1.591 7.901 -2.041 602 HB3 PRO 94 2HB PRO 94 0.729 8.514 -2.313 603 HG3 PRO 94 2HG PRO 94 2.280 8.280 -0.511 604 HD3 PRO 94 2HD PRO 94 0.551 9.636 0.206 605 H ILE 95 H ILE 95 -1.440 6.276 0.991 606 HA ILE 95 HA ILE 95 -2.371 3.878 -0.494 607 HB ILE 95 HB ILE 95 -1.365 3.608 2.289 608 HG13 ILE 95 2HG1 ILE 95 0.913 3.059 1.695 609 HG21 ILE 95 1HG2 ILE 95 -2.516 1.757 1.230 610 HG22 ILE 95 2HG2 ILE 95 -1.431 1.821 -0.159 611 HG23 ILE 95 3HG2 ILE 95 -0.804 1.321 1.421 612 HD11 ILE 95 3HD1 ILE 95 0.341 3.158 -1.001 613 HD12 ILE 95 1HD1 ILE 95 1.010 4.774 -0.715 614 HD13 ILE 95 2HD1 ILE 95 1.959 3.377 -0.283 615 H LYS 96 H LYS 96 -4.208 5.305 -0.455 616 HA LYS 96 HA LYS 96 -5.970 4.304 1.616 617 HB3 LYS 96 2HB LYS 96 -7.024 6.872 1.070 618 HG3 LYS 96 2HG LYS 96 -6.564 7.285 3.515 619 HD3 LYS 96 2HD LYS 96 -7.639 4.472 2.975 620 HE3 LYS 96 2HE LYS 96 -8.007 6.389 5.313 621 HZ1 LYS 96 3HZ LYS 96 -8.965 3.596 4.951 622 HZ2 LYS 96 1HZ LYS 96 -9.893 4.955 5.015 623 HZ3 LYS 96 2HZ LYS 96 -9.060 4.465 6.330 624 H THR 97 H THR 97 -5.884 6.288 -1.449 625 HA THR 97 HA THR 97 -8.476 5.497 -2.297 626 HB THR 97 HB THR 97 -6.038 6.099 -4.051 627 HG1 THR 97 1HG THR 97 -7.549 8.219 -3.076 628 HG21 THR 97 3HG2 THR 97 -7.970 5.729 -5.429 629 HG22 THR 97 1HG2 THR 97 -7.667 7.475 -5.406 630 HG23 THR 97 2HG2 THR 97 -8.966 6.787 -4.416 631 H LEU 98 H LEU 98 -5.325 3.977 -2.953 632 HA LEU 98 HA LEU 98 -6.198 2.107 -4.853 633 HB3 LEU 98 2HB LEU 98 -4.114 0.948 -3.155 634 HG LEU 98 HG LEU 98 -2.721 1.089 -5.068 635 HD11 LEU 98 1HD1 LEU 98 -5.498 0.300 -6.004 636 HD12 LEU 98 2HD1 LEU 98 -4.390 -0.706 -5.059 637 HD13 LEU 98 3HD1 LEU 98 -3.945 -0.207 -6.684 638 HD21 LEU 98 3HD2 LEU 98 -3.222 2.215 -7.095 639 HD22 LEU 98 1HD2 LEU 98 -3.405 3.392 -5.785 640 HD23 LEU 98 2HD2 LEU 98 -4.846 2.634 -6.541 641 H LEU 99 H LEU 99 -5.970 1.660 -1.230 642 HA LEU 99 HA LEU 99 -6.790 -0.954 -1.033 643 HB3 LEU 99 2HB LEU 99 -7.896 -0.176 1.117 644 HG LEU 99 HG LEU 99 -6.021 -0.343 2.159 645 HD11 LEU 99 1HD1 LEU 99 -3.854 -0.543 1.284 646 HD12 LEU 99 2HD1 LEU 99 -4.373 0.115 -0.292 647 HD13 LEU 99 3HD1 LEU 99 -5.018 -1.431 0.312 648 HD21 LEU 99 3HD2 LEU 99 -5.085 2.301 1.145 649 HD22 LEU 99 1HD2 LEU 99 -4.524 1.456 2.592 650 HD23 LEU 99 2HD2 LEU 99 -6.181 2.058 2.489 651 H ASP 100 H ASP 100 -8.880 1.926 -1.560 652 HA ASP 100 HA ASP 100 -11.334 0.465 -1.258 653 HB3 ASP 100 2HB ASP 100 -10.991 2.945 -2.935 654 H GLN 101 H GLN 101 -9.071 0.711 -3.905 655 HA GLN 101 HA GLN 101 -11.089 0.002 -5.953 656 HB3 GLN 101 2HB GLN 101 -9.340 0.182 -7.556 657 HG3 GLN 101 2HG GLN 101 -8.502 2.362 -5.690 658 HE21 GLN 101 1HE2 GLN 101 -10.011 4.379 -7.042 659 HE22 GLN 101 2HE2 GLN 101 -9.367 4.549 -8.665 660 H MET 102 H MET 102 -8.429 -1.328 -4.077 661 HA MET 102 HA MET 102 -8.518 -4.026 -5.041 662 HB3 MET 102 2HB MET 102 -7.078 -4.452 -3.110 663 HG3 MET 102 2HG MET 102 -6.431 -1.851 -4.561 664 HE1 MET 102 3HE MET 102 -4.475 -5.062 -3.432 665 HE2 MET 102 1HE MET 102 -3.419 -4.476 -2.127 666 HE3 MET 102 2HE MET 102 -5.165 -4.629 -1.852 667 H LYS 103 H LYS 103 -11.107 -2.617 -3.605 668 HA LYS 103 HA LYS 103 -11.679 -4.209 -1.330 669 HB3 LYS 103 2HB LYS 103 -14.139 -3.769 -2.114 670 HG3 LYS 103 2HG LYS 103 -13.737 -1.171 -1.839 671 HD3 LYS 103 2HD LYS 103 -13.215 -3.293 0.251 672 HE3 LYS 103 2HE LYS 103 -12.173 -1.129 0.980 673 HZ1 LYS 103 3HZ LYS 103 -13.702 0.502 0.052 674 HZ2 LYS 103 1HZ LYS 103 -13.765 0.587 1.691 675 HZ3 LYS 103 2HZ LYS 103 -14.971 -0.159 0.862 676 H ASN 104 H ASN 104 -11.573 -5.216 -4.682 677 HA ASN 104 HA ASN 104 -12.745 -7.851 -3.904 678 HB3 ASN 104 2HB ASN 104 -13.307 -8.128 -6.263 679 HD21 ASN 104 1HD2 ASN 104 -14.459 -6.950 -3.580 680 HD22 ASN 104 2HD2 ASN 104 -15.728 -5.899 -4.089 681 H TYR 105 H TYR 105 -10.101 -7.200 -3.169 682 HA TYR 105 HA TYR 105 -8.644 -9.151 -4.880 683 HB3 TYR 105 2HB TYR 105 -7.697 -6.863 -3.143 684 HD1 TYR 105 1HD TYR 105 -6.295 -9.499 -5.495 685 HD2 TYR 105 2HD TYR 105 -5.852 -7.238 -1.832 686 HE1 TYR 105 1HE TYR 105 -4.169 -10.639 -5.058 687 HE2 TYR 105 2HE TYR 105 -3.657 -8.343 -1.435 688 HH TYR 105 HH TYR 105 -2.418 -10.967 -3.357 689 H ARG 106 H ARG 106 -8.136 -11.026 -3.990 690 HA ARG 106 HA ARG 106 -8.055 -11.411 -1.066 691 HB3 ARG 106 2HB ARG 106 -8.842 -13.751 -1.602 692 HG3 ARG 106 2HG ARG 106 -11.206 -12.227 -2.476 693 HD3 ARG 106 2HD ARG 106 -11.745 -12.647 0.041 694 HE ARG 106 HE ARG 106 -12.276 -14.203 -2.036 695 HH11 ARG 106 1HH1 ARG 106 -10.993 -15.199 1.149 696 HH12 ARG 106 2HH1 ARG 106 -11.553 -16.832 0.997 697 HH21 ARG 106 1HH2 ARG 106 -13.258 -16.234 -2.059 698 HH22 ARG 106 2HH2 ARG 106 -12.861 -17.455 -0.891 699 H GLY 107 H GLY 107 -6.021 -12.295 -0.525 700 HA2 GLY 107 1HA GLY 107 -4.261 -13.856 -1.965 701 HA3 GLY 107 2HA GLY 107 -4.048 -12.219 -2.610 702 H GLU 108 H GLU 108 -2.036 -11.612 -1.604 703 HA GLU 108 HA GLU 108 -1.925 -11.591 1.362 704 HB3 GLU 108 2HB GLU 108 0.530 -12.149 0.964 705 HG3 GLU 108 2HG GLU 108 -1.522 -14.236 0.121 706 H VAL 109 H VAL 109 -1.326 -9.630 2.138 707 HA VAL 109 HA VAL 109 -0.106 -7.642 0.256 708 HB VAL 109 HB VAL 109 -1.770 -7.050 2.767 709 HG11 VAL 109 1HG1 VAL 109 -1.645 -4.714 1.987 710 HG12 VAL 109 2HG1 VAL 109 -0.060 -5.309 2.412 711 HG13 VAL 109 3HG1 VAL 109 -0.513 -5.182 0.700 712 HG21 VAL 109 3HG2 VAL 109 -2.317 -6.821 -0.226 713 HG22 VAL 109 1HG2 VAL 109 -3.173 -7.855 0.939 714 HG23 VAL 109 2HG2 VAL 109 -3.321 -6.094 1.044 715 H ALA 110 H ALA 110 1.728 -6.541 0.725 716 HA ALA 110 HA ALA 110 2.685 -6.535 3.463 717 HB1 ALA 110 1HB ALA 110 4.174 -8.098 1.823 718 HB2 ALA 110 2HB ALA 110 4.924 -6.500 1.538 719 HB3 ALA 110 3HB ALA 110 4.821 -7.136 3.171 720 H SER 111 H SER 111 4.195 -4.540 3.732 721 HA SER 111 HA SER 111 3.552 -2.447 1.774 722 HB3 SER 111 2HB SER 111 1.788 -1.962 3.159 723 HG SER 111 HG SER 111 2.180 -3.413 4.842 724 H PHE 112 H PHE 112 5.613 -2.104 1.112 725 HA PHE 112 HA PHE 112 7.736 -2.316 3.107 726 HB3 PHE 112 2HB PHE 112 8.042 -3.625 1.153 727 HD1 PHE 112 2HD PHE 112 6.020 -3.519 -0.467 728 HD2 PHE 112 1HD PHE 112 9.388 -0.859 -0.742 729 HE1 PHE 112 2HE PHE 112 5.416 -2.940 -2.814 730 HE2 PHE 112 1HE PHE 112 8.671 -0.233 -3.060 731 HZ PHE 112 HZ PHE 112 6.657 -1.215 -4.047 732 H PHE 113 H PHE 113 7.383 -0.339 4.236 733 HA PHE 113 HA PHE 113 7.532 2.202 2.815 734 HB3 PHE 113 2HB PHE 113 6.244 2.239 4.776 735 HD1 PHE 113 2HD PHE 113 6.327 -0.188 5.773 736 HD2 PHE 113 1HD PHE 113 8.891 3.046 7.060 737 HE1 PHE 113 2HE PHE 113 6.899 -1.435 7.805 738 HE2 PHE 113 1HE PHE 113 9.401 1.826 9.105 739 HZ PHE 113 HZ PHE 113 8.399 -0.459 9.499 740 H THR 114 H THR 114 9.316 3.835 3.465 741 HA THR 114 HA THR 114 11.990 2.483 3.269 742 HB THR 114 HB THR 114 12.415 4.103 1.362 743 HG1 THR 114 1HG THR 114 9.573 4.309 1.438 744 HG21 THR 114 3HG2 THR 114 10.228 2.037 0.899 745 HG22 THR 114 1HG2 THR 114 11.978 1.717 0.995 746 HG23 THR 114 2HG2 THR 114 11.329 2.744 -0.307 747 H SER 115 H SER 115 10.962 3.784 5.615 748 HA SER 115 HA SER 115 12.669 6.154 5.868 749 HB3 SER 115 2HB SER 115 10.444 7.359 6.575 750 HG SER 115 HG SER 115 11.742 7.694 4.600 751 H ALA 116 H ALA 116 13.349 6.373 7.902 752 HA ALA 116 HA ALA 116 11.814 5.340 10.207 753 HB1 ALA 116 1HB ALA 116 14.652 4.451 9.520 754 HB2 ALA 116 2HB ALA 116 13.755 4.035 10.993 755 HB3 ALA 116 3HB ALA 116 13.188 3.439 9.426 756 H GLY 117 H GLY 117 12.162 8.012 9.529 757 HA2 GLY 117 1HA GLY 117 14.521 9.357 10.485 758 HA3 GLY 117 2HA GLY 117 12.918 10.067 10.247 759 H THR 118 H THR 118 11.248 9.554 11.974 760 HA THR 118 HA THR 118 12.383 8.745 14.613 761 HB THR 118 HB THR 118 10.940 10.546 15.602 762 HG1 THR 118 1HG THR 118 11.027 12.131 13.367 763 HG21 THR 118 3HG2 THR 118 13.199 11.559 13.822 764 HG22 THR 118 1HG2 THR 118 13.403 10.802 15.413 765 HG23 THR 118 2HG2 THR 118 12.564 12.356 15.258 766 H ASN 119 H ASN 119 10.085 8.164 12.220 767 HA ASN 119 HA ASN 119 8.005 7.205 14.129 768 HB3 ASN 119 2HB ASN 119 6.889 8.400 11.717 769 HD21 ASN 119 1HD2 ASN 119 5.342 7.237 13.391 770 HD22 ASN 119 2HD2 ASN 119 4.658 8.337 14.593 771 H HIS 120 H HIS 120 8.931 5.171 13.809 772 HA HIS 120 HA HIS 120 8.696 3.874 11.139 773 HB3 HIS 120 2HB HIS 120 10.110 3.153 13.734 774 HD1 HIS 120 1HD HIS 120 12.404 1.481 12.931 775 HD2 HIS 120 2HD HIS 120 8.562 1.069 11.205 776 HE1 HIS 120 1HE HIS 120 12.188 -0.940 12.199 777 H LYS 121 H LYS 121 8.317 2.799 14.547 778 HA LYS 121 HA LYS 121 6.603 0.704 14.024 779 HB3 LYS 121 2HB LYS 121 6.249 2.102 16.639 780 HG3 LYS 121 2HG LYS 121 6.923 0.028 17.637 781 HD3 LYS 121 2HD LYS 121 5.144 -0.937 15.397 782 HE3 LYS 121 2HE LYS 121 5.973 -2.291 17.513 783 HZ1 LYS 121 3HZ LYS 121 4.346 -2.075 19.311 784 HZ2 LYS 121 1HZ LYS 121 3.652 -0.800 18.574 785 HZ3 LYS 121 2HZ LYS 121 5.196 -0.688 19.192 786 H ALA 122 H ALA 122 5.620 4.085 14.821 787 HA ALA 122 HA ALA 122 2.890 3.651 15.051 788 HB1 ALA 122 1HB ALA 122 3.785 6.131 13.582 789 HB2 ALA 122 2HB ALA 122 2.562 5.931 14.806 790 HB3 ALA 122 3HB ALA 122 4.268 5.888 15.284 791 H TYR 123 H TYR 123 4.747 4.001 11.984 792 HA TYR 123 HA TYR 123 2.644 4.300 10.164 793 HB3 TYR 123 2HB TYR 123 5.215 2.715 9.776 794 HD1 TYR 123 1HD TYR 123 3.658 5.469 7.719 795 HD2 TYR 123 2HD TYR 123 4.570 1.236 7.993 796 HE1 TYR 123 1HE TYR 123 3.086 5.180 5.352 797 HE2 TYR 123 2HE TYR 123 3.949 0.962 5.628 798 HH TYR 123 HH TYR 123 2.524 2.082 3.891 799 H VAL 124 H VAL 124 4.029 1.318 11.525 800 HA VAL 124 HA VAL 124 2.695 -0.591 9.985 801 HB VAL 124 HB VAL 124 3.487 -0.708 12.942 802 HG11 VAL 124 1HG1 VAL 124 2.152 -2.611 12.243 803 HG12 VAL 124 2HG1 VAL 124 3.282 -2.953 10.921 804 HG13 VAL 124 3HG1 VAL 124 3.816 -3.097 12.605 805 HG21 VAL 124 3HG2 VAL 124 5.674 -1.716 12.063 806 HG22 VAL 124 1HG2 VAL 124 5.223 -1.146 10.462 807 HG23 VAL 124 2HG2 VAL 124 5.522 0.020 11.772 808 H SER 125 H SER 125 1.752 0.844 13.123 809 HA SER 125 HA SER 125 -0.743 -0.528 13.391 810 HB3 SER 125 2HB SER 125 -0.919 1.441 15.106 811 HG SER 125 HG SER 125 -0.429 -0.616 15.657 812 H HIS 126 H HIS 126 0.237 2.697 12.191 813 HA HIS 126 HA HIS 126 -2.354 3.791 11.920 814 HB3 HIS 126 2HB HIS 126 -1.168 5.274 10.211 815 HD1 HIS 126 1HD HIS 126 1.391 6.666 11.331 816 HD2 HIS 126 2HD HIS 126 -1.839 5.212 13.619 817 HE1 HIS 126 1HE HIS 126 1.334 8.027 13.516 818 H PHE 127 H PHE 127 -0.265 2.011 9.592 819 HA PHE 127 HA PHE 127 -2.037 2.151 7.392 820 HB3 PHE 127 2HB PHE 127 0.007 0.025 8.122 821 HD1 PHE 127 1HD PHE 127 -1.713 1.714 5.167 822 HD2 PHE 127 2HD PHE 127 0.179 -1.858 6.714 823 HE1 PHE 127 1HE PHE 127 -2.227 0.497 3.078 824 HE2 PHE 127 2HE PHE 127 -0.372 -3.040 4.632 825 HZ PHE 127 HZ PHE 127 -1.545 -1.854 2.785 826 H ASN 128 H ASN 128 -1.840 -0.163 10.126 827 HA ASN 128 HA ASN 128 -3.734 -1.995 9.097 828 HB3 ASN 128 2HB ASN 128 -4.234 -2.195 11.785 829 HD21 ASN 128 1HD2 ASN 128 -1.205 -3.181 12.354 830 HD22 ASN 128 2HD2 ASN 128 -1.247 -4.667 11.452 831 H GLU 129 H GLU 129 -4.325 1.180 10.611 832 HA GLU 129 HA GLU 129 -7.221 0.664 10.704 833 HB3 GLU 129 2HB GLU 129 -7.276 3.091 11.319 834 HG3 GLU 129 2HG GLU 129 -6.252 3.015 13.473 835 H TRP 130 H TRP 130 -4.905 2.023 8.467 836 HA TRP 130 HA TRP 130 -6.992 3.414 6.930 837 HB3 TRP 130 2HB TRP 130 -5.065 3.912 5.375 838 HD1 TRP 130 HD TRP 130 -5.977 4.594 8.981 839 HE1 TRP 130 1HE TRP 130 -5.430 6.939 9.611 840 HE3 TRP 130 3HE TRP 130 -3.344 5.975 4.782 841 HZ2 TRP 130 2HZ TRP 130 -3.802 9.109 8.618 842 HZ3 TRP 130 3HZ TRP 130 -2.427 8.259 4.650 843 HH2 TRP 130 HH TRP 130 -2.698 9.890 6.561 844 H ALA 131 H ALA 131 -5.712 0.246 7.032 845 HA ALA 131 HA ALA 131 -6.660 -0.407 4.270 846 HB1 ALA 131 1HB ALA 131 -4.122 -1.328 5.637 847 HB2 ALA 131 2HB ALA 131 -4.629 -1.604 3.956 848 HB3 ALA 131 3HB ALA 131 -4.224 0.031 4.486 849 H ASP 132 H ASP 132 -7.876 -0.777 7.008 850 HA ASP 132 HA ASP 132 -7.664 -3.485 7.894 851 HB3 ASP 132 2HB ASP 132 -9.872 -1.469 8.282 852 H GLY 133 H GLY 133 -7.937 -4.108 5.512 853 HA2 GLY 133 1HA GLY 133 -10.619 -5.333 5.214 854 HA3 GLY 133 2HA GLY 133 -10.084 -4.232 3.956 855 H LEU 134 H LEU 134 -7.312 -4.878 3.880 856 HA LEU 134 HA LEU 134 -7.553 -7.262 2.258 857 HB3 LEU 134 2HB LEU 134 -5.501 -6.479 1.312 858 HG LEU 134 HG LEU 134 -5.839 -4.270 0.603 859 HD11 LEU 134 1HD1 LEU 134 -8.580 -5.607 0.736 860 HD12 LEU 134 2HD1 LEU 134 -7.289 -6.040 -0.408 861 HD13 LEU 134 3HD1 LEU 134 -8.038 -4.444 -0.476 862 HD21 LEU 134 3HD2 LEU 134 -7.331 -2.653 1.261 863 HD22 LEU 134 1HD2 LEU 134 -6.516 -3.221 2.731 864 HD23 LEU 134 2HD2 LEU 134 -8.193 -3.723 2.357 865 H ASN 135 H ASN 135 -5.743 -8.730 2.172 866 HA ASN 135 HA ASN 135 -5.325 -9.840 4.858 867 HB3 ASN 135 2HB ASN 135 -4.635 -11.097 2.198 868 HD21 ASN 135 1HD2 ASN 135 -2.945 -12.234 3.522 869 HD22 ASN 135 2HD2 ASN 135 -3.383 -13.517 4.626 870 H VAL 136 H VAL 136 -3.790 -8.106 5.318 871 HA VAL 136 HA VAL 136 -1.074 -8.300 4.302 872 HB VAL 136 HB VAL 136 -1.574 -6.182 5.037 873 HG11 VAL 136 1HG1 VAL 136 -3.571 -6.439 6.202 874 HG12 VAL 136 2HG1 VAL 136 -2.829 -7.452 7.485 875 HG13 VAL 136 3HG1 VAL 136 -2.462 -5.725 7.384 876 HG21 VAL 136 3HG2 VAL 136 0.615 -7.043 5.964 877 HG22 VAL 136 1HG2 VAL 136 -0.096 -5.665 6.854 878 HG23 VAL 136 2HG2 VAL 136 -0.208 -7.303 7.510 879 H ILE 137 H ILE 137 0.494 -9.512 4.819 880 HA ILE 137 HA ILE 137 0.355 -11.305 7.184 881 HB ILE 137 HB ILE 137 1.743 -12.851 5.715 882 HG13 ILE 137 2HG1 ILE 137 1.747 -10.715 3.874 883 HG21 ILE 137 1HG2 ILE 137 -0.254 -13.745 4.606 884 HG22 ILE 137 2HG2 ILE 137 -0.650 -13.177 6.242 885 HG23 ILE 137 3HG2 ILE 137 -1.101 -12.205 4.833 886 HD11 ILE 137 3HD1 ILE 137 2.754 -12.209 2.276 887 HD12 ILE 137 1HD1 ILE 137 3.420 -12.523 3.887 888 HD13 ILE 137 2HD1 ILE 137 2.191 -13.623 3.190 889 H GLY 138 H GLY 138 2.026 -8.589 6.076 890 HA2 GLY 138 1HA GLY 138 4.155 -8.835 8.052 891 HA3 GLY 138 2HA GLY 138 4.662 -9.047 6.384 892 H VAL 139 H VAL 139 5.195 -6.797 8.368 893 HA VAL 139 HA VAL 139 4.916 -4.582 6.460 894 HB VAL 139 HB VAL 139 4.113 -4.502 9.432 895 HG11 VAL 139 1HG1 VAL 139 4.382 -2.386 7.272 896 HG12 VAL 139 2HG1 VAL 139 3.571 -2.117 8.819 897 HG13 VAL 139 3HG1 VAL 139 5.293 -2.531 8.790 898 HG21 VAL 139 3HG2 VAL 139 1.891 -3.725 8.730 899 HG22 VAL 139 1HG2 VAL 139 2.303 -4.038 7.048 900 HG23 VAL 139 2HG2 VAL 139 2.185 -5.385 8.202 901 H ALA 140 H ALA 140 7.057 -4.541 6.112 902 HA ALA 140 HA ALA 140 8.780 -3.837 8.347 903 HB1 ALA 140 1HB ALA 140 9.613 -5.909 6.267 904 HB2 ALA 140 2HB ALA 140 10.657 -5.183 7.501 905 HB3 ALA 140 3HB ALA 140 9.321 -6.243 7.992 906 H ARG 141 H ARG 141 10.403 -2.395 7.625 907 HA ARG 141 HA ARG 141 9.805 -0.965 5.144 908 HB3 ARG 141 2HB ARG 141 10.600 0.236 7.145 909 HG3 ARG 141 2HG ARG 141 13.338 -0.920 6.667 910 HD3 ARG 141 2HD ARG 141 12.138 0.919 8.700 911 HE ARG 141 HE ARG 141 13.270 -1.254 9.682 912 HH11 ARG 141 1HH1 ARG 141 15.191 1.637 9.087 913 HH12 ARG 141 2HH1 ARG 141 15.797 1.764 10.707 914 HH21 ARG 141 1HH2 ARG 141 14.471 -1.448 11.533 915 HH22 ARG 141 2HH2 ARG 141 15.614 -0.226 12.036 916 H ASP 142 H ASP 142 11.422 -0.598 3.530 917 HA ASP 142 HA ASP 142 12.714 -1.335 1.824 918 HB3 ASP 142 2HB ASP 142 14.923 -1.838 2.271 919 H ASP 143 H ASP 143 14.309 -3.833 1.847 920 HA ASP 143 HA ASP 143 12.216 -5.724 1.043 921 HB3 ASP 143 2HB ASP 143 13.388 -5.100 -0.840 922 H SER 144 H SER 144 13.055 -5.471 3.812 923 HA SER 144 HA SER 144 15.124 -7.233 4.607 924 HB3 SER 144 2HB SER 144 12.559 -6.547 6.116 925 HG SER 144 HG SER 144 15.169 -6.426 7.171 926 H GLU 145 H GLU 145 11.999 -7.971 3.324 927 HA GLU 145 HA GLU 145 11.987 -10.713 4.490 928 HB3 GLU 145 2HB GLU 145 9.583 -10.311 5.042 929 HG3 GLU 145 2HG GLU 145 10.894 -8.003 6.420 930 H VAL 146 H VAL 146 12.229 -9.318 1.550 931 HA VAL 146 HA VAL 146 9.810 -10.098 0.219 932 HB VAL 146 HB VAL 146 12.619 -9.814 -0.926 933 HG11 VAL 146 1HG1 VAL 146 11.363 -9.354 -3.063 934 HG12 VAL 146 2HG1 VAL 146 11.208 -11.019 -2.502 935 HG13 VAL 146 3HG1 VAL 146 9.874 -9.881 -2.240 936 HG21 VAL 146 3HG2 VAL 146 11.842 -7.744 0.179 937 HG22 VAL 146 1HG2 VAL 146 11.911 -7.562 -1.572 938 HG23 VAL 146 2HG2 VAL 146 10.339 -7.796 -0.766 939 H ASP 147 H ASP 147 12.796 -11.806 0.915 940 HA ASP 147 HA ASP 147 12.570 -14.225 -0.308 941 HB3 ASP 147 2HB ASP 147 13.440 -13.770 2.575 942 H LYS 148 H LYS 148 10.679 -13.144 2.469 943 HA LYS 148 HA LYS 148 9.493 -15.842 2.806 944 HB3 LYS 148 2HB LYS 148 10.202 -15.163 4.937 945 HG3 LYS 148 2HG LYS 148 8.910 -12.458 4.439 946 HD3 LYS 148 2HD LYS 148 10.328 -12.081 6.681 947 HE3 LYS 148 2HE LYS 148 7.485 -13.183 6.615 948 HZ1 LYS 148 3HZ LYS 148 7.213 -11.977 8.613 949 HZ2 LYS 148 1HZ LYS 148 8.707 -11.265 8.491 950 HZ3 LYS 148 2HZ LYS 148 8.572 -12.877 8.807 951 H TRP 149 H TRP 149 8.746 -12.441 1.953 952 HA TRP 149 HA TRP 149 5.889 -12.876 1.910 953 HB3 TRP 149 2HB TRP 149 5.846 -10.786 0.599 954 HD1 TRP 149 HD TRP 149 6.033 -11.652 3.836 955 HE1 TRP 149 1HE TRP 149 6.652 -9.807 5.516 956 HE3 TRP 149 3HE TRP 149 8.345 -8.347 0.692 957 HZ2 TRP 149 2HZ TRP 149 7.517 -7.132 5.454 958 HZ3 TRP 149 3HZ TRP 149 9.225 -6.182 1.585 959 HH2 TRP 149 HH TRP 149 8.826 -5.548 3.937 960 H SER 150 H SER 150 8.337 -14.077 -0.150 961 HA SER 150 HA SER 150 6.356 -14.676 -2.273 962 HB3 SER 150 2HB SER 150 9.386 -14.488 -2.283 963 HG SER 150 HG SER 150 8.953 -15.733 -3.897 964 H LYS 151 H LYS 151 7.330 -16.202 0.512 965 HA LYS 151 HA LYS 151 7.494 -18.844 -0.845 966 HB3 LYS 151 2HB LYS 151 9.527 -18.089 0.444 967 HG3 LYS 151 2HG LYS 151 8.095 -17.477 2.575 968 HD3 LYS 151 2HD LYS 151 8.926 -20.269 3.373 969 HE3 LYS 151 2HE LYS 151 8.335 -18.621 5.167 970 HZ1 LYS 151 3HZ LYS 151 5.706 -18.344 5.181 971 HZ2 LYS 151 1HZ LYS 151 5.922 -18.392 3.539 972 HZ3 LYS 151 2HZ LYS 151 6.634 -17.251 4.395 Start of MODEL 17 1 H1 GLY 1 H GLY 1 -7.582 -23.326 -12.326 2 HA2 GLY 1 1HA GLY 1 -5.579 -22.022 -12.879 3 HA3 GLY 1 2HA GLY 1 -6.549 -21.211 -11.634 4 H MET 2 H MET 2 -3.432 -21.978 -12.402 5 HA MET 2 HA MET 2 -2.545 -21.884 -9.591 6 HB3 MET 2 2HB MET 2 -1.631 -23.997 -11.589 7 HG3 MET 2 2HG MET 2 -0.337 -22.909 -9.234 8 HE1 MET 2 3HE MET 2 -2.205 -24.820 -6.412 9 HE2 MET 2 1HE MET 2 -1.611 -23.254 -7.008 10 HE3 MET 2 2HE MET 2 -2.945 -24.080 -7.846 11 H ALA 3 H ALA 3 -1.811 -19.842 -9.875 12 HA ALA 3 HA ALA 3 0.789 -19.620 -10.720 13 HB1 ALA 3 1HB ALA 3 -1.122 -18.091 -12.538 14 HB2 ALA 3 2HB ALA 3 0.575 -17.610 -12.274 15 HB3 ALA 3 3HB ALA 3 0.214 -19.182 -12.991 16 H LYS 4 H LYS 4 1.355 -18.618 -8.811 17 HA LYS 4 HA LYS 4 -0.253 -16.367 -7.825 18 HB3 LYS 4 2HB LYS 4 1.532 -16.232 -6.102 19 HG3 LYS 4 2HG LYS 4 0.378 -19.045 -6.453 20 HD3 LYS 4 2HD LYS 4 0.038 -18.574 -3.881 21 HE3 LYS 4 2HE LYS 4 2.159 -19.514 -3.235 22 HZ1 LYS 4 3HZ LYS 4 1.730 -20.743 -5.848 23 HZ2 LYS 4 1HZ LYS 4 0.514 -20.816 -4.741 24 HZ3 LYS 4 2HZ LYS 4 1.998 -21.464 -4.403 25 H LYS 5 H LYS 5 0.265 -14.307 -8.317 26 HA LYS 5 HA LYS 5 2.794 -13.705 -9.744 27 HB3 LYS 5 2HB LYS 5 1.717 -11.887 -10.919 28 HG3 LYS 5 2HG LYS 5 1.574 -13.988 -12.174 29 HD3 LYS 5 2HD LYS 5 -0.827 -14.293 -10.519 30 HE3 LYS 5 2HE LYS 5 -1.447 -15.987 -12.622 31 HZ1 LYS 5 3HZ LYS 5 -3.138 -14.270 -13.210 32 HZ2 LYS 5 1HZ LYS 5 -2.406 -13.254 -12.146 33 HZ3 LYS 5 2HZ LYS 5 -3.060 -14.661 -11.607 34 H THR 6 H THR 6 3.098 -11.353 -9.459 35 HA THR 6 HA THR 6 2.268 -10.320 -6.794 36 HB THR 6 HB THR 6 5.176 -10.641 -7.618 37 HG1 THR 6 1HG THR 6 3.551 -11.885 -5.665 38 HG21 THR 6 3HG2 THR 6 4.029 -9.352 -5.109 39 HG22 THR 6 1HG2 THR 6 5.044 -8.588 -6.345 40 HG23 THR 6 2HG2 THR 6 5.720 -9.855 -5.319 41 H LEU 7 H LEU 7 2.102 -8.082 -6.671 42 HA LEU 7 HA LEU 7 2.988 -6.532 -9.051 43 HB3 LEU 7 2HB LEU 7 0.846 -5.336 -7.420 44 HG LEU 7 HG LEU 7 0.514 -6.216 -10.291 45 HD11 LEU 7 1HD1 LEU 7 -0.976 -4.277 -10.373 46 HD12 LEU 7 2HD1 LEU 7 -0.485 -3.789 -8.734 47 HD13 LEU 7 3HD1 LEU 7 -1.408 -5.292 -8.987 48 HD21 LEU 7 3HD2 LEU 7 1.263 -4.013 -11.070 49 HD22 LEU 7 1HD2 LEU 7 2.589 -5.000 -10.482 50 HD23 LEU 7 2HD2 LEU 7 1.956 -3.670 -9.463 51 H ILE 8 H ILE 8 4.029 -4.590 -8.583 52 HA ILE 8 HA ILE 8 4.355 -3.782 -5.734 53 HB ILE 8 HB ILE 8 6.460 -3.637 -7.896 54 HG13 ILE 8 2HG1 ILE 8 5.887 -5.881 -6.163 55 HG21 ILE 8 1HG2 ILE 8 6.612 -2.875 -4.986 56 HG22 ILE 8 2HG2 ILE 8 7.993 -2.919 -6.103 57 HG23 ILE 8 3HG2 ILE 8 6.676 -1.775 -6.381 58 HD11 ILE 8 3HD1 ILE 8 8.496 -5.560 -7.727 59 HD12 ILE 8 1HD1 ILE 8 7.669 -7.034 -7.245 60 HD13 ILE 8 2HD1 ILE 8 6.939 -6.006 -8.488 61 H LEU 9 H LEU 9 3.127 -1.953 -5.607 62 HA LEU 9 HA LEU 9 3.301 0.068 -7.801 63 HB3 LEU 9 2HB LEU 9 1.208 0.987 -6.538 64 HG LEU 9 HG LEU 9 1.077 -1.527 -8.258 65 HD11 LEU 9 1HD1 LEU 9 -1.171 0.357 -7.395 66 HD12 LEU 9 2HD1 LEU 9 -0.979 -1.354 -6.952 67 HD13 LEU 9 3HD1 LEU 9 -1.299 -0.922 -8.627 68 HD21 LEU 9 3HD2 LEU 9 0.318 0.209 -9.958 69 HD22 LEU 9 1HD2 LEU 9 2.004 0.367 -9.457 70 HD23 LEU 9 2HD2 LEU 9 0.776 1.460 -8.794 71 H TYR 10 H TYR 10 4.690 1.700 -7.329 72 HA TYR 10 HA TYR 10 4.907 2.549 -4.484 73 HB3 TYR 10 2HB TYR 10 7.269 3.205 -6.040 74 HD1 TYR 10 1HD TYR 10 6.316 3.777 -3.231 75 HD2 TYR 10 2HD TYR 10 8.718 0.594 -4.901 76 HE1 TYR 10 1HE TYR 10 7.505 3.514 -1.079 77 HE2 TYR 10 2HE TYR 10 9.853 0.343 -2.734 78 HH TYR 10 HH TYR 10 8.742 1.008 -0.014 79 H TYR 11 H TYR 11 3.897 4.434 -4.274 80 HA TYR 11 HA TYR 11 3.595 6.185 -6.568 81 HB3 TYR 11 2HB TYR 11 2.237 5.834 -4.063 82 HD1 TYR 11 1HD TYR 11 1.670 8.356 -6.678 83 HD2 TYR 11 2HD TYR 11 2.750 7.900 -2.533 84 HE1 TYR 11 1HE TYR 11 1.251 10.758 -6.320 85 HE2 TYR 11 2HE TYR 11 2.299 10.343 -2.149 86 HH TYR 11 HH TYR 11 1.701 12.549 -4.847 87 H SER 12 H SER 12 4.464 8.527 -6.406 88 HA SER 12 HA SER 12 6.108 10.002 -6.207 89 HB3 SER 12 2HB SER 12 6.895 10.543 -3.918 90 HG SER 12 HG SER 12 4.173 10.031 -3.693 91 H TRP 13 H TRP 13 7.601 9.259 -7.630 92 HA TRP 13 HA TRP 13 9.867 7.721 -6.486 93 HB3 TRP 13 2HB TRP 13 8.683 6.236 -7.787 94 HD1 TRP 13 HD TRP 13 6.363 6.680 -8.802 95 HE1 TRP 13 1HE TRP 13 5.506 7.339 -11.123 96 HE3 TRP 13 3HE TRP 13 10.801 8.077 -10.931 97 HZ2 TRP 13 2HZ TRP 13 6.623 8.326 -13.606 98 HZ3 TRP 13 3HZ TRP 13 10.875 8.895 -13.273 99 HH2 TRP 13 HH TRP 13 8.785 9.025 -14.617 100 H SER 14 H SER 14 9.824 10.548 -6.370 101 HA SER 14 HA SER 14 11.844 11.549 -8.179 102 HB3 SER 14 2HB SER 14 12.149 13.298 -6.458 103 HG SER 14 HG SER 14 10.300 14.226 -6.835 104 H GLY 15 H GLY 15 12.957 9.303 -7.972 105 HA2 GLY 15 1HA GLY 15 14.961 8.307 -7.696 106 HA3 GLY 15 2HA GLY 15 15.542 9.800 -7.006 107 H GLU 16 H GLU 16 13.034 8.772 -5.042 108 HA GLU 16 HA GLU 16 14.810 7.420 -3.138 109 HB3 GLU 16 2HB GLU 16 13.634 9.107 -2.126 110 HG3 GLU 16 2HG GLU 16 10.925 8.126 -3.080 111 H THR 17 H THR 17 11.347 6.655 -3.970 112 HA THR 17 HA THR 17 11.567 3.967 -3.206 113 HB THR 17 HB THR 17 9.332 3.879 -4.446 114 HG1 THR 17 1HG THR 17 8.754 6.266 -4.896 115 HG21 THR 17 3HG2 THR 17 9.577 6.284 -2.571 116 HG22 THR 17 1HG2 THR 17 9.488 4.609 -2.021 117 HG23 THR 17 2HG2 THR 17 8.115 5.310 -2.882 118 H LYS 18 H LYS 18 11.994 5.482 -6.353 119 HA LYS 18 HA LYS 18 11.520 3.556 -8.144 120 HB3 LYS 18 2HB LYS 18 13.783 5.624 -8.253 121 HG3 LYS 18 2HG LYS 18 12.685 3.685 -10.330 122 HD3 LYS 18 2HD LYS 18 13.874 6.423 -10.941 123 HE3 LYS 18 2HE LYS 18 13.226 3.953 -12.592 124 HZ1 LYS 18 3HZ LYS 18 13.640 5.367 -14.537 125 HZ2 LYS 18 1HZ LYS 18 13.560 6.710 -13.626 126 HZ3 LYS 18 2HZ LYS 18 12.232 5.749 -13.758 127 H LYS 19 H LYS 19 14.864 3.801 -6.779 128 HA LYS 19 HA LYS 19 15.916 1.500 -7.935 129 HB3 LYS 19 2HB LYS 19 17.366 2.905 -6.689 130 HG3 LYS 19 2HG LYS 19 15.387 2.942 -4.569 131 HD3 LYS 19 2HD LYS 19 16.961 1.064 -3.604 132 HE3 LYS 19 2HE LYS 19 18.799 2.385 -2.260 133 HZ1 LYS 19 3HZ LYS 19 20.376 2.366 -4.103 134 HZ2 LYS 19 1HZ LYS 19 19.245 1.807 -5.138 135 HZ3 LYS 19 2HZ LYS 19 19.695 0.915 -3.804 136 H MET 20 H MET 20 13.931 1.700 -4.953 137 HA MET 20 HA MET 20 14.442 -0.943 -4.077 138 HB3 MET 20 2HB MET 20 11.896 0.401 -3.335 139 HG3 MET 20 2HG MET 20 13.388 -1.337 -2.027 140 HE1 MET 20 3HE MET 20 15.597 -1.860 -0.815 141 HE2 MET 20 1HE MET 20 15.858 -1.332 -2.499 142 HE3 MET 20 2HE MET 20 16.953 -0.780 -1.204 143 H ALA 21 H ALA 21 12.125 0.525 -6.291 144 HA ALA 21 HA ALA 21 10.267 -1.738 -6.315 145 HB1 ALA 21 1HB ALA 21 10.668 0.453 -8.420 146 HB2 ALA 21 2HB ALA 21 9.289 -0.653 -8.294 147 HB3 ALA 21 3HB ALA 21 9.572 0.561 -7.032 148 H GLU 22 H GLU 22 12.821 -0.552 -8.494 149 HA GLU 22 HA GLU 22 12.633 -2.665 -10.405 150 HB3 GLU 22 2HB GLU 22 14.856 -1.731 -11.159 151 HG3 GLU 22 2HG GLU 22 14.115 0.633 -11.436 152 H LYS 23 H LYS 23 14.649 -2.236 -7.510 153 HA LYS 23 HA LYS 23 16.284 -4.590 -7.841 154 HB3 LYS 23 2HB LYS 23 15.790 -4.543 -5.189 155 HG3 LYS 23 2HG LYS 23 18.032 -4.243 -6.488 156 HD3 LYS 23 2HD LYS 23 18.937 -2.055 -5.359 157 HE3 LYS 23 2HE LYS 23 18.317 -0.669 -7.435 158 HZ1 LYS 23 3HZ LYS 23 20.282 -2.138 -7.336 159 HZ2 LYS 23 1HZ LYS 23 19.645 -2.026 -8.856 160 HZ3 LYS 23 2HZ LYS 23 19.382 -3.367 -7.977 161 H ILE 24 H ILE 24 13.302 -4.225 -5.812 162 HA ILE 24 HA ILE 24 13.113 -6.920 -5.246 163 HB ILE 24 HB ILE 24 10.985 -4.762 -5.401 164 HG13 ILE 24 2HG1 ILE 24 12.899 -4.392 -3.775 165 HG21 ILE 24 1HG2 ILE 24 10.799 -7.484 -4.042 166 HG22 ILE 24 2HG2 ILE 24 9.620 -6.166 -3.868 167 HG23 ILE 24 3HG2 ILE 24 9.841 -6.930 -5.435 168 HD11 ILE 24 3HD1 ILE 24 10.471 -3.730 -3.243 169 HD12 ILE 24 1HD1 ILE 24 10.466 -5.098 -2.107 170 HD13 ILE 24 2HD1 ILE 24 11.628 -3.791 -1.898 171 H ASN 25 H ASN 25 11.697 -5.212 -8.051 172 HA ASN 25 HA ASN 25 10.085 -7.246 -9.089 173 HB3 ASN 25 2HB ASN 25 11.949 -5.334 -10.483 174 HD21 ASN 25 1HD2 ASN 25 8.937 -7.335 -11.006 175 HD22 ASN 25 2HD2 ASN 25 9.399 -7.817 -12.616 176 H SER 26 H SER 26 13.650 -7.047 -9.137 177 HA SER 26 HA SER 26 14.001 -9.265 -10.975 178 HB3 SER 26 2HB SER 26 15.995 -7.786 -9.198 179 HG SER 26 HG SER 26 16.289 -9.145 -11.684 180 H GLU 27 H GLU 27 13.680 -8.963 -7.460 181 HA GLU 27 HA GLU 27 15.244 -11.419 -7.041 182 HB3 GLU 27 2HB GLU 27 16.045 -10.128 -5.476 183 HG3 GLU 27 2HG GLU 27 13.517 -8.775 -4.915 184 H ILE 28 H ILE 28 12.175 -10.911 -7.921 185 HA ILE 28 HA ILE 28 11.059 -13.217 -6.408 186 HB ILE 28 HB ILE 28 9.683 -10.762 -7.550 187 HG13 ILE 28 2HG1 ILE 28 10.878 -10.298 -5.448 188 HG21 ILE 28 1HG2 ILE 28 8.171 -12.646 -7.828 189 HG22 ILE 28 2HG2 ILE 28 8.471 -13.171 -6.143 190 HG23 ILE 28 3HG2 ILE 28 7.585 -11.679 -6.516 191 HD11 ILE 28 3HD1 ILE 28 8.019 -10.664 -4.564 192 HD12 ILE 28 1HD1 ILE 28 9.184 -9.412 -4.129 193 HD13 ILE 28 2HD1 ILE 28 8.493 -9.418 -5.760 194 H LYS 29 H LYS 29 9.575 -14.560 -7.746 195 HA LYS 29 HA LYS 29 10.275 -14.542 -10.646 196 HB3 LYS 29 2HB LYS 29 8.872 -16.882 -9.438 197 HG3 LYS 29 2HG LYS 29 9.882 -16.650 -11.833 198 HD3 LYS 29 2HD LYS 29 12.361 -17.447 -10.227 199 HE3 LYS 29 2HE LYS 29 13.569 -17.280 -12.338 200 HZ1 LYS 29 3HZ LYS 29 12.530 -19.434 -12.039 201 HZ2 LYS 29 1HZ LYS 29 12.496 -19.026 -13.624 202 HZ3 LYS 29 2HZ LYS 29 11.133 -18.929 -12.747 203 H ASP 30 H ASP 30 8.603 -14.119 -12.024 204 HA ASP 30 HA ASP 30 6.622 -13.485 -12.802 205 HB3 ASP 30 2HB ASP 30 4.964 -14.995 -10.825 206 H SER 31 H SER 31 7.896 -11.672 -11.118 207 HA SER 31 HA SER 31 5.867 -10.215 -9.624 208 HB3 SER 31 2HB SER 31 7.895 -9.969 -8.570 209 HG SER 31 HG SER 31 9.951 -9.898 -10.045 210 H GLU 32 H GLU 32 4.953 -8.227 -10.370 211 HA GLU 32 HA GLU 32 6.004 -7.102 -12.891 212 HB3 GLU 32 2HB GLU 32 3.308 -6.303 -12.635 213 HG3 GLU 32 2HG GLU 32 4.566 -7.106 -14.680 214 H LEU 33 H LEU 33 5.766 -4.983 -13.229 215 HA LEU 33 HA LEU 33 5.711 -3.317 -10.797 216 HB3 LEU 33 2HB LEU 33 7.555 -2.179 -12.700 217 HG LEU 33 HG LEU 33 7.748 -2.072 -10.269 218 HD11 LEU 33 1HD1 LEU 33 8.742 -4.134 -9.225 219 HD12 LEU 33 2HD1 LEU 33 8.216 -5.047 -10.734 220 HD13 LEU 33 3HD1 LEU 33 7.073 -4.281 -9.708 221 HD21 LEU 33 3HD2 LEU 33 10.221 -2.468 -10.219 222 HD22 LEU 33 1HD2 LEU 33 9.705 -1.535 -11.614 223 HD23 LEU 33 2HD2 LEU 33 10.116 -3.243 -11.816 224 H LYS 34 H LYS 34 4.809 -1.278 -11.087 225 HA LYS 34 HA LYS 34 3.599 -0.483 -13.611 226 HB3 LYS 34 2HB LYS 34 1.654 -0.948 -11.384 227 HG3 LYS 34 2HG LYS 34 1.017 -0.336 -13.773 228 HD3 LYS 34 2HD LYS 34 2.397 -2.065 -14.968 229 HE3 LYS 34 2HE LYS 34 0.259 -3.973 -13.890 230 HZ1 LYS 34 3HZ LYS 34 1.467 -5.647 -15.190 231 HZ2 LYS 34 1HZ LYS 34 2.518 -4.529 -15.764 232 HZ3 LYS 34 2HZ LYS 34 0.948 -4.445 -16.184 233 H GLU 35 H GLU 35 2.006 1.567 -12.852 234 HA GLU 35 HA GLU 35 3.452 2.958 -10.639 235 HB3 GLU 35 2HB GLU 35 2.843 5.060 -12.033 236 HG3 GLU 35 2HG GLU 35 5.231 3.885 -11.674 237 H VAL 36 H VAL 36 2.399 4.505 -9.494 238 HA VAL 36 HA VAL 36 -0.501 4.866 -9.671 239 HB VAL 36 HB VAL 36 0.250 3.587 -7.613 240 HG11 VAL 36 1HG1 VAL 36 2.555 5.159 -7.726 241 HG12 VAL 36 2HG1 VAL 36 1.936 4.303 -6.228 242 HG13 VAL 36 3HG1 VAL 36 2.339 3.433 -7.667 243 HG21 VAL 36 3HG2 VAL 36 -1.439 5.357 -7.258 244 HG22 VAL 36 1HG2 VAL 36 -0.343 5.096 -5.876 245 HG23 VAL 36 2HG2 VAL 36 -0.091 6.476 -6.962 246 H LYS 37 H LYS 37 -1.180 7.042 -9.780 247 HA LYS 37 HA LYS 37 0.686 9.049 -8.690 248 HB3 LYS 37 2HB LYS 37 0.994 9.923 -10.702 249 HG3 LYS 37 2HG LYS 37 -1.435 8.456 -11.709 250 HD3 LYS 37 2HD LYS 37 -0.014 10.787 -13.045 251 HE3 LYS 37 2HE LYS 37 -2.055 8.775 -14.085 252 HZ1 LYS 37 3HZ LYS 37 -2.793 10.902 -14.830 253 HZ2 LYS 37 1HZ LYS 37 -2.003 10.207 -16.087 254 HZ3 LYS 37 2HZ LYS 37 -1.277 11.397 -15.191 255 H VAL 38 H VAL 38 -0.816 11.174 -8.284 256 HA VAL 38 HA VAL 38 -3.270 10.272 -6.909 257 HB VAL 38 HB VAL 38 -3.075 12.471 -5.639 258 HG11 VAL 38 1HG1 VAL 38 -1.622 11.568 -3.915 259 HG12 VAL 38 2HG1 VAL 38 -2.731 10.354 -4.560 260 HG13 VAL 38 3HG1 VAL 38 -1.025 10.339 -5.050 261 HG21 VAL 38 3HG2 VAL 38 -0.136 12.354 -6.446 262 HG22 VAL 38 1HG2 VAL 38 -1.294 13.561 -6.987 263 HG23 VAL 38 2HG2 VAL 38 -0.890 13.453 -5.276 264 H SER 39 H SER 39 -4.584 12.806 -6.898 265 HA SER 39 HA SER 39 -4.468 13.815 -9.666 266 HB3 SER 39 2HB SER 39 -6.439 14.338 -7.405 267 HG SER 39 HG SER 39 -6.637 16.126 -8.400 268 H GLU 40 H GLU 40 -4.162 16.123 -9.747 269 HA GLU 40 HA GLU 40 -2.378 17.345 -7.734 270 HB3 GLU 40 2HB GLU 40 -0.890 16.378 -9.318 271 HG3 GLU 40 2HG GLU 40 -2.839 16.558 -11.287 272 H GLY 41 H GLY 41 -2.186 19.878 -8.685 273 HA2 GLY 41 1HA GLY 41 -3.862 21.093 -10.328 274 HA3 GLY 41 2HA GLY 41 -5.029 20.689 -9.080 275 H THR 42 H THR 42 -2.164 22.583 -9.827 276 HA THR 42 HA THR 42 -2.898 24.493 -7.739 277 HB THR 42 HB THR 42 0.026 24.211 -7.825 278 HG1 THR 42 1HG THR 42 -0.095 22.090 -7.996 279 HG21 THR 42 3HG2 THR 42 -2.148 24.032 -5.683 280 HG22 THR 42 1HG2 THR 42 -1.191 25.462 -6.125 281 HG23 THR 42 2HG2 THR 42 -0.420 24.082 -5.337 282 H PHE 43 H PHE 43 -0.562 26.123 -8.173 283 HA PHE 43 HA PHE 43 -0.833 26.995 -10.944 284 HB3 PHE 43 2HB PHE 43 -0.950 28.945 -8.607 285 HD1 PHE 43 2HD PHE 43 -2.445 28.322 -12.032 286 HD2 PHE 43 1HD PHE 43 -0.557 31.168 -9.381 287 HE1 PHE 43 2HE PHE 43 -2.760 30.098 -13.710 288 HE2 PHE 43 1HE PHE 43 -0.897 32.943 -11.073 289 HZ PHE 43 HZ PHE 43 -1.991 32.419 -13.241 290 H ASP 44 H ASP 44 0.921 29.179 -10.609 291 HA ASP 44 HA ASP 44 3.124 29.668 -10.564 292 HB3 ASP 44 2HB ASP 44 3.198 28.167 -7.923 293 H ALA 45 H ALA 45 2.573 27.627 -12.158 294 HA ALA 45 HA ALA 45 3.465 26.184 -13.567 295 HB1 ALA 45 1HB ALA 45 5.917 25.893 -11.811 296 HB2 ALA 45 2HB ALA 45 5.672 25.232 -13.434 297 HB3 ALA 45 3HB ALA 45 5.749 26.989 -13.206 298 H ASP 46 H ASP 46 4.367 24.960 -10.276 299 HA ASP 46 HA ASP 46 1.997 23.782 -9.823 300 HB3 ASP 46 2HB ASP 46 3.701 21.340 -10.151 301 H MET 47 H MET 47 2.364 21.935 -7.948 302 HA MET 47 HA MET 47 4.878 21.913 -6.629 303 HB3 MET 47 2HB MET 47 4.209 24.061 -5.763 304 HG3 MET 47 2HG MET 47 1.785 22.922 -4.397 305 HE1 MET 47 3HE MET 47 2.158 27.312 -5.824 306 HE2 MET 47 1HE MET 47 3.205 26.025 -6.464 307 HE3 MET 47 2HE MET 47 1.454 25.967 -6.744 308 H TYR 48 H TYR 48 4.546 20.574 -4.496 309 HA TYR 48 HA TYR 48 2.872 18.243 -5.025 310 HB3 TYR 48 2HB TYR 48 3.391 17.834 -2.534 311 HD1 TYR 48 2HD TYR 48 6.125 18.980 -4.934 312 HD2 TYR 48 1HD TYR 48 4.405 15.802 -2.578 313 HE1 TYR 48 2HE TYR 48 7.911 17.470 -5.668 314 HE2 TYR 48 1HE TYR 48 6.151 14.267 -3.344 315 HH TYR 48 HH TYR 48 8.079 14.043 -4.522 316 H LYS 49 H LYS 49 0.953 17.613 -3.688 317 HA LYS 49 HA LYS 49 -0.379 19.783 -2.193 318 HB3 LYS 49 2HB LYS 49 -1.944 18.378 -4.355 319 HG3 LYS 49 2HG LYS 49 -2.826 20.134 -2.442 320 HD3 LYS 49 2HD LYS 49 -3.345 22.253 -3.735 321 HE3 LYS 49 2HE LYS 49 -1.128 23.379 -3.501 322 HZ1 LYS 49 3HZ LYS 49 -2.591 23.046 -1.571 323 HZ2 LYS 49 1HZ LYS 49 -1.004 23.184 -1.178 324 HZ3 LYS 49 2HZ LYS 49 -1.758 21.722 -1.141 325 H THR 50 H THR 50 0.820 16.967 -1.876 326 HA THR 50 HA THR 50 -1.378 15.932 -0.182 327 HB THR 50 HB THR 50 0.194 14.399 -2.253 328 HG1 THR 50 1HG THR 50 -1.813 15.099 -2.943 329 HG21 THR 50 3HG2 THR 50 -1.482 13.242 0.041 330 HG22 THR 50 1HG2 THR 50 0.281 13.011 -0.153 331 HG23 THR 50 2HG2 THR 50 -0.849 12.314 -1.331 332 H SER 51 H SER 51 2.137 14.995 -0.831 333 HA SER 51 HA SER 51 2.461 15.117 2.120 334 HB3 SER 51 2HB SER 51 2.567 12.921 1.316 335 HG SER 51 HG SER 51 4.775 13.581 -0.328 336 H ASP 52 H ASP 52 3.274 17.084 2.588 337 HA ASP 52 HA ASP 52 6.102 17.364 2.007 338 HB3 ASP 52 2HB ASP 52 4.299 19.742 1.450 339 H ILE 53 H ILE 53 3.502 19.424 3.422 340 HA ILE 53 HA ILE 53 5.185 20.342 5.421 341 HB ILE 53 HB ILE 53 3.329 21.604 6.220 342 HG13 ILE 53 2HG1 ILE 53 1.594 20.005 6.512 343 HG21 ILE 53 1HG2 ILE 53 2.942 21.381 3.212 344 HG22 ILE 53 2HG2 ILE 53 2.732 22.799 4.254 345 HG23 ILE 53 3HG2 ILE 53 4.342 22.146 3.981 346 HD11 ILE 53 3HD1 ILE 53 0.800 22.325 5.897 347 HD12 ILE 53 1HD1 ILE 53 0.514 21.707 4.253 348 HD13 ILE 53 2HD1 ILE 53 -0.363 21.018 5.628 349 H ALA 54 H ALA 54 3.332 17.468 5.553 350 HA ALA 54 HA ALA 54 3.000 15.853 7.152 351 HB1 ALA 54 1HB ALA 54 5.327 16.498 8.011 352 HB2 ALA 54 2HB ALA 54 4.466 17.386 9.259 353 HB3 ALA 54 3HB ALA 54 4.187 15.661 9.109 354 H LEU 55 H LEU 55 1.208 15.437 8.162 355 HA LEU 55 HA LEU 55 -0.521 15.402 9.351 356 HB3 LEU 55 2HB LEU 55 -0.239 18.081 10.562 357 HG LEU 55 HG LEU 55 -0.799 15.238 11.428 358 HD11 LEU 55 1HD1 LEU 55 0.353 17.299 13.335 359 HD12 LEU 55 2HD1 LEU 55 1.190 15.872 12.711 360 HD13 LEU 55 3HD1 LEU 55 -0.231 15.662 13.757 361 HD21 LEU 55 3HD2 LEU 55 -1.956 17.932 12.287 362 HD22 LEU 55 1HD2 LEU 55 -2.429 16.372 12.990 363 HD23 LEU 55 2HD2 LEU 55 -2.746 16.709 11.276 364 H ASP 56 H ASP 56 -0.226 16.874 6.695 365 HA ASP 56 HA ASP 56 -2.865 18.204 6.521 366 HB3 ASP 56 2HB ASP 56 -0.949 17.243 4.356 367 H GLN 57 H GLN 57 -4.487 17.074 5.216 368 HA GLN 57 HA GLN 57 -5.957 15.403 4.827 369 HB3 GLN 57 2HB GLN 57 -5.193 13.467 3.642 370 HG3 GLN 57 2HG GLN 57 -3.613 14.259 1.972 371 HE21 GLN 57 1HE2 GLN 57 -4.910 17.381 3.278 372 HE22 GLN 57 2HE2 GLN 57 -6.202 17.486 2.143 373 H ILE 58 H ILE 58 -4.164 15.169 7.601 374 HA ILE 58 HA ILE 58 -5.225 12.529 8.427 375 HB ILE 58 HB ILE 58 -3.298 14.456 9.774 376 HG13 ILE 58 2HG1 ILE 58 -1.601 12.485 9.388 377 HG21 ILE 58 1HG2 ILE 58 -4.664 13.122 11.417 378 HG22 ILE 58 2HG2 ILE 58 -3.972 11.647 10.723 379 HG23 ILE 58 3HG2 ILE 58 -2.925 12.851 11.492 380 HD11 ILE 58 3HD1 ILE 58 -3.257 10.746 8.684 381 HD12 ILE 58 1HD1 ILE 58 -3.623 11.734 7.239 382 HD13 ILE 58 2HD1 ILE 58 -2.025 11.080 7.459 383 H GLN 59 H GLN 59 -5.128 15.517 10.477 384 HA GLN 59 HA GLN 59 -7.977 15.042 11.068 385 HB3 GLN 59 2HB GLN 59 -6.787 14.299 12.914 386 HG3 GLN 59 2HG GLN 59 -5.080 16.823 12.816 387 HE21 GLN 59 1HE2 GLN 59 -5.038 13.475 14.266 388 HE22 GLN 59 2HE2 GLN 59 -4.516 14.026 15.847 389 H GLY 60 H GLY 60 -9.263 16.894 11.321 390 HA2 GLY 60 1HA GLY 60 -9.932 19.037 11.070 391 HA3 GLY 60 2HA GLY 60 -8.258 19.574 11.180 392 H ASN 61 H ASN 61 -7.672 17.696 8.734 393 HA ASN 61 HA ASN 61 -9.090 19.260 6.609 394 HB3 ASN 61 2HB ASN 61 -7.762 17.756 5.046 395 HD21 ASN 61 1HD2 ASN 61 -5.180 18.589 7.162 396 HD22 ASN 61 2HD2 ASN 61 -4.889 20.190 6.480 397 H LYS 62 H LYS 62 -10.092 17.761 4.938 398 HA LYS 62 HA LYS 62 -10.841 15.115 5.780 399 HB3 LYS 62 2HB LYS 62 -13.263 16.541 4.866 400 HG3 LYS 62 2HG LYS 62 -12.481 14.677 7.091 401 HD3 LYS 62 2HD LYS 62 -14.714 14.967 8.152 402 HE3 LYS 62 2HE LYS 62 -13.014 17.487 8.356 403 HZ1 LYS 62 3HZ LYS 62 -14.317 15.959 10.507 404 HZ2 LYS 62 1HZ LYS 62 -15.058 17.218 9.729 405 HZ3 LYS 62 2HZ LYS 62 -13.675 17.483 10.569 406 H ASP 63 H ASP 63 -12.035 14.118 3.885 407 HA ASP 63 HA ASP 63 -12.268 13.588 1.765 408 HB3 ASP 63 2HB ASP 63 -11.438 16.123 0.455 409 H PHE 64 H PHE 64 -10.799 12.057 1.433 410 HA PHE 64 HA PHE 64 -7.967 12.498 1.488 411 HB3 PHE 64 2HB PHE 64 -8.007 10.097 0.498 412 HD1 PHE 64 2HD PHE 64 -6.663 10.222 2.663 413 HD2 PHE 64 1HD PHE 64 -10.953 9.850 2.577 414 HE1 PHE 64 2HE PHE 64 -6.645 9.453 5.027 415 HE2 PHE 64 1HE PHE 64 -10.940 9.114 4.929 416 HZ PHE 64 HZ PHE 64 -8.793 8.900 6.170 417 HA PRO 65 HA PRO 65 -7.119 13.473 -2.794 418 HB3 PRO 65 2HB PRO 65 -4.873 13.439 -2.379 419 HG3 PRO 65 2HG PRO 65 -3.924 11.906 -0.832 420 HD3 PRO 65 2HD PRO 65 -5.718 12.990 0.284 421 H GLU 66 H GLU 66 -6.783 12.338 -4.974 422 HA GLU 66 HA GLU 66 -8.403 9.831 -5.316 423 HB3 GLU 66 2HB GLU 66 -8.165 10.611 -7.760 424 HG3 GLU 66 2HG GLU 66 -9.714 12.384 -5.836 425 H ILE 67 H ILE 67 -7.475 8.509 -7.184 426 HA ILE 67 HA ILE 67 -4.515 8.565 -7.314 427 HB ILE 67 HB ILE 67 -4.624 6.149 -7.978 428 HG13 ILE 67 2HG1 ILE 67 -7.156 6.259 -8.475 429 HG21 ILE 67 1HG2 ILE 67 -5.450 6.853 -5.163 430 HG22 ILE 67 2HG2 ILE 67 -4.895 5.244 -5.663 431 HG23 ILE 67 3HG2 ILE 67 -3.819 6.637 -5.853 432 HD11 ILE 67 3HD1 ILE 67 -6.587 3.990 -6.578 433 HD12 ILE 67 1HD1 ILE 67 -7.485 3.989 -8.104 434 HD13 ILE 67 2HD1 ILE 67 -5.721 4.092 -8.148 435 H GLN 68 H GLN 68 -3.823 7.664 -9.459 436 HA GLN 68 HA GLN 68 -5.767 7.557 -11.634 437 HB3 GLN 68 2HB GLN 68 -3.909 8.746 -13.039 438 HG3 GLN 68 2HG GLN 68 -5.544 10.457 -11.121 439 HE21 GLN 68 1HE2 GLN 68 -4.017 12.156 -11.005 440 HE22 GLN 68 2HE2 GLN 68 -3.664 13.161 -12.389 441 H LEU 69 H LEU 69 -5.054 5.868 -13.079 442 HA LEU 69 HA LEU 69 -2.402 4.935 -13.199 443 HB3 LEU 69 2HB LEU 69 -3.127 3.948 -10.945 444 HG LEU 69 HG LEU 69 -4.549 1.936 -12.712 445 HD11 LEU 69 1HD1 LEU 69 -3.222 1.052 -10.771 446 HD12 LEU 69 2HD1 LEU 69 -4.944 0.704 -10.703 447 HD13 LEU 69 3HD1 LEU 69 -4.287 1.995 -9.686 448 HD21 LEU 69 3HD2 LEU 69 -6.144 3.750 -12.387 449 HD22 LEU 69 1HD2 LEU 69 -5.729 3.865 -10.657 450 HD23 LEU 69 2HD2 LEU 69 -6.579 2.440 -11.289 451 H ASP 70 H ASP 70 -2.492 2.651 -14.329 452 HA ASP 70 HA ASP 70 -3.761 2.882 -16.907 453 HB3 ASP 70 2HB ASP 70 -2.350 0.469 -15.905 454 H ASN 71 H ASN 71 -4.478 0.518 -17.811 455 HA ASN 71 HA ASN 71 -6.798 -0.477 -16.331 456 HB3 ASN 71 2HB ASN 71 -6.199 -2.179 -18.474 457 HD21 ASN 71 1HD2 ASN 71 -8.530 -1.903 -17.030 458 HD22 ASN 71 2HD2 ASN 71 -9.707 -1.204 -18.117 459 H ILE 72 H ILE 72 -5.695 -1.095 -14.452 460 HA ILE 72 HA ILE 72 -4.238 -3.698 -14.635 461 HB ILE 72 HB ILE 72 -4.334 -1.575 -12.458 462 HG13 ILE 72 2HG1 ILE 72 -2.879 -1.322 -14.760 463 HG21 ILE 72 1HG2 ILE 72 -2.720 -4.146 -12.525 464 HG22 ILE 72 2HG2 ILE 72 -2.532 -2.830 -11.341 465 HG23 ILE 72 3HG2 ILE 72 -4.040 -3.735 -11.401 466 HD11 ILE 72 3HD1 ILE 72 -2.980 0.347 -13.002 467 HD12 ILE 72 1HD1 ILE 72 -1.842 -0.596 -12.007 468 HD13 ILE 72 2HD1 ILE 72 -1.334 0.103 -13.568 469 H ASP 73 H ASP 73 -5.162 -5.442 -13.349 470 HA ASP 73 HA ASP 73 -7.753 -4.857 -12.022 471 HB3 ASP 73 2HB ASP 73 -7.218 -7.100 -13.998 472 H TYR 74 H TYR 74 -7.235 -5.198 -9.977 473 HA TYR 74 HA TYR 74 -5.014 -6.527 -9.040 474 HB3 TYR 74 2HB TYR 74 -5.971 -6.252 -6.814 475 HD1 TYR 74 1HD TYR 74 -4.162 -4.486 -7.931 476 HD2 TYR 74 2HD TYR 74 -8.442 -3.917 -7.643 477 HE1 TYR 74 1HE TYR 74 -3.873 -2.043 -8.261 478 HE2 TYR 74 2HE TYR 74 -8.135 -1.500 -7.901 479 HH TYR 74 HH TYR 74 -6.482 -0.070 -9.126 480 H ASN 75 H ASN 75 -8.090 -8.057 -9.772 481 HA ASN 75 HA ASN 75 -7.941 -10.432 -8.266 482 HB3 ASN 75 2HB ASN 75 -8.777 -11.333 -10.774 483 HD21 ASN 75 1HD2 ASN 75 -10.417 -8.623 -9.096 484 HD22 ASN 75 2HD2 ASN 75 -11.592 -9.662 -8.296 485 H ASN 76 H ASN 76 -6.023 -9.459 -11.041 486 HA ASN 76 HA ASN 76 -5.109 -12.161 -11.577 487 HB3 ASN 76 2HB ASN 76 -3.786 -11.031 -13.370 488 HD21 ASN 76 1HD2 ASN 76 -5.686 -8.767 -14.424 489 HD22 ASN 76 2HD2 ASN 76 -7.109 -9.698 -14.841 490 H TYR 77 H TYR 77 -4.242 -10.253 -9.012 491 HA TYR 77 HA TYR 77 -1.432 -11.246 -9.144 492 HB3 TYR 77 2HB TYR 77 -0.704 -9.227 -7.949 493 HD1 TYR 77 2HD TYR 77 0.656 -9.948 -10.037 494 HD2 TYR 77 1HD TYR 77 -2.846 -7.427 -10.276 495 HE1 TYR 77 2HE TYR 77 1.333 -9.248 -12.275 496 HE2 TYR 77 1HE TYR 77 -2.138 -6.683 -12.536 497 HH TYR 77 HH TYR 77 0.451 -8.284 -14.264 498 H ASP 78 H ASP 78 -1.168 -12.766 -7.732 499 HA ASP 78 HA ASP 78 -3.044 -13.251 -5.587 500 HB3 ASP 78 2HB ASP 78 -0.383 -14.651 -5.771 501 H LEU 79 H LEU 79 -0.253 -11.297 -5.877 502 HA LEU 79 HA LEU 79 -0.103 -10.887 -2.955 503 HB3 LEU 79 2HB LEU 79 2.420 -10.791 -4.514 504 HG LEU 79 HG LEU 79 3.544 -11.409 -2.764 505 HD11 LEU 79 1HD1 LEU 79 1.076 -10.701 -1.141 506 HD12 LEU 79 2HD1 LEU 79 2.159 -9.525 -1.914 507 HD13 LEU 79 3HD1 LEU 79 2.770 -10.600 -0.651 508 HD21 LEU 79 3HD2 LEU 79 2.602 -13.713 -2.781 509 HD22 LEU 79 1HD2 LEU 79 1.301 -13.174 -1.707 510 HD23 LEU 79 2HD2 LEU 79 3.025 -13.132 -1.187 511 H ILE 80 H ILE 80 -0.238 -8.654 -2.623 512 HA ILE 80 HA ILE 80 0.513 -6.840 -4.901 513 HB ILE 80 HB ILE 80 -2.040 -6.773 -3.243 514 HG13 ILE 80 2HG1 ILE 80 -2.088 -8.480 -5.007 515 HG21 ILE 80 1HG2 ILE 80 -1.120 -4.497 -3.730 516 HG22 ILE 80 2HG2 ILE 80 -1.123 -4.905 -5.467 517 HG23 ILE 80 3HG2 ILE 80 -2.639 -4.795 -4.560 518 HD11 ILE 80 3HD1 ILE 80 -3.847 -7.805 -6.465 519 HD12 ILE 80 1HD1 ILE 80 -4.177 -7.099 -4.878 520 HD13 ILE 80 2HD1 ILE 80 -3.534 -6.092 -6.198 521 H LEU 81 H LEU 81 2.123 -5.629 -4.295 522 HA LEU 81 HA LEU 81 2.441 -4.967 -1.405 523 HB3 LEU 81 2HB LEU 81 4.876 -5.172 -1.824 524 HG LEU 81 HG LEU 81 3.187 -7.614 -2.565 525 HD11 LEU 81 1HD1 LEU 81 5.148 -8.990 -1.900 526 HD12 LEU 81 2HD1 LEU 81 6.142 -7.511 -1.927 527 HD13 LEU 81 3HD1 LEU 81 5.313 -8.101 -3.411 528 HD21 LEU 81 3HD2 LEU 81 4.572 -6.757 -0.007 529 HD22 LEU 81 1HD2 LEU 81 3.690 -8.283 -0.229 530 HD23 LEU 81 2HD2 LEU 81 2.816 -6.756 -0.297 531 H ILE 82 H ILE 82 3.372 -2.998 -0.852 532 HA ILE 82 HA ILE 82 2.963 -0.857 -2.867 533 HB ILE 82 HB ILE 82 1.686 -0.851 -0.102 534 HG13 ILE 82 2HG1 ILE 82 0.770 -2.893 -1.228 535 HG21 ILE 82 1HG2 ILE 82 0.187 0.798 -1.262 536 HG22 ILE 82 2HG2 ILE 82 1.858 1.285 -1.264 537 HG23 ILE 82 3HG2 ILE 82 1.159 0.592 -2.739 538 HD11 ILE 82 3HD1 ILE 82 -1.356 -0.758 -0.984 539 HD12 ILE 82 1HD1 ILE 82 -1.538 -2.511 -0.901 540 HD13 ILE 82 2HD1 ILE 82 -0.636 -1.664 0.368 541 H GLY 83 H GLY 83 4.093 1.212 -2.253 542 HA2 GLY 83 1HA GLY 83 5.186 1.274 0.505 543 HA3 GLY 83 2HA GLY 83 6.267 1.430 -0.819 544 H SER 84 H SER 84 5.920 3.393 1.139 545 HA SER 84 HA SER 84 4.980 5.748 -0.262 546 HB3 SER 84 2HB SER 84 3.670 4.657 2.324 547 HG SER 84 HG SER 84 1.949 6.107 1.826 548 HA PRO 85 HA PRO 85 8.146 7.243 2.613 549 HB3 PRO 85 2HB PRO 85 8.096 9.224 1.361 550 HG3 PRO 85 2HG PRO 85 6.008 10.312 0.842 551 HD3 PRO 85 2HD PRO 85 5.782 8.136 -0.052 552 H VAL 86 H VAL 86 8.521 8.130 4.876 553 HA VAL 86 HA VAL 86 6.156 8.328 6.556 554 HB VAL 86 HB VAL 86 8.262 6.337 7.422 555 HG11 VAL 86 1HG1 VAL 86 5.380 6.685 8.438 556 HG12 VAL 86 2HG1 VAL 86 6.682 5.625 9.044 557 HG13 VAL 86 3HG1 VAL 86 6.805 7.379 9.186 558 HG21 VAL 86 3HG2 VAL 86 6.771 4.498 6.842 559 HG22 VAL 86 1HG2 VAL 86 5.697 5.656 6.001 560 HG23 VAL 86 2HG2 VAL 86 7.354 5.389 5.431 561 H TRP 87 H TRP 87 6.554 10.211 7.573 562 HA TRP 87 HA TRP 87 9.115 10.409 9.051 563 HB3 TRP 87 2HB TRP 87 8.377 12.662 7.190 564 HD1 TRP 87 HD TRP 87 11.821 11.144 7.444 565 HE1 TRP 87 1HE TRP 87 13.475 12.796 8.503 566 HE3 TRP 87 3HE TRP 87 8.532 14.739 9.012 567 HZ2 TRP 87 2HZ TRP 87 13.385 15.402 9.774 568 HZ3 TRP 87 3HZ TRP 87 9.330 16.757 10.178 569 HH2 TRP 87 HH TRP 87 11.778 17.100 10.563 570 H SER 88 H SER 88 5.791 10.851 9.078 571 HA SER 88 HA SER 88 5.998 11.824 11.768 572 HB3 SER 88 2HB SER 88 4.651 13.815 11.607 573 HG SER 88 HG SER 88 7.013 13.779 10.728 574 H GLY 89 H GLY 89 5.243 9.498 11.500 575 HA2 GLY 89 1HA GLY 89 3.789 7.824 11.637 576 HA3 GLY 89 2HA GLY 89 2.522 8.986 11.963 577 H TYR 90 H TYR 90 2.430 10.299 9.544 578 HA TYR 90 HA TYR 90 1.632 8.740 7.270 579 HB3 TYR 90 2HB TYR 90 -0.062 7.867 8.492 580 HD1 TYR 90 2HD TYR 90 0.333 11.331 9.935 581 HD2 TYR 90 1HD TYR 90 -1.716 7.537 10.195 582 HE1 TYR 90 2HE TYR 90 -0.527 11.950 12.140 583 HE2 TYR 90 1HE TYR 90 -2.531 8.145 12.447 584 HH TYR 90 HH TYR 90 -2.605 9.816 14.136 585 HA PRO 91 HA PRO 91 2.025 13.371 6.703 586 HB3 PRO 91 2HB PRO 91 4.284 13.465 6.804 587 HG3 PRO 91 2HG PRO 91 5.642 11.609 6.119 588 HD3 PRO 91 2HD PRO 91 4.132 10.969 7.789 589 H ALA 92 H ALA 92 1.999 10.521 4.640 590 HA ALA 92 HA ALA 92 0.832 12.034 2.366 591 HB1 ALA 92 1HB ALA 92 3.094 10.683 2.086 592 HB2 ALA 92 2HB ALA 92 2.050 9.241 2.191 593 HB3 ALA 92 3HB ALA 92 1.819 10.442 0.902 594 H THR 93 H THR 93 -1.077 10.994 1.453 595 HA THR 93 HA THR 93 -2.071 8.644 2.926 596 HB THR 93 HB THR 93 -4.331 9.520 2.900 597 HG1 THR 93 1HG THR 93 -4.230 11.005 1.274 598 HG21 THR 93 3HG2 THR 93 -2.746 10.021 4.904 599 HG22 THR 93 1HG2 THR 93 -4.146 11.120 4.739 600 HG23 THR 93 2HG2 THR 93 -2.528 11.628 4.233 601 HA PRO 94 HA PRO 94 -2.581 8.412 -1.673 602 HB3 PRO 94 2HB PRO 94 -0.314 8.961 -2.255 603 HG3 PRO 94 2HG PRO 94 1.503 8.190 -0.831 604 HD3 PRO 94 2HD PRO 94 0.068 9.531 0.325 605 H ILE 95 H ILE 95 -1.896 6.167 0.820 606 HA ILE 95 HA ILE 95 -2.820 3.902 -0.891 607 HB ILE 95 HB ILE 95 -1.344 3.592 1.686 608 HG13 ILE 95 2HG1 ILE 95 0.759 3.111 0.472 609 HG21 ILE 95 1HG2 ILE 95 -2.560 1.656 0.799 610 HG22 ILE 95 2HG2 ILE 95 -1.726 1.797 -0.746 611 HG23 ILE 95 3HG2 ILE 95 -0.825 1.355 0.735 612 HD11 ILE 95 3HD1 ILE 95 1.349 4.150 -1.607 613 HD12 ILE 95 1HD1 ILE 95 -0.063 3.128 -1.953 614 HD13 ILE 95 2HD1 ILE 95 -0.211 4.886 -1.815 615 H LYS 96 H LYS 96 -4.632 5.740 -0.035 616 HA LYS 96 HA LYS 96 -6.270 4.031 1.803 617 HB3 LYS 96 2HB LYS 96 -7.550 6.552 1.350 618 HG3 LYS 96 2HG LYS 96 -6.746 7.019 3.734 619 HD3 LYS 96 2HD LYS 96 -8.078 4.292 3.408 620 HE3 LYS 96 2HE LYS 96 -8.067 6.555 5.449 621 HZ1 LYS 96 3HZ LYS 96 -10.376 6.200 4.952 622 HZ2 LYS 96 1HZ LYS 96 -10.027 5.498 6.415 623 HZ3 LYS 96 2HZ LYS 96 -10.224 4.592 5.043 624 H THR 97 H THR 97 -6.547 6.096 -1.198 625 HA THR 97 HA THR 97 -9.116 5.048 -1.799 626 HB THR 97 HB THR 97 -6.969 6.220 -3.624 627 HG1 THR 97 1HG THR 97 -7.503 8.072 -2.816 628 HG21 THR 97 3HG2 THR 97 -9.984 6.002 -3.997 629 HG22 THR 97 1HG2 THR 97 -8.731 5.284 -5.009 630 HG23 THR 97 2HG2 THR 97 -8.929 7.046 -4.974 631 H LEU 98 H LEU 98 -5.894 4.010 -2.981 632 HA LEU 98 HA LEU 98 -6.647 2.174 -4.888 633 HB3 LEU 98 2HB LEU 98 -4.383 1.403 -3.033 634 HG LEU 98 HG LEU 98 -3.008 1.447 -5.050 635 HD11 LEU 98 1HD1 LEU 98 -4.156 -0.631 -4.365 636 HD12 LEU 98 2HD1 LEU 98 -3.808 -0.556 -6.098 637 HD13 LEU 98 3HD1 LEU 98 -5.458 -0.270 -5.528 638 HD21 LEU 98 3HD2 LEU 98 -4.202 3.145 -6.364 639 HD22 LEU 98 1HD2 LEU 98 -5.469 1.928 -6.719 640 HD23 LEU 98 2HD2 LEU 98 -3.814 1.674 -7.264 641 H LEU 99 H LEU 99 -6.347 1.595 -1.393 642 HA LEU 99 HA LEU 99 -6.683 -1.219 -1.361 643 HB3 LEU 99 2HB LEU 99 -7.491 -0.656 1.076 644 HG LEU 99 HG LEU 99 -4.832 0.350 -0.037 645 HD11 LEU 99 1HD1 LEU 99 -5.464 1.631 1.958 646 HD12 LEU 99 2HD1 LEU 99 -4.075 0.583 2.261 647 HD13 LEU 99 3HD1 LEU 99 -5.673 0.122 2.871 648 HD21 LEU 99 3HD2 LEU 99 -3.884 -1.629 1.050 649 HD22 LEU 99 1HD2 LEU 99 -5.173 -2.140 -0.050 650 HD23 LEU 99 2HD2 LEU 99 -5.472 -2.076 1.702 651 H ASP 100 H ASP 100 -9.074 1.426 -1.381 652 HA ASP 100 HA ASP 100 -11.336 -0.338 -0.943 653 HB3 ASP 100 2HB ASP 100 -11.498 2.343 -2.342 654 H GLN 101 H GLN 101 -9.342 0.352 -3.685 655 HA GLN 101 HA GLN 101 -11.462 -0.313 -5.634 656 HB3 GLN 101 2HB GLN 101 -9.919 0.185 -7.355 657 HG3 GLN 101 2HG GLN 101 -9.184 2.356 -5.419 658 HE21 GLN 101 1HE2 GLN 101 -10.977 4.264 -6.441 659 HE22 GLN 101 2HE2 GLN 101 -10.481 4.637 -8.087 660 H MET 102 H MET 102 -8.621 -1.644 -4.025 661 HA MET 102 HA MET 102 -8.575 -4.172 -5.392 662 HB3 MET 102 2HB MET 102 -7.149 -4.911 -3.615 663 HG3 MET 102 2HG MET 102 -6.573 -2.043 -4.392 664 HE1 MET 102 3HE MET 102 -5.453 -4.996 -1.898 665 HE2 MET 102 1HE MET 102 -4.656 -5.398 -3.431 666 HE3 MET 102 2HE MET 102 -3.690 -4.868 -2.042 667 H LYS 103 H LYS 103 -11.261 -3.107 -3.914 668 HA LYS 103 HA LYS 103 -11.742 -4.956 -1.856 669 HB3 LYS 103 2HB LYS 103 -14.303 -4.328 -2.819 670 HG3 LYS 103 2HG LYS 103 -14.117 -2.174 -1.508 671 HD3 LYS 103 2HD LYS 103 -13.244 -4.851 -0.350 672 HE3 LYS 103 2HE LYS 103 -14.421 -2.815 1.476 673 HZ1 LYS 103 3HZ LYS 103 -13.638 -4.994 2.224 674 HZ2 LYS 103 1HZ LYS 103 -12.744 -3.802 2.918 675 HZ3 LYS 103 2HZ LYS 103 -12.113 -4.633 1.658 676 H ASN 104 H ASN 104 -11.108 -6.055 -4.848 677 HA ASN 104 HA ASN 104 -12.964 -8.384 -4.656 678 HB3 ASN 104 2HB ASN 104 -12.732 -8.541 -7.123 679 HD21 ASN 104 1HD2 ASN 104 -14.467 -7.066 -4.838 680 HD22 ASN 104 2HD2 ASN 104 -15.517 -6.063 -5.766 681 H TYR 105 H TYR 105 -10.012 -7.550 -3.786 682 HA TYR 105 HA TYR 105 -8.137 -8.891 -5.305 683 HB3 TYR 105 2HB TYR 105 -7.765 -7.227 -3.414 684 HD1 TYR 105 1HD TYR 105 -9.800 -7.423 -1.672 685 HD2 TYR 105 2HD TYR 105 -6.345 -10.013 -1.666 686 HE1 TYR 105 1HE TYR 105 -10.322 -8.094 0.624 687 HE2 TYR 105 2HE TYR 105 -6.913 -10.752 0.614 688 HH TYR 105 HH TYR 105 -8.729 -10.775 2.197 689 H ARG 106 H ARG 106 -7.029 -10.819 -5.032 690 HA ARG 106 HA ARG 106 -8.339 -13.098 -3.653 691 HB3 ARG 106 2HB ARG 106 -8.032 -14.402 -5.827 692 HG3 ARG 106 2HG ARG 106 -9.926 -12.665 -7.009 693 HD3 ARG 106 2HD ARG 106 -11.595 -14.181 -5.665 694 HE ARG 106 HE ARG 106 -10.460 -14.620 -8.022 695 HH11 ARG 106 1HH1 ARG 106 -10.825 -16.944 -5.334 696 HH12 ARG 106 2HH1 ARG 106 -10.987 -18.319 -6.353 697 HH21 ARG 106 1HH2 ARG 106 -10.768 -16.269 -9.338 698 HH22 ARG 106 2HH2 ARG 106 -11.032 -17.907 -8.828 699 H GLY 107 H GLY 107 -6.361 -12.336 -2.316 700 HA2 GLY 107 1HA GLY 107 -3.968 -13.743 -2.742 701 HA3 GLY 107 2HA GLY 107 -3.831 -12.165 -3.551 702 H GLU 108 H GLU 108 -2.074 -11.856 -1.916 703 HA GLU 108 HA GLU 108 -3.125 -10.981 0.743 704 HB3 GLU 108 2HB GLU 108 -0.869 -11.522 1.596 705 HG3 GLU 108 2HG GLU 108 -2.887 -13.189 1.501 706 H VAL 109 H VAL 109 -1.778 -9.372 1.867 707 HA VAL 109 HA VAL 109 -0.594 -7.368 -0.008 708 HB VAL 109 HB VAL 109 -2.601 -6.854 2.213 709 HG11 VAL 109 1HG1 VAL 109 -1.305 -4.904 0.252 710 HG12 VAL 109 2HG1 VAL 109 -2.677 -4.507 1.314 711 HG13 VAL 109 3HG1 VAL 109 -1.115 -4.914 2.020 712 HG21 VAL 109 3HG2 VAL 109 -4.087 -6.048 0.317 713 HG22 VAL 109 1HG2 VAL 109 -2.910 -6.741 -0.814 714 HG23 VAL 109 2HG2 VAL 109 -3.795 -7.788 0.312 715 H ALA 110 H ALA 110 1.097 -6.062 0.804 716 HA ALA 110 HA ALA 110 1.512 -5.794 3.632 717 HB1 ALA 110 1HB ALA 110 2.789 -7.849 3.363 718 HB2 ALA 110 2HB ALA 110 3.663 -7.198 1.992 719 HB3 ALA 110 3HB ALA 110 3.923 -6.498 3.577 720 H SER 111 H SER 111 3.355 -4.097 3.985 721 HA SER 111 HA SER 111 3.323 -2.161 1.720 722 HB3 SER 111 2HB SER 111 2.376 -1.449 4.508 723 HG SER 111 HG SER 111 2.796 0.403 3.517 724 H PHE 112 H PHE 112 5.395 -1.756 1.349 725 HA PHE 112 HA PHE 112 7.360 -1.910 3.538 726 HB3 PHE 112 2HB PHE 112 7.331 -3.690 1.770 727 HD1 PHE 112 2HD PHE 112 5.928 -3.102 -0.327 728 HD2 PHE 112 1HD PHE 112 10.044 -1.922 0.289 729 HE1 PHE 112 2HE PHE 112 6.183 -2.751 -2.745 730 HE2 PHE 112 1HE PHE 112 10.313 -1.661 -2.141 731 HZ PHE 112 HZ PHE 112 8.390 -2.025 -3.676 732 H PHE 113 H PHE 113 8.197 -0.070 4.147 733 HA PHE 113 HA PHE 113 8.249 2.336 2.389 734 HB3 PHE 113 2HB PHE 113 6.726 2.605 4.251 735 HD1 PHE 113 2HD PHE 113 6.311 0.402 5.416 736 HD2 PHE 113 1HD PHE 113 9.645 2.917 6.469 737 HE1 PHE 113 2HE PHE 113 6.737 -0.992 7.391 738 HE2 PHE 113 1HE PHE 113 10.023 1.572 8.505 739 HZ PHE 113 HZ PHE 113 8.580 -0.435 8.956 740 H THR 114 H THR 114 10.127 3.707 2.622 741 HA THR 114 HA THR 114 12.585 2.247 3.498 742 HB THR 114 HB THR 114 13.684 3.552 1.687 743 HG1 THR 114 1HG THR 114 11.025 4.248 0.993 744 HG21 THR 114 3HG2 THR 114 12.759 2.280 -0.220 745 HG22 THR 114 1HG2 THR 114 11.405 1.753 0.801 746 HG23 THR 114 2HG2 THR 114 13.054 1.270 1.209 747 H SER 115 H SER 115 10.674 4.666 4.684 748 HA SER 115 HA SER 115 12.967 6.319 5.627 749 HB3 SER 115 2HB SER 115 11.377 8.132 5.899 750 HG SER 115 HG SER 115 10.883 8.570 3.836 751 H ALA 116 H ALA 116 13.281 6.241 7.873 752 HA ALA 116 HA ALA 116 11.045 5.640 9.636 753 HB1 ALA 116 1HB ALA 116 11.695 3.336 8.773 754 HB2 ALA 116 2HB ALA 116 13.264 3.546 9.599 755 HB3 ALA 116 3HB ALA 116 11.757 3.530 10.520 756 H GLY 117 H GLY 117 13.674 7.509 9.259 757 HA2 GLY 117 1HA GLY 117 15.443 6.876 11.358 758 HA3 GLY 117 2HA GLY 117 15.321 8.411 10.505 759 H THR 118 H THR 118 12.313 8.399 11.598 760 HA THR 118 HA THR 118 12.834 8.684 14.500 761 HB THR 118 HB THR 118 11.037 10.794 13.786 762 HG1 THR 118 1HG THR 118 12.082 11.999 12.366 763 HG21 THR 118 3HG2 THR 118 12.492 10.789 15.742 764 HG22 THR 118 1HG2 THR 118 12.843 12.208 14.752 765 HG23 THR 118 2HG2 THR 118 13.941 10.818 14.716 766 H ASN 119 H ASN 119 10.927 7.324 12.086 767 HA ASN 119 HA ASN 119 8.534 7.038 13.845 768 HB3 ASN 119 2HB ASN 119 7.714 7.733 11.161 769 HD21 ASN 119 1HD2 ASN 119 5.953 7.261 12.739 770 HD22 ASN 119 2HD2 ASN 119 5.325 8.597 13.689 771 H HIS 120 H HIS 120 9.119 4.826 14.060 772 HA HIS 120 HA HIS 120 8.721 3.205 11.591 773 HB3 HIS 120 2HB HIS 120 10.227 2.450 14.122 774 HD1 HIS 120 1HD HIS 120 10.995 -0.122 14.144 775 HD2 HIS 120 2HD HIS 120 9.296 1.252 10.539 776 HE1 HIS 120 1HE HIS 120 10.759 -2.146 12.640 777 H LYS 121 H LYS 121 8.283 2.720 15.162 778 HA LYS 121 HA LYS 121 6.347 0.688 14.857 779 HB3 LYS 121 2HB LYS 121 5.574 1.510 17.218 780 HG3 LYS 121 2HG LYS 121 8.433 0.569 16.812 781 HD3 LYS 121 2HD LYS 121 6.607 0.697 19.266 782 HE3 LYS 121 2HE LYS 121 9.104 -0.222 20.090 783 HZ1 LYS 121 3HZ LYS 121 7.971 -2.260 20.610 784 HZ2 LYS 121 1HZ LYS 121 6.758 -1.957 19.578 785 HZ3 LYS 121 2HZ LYS 121 6.946 -1.008 20.906 786 H ALA 122 H ALA 122 5.833 4.215 14.828 787 HA ALA 122 HA ALA 122 3.018 4.196 15.218 788 HB1 ALA 122 1HB ALA 122 4.244 6.239 15.448 789 HB2 ALA 122 2HB ALA 122 4.967 6.071 13.845 790 HB3 ALA 122 3HB ALA 122 3.240 6.445 14.003 791 H TYR 123 H TYR 123 4.972 3.876 12.230 792 HA TYR 123 HA TYR 123 2.893 4.142 10.346 793 HB3 TYR 123 2HB TYR 123 5.389 2.414 10.141 794 HD1 TYR 123 2HD TYR 123 4.052 4.981 7.788 795 HD2 TYR 123 1HD TYR 123 4.553 0.758 8.574 796 HE1 TYR 123 2HE TYR 123 3.439 4.474 5.451 797 HE2 TYR 123 1HE TYR 123 3.930 0.250 6.232 798 HH TYR 123 HH TYR 123 2.736 2.682 3.987 799 H VAL 124 H VAL 124 3.919 1.345 12.267 800 HA VAL 124 HA VAL 124 2.493 -0.641 10.802 801 HB VAL 124 HB VAL 124 3.395 -0.554 13.708 802 HG11 VAL 124 1HG1 VAL 124 1.746 -2.307 13.382 803 HG12 VAL 124 2HG1 VAL 124 2.631 -2.925 11.969 804 HG13 VAL 124 3HG1 VAL 124 3.348 -3.013 13.596 805 HG21 VAL 124 3HG2 VAL 124 5.328 -0.246 12.175 806 HG22 VAL 124 1HG2 VAL 124 5.368 -1.846 12.910 807 HG23 VAL 124 2HG2 VAL 124 4.812 -1.671 11.240 808 H SER 125 H SER 125 1.509 1.558 13.503 809 HA SER 125 HA SER 125 -1.040 0.202 13.820 810 HB3 SER 125 2HB SER 125 -0.357 3.005 14.710 811 HG SER 125 HG SER 125 -2.521 2.453 15.098 812 H HIS 126 H HIS 126 0.029 3.341 12.237 813 HA HIS 126 HA HIS 126 -2.176 4.222 11.082 814 HB3 HIS 126 2HB HIS 126 0.783 4.063 10.531 815 HD1 HIS 126 1HD HIS 126 1.684 4.229 8.099 816 HD2 HIS 126 2HD HIS 126 -2.257 5.344 8.784 817 HE1 HIS 126 1HE HIS 126 0.757 4.754 5.792 818 H PHE 127 H PHE 127 0.038 1.770 9.478 819 HA PHE 127 HA PHE 127 -1.892 1.647 7.374 820 HB3 PHE 127 2HB PHE 127 0.434 -0.238 7.849 821 HD1 PHE 127 1HD PHE 127 -1.329 1.723 5.172 822 HD2 PHE 127 2HD PHE 127 0.066 -2.143 6.447 823 HE1 PHE 127 1HE PHE 127 -2.030 0.756 2.997 824 HE2 PHE 127 2HE PHE 127 -0.755 -3.134 4.318 825 HZ PHE 127 HZ PHE 127 -1.783 -1.690 2.585 826 H ASN 128 H ASN 128 -1.607 -0.247 10.308 827 HA ASN 128 HA ASN 128 -3.391 -2.417 9.554 828 HB3 ASN 128 2HB ASN 128 -3.974 -2.354 12.075 829 HD21 ASN 128 1HD2 ASN 128 -0.609 -2.204 12.530 830 HD22 ASN 128 2HD2 ASN 128 -0.287 -3.913 12.289 831 H GLU 129 H GLU 129 -3.899 0.728 11.144 832 HA GLU 129 HA GLU 129 -6.742 0.528 11.317 833 HB3 GLU 129 2HB GLU 129 -6.430 3.073 11.601 834 HG3 GLU 129 2HG GLU 129 -4.673 1.275 13.340 835 H TRP 130 H TRP 130 -4.701 1.309 8.620 836 HA TRP 130 HA TRP 130 -6.958 2.641 7.211 837 HB3 TRP 130 2HB TRP 130 -5.153 3.448 5.709 838 HD1 TRP 130 HD TRP 130 -5.651 3.878 9.496 839 HE1 TRP 130 1HE TRP 130 -5.481 6.274 10.142 840 HE3 TRP 130 3HE TRP 130 -4.193 5.664 4.996 841 HZ2 TRP 130 2HZ TRP 130 -4.729 8.798 8.823 842 HZ3 TRP 130 3HZ TRP 130 -3.930 8.100 4.652 843 HH2 TRP 130 HH TRP 130 -4.235 9.671 6.571 844 H ALA 131 H ALA 131 -5.824 -0.423 7.547 845 HA ALA 131 HA ALA 131 -6.614 -1.214 4.797 846 HB1 ALA 131 1HB ALA 131 -4.090 -0.906 4.891 847 HB2 ALA 131 2HB ALA 131 -4.052 -2.210 6.095 848 HB3 ALA 131 3HB ALA 131 -4.634 -2.540 4.451 849 H ASP 132 H ASP 132 -7.807 -1.401 7.535 850 HA ASP 132 HA ASP 132 -7.574 -4.095 8.539 851 HB3 ASP 132 2HB ASP 132 -9.627 -1.977 8.985 852 H GLY 133 H GLY 133 -8.046 -4.733 6.105 853 HA2 GLY 133 1HA GLY 133 -10.293 -6.429 6.460 854 HA3 GLY 133 2HA GLY 133 -10.776 -5.169 5.317 855 H LEU 134 H LEU 134 -7.755 -5.246 4.281 856 HA LEU 134 HA LEU 134 -8.115 -7.401 2.383 857 HB3 LEU 134 2HB LEU 134 -5.890 -6.656 1.642 858 HG LEU 134 HG LEU 134 -6.178 -4.358 1.117 859 HD11 LEU 134 1HD1 LEU 134 -7.356 -6.070 -0.305 860 HD12 LEU 134 2HD1 LEU 134 -8.156 -4.493 -0.361 861 HD13 LEU 134 3HD1 LEU 134 -8.844 -5.771 0.619 862 HD21 LEU 134 3HD2 LEU 134 -7.228 -3.521 3.163 863 HD22 LEU 134 1HD2 LEU 134 -8.790 -4.130 2.537 864 HD23 LEU 134 2HD2 LEU 134 -7.897 -2.906 1.641 865 H ASN 135 H ASN 135 -6.222 -8.992 2.220 866 HA ASN 135 HA ASN 135 -5.698 -10.207 4.844 867 HB3 ASN 135 2HB ASN 135 -4.639 -11.166 2.162 868 HD21 ASN 135 1HD2 ASN 135 -2.830 -11.976 3.622 869 HD22 ASN 135 2HD2 ASN 135 -3.145 -13.434 4.556 870 H VAL 136 H VAL 136 -4.491 -8.168 5.548 871 HA VAL 136 HA VAL 136 -1.862 -7.825 4.336 872 HB VAL 136 HB VAL 136 -2.824 -6.418 6.838 873 HG11 VAL 136 1HG1 VAL 136 -1.131 -4.727 6.012 874 HG12 VAL 136 2HG1 VAL 136 -0.407 -6.273 6.425 875 HG13 VAL 136 3HG1 VAL 136 -0.686 -5.842 4.720 876 HG21 VAL 136 3HG2 VAL 136 -3.160 -5.512 3.947 877 HG22 VAL 136 1HG2 VAL 136 -4.471 -5.918 5.083 878 HG23 VAL 136 2HG2 VAL 136 -3.442 -4.522 5.391 879 H ILE 137 H ILE 137 -0.050 -8.857 5.007 880 HA ILE 137 HA ILE 137 0.075 -9.923 7.794 881 HB ILE 137 HB ILE 137 0.937 -11.992 7.065 882 HG13 ILE 137 2HG1 ILE 137 1.060 -12.700 4.684 883 HG21 ILE 137 1HG2 ILE 137 -1.527 -11.420 5.395 884 HG22 ILE 137 2HG2 ILE 137 -0.953 -13.002 5.939 885 HG23 ILE 137 3HG2 ILE 137 -1.502 -11.814 7.129 886 HD11 ILE 137 3HD1 ILE 137 -0.147 -10.694 3.647 887 HD12 ILE 137 1HD1 ILE 137 1.369 -9.796 3.975 888 HD13 ILE 137 2HD1 ILE 137 1.383 -11.184 2.910 889 H GLY 138 H GLY 138 1.528 -7.648 5.920 890 HA2 GLY 138 1HA GLY 138 4.250 -8.207 7.003 891 HA3 GLY 138 2HA GLY 138 3.978 -7.964 5.293 892 H VAL 139 H VAL 139 5.023 -6.430 7.989 893 HA VAL 139 HA VAL 139 4.929 -3.886 6.566 894 HB VAL 139 HB VAL 139 4.299 -3.957 9.554 895 HG11 VAL 139 1HG1 VAL 139 4.066 -1.831 7.386 896 HG12 VAL 139 2HG1 VAL 139 3.478 -1.629 9.043 897 HG13 VAL 139 3HG1 VAL 139 5.206 -1.865 8.754 898 HG21 VAL 139 3HG2 VAL 139 2.020 -3.508 9.196 899 HG22 VAL 139 1HG2 VAL 139 2.160 -3.595 7.419 900 HG23 VAL 139 2HG2 VAL 139 2.346 -5.034 8.456 901 H ALA 140 H ALA 140 7.163 -3.846 6.220 902 HA ALA 140 HA ALA 140 8.871 -3.629 8.602 903 HB1 ALA 140 1HB ALA 140 10.424 -5.362 7.937 904 HB2 ALA 140 2HB ALA 140 8.822 -6.104 8.017 905 HB3 ALA 140 3HB ALA 140 9.531 -5.684 6.444 906 H ARG 141 H ARG 141 11.039 -2.623 8.082 907 HA ARG 141 HA ARG 141 10.932 -0.984 5.695 908 HB3 ARG 141 2HB ARG 141 12.933 -1.238 7.967 909 HG3 ARG 141 2HG ARG 141 12.818 0.576 5.515 910 HD3 ARG 141 2HD ARG 141 14.313 0.909 8.108 911 HE ARG 141 HE ARG 141 15.425 1.363 5.668 912 HH11 ARG 141 1HH1 ARG 141 14.282 3.650 8.085 913 HH12 ARG 141 2HH1 ARG 141 15.262 4.970 7.465 914 HH21 ARG 141 1HH2 ARG 141 16.809 2.954 5.039 915 HH22 ARG 141 2HH2 ARG 141 16.744 4.590 5.649 916 H ASP 142 H ASP 142 12.153 -1.248 3.963 917 HA ASP 142 HA ASP 142 13.247 -2.063 2.301 918 HB3 ASP 142 2HB ASP 142 15.446 -3.214 2.616 919 H ASP 143 H ASP 143 14.180 -4.275 1.477 920 HA ASP 143 HA ASP 143 11.949 -6.057 1.308 921 HB3 ASP 143 2HB ASP 143 13.105 -5.619 -0.687 922 H SER 144 H SER 144 13.820 -5.907 3.828 923 HA SER 144 HA SER 144 15.271 -8.265 4.158 924 HB3 SER 144 2HB SER 144 13.923 -7.013 6.533 925 HG SER 144 HG SER 144 16.144 -6.783 7.133 926 H GLU 145 H GLU 145 11.914 -8.092 3.838 927 HA GLU 145 HA GLU 145 11.598 -10.757 5.025 928 HB3 GLU 145 2HB GLU 145 9.672 -10.310 6.252 929 HG3 GLU 145 2HG GLU 145 11.181 -7.796 6.872 930 H VAL 146 H VAL 146 11.654 -9.350 2.132 931 HA VAL 146 HA VAL 146 8.995 -9.842 1.123 932 HB VAL 146 HB VAL 146 11.713 -9.593 -0.187 933 HG11 VAL 146 1HG1 VAL 146 9.007 -9.997 -1.554 934 HG12 VAL 146 2HG1 VAL 146 10.493 -9.424 -2.358 935 HG13 VAL 146 3HG1 VAL 146 10.440 -11.045 -1.685 936 HG21 VAL 146 3HG2 VAL 146 9.233 -7.829 -0.350 937 HG22 VAL 146 1HG2 VAL 146 10.533 -7.574 0.828 938 HG23 VAL 146 2HG2 VAL 146 10.869 -7.439 -0.904 939 H ASP 147 H ASP 147 11.715 -11.955 1.771 940 HA ASP 147 HA ASP 147 10.898 -14.257 0.432 941 HB3 ASP 147 2HB ASP 147 12.122 -14.574 3.145 942 H LYS 148 H LYS 148 9.180 -12.725 3.018 943 HA LYS 148 HA LYS 148 7.577 -15.198 3.505 944 HB3 LYS 148 2HB LYS 148 8.543 -14.457 5.617 945 HG3 LYS 148 2HG LYS 148 7.431 -11.814 4.765 946 HD3 LYS 148 2HD LYS 148 6.227 -12.135 6.854 947 HE3 LYS 148 2HE LYS 148 7.579 -13.458 8.326 948 HZ1 LYS 148 3HZ LYS 148 9.791 -13.088 7.592 949 HZ2 LYS 148 1HZ LYS 148 9.669 -12.583 9.134 950 HZ3 LYS 148 2HZ LYS 148 9.681 -11.426 7.992 951 H TRP 149 H TRP 149 7.532 -12.338 1.801 952 HA TRP 149 HA TRP 149 4.563 -12.491 1.611 953 HB3 TRP 149 2HB TRP 149 4.539 -10.284 0.827 954 HD1 TRP 149 HD TRP 149 4.609 -11.252 3.835 955 HE1 TRP 149 1HE TRP 149 5.556 -9.771 5.701 956 HE3 TRP 149 3HE TRP 149 7.423 -8.154 0.979 957 HZ2 TRP 149 2HZ TRP 149 7.253 -7.383 5.888 958 HZ3 TRP 149 3HZ TRP 149 8.790 -6.341 2.000 959 HH2 TRP 149 HH TRP 149 8.683 -5.938 4.447 960 H SER 150 H SER 150 6.228 -14.472 0.523 961 HA SER 150 HA SER 150 5.601 -14.276 -2.338 962 HB3 SER 150 2HB SER 150 8.485 -14.677 -1.411 963 HG SER 150 HG SER 150 7.304 -14.247 -3.975 964 H LYS 151 H LYS 151 6.887 -16.228 0.399 965 HA LYS 151 HA LYS 151 6.910 -18.725 -0.997 966 HB3 LYS 151 2HB LYS 151 6.788 -19.637 1.409 967 HG3 LYS 151 2HG LYS 151 8.942 -18.591 2.172 968 HD3 LYS 151 2HD LYS 151 8.998 -19.769 -0.631 969 HE3 LYS 151 2HE LYS 151 11.112 -18.764 0.272 970 HZ1 LYS 151 3HZ LYS 151 12.229 -19.881 1.997 971 HZ2 LYS 151 1HZ LYS 151 10.968 -20.920 2.287 972 HZ3 LYS 151 2HZ LYS 151 10.840 -19.287 2.599 Start of MODEL 18 1 H1 GLY 1 H GLY 1 -0.308 -26.858 -10.384 2 HA2 GLY 1 1HA GLY 1 -2.272 -25.467 -12.110 3 HA3 GLY 1 2HA GLY 1 -2.691 -26.561 -10.788 4 H MET 2 H MET 2 -0.044 -24.072 -10.424 5 HA MET 2 HA MET 2 -1.842 -22.320 -8.887 6 HB3 MET 2 2HB MET 2 0.703 -23.578 -7.785 7 HG3 MET 2 2HG MET 2 -0.434 -22.804 -5.608 8 HE1 MET 2 3HE MET 2 0.693 -21.391 -4.035 9 HE2 MET 2 1HE MET 2 1.529 -19.872 -4.385 10 HE3 MET 2 2HE MET 2 -0.230 -19.981 -4.600 11 H ALA 3 H ALA 3 -1.045 -20.114 -8.980 12 HA ALA 3 HA ALA 3 1.505 -19.636 -10.335 13 HB1 ALA 3 1HB ALA 3 -1.131 -18.665 -11.491 14 HB2 ALA 3 2HB ALA 3 0.487 -18.069 -11.928 15 HB3 ALA 3 3HB ALA 3 0.042 -19.762 -12.265 16 H LYS 4 H LYS 4 2.314 -18.590 -8.695 17 HA LYS 4 HA LYS 4 0.683 -16.539 -7.295 18 HB3 LYS 4 2HB LYS 4 1.342 -18.029 -5.747 19 HG3 LYS 4 2HG LYS 4 4.052 -17.959 -7.050 20 HD3 LYS 4 2HD LYS 4 4.800 -18.742 -4.614 21 HE3 LYS 4 2HE LYS 4 5.751 -16.812 -6.019 22 HZ1 LYS 4 3HZ LYS 4 4.182 -15.123 -5.938 23 HZ2 LYS 4 1HZ LYS 4 5.276 -14.668 -4.783 24 HZ3 LYS 4 2HZ LYS 4 3.836 -15.331 -4.333 25 H LYS 5 H LYS 5 0.872 -15.089 -9.090 26 HA LYS 5 HA LYS 5 3.405 -13.805 -9.773 27 HB3 LYS 5 2HB LYS 5 2.133 -12.123 -10.832 28 HG3 LYS 5 2HG LYS 5 -0.037 -12.975 -11.657 29 HD3 LYS 5 2HD LYS 5 2.251 -14.931 -12.045 30 HE3 LYS 5 2HE LYS 5 0.054 -15.697 -12.964 31 HZ1 LYS 5 3HZ LYS 5 -0.854 -14.369 -14.803 32 HZ2 LYS 5 1HZ LYS 5 0.194 -13.169 -14.470 33 HZ3 LYS 5 2HZ LYS 5 -0.991 -13.553 -13.364 34 H THR 6 H THR 6 3.574 -11.548 -9.368 35 HA THR 6 HA THR 6 2.606 -10.563 -6.773 36 HB THR 6 HB THR 6 5.559 -10.552 -7.473 37 HG1 THR 6 1HG THR 6 5.379 -11.526 -5.174 38 HG21 THR 6 3HG2 THR 6 4.127 -9.274 -5.097 39 HG22 THR 6 1HG2 THR 6 5.031 -8.423 -6.370 40 HG23 THR 6 2HG2 THR 6 5.885 -9.461 -5.236 41 H LEU 7 H LEU 7 2.271 -8.307 -6.740 42 HA LEU 7 HA LEU 7 3.019 -6.760 -9.186 43 HB3 LEU 7 2HB LEU 7 0.490 -6.563 -7.515 44 HG LEU 7 HG LEU 7 1.254 -4.456 -8.788 45 HD11 LEU 7 1HD1 LEU 7 1.979 -5.721 -10.901 46 HD12 LEU 7 2HD1 LEU 7 0.922 -4.342 -11.158 47 HD13 LEU 7 3HD1 LEU 7 0.270 -6.014 -11.240 48 HD21 LEU 7 3HD2 LEU 7 -1.049 -4.855 -7.991 49 HD22 LEU 7 1HD2 LEU 7 -1.419 -5.680 -9.524 50 HD23 LEU 7 2HD2 LEU 7 -0.993 -3.948 -9.508 51 H ILE 8 H ILE 8 4.025 -4.857 -8.693 52 HA ILE 8 HA ILE 8 4.265 -4.005 -5.831 53 HB ILE 8 HB ILE 8 6.286 -3.878 -8.106 54 HG13 ILE 8 2HG1 ILE 8 5.873 -6.149 -6.783 55 HG21 ILE 8 1HG2 ILE 8 6.471 -1.883 -6.700 56 HG22 ILE 8 2HG2 ILE 8 6.501 -2.887 -5.235 57 HG23 ILE 8 3HG2 ILE 8 7.844 -2.956 -6.405 58 HD11 ILE 8 3HD1 ILE 8 7.745 -5.728 -8.343 59 HD12 ILE 8 1HD1 ILE 8 8.687 -5.045 -7.002 60 HD13 ILE 8 2HD1 ILE 8 8.176 -6.751 -6.970 61 H LEU 9 H LEU 9 2.667 -2.479 -5.809 62 HA LEU 9 HA LEU 9 2.468 -0.481 -8.016 63 HB3 LEU 9 2HB LEU 9 0.365 0.110 -6.458 64 HG LEU 9 HG LEU 9 0.445 -2.224 -8.384 65 HD11 LEU 9 1HD1 LEU 9 -1.487 -2.565 -6.987 66 HD12 LEU 9 2HD1 LEU 9 -2.069 -1.670 -8.416 67 HD13 LEU 9 3HD1 LEU 9 -1.817 -0.816 -6.908 68 HD21 LEU 9 3HD2 LEU 9 0.924 0.163 -9.245 69 HD22 LEU 9 1HD2 LEU 9 -0.706 0.586 -8.703 70 HD23 LEU 9 2HD2 LEU 9 -0.492 -0.659 -9.942 71 H TYR 10 H TYR 10 3.938 1.175 -7.563 72 HA TYR 10 HA TYR 10 3.880 2.181 -4.744 73 HB3 TYR 10 2HB TYR 10 6.096 1.328 -5.404 74 HD1 TYR 10 2HD TYR 10 6.380 4.814 -6.643 75 HD2 TYR 10 1HD TYR 10 6.641 0.654 -7.728 76 HE1 TYR 10 2HE TYR 10 7.752 5.435 -8.567 77 HE2 TYR 10 1HE TYR 10 8.001 1.255 -9.693 78 HH TYR 10 HH TYR 10 8.319 3.738 -11.168 79 H TYR 11 H TYR 11 3.704 4.412 -4.440 80 HA TYR 11 HA TYR 11 2.450 5.933 -6.655 81 HB3 TYR 11 2HB TYR 11 2.199 7.527 -4.603 82 HD1 TYR 11 2HD TYR 11 0.975 4.002 -4.066 83 HD2 TYR 11 1HD TYR 11 0.005 8.164 -4.762 84 HE1 TYR 11 2HE TYR 11 -1.387 3.527 -3.605 85 HE2 TYR 11 1HE TYR 11 -2.359 7.689 -4.338 86 HH TYR 11 HH TYR 11 -3.571 5.808 -2.819 87 H SER 12 H SER 12 3.226 7.982 -7.068 88 HA SER 12 HA SER 12 4.623 9.730 -7.324 89 HB3 SER 12 2HB SER 12 6.754 8.476 -5.588 90 HG SER 12 HG SER 12 7.430 10.502 -5.374 91 H TRP 13 H TRP 13 7.029 9.952 -8.219 92 HA TRP 13 HA TRP 13 7.545 7.741 -10.104 93 HB3 TRP 13 2HB TRP 13 7.073 10.409 -11.386 94 HD1 TRP 13 HD TRP 13 5.067 7.189 -11.692 95 HE1 TRP 13 1HE TRP 13 5.701 5.903 -13.862 96 HE3 TRP 13 3HE TRP 13 8.863 10.150 -13.359 97 HZ2 TRP 13 2HZ TRP 13 7.684 6.037 -15.884 98 HZ3 TRP 13 3HZ TRP 13 10.306 9.399 -15.245 99 HH2 TRP 13 HH TRP 13 9.739 7.324 -16.484 100 H SER 14 H SER 14 9.194 8.604 -7.989 101 HA SER 14 HA SER 14 11.365 10.136 -9.314 102 HB3 SER 14 2HB SER 14 11.715 11.308 -7.336 103 HG SER 14 HG SER 14 9.645 12.019 -6.610 104 H GLY 15 H GLY 15 13.456 9.716 -7.674 105 HA2 GLY 15 1HA GLY 15 14.132 7.001 -8.254 106 HA3 GLY 15 2HA GLY 15 15.104 8.181 -7.365 107 H GLU 16 H GLU 16 12.597 8.413 -5.572 108 HA GLU 16 HA GLU 16 13.637 7.174 -3.295 109 HB3 GLU 16 2HB GLU 16 11.401 7.825 -2.323 110 HG3 GLU 16 2HG GLU 16 11.443 10.299 -3.213 111 H THR 17 H THR 17 10.357 6.338 -4.545 112 HA THR 17 HA THR 17 10.514 3.716 -3.379 113 HB THR 17 HB THR 17 8.243 3.617 -4.736 114 HG1 THR 17 1HG THR 17 7.383 5.657 -5.094 115 HG21 THR 17 3HG2 THR 17 8.657 5.570 -2.420 116 HG22 THR 17 1HG2 THR 17 8.445 3.816 -2.266 117 HG23 THR 17 2HG2 THR 17 7.120 4.805 -2.890 118 H LYS 18 H LYS 18 11.262 5.035 -6.538 119 HA LYS 18 HA LYS 18 10.964 2.816 -8.183 120 HB3 LYS 18 2HB LYS 18 12.880 5.149 -8.188 121 HG3 LYS 18 2HG LYS 18 12.846 2.890 -10.212 122 HD3 LYS 18 2HD LYS 18 14.391 4.500 -11.511 123 HE3 LYS 18 2HE LYS 18 11.378 4.772 -11.329 124 HZ1 LYS 18 3HZ LYS 18 12.967 5.855 -13.573 125 HZ2 LYS 18 1HZ LYS 18 12.332 6.785 -12.340 126 HZ3 LYS 18 2HZ LYS 18 11.379 5.912 -13.327 127 H LYS 19 H LYS 19 14.038 3.641 -6.392 128 HA LYS 19 HA LYS 19 15.414 1.388 -7.463 129 HB3 LYS 19 2HB LYS 19 16.855 1.592 -5.353 130 HG3 LYS 19 2HG LYS 19 16.486 4.164 -6.942 131 HD3 LYS 19 2HD LYS 19 18.955 4.139 -6.940 132 HE3 LYS 19 2HE LYS 19 17.994 3.791 -4.080 133 HZ1 LYS 19 3HZ LYS 19 19.788 5.807 -5.225 134 HZ2 LYS 19 1HZ LYS 19 20.376 4.373 -4.713 135 HZ3 LYS 19 2HZ LYS 19 19.615 5.398 -3.628 136 H MET 20 H MET 20 13.540 1.631 -4.517 137 HA MET 20 HA MET 20 13.826 -1.020 -3.584 138 HB3 MET 20 2HB MET 20 11.199 0.221 -3.098 139 HG3 MET 20 2HG MET 20 12.635 -1.290 -1.509 140 HE1 MET 20 3HE MET 20 16.285 -0.646 -0.791 141 HE2 MET 20 1HE MET 20 14.966 -1.771 -1.153 142 HE3 MET 20 2HE MET 20 15.554 -0.656 -2.414 143 H ALA 21 H ALA 21 11.411 0.378 -5.896 144 HA ALA 21 HA ALA 21 9.850 -1.995 -6.055 145 HB1 ALA 21 1HB ALA 21 8.990 0.238 -6.617 146 HB2 ALA 21 2HB ALA 21 10.106 0.345 -8.001 147 HB3 ALA 21 3HB ALA 21 8.818 -0.871 -7.991 148 H GLU 22 H GLU 22 12.352 -0.647 -8.297 149 HA GLU 22 HA GLU 22 12.084 -2.701 -10.230 150 HB3 GLU 22 2HB GLU 22 14.283 -2.009 -11.091 151 HG3 GLU 22 2HG GLU 22 12.918 0.536 -10.243 152 H LYS 23 H LYS 23 13.972 -2.587 -7.240 153 HA LYS 23 HA LYS 23 15.582 -4.875 -7.802 154 HB3 LYS 23 2HB LYS 23 14.944 -4.600 -4.932 155 HG3 LYS 23 2HG LYS 23 17.029 -5.500 -6.315 156 HD3 LYS 23 2HD LYS 23 18.796 -3.829 -5.834 157 HE3 LYS 23 2HE LYS 23 16.664 -2.864 -7.788 158 HZ1 LYS 23 3HZ LYS 23 18.445 -1.241 -7.252 159 HZ2 LYS 23 1HZ LYS 23 18.271 -1.638 -8.840 160 HZ3 LYS 23 2HZ LYS 23 19.528 -2.256 -7.978 161 H ILE 24 H ILE 24 12.714 -4.654 -5.668 162 HA ILE 24 HA ILE 24 12.619 -7.379 -5.123 163 HB ILE 24 HB ILE 24 10.334 -5.346 -5.264 164 HG13 ILE 24 2HG1 ILE 24 12.266 -4.746 -3.749 165 HG21 ILE 24 1HG2 ILE 24 9.391 -7.615 -5.184 166 HG22 ILE 24 2HG2 ILE 24 10.430 -8.021 -3.808 167 HG23 ILE 24 3HG2 ILE 24 9.128 -6.819 -3.642 168 HD11 ILE 24 3HD1 ILE 24 10.973 -4.019 -1.956 169 HD12 ILE 24 1HD1 ILE 24 9.790 -4.178 -3.266 170 HD13 ILE 24 2HD1 ILE 24 9.899 -5.427 -2.003 171 H ASN 25 H ASN 25 11.194 -5.581 -7.859 172 HA ASN 25 HA ASN 25 9.634 -7.614 -9.017 173 HB3 ASN 25 2HB ASN 25 11.210 -5.313 -10.213 174 HD21 ASN 25 1HD2 ASN 25 8.337 -7.389 -10.960 175 HD22 ASN 25 2HD2 ASN 25 8.816 -7.656 -12.621 176 H SER 26 H SER 26 13.144 -7.150 -9.171 177 HA SER 26 HA SER 26 13.544 -9.185 -11.230 178 HB3 SER 26 2HB SER 26 15.486 -7.595 -9.498 179 HG SER 26 HG SER 26 16.454 -9.335 -10.538 180 H GLU 27 H GLU 27 13.068 -9.231 -7.795 181 HA GLU 27 HA GLU 27 14.809 -11.599 -7.405 182 HB3 GLU 27 2HB GLU 27 14.477 -11.200 -4.999 183 HG3 GLU 27 2HG GLU 27 15.254 -8.590 -6.333 184 H ILE 28 H ILE 28 11.804 -11.184 -8.534 185 HA ILE 28 HA ILE 28 10.698 -13.585 -7.171 186 HB ILE 28 HB ILE 28 9.171 -11.066 -7.898 187 HG13 ILE 28 2HG1 ILE 28 10.626 -10.822 -5.820 188 HG21 ILE 28 1HG2 ILE 28 7.259 -12.197 -6.719 189 HG22 ILE 28 2HG2 ILE 28 7.743 -13.052 -8.132 190 HG23 ILE 28 3HG2 ILE 28 8.252 -13.656 -6.526 191 HD11 ILE 28 3HD1 ILE 28 8.440 -9.627 -6.021 192 HD12 ILE 28 1HD1 ILE 28 7.716 -10.942 -5.067 193 HD13 ILE 28 2HD1 ILE 28 8.989 -9.952 -4.361 194 H LYS 29 H LYS 29 9.109 -14.695 -8.624 195 HA LYS 29 HA LYS 29 9.908 -14.501 -11.482 196 HB3 LYS 29 2HB LYS 29 8.136 -16.568 -10.140 197 HG3 LYS 29 2HG LYS 29 9.984 -16.734 -12.547 198 HD3 LYS 29 2HD LYS 29 7.837 -18.712 -11.733 199 HE3 LYS 29 2HE LYS 29 10.493 -18.866 -13.222 200 HZ1 LYS 29 3HZ LYS 29 10.015 -21.090 -13.606 201 HZ2 LYS 29 1HZ LYS 29 8.455 -20.967 -13.075 202 HZ3 LYS 29 2HZ LYS 29 9.695 -20.900 -11.985 203 H ASP 30 H ASP 30 8.321 -14.063 -13.016 204 HA ASP 30 HA ASP 30 6.559 -12.870 -13.827 205 HB3 ASP 30 2HB ASP 30 4.766 -14.630 -12.149 206 H SER 31 H SER 31 7.717 -11.435 -11.704 207 HA SER 31 HA SER 31 5.431 -10.242 -10.296 208 HB3 SER 31 2HB SER 31 8.431 -9.963 -10.076 209 HG SER 31 HG SER 31 6.538 -8.295 -8.773 210 H GLU 32 H GLU 32 5.165 -7.940 -10.523 211 HA GLU 32 HA GLU 32 6.324 -6.632 -12.911 212 HB3 GLU 32 2HB GLU 32 3.945 -5.516 -13.120 213 HG3 GLU 32 2HG GLU 32 4.654 -8.321 -14.033 214 H LEU 33 H LEU 33 6.069 -4.254 -12.785 215 HA LEU 33 HA LEU 33 5.805 -3.124 -10.132 216 HB3 LEU 33 2HB LEU 33 8.203 -3.471 -10.646 217 HG LEU 33 HG LEU 33 7.832 -1.315 -12.799 218 HD11 LEU 33 1HD1 LEU 33 10.336 -2.586 -11.647 219 HD12 LEU 33 2HD1 LEU 33 9.686 -0.986 -11.199 220 HD13 LEU 33 3HD1 LEU 33 10.242 -1.274 -12.848 221 HD21 LEU 33 3HD2 LEU 33 8.901 -4.175 -13.058 222 HD22 LEU 33 1HD2 LEU 33 9.112 -2.903 -14.278 223 HD23 LEU 33 2HD2 LEU 33 7.494 -3.479 -13.902 224 H LYS 34 H LYS 34 4.341 -1.513 -10.249 225 HA LYS 34 HA LYS 34 3.589 -0.213 -12.823 226 HB3 LYS 34 2HB LYS 34 1.247 -0.351 -11.450 227 HG3 LYS 34 2HG LYS 34 1.164 -0.971 -13.659 228 HD3 LYS 34 2HD LYS 34 2.384 -3.704 -13.076 229 HE3 LYS 34 2HE LYS 34 1.264 -2.343 -15.581 230 HZ1 LYS 34 3HZ LYS 34 1.378 -4.426 -16.581 231 HZ2 LYS 34 1HZ LYS 34 1.902 -5.206 -15.239 232 HZ3 LYS 34 2HZ LYS 34 2.897 -4.166 -16.036 233 H GLU 35 H GLU 35 2.473 1.868 -12.413 234 HA GLU 35 HA GLU 35 3.656 3.194 -10.021 235 HB3 GLU 35 2HB GLU 35 4.231 4.995 -11.653 236 HG3 GLU 35 2HG GLU 35 5.442 2.210 -11.996 237 H VAL 36 H VAL 36 2.118 3.964 -8.891 238 HA VAL 36 HA VAL 36 -0.610 4.699 -9.871 239 HB VAL 36 HB VAL 36 0.771 4.772 -7.121 240 HG11 VAL 36 1HG1 VAL 36 -0.954 6.285 -6.951 241 HG12 VAL 36 2HG1 VAL 36 -2.053 5.350 -8.001 242 HG13 VAL 36 3HG1 VAL 36 -1.683 4.793 -6.369 243 HG21 VAL 36 3HG2 VAL 36 -1.228 2.705 -8.007 244 HG22 VAL 36 1HG2 VAL 36 0.532 2.439 -7.906 245 HG23 VAL 36 2HG2 VAL 36 -0.386 2.814 -6.467 246 H LYS 37 H LYS 37 -1.182 7.024 -9.655 247 HA LYS 37 HA LYS 37 0.652 8.994 -8.548 248 HB3 LYS 37 2HB LYS 37 1.426 9.580 -10.546 249 HG3 LYS 37 2HG LYS 37 -1.022 8.350 -11.858 250 HD3 LYS 37 2HD LYS 37 0.380 8.923 -13.924 251 HE3 LYS 37 2HE LYS 37 -1.185 11.142 -12.514 252 HZ1 LYS 37 3HZ LYS 37 -0.270 10.799 -15.297 253 HZ2 LYS 37 1HZ LYS 37 -0.173 12.159 -14.355 254 HZ3 LYS 37 2HZ LYS 37 -1.609 11.677 -14.972 255 H VAL 38 H VAL 38 -0.888 11.271 -8.877 256 HA VAL 38 HA VAL 38 -3.483 10.486 -7.667 257 HB VAL 38 HB VAL 38 -3.554 13.034 -7.183 258 HG11 VAL 38 1HG1 VAL 38 -1.645 11.138 -5.756 259 HG12 VAL 38 2HG1 VAL 38 -2.296 12.646 -5.082 260 HG13 VAL 38 3HG1 VAL 38 -3.395 11.325 -5.476 261 HG21 VAL 38 3HG2 VAL 38 -0.527 12.730 -7.484 262 HG22 VAL 38 1HG2 VAL 38 -1.577 13.642 -8.605 263 HG23 VAL 38 2HG2 VAL 38 -1.410 14.140 -6.919 264 H SER 39 H SER 39 -5.439 11.616 -8.336 265 HA SER 39 HA SER 39 -5.697 12.254 -11.161 266 HB3 SER 39 2HB SER 39 -7.641 12.618 -8.858 267 HG SER 39 HG SER 39 -9.015 12.827 -10.385 268 H GLU 40 H GLU 40 -7.414 14.373 -10.958 269 HA GLU 40 HA GLU 40 -5.606 16.617 -10.573 270 HB3 GLU 40 2HB GLU 40 -7.686 17.959 -11.263 271 HG3 GLU 40 2HG GLU 40 -6.610 15.698 -13.024 272 H GLY 41 H GLY 41 -6.456 18.521 -9.308 273 HA2 GLY 41 1HA GLY 41 -6.365 17.763 -6.613 274 HA3 GLY 41 2HA GLY 41 -6.471 19.397 -7.276 275 H THR 42 H THR 42 -7.652 19.586 -5.152 276 HA THR 42 HA THR 42 -10.564 19.436 -5.710 277 HB THR 42 HB THR 42 -10.825 19.213 -3.155 278 HG1 THR 42 1HG THR 42 -8.199 18.185 -3.486 279 HG21 THR 42 3HG2 THR 42 -11.439 17.417 -4.750 280 HG22 THR 42 1HG2 THR 42 -10.840 16.793 -3.205 281 HG23 THR 42 2HG2 THR 42 -9.788 16.773 -4.630 282 H PHE 43 H PHE 43 -8.602 20.764 -3.065 283 HA PHE 43 HA PHE 43 -9.246 23.550 -3.926 284 HB3 PHE 43 2HB PHE 43 -10.791 22.983 -2.219 285 HD1 PHE 43 2HD PHE 43 -7.809 22.819 0.060 286 HD2 PHE 43 1HD PHE 43 -11.260 20.756 -1.517 287 HE1 PHE 43 2HE PHE 43 -7.534 21.036 1.753 288 HE2 PHE 43 1HE PHE 43 -10.949 18.956 0.135 289 HZ PHE 43 HZ PHE 43 -9.080 19.091 1.790 290 H ASP 44 H ASP 44 -7.783 25.151 -3.125 291 HA ASP 44 HA ASP 44 -5.797 26.094 -2.887 292 HB3 ASP 44 2HB ASP 44 -4.708 25.543 -0.655 293 H ALA 45 H ALA 45 -5.644 23.516 -4.501 294 HA ALA 45 HA ALA 45 -2.697 23.560 -4.683 295 HB1 ALA 45 1HB ALA 45 -2.649 21.170 -5.099 296 HB2 ALA 45 2HB ALA 45 -3.501 21.427 -3.561 297 HB3 ALA 45 3HB ALA 45 -4.409 21.077 -5.062 298 H ASP 46 H ASP 46 -1.967 22.983 -6.769 299 HA ASP 46 HA ASP 46 -3.635 23.774 -9.063 300 HB3 ASP 46 2HB ASP 46 -1.437 22.798 -10.229 301 H MET 47 H MET 47 -3.471 22.141 -10.987 302 HA MET 47 HA MET 47 -5.263 20.118 -10.402 303 HB3 MET 47 2HB MET 47 -4.704 19.259 -12.742 304 HG3 MET 47 2HG MET 47 -5.366 22.123 -12.093 305 HE1 MET 47 3HE MET 47 -6.701 23.705 -13.435 306 HE2 MET 47 1HE MET 47 -6.987 23.614 -15.178 307 HE3 MET 47 2HE MET 47 -7.769 22.450 -14.088 308 H TYR 48 H TYR 48 -1.725 19.578 -11.124 309 HA TYR 48 HA TYR 48 -1.979 17.019 -9.566 310 HB3 TYR 48 2HB TYR 48 -0.240 16.072 -11.039 311 HD1 TYR 48 2HD TYR 48 -2.053 14.372 -11.006 312 HD2 TYR 48 1HD TYR 48 -2.268 17.841 -13.560 313 HE1 TYR 48 2HE TYR 48 -3.788 13.262 -12.349 314 HE2 TYR 48 1HE TYR 48 -4.052 16.755 -14.867 315 HH TYR 48 HH TYR 48 -5.534 13.715 -13.940 316 H LYS 49 H LYS 49 -1.362 18.223 -7.669 317 HA LYS 49 HA LYS 49 1.519 18.343 -7.416 318 HB3 LYS 49 2HB LYS 49 0.211 20.934 -6.638 319 HG3 LYS 49 2HG LYS 49 2.927 19.914 -7.008 320 HD3 LYS 49 2HD LYS 49 2.595 20.828 -9.333 321 HE3 LYS 49 2HE LYS 49 2.767 23.578 -8.115 322 HZ1 LYS 49 3HZ LYS 49 2.800 23.427 -10.467 323 HZ2 LYS 49 1HZ LYS 49 1.348 24.088 -10.024 324 HZ3 LYS 49 2HZ LYS 49 1.411 22.523 -10.514 325 H THR 50 H THR 50 -1.388 17.574 -6.105 326 HA THR 50 HA THR 50 -1.360 18.454 -3.475 327 HB THR 50 HB THR 50 -3.288 17.767 -4.658 328 HG1 THR 50 1HG THR 50 -3.084 17.150 -2.269 329 HG21 THR 50 3HG2 THR 50 -3.889 15.489 -5.262 330 HG22 THR 50 1HG2 THR 50 -2.281 14.915 -4.785 331 HG23 THR 50 2HG2 THR 50 -2.475 16.019 -6.160 332 H SER 51 H SER 51 0.948 18.191 -2.939 333 HA SER 51 HA SER 51 1.403 16.076 -1.082 334 HB3 SER 51 2HB SER 51 3.574 15.336 -2.266 335 HG SER 51 HG SER 51 1.005 14.677 -3.227 336 H ASP 52 H ASP 52 4.091 16.408 -0.762 337 HA ASP 52 HA ASP 52 5.687 17.633 0.131 338 HB3 ASP 52 2HB ASP 52 4.711 20.053 -1.392 339 H ILE 53 H ILE 53 3.895 16.925 1.642 340 HA ILE 53 HA ILE 53 3.151 19.125 3.489 341 HB ILE 53 HB ILE 53 1.077 17.830 3.967 342 HG13 ILE 53 2HG1 ILE 53 1.965 15.632 2.985 343 HG21 ILE 53 1HG2 ILE 53 -0.191 18.668 2.039 344 HG22 ILE 53 2HG2 ILE 53 1.075 19.817 2.470 345 HG23 ILE 53 3HG2 ILE 53 1.282 18.756 1.067 346 HD11 ILE 53 3HD1 ILE 53 -0.809 16.449 2.046 347 HD12 ILE 53 1HD1 ILE 53 -0.190 14.803 2.280 348 HD13 ILE 53 2HD1 ILE 53 -0.390 15.872 3.680 349 H ALA 54 H ALA 54 2.515 17.932 5.683 350 HA ALA 54 HA ALA 54 3.523 15.277 6.070 351 HB1 ALA 54 1HB ALA 54 5.080 17.526 7.423 352 HB2 ALA 54 2HB ALA 54 5.170 15.808 7.879 353 HB3 ALA 54 3HB ALA 54 5.718 16.317 6.285 354 H LEU 55 H LEU 55 2.106 18.221 7.391 355 HA LEU 55 HA LEU 55 0.845 16.791 9.698 356 HB3 LEU 55 2HB LEU 55 0.283 19.246 10.250 357 HG LEU 55 HG LEU 55 2.631 20.145 10.663 358 HD11 LEU 55 1HD1 LEU 55 1.262 19.267 12.418 359 HD12 LEU 55 2HD1 LEU 55 2.924 18.737 12.679 360 HD13 LEU 55 3HD1 LEU 55 1.724 17.597 12.013 361 HD21 LEU 55 3HD2 LEU 55 4.497 18.636 10.841 362 HD22 LEU 55 1HD2 LEU 55 3.958 18.751 9.166 363 HD23 LEU 55 2HD2 LEU 55 3.556 17.308 10.146 364 H ASP 56 H ASP 56 0.357 18.402 6.616 365 HA ASP 56 HA ASP 56 -2.459 18.731 6.782 366 HB3 ASP 56 2HB ASP 56 -1.446 18.258 4.056 367 H GLN 57 H GLN 57 -3.906 17.632 5.145 368 HA GLN 57 HA GLN 57 -5.232 15.841 4.838 369 HB3 GLN 57 2HB GLN 57 -3.321 13.739 4.335 370 HG3 GLN 57 2HG GLN 57 -5.542 13.918 3.247 371 HE21 GLN 57 1HE2 GLN 57 -7.084 15.333 2.460 372 HE22 GLN 57 2HE2 GLN 57 -6.766 16.615 1.332 373 H ILE 58 H ILE 58 -3.270 15.852 7.530 374 HA ILE 58 HA ILE 58 -4.622 13.512 8.792 375 HB ILE 58 HB ILE 58 -2.203 15.125 9.661 376 HG13 ILE 58 2HG1 ILE 58 -2.102 13.245 7.607 377 HG21 ILE 58 1HG2 ILE 58 -3.287 12.501 10.779 378 HG22 ILE 58 2HG2 ILE 58 -1.835 13.360 11.328 379 HG23 ILE 58 3HG2 ILE 58 -3.420 14.087 11.561 380 HD11 ILE 58 3HD1 ILE 58 0.118 13.816 9.602 381 HD12 ILE 58 1HD1 ILE 58 0.284 13.413 7.886 382 HD13 ILE 58 2HD1 ILE 58 -0.385 14.961 8.337 383 H GLN 59 H GLN 59 -3.296 16.753 9.738 384 HA GLN 59 HA GLN 59 -5.222 16.937 11.926 385 HB3 GLN 59 2HB GLN 59 -4.007 19.114 12.314 386 HG3 GLN 59 2HG GLN 59 -2.272 16.631 12.080 387 HE21 GLN 59 1HE2 GLN 59 -0.332 16.646 13.427 388 HE22 GLN 59 2HE2 GLN 59 0.204 18.172 14.182 389 H GLY 60 H GLY 60 -7.092 17.982 11.806 390 HA2 GLY 60 1HA GLY 60 -8.751 19.431 11.125 391 HA3 GLY 60 2HA GLY 60 -7.641 20.190 9.988 392 H ASN 61 H ASN 61 -6.815 18.031 8.431 393 HA ASN 61 HA ASN 61 -9.080 17.947 6.608 394 HB3 ASN 61 2HB ASN 61 -7.431 16.401 5.317 395 HD21 ASN 61 1HD2 ASN 61 -6.655 17.548 3.444 396 HD22 ASN 61 2HD2 ASN 61 -6.335 19.274 3.553 397 H LYS 62 H LYS 62 -10.192 16.120 5.884 398 HA LYS 62 HA LYS 62 -9.993 13.647 7.570 399 HB3 LYS 62 2HB LYS 62 -12.431 13.385 6.561 400 HG3 LYS 62 2HG LYS 62 -12.208 13.448 8.922 401 HD3 LYS 62 2HD LYS 62 -11.808 16.466 8.759 402 HE3 LYS 62 2HE LYS 62 -12.425 14.545 11.024 403 HZ1 LYS 62 3HZ LYS 62 -11.681 16.166 12.548 404 HZ2 LYS 62 1HZ LYS 62 -11.141 17.184 11.371 405 HZ3 LYS 62 2HZ LYS 62 -10.416 15.722 11.622 406 H ASP 63 H ASP 63 -11.356 14.580 4.424 407 HA ASP 63 HA ASP 63 -10.593 12.069 3.267 408 HB3 ASP 63 2HB ASP 63 -11.791 12.919 1.291 409 H PHE 64 H PHE 64 -9.868 12.284 0.806 410 HA PHE 64 HA PHE 64 -7.512 13.904 0.331 411 HB3 PHE 64 2HB PHE 64 -6.420 12.240 1.577 412 HD1 PHE 64 1HD PHE 64 -8.109 9.900 -0.849 413 HD2 PHE 64 2HD PHE 64 -7.349 10.894 3.287 414 HE1 PHE 64 1HE PHE 64 -9.595 8.067 -0.132 415 HE2 PHE 64 2HE PHE 64 -8.764 8.987 4.006 416 HZ PHE 64 HZ PHE 64 -10.042 7.692 2.281 417 HA PRO 65 HA PRO 65 -9.249 13.355 -3.631 418 HB3 PRO 65 2HB PRO 65 -7.735 14.929 -4.354 419 HG3 PRO 65 2HG PRO 65 -5.441 14.809 -3.732 420 HD3 PRO 65 2HD PRO 65 -6.646 14.765 -1.715 421 H GLU 66 H GLU 66 -9.361 12.199 -5.670 422 HA GLU 66 HA GLU 66 -8.930 9.348 -5.475 423 HB3 GLU 66 2HB GLU 66 -10.919 10.002 -6.501 424 HG3 GLU 66 2HG GLU 66 -10.172 11.216 -8.979 425 H ILE 67 H ILE 67 -7.848 8.205 -7.442 426 HA ILE 67 HA ILE 67 -5.192 9.485 -7.826 427 HB ILE 67 HB ILE 67 -4.121 7.357 -7.412 428 HG13 ILE 67 2HG1 ILE 67 -6.254 5.987 -8.062 429 HG21 ILE 67 1HG2 ILE 67 -5.892 8.352 -5.148 430 HG22 ILE 67 2HG2 ILE 67 -4.498 7.289 -4.955 431 HG23 ILE 67 3HG2 ILE 67 -4.283 8.925 -5.593 432 HD11 ILE 67 3HD1 ILE 67 -4.155 5.293 -6.014 433 HD12 ILE 67 1HD1 ILE 67 -5.460 4.163 -6.367 434 HD13 ILE 67 2HD1 ILE 67 -4.366 4.700 -7.665 435 H GLN 68 H GLN 68 -3.800 8.016 -9.404 436 HA GLN 68 HA GLN 68 -5.426 7.141 -11.700 437 HB3 GLN 68 2HB GLN 68 -3.712 8.230 -13.218 438 HG3 GLN 68 2HG GLN 68 -4.563 10.464 -13.161 439 HE21 GLN 68 1HE2 GLN 68 -7.356 10.566 -11.670 440 HE22 GLN 68 2HE2 GLN 68 -8.320 9.490 -12.617 441 H LEU 69 H LEU 69 -4.255 5.789 -13.083 442 HA LEU 69 HA LEU 69 -1.773 4.554 -12.627 443 HB3 LEU 69 2HB LEU 69 -4.280 3.135 -11.645 444 HG LEU 69 HG LEU 69 -2.662 1.493 -12.494 445 HD11 LEU 69 1HD1 LEU 69 -0.592 1.237 -11.252 446 HD12 LEU 69 2HD1 LEU 69 -1.082 2.601 -10.179 447 HD13 LEU 69 3HD1 LEU 69 -0.694 2.892 -11.903 448 HD21 LEU 69 3HD2 LEU 69 -4.301 0.951 -10.777 449 HD22 LEU 69 1HD2 LEU 69 -3.253 1.607 -9.492 450 HD23 LEU 69 2HD2 LEU 69 -2.775 0.135 -10.393 451 H ASP 70 H ASP 70 -1.990 2.375 -13.899 452 HA ASP 70 HA ASP 70 -3.368 2.666 -16.468 453 HB3 ASP 70 2HB ASP 70 -1.856 0.315 -15.456 454 H ASN 71 H ASN 71 -4.246 0.339 -17.163 455 HA ASN 71 HA ASN 71 -6.414 -0.243 -15.223 456 HB3 ASN 71 2HB ASN 71 -6.514 -1.374 -17.994 457 HD21 ASN 71 1HD2 ASN 71 -7.895 -2.811 -16.328 458 HD22 ASN 71 2HD2 ASN 71 -9.479 -2.184 -16.000 459 H ILE 72 H ILE 72 -5.054 -1.365 -13.907 460 HA ILE 72 HA ILE 72 -4.132 -4.100 -14.732 461 HB ILE 72 HB ILE 72 -3.871 -2.404 -12.198 462 HG13 ILE 72 2HG1 ILE 72 -2.407 -2.398 -14.690 463 HG21 ILE 72 1HG2 ILE 72 -2.125 -4.062 -11.475 464 HG22 ILE 72 2HG2 ILE 72 -3.764 -4.710 -11.437 465 HG23 ILE 72 3HG2 ILE 72 -2.663 -5.151 -12.766 466 HD11 ILE 72 3HD1 ILE 72 -2.844 -0.524 -13.142 467 HD12 ILE 72 1HD1 ILE 72 -1.686 -1.228 -11.980 468 HD13 ILE 72 2HD1 ILE 72 -1.124 -0.660 -13.574 469 H ASP 73 H ASP 73 -4.813 -5.958 -13.373 470 HA ASP 73 HA ASP 73 -7.358 -5.567 -11.951 471 HB3 ASP 73 2HB ASP 73 -7.268 -8.098 -13.467 472 H TYR 74 H TYR 74 -6.859 -6.111 -9.973 473 HA TYR 74 HA TYR 74 -4.458 -7.495 -9.269 474 HB3 TYR 74 2HB TYR 74 -5.218 -7.220 -6.973 475 HD1 TYR 74 1HD TYR 74 -3.590 -5.586 -8.803 476 HD2 TYR 74 2HD TYR 74 -7.398 -4.652 -7.010 477 HE1 TYR 74 1HE TYR 74 -3.188 -3.213 -9.181 478 HE2 TYR 74 2HE TYR 74 -6.886 -2.227 -7.213 479 HH TYR 74 HH TYR 74 -5.404 -0.761 -8.792 480 H ASN 75 H ASN 75 -7.613 -8.615 -9.977 481 HA ASN 75 HA ASN 75 -7.718 -11.154 -8.758 482 HB3 ASN 75 2HB ASN 75 -8.888 -11.784 -11.005 483 HD21 ASN 75 1HD2 ASN 75 -9.697 -8.376 -9.930 484 HD22 ASN 75 2HD2 ASN 75 -10.861 -9.017 -8.784 485 H ASN 76 H ASN 76 -5.775 -10.034 -11.495 486 HA ASN 76 HA ASN 76 -5.127 -12.697 -12.416 487 HB3 ASN 76 2HB ASN 76 -3.789 -11.525 -14.092 488 HD21 ASN 76 1HD2 ASN 76 -4.582 -9.187 -15.333 489 HD22 ASN 76 2HD2 ASN 76 -6.277 -9.161 -15.678 490 H TYR 77 H TYR 77 -4.054 -11.347 -9.612 491 HA TYR 77 HA TYR 77 -1.299 -12.400 -9.790 492 HB3 TYR 77 2HB TYR 77 -0.479 -10.416 -8.535 493 HD1 TYR 77 2HD TYR 77 -2.929 -9.085 -11.063 494 HD2 TYR 77 1HD TYR 77 1.186 -10.085 -10.243 495 HE1 TYR 77 2HE TYR 77 -2.312 -8.467 -13.373 496 HE2 TYR 77 1HE TYR 77 1.802 -9.511 -12.552 497 HH TYR 77 HH TYR 77 0.917 -8.295 -14.567 498 H ASP 78 H ASP 78 -0.377 -12.705 -7.481 499 HA ASP 78 HA ASP 78 -2.548 -13.588 -5.614 500 HB3 ASP 78 2HB ASP 78 0.116 -14.867 -6.209 501 H LEU 79 H LEU 79 0.159 -11.546 -5.952 502 HA LEU 79 HA LEU 79 0.282 -11.137 -3.000 503 HB3 LEU 79 2HB LEU 79 2.791 -11.203 -4.652 504 HG LEU 79 HG LEU 79 3.951 -11.839 -2.796 505 HD11 LEU 79 1HD1 LEU 79 3.150 -9.493 -2.611 506 HD12 LEU 79 2HD1 LEU 79 3.543 -10.234 -1.060 507 HD13 LEU 79 3HD1 LEU 79 1.841 -10.069 -1.535 508 HD21 LEU 79 3HD2 LEU 79 1.392 -12.959 -1.773 509 HD22 LEU 79 1HD2 LEU 79 2.591 -12.407 -0.558 510 HD23 LEU 79 2HD2 LEU 79 3.035 -13.605 -1.749 511 H ILE 80 H ILE 80 0.387 -8.907 -2.532 512 HA ILE 80 HA ILE 80 1.229 -7.075 -4.725 513 HB ILE 80 HB ILE 80 -1.225 -6.685 -2.984 514 HG13 ILE 80 2HG1 ILE 80 -1.608 -8.436 -4.580 515 HG21 ILE 80 1HG2 ILE 80 -0.118 -5.009 -5.296 516 HG22 ILE 80 2HG2 ILE 80 -1.623 -4.694 -4.391 517 HG23 ILE 80 3HG2 ILE 80 -0.069 -4.547 -3.578 518 HD11 ILE 80 3HD1 ILE 80 -3.247 -7.651 -6.106 519 HD12 ILE 80 1HD1 ILE 80 -3.424 -6.673 -4.637 520 HD13 ILE 80 2HD1 ILE 80 -2.632 -5.989 -6.076 521 H LEU 81 H LEU 81 2.833 -5.868 -4.167 522 HA LEU 81 HA LEU 81 3.376 -5.131 -1.342 523 HB3 LEU 81 2HB LEU 81 5.518 -4.158 -2.597 524 HG LEU 81 HG LEU 81 6.764 -6.249 -2.506 525 HD11 LEU 81 1HD1 LEU 81 6.498 -6.569 -0.055 526 HD12 LEU 81 2HD1 LEU 81 5.024 -5.596 -0.101 527 HD13 LEU 81 3HD1 LEU 81 6.593 -4.879 -0.533 528 HD21 LEU 81 3HD2 LEU 81 5.794 -8.296 -1.640 529 HD22 LEU 81 1HD2 LEU 81 4.999 -7.851 -3.157 530 HD23 LEU 81 2HD2 LEU 81 4.180 -7.568 -1.603 531 H ILE 82 H ILE 82 3.516 -3.015 -0.726 532 HA ILE 82 HA ILE 82 2.601 -0.877 -2.605 533 HB ILE 82 HB ILE 82 1.796 -1.406 0.288 534 HG13 ILE 82 2HG1 ILE 82 0.804 -3.134 -1.095 535 HG21 ILE 82 1HG2 ILE 82 1.795 1.024 -0.454 536 HG22 ILE 82 2HG2 ILE 82 0.608 0.572 -1.694 537 HG23 ILE 82 3HG2 ILE 82 0.240 0.390 0.036 538 HD11 ILE 82 3HD1 ILE 82 -1.542 -2.787 -0.896 539 HD12 ILE 82 1HD1 ILE 82 -0.750 -2.056 0.522 540 HD13 ILE 82 2HD1 ILE 82 -1.366 -1.034 -0.802 541 H GLY 83 H GLY 83 4.097 0.859 -2.673 542 HA2 GLY 83 1HA GLY 83 5.912 1.232 -0.329 543 HA3 GLY 83 2HA GLY 83 6.314 1.565 -2.004 544 H SER 84 H SER 84 6.108 3.261 0.616 545 HA SER 84 HA SER 84 5.155 5.725 -0.584 546 HB3 SER 84 2HB SER 84 3.010 5.228 0.085 547 HG SER 84 HG SER 84 2.788 4.308 2.360 548 HA PRO 85 HA PRO 85 8.074 7.267 2.489 549 HB3 PRO 85 2HB PRO 85 7.962 9.244 1.297 550 HG3 PRO 85 2HG PRO 85 5.876 10.195 0.654 551 HD3 PRO 85 2HD PRO 85 5.851 8.032 -0.275 552 H VAL 86 H VAL 86 8.313 8.045 4.778 553 HA VAL 86 HA VAL 86 5.960 8.611 6.345 554 HB VAL 86 HB VAL 86 7.884 6.694 7.675 555 HG11 VAL 86 1HG1 VAL 86 5.923 6.204 9.054 556 HG12 VAL 86 2HG1 VAL 86 6.268 7.928 9.052 557 HG13 VAL 86 3HG1 VAL 86 4.926 7.297 8.063 558 HG21 VAL 86 3HG2 VAL 86 5.566 5.720 6.009 559 HG22 VAL 86 1HG2 VAL 86 7.300 5.366 5.826 560 HG23 VAL 86 2HG2 VAL 86 6.452 4.763 7.236 561 H TRP 87 H TRP 87 6.646 9.990 8.135 562 HA TRP 87 HA TRP 87 9.319 9.912 9.062 563 HB3 TRP 87 2HB TRP 87 8.620 12.576 7.819 564 HD1 TRP 87 HD TRP 87 11.743 10.299 8.069 565 HE1 TRP 87 1HE TRP 87 13.746 11.667 8.860 566 HE3 TRP 87 3HE TRP 87 9.366 14.775 8.786 567 HZ2 TRP 87 2HZ TRP 87 14.211 14.390 9.871 568 HZ3 TRP 87 3HZ TRP 87 10.619 16.735 9.646 569 HH2 TRP 87 HH TRP 87 13.032 16.550 10.181 570 H SER 88 H SER 88 6.448 11.719 9.012 571 HA SER 88 HA SER 88 6.635 11.854 11.958 572 HB3 SER 88 2HB SER 88 6.916 14.041 11.422 573 HG SER 88 HG SER 88 6.387 14.943 9.554 574 H GLY 89 H GLY 89 5.687 9.743 11.718 575 HA2 GLY 89 1HA GLY 89 4.012 8.390 12.437 576 HA3 GLY 89 2HA GLY 89 2.888 9.713 12.421 577 H TYR 90 H TYR 90 2.434 10.514 10.121 578 HA TYR 90 HA TYR 90 2.018 8.456 8.074 579 HB3 TYR 90 2HB TYR 90 0.279 7.751 9.363 580 HD1 TYR 90 2HD TYR 90 0.597 11.400 10.228 581 HD2 TYR 90 1HD TYR 90 -1.602 7.746 10.890 582 HE1 TYR 90 2HE TYR 90 -0.116 12.230 12.405 583 HE2 TYR 90 1HE TYR 90 -2.375 8.548 13.032 584 HH TYR 90 HH TYR 90 -1.382 11.898 14.208 585 HA PRO 91 HA PRO 91 2.258 13.088 7.057 586 HB3 PRO 91 2HB PRO 91 4.555 13.135 7.365 587 HG3 PRO 91 2HG PRO 91 5.920 11.282 6.678 588 HD3 PRO 91 2HD PRO 91 4.376 10.709 8.413 589 H ALA 92 H ALA 92 1.299 10.435 5.302 590 HA ALA 92 HA ALA 92 0.622 12.081 2.978 591 HB1 ALA 92 1HB ALA 92 1.797 9.277 2.568 592 HB2 ALA 92 2HB ALA 92 1.571 10.586 1.377 593 HB3 ALA 92 3HB ALA 92 2.843 10.698 2.583 594 H THR 93 H THR 93 -1.223 10.995 1.759 595 HA THR 93 HA THR 93 -2.283 8.554 3.021 596 HB THR 93 HB THR 93 -4.606 9.309 2.734 597 HG1 THR 93 1HG THR 93 -4.344 10.980 1.363 598 HG21 THR 93 3HG2 THR 93 -4.843 10.703 4.718 599 HG22 THR 93 1HG2 THR 93 -3.104 11.074 4.711 600 HG23 THR 93 2HG2 THR 93 -3.668 9.408 4.994 601 HA PRO 94 HA PRO 94 -2.366 8.308 -1.625 602 HB3 PRO 94 2HB PRO 94 -0.135 8.315 -2.138 603 HG3 PRO 94 2HG PRO 94 1.534 7.979 -0.515 604 HD3 PRO 94 2HD PRO 94 0.096 9.563 0.380 605 H ILE 95 H ILE 95 -1.277 5.961 0.895 606 HA ILE 95 HA ILE 95 -2.761 3.783 -0.299 607 HB ILE 95 HB ILE 95 -1.460 3.729 2.414 608 HG13 ILE 95 2HG1 ILE 95 0.707 3.069 1.404 609 HG21 ILE 95 1HG2 ILE 95 -0.952 1.396 1.778 610 HG22 ILE 95 2HG2 ILE 95 -2.679 1.734 1.675 611 HG23 ILE 95 3HG2 ILE 95 -1.712 1.658 0.190 612 HD11 ILE 95 3HD1 ILE 95 0.016 2.846 -1.046 613 HD12 ILE 95 1HD1 ILE 95 -0.173 4.601 -1.075 614 HD13 ILE 95 2HD1 ILE 95 1.403 3.920 -0.746 615 H LYS 96 H LYS 96 -4.616 5.366 0.016 616 HA LYS 96 HA LYS 96 -6.459 4.103 1.975 617 HB3 LYS 96 2HB LYS 96 -7.393 6.745 1.517 618 HG3 LYS 96 2HG LYS 96 -6.672 7.191 3.909 619 HD3 LYS 96 2HD LYS 96 -8.147 4.582 3.395 620 HE3 LYS 96 2HE LYS 96 -8.084 6.497 5.753 621 HZ1 LYS 96 3HZ LYS 96 -9.722 4.766 6.613 622 HZ2 LYS 96 1HZ LYS 96 -10.081 4.446 5.060 623 HZ3 LYS 96 2HZ LYS 96 -10.297 5.958 5.607 624 H THR 97 H THR 97 -6.098 6.134 -1.025 625 HA THR 97 HA THR 97 -8.585 5.344 -2.007 626 HB THR 97 HB THR 97 -6.179 6.324 -3.587 627 HG1 THR 97 1HG THR 97 -7.264 8.440 -2.959 628 HG21 THR 97 3HG2 THR 97 -7.963 7.415 -4.940 629 HG22 THR 97 1HG2 THR 97 -9.188 6.683 -3.897 630 HG23 THR 97 2HG2 THR 97 -8.128 5.669 -4.904 631 H LEU 98 H LEU 98 -5.271 4.129 -2.978 632 HA LEU 98 HA LEU 98 -6.127 2.276 -4.850 633 HB3 LEU 98 2HB LEU 98 -3.768 1.814 -2.959 634 HG LEU 98 HG LEU 98 -2.586 0.994 -4.866 635 HD11 LEU 98 1HD1 LEU 98 -3.640 -1.027 -5.567 636 HD12 LEU 98 2HD1 LEU 98 -5.237 -0.389 -5.336 637 HD13 LEU 98 3HD1 LEU 98 -4.213 -0.716 -3.913 638 HD21 LEU 98 3HD2 LEU 98 -3.401 2.589 -6.516 639 HD22 LEU 98 1HD2 LEU 98 -4.933 1.685 -6.653 640 HD23 LEU 98 2HD2 LEU 98 -3.410 0.942 -7.150 641 H LEU 99 H LEU 99 -5.769 1.782 -1.339 642 HA LEU 99 HA LEU 99 -6.382 -0.869 -0.968 643 HB3 LEU 99 2HB LEU 99 -7.824 0.386 1.038 644 HG LEU 99 HG LEU 99 -4.824 0.009 0.801 645 HD11 LEU 99 1HD1 LEU 99 -4.707 0.434 3.243 646 HD12 LEU 99 2HD1 LEU 99 -6.417 0.927 3.219 647 HD13 LEU 99 3HD1 LEU 99 -5.219 1.873 2.349 648 HD21 LEU 99 3HD2 LEU 99 -6.016 -2.059 0.907 649 HD22 LEU 99 1HD2 LEU 99 -7.123 -1.462 2.167 650 HD23 LEU 99 2HD2 LEU 99 -5.442 -1.777 2.567 651 H ASP 100 H ASP 100 -8.716 1.725 -1.761 652 HA ASP 100 HA ASP 100 -11.061 0.055 -1.388 653 HB3 ASP 100 2HB ASP 100 -10.794 2.570 -3.044 654 H GLN 101 H GLN 101 -8.880 0.758 -4.111 655 HA GLN 101 HA GLN 101 -10.629 -0.343 -6.181 656 HB3 GLN 101 2HB GLN 101 -8.624 -0.336 -7.593 657 HG3 GLN 101 2HG GLN 101 -8.762 2.334 -6.164 658 HE21 GLN 101 1HE2 GLN 101 -7.173 3.475 -7.167 659 HE22 GLN 101 2HE2 GLN 101 -6.453 3.242 -8.725 660 H MET 102 H MET 102 -8.643 -1.684 -3.674 661 HA MET 102 HA MET 102 -8.185 -4.214 -5.087 662 HB3 MET 102 2HB MET 102 -7.141 -4.967 -3.025 663 HG3 MET 102 2HG MET 102 -6.324 -2.172 -3.870 664 HE1 MET 102 3HE MET 102 -5.186 -5.403 -1.645 665 HE2 MET 102 1HE MET 102 -4.419 -5.394 -3.241 666 HE3 MET 102 2HE MET 102 -3.444 -5.094 -1.792 667 H LYS 103 H LYS 103 -11.096 -3.125 -4.246 668 HA LYS 103 HA LYS 103 -12.058 -5.056 -2.421 669 HB3 LYS 103 2HB LYS 103 -14.351 -4.332 -3.591 670 HG3 LYS 103 2HG LYS 103 -14.111 -2.041 -2.464 671 HD3 LYS 103 2HD LYS 103 -13.608 -4.587 -0.863 672 HE3 LYS 103 2HE LYS 103 -13.068 -2.461 0.370 673 HZ1 LYS 103 3HZ LYS 103 -14.987 -1.171 -0.663 674 HZ2 LYS 103 1HZ LYS 103 -14.712 -0.962 0.907 675 HZ3 LYS 103 2HZ LYS 103 -15.967 -1.904 0.444 676 H ASN 104 H ASN 104 -10.960 -6.009 -5.481 677 HA ASN 104 HA ASN 104 -12.580 -8.463 -5.242 678 HB3 ASN 104 2HB ASN 104 -12.439 -8.704 -7.644 679 HD21 ASN 104 1HD2 ASN 104 -12.834 -5.251 -7.401 680 HD22 ASN 104 2HD2 ASN 104 -14.585 -5.193 -7.321 681 H TYR 105 H TYR 105 -9.934 -7.727 -4.017 682 HA TYR 105 HA TYR 105 -7.808 -8.682 -5.689 683 HB3 TYR 105 2HB TYR 105 -7.711 -7.109 -3.638 684 HD1 TYR 105 1HD TYR 105 -9.550 -7.657 -1.881 685 HD2 TYR 105 2HD TYR 105 -5.978 -9.912 -2.275 686 HE1 TYR 105 1HE TYR 105 -9.921 -8.600 0.408 687 HE2 TYR 105 2HE TYR 105 -6.270 -10.847 0.010 688 HH TYR 105 HH TYR 105 -8.017 -11.192 1.673 689 H ARG 106 H ARG 106 -6.510 -10.647 -5.456 690 HA ARG 106 HA ARG 106 -7.764 -12.989 -4.124 691 HB3 ARG 106 2HB ARG 106 -7.116 -14.220 -6.275 692 HG3 ARG 106 2HG ARG 106 -8.849 -12.933 -7.768 693 HD3 ARG 106 2HD ARG 106 -10.586 -13.818 -5.712 694 HE ARG 106 HE ARG 106 -10.612 -14.489 -8.119 695 HH11 ARG 106 1HH1 ARG 106 -9.387 -16.773 -5.650 696 HH12 ARG 106 2HH1 ARG 106 -9.498 -18.116 -6.730 697 HH21 ARG 106 1HH2 ARG 106 -11.020 -16.363 -9.357 698 HH22 ARG 106 2HH2 ARG 106 -10.896 -17.923 -8.661 699 H GLY 107 H GLY 107 -5.646 -11.586 -2.853 700 HA2 GLY 107 1HA GLY 107 -3.386 -13.339 -3.065 701 HA3 GLY 107 2HA GLY 107 -3.122 -11.808 -3.915 702 H GLU 108 H GLU 108 -1.375 -12.171 -1.886 703 HA GLU 108 HA GLU 108 -2.601 -11.315 0.687 704 HB3 GLU 108 2HB GLU 108 -0.130 -11.601 1.407 705 HG3 GLU 108 2HG GLU 108 -1.541 -14.070 0.279 706 H VAL 109 H VAL 109 -1.976 -9.298 1.741 707 HA VAL 109 HA VAL 109 -0.625 -7.424 -0.139 708 HB VAL 109 HB VAL 109 -2.441 -6.582 2.127 709 HG11 VAL 109 1HG1 VAL 109 -0.992 -4.845 1.209 710 HG12 VAL 109 2HG1 VAL 109 -1.445 -5.284 -0.449 711 HG13 VAL 109 3HG1 VAL 109 -2.643 -4.565 0.645 712 HG21 VAL 109 3HG2 VAL 109 -3.230 -7.210 -0.752 713 HG22 VAL 109 1HG2 VAL 109 -3.855 -8.004 0.699 714 HG23 VAL 109 2HG2 VAL 109 -4.236 -6.312 0.409 715 H ALA 110 H ALA 110 1.200 -6.505 0.360 716 HA ALA 110 HA ALA 110 2.175 -6.383 3.153 717 HB1 ALA 110 1HB ALA 110 3.584 -7.407 0.667 718 HB2 ALA 110 2HB ALA 110 4.489 -6.805 2.060 719 HB3 ALA 110 3HB ALA 110 3.416 -8.197 2.253 720 H SER 111 H SER 111 3.753 -4.655 3.413 721 HA SER 111 HA SER 111 3.630 -2.465 1.441 722 HB3 SER 111 2HB SER 111 1.670 -2.029 2.667 723 HG SER 111 HG SER 111 2.429 -3.376 4.575 724 H PHE 112 H PHE 112 5.523 -1.360 1.323 725 HA PHE 112 HA PHE 112 7.560 -2.046 3.337 726 HB3 PHE 112 2HB PHE 112 7.755 -3.588 1.487 727 HD1 PHE 112 2HD PHE 112 6.001 -2.507 -0.431 728 HD2 PHE 112 1HD PHE 112 10.296 -2.107 -0.235 729 HE1 PHE 112 2HE PHE 112 6.087 -1.995 -2.795 730 HE2 PHE 112 1HE PHE 112 10.349 -1.694 -2.647 731 HZ PHE 112 HZ PHE 112 8.230 -1.561 -3.958 732 H PHE 113 H PHE 113 8.094 -0.293 4.332 733 HA PHE 113 HA PHE 113 7.929 2.309 2.944 734 HB3 PHE 113 2HB PHE 113 6.807 2.473 4.950 735 HD1 PHE 113 1HD PHE 113 6.380 0.101 5.821 736 HD2 PHE 113 2HD PHE 113 9.684 2.555 7.132 737 HE1 PHE 113 1HE PHE 113 6.645 -1.305 7.825 738 HE2 PHE 113 2HE PHE 113 9.964 1.107 9.104 739 HZ PHE 113 HZ PHE 113 8.442 -0.853 9.449 740 H THR 114 H THR 114 9.656 3.845 3.225 741 HA THR 114 HA THR 114 12.360 2.667 2.912 742 HB THR 114 HB THR 114 12.555 4.414 1.071 743 HG1 THR 114 1HG THR 114 9.732 4.365 1.078 744 HG21 THR 114 3HG2 THR 114 11.473 3.077 -0.636 745 HG22 THR 114 1HG2 THR 114 10.420 2.289 0.568 746 HG23 THR 114 2HG2 THR 114 12.166 2.007 0.595 747 H SER 115 H SER 115 10.754 4.263 5.141 748 HA SER 115 HA SER 115 12.928 5.999 5.955 749 HB3 SER 115 2HB SER 115 11.416 7.963 6.098 750 HG SER 115 HG SER 115 12.329 6.906 3.812 751 H ALA 116 H ALA 116 12.958 5.790 8.187 752 HA ALA 116 HA ALA 116 10.504 4.850 9.597 753 HB1 ALA 116 1HB ALA 116 11.751 2.913 10.459 754 HB2 ALA 116 2HB ALA 116 11.737 2.884 8.686 755 HB3 ALA 116 3HB ALA 116 13.193 3.410 9.555 756 H GLY 117 H GLY 117 13.451 6.685 9.754 757 HA2 GLY 117 1HA GLY 117 14.748 6.034 11.861 758 HA3 GLY 117 2HA GLY 117 14.552 7.744 11.512 759 H THR 118 H THR 118 12.536 8.815 12.596 760 HA THR 118 HA THR 118 12.488 7.935 15.424 761 HB THR 118 HB THR 118 11.222 10.232 15.580 762 HG1 THR 118 1HG THR 118 11.123 11.333 13.854 763 HG21 THR 118 3HG2 THR 118 13.331 11.397 15.813 764 HG22 THR 118 1HG2 THR 118 14.180 10.152 14.857 765 HG23 THR 118 2HG2 THR 118 13.502 9.758 16.450 766 H ASN 119 H ASN 119 10.650 7.103 12.771 767 HA ASN 119 HA ASN 119 8.174 6.843 14.360 768 HB3 ASN 119 2HB ASN 119 7.353 7.981 11.845 769 HD21 ASN 119 1HD2 ASN 119 5.658 7.366 13.634 770 HD22 ASN 119 2HD2 ASN 119 5.231 8.686 14.728 771 H HIS 120 H HIS 120 9.325 4.705 14.117 772 HA HIS 120 HA HIS 120 8.719 3.318 11.576 773 HB3 HIS 120 2HB HIS 120 10.236 2.505 14.081 774 HD1 HIS 120 1HD HIS 120 11.883 0.384 13.613 775 HD2 HIS 120 2HD HIS 120 8.432 0.773 11.229 776 HE1 HIS 120 1HE HIS 120 11.392 -1.951 12.648 777 H LYS 121 H LYS 121 8.245 2.684 15.134 778 HA LYS 121 HA LYS 121 6.350 0.618 14.572 779 HB3 LYS 121 2HB LYS 121 5.684 0.816 16.972 780 HG3 LYS 121 2HG LYS 121 8.712 0.788 16.794 781 HD3 LYS 121 2HD LYS 121 6.709 -0.939 18.327 782 HE3 LYS 121 2HE LYS 121 8.664 -1.235 19.900 783 HZ1 LYS 121 3HZ LYS 121 9.674 -2.968 18.630 784 HZ2 LYS 121 1HZ LYS 121 9.087 -2.365 17.209 785 HZ3 LYS 121 2HZ LYS 121 8.071 -2.989 18.355 786 H ALA 122 H ALA 122 5.764 4.105 15.172 787 HA ALA 122 HA ALA 122 2.996 3.932 15.569 788 HB1 ALA 122 1HB ALA 122 4.183 6.235 13.989 789 HB2 ALA 122 2HB ALA 122 2.893 6.240 15.172 790 HB3 ALA 122 3HB ALA 122 4.567 6.021 15.706 791 H TYR 123 H TYR 123 4.802 4.096 12.472 792 HA TYR 123 HA TYR 123 2.698 4.391 10.694 793 HB3 TYR 123 2HB TYR 123 5.232 2.738 10.322 794 HD1 TYR 123 1HD TYR 123 3.649 5.409 8.229 795 HD2 TYR 123 2HD TYR 123 4.460 1.179 8.651 796 HE1 TYR 123 1HE TYR 123 2.909 5.026 5.905 797 HE2 TYR 123 2HE TYR 123 3.561 0.788 6.390 798 HH TYR 123 HH TYR 123 2.238 1.765 4.694 799 H VAL 124 H VAL 124 3.947 1.362 12.098 800 HA VAL 124 HA VAL 124 2.527 -0.501 10.537 801 HB VAL 124 HB VAL 124 3.229 -0.658 13.501 802 HG11 VAL 124 1HG1 VAL 124 2.792 -2.878 11.452 803 HG12 VAL 124 2HG1 VAL 124 3.368 -3.105 13.125 804 HG13 VAL 124 3HG1 VAL 124 1.749 -2.481 12.836 805 HG21 VAL 124 3HG2 VAL 124 5.344 -1.781 12.734 806 HG22 VAL 124 1HG2 VAL 124 4.919 -1.414 11.056 807 HG23 VAL 124 2HG2 VAL 124 5.277 -0.108 12.201 808 H SER 125 H SER 125 1.642 1.104 13.604 809 HA SER 125 HA SER 125 -0.879 -0.191 13.913 810 HB3 SER 125 2HB SER 125 -1.041 1.905 15.485 811 HG SER 125 HG SER 125 -0.554 0.260 16.634 812 H HIS 126 H HIS 126 0.115 3.117 12.804 813 HA HIS 126 HA HIS 126 -2.362 4.244 12.228 814 HB3 HIS 126 2HB HIS 126 -1.159 5.565 10.516 815 HD1 HIS 126 1HD HIS 126 1.680 6.645 11.346 816 HD2 HIS 126 2HD HIS 126 -1.486 5.608 13.938 817 HE1 HIS 126 1HE HIS 126 2.027 7.955 13.520 818 H PHE 127 H PHE 127 -0.319 2.194 10.087 819 HA PHE 127 HA PHE 127 -2.054 2.329 7.818 820 HB3 PHE 127 2HB PHE 127 0.060 0.321 8.667 821 HD1 PHE 127 2HD PHE 127 -1.733 1.590 5.554 822 HD2 PHE 127 1HD PHE 127 -0.053 -1.763 7.672 823 HE1 PHE 127 2HE PHE 127 -2.097 0.113 3.556 824 HE2 PHE 127 1HE PHE 127 -0.446 -3.211 5.689 825 HZ PHE 127 HZ PHE 127 -1.432 -2.256 3.637 826 H ASN 128 H ASN 128 -1.901 0.031 10.587 827 HA ASN 128 HA ASN 128 -3.678 -1.888 9.445 828 HB3 ASN 128 2HB ASN 128 -4.257 -2.281 11.999 829 HD21 ASN 128 1HD2 ASN 128 -0.756 -2.048 11.415 830 HD22 ASN 128 2HD2 ASN 128 -0.577 -3.724 10.912 831 H GLU 129 H GLU 129 -4.390 1.015 11.506 832 HA GLU 129 HA GLU 129 -7.195 0.724 11.445 833 HB3 GLU 129 2HB GLU 129 -7.341 3.005 11.992 834 HG3 GLU 129 2HG GLU 129 -5.798 3.486 13.676 835 H TRP 130 H TRP 130 -4.940 2.193 9.093 836 HA TRP 130 HA TRP 130 -7.090 3.375 7.568 837 HB3 TRP 130 2HB TRP 130 -5.212 3.994 6.039 838 HD1 TRP 130 HD TRP 130 -6.526 4.706 9.396 839 HE1 TRP 130 1HE TRP 130 -5.906 7.062 10.177 840 HE3 TRP 130 3HE TRP 130 -2.658 5.686 6.188 841 HZ2 TRP 130 2HZ TRP 130 -4.340 9.259 9.221 842 HZ3 TRP 130 3HZ TRP 130 -1.687 7.988 6.110 843 HH2 TRP 130 HH TRP 130 -2.592 9.790 7.559 844 H ALA 131 H ALA 131 -5.830 0.203 7.725 845 HA ALA 131 HA ALA 131 -6.609 -0.394 4.904 846 HB1 ALA 131 1HB ALA 131 -4.183 -0.503 5.437 847 HB2 ALA 131 2HB ALA 131 -4.525 -1.747 6.658 848 HB3 ALA 131 3HB ALA 131 -4.846 -2.074 4.944 849 H ASP 132 H ASP 132 -7.678 -0.915 7.949 850 HA ASP 132 HA ASP 132 -7.812 -3.442 8.619 851 HB3 ASP 132 2HB ASP 132 -10.058 -1.545 9.275 852 H GLY 133 H GLY 133 -8.551 -4.015 6.126 853 HA2 GLY 133 1HA GLY 133 -10.896 -5.671 6.408 854 HA3 GLY 133 2HA GLY 133 -11.234 -4.266 5.394 855 H LEU 134 H LEU 134 -8.081 -4.642 4.425 856 HA LEU 134 HA LEU 134 -8.567 -6.970 2.661 857 HB3 LEU 134 2HB LEU 134 -6.404 -5.967 1.692 858 HG LEU 134 HG LEU 134 -7.395 -3.774 0.942 859 HD11 LEU 134 1HD1 LEU 134 -7.356 -5.806 -0.498 860 HD12 LEU 134 2HD1 LEU 134 -8.864 -4.899 -0.781 861 HD13 LEU 134 3HD1 LEU 134 -8.877 -6.325 0.258 862 HD21 LEU 134 3HD2 LEU 134 -9.198 -3.395 2.498 863 HD22 LEU 134 1HD2 LEU 134 -10.058 -4.812 1.859 864 HD23 LEU 134 2HD2 LEU 134 -9.753 -3.418 0.819 865 H ASN 135 H ASN 135 -6.907 -8.663 2.702 866 HA ASN 135 HA ASN 135 -5.848 -9.298 5.290 867 HB3 ASN 135 2HB ASN 135 -5.262 -10.445 2.540 868 HD21 ASN 135 1HD2 ASN 135 -3.574 -11.741 2.530 869 HD22 ASN 135 2HD2 ASN 135 -2.830 -12.609 3.855 870 H VAL 136 H VAL 136 -4.279 -7.890 6.131 871 HA VAL 136 HA VAL 136 -1.880 -7.370 4.486 872 HB VAL 136 HB VAL 136 -2.563 -6.616 7.384 873 HG11 VAL 136 1HG1 VAL 136 -0.142 -6.724 7.145 874 HG12 VAL 136 2HG1 VAL 136 -0.208 -5.734 5.662 875 HG13 VAL 136 3HG1 VAL 136 -0.656 -5.045 7.245 876 HG21 VAL 136 3HG2 VAL 136 -2.866 -4.330 6.593 877 HG22 VAL 136 1HG2 VAL 136 -2.473 -4.820 4.932 878 HG23 VAL 136 2HG2 VAL 136 -3.970 -5.394 5.730 879 H ILE 137 H ILE 137 -0.078 -8.622 4.650 880 HA ILE 137 HA ILE 137 0.345 -10.158 7.163 881 HB ILE 137 HB ILE 137 1.362 -12.012 5.952 882 HG13 ILE 137 2HG1 ILE 137 0.446 -10.552 3.433 883 HG21 ILE 137 1HG2 ILE 137 -0.697 -13.036 5.171 884 HG22 ILE 137 2HG2 ILE 137 -0.975 -12.140 6.670 885 HG23 ILE 137 3HG2 ILE 137 -1.499 -11.459 5.118 886 HD11 ILE 137 3HD1 ILE 137 2.807 -10.239 3.731 887 HD12 ILE 137 1HD1 ILE 137 3.024 -11.922 4.286 888 HD13 ILE 137 2HD1 ILE 137 2.627 -11.601 2.598 889 H GLY 138 H GLY 138 1.496 -7.612 5.338 890 HA2 GLY 138 1HA GLY 138 4.160 -7.896 6.621 891 HA3 GLY 138 2HA GLY 138 4.033 -7.613 4.883 892 H VAL 139 H VAL 139 4.646 -6.092 7.681 893 HA VAL 139 HA VAL 139 4.463 -3.586 6.233 894 HB VAL 139 HB VAL 139 3.668 -3.572 9.190 895 HG11 VAL 139 1HG1 VAL 139 2.753 -1.298 8.505 896 HG12 VAL 139 2HG1 VAL 139 4.510 -1.455 8.388 897 HG13 VAL 139 3HG1 VAL 139 3.501 -1.542 6.921 898 HG21 VAL 139 3HG2 VAL 139 1.826 -4.767 8.080 899 HG22 VAL 139 1HG2 VAL 139 1.357 -3.176 8.662 900 HG23 VAL 139 2HG2 VAL 139 1.668 -3.423 6.926 901 H ALA 140 H ALA 140 6.759 -3.739 5.922 902 HA ALA 140 HA ALA 140 8.374 -3.343 8.327 903 HB1 ALA 140 1HB ALA 140 9.068 -5.613 6.411 904 HB2 ALA 140 2HB ALA 140 9.965 -5.114 7.841 905 HB3 ALA 140 3HB ALA 140 8.369 -5.837 8.027 906 H ARG 141 H ARG 141 10.478 -2.469 7.807 907 HA ARG 141 HA ARG 141 10.383 -0.770 5.459 908 HB3 ARG 141 2HB ARG 141 11.393 -0.289 7.859 909 HG3 ARG 141 2HG ARG 141 13.916 -1.075 6.396 910 HD3 ARG 141 2HD ARG 141 13.773 0.868 8.185 911 HE ARG 141 HE ARG 141 13.214 -1.452 9.796 912 HH11 ARG 141 1HH1 ARG 141 15.272 1.436 9.825 913 HH12 ARG 141 2HH1 ARG 141 15.463 1.502 11.530 914 HH21 ARG 141 1HH2 ARG 141 13.765 -1.644 11.973 915 HH22 ARG 141 2HH2 ARG 141 14.633 -0.378 12.817 916 H ASP 142 H ASP 142 12.162 -0.605 3.916 917 HA ASP 142 HA ASP 142 13.274 -1.463 2.122 918 HB3 ASP 142 2HB ASP 142 15.263 -2.913 2.693 919 H ASP 143 H ASP 143 14.318 -4.225 1.791 920 HA ASP 143 HA ASP 143 11.728 -5.596 1.269 921 HB3 ASP 143 2HB ASP 143 12.565 -4.874 -0.817 922 H SER 144 H SER 144 13.642 -5.709 3.563 923 HA SER 144 HA SER 144 15.224 -8.011 3.725 924 HB3 SER 144 2HB SER 144 13.627 -6.540 5.853 925 HG SER 144 HG SER 144 16.236 -7.454 6.296 926 H GLU 145 H GLU 145 11.704 -7.738 3.781 927 HA GLU 145 HA GLU 145 11.469 -10.525 4.837 928 HB3 GLU 145 2HB GLU 145 9.259 -9.788 5.586 929 HG3 GLU 145 2HG GLU 145 10.970 -7.580 6.668 930 H VAL 146 H VAL 146 11.555 -9.221 1.833 931 HA VAL 146 HA VAL 146 9.117 -10.138 0.639 932 HB VAL 146 HB VAL 146 11.966 -9.950 -0.415 933 HG11 VAL 146 1HG1 VAL 146 9.425 -10.493 -2.012 934 HG12 VAL 146 2HG1 VAL 146 11.019 -10.088 -2.700 935 HG13 VAL 146 3HG1 VAL 146 10.802 -11.600 -1.824 936 HG21 VAL 146 3HG2 VAL 146 11.119 -7.943 -1.539 937 HG22 VAL 146 1HG2 VAL 146 9.488 -8.222 -0.894 938 HG23 VAL 146 2HG2 VAL 146 10.824 -7.802 0.194 939 H ASP 147 H ASP 147 11.903 -11.802 1.865 940 HA ASP 147 HA ASP 147 11.620 -14.424 0.926 941 HB3 ASP 147 2HB ASP 147 12.550 -14.352 3.676 942 H LYS 148 H LYS 148 9.412 -12.766 3.006 943 HA LYS 148 HA LYS 148 8.099 -15.354 3.724 944 HB3 LYS 148 2HB LYS 148 9.212 -14.610 5.706 945 HG3 LYS 148 2HG LYS 148 7.964 -11.893 5.214 946 HD3 LYS 148 2HD LYS 148 9.488 -11.524 7.377 947 HE3 LYS 148 2HE LYS 148 6.664 -12.519 7.852 948 HZ1 LYS 148 3HZ LYS 148 7.942 -11.377 9.632 949 HZ2 LYS 148 1HZ LYS 148 6.596 -10.489 9.160 950 HZ3 LYS 148 2HZ LYS 148 8.087 -10.045 8.672 951 H TRP 149 H TRP 149 7.840 -12.576 1.986 952 HA TRP 149 HA TRP 149 4.861 -12.635 2.026 953 HB3 TRP 149 2HB TRP 149 4.993 -10.450 0.999 954 HD1 TRP 149 HD TRP 149 5.171 -11.382 4.197 955 HE1 TRP 149 1HE TRP 149 5.849 -9.601 5.868 956 HE3 TRP 149 3HE TRP 149 7.592 -8.213 1.020 957 HZ2 TRP 149 2HZ TRP 149 7.269 -7.072 5.848 958 HZ3 TRP 149 3HZ TRP 149 8.568 -6.090 1.841 959 HH2 TRP 149 HH TRP 149 8.387 -5.484 4.265 960 H SER 150 H SER 150 6.326 -14.769 0.781 961 HA SER 150 HA SER 150 5.156 -14.692 -1.820 962 HB3 SER 150 2HB SER 150 8.203 -14.666 -1.880 963 HG SER 150 HG SER 150 7.631 -15.556 -3.738 964 H LYS 151 H LYS 151 7.191 -16.401 0.534 965 HA LYS 151 HA LYS 151 7.753 -18.722 -0.972 966 HB3 LYS 151 2HB LYS 151 7.972 -19.768 1.385 967 HG3 LYS 151 2HG LYS 151 9.494 -17.197 0.923 968 HD3 LYS 151 2HD LYS 151 10.387 -19.878 2.091 969 HE3 LYS 151 2HE LYS 151 11.681 -17.182 1.595 970 HZ1 LYS 151 3HZ LYS 151 12.936 -19.229 3.279 971 HZ2 LYS 151 1HZ LYS 151 12.118 -17.908 3.880 972 HZ3 LYS 151 2HZ LYS 151 13.408 -17.681 2.927 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -2.529 -27.050 -10.610 2 HA2 GLY 1 1HA GLY 1 0.352 -26.515 -11.127 3 HA3 GLY 1 2HA GLY 1 -0.991 -25.674 -11.946 4 H MET 2 H MET 2 0.804 -24.104 -10.687 5 HA MET 2 HA MET 2 -1.021 -22.642 -9.057 6 HB3 MET 2 2HB MET 2 1.509 -22.372 -7.703 7 HG3 MET 2 2HG MET 2 -1.113 -23.547 -6.716 8 HE1 MET 2 3HE MET 2 -1.753 -22.971 -4.054 9 HE2 MET 2 1HE MET 2 -0.599 -22.128 -2.994 10 HE3 MET 2 2HE MET 2 -1.280 -21.292 -4.402 11 H ALA 3 H ALA 3 -0.426 -20.360 -9.154 12 HA ALA 3 HA ALA 3 2.146 -19.644 -10.287 13 HB1 ALA 3 1HB ALA 3 1.250 -18.224 -12.024 14 HB2 ALA 3 2HB ALA 3 0.979 -19.941 -12.371 15 HB3 ALA 3 3HB ALA 3 -0.378 -18.916 -11.805 16 H LYS 4 H LYS 4 2.490 -18.691 -8.460 17 HA LYS 4 HA LYS 4 0.644 -16.699 -7.292 18 HB3 LYS 4 2HB LYS 4 2.294 -16.474 -5.518 19 HG3 LYS 4 2HG LYS 4 1.807 -19.439 -6.159 20 HD3 LYS 4 2HD LYS 4 1.615 -19.415 -3.594 21 HE3 LYS 4 2HE LYS 4 4.085 -19.377 -5.221 22 HZ1 LYS 4 3HZ LYS 4 4.201 -18.596 -2.382 23 HZ2 LYS 4 1HZ LYS 4 4.981 -17.907 -3.651 24 HZ3 LYS 4 2HZ LYS 4 5.444 -19.365 -3.098 25 H LYS 5 H LYS 5 0.609 -15.190 -9.013 26 HA LYS 5 HA LYS 5 3.018 -13.845 -9.936 27 HB3 LYS 5 2HB LYS 5 1.618 -12.098 -10.811 28 HG3 LYS 5 2HG LYS 5 1.517 -14.488 -11.793 29 HD3 LYS 5 2HD LYS 5 -1.443 -14.001 -11.565 30 HE3 LYS 5 2HE LYS 5 -1.538 -16.427 -11.854 31 HZ1 LYS 5 3HZ LYS 5 0.353 -15.261 -13.827 32 HZ2 LYS 5 1HZ LYS 5 -1.275 -15.057 -13.854 33 HZ3 LYS 5 2HZ LYS 5 -0.629 -16.550 -14.057 34 H THR 6 H THR 6 3.075 -11.450 -9.589 35 HA THR 6 HA THR 6 2.235 -10.505 -6.956 36 HB THR 6 HB THR 6 5.177 -10.799 -7.635 37 HG1 THR 6 1HG THR 6 3.505 -12.326 -6.372 38 HG21 THR 6 3HG2 THR 6 3.858 -9.163 -5.444 39 HG22 THR 6 1HG2 THR 6 5.086 -8.649 -6.611 40 HG23 THR 6 2HG2 THR 6 5.517 -9.767 -5.313 41 H LEU 7 H LEU 7 2.184 -8.135 -6.832 42 HA LEU 7 HA LEU 7 3.127 -6.727 -9.275 43 HB3 LEU 7 2HB LEU 7 0.785 -5.513 -7.909 44 HG LEU 7 HG LEU 7 0.987 -6.283 -10.829 45 HD11 LEU 7 1HD1 LEU 7 -1.185 -5.481 -9.872 46 HD12 LEU 7 2HD1 LEU 7 -0.552 -4.447 -11.172 47 HD13 LEU 7 3HD1 LEU 7 -0.400 -3.929 -9.462 48 HD21 LEU 7 3HD2 LEU 7 1.855 -4.171 -11.494 49 HD22 LEU 7 1HD2 LEU 7 3.027 -4.944 -10.479 50 HD23 LEU 7 2HD2 LEU 7 2.045 -3.606 -9.817 51 H ILE 8 H ILE 8 4.395 -5.064 -8.769 52 HA ILE 8 HA ILE 8 4.500 -3.994 -5.993 53 HB ILE 8 HB ILE 8 6.599 -3.810 -8.189 54 HG13 ILE 8 2HG1 ILE 8 6.488 -5.502 -5.656 55 HG21 ILE 8 1HG2 ILE 8 8.018 -2.773 -6.461 56 HG22 ILE 8 2HG2 ILE 8 6.559 -1.813 -6.688 57 HG23 ILE 8 3HG2 ILE 8 6.699 -2.886 -5.282 58 HD11 ILE 8 3HD1 ILE 8 7.507 -7.246 -7.112 59 HD12 ILE 8 1HD1 ILE 8 5.902 -6.791 -7.683 60 HD13 ILE 8 2HD1 ILE 8 7.346 -6.154 -8.504 61 H LEU 9 H LEU 9 2.931 -2.499 -5.891 62 HA LEU 9 HA LEU 9 2.572 -0.510 -8.077 63 HB3 LEU 9 2HB LEU 9 0.998 0.484 -6.239 64 HG LEU 9 HG LEU 9 -0.839 -1.139 -6.431 65 HD11 LEU 9 1HD1 LEU 9 -1.135 0.012 -8.328 66 HD12 LEU 9 2HD1 LEU 9 -0.331 -1.346 -9.175 67 HD13 LEU 9 3HD1 LEU 9 0.570 0.067 -8.642 68 HD21 LEU 9 3HD2 LEU 9 0.984 -3.025 -7.872 69 HD22 LEU 9 1HD2 LEU 9 -0.712 -3.249 -7.373 70 HD23 LEU 9 2HD2 LEU 9 0.573 -3.171 -6.163 71 H TYR 10 H TYR 10 3.370 1.631 -7.797 72 HA TYR 10 HA TYR 10 4.003 2.604 -5.136 73 HB3 TYR 10 2HB TYR 10 6.232 1.992 -5.689 74 HD1 TYR 10 1HD TYR 10 6.100 4.539 -8.376 75 HD2 TYR 10 2HD TYR 10 6.552 0.359 -7.473 76 HE1 TYR 10 1HE TYR 10 6.861 4.140 -10.693 77 HE2 TYR 10 2HE TYR 10 7.334 -0.060 -9.784 78 HH TYR 10 HH TYR 10 7.418 2.479 -12.289 79 H TYR 11 H TYR 11 3.698 4.985 -5.121 80 HA TYR 11 HA TYR 11 2.068 5.890 -7.454 81 HB3 TYR 11 2HB TYR 11 1.901 6.881 -4.628 82 HD1 TYR 11 1HD TYR 11 1.117 8.307 -7.522 83 HD2 TYR 11 2HD TYR 11 -1.022 6.301 -4.349 84 HE1 TYR 11 1HE TYR 11 -0.690 9.899 -7.711 85 HE2 TYR 11 2HE TYR 11 -2.830 7.961 -4.509 86 HH TYR 11 HH TYR 11 -3.690 9.822 -5.882 87 H SER 12 H SER 12 4.543 6.121 -8.077 88 HA SER 12 HA SER 12 5.032 8.906 -8.386 89 HB3 SER 12 2HB SER 12 6.051 8.675 -6.168 90 HG SER 12 HG SER 12 6.625 6.638 -5.939 91 H TRP 13 H TRP 13 7.584 8.765 -9.445 92 HA TRP 13 HA TRP 13 7.576 6.487 -11.372 93 HB3 TRP 13 2HB TRP 13 9.171 8.084 -12.621 94 HD1 TRP 13 HD TRP 13 5.624 7.280 -12.270 95 HE1 TRP 13 1HE TRP 13 4.395 7.845 -14.398 96 HE3 TRP 13 3HE TRP 13 9.058 10.458 -14.351 97 HZ2 TRP 13 2HZ TRP 13 4.784 9.499 -16.706 98 HZ3 TRP 13 3HZ TRP 13 8.586 11.504 -16.585 99 HH2 TRP 13 HH TRP 13 6.474 11.008 -17.770 100 H SER 14 H SER 14 10.139 8.747 -10.338 101 HA SER 14 HA SER 14 11.822 6.414 -9.615 102 HB3 SER 14 2HB SER 14 13.251 6.910 -11.532 103 HG SER 14 HG SER 14 11.233 5.681 -11.899 104 H GLY 15 H GLY 15 11.173 8.425 -7.725 105 HA2 GLY 15 1HA GLY 15 13.922 9.338 -7.253 106 HA3 GLY 15 2HA GLY 15 12.780 10.646 -7.479 107 H GLU 16 H GLU 16 10.874 8.435 -5.884 108 HA GLU 16 HA GLU 16 11.895 9.286 -3.213 109 HB3 GLU 16 2HB GLU 16 9.922 10.394 -3.275 110 HG3 GLU 16 2HG GLU 16 8.706 8.050 -4.738 111 H THR 17 H THR 17 9.713 6.643 -4.435 112 HA THR 17 HA THR 17 11.002 4.689 -2.694 113 HB THR 17 HB THR 17 9.329 3.192 -4.061 114 HG1 THR 17 1HG THR 17 8.771 4.622 -5.723 115 HG21 THR 17 3HG2 THR 17 8.314 5.446 -2.281 116 HG22 THR 17 1HG2 THR 17 9.018 3.900 -1.747 117 HG23 THR 17 2HG2 THR 17 7.479 3.914 -2.638 118 H LYS 18 H LYS 18 12.152 6.060 -5.461 119 HA LYS 18 HA LYS 18 12.662 3.830 -7.093 120 HB3 LYS 18 2HB LYS 18 14.331 6.342 -6.711 121 HG3 LYS 18 2HG LYS 18 14.439 4.337 -9.017 122 HD3 LYS 18 2HD LYS 18 15.437 7.159 -8.664 123 HE3 LYS 18 2HE LYS 18 17.484 5.844 -9.047 124 HZ1 LYS 18 3HZ LYS 18 17.728 4.983 -11.330 125 HZ2 LYS 18 1HZ LYS 18 16.124 5.021 -11.542 126 HZ3 LYS 18 2HZ LYS 18 16.797 4.014 -10.390 127 H LYS 19 H LYS 19 14.695 2.699 -7.447 128 HA LYS 19 HA LYS 19 16.051 1.189 -6.956 129 HB3 LYS 19 2HB LYS 19 17.032 1.853 -4.276 130 HG3 LYS 19 2HG LYS 19 19.108 2.430 -5.532 131 HD3 LYS 19 2HD LYS 19 17.685 -0.167 -6.274 132 HE3 LYS 19 2HE LYS 19 19.172 0.553 -8.106 133 HZ1 LYS 19 3HZ LYS 19 21.584 0.419 -7.531 134 HZ2 LYS 19 1HZ LYS 19 21.199 0.498 -5.929 135 HZ3 LYS 19 2HZ LYS 19 20.860 1.757 -6.907 136 H MET 20 H MET 20 14.297 2.087 -3.951 137 HA MET 20 HA MET 20 14.126 -0.642 -3.041 138 HB3 MET 20 2HB MET 20 12.914 0.526 -1.162 139 HG3 MET 20 2HG MET 20 14.846 2.428 -0.923 140 HE1 MET 20 3HE MET 20 14.366 -1.547 -0.915 141 HE2 MET 20 1HE MET 20 16.038 -1.308 -1.451 142 HE3 MET 20 2HE MET 20 15.712 -2.014 0.134 143 H ALA 21 H ALA 21 12.871 -0.277 -5.565 144 HA ALA 21 HA ALA 21 10.167 -1.104 -4.940 145 HB1 ALA 21 1HB ALA 21 9.728 1.253 -5.391 146 HB2 ALA 21 2HB ALA 21 10.665 1.192 -6.899 147 HB3 ALA 21 3HB ALA 21 9.143 0.285 -6.757 148 H GLU 22 H GLU 22 12.437 -0.208 -7.625 149 HA GLU 22 HA GLU 22 11.772 -2.293 -9.433 150 HB3 GLU 22 2HB GLU 22 14.219 -1.991 -10.170 151 HG3 GLU 22 2HG GLU 22 13.964 0.630 -10.460 152 H LYS 23 H LYS 23 14.057 -2.325 -6.594 153 HA LYS 23 HA LYS 23 15.373 -4.677 -7.313 154 HB3 LYS 23 2HB LYS 23 14.876 -4.433 -4.403 155 HG3 LYS 23 2HG LYS 23 16.811 -5.583 -5.858 156 HD3 LYS 23 2HD LYS 23 18.804 -4.211 -5.241 157 HE3 LYS 23 2HE LYS 23 18.705 -2.525 -7.088 158 HZ1 LYS 23 3HZ LYS 23 18.244 -4.100 -8.879 159 HZ2 LYS 23 1HZ LYS 23 17.532 -5.140 -7.834 160 HZ3 LYS 23 2HZ LYS 23 19.113 -4.839 -7.706 161 H ILE 24 H ILE 24 12.562 -4.361 -5.159 162 HA ILE 24 HA ILE 24 12.023 -7.012 -4.627 163 HB ILE 24 HB ILE 24 10.096 -4.685 -5.080 164 HG13 ILE 24 2HG1 ILE 24 12.009 -4.903 -3.091 165 HG21 ILE 24 1HG2 ILE 24 8.833 -6.832 -5.118 166 HG22 ILE 24 2HG2 ILE 24 9.656 -7.343 -3.635 167 HG23 ILE 24 3HG2 ILE 24 8.552 -5.960 -3.598 168 HD11 ILE 24 3HD1 ILE 24 9.205 -3.767 -2.679 169 HD12 ILE 24 1HD1 ILE 24 10.672 -3.310 -1.793 170 HD13 ILE 24 2HD1 ILE 24 10.521 -2.911 -3.515 171 H ASN 25 H ASN 25 11.034 -5.164 -7.565 172 HA ASN 25 HA ASN 25 9.380 -7.188 -8.657 173 HB3 ASN 25 2HB ASN 25 11.075 -5.120 -10.129 174 HD21 ASN 25 1HD2 ASN 25 7.892 -6.949 -10.371 175 HD22 ASN 25 2HD2 ASN 25 8.275 -7.491 -11.972 176 H SER 26 H SER 26 12.882 -6.776 -8.902 177 HA SER 26 HA SER 26 13.262 -9.057 -10.631 178 HB3 SER 26 2HB SER 26 15.681 -8.082 -9.771 179 HG SER 26 HG SER 26 14.113 -7.131 -11.946 180 H GLU 27 H GLU 27 12.902 -8.764 -7.224 181 HA GLU 27 HA GLU 27 14.768 -11.041 -6.674 182 HB3 GLU 27 2HB GLU 27 14.656 -10.359 -4.318 183 HG3 GLU 27 2HG GLU 27 15.293 -7.690 -4.991 184 H ILE 28 H ILE 28 11.664 -10.551 -7.539 185 HA ILE 28 HA ILE 28 10.610 -12.881 -6.000 186 HB ILE 28 HB ILE 28 9.164 -10.427 -7.067 187 HG13 ILE 28 2HG1 ILE 28 10.302 -10.049 -4.916 188 HG21 ILE 28 1HG2 ILE 28 7.922 -12.877 -5.774 189 HG22 ILE 28 2HG2 ILE 28 7.068 -11.382 -6.159 190 HG23 ILE 28 3HG2 ILE 28 7.691 -12.321 -7.461 191 HD11 ILE 28 3HD1 ILE 28 7.902 -9.173 -5.224 192 HD12 ILE 28 1HD1 ILE 28 7.420 -10.526 -4.151 193 HD13 ILE 28 2HD1 ILE 28 8.511 -9.285 -3.569 194 H LYS 29 H LYS 29 9.108 -14.206 -7.297 195 HA LYS 29 HA LYS 29 9.933 -14.416 -10.141 196 HB3 LYS 29 2HB LYS 29 8.158 -16.518 -9.036 197 HG3 LYS 29 2HG LYS 29 9.623 -16.749 -11.088 198 HD3 LYS 29 2HD LYS 29 11.825 -16.921 -8.965 199 HE3 LYS 29 2HE LYS 29 11.791 -17.527 -11.952 200 HZ1 LYS 29 3HZ LYS 29 13.766 -16.277 -11.309 201 HZ2 LYS 29 1HZ LYS 29 14.139 -17.835 -11.712 202 HZ3 LYS 29 2HZ LYS 29 14.102 -17.345 -10.128 203 H ASP 30 H ASP 30 8.539 -13.839 -11.695 204 HA ASP 30 HA ASP 30 6.695 -13.406 -12.864 205 HB3 ASP 30 2HB ASP 30 4.863 -14.811 -10.951 206 H SER 31 H SER 31 7.647 -11.584 -10.696 207 HA SER 31 HA SER 31 5.358 -10.124 -9.819 208 HB3 SER 31 2HB SER 31 7.017 -9.809 -8.329 209 HG SER 31 HG SER 31 9.352 -9.792 -9.743 210 H GLU 32 H GLU 32 4.453 -8.451 -10.902 211 HA GLU 32 HA GLU 32 5.950 -7.087 -13.121 212 HB3 GLU 32 2HB GLU 32 3.602 -5.901 -13.272 213 HG3 GLU 32 2HG GLU 32 4.713 -7.452 -14.953 214 H LEU 33 H LEU 33 5.755 -4.563 -12.939 215 HA LEU 33 HA LEU 33 5.159 -3.599 -10.301 216 HB3 LEU 33 2HB LEU 33 7.648 -3.900 -10.571 217 HG LEU 33 HG LEU 33 7.430 -1.478 -12.437 218 HD11 LEU 33 1HD1 LEU 33 9.171 -1.297 -10.672 219 HD12 LEU 33 2HD1 LEU 33 9.869 -1.439 -12.289 220 HD13 LEU 33 3HD1 LEU 33 9.866 -2.846 -11.209 221 HD21 LEU 33 3HD2 LEU 33 8.588 -4.254 -12.959 222 HD22 LEU 33 1HD2 LEU 33 8.879 -2.839 -13.992 223 HD23 LEU 33 2HD2 LEU 33 7.249 -3.479 -13.810 224 H LYS 34 H LYS 34 4.553 -1.250 -10.388 225 HA LYS 34 HA LYS 34 3.716 -0.239 -13.040 226 HB3 LYS 34 2HB LYS 34 2.243 -2.171 -12.211 227 HG3 LYS 34 2HG LYS 34 1.672 -1.015 -10.090 228 HD3 LYS 34 2HD LYS 34 0.826 0.971 -12.133 229 HE3 LYS 34 2HE LYS 34 -1.411 -0.316 -10.665 230 HZ1 LYS 34 3HZ LYS 34 -1.185 2.442 -11.671 231 HZ2 LYS 34 1HZ LYS 34 -1.425 1.971 -10.108 232 HZ3 LYS 34 2HZ LYS 34 -2.612 1.683 -11.177 233 H GLU 35 H GLU 35 2.946 1.953 -12.912 234 HA GLU 35 HA GLU 35 3.431 3.379 -10.360 235 HB3 GLU 35 2HB GLU 35 4.516 4.205 -12.433 236 HG3 GLU 35 2HG GLU 35 1.744 5.205 -13.219 237 H VAL 36 H VAL 36 1.735 4.145 -9.145 238 HA VAL 36 HA VAL 36 -1.054 4.052 -10.152 239 HB VAL 36 HB VAL 36 0.095 5.065 -7.521 240 HG11 VAL 36 1HG1 VAL 36 -2.009 6.176 -8.056 241 HG12 VAL 36 2HG1 VAL 36 -2.779 4.623 -8.432 242 HG13 VAL 36 3HG1 VAL 36 -2.271 5.007 -6.768 243 HG21 VAL 36 3HG2 VAL 36 -0.866 3.044 -6.513 244 HG22 VAL 36 1HG2 VAL 36 -1.315 2.439 -8.122 245 HG23 VAL 36 2HG2 VAL 36 0.402 2.642 -7.662 246 H LYS 37 H LYS 37 -1.862 6.103 -11.198 247 HA LYS 37 HA LYS 37 0.059 8.378 -11.173 248 HB3 LYS 37 2HB LYS 37 -1.063 9.107 -13.167 249 HG3 LYS 37 2HG LYS 37 -0.860 6.086 -13.564 250 HD3 LYS 37 2HD LYS 37 -0.246 8.426 -15.393 251 HE3 LYS 37 2HE LYS 37 -0.856 5.586 -16.214 252 HZ1 LYS 37 3HZ LYS 37 -0.056 6.284 -18.264 253 HZ2 LYS 37 1HZ LYS 37 0.789 7.556 -17.647 254 HZ3 LYS 37 2HZ LYS 37 -0.851 7.610 -17.783 255 H VAL 38 H VAL 38 -1.101 10.574 -11.132 256 HA VAL 38 HA VAL 38 -3.395 10.616 -9.255 257 HB VAL 38 HB VAL 38 -3.184 13.093 -9.445 258 HG11 VAL 38 1HG1 VAL 38 -2.151 11.792 -7.724 259 HG12 VAL 38 2HG1 VAL 38 -0.612 11.767 -8.664 260 HG13 VAL 38 3HG1 VAL 38 -1.276 13.297 -8.068 261 HG21 VAL 38 3HG2 VAL 38 -1.288 14.176 -10.445 262 HG22 VAL 38 1HG2 VAL 38 -0.623 12.647 -11.004 263 HG23 VAL 38 2HG2 VAL 38 -2.130 13.271 -11.708 264 H SER 39 H SER 39 -5.203 12.116 -9.819 265 HA SER 39 HA SER 39 -5.347 13.060 -12.477 266 HB3 SER 39 2HB SER 39 -8.068 12.682 -11.494 267 HG SER 39 HG SER 39 -8.411 12.016 -13.538 268 H GLU 40 H GLU 40 -7.456 14.905 -11.903 269 HA GLU 40 HA GLU 40 -6.103 16.756 -10.255 270 HB3 GLU 40 2HB GLU 40 -7.333 17.823 -11.784 271 HG3 GLU 40 2HG GLU 40 -9.966 17.332 -11.870 272 H GLY 41 H GLY 41 -7.237 18.071 -8.487 273 HA2 GLY 41 1HA GLY 41 -8.871 16.691 -6.615 274 HA3 GLY 41 2HA GLY 41 -7.185 16.710 -6.064 275 H THR 42 H THR 42 -6.405 18.647 -5.179 276 HA THR 42 HA THR 42 -7.966 21.130 -5.530 277 HB THR 42 HB THR 42 -6.919 20.397 -2.793 278 HG1 THR 42 1HG THR 42 -8.175 18.752 -2.868 279 HG21 THR 42 3HG2 THR 42 -9.308 22.049 -3.706 280 HG22 THR 42 1HG2 THR 42 -7.721 22.686 -3.202 281 HG23 THR 42 2HG2 THR 42 -8.733 21.854 -2.032 282 H PHE 43 H PHE 43 -6.628 22.992 -5.392 283 HA PHE 43 HA PHE 43 -4.843 24.171 -5.908 284 HB3 PHE 43 2HB PHE 43 -2.955 24.102 -4.302 285 HD1 PHE 43 1HD PHE 43 -4.315 26.275 -4.238 286 HD2 PHE 43 2HD PHE 43 -5.352 22.772 -1.941 287 HE1 PHE 43 1HE PHE 43 -5.681 27.674 -2.704 288 HE2 PHE 43 2HE PHE 43 -6.738 24.165 -0.440 289 HZ PHE 43 HZ PHE 43 -6.905 26.605 -0.805 290 H ASP 44 H ASP 44 -4.922 22.885 -7.958 291 HA ASP 44 HA ASP 44 -2.727 21.118 -8.591 292 HB3 ASP 44 2HB ASP 44 -4.800 21.218 -9.938 293 H ALA 45 H ALA 45 -1.003 21.777 -10.122 294 HA ALA 45 HA ALA 45 -0.137 24.575 -10.063 295 HB1 ALA 45 1HB ALA 45 2.015 23.911 -8.869 296 HB2 ALA 45 2HB ALA 45 0.557 23.958 -7.864 297 HB3 ALA 45 3HB ALA 45 1.193 22.401 -8.429 298 H ASP 46 H ASP 46 -0.608 23.845 -12.312 299 HA ASP 46 HA ASP 46 0.080 23.526 -14.415 300 HB3 ASP 46 2HB ASP 46 2.914 22.771 -13.772 301 H MET 47 H MET 47 2.097 21.068 -12.756 302 HA MET 47 HA MET 47 0.233 18.993 -12.928 303 HB3 MET 47 2HB MET 47 0.652 18.947 -15.341 304 HG3 MET 47 2HG MET 47 3.576 18.432 -14.676 305 HE1 MET 47 3HE MET 47 2.036 19.291 -18.945 306 HE2 MET 47 1HE MET 47 0.896 19.284 -17.586 307 HE3 MET 47 2HE MET 47 2.224 20.468 -17.629 308 H TYR 48 H TYR 48 1.283 16.931 -12.164 309 HA TYR 48 HA TYR 48 2.487 15.802 -10.665 310 HB3 TYR 48 2HB TYR 48 5.009 16.888 -11.902 311 HD1 TYR 48 1HD TYR 48 3.073 13.709 -12.236 312 HD2 TYR 48 2HD TYR 48 6.540 15.583 -10.503 313 HE1 TYR 48 1HE TYR 48 3.898 11.522 -11.580 314 HE2 TYR 48 2HE TYR 48 7.386 13.366 -9.790 315 HH TYR 48 HH TYR 48 5.485 10.361 -10.497 316 H LYS 49 H LYS 49 1.639 18.203 -9.465 317 HA LYS 49 HA LYS 49 3.646 18.448 -7.373 318 HB3 LYS 49 2HB LYS 49 2.974 21.194 -8.270 319 HG3 LYS 49 2HG LYS 49 5.420 19.546 -7.595 320 HD3 LYS 49 2HD LYS 49 5.506 22.353 -8.759 321 HE3 LYS 49 2HE LYS 49 7.538 20.242 -7.899 322 HZ1 LYS 49 3HZ LYS 49 8.009 21.436 -10.033 323 HZ2 LYS 49 1HZ LYS 49 9.177 21.551 -8.908 324 HZ3 LYS 49 2HZ LYS 49 8.135 22.815 -9.182 325 H THR 50 H THR 50 1.556 17.196 -6.949 326 HA THR 50 HA THR 50 -0.189 18.782 -5.221 327 HB THR 50 HB THR 50 -1.337 17.350 -7.663 328 HG1 THR 50 1HG THR 50 -0.737 20.036 -7.202 329 HG21 THR 50 3HG2 THR 50 -3.460 18.421 -7.027 330 HG22 THR 50 1HG2 THR 50 -2.686 19.169 -5.612 331 HG23 THR 50 2HG2 THR 50 -2.884 17.405 -5.703 332 H SER 51 H SER 51 1.063 17.314 -3.802 333 HA SER 51 HA SER 51 -0.203 14.701 -3.488 334 HB3 SER 51 2HB SER 51 1.838 13.400 -3.557 335 HG SER 51 HG SER 51 0.615 14.306 -5.572 336 H ASP 52 H ASP 52 0.134 17.305 -1.986 337 HA ASP 52 HA ASP 52 0.215 17.989 0.111 338 HB3 ASP 52 2HB ASP 52 -0.373 16.528 1.858 339 H ILE 53 H ILE 53 1.561 17.301 2.474 340 HA ILE 53 HA ILE 53 4.416 17.072 1.689 341 HB ILE 53 HB ILE 53 3.263 19.241 3.460 342 HG13 ILE 53 2HG1 ILE 53 4.053 20.852 1.918 343 HG21 ILE 53 1HG2 ILE 53 5.658 20.050 3.595 344 HG22 ILE 53 2HG2 ILE 53 5.341 18.557 4.472 345 HG23 ILE 53 3HG2 ILE 53 6.167 18.488 2.903 346 HD11 ILE 53 3HD1 ILE 53 5.147 18.597 0.172 347 HD12 ILE 53 1HD1 ILE 53 4.969 20.286 -0.319 348 HD13 ILE 53 2HD1 ILE 53 6.098 19.862 0.973 349 H ALA 54 H ALA 54 2.547 17.542 4.787 350 HA ALA 54 HA ALA 54 3.554 14.990 5.746 351 HB1 ALA 54 1HB ALA 54 5.594 16.461 5.895 352 HB2 ALA 54 2HB ALA 54 4.708 17.515 7.008 353 HB3 ALA 54 3HB ALA 54 5.048 15.821 7.444 354 H LEU 55 H LEU 55 2.394 18.211 7.098 355 HA LEU 55 HA LEU 55 0.714 16.903 9.100 356 HB3 LEU 55 2HB LEU 55 0.073 19.678 8.720 357 HG LEU 55 HG LEU 55 1.843 20.205 10.341 358 HD11 LEU 55 1HD1 LEU 55 -0.079 17.962 11.157 359 HD12 LEU 55 2HD1 LEU 55 -0.497 19.685 11.001 360 HD13 LEU 55 3HD1 LEU 55 0.638 19.163 12.253 361 HD21 LEU 55 3HD2 LEU 55 2.237 17.227 10.728 362 HD22 LEU 55 1HD2 LEU 55 3.029 18.577 11.573 363 HD23 LEU 55 2HD2 LEU 55 3.372 18.296 9.852 364 H ASP 56 H ASP 56 -1.414 18.268 9.136 365 HA ASP 56 HA ASP 56 -3.439 18.784 8.486 366 HB3 ASP 56 2HB ASP 56 -3.803 19.565 6.188 367 H GLN 57 H GLN 57 -2.336 16.479 5.948 368 HA GLN 57 HA GLN 57 -4.835 15.156 5.654 369 HB3 GLN 57 2HB GLN 57 -3.500 13.378 4.571 370 HG3 GLN 57 2HG GLN 57 -2.148 14.640 2.961 371 HE21 GLN 57 1HE2 GLN 57 -3.524 14.608 1.218 372 HE22 GLN 57 2HE2 GLN 57 -5.161 15.295 1.261 373 H ILE 58 H ILE 58 -2.716 15.066 8.249 374 HA ILE 58 HA ILE 58 -3.595 12.474 9.367 375 HB ILE 58 HB ILE 58 -1.707 14.713 10.302 376 HG13 ILE 58 2HG1 ILE 58 -1.351 11.791 9.429 377 HG21 ILE 58 1HG2 ILE 58 -2.496 12.133 11.780 378 HG22 ILE 58 2HG2 ILE 58 -1.214 13.259 12.283 379 HG23 ILE 58 3HG2 ILE 58 -2.901 13.765 12.310 380 HD11 ILE 58 3HD1 ILE 58 -0.972 13.096 7.524 381 HD12 ILE 58 1HD1 ILE 58 -0.342 14.475 8.469 382 HD13 ILE 58 2HD1 ILE 58 0.619 13.002 8.290 383 H GLN 59 H GLN 59 -3.769 16.026 10.199 384 HA GLN 59 HA GLN 59 -5.909 15.479 12.100 385 HB3 GLN 59 2HB GLN 59 -4.010 15.378 13.446 386 HG3 GLN 59 2HG GLN 59 -2.673 17.149 11.482 387 HE21 GLN 59 1HE2 GLN 59 -2.855 19.329 12.027 388 HE22 GLN 59 2HE2 GLN 59 -2.241 20.026 13.516 389 H GLY 60 H GLY 60 -7.461 16.956 11.867 390 HA2 GLY 60 1HA GLY 60 -8.493 18.982 11.481 391 HA3 GLY 60 2HA GLY 60 -6.931 19.720 11.102 392 H ASN 61 H ASN 61 -6.340 17.503 8.939 393 HA ASN 61 HA ASN 61 -8.452 18.277 6.993 394 HB3 ASN 61 2HB ASN 61 -5.722 17.945 5.905 395 HD21 ASN 61 1HD2 ASN 61 -6.255 21.019 5.313 396 HD22 ASN 61 2HD2 ASN 61 -7.392 20.941 3.994 397 H LYS 62 H LYS 62 -8.129 16.756 4.949 398 HA LYS 62 HA LYS 62 -7.413 14.034 5.557 399 HB3 LYS 62 2HB LYS 62 -9.347 14.134 7.065 400 HG3 LYS 62 2HG LYS 62 -11.063 14.707 4.602 401 HD3 LYS 62 2HD LYS 62 -11.699 14.217 7.540 402 HE3 LYS 62 2HE LYS 62 -13.027 16.083 6.555 403 HZ1 LYS 62 3HZ LYS 62 -14.742 15.484 5.010 404 HZ2 LYS 62 1HZ LYS 62 -14.112 13.998 4.752 405 HZ3 LYS 62 2HZ LYS 62 -13.295 15.393 4.289 406 H ASP 63 H ASP 63 -8.773 16.340 3.259 407 HA ASP 63 HA ASP 63 -9.866 14.337 1.457 408 HB3 ASP 63 2HB ASP 63 -9.114 17.248 0.992 409 H PHE 64 H PHE 64 -8.797 13.231 -0.170 410 HA PHE 64 HA PHE 64 -6.111 14.103 -0.953 411 HB3 PHE 64 2HB PHE 64 -5.543 12.347 0.466 412 HD1 PHE 64 1HD PHE 64 -8.028 10.572 -1.786 413 HD2 PHE 64 2HD PHE 64 -6.363 10.999 2.168 414 HE1 PHE 64 1HE PHE 64 -9.550 8.805 -0.954 415 HE2 PHE 64 2HE PHE 64 -7.829 9.150 2.975 416 HZ PHE 64 HZ PHE 64 -9.477 8.107 1.426 417 HA PRO 65 HA PRO 65 -7.946 13.890 -4.876 418 HB3 PRO 65 2HB PRO 65 -5.976 14.778 -5.708 419 HG3 PRO 65 2HG PRO 65 -3.843 13.921 -5.020 420 HD3 PRO 65 2HD PRO 65 -5.073 14.586 -3.083 421 H GLU 66 H GLU 66 -8.151 12.484 -6.975 422 HA GLU 66 HA GLU 66 -8.605 9.680 -6.314 423 HB3 GLU 66 2HB GLU 66 -10.268 10.984 -7.606 424 HG3 GLU 66 2HG GLU 66 -8.124 10.932 -9.737 425 H ILE 67 H ILE 67 -7.881 8.484 -8.676 426 HA ILE 67 HA ILE 67 -5.017 8.954 -9.082 427 HB ILE 67 HB ILE 67 -4.681 6.421 -8.815 428 HG13 ILE 67 2HG1 ILE 67 -7.180 5.880 -8.677 429 HG21 ILE 67 1HG2 ILE 67 -4.166 6.649 -6.425 430 HG22 ILE 67 2HG2 ILE 67 -3.808 8.107 -7.344 431 HG23 ILE 67 3HG2 ILE 67 -5.254 8.050 -6.308 432 HD11 ILE 67 3HD1 ILE 67 -5.657 4.139 -8.132 433 HD12 ILE 67 1HD1 ILE 67 -5.298 4.829 -6.526 434 HD13 ILE 67 2HD1 ILE 67 -6.886 4.180 -6.844 435 H GLN 68 H GLN 68 -4.288 7.523 -10.889 436 HA GLN 68 HA GLN 68 -6.446 6.493 -12.650 437 HB3 GLN 68 2HB GLN 68 -4.768 7.324 -14.533 438 HG3 GLN 68 2HG GLN 68 -6.666 9.217 -13.055 439 HE21 GLN 68 1HE2 GLN 68 -4.707 10.697 -13.910 440 HE22 GLN 68 2HE2 GLN 68 -5.229 11.518 -15.359 441 H LEU 69 H LEU 69 -5.723 4.841 -14.078 442 HA LEU 69 HA LEU 69 -3.139 3.642 -13.879 443 HB3 LEU 69 2HB LEU 69 -4.293 2.919 -11.701 444 HG LEU 69 HG LEU 69 -5.818 1.074 -13.557 445 HD11 LEU 69 1HD1 LEU 69 -5.715 1.128 -10.559 446 HD12 LEU 69 2HD1 LEU 69 -4.943 -0.079 -11.638 447 HD13 LEU 69 3HD1 LEU 69 -6.692 0.041 -11.578 448 HD21 LEU 69 3HD2 LEU 69 -6.894 3.163 -11.607 449 HD22 LEU 69 1HD2 LEU 69 -7.870 1.933 -12.445 450 HD23 LEU 69 2HD2 LEU 69 -7.062 3.171 -13.379 451 H ASP 70 H ASP 70 -3.760 1.147 -14.924 452 HA ASP 70 HA ASP 70 -4.861 1.840 -17.570 453 HB3 ASP 70 2HB ASP 70 -3.786 -0.872 -17.212 454 H ASN 71 H ASN 71 -5.918 -0.456 -18.551 455 HA ASN 71 HA ASN 71 -8.081 -1.225 -16.635 456 HB3 ASN 71 2HB ASN 71 -7.528 -2.597 -19.244 457 HD21 ASN 71 1HD2 ASN 71 -8.052 -4.417 -17.441 458 HD22 ASN 71 2HD2 ASN 71 -9.749 -4.633 -17.021 459 H ILE 72 H ILE 72 -6.813 -1.841 -15.017 460 HA ILE 72 HA ILE 72 -5.239 -4.384 -15.232 461 HB ILE 72 HB ILE 72 -5.281 -2.383 -12.931 462 HG13 ILE 72 2HG1 ILE 72 -4.267 -1.379 -14.934 463 HG21 ILE 72 1HG2 ILE 72 -3.035 -3.792 -12.449 464 HG22 ILE 72 2HG2 ILE 72 -4.616 -4.319 -11.868 465 HG23 ILE 72 3HG2 ILE 72 -3.888 -5.020 -13.344 466 HD11 ILE 72 3HD1 ILE 72 -2.199 -0.649 -14.197 467 HD12 ILE 72 1HD1 ILE 72 -3.134 -0.946 -12.721 468 HD13 ILE 72 2HD1 ILE 72 -1.876 -2.102 -13.254 469 H ASP 73 H ASP 73 -5.779 -6.084 -13.672 470 HA ASP 73 HA ASP 73 -8.184 -5.556 -12.058 471 HB3 ASP 73 2HB ASP 73 -7.736 -8.199 -13.479 472 H TYR 74 H TYR 74 -7.744 -5.949 -9.931 473 HA TYR 74 HA TYR 74 -5.056 -6.805 -9.246 474 HB3 TYR 74 2HB TYR 74 -5.763 -6.428 -6.968 475 HD1 TYR 74 2HD TYR 74 -4.260 -4.674 -8.362 476 HD2 TYR 74 1HD TYR 74 -8.493 -4.286 -7.658 477 HE1 TYR 74 2HE TYR 74 -4.102 -2.276 -8.754 478 HE2 TYR 74 1HE TYR 74 -8.351 -1.851 -8.001 479 HH TYR 74 HH TYR 74 -6.827 0.003 -8.208 480 H ASN 75 H ASN 75 -8.026 -8.377 -9.727 481 HA ASN 75 HA ASN 75 -8.001 -10.544 -7.947 482 HB3 ASN 75 2HB ASN 75 -8.933 -10.970 -10.798 483 HD21 ASN 75 1HD2 ASN 75 -10.475 -10.260 -7.668 484 HD22 ASN 75 2HD2 ASN 75 -11.305 -11.804 -7.482 485 H ASN 76 H ASN 76 -6.170 -10.095 -10.949 486 HA ASN 76 HA ASN 76 -5.290 -12.867 -10.981 487 HB3 ASN 76 2HB ASN 76 -5.987 -11.909 -13.070 488 HD21 ASN 76 1HD2 ASN 76 -6.407 -9.955 -14.119 489 HD22 ASN 76 2HD2 ASN 76 -5.263 -8.633 -14.200 490 H TYR 77 H TYR 77 -4.359 -11.071 -8.699 491 HA TYR 77 HA TYR 77 -1.518 -11.822 -9.068 492 HB3 TYR 77 2HB TYR 77 -0.961 -9.836 -7.559 493 HD1 TYR 77 1HD TYR 77 0.616 -10.514 -9.494 494 HD2 TYR 77 2HD TYR 77 -2.845 -8.011 -10.057 495 HE1 TYR 77 1HE TYR 77 1.558 -9.739 -11.623 496 HE2 TYR 77 2HE TYR 77 -1.911 -7.211 -12.196 497 HH TYR 77 HH TYR 77 1.159 -8.598 -13.545 498 H ASP 78 H ASP 78 -0.690 -13.073 -7.526 499 HA ASP 78 HA ASP 78 -2.425 -13.831 -5.265 500 HB3 ASP 78 2HB ASP 78 0.466 -14.668 -5.693 501 H LEU 79 H LEU 79 0.253 -11.599 -5.766 502 HA LEU 79 HA LEU 79 0.214 -10.901 -2.887 503 HB3 LEU 79 2HB LEU 79 2.838 -10.673 -4.221 504 HG LEU 79 HG LEU 79 3.845 -11.332 -2.324 505 HD11 LEU 79 1HD1 LEU 79 2.480 -9.328 -1.764 506 HD12 LEU 79 2HD1 LEU 79 2.876 -10.344 -0.377 507 HD13 LEU 79 3HD1 LEU 79 1.253 -10.409 -1.050 508 HD21 LEU 79 3HD2 LEU 79 3.103 -13.551 -2.095 509 HD22 LEU 79 1HD2 LEU 79 1.439 -13.073 -1.737 510 HD23 LEU 79 2HD2 LEU 79 2.746 -12.796 -0.552 511 H ILE 80 H ILE 80 0.082 -8.696 -2.623 512 HA ILE 80 HA ILE 80 0.772 -6.897 -4.939 513 HB ILE 80 HB ILE 80 -1.666 -6.756 -3.119 514 HG13 ILE 80 2HG1 ILE 80 -1.843 -8.477 -4.912 515 HG21 ILE 80 1HG2 ILE 80 -2.277 -4.758 -4.429 516 HG22 ILE 80 2HG2 ILE 80 -0.709 -4.516 -3.658 517 HG23 ILE 80 3HG2 ILE 80 -0.788 -4.922 -5.395 518 HD11 ILE 80 3HD1 ILE 80 -3.522 -6.093 -5.760 519 HD12 ILE 80 1HD1 ILE 80 -3.818 -7.802 -6.079 520 HD13 ILE 80 2HD1 ILE 80 -3.917 -7.201 -4.417 521 H LEU 81 H LEU 81 2.613 -6.034 -4.339 522 HA LEU 81 HA LEU 81 3.229 -5.212 -1.579 523 HB3 LEU 81 2HB LEU 81 5.204 -4.087 -2.900 524 HG LEU 81 HG LEU 81 6.496 -6.080 -3.290 525 HD11 LEU 81 1HD1 LEU 81 6.576 -5.107 -1.088 526 HD12 LEU 81 2HD1 LEU 81 6.640 -6.857 -0.961 527 HD13 LEU 81 3HD1 LEU 81 5.123 -6.015 -0.586 528 HD21 LEU 81 3HD2 LEU 81 4.155 -7.714 -2.354 529 HD22 LEU 81 1HD2 LEU 81 5.757 -8.281 -2.832 530 HD23 LEU 81 2HD2 LEU 81 4.683 -7.554 -4.047 531 H ILE 82 H ILE 82 3.593 -3.041 -1.027 532 HA ILE 82 HA ILE 82 2.403 -0.901 -2.715 533 HB ILE 82 HB ILE 82 1.879 -1.654 0.212 534 HG13 ILE 82 2HG1 ILE 82 0.571 -3.027 -1.336 535 HG21 ILE 82 1HG2 ILE 82 0.503 0.282 0.394 536 HG22 ILE 82 2HG2 ILE 82 2.076 0.832 -0.120 537 HG23 ILE 82 3HG2 ILE 82 0.770 0.710 -1.321 538 HD11 ILE 82 3HD1 ILE 82 -1.689 -2.553 -0.741 539 HD12 ILE 82 1HD1 ILE 82 -0.654 -2.262 0.667 540 HD13 ILE 82 2HD1 ILE 82 -1.309 -0.895 -0.274 541 H GLY 83 H GLY 83 3.902 0.761 -2.896 542 HA2 GLY 83 1HA GLY 83 5.856 1.157 -0.661 543 HA3 GLY 83 2HA GLY 83 6.147 1.546 -2.363 544 H SER 84 H SER 84 5.903 3.185 0.264 545 HA SER 84 HA SER 84 4.973 5.599 -1.017 546 HB3 SER 84 2HB SER 84 3.434 4.204 1.206 547 HG SER 84 HG SER 84 2.288 6.111 1.513 548 HA PRO 85 HA PRO 85 8.014 6.907 2.088 549 HB3 PRO 85 2HB PRO 85 8.254 8.807 0.732 550 HG3 PRO 85 2HG PRO 85 6.340 9.977 -0.117 551 HD3 PRO 85 2HD PRO 85 6.185 7.766 -0.913 552 H VAL 86 H VAL 86 8.142 8.158 4.222 553 HA VAL 86 HA VAL 86 5.770 8.451 5.848 554 HB VAL 86 HB VAL 86 7.981 6.620 6.861 555 HG11 VAL 86 1HG1 VAL 86 6.739 7.647 8.700 556 HG12 VAL 86 2HG1 VAL 86 5.186 7.245 7.913 557 HG13 VAL 86 3HG1 VAL 86 6.245 5.976 8.553 558 HG21 VAL 86 3HG2 VAL 86 5.321 5.898 5.704 559 HG22 VAL 86 1HG2 VAL 86 6.923 5.473 5.063 560 HG23 VAL 86 2HG2 VAL 86 6.389 4.764 6.596 561 H TRP 87 H TRP 87 6.566 9.578 7.826 562 HA TRP 87 HA TRP 87 9.194 9.633 8.598 563 HB3 TRP 87 2HB TRP 87 8.325 12.368 7.601 564 HD1 TRP 87 HD TRP 87 11.503 10.370 8.617 565 HE1 TRP 87 1HE TRP 87 13.264 12.036 9.547 566 HE3 TRP 87 3HE TRP 87 8.925 14.775 8.049 567 HZ2 TRP 87 2HZ TRP 87 13.521 14.824 9.971 568 HZ3 TRP 87 3HZ TRP 87 10.013 16.923 8.657 569 HH2 TRP 87 HH TRP 87 12.304 16.956 9.604 570 H SER 88 H SER 88 6.263 11.326 8.702 571 HA SER 88 HA SER 88 6.504 11.327 11.646 572 HB3 SER 88 2HB SER 88 5.087 13.390 11.587 573 HG SER 88 HG SER 88 6.196 14.712 10.116 574 H GLY 89 H GLY 89 5.760 9.133 11.429 575 HA2 GLY 89 1HA GLY 89 4.217 7.545 11.972 576 HA3 GLY 89 2HA GLY 89 3.020 8.836 12.108 577 H TYR 90 H TYR 90 2.544 9.780 9.768 578 HA TYR 90 HA TYR 90 2.222 7.974 7.552 579 HB3 TYR 90 2HB TYR 90 0.551 6.890 8.674 580 HD1 TYR 90 1HD TYR 90 0.577 10.247 10.226 581 HD2 TYR 90 2HD TYR 90 -1.796 6.677 9.661 582 HE1 TYR 90 1HE TYR 90 -0.509 10.627 12.383 583 HE2 TYR 90 2HE TYR 90 -2.934 7.105 11.811 584 HH TYR 90 HH TYR 90 -2.169 8.346 14.093 585 HA PRO 91 HA PRO 91 2.041 12.693 6.964 586 HB3 PRO 91 2HB PRO 91 4.273 13.048 6.998 587 HG3 PRO 91 2HG PRO 91 5.784 11.303 6.501 588 HD3 PRO 91 2HD PRO 91 4.303 10.630 8.269 589 H ALA 92 H ALA 92 2.122 9.878 4.793 590 HA ALA 92 HA ALA 92 1.086 11.586 2.596 591 HB1 ALA 92 1HB ALA 92 2.436 8.854 2.398 592 HB2 ALA 92 2HB ALA 92 2.151 10.029 1.105 593 HB3 ALA 92 3HB ALA 92 3.332 10.394 2.356 594 H THR 93 H THR 93 -0.653 10.762 1.300 595 HA THR 93 HA THR 93 -1.998 8.275 2.247 596 HB THR 93 HB THR 93 -4.169 9.621 1.708 597 HG1 THR 93 1HG THR 93 -2.918 11.502 0.964 598 HG21 THR 93 3HG2 THR 93 -2.608 10.259 4.244 599 HG22 THR 93 1HG2 THR 93 -3.703 8.878 3.962 600 HG23 THR 93 2HG2 THR 93 -4.338 10.522 3.987 601 HA PRO 94 HA PRO 94 -1.806 8.100 -2.392 602 HB3 PRO 94 2HB PRO 94 0.457 8.313 -2.885 603 HG3 PRO 94 2HG PRO 94 2.134 7.903 -1.239 604 HD3 PRO 94 2HD PRO 94 0.624 9.498 -0.409 605 H ILE 95 H ILE 95 -1.059 6.098 0.461 606 HA ILE 95 HA ILE 95 -2.303 3.705 -0.793 607 HB ILE 95 HB ILE 95 -1.124 3.899 1.959 608 HG13 ILE 95 2HG1 ILE 95 1.041 2.989 1.082 609 HG21 ILE 95 1HG2 ILE 95 -0.764 1.503 1.644 610 HG22 ILE 95 2HG2 ILE 95 -2.444 1.922 1.335 611 HG23 ILE 95 3HG2 ILE 95 -1.381 1.612 -0.034 612 HD11 ILE 95 3HD1 ILE 95 0.026 2.792 -1.402 613 HD12 ILE 95 1HD1 ILE 95 0.579 4.479 -1.477 614 HD13 ILE 95 2HD1 ILE 95 1.724 3.187 -1.107 615 H LYS 96 H LYS 96 -4.051 5.529 -0.721 616 HA LYS 96 HA LYS 96 -5.874 4.573 1.389 617 HB3 LYS 96 2HB LYS 96 -6.798 7.164 0.845 618 HG3 LYS 96 2HG LYS 96 -5.968 7.664 3.182 619 HD3 LYS 96 2HD LYS 96 -7.342 4.947 2.825 620 HE3 LYS 96 2HE LYS 96 -7.139 6.865 5.179 621 HZ1 LYS 96 3HZ LYS 96 -8.560 5.186 6.267 622 HZ2 LYS 96 1HZ LYS 96 -8.811 4.460 4.815 623 HZ3 LYS 96 2HZ LYS 96 -9.324 6.017 5.080 624 H THR 97 H THR 97 -6.050 6.688 -1.579 625 HA THR 97 HA THR 97 -8.449 5.788 -2.476 626 HB THR 97 HB THR 97 -6.838 5.741 -4.822 627 HG1 THR 97 1HG THR 97 -5.677 7.721 -3.193 628 HG21 THR 97 3HG2 THR 97 -8.359 8.014 -3.649 629 HG22 THR 97 1HG2 THR 97 -8.767 6.829 -4.948 630 HG23 THR 97 2HG2 THR 97 -7.526 8.046 -5.233 631 H LEU 98 H LEU 98 -5.313 4.365 -3.351 632 HA LEU 98 HA LEU 98 -6.337 2.555 -5.154 633 HB3 LEU 98 2HB LEU 98 -3.815 2.122 -3.466 634 HG LEU 98 HG LEU 98 -2.710 1.367 -5.438 635 HD11 LEU 98 1HD1 LEU 98 -5.426 0.037 -5.789 636 HD12 LEU 98 2HD1 LEU 98 -4.241 -0.422 -4.560 637 HD13 LEU 98 3HD1 LEU 98 -3.847 -0.583 -6.273 638 HD21 LEU 98 3HD2 LEU 98 -5.143 2.026 -7.132 639 HD22 LEU 98 1HD2 LEU 98 -3.532 1.516 -7.662 640 HD23 LEU 98 2HD2 LEU 98 -3.735 3.094 -6.922 641 H LEU 99 H LEU 99 -5.452 1.981 -1.735 642 HA LEU 99 HA LEU 99 -6.195 -0.711 -1.406 643 HB3 LEU 99 2HB LEU 99 -6.962 0.427 0.959 644 HG LEU 99 HG LEU 99 -4.041 0.199 0.168 645 HD11 LEU 99 1HD1 LEU 99 -5.487 0.359 2.844 646 HD12 LEU 99 2HD1 LEU 99 -4.479 1.621 2.164 647 HD13 LEU 99 3HD1 LEU 99 -3.760 0.068 2.648 648 HD21 LEU 99 3HD2 LEU 99 -5.895 -1.777 1.595 649 HD22 LEU 99 1HD2 LEU 99 -4.141 -1.976 1.393 650 HD23 LEU 99 2HD2 LEU 99 -5.191 -2.012 -0.022 651 H ASP 100 H ASP 100 -8.217 2.266 -1.178 652 HA ASP 100 HA ASP 100 -10.589 0.894 -0.432 653 HB3 ASP 100 2HB ASP 100 -10.367 3.568 -1.858 654 H GLN 101 H GLN 101 -9.072 1.376 -3.531 655 HA GLN 101 HA GLN 101 -11.493 0.974 -5.136 656 HB3 GLN 101 2HB GLN 101 -9.983 0.516 -7.008 657 HG3 GLN 101 2HG GLN 101 -8.688 2.813 -5.589 658 HE21 GLN 101 1HE2 GLN 101 -10.104 4.391 -7.841 659 HE22 GLN 101 2HE2 GLN 101 -8.927 4.269 -9.106 660 H MET 102 H MET 102 -8.873 -0.953 -3.706 661 HA MET 102 HA MET 102 -9.767 -3.435 -4.919 662 HB3 MET 102 2HB MET 102 -7.930 -4.466 -3.932 663 HG3 MET 102 2HG MET 102 -6.688 -1.752 -4.037 664 HE1 MET 102 3HE MET 102 -4.269 -5.187 -3.228 665 HE2 MET 102 1HE MET 102 -5.433 -4.170 -2.351 666 HE3 MET 102 2HE MET 102 -6.007 -5.470 -3.425 667 H LYS 103 H LYS 103 -11.916 -2.254 -3.166 668 HA LYS 103 HA LYS 103 -11.758 -3.139 -0.518 669 HB3 LYS 103 2HB LYS 103 -14.467 -3.442 -1.014 670 HG3 LYS 103 2HG LYS 103 -14.829 -1.110 -0.559 671 HD3 LYS 103 2HD LYS 103 -13.593 -2.868 1.171 672 HE3 LYS 103 2HE LYS 103 -11.439 -1.448 0.680 673 HZ1 LYS 103 3HZ LYS 103 -12.733 0.298 2.678 674 HZ2 LYS 103 1HZ LYS 103 -12.505 0.747 1.096 675 HZ3 LYS 103 2HZ LYS 103 -11.242 0.468 2.052 676 H ASN 104 H ASN 104 -13.055 -5.109 -3.206 677 HA ASN 104 HA ASN 104 -13.772 -7.161 -1.255 678 HB3 ASN 104 2HB ASN 104 -14.837 -8.277 -3.226 679 HD21 ASN 104 1HD2 ASN 104 -15.811 -6.937 -1.027 680 HD22 ASN 104 2HD2 ASN 104 -17.121 -5.879 -1.529 681 H TYR 105 H TYR 105 -10.776 -6.767 -2.180 682 HA TYR 105 HA TYR 105 -10.459 -9.119 -3.873 683 HB3 TYR 105 2HB TYR 105 -8.104 -8.140 -4.116 684 HD1 TYR 105 1HD TYR 105 -10.794 -5.685 -3.920 685 HD2 TYR 105 2HD TYR 105 -8.721 -8.398 -6.454 686 HE1 TYR 105 1HE TYR 105 -11.947 -4.630 -5.898 687 HE2 TYR 105 2HE TYR 105 -9.863 -7.415 -8.463 688 HH TYR 105 HH TYR 105 -10.870 -5.235 -9.088 689 H ARG 106 H ARG 106 -8.579 -10.500 -3.719 690 HA ARG 106 HA ARG 106 -7.699 -11.224 -1.008 691 HB3 ARG 106 2HB ARG 106 -7.806 -13.588 -1.797 692 HG3 ARG 106 2HG ARG 106 -10.652 -12.761 -2.040 693 HD3 ARG 106 2HD ARG 106 -10.484 -13.801 0.395 694 HE ARG 106 HE ARG 106 -9.801 -15.729 -1.757 695 HH11 ARG 106 1HH1 ARG 106 -12.431 -13.959 -0.162 696 HH12 ARG 106 2HH1 ARG 106 -13.652 -15.130 -0.513 697 HH21 ARG 106 1HH2 ARG 106 -11.383 -17.332 -2.180 698 HH22 ARG 106 2HH2 ARG 106 -13.052 -17.015 -1.913 699 H GLY 107 H GLY 107 -5.969 -13.248 -2.270 700 HA2 GLY 107 1HA GLY 107 -3.762 -13.189 -2.919 701 HA3 GLY 107 2HA GLY 107 -3.937 -11.534 -3.542 702 H GLU 108 H GLU 108 -1.840 -11.845 -1.917 703 HA GLU 108 HA GLU 108 -2.625 -11.140 0.863 704 HB3 GLU 108 2HB GLU 108 -0.155 -11.643 1.201 705 HG3 GLU 108 2HG GLU 108 -1.912 -13.892 0.094 706 H VAL 109 H VAL 109 -1.880 -9.160 1.741 707 HA VAL 109 HA VAL 109 -0.693 -7.314 -0.289 708 HB VAL 109 HB VAL 109 -2.566 -6.451 1.921 709 HG11 VAL 109 1HG1 VAL 109 -1.897 -5.305 -0.850 710 HG12 VAL 109 2HG1 VAL 109 -2.908 -4.535 0.405 711 HG13 VAL 109 3HG1 VAL 109 -1.169 -4.754 0.670 712 HG21 VAL 109 3HG2 VAL 109 -4.386 -6.414 0.182 713 HG22 VAL 109 1HG2 VAL 109 -3.336 -7.384 -0.877 714 HG23 VAL 109 2HG2 VAL 109 -3.921 -8.042 0.673 715 H ALA 110 H ALA 110 1.073 -6.105 0.268 716 HA ALA 110 HA ALA 110 2.019 -6.197 3.057 717 HB1 ALA 110 1HB ALA 110 3.582 -7.151 0.625 718 HB2 ALA 110 2HB ALA 110 4.299 -6.867 2.225 719 HB3 ALA 110 3HB ALA 110 3.078 -8.136 2.005 720 H SER 111 H SER 111 3.462 -4.439 3.583 721 HA SER 111 HA SER 111 3.709 -2.380 1.438 722 HB3 SER 111 2HB SER 111 3.597 -1.557 4.309 723 HG SER 111 HG SER 111 2.284 -0.710 1.931 724 H PHE 112 H PHE 112 5.547 -1.140 1.305 725 HA PHE 112 HA PHE 112 7.771 -1.740 3.185 726 HB3 PHE 112 2HB PHE 112 8.013 -3.050 1.146 727 HD1 PHE 112 1HD PHE 112 9.374 0.147 -0.062 728 HD2 PHE 112 2HD PHE 112 6.527 -2.968 -0.804 729 HE1 PHE 112 1HE PHE 112 8.974 1.053 -2.380 730 HE2 PHE 112 2HE PHE 112 6.195 -2.124 -3.116 731 HZ PHE 112 HZ PHE 112 7.433 -0.147 -3.913 732 H PHE 113 H PHE 113 9.250 0.013 3.454 733 HA PHE 113 HA PHE 113 8.861 2.482 1.996 734 HB3 PHE 113 2HB PHE 113 7.201 2.589 3.977 735 HD1 PHE 113 1HD PHE 113 8.546 0.665 5.641 736 HD2 PHE 113 2HD PHE 113 8.992 4.948 5.656 737 HE1 PHE 113 1HE PHE 113 9.141 0.584 8.013 738 HE2 PHE 113 2HE PHE 113 9.331 4.880 8.083 739 HZ PHE 113 HZ PHE 113 9.502 2.715 9.284 740 H THR 114 H THR 114 10.644 4.106 2.818 741 HA THR 114 HA THR 114 13.004 2.685 3.912 742 HB THR 114 HB THR 114 12.835 2.099 1.588 743 HG1 THR 114 1HG THR 114 14.831 2.209 1.383 744 HG21 THR 114 3HG2 THR 114 13.045 3.692 -0.250 745 HG22 THR 114 1HG2 THR 114 12.906 5.054 0.897 746 HG23 THR 114 2HG2 THR 114 11.556 3.912 0.638 747 H SER 115 H SER 115 11.356 4.620 5.087 748 HA SER 115 HA SER 115 12.958 7.119 5.212 749 HB3 SER 115 2HB SER 115 10.860 8.357 4.701 750 HG SER 115 HG SER 115 10.753 7.014 2.403 751 H ALA 116 H ALA 116 13.241 5.717 7.221 752 HA ALA 116 HA ALA 116 10.919 5.596 9.066 753 HB1 ALA 116 1HB ALA 116 11.999 3.687 10.045 754 HB2 ALA 116 2HB ALA 116 12.017 3.501 8.281 755 HB3 ALA 116 3HB ALA 116 13.497 4.013 9.144 756 H GLY 117 H GLY 117 13.021 7.877 8.846 757 HA2 GLY 117 1HA GLY 117 14.926 8.010 10.529 758 HA3 GLY 117 2HA GLY 117 13.927 9.441 10.314 759 H THR 118 H THR 118 11.619 8.522 11.924 760 HA THR 118 HA THR 118 12.786 7.633 14.461 761 HB THR 118 HB THR 118 10.917 9.913 14.848 762 HG1 THR 118 1HG THR 118 12.186 10.895 13.331 763 HG21 THR 118 3HG2 THR 118 12.411 10.398 16.716 764 HG22 THR 118 1HG2 THR 118 13.593 9.215 16.115 765 HG23 THR 118 2HG2 THR 118 12.012 8.673 16.720 766 H ASN 119 H ASN 119 10.929 6.562 12.307 767 HA ASN 119 HA ASN 119 8.575 5.930 13.969 768 HB3 ASN 119 2HB ASN 119 7.251 6.355 11.663 769 HD21 ASN 119 1HD2 ASN 119 6.560 6.437 14.341 770 HD22 ASN 119 2HD2 ASN 119 5.833 7.997 14.622 771 H HIS 120 H HIS 120 8.306 3.854 13.883 772 HA HIS 120 HA HIS 120 8.112 2.471 11.317 773 HB3 HIS 120 2HB HIS 120 9.958 1.479 13.538 774 HD1 HIS 120 1HD HIS 120 10.847 -1.050 13.233 775 HD2 HIS 120 2HD HIS 120 8.278 0.357 10.153 776 HE1 HIS 120 1HE HIS 120 10.394 -2.994 11.718 777 H LYS 121 H LYS 121 8.214 1.830 14.875 778 HA LYS 121 HA LYS 121 6.283 -0.146 14.976 779 HB3 LYS 121 2HB LYS 121 6.067 1.668 17.285 780 HG3 LYS 121 2HG LYS 121 7.573 -0.958 17.163 781 HD3 LYS 121 2HD LYS 121 5.659 0.075 19.287 782 HE3 LYS 121 2HE LYS 121 6.785 -1.308 20.833 783 HZ1 LYS 121 3HZ LYS 121 6.931 -2.985 18.415 784 HZ2 LYS 121 1HZ LYS 121 5.503 -2.652 19.176 785 HZ3 LYS 121 2HZ LYS 121 6.666 -3.454 19.985 786 H ALA 122 H ALA 122 5.728 3.395 15.173 787 HA ALA 122 HA ALA 122 2.962 3.368 15.581 788 HB1 ALA 122 1HB ALA 122 3.011 5.646 14.803 789 HB2 ALA 122 2HB ALA 122 4.517 5.360 15.679 790 HB3 ALA 122 3HB ALA 122 4.516 5.387 13.899 791 H TYR 123 H TYR 123 4.724 3.397 12.438 792 HA TYR 123 HA TYR 123 2.461 3.671 10.791 793 HB3 TYR 123 2HB TYR 123 5.134 2.388 10.160 794 HD1 TYR 123 2HD TYR 123 3.780 0.854 8.578 795 HD2 TYR 123 1HD TYR 123 3.925 5.165 8.112 796 HE1 TYR 123 2HE TYR 123 3.188 0.648 6.161 797 HE2 TYR 123 1HE TYR 123 3.288 4.915 5.750 798 HH TYR 123 HH TYR 123 3.546 3.308 3.985 799 H VAL 124 H VAL 124 4.052 0.686 12.019 800 HA VAL 124 HA VAL 124 2.556 -1.211 10.530 801 HB VAL 124 HB VAL 124 3.847 -1.286 13.283 802 HG11 VAL 124 1HG1 VAL 124 2.861 -3.607 11.584 803 HG12 VAL 124 2HG1 VAL 124 4.054 -3.789 12.893 804 HG13 VAL 124 3HG1 VAL 124 2.428 -3.205 13.256 805 HG21 VAL 124 3HG2 VAL 124 5.782 -2.282 12.148 806 HG22 VAL 124 1HG2 VAL 124 4.913 -2.311 10.608 807 HG23 VAL 124 2HG2 VAL 124 5.394 -0.769 11.319 808 H SER 125 H SER 125 1.560 0.791 13.210 809 HA SER 125 HA SER 125 -0.824 -0.865 13.808 810 HB3 SER 125 2HB SER 125 -0.077 1.725 15.149 811 HG SER 125 HG SER 125 -0.550 -0.715 16.458 812 H HIS 126 H HIS 126 0.155 2.428 12.697 813 HA HIS 126 HA HIS 126 -2.320 3.564 12.053 814 HB3 HIS 126 2HB HIS 126 -1.061 4.789 10.317 815 HD1 HIS 126 1HD HIS 126 1.613 6.092 11.044 816 HD2 HIS 126 2HD HIS 126 -1.232 4.723 13.832 817 HE1 HIS 126 1HE HIS 126 1.986 7.409 13.226 818 H PHE 127 H PHE 127 -0.224 1.572 9.915 819 HA PHE 127 HA PHE 127 -1.842 1.828 7.648 820 HB3 PHE 127 2HB PHE 127 0.139 -0.341 8.447 821 HD1 PHE 127 2HD PHE 127 -1.580 1.331 5.510 822 HD2 PHE 127 1HD PHE 127 0.643 -2.078 6.939 823 HE1 PHE 127 2HE PHE 127 -1.747 0.277 3.293 824 HE2 PHE 127 1HE PHE 127 0.361 -3.181 4.750 825 HZ PHE 127 HZ PHE 127 -0.784 -1.974 2.892 826 H ASN 128 H ASN 128 -1.964 -0.523 10.282 827 HA ASN 128 HA ASN 128 -3.719 -2.405 9.083 828 HB3 ASN 128 2HB ASN 128 -4.384 -2.507 11.774 829 HD21 ASN 128 1HD2 ASN 128 -0.947 -3.105 11.535 830 HD22 ASN 128 2HD2 ASN 128 -1.124 -4.807 11.151 831 H GLU 129 H GLU 129 -4.357 0.546 10.980 832 HA GLU 129 HA GLU 129 -7.233 0.281 10.943 833 HB3 GLU 129 2HB GLU 129 -7.058 2.627 11.792 834 HG3 GLU 129 2HG GLU 129 -5.965 2.226 13.879 835 H TRP 130 H TRP 130 -4.963 1.495 8.738 836 HA TRP 130 HA TRP 130 -6.917 3.077 7.116 837 HB3 TRP 130 2HB TRP 130 -4.773 3.664 5.894 838 HD1 TRP 130 HD TRP 130 -5.951 4.259 9.524 839 HE1 TRP 130 1HE TRP 130 -5.568 6.705 10.091 840 HE3 TRP 130 3HE TRP 130 -3.125 5.601 5.470 841 HZ2 TRP 130 2HZ TRP 130 -4.077 8.948 9.021 842 HZ3 TRP 130 3HZ TRP 130 -2.125 7.869 5.346 843 HH2 TRP 130 HH TRP 130 -2.614 9.554 7.096 844 H ALA 131 H ALA 131 -6.111 -0.166 7.299 845 HA ALA 131 HA ALA 131 -6.662 -0.498 4.386 846 HB1 ALA 131 1HB ALA 131 -4.212 -0.728 4.872 847 HB2 ALA 131 2HB ALA 131 -4.586 -2.045 5.991 848 HB3 ALA 131 3HB ALA 131 -4.947 -2.224 4.260 849 H ASP 132 H ASP 132 -8.061 -1.005 7.249 850 HA ASP 132 HA ASP 132 -8.213 -3.720 7.602 851 HB3 ASP 132 2HB ASP 132 -10.361 -1.732 8.420 852 H GLY 133 H GLY 133 -9.120 -5.287 6.614 853 HA2 GLY 133 1HA GLY 133 -11.329 -6.229 5.851 854 HA3 GLY 133 2HA GLY 133 -11.415 -4.868 4.730 855 H LEU 134 H LEU 134 -8.278 -5.217 4.428 856 HA LEU 134 HA LEU 134 -8.382 -7.520 2.526 857 HB3 LEU 134 2HB LEU 134 -6.548 -6.300 1.329 858 HG LEU 134 HG LEU 134 -9.200 -4.806 1.506 859 HD11 LEU 134 1HD1 LEU 134 -7.181 -3.500 0.698 860 HD12 LEU 134 2HD1 LEU 134 -8.501 -3.621 -0.445 861 HD13 LEU 134 3HD1 LEU 134 -7.062 -4.657 -0.649 862 HD21 LEU 134 3HD2 LEU 134 -9.776 -6.027 -0.580 863 HD22 LEU 134 1HD2 LEU 134 -9.459 -7.157 0.705 864 HD23 LEU 134 2HD2 LEU 134 -8.222 -6.864 -0.543 865 H ASN 135 H ASN 135 -6.728 -8.922 2.550 866 HA ASN 135 HA ASN 135 -5.708 -9.458 5.100 867 HB3 ASN 135 2HB ASN 135 -4.933 -10.770 2.466 868 HD21 ASN 135 1HD2 ASN 135 -3.110 -11.940 3.076 869 HD22 ASN 135 2HD2 ASN 135 -3.041 -12.980 4.489 870 H VAL 136 H VAL 136 -4.347 -7.781 5.751 871 HA VAL 136 HA VAL 136 -1.807 -7.245 4.492 872 HB VAL 136 HB VAL 136 -2.459 -6.998 7.469 873 HG11 VAL 136 1HG1 VAL 136 -0.729 -5.205 7.423 874 HG12 VAL 136 2HG1 VAL 136 -0.063 -6.767 6.983 875 HG13 VAL 136 3HG1 VAL 136 -0.408 -5.567 5.713 876 HG21 VAL 136 3HG2 VAL 136 -3.058 -4.670 7.131 877 HG22 VAL 136 1HG2 VAL 136 -2.848 -4.842 5.386 878 HG23 VAL 136 2HG2 VAL 136 -4.154 -5.705 6.222 879 H ILE 137 H ILE 137 -0.030 -8.490 4.487 880 HA ILE 137 HA ILE 137 0.529 -10.165 6.883 881 HB ILE 137 HB ILE 137 1.626 -11.888 5.503 882 HG13 ILE 137 2HG1 ILE 137 0.393 -10.412 3.137 883 HG21 ILE 137 1HG2 ILE 137 -0.649 -12.173 6.393 884 HG22 ILE 137 2HG2 ILE 137 -1.317 -11.455 4.914 885 HG23 ILE 137 3HG2 ILE 137 -0.464 -13.006 4.841 886 HD11 ILE 137 3HD1 ILE 137 3.145 -11.654 3.505 887 HD12 ILE 137 1HD1 ILE 137 2.531 -10.893 2.030 888 HD13 ILE 137 2HD1 ILE 137 2.814 -9.906 3.469 889 H GLY 138 H GLY 138 1.528 -7.493 5.088 890 HA2 GLY 138 1HA GLY 138 4.244 -7.760 6.254 891 HA3 GLY 138 2HA GLY 138 4.059 -7.538 4.502 892 H VAL 139 H VAL 139 5.005 -5.899 7.003 893 HA VAL 139 HA VAL 139 4.854 -3.430 5.709 894 HB VAL 139 HB VAL 139 2.761 -3.179 6.416 895 HG11 VAL 139 1HG1 VAL 139 3.411 -4.142 9.175 896 HG12 VAL 139 2HG1 VAL 139 1.884 -3.342 8.704 897 HG13 VAL 139 3HG1 VAL 139 2.326 -4.857 7.932 898 HG21 VAL 139 3HG2 VAL 139 4.392 -1.699 8.493 899 HG22 VAL 139 1HG2 VAL 139 4.140 -1.215 6.811 900 HG23 VAL 139 2HG2 VAL 139 2.765 -1.264 7.924 901 H ALA 140 H ALA 140 7.011 -3.391 5.747 902 HA ALA 140 HA ALA 140 8.390 -3.094 8.324 903 HB1 ALA 140 1HB ALA 140 9.254 -5.076 6.159 904 HB2 ALA 140 2HB ALA 140 10.177 -4.667 7.620 905 HB3 ALA 140 3HB ALA 140 8.621 -5.502 7.767 906 H ARG 141 H ARG 141 10.798 -2.424 7.740 907 HA ARG 141 HA ARG 141 10.737 -0.298 5.706 908 HB3 ARG 141 2HB ARG 141 12.812 -1.201 7.748 909 HG3 ARG 141 2HG ARG 141 12.700 1.407 6.195 910 HD3 ARG 141 2HD ARG 141 14.464 0.297 8.388 911 HE ARG 141 HE ARG 141 15.392 2.434 6.488 912 HH11 ARG 141 1HH1 ARG 141 16.213 -0.452 8.430 913 HH12 ARG 141 2HH1 ARG 141 17.899 -0.019 8.527 914 HH21 ARG 141 1HH2 ARG 141 17.737 2.737 6.369 915 HH22 ARG 141 2HH2 ARG 141 18.706 1.671 7.317 916 H ASP 142 H ASP 142 12.080 -0.308 3.949 917 HA ASP 142 HA ASP 142 13.019 -1.107 2.147 918 HB3 ASP 142 2HB ASP 142 14.962 -0.560 3.336 919 H ASP 143 H ASP 143 14.531 -3.755 1.920 920 HA ASP 143 HA ASP 143 12.087 -5.331 1.349 921 HB3 ASP 143 2HB ASP 143 12.778 -4.632 -0.711 922 H SER 144 H SER 144 13.790 -5.231 3.771 923 HA SER 144 HA SER 144 15.413 -7.474 4.011 924 HB3 SER 144 2HB SER 144 13.696 -6.557 6.320 925 HG SER 144 HG SER 144 16.523 -6.798 5.921 926 H GLU 145 H GLU 145 11.855 -7.279 4.092 927 HA GLU 145 HA GLU 145 11.675 -10.054 5.110 928 HB3 GLU 145 2HB GLU 145 9.389 -9.447 5.701 929 HG3 GLU 145 2HG GLU 145 10.973 -7.074 6.656 930 H VAL 146 H VAL 146 11.875 -9.003 2.030 931 HA VAL 146 HA VAL 146 9.338 -9.588 0.947 932 HB VAL 146 HB VAL 146 12.139 -9.432 -0.228 933 HG11 VAL 146 1HG1 VAL 146 10.944 -10.829 -1.810 934 HG12 VAL 146 2HG1 VAL 146 9.528 -9.753 -1.731 935 HG13 VAL 146 3HG1 VAL 146 11.052 -9.188 -2.470 936 HG21 VAL 146 3HG2 VAL 146 9.725 -7.575 -0.408 937 HG22 VAL 146 1HG2 VAL 146 11.090 -7.369 0.715 938 HG23 VAL 146 2HG2 VAL 146 11.371 -7.285 -1.025 939 H ASP 147 H ASP 147 12.024 -11.795 1.493 940 HA ASP 147 HA ASP 147 11.180 -14.138 0.335 941 HB3 ASP 147 2HB ASP 147 12.412 -13.874 3.115 942 H LYS 148 H LYS 148 10.222 -12.988 3.603 943 HA LYS 148 HA LYS 148 8.643 -15.328 4.158 944 HB3 LYS 148 2HB LYS 148 9.473 -14.023 6.041 945 HG3 LYS 148 2HG LYS 148 7.913 -11.787 4.810 946 HD3 LYS 148 2HD LYS 148 6.741 -12.256 6.976 947 HE3 LYS 148 2HE LYS 148 9.282 -11.071 8.180 948 HZ1 LYS 148 3HZ LYS 148 7.236 -10.678 9.367 949 HZ2 LYS 148 1HZ LYS 148 8.141 -11.759 10.218 950 HZ3 LYS 148 2HZ LYS 148 6.879 -12.308 9.358 951 H TRP 149 H TRP 149 7.961 -12.395 2.382 952 HA TRP 149 HA TRP 149 5.060 -12.887 2.343 953 HB3 TRP 149 2HB TRP 149 4.964 -10.824 1.168 954 HD1 TRP 149 HD TRP 149 5.208 -11.342 4.424 955 HE1 TRP 149 1HE TRP 149 5.697 -9.331 5.836 956 HE3 TRP 149 3HE TRP 149 7.279 -8.347 0.822 957 HZ2 TRP 149 2HZ TRP 149 6.882 -6.646 5.475 958 HZ3 TRP 149 3HZ TRP 149 7.849 -6.031 1.301 959 HH2 TRP 149 HH TRP 149 7.718 -5.152 3.656 960 H SER 150 H SER 150 7.262 -14.704 0.938 961 HA SER 150 HA SER 150 5.872 -14.852 -1.664 962 HB3 SER 150 2HB SER 150 8.908 -14.800 -1.586 963 HG SER 150 HG SER 150 6.987 -14.029 -3.549 964 H LYS 151 H LYS 151 7.900 -16.336 0.824 965 HA LYS 151 HA LYS 151 8.145 -18.947 -0.092 966 HB3 LYS 151 2HB LYS 151 9.088 -18.056 1.972 967 HG3 LYS 151 2HG LYS 151 6.653 -17.049 2.674 968 HD3 LYS 151 2HD LYS 151 6.841 -18.784 4.998 969 HE3 LYS 151 2HE LYS 151 4.425 -19.115 4.679 970 HZ1 LYS 151 3HZ LYS 151 5.040 -16.328 3.965 971 HZ2 LYS 151 1HZ LYS 151 5.145 -16.919 5.501 972 HZ3 LYS 151 2HZ LYS 151 3.689 -16.902 4.719 Start of MODEL 20 1 H1 GLY 1 H GLY 1 -5.021 -22.638 -6.504 2 HA2 GLY 1 1HA GLY 1 -5.302 -22.027 -9.385 3 HA3 GLY 1 2HA GLY 1 -4.743 -20.882 -8.151 4 H MET 2 H MET 2 -3.405 -21.634 -10.549 5 HA MET 2 HA MET 2 -0.830 -22.578 -9.497 6 HB3 MET 2 2HB MET 2 -1.764 -24.623 -10.330 7 HG3 MET 2 2HG MET 2 -2.215 -24.805 -12.849 8 HE1 MET 2 3HE MET 2 -6.074 -23.238 -12.987 9 HE2 MET 2 1HE MET 2 -4.565 -22.305 -13.122 10 HE3 MET 2 2HE MET 2 -4.769 -23.799 -14.067 11 H ALA 3 H ALA 3 -1.621 -20.034 -9.918 12 HA ALA 3 HA ALA 3 0.706 -19.303 -11.324 13 HB1 ALA 3 1HB ALA 3 -1.906 -17.953 -12.124 14 HB2 ALA 3 2HB ALA 3 -0.322 -17.166 -12.265 15 HB3 ALA 3 3HB ALA 3 -0.641 -18.630 -13.180 16 H LYS 4 H LYS 4 1.703 -18.340 -9.715 17 HA LYS 4 HA LYS 4 0.153 -16.416 -8.062 18 HB3 LYS 4 2HB LYS 4 0.678 -18.206 -6.659 19 HG3 LYS 4 2HG LYS 4 3.307 -18.272 -7.739 20 HD3 LYS 4 2HD LYS 4 3.844 -16.527 -5.937 21 HE3 LYS 4 2HE LYS 4 4.220 -18.087 -3.715 22 HZ1 LYS 4 3HZ LYS 4 3.330 -15.869 -3.719 23 HZ2 LYS 4 1HZ LYS 4 2.569 -16.814 -2.668 24 HZ3 LYS 4 2HZ LYS 4 1.784 -16.432 -4.054 25 H LYS 5 H LYS 5 0.373 -14.802 -9.322 26 HA LYS 5 HA LYS 5 2.928 -13.583 -10.109 27 HB3 LYS 5 2HB LYS 5 1.505 -11.708 -10.834 28 HG3 LYS 5 2HG LYS 5 -0.483 -12.786 -12.021 29 HD3 LYS 5 2HD LYS 5 2.320 -13.824 -12.494 30 HE3 LYS 5 2HE LYS 5 0.758 -15.103 -13.904 31 HZ1 LYS 5 3HZ LYS 5 0.010 -13.356 -15.781 32 HZ2 LYS 5 1HZ LYS 5 -0.286 -12.460 -14.439 33 HZ3 LYS 5 2HZ LYS 5 -1.002 -13.963 -14.648 34 H THR 6 H THR 6 3.058 -11.279 -9.533 35 HA THR 6 HA THR 6 1.847 -10.412 -7.061 36 HB THR 6 HB THR 6 4.851 -10.685 -7.204 37 HG1 THR 6 1HG THR 6 3.077 -12.255 -6.247 38 HG21 THR 6 3HG2 THR 6 4.798 -9.592 -4.880 39 HG22 THR 6 1HG2 THR 6 3.167 -9.036 -5.255 40 HG23 THR 6 2HG2 THR 6 4.543 -8.486 -6.238 41 H LEU 7 H LEU 7 1.684 -8.118 -6.988 42 HA LEU 7 HA LEU 7 2.913 -6.623 -9.260 43 HB3 LEU 7 2HB LEU 7 0.391 -5.923 -7.715 44 HG LEU 7 HG LEU 7 1.480 -3.907 -8.648 45 HD11 LEU 7 1HD1 LEU 7 1.495 -5.490 -11.244 46 HD12 LEU 7 2HD1 LEU 7 2.800 -4.547 -10.490 47 HD13 LEU 7 3HD1 LEU 7 1.455 -3.719 -11.238 48 HD21 LEU 7 3HD2 LEU 7 -0.952 -4.805 -10.226 49 HD22 LEU 7 1HD2 LEU 7 -0.414 -3.127 -10.004 50 HD23 LEU 7 2HD2 LEU 7 -0.949 -4.062 -8.609 51 H ILE 8 H ILE 8 3.946 -4.700 -8.677 52 HA ILE 8 HA ILE 8 3.968 -3.951 -5.796 53 HB ILE 8 HB ILE 8 6.305 -3.762 -7.743 54 HG13 ILE 8 2HG1 ILE 8 5.621 -5.803 -5.685 55 HG21 ILE 8 1HG2 ILE 8 6.152 -1.857 -6.102 56 HG22 ILE 8 2HG2 ILE 8 6.152 -3.038 -4.785 57 HG23 ILE 8 3HG2 ILE 8 7.575 -2.871 -5.833 58 HD11 ILE 8 3HD1 ILE 8 7.716 -5.745 -7.898 59 HD12 ILE 8 1HD1 ILE 8 7.354 -7.136 -6.873 60 HD13 ILE 8 2HD1 ILE 8 6.104 -6.514 -7.951 61 H LEU 9 H LEU 9 3.139 -1.847 -5.551 62 HA LEU 9 HA LEU 9 2.931 -0.114 -7.938 63 HB3 LEU 9 2HB LEU 9 0.988 0.829 -6.593 64 HG LEU 9 HG LEU 9 0.623 -2.060 -7.495 65 HD11 LEU 9 1HD1 LEU 9 -1.268 0.263 -6.970 66 HD12 LEU 9 2HD1 LEU 9 -1.205 -1.319 -6.169 67 HD13 LEU 9 3HD1 LEU 9 -1.730 -1.228 -7.848 68 HD21 LEU 9 3HD2 LEU 9 0.709 0.573 -9.031 69 HD22 LEU 9 1HD2 LEU 9 -0.184 -0.850 -9.642 70 HD23 LEU 9 2HD2 LEU 9 1.546 -0.948 -9.363 71 H TYR 10 H TYR 10 4.558 1.284 -7.710 72 HA TYR 10 HA TYR 10 5.106 2.516 -5.049 73 HB3 TYR 10 2HB TYR 10 7.028 1.330 -5.742 74 HD1 TYR 10 1HD TYR 10 6.477 -0.241 -7.534 75 HD2 TYR 10 2HD TYR 10 7.775 3.776 -8.360 76 HE1 TYR 10 1HE TYR 10 7.012 -0.898 -9.856 77 HE2 TYR 10 2HE TYR 10 8.321 3.117 -10.706 78 HH TYR 10 HH TYR 10 8.123 1.388 -12.315 79 H TYR 11 H TYR 11 4.651 4.727 -4.915 80 HA TYR 11 HA TYR 11 3.614 5.944 -7.351 81 HB3 TYR 11 2HB TYR 11 2.549 5.727 -4.974 82 HD1 TYR 11 2HD TYR 11 4.925 6.262 -3.560 83 HD2 TYR 11 1HD TYR 11 1.913 9.082 -4.775 84 HE1 TYR 11 2HE TYR 11 5.585 7.714 -1.690 85 HE2 TYR 11 1HE TYR 11 2.614 10.591 -2.941 86 HH TYR 11 HH TYR 11 3.932 10.787 -0.983 87 H SER 12 H SER 12 4.142 8.536 -7.237 88 HA SER 12 HA SER 12 5.648 10.137 -7.730 89 HB3 SER 12 2HB SER 12 7.311 8.658 -5.672 90 HG SER 12 HG SER 12 7.633 11.354 -6.408 91 H TRP 13 H TRP 13 5.990 9.693 -9.981 92 HA TRP 13 HA TRP 13 8.213 7.982 -10.697 93 HB3 TRP 13 2HB TRP 13 7.298 10.138 -12.571 94 HD1 TRP 13 HD TRP 13 9.156 6.855 -12.143 95 HE1 TRP 13 1HE TRP 13 9.975 5.984 -14.371 96 HE3 TRP 13 3HE TRP 13 6.574 10.010 -15.253 97 HZ2 TRP 13 2HZ TRP 13 9.674 6.614 -17.162 98 HZ3 TRP 13 3HZ TRP 13 6.871 9.816 -17.726 99 HH2 TRP 13 HH TRP 13 8.431 8.149 -18.675 100 H SER 14 H SER 14 8.244 10.854 -9.001 101 HA SER 14 HA SER 14 10.754 11.884 -9.940 102 HB3 SER 14 2HB SER 14 9.888 11.977 -7.055 103 HG SER 14 HG SER 14 11.851 12.961 -7.585 104 H GLY 15 H GLY 15 9.835 8.837 -8.431 105 HA2 GLY 15 1HA GLY 15 11.240 6.986 -8.449 106 HA3 GLY 15 2HA GLY 15 12.611 8.026 -8.824 107 H GLU 16 H GLU 16 10.362 8.557 -6.078 108 HA GLU 16 HA GLU 16 12.501 8.661 -4.173 109 HB3 GLU 16 2HB GLU 16 10.362 9.817 -3.924 110 HG3 GLU 16 2HG GLU 16 8.935 7.499 -4.389 111 H THR 17 H THR 17 10.267 6.098 -5.220 112 HA THR 17 HA THR 17 11.710 4.050 -3.675 113 HB THR 17 HB THR 17 9.489 2.810 -4.437 114 HG1 THR 17 1HG THR 17 7.827 4.619 -4.321 115 HG21 THR 17 3HG2 THR 17 8.439 3.760 -2.394 116 HG22 THR 17 1HG2 THR 17 9.700 5.002 -2.358 117 HG23 THR 17 2HG2 THR 17 10.149 3.305 -2.182 118 H LYS 18 H LYS 18 12.271 5.297 -6.496 119 HA LYS 18 HA LYS 18 12.799 2.820 -7.958 120 HB3 LYS 18 2HB LYS 18 14.235 5.520 -8.086 121 HG3 LYS 18 2HG LYS 18 14.336 2.980 -9.735 122 HD3 LYS 18 2HD LYS 18 15.512 4.429 -11.479 123 HE3 LYS 18 2HE LYS 18 13.530 5.062 -12.753 124 HZ1 LYS 18 3HZ LYS 18 13.997 2.604 -12.548 125 HZ2 LYS 18 1HZ LYS 18 12.438 2.964 -12.853 126 HZ3 LYS 18 2HZ LYS 18 12.819 2.560 -11.361 127 H LYS 19 H LYS 19 15.223 1.955 -7.889 128 HA LYS 19 HA LYS 19 16.442 0.651 -6.644 129 HB3 LYS 19 2HB LYS 19 16.441 2.270 -4.113 130 HG3 LYS 19 2HG LYS 19 18.942 2.287 -4.670 131 HD3 LYS 19 2HD LYS 19 17.349 0.139 -3.573 132 HE3 LYS 19 2HE LYS 19 18.219 -1.152 -5.509 133 HZ1 LYS 19 3HZ LYS 19 20.526 -1.677 -5.575 134 HZ2 LYS 19 1HZ LYS 19 20.904 -0.765 -4.298 135 HZ3 LYS 19 2HZ LYS 19 20.447 -0.052 -5.703 136 H MET 20 H MET 20 14.285 1.939 -4.048 137 HA MET 20 HA MET 20 14.305 -0.698 -3.059 138 HB3 MET 20 2HB MET 20 12.316 1.294 -1.991 139 HG3 MET 20 2HG MET 20 12.975 -0.949 -0.830 140 HE1 MET 20 3HE MET 20 16.446 -2.278 -0.501 141 HE2 MET 20 1HE MET 20 14.758 -2.488 -1.003 142 HE3 MET 20 2HE MET 20 15.905 -1.609 -2.048 143 H ALA 21 H ALA 21 12.099 0.425 -5.433 144 HA ALA 21 HA ALA 21 10.255 -1.848 -4.784 145 HB1 ALA 21 1HB ALA 21 8.811 -0.820 -6.478 146 HB2 ALA 21 2HB ALA 21 9.260 0.388 -5.252 147 HB3 ALA 21 3HB ALA 21 10.051 0.395 -6.844 148 H GLU 22 H GLU 22 12.712 -0.737 -7.055 149 HA GLU 22 HA GLU 22 12.105 -2.491 -9.274 150 HB3 GLU 22 2HB GLU 22 14.601 -1.854 -9.764 151 HG3 GLU 22 2HG GLU 22 14.029 0.646 -9.940 152 H LYS 23 H LYS 23 14.135 -2.699 -6.379 153 HA LYS 23 HA LYS 23 15.524 -5.062 -6.903 154 HB3 LYS 23 2HB LYS 23 15.332 -5.229 -4.318 155 HG3 LYS 23 2HG LYS 23 16.434 -3.010 -3.821 156 HD3 LYS 23 2HD LYS 23 17.691 -5.093 -4.519 157 HE3 LYS 23 2HE LYS 23 18.800 -3.967 -6.933 158 HZ1 LYS 23 3HZ LYS 23 17.888 -6.070 -7.891 159 HZ2 LYS 23 1HZ LYS 23 17.248 -6.423 -6.407 160 HZ3 LYS 23 2HZ LYS 23 18.855 -6.282 -6.579 161 H ILE 24 H ILE 24 12.564 -4.905 -4.993 162 HA ILE 24 HA ILE 24 12.289 -7.591 -4.759 163 HB ILE 24 HB ILE 24 10.102 -5.420 -4.826 164 HG13 ILE 24 2HG1 ILE 24 12.202 -6.215 -2.845 165 HG21 ILE 24 1HG2 ILE 24 8.924 -7.469 -4.906 166 HG22 ILE 24 2HG2 ILE 24 10.057 -8.274 -3.811 167 HG23 ILE 24 3HG2 ILE 24 8.937 -7.049 -3.193 168 HD11 ILE 24 3HD1 ILE 24 11.782 -3.952 -1.986 169 HD12 ILE 24 1HD1 ILE 24 12.065 -3.890 -3.736 170 HD13 ILE 24 2HD1 ILE 24 10.411 -3.762 -3.096 171 H ASN 25 H ASN 25 11.085 -5.564 -7.418 172 HA ASN 25 HA ASN 25 9.392 -7.340 -8.779 173 HB3 ASN 25 2HB ASN 25 11.442 -5.347 -9.822 174 HD21 ASN 25 1HD2 ASN 25 8.822 -7.621 -10.788 175 HD22 ASN 25 2HD2 ASN 25 9.147 -7.584 -12.465 176 H SER 26 H SER 26 12.982 -7.166 -8.926 177 HA SER 26 HA SER 26 13.302 -9.127 -10.885 178 HB3 SER 26 2HB SER 26 15.632 -8.927 -9.338 179 HG SER 26 HG SER 26 14.838 -7.123 -11.366 180 H GLU 27 H GLU 27 12.384 -9.503 -7.601 181 HA GLU 27 HA GLU 27 14.003 -11.927 -7.150 182 HB3 GLU 27 2HB GLU 27 13.815 -11.257 -4.774 183 HG3 GLU 27 2HG GLU 27 14.788 -9.060 -6.667 184 H ILE 28 H ILE 28 10.871 -11.119 -7.917 185 HA ILE 28 HA ILE 28 9.723 -13.490 -6.504 186 HB ILE 28 HB ILE 28 8.322 -10.994 -7.515 187 HG13 ILE 28 2HG1 ILE 28 9.702 -10.657 -5.401 188 HG21 ILE 28 1HG2 ILE 28 6.845 -12.885 -7.729 189 HG22 ILE 28 2HG2 ILE 28 7.297 -13.516 -6.124 190 HG23 ILE 28 3HG2 ILE 28 6.341 -12.051 -6.281 191 HD11 ILE 28 3HD1 ILE 28 8.055 -9.587 -4.105 192 HD12 ILE 28 1HD1 ILE 28 7.535 -9.413 -5.791 193 HD13 ILE 28 2HD1 ILE 28 6.764 -10.606 -4.714 194 H LYS 29 H LYS 29 8.827 -15.031 -7.809 195 HA LYS 29 HA LYS 29 9.389 -14.922 -10.652 196 HB3 LYS 29 2HB LYS 29 7.699 -16.841 -9.071 197 HG3 LYS 29 2HG LYS 29 8.806 -17.108 -11.856 198 HD3 LYS 29 2HD LYS 29 8.428 -19.207 -9.741 199 HE3 LYS 29 2HE LYS 29 7.996 -20.778 -11.847 200 HZ1 LYS 29 3HZ LYS 29 5.866 -19.391 -10.356 201 HZ2 LYS 29 1HZ LYS 29 6.553 -20.861 -10.021 202 HZ3 LYS 29 2HZ LYS 29 5.616 -20.672 -11.364 203 H ASP 30 H ASP 30 8.009 -14.695 -12.247 204 HA ASP 30 HA ASP 30 6.332 -13.735 -13.479 205 HB3 ASP 30 2HB ASP 30 4.148 -14.946 -11.867 206 H SER 31 H SER 31 7.295 -11.969 -11.364 207 HA SER 31 HA SER 31 5.173 -10.483 -10.240 208 HB3 SER 31 2HB SER 31 7.361 -10.706 -9.325 209 HG SER 31 HG SER 31 9.228 -9.920 -10.416 210 H GLU 32 H GLU 32 4.813 -8.170 -10.770 211 HA GLU 32 HA GLU 32 5.666 -7.044 -13.345 212 HB3 GLU 32 2HB GLU 32 3.141 -6.051 -13.326 213 HG3 GLU 32 2HG GLU 32 4.160 -8.598 -14.538 214 H LEU 33 H LEU 33 6.040 -4.781 -13.135 215 HA LEU 33 HA LEU 33 5.477 -3.655 -10.480 216 HB3 LEU 33 2HB LEU 33 7.901 -4.417 -10.955 217 HG LEU 33 HG LEU 33 7.933 -1.780 -12.501 218 HD11 LEU 33 1HD1 LEU 33 9.656 -1.777 -10.718 219 HD12 LEU 33 2HD1 LEU 33 10.367 -1.867 -12.315 220 HD13 LEU 33 3HD1 LEU 33 10.287 -3.329 -11.326 221 HD21 LEU 33 3HD2 LEU 33 8.705 -4.643 -13.137 222 HD22 LEU 33 1HD2 LEU 33 9.339 -3.256 -14.073 223 HD23 LEU 33 2HD2 LEU 33 7.606 -3.589 -14.020 224 H LYS 34 H LYS 34 4.339 -1.824 -10.523 225 HA LYS 34 HA LYS 34 4.246 -0.221 -12.998 226 HB3 LYS 34 2HB LYS 34 1.739 -0.097 -12.740 227 HG3 LYS 34 2HG LYS 34 1.153 -2.439 -13.519 228 HD3 LYS 34 2HD LYS 34 3.025 -2.587 -15.392 229 HE3 LYS 34 2HE LYS 34 1.040 -0.277 -15.431 230 HZ1 LYS 34 3HZ LYS 34 2.067 -2.069 -17.567 231 HZ2 LYS 34 1HZ LYS 34 2.428 -0.479 -17.425 232 HZ3 LYS 34 2HZ LYS 34 0.900 -0.946 -17.778 233 H GLU 35 H GLU 35 3.119 1.851 -12.484 234 HA GLU 35 HA GLU 35 3.868 2.616 -9.697 235 HB3 GLU 35 2HB GLU 35 5.380 3.393 -11.587 236 HG3 GLU 35 2HG GLU 35 3.100 5.386 -11.979 237 H VAL 36 H VAL 36 2.708 4.302 -8.687 238 HA VAL 36 HA VAL 36 -0.087 4.516 -9.682 239 HB VAL 36 HB VAL 36 0.502 3.101 -7.633 240 HG11 VAL 36 1HG1 VAL 36 2.004 4.310 -6.520 241 HG12 VAL 36 2HG1 VAL 36 0.678 5.458 -6.013 242 HG13 VAL 36 3HG1 VAL 36 0.666 3.734 -5.563 243 HG21 VAL 36 3HG2 VAL 36 -1.528 5.325 -7.126 244 HG22 VAL 36 1HG2 VAL 36 -1.852 4.024 -8.282 245 HG23 VAL 36 2HG2 VAL 36 -1.620 3.648 -6.566 246 H LYS 37 H LYS 37 -1.163 6.692 -9.389 247 HA LYS 37 HA LYS 37 0.729 8.906 -8.725 248 HB3 LYS 37 2HB LYS 37 -0.715 10.195 -10.413 249 HG3 LYS 37 2HG LYS 37 1.118 7.969 -11.399 250 HD3 LYS 37 2HD LYS 37 -0.445 10.084 -12.912 251 HE3 LYS 37 2HE LYS 37 1.106 9.624 -14.822 252 HZ1 LYS 37 3HZ LYS 37 2.450 11.384 -14.283 253 HZ2 LYS 37 1HZ LYS 37 2.657 10.967 -12.717 254 HZ3 LYS 37 2HZ LYS 37 1.226 11.607 -13.240 255 H VAL 38 H VAL 38 -0.676 10.896 -8.128 256 HA VAL 38 HA VAL 38 -3.002 10.002 -6.512 257 HB VAL 38 HB VAL 38 -2.750 12.464 -5.604 258 HG11 VAL 38 1HG1 VAL 38 -1.492 11.525 -3.712 259 HG12 VAL 38 2HG1 VAL 38 -2.766 10.443 -4.288 260 HG13 VAL 38 3HG1 VAL 38 -1.067 10.106 -4.704 261 HG21 VAL 38 3HG2 VAL 38 0.179 11.804 -6.149 262 HG22 VAL 38 1HG2 VAL 38 -0.773 13.002 -7.052 263 HG23 VAL 38 2HG2 VAL 38 -0.486 13.221 -5.321 264 H SER 39 H SER 39 -4.935 11.283 -6.663 265 HA SER 39 HA SER 39 -5.439 12.614 -9.246 266 HB3 SER 39 2HB SER 39 -7.358 12.095 -6.961 267 HG SER 39 HG SER 39 -8.827 12.155 -8.487 268 H GLU 40 H GLU 40 -7.322 14.466 -8.451 269 HA GLU 40 HA GLU 40 -6.303 16.069 -6.221 270 HB3 GLU 40 2HB GLU 40 -5.118 16.829 -8.238 271 HG3 GLU 40 2HG GLU 40 -7.536 18.234 -9.250 272 H GLY 41 H GLY 41 -8.058 18.179 -6.312 273 HA2 GLY 41 1HA GLY 41 -10.607 16.828 -5.697 274 HA3 GLY 41 2HA GLY 41 -10.127 18.457 -5.260 275 H THR 42 H THR 42 -10.802 20.147 -6.469 276 HA THR 42 HA THR 42 -12.194 19.707 -9.040 277 HB THR 42 HB THR 42 -12.080 22.430 -7.901 278 HG1 THR 42 1HG THR 42 -13.491 20.538 -6.340 279 HG21 THR 42 3HG2 THR 42 -13.669 21.715 -9.647 280 HG22 THR 42 1HG2 THR 42 -14.471 22.387 -8.213 281 HG23 THR 42 2HG2 THR 42 -14.448 20.624 -8.481 282 H PHE 43 H PHE 43 -9.211 20.561 -7.769 283 HA PHE 43 HA PHE 43 -7.550 22.001 -8.090 284 HB3 PHE 43 2HB PHE 43 -7.962 21.555 -11.026 285 HD1 PHE 43 2HD PHE 43 -5.119 20.860 -8.722 286 HD2 PHE 43 1HD PHE 43 -6.701 23.482 -11.767 287 HE1 PHE 43 2HE PHE 43 -2.878 21.930 -8.991 288 HE2 PHE 43 1HE PHE 43 -4.473 24.535 -12.012 289 HZ PHE 43 HZ PHE 43 -2.568 23.712 -10.650 290 H ASP 44 H ASP 44 -8.830 23.785 -7.174 291 HA ASP 44 HA ASP 44 -9.830 25.781 -9.134 292 HB3 ASP 44 2HB ASP 44 -9.653 25.678 -6.110 293 H ALA 45 H ALA 45 -7.780 26.680 -6.341 294 HA ALA 45 HA ALA 45 -5.481 27.279 -8.126 295 HB1 ALA 45 1HB ALA 45 -6.825 29.343 -8.057 296 HB2 ALA 45 2HB ALA 45 -6.853 29.290 -6.281 297 HB3 ALA 45 3HB ALA 45 -5.319 29.540 -7.141 298 H ASP 46 H ASP 46 -3.602 26.741 -7.152 299 HA ASP 46 HA ASP 46 -2.223 25.682 -5.782 300 HB3 ASP 46 2HB ASP 46 -3.263 27.225 -3.412 301 H MET 47 H MET 47 -4.771 24.371 -6.237 302 HA MET 47 HA MET 47 -5.660 23.414 -3.604 303 HB3 MET 47 2HB MET 47 -6.784 22.460 -6.211 304 HG3 MET 47 2HG MET 47 -8.306 23.558 -3.859 305 HE1 MET 47 3HE MET 47 -10.163 21.737 -2.981 306 HE2 MET 47 1HE MET 47 -10.855 23.143 -3.794 307 HE3 MET 47 2HE MET 47 -11.486 21.520 -4.148 308 H TYR 48 H TYR 48 -3.434 22.313 -5.988 309 HA TYR 48 HA TYR 48 -3.743 19.453 -5.330 310 HB3 TYR 48 2HB TYR 48 -1.581 20.877 -6.919 311 HD1 TYR 48 1HD TYR 48 -3.545 17.685 -7.045 312 HD2 TYR 48 2HD TYR 48 0.362 19.481 -6.871 313 HE1 TYR 48 1HE TYR 48 -2.544 15.512 -7.661 314 HE2 TYR 48 2HE TYR 48 1.384 17.316 -7.499 315 HH TYR 48 HH TYR 48 0.947 15.217 -8.407 316 H LYS 49 H LYS 49 -3.455 19.302 -3.160 317 HA LYS 49 HA LYS 49 -0.857 20.083 -1.999 318 HB3 LYS 49 2HB LYS 49 -2.093 21.935 -1.269 319 HG3 LYS 49 2HG LYS 49 -4.486 20.096 -0.901 320 HD3 LYS 49 2HD LYS 49 -3.881 22.717 0.509 321 HE3 LYS 49 2HE LYS 49 -6.215 22.607 -0.421 322 HZ1 LYS 49 3HZ LYS 49 -6.695 20.229 -0.042 323 HZ2 LYS 49 1HZ LYS 49 -7.759 21.203 0.703 324 HZ3 LYS 49 2HZ LYS 49 -6.611 20.445 1.587 325 H THR 50 H THR 50 -0.636 17.861 -2.594 326 HA THR 50 HA THR 50 -1.606 16.011 -0.558 327 HB THR 50 HB THR 50 -3.128 15.822 -2.301 328 HG1 THR 50 1HG THR 50 -1.279 13.718 -2.740 329 HG21 THR 50 3HG2 THR 50 -2.164 16.756 -4.263 330 HG22 THR 50 1HG2 THR 50 -2.776 15.133 -4.578 331 HG23 THR 50 2HG2 THR 50 -1.021 15.403 -4.407 332 H SER 51 H SER 51 0.494 16.908 0.149 333 HA SER 51 HA SER 51 2.812 16.140 -1.560 334 HB3 SER 51 2HB SER 51 3.656 18.385 -1.094 335 HG SER 51 HG SER 51 2.177 19.504 -2.332 336 H ASP 52 H ASP 52 4.625 15.498 -0.561 337 HA ASP 52 HA ASP 52 3.668 13.998 1.657 338 HB3 ASP 52 2HB ASP 52 5.255 12.356 0.859 339 H ILE 53 H ILE 53 4.013 15.432 3.410 340 HA ILE 53 HA ILE 53 6.848 15.637 4.327 341 HB ILE 53 HB ILE 53 6.228 17.961 5.173 342 HG13 ILE 53 2HG1 ILE 53 3.708 17.686 4.463 343 HG21 ILE 53 1HG2 ILE 53 6.553 17.523 2.173 344 HG22 ILE 53 2HG2 ILE 53 7.056 18.952 3.103 345 HG23 ILE 53 3HG2 ILE 53 7.855 17.410 3.372 346 HD11 ILE 53 3HD1 ILE 53 4.592 19.818 5.295 347 HD12 ILE 53 1HD1 ILE 53 5.229 20.208 3.689 348 HD13 ILE 53 2HD1 ILE 53 3.484 20.056 3.923 349 H ALA 54 H ALA 54 3.571 16.387 5.777 350 HA ALA 54 HA ALA 54 4.283 14.774 8.104 351 HB1 ALA 54 1HB ALA 54 4.440 17.803 8.280 352 HB2 ALA 54 2HB ALA 54 4.267 16.717 9.688 353 HB3 ALA 54 3HB ALA 54 5.694 16.605 8.658 354 H LEU 55 H LEU 55 2.352 17.821 7.957 355 HA LEU 55 HA LEU 55 0.069 16.484 9.109 356 HB3 LEU 55 2HB LEU 55 -0.348 19.262 8.750 357 HG LEU 55 HG LEU 55 0.673 19.549 10.959 358 HD11 LEU 55 1HD1 LEU 55 -1.748 18.986 10.598 359 HD12 LEU 55 2HD1 LEU 55 -1.141 18.422 12.164 360 HD13 LEU 55 3HD1 LEU 55 -1.364 17.273 10.822 361 HD21 LEU 55 3HD2 LEU 55 0.985 16.535 11.098 362 HD22 LEU 55 1HD2 LEU 55 1.201 17.718 12.395 363 HD23 LEU 55 2HD2 LEU 55 2.314 17.729 11.001 364 H ASP 56 H ASP 56 0.762 16.327 5.990 365 HA ASP 56 HA ASP 56 -0.756 18.122 4.601 366 HB3 ASP 56 2HB ASP 56 -0.181 15.270 3.773 367 H GLN 57 H GLN 57 -1.949 14.717 4.976 368 HA GLN 57 HA GLN 57 -4.693 15.826 5.230 369 HB3 GLN 57 2HB GLN 57 -4.088 13.270 3.722 370 HG3 GLN 57 2HG GLN 57 -6.090 13.914 2.483 371 HE21 GLN 57 1HE2 GLN 57 -8.289 15.061 4.089 372 HE22 GLN 57 2HE2 GLN 57 -8.670 13.855 5.337 373 H ILE 58 H ILE 58 -4.576 15.660 7.445 374 HA ILE 58 HA ILE 58 -5.042 12.929 8.502 375 HB ILE 58 HB ILE 58 -2.968 14.908 9.558 376 HG13 ILE 58 2HG1 ILE 58 -2.808 12.313 8.109 377 HG21 ILE 58 1HG2 ILE 58 -4.077 12.460 10.977 378 HG22 ILE 58 2HG2 ILE 58 -2.676 13.426 11.502 379 HG23 ILE 58 3HG2 ILE 58 -4.292 14.134 11.464 380 HD11 ILE 58 3HD1 ILE 58 -1.698 14.466 7.393 381 HD12 ILE 58 1HD1 ILE 58 -0.684 14.345 8.844 382 HD13 ILE 58 2HD1 ILE 58 -0.590 13.105 7.575 383 H GLN 59 H GLN 59 -4.717 16.429 9.452 384 HA GLN 59 HA GLN 59 -7.222 16.167 10.954 385 HB3 GLN 59 2HB GLN 59 -5.800 16.001 12.700 386 HG3 GLN 59 2HG GLN 59 -3.872 17.991 11.448 387 HE21 GLN 59 1HE2 GLN 59 -3.759 15.356 14.028 388 HE22 GLN 59 2HE2 GLN 59 -3.039 16.409 15.204 389 H GLY 60 H GLY 60 -8.622 17.289 9.988 390 HA2 GLY 60 1HA GLY 60 -9.712 19.288 9.681 391 HA3 GLY 60 2HA GLY 60 -8.182 20.166 9.679 392 H ASN 61 H ASN 61 -7.228 17.912 7.635 393 HA ASN 61 HA ASN 61 -7.857 19.662 5.372 394 HB3 ASN 61 2HB ASN 61 -6.587 16.951 5.060 395 HD21 ASN 61 1HD2 ASN 61 -4.432 17.599 3.567 396 HD22 ASN 61 2HD2 ASN 61 -4.917 18.269 2.047 397 H LYS 62 H LYS 62 -8.815 18.948 3.271 398 HA LYS 62 HA LYS 62 -11.550 18.054 3.906 399 HB3 LYS 62 2HB LYS 62 -11.883 18.828 1.475 400 HG3 LYS 62 2HG LYS 62 -12.637 20.334 3.196 401 HD3 LYS 62 2HD LYS 62 -10.938 22.420 3.383 402 HE3 LYS 62 2HE LYS 62 -10.135 21.612 5.569 403 HZ1 LYS 62 3HZ LYS 62 -12.956 20.833 5.262 404 HZ2 LYS 62 1HZ LYS 62 -12.458 22.416 5.280 405 HZ3 LYS 62 2HZ LYS 62 -12.214 21.437 6.583 406 H ASP 63 H ASP 63 -10.800 15.768 4.160 407 HA ASP 63 HA ASP 63 -10.551 13.606 3.453 408 HB3 ASP 63 2HB ASP 63 -11.638 12.801 1.455 409 H PHE 64 H PHE 64 -9.713 12.398 1.064 410 HA PHE 64 HA PHE 64 -7.187 13.791 0.381 411 HB3 PHE 64 2HB PHE 64 -6.371 12.002 1.615 412 HD1 PHE 64 2HD PHE 64 -8.417 9.983 -0.731 413 HD2 PHE 64 1HD PHE 64 -7.398 10.837 3.345 414 HE1 PHE 64 2HE PHE 64 -9.867 8.079 0.030 415 HE2 PHE 64 1HE PHE 64 -8.825 8.984 4.117 416 HZ PHE 64 HZ PHE 64 -10.151 7.639 2.447 417 HA PRO 65 HA PRO 65 -8.467 13.247 -3.849 418 HB3 PRO 65 2HB PRO 65 -6.627 14.294 -4.610 419 HG3 PRO 65 2HG PRO 65 -4.610 14.196 -3.413 420 HD3 PRO 65 2HD PRO 65 -6.177 14.598 -1.662 421 H GLU 66 H GLU 66 -8.559 11.511 -5.539 422 HA GLU 66 HA GLU 66 -8.402 8.793 -4.487 423 HB3 GLU 66 2HB GLU 66 -8.732 8.302 -7.049 424 HG3 GLU 66 2HG GLU 66 -11.149 9.720 -6.144 425 H ILE 67 H ILE 67 -7.111 7.286 -6.233 426 HA ILE 67 HA ILE 67 -4.510 8.521 -6.861 427 HB ILE 67 HB ILE 67 -3.649 6.193 -6.973 428 HG13 ILE 67 2HG1 ILE 67 -6.452 5.502 -6.176 429 HG21 ILE 67 1HG2 ILE 67 -3.218 7.656 -5.062 430 HG22 ILE 67 2HG2 ILE 67 -4.678 7.071 -4.242 431 HG23 ILE 67 3HG2 ILE 67 -3.334 5.965 -4.586 432 HD11 ILE 67 3HD1 ILE 67 -5.997 3.438 -7.237 433 HD12 ILE 67 1HD1 ILE 67 -5.582 4.763 -8.336 434 HD13 ILE 67 2HD1 ILE 67 -4.286 3.888 -7.488 435 H GLN 68 H GLN 68 -3.701 7.828 -8.865 436 HA GLN 68 HA GLN 68 -5.701 6.897 -10.850 437 HB3 GLN 68 2HB GLN 68 -4.220 8.181 -12.484 438 HG3 GLN 68 2HG GLN 68 -5.487 10.107 -12.456 439 HE21 GLN 68 1HE2 GLN 68 -7.440 10.373 -9.848 440 HE22 GLN 68 2HE2 GLN 68 -8.657 9.170 -10.210 441 H LEU 69 H LEU 69 -4.705 5.678 -12.564 442 HA LEU 69 HA LEU 69 -2.093 4.644 -12.381 443 HB3 LEU 69 2HB LEU 69 -3.233 3.506 -10.351 444 HG LEU 69 HG LEU 69 -4.363 1.713 -12.532 445 HD11 LEU 69 1HD1 LEU 69 -5.183 0.348 -10.704 446 HD12 LEU 69 2HD1 LEU 69 -4.466 1.436 -9.506 447 HD13 LEU 69 3HD1 LEU 69 -3.443 0.489 -10.649 448 HD21 LEU 69 3HD2 LEU 69 -5.895 3.641 -12.216 449 HD22 LEU 69 1HD2 LEU 69 -5.827 3.442 -10.447 450 HD23 LEU 69 2HD2 LEU 69 -6.606 2.230 -11.470 451 H ASP 70 H ASP 70 -2.379 2.303 -13.661 452 HA ASP 70 HA ASP 70 -3.491 3.165 -16.268 453 HB3 ASP 70 2HB ASP 70 -1.527 0.981 -16.133 454 H ASN 71 H ASN 71 -3.749 1.056 -17.712 455 HA ASN 71 HA ASN 71 -6.013 -0.286 -16.511 456 HB3 ASN 71 2HB ASN 71 -4.855 -1.005 -19.197 457 HD21 ASN 71 1HD2 ASN 71 -5.991 -3.118 -18.093 458 HD22 ASN 71 2HD2 ASN 71 -7.711 -3.248 -18.440 459 H ILE 72 H ILE 72 -5.000 -1.303 -14.861 460 HA ILE 72 HA ILE 72 -3.726 -3.971 -15.341 461 HB ILE 72 HB ILE 72 -3.983 -2.283 -12.821 462 HG13 ILE 72 2HG1 ILE 72 -2.287 -1.535 -14.755 463 HG21 ILE 72 1HG2 ILE 72 -2.480 -4.892 -13.210 464 HG22 ILE 72 2HG2 ILE 72 -2.317 -3.817 -11.804 465 HG23 ILE 72 3HG2 ILE 72 -3.854 -4.571 -12.114 466 HD11 ILE 72 3HD1 ILE 72 -1.099 -1.974 -12.019 467 HD12 ILE 72 1HD1 ILE 72 -0.645 -0.793 -13.260 468 HD13 ILE 72 2HD1 ILE 72 -2.217 -0.654 -12.455 469 H ASP 73 H ASP 73 -4.754 -5.730 -13.936 470 HA ASP 73 HA ASP 73 -7.359 -4.967 -12.822 471 HB3 ASP 73 2HB ASP 73 -6.975 -7.510 -14.446 472 H TYR 74 H TYR 74 -7.436 -5.671 -10.693 473 HA TYR 74 HA TYR 74 -4.987 -6.757 -9.640 474 HB3 TYR 74 2HB TYR 74 -6.069 -6.700 -7.475 475 HD1 TYR 74 1HD TYR 74 -4.517 -4.677 -9.034 476 HD2 TYR 74 2HD TYR 74 -8.498 -4.532 -7.399 477 HE1 TYR 74 1HE TYR 74 -4.444 -2.194 -9.093 478 HE2 TYR 74 2HE TYR 74 -8.430 -2.059 -7.443 479 HH TYR 74 HH TYR 74 -6.898 -0.307 -9.120 480 H ASN 75 H ASN 75 -7.877 -8.302 -10.858 481 HA ASN 75 HA ASN 75 -8.086 -10.292 -8.902 482 HB3 ASN 75 2HB ASN 75 -9.050 -10.857 -11.709 483 HD21 ASN 75 1HD2 ASN 75 -10.614 -9.824 -8.726 484 HD22 ASN 75 2HD2 ASN 75 -11.373 -11.375 -8.330 485 H ASN 76 H ASN 76 -6.229 -10.249 -11.830 486 HA ASN 76 HA ASN 76 -5.674 -13.073 -11.977 487 HB3 ASN 76 2HB ASN 76 -5.654 -11.980 -14.048 488 HD21 ASN 76 1HD2 ASN 76 -6.434 -9.824 -13.929 489 HD22 ASN 76 2HD2 ASN 76 -5.345 -8.459 -13.727 490 H TYR 77 H TYR 77 -4.485 -10.971 -9.673 491 HA TYR 77 HA TYR 77 -1.721 -12.002 -9.822 492 HB3 TYR 77 2HB TYR 77 -1.422 -10.303 -7.893 493 HD1 TYR 77 1HD TYR 77 0.440 -10.076 -9.427 494 HD2 TYR 77 2HD TYR 77 -3.455 -8.540 -10.455 495 HE1 TYR 77 1HE TYR 77 1.454 -8.745 -11.241 496 HE2 TYR 77 2HE TYR 77 -2.442 -7.136 -12.202 497 HH TYR 77 HH TYR 77 -0.405 -6.964 -13.616 498 H ASP 78 H ASP 78 -0.739 -12.470 -7.461 499 HA ASP 78 HA ASP 78 -2.726 -13.827 -5.684 500 HB3 ASP 78 2HB ASP 78 0.100 -14.726 -6.296 501 H LEU 79 H LEU 79 -0.096 -11.528 -5.998 502 HA LEU 79 HA LEU 79 -0.609 -10.779 -3.205 503 HB3 LEU 79 2HB LEU 79 2.274 -10.689 -3.760 504 HG LEU 79 HG LEU 79 0.448 -11.942 -1.684 505 HD11 LEU 79 1HD1 LEU 79 2.043 -13.649 -2.021 506 HD12 LEU 79 2HD1 LEU 79 2.594 -12.767 -0.589 507 HD13 LEU 79 3HD1 LEU 79 3.364 -12.482 -2.177 508 HD21 LEU 79 3HD2 LEU 79 2.760 -9.939 -1.513 509 HD22 LEU 79 1HD2 LEU 79 1.812 -10.534 -0.140 510 HD23 LEU 79 2HD2 LEU 79 1.026 -9.549 -1.371 511 H ILE 80 H ILE 80 -0.008 -8.556 -2.710 512 HA ILE 80 HA ILE 80 0.754 -6.849 -5.009 513 HB ILE 80 HB ILE 80 -1.783 -6.661 -3.350 514 HG13 ILE 80 2HG1 ILE 80 -1.918 -8.110 -5.291 515 HG21 ILE 80 1HG2 ILE 80 -2.217 -4.469 -4.413 516 HG22 ILE 80 2HG2 ILE 80 -0.759 -4.393 -3.458 517 HG23 ILE 80 3HG2 ILE 80 -0.640 -4.535 -5.230 518 HD11 ILE 80 3HD1 ILE 80 -3.783 -7.200 -6.494 519 HD12 ILE 80 1HD1 ILE 80 -3.936 -6.839 -4.770 520 HD13 ILE 80 2HD1 ILE 80 -3.460 -5.576 -5.916 521 H LEU 81 H LEU 81 2.389 -5.586 -4.367 522 HA LEU 81 HA LEU 81 2.793 -4.970 -1.479 523 HB3 LEU 81 2HB LEU 81 5.164 -4.493 -2.235 524 HG LEU 81 HG LEU 81 3.956 -7.261 -2.390 525 HD11 LEU 81 1HD1 LEU 81 6.284 -8.171 -2.686 526 HD12 LEU 81 2HD1 LEU 81 6.804 -6.531 -3.138 527 HD13 LEU 81 3HD1 LEU 81 5.618 -7.406 -4.130 528 HD21 LEU 81 3HD2 LEU 81 4.492 -6.046 -0.246 529 HD22 LEU 81 1HD2 LEU 81 6.195 -6.054 -0.711 530 HD23 LEU 81 2HD2 LEU 81 5.360 -7.593 -0.448 531 H ILE 82 H ILE 82 3.374 -2.818 -0.875 532 HA ILE 82 HA ILE 82 3.065 -0.665 -2.891 533 HB ILE 82 HB ILE 82 1.515 -0.834 -0.259 534 HG13 ILE 82 2HG1 ILE 82 0.566 -2.527 -1.803 535 HG21 ILE 82 1HG2 ILE 82 1.541 1.112 -2.591 536 HG22 ILE 82 2HG2 ILE 82 0.301 1.115 -1.318 537 HG23 ILE 82 3HG2 ILE 82 1.967 1.422 -0.893 538 HD11 ILE 82 3HD1 ILE 82 -1.697 -1.971 -1.690 539 HD12 ILE 82 1HD1 ILE 82 -0.951 -1.202 -0.272 540 HD13 ILE 82 2HD1 ILE 82 -1.392 -0.234 -1.704 541 H GLY 83 H GLY 83 4.427 1.218 -2.325 542 HA2 GLY 83 1HA GLY 83 5.413 1.255 0.500 543 HA3 GLY 83 2HA GLY 83 6.515 1.431 -0.849 544 H SER 84 H SER 84 6.358 3.341 1.220 545 HA SER 84 HA SER 84 5.761 5.844 -0.116 546 HB3 SER 84 2HB SER 84 4.158 6.460 1.814 547 HG SER 84 HG SER 84 3.547 4.742 -0.319 548 HA PRO 85 HA PRO 85 8.556 7.065 3.263 549 HB3 PRO 85 2HB PRO 85 8.925 8.885 1.835 550 HG3 PRO 85 2HG PRO 85 7.077 10.174 0.923 551 HD3 PRO 85 2HD PRO 85 6.915 7.963 0.123 552 H VAL 86 H VAL 86 8.572 8.357 5.404 553 HA VAL 86 HA VAL 86 6.049 9.042 6.586 554 HB VAL 86 HB VAL 86 5.769 6.741 6.728 555 HG11 VAL 86 1HG1 VAL 86 7.941 5.778 6.591 556 HG12 VAL 86 2HG1 VAL 86 8.276 6.305 8.275 557 HG13 VAL 86 3HG1 VAL 86 6.981 5.138 7.896 558 HG21 VAL 86 3HG2 VAL 86 5.595 6.481 9.232 559 HG22 VAL 86 1HG2 VAL 86 6.464 7.994 9.396 560 HG23 VAL 86 2HG2 VAL 86 4.883 7.969 8.581 561 H TRP 87 H TRP 87 6.598 10.905 7.669 562 HA TRP 87 HA TRP 87 9.063 10.826 9.343 563 HB3 TRP 87 2HB TRP 87 8.315 13.363 7.930 564 HD1 TRP 87 HD TRP 87 11.412 11.071 8.068 565 HE1 TRP 87 1HE TRP 87 13.428 12.355 8.975 566 HE3 TRP 87 3HE TRP 87 9.108 15.507 9.070 567 HZ2 TRP 87 2HZ TRP 87 13.956 14.998 10.058 568 HZ3 TRP 87 3HZ TRP 87 10.392 17.402 10.057 569 HH2 TRP 87 HH TRP 87 12.813 17.145 10.560 570 H SER 88 H SER 88 5.753 11.387 9.457 571 HA SER 88 HA SER 88 6.096 12.348 12.191 572 HB3 SER 88 2HB SER 88 4.330 14.097 11.903 573 HG SER 88 HG SER 88 6.540 14.652 11.642 574 H GLY 89 H GLY 89 5.294 9.764 11.026 575 HA2 GLY 89 1HA GLY 89 3.909 8.281 12.211 576 HA3 GLY 89 2HA GLY 89 2.630 9.487 12.321 577 H TYR 90 H TYR 90 2.179 10.316 9.786 578 HA TYR 90 HA TYR 90 1.815 8.174 7.882 579 HB3 TYR 90 2HB TYR 90 0.132 7.338 9.195 580 HD1 TYR 90 2HD TYR 90 0.189 10.899 10.152 581 HD2 TYR 90 1HD TYR 90 -2.221 7.323 10.189 582 HE1 TYR 90 2HE TYR 90 -1.028 11.737 12.098 583 HE2 TYR 90 1HE TYR 90 -3.452 8.157 12.126 584 HH TYR 90 HH TYR 90 -2.915 11.454 13.435 585 HA PRO 91 HA PRO 91 1.760 12.713 6.998 586 HB3 PRO 91 2HB PRO 91 4.090 12.791 7.198 587 HG3 PRO 91 2HG PRO 91 5.464 11.079 6.245 588 HD3 PRO 91 2HD PRO 91 4.003 10.234 7.952 589 H ALA 92 H ALA 92 1.514 10.159 4.647 590 HA ALA 92 HA ALA 92 0.462 12.097 2.643 591 HB1 ALA 92 1HB ALA 92 1.477 10.768 0.888 592 HB2 ALA 92 2HB ALA 92 2.755 11.131 2.038 593 HB3 ALA 92 3HB ALA 92 2.011 9.517 2.029 594 H THR 93 H THR 93 -1.251 10.978 1.195 595 HA THR 93 HA THR 93 -2.353 8.482 2.416 596 HB THR 93 HB THR 93 -4.633 9.607 1.929 597 HG1 THR 93 1HG THR 93 -3.955 11.349 0.724 598 HG21 THR 93 3HG2 THR 93 -4.764 10.881 4.009 599 HG22 THR 93 1HG2 THR 93 -3.000 10.838 4.195 600 HG23 THR 93 2HG2 THR 93 -3.961 9.339 4.219 601 HA PRO 94 HA PRO 94 -2.476 8.261 -2.281 602 HB3 PRO 94 2HB PRO 94 -0.280 8.695 -2.924 603 HG3 PRO 94 2HG PRO 94 1.541 8.356 -1.416 604 HD3 PRO 94 2HD PRO 94 0.037 9.745 -0.305 605 H ILE 95 H ILE 95 -1.156 6.255 0.346 606 HA ILE 95 HA ILE 95 -2.481 3.863 -0.754 607 HB ILE 95 HB ILE 95 -1.033 3.867 1.837 608 HG13 ILE 95 2HG1 ILE 95 1.081 3.234 0.634 609 HG21 ILE 95 1HG2 ILE 95 -0.506 1.524 1.024 610 HG22 ILE 95 2HG2 ILE 95 -2.221 1.862 1.247 611 HG23 ILE 95 3HG2 ILE 95 -1.542 1.852 -0.383 612 HD11 ILE 95 3HD1 ILE 95 0.271 5.014 -1.680 613 HD12 ILE 95 1HD1 ILE 95 1.670 3.989 -1.506 614 HD13 ILE 95 2HD1 ILE 95 0.065 3.274 -1.795 615 H LYS 96 H LYS 96 -4.247 5.516 -0.488 616 HA LYS 96 HA LYS 96 -5.905 4.377 1.705 617 HB3 LYS 96 2HB LYS 96 -7.267 6.706 0.946 618 HG3 LYS 96 2HG LYS 96 -6.462 7.623 3.174 619 HD3 LYS 96 2HD LYS 96 -7.395 4.720 3.276 620 HE3 LYS 96 2HE LYS 96 -7.655 7.098 5.147 621 HZ1 LYS 96 3HZ LYS 96 -9.244 4.619 5.313 622 HZ2 LYS 96 1HZ LYS 96 -9.848 6.036 4.770 623 HZ3 LYS 96 2HZ LYS 96 -9.335 5.970 6.294 624 H THR 97 H THR 97 -6.204 6.046 -1.604 625 HA THR 97 HA THR 97 -8.602 4.793 -2.038 626 HB THR 97 HB THR 97 -6.532 5.824 -3.981 627 HG1 THR 97 1HG THR 97 -8.549 7.301 -2.662 628 HG21 THR 97 3HG2 THR 97 -8.571 6.540 -5.270 629 HG22 THR 97 1HG2 THR 97 -9.559 5.606 -4.128 630 HG23 THR 97 2HG2 THR 97 -8.394 4.788 -5.164 631 H LEU 98 H LEU 98 -5.282 3.523 -2.741 632 HA LEU 98 HA LEU 98 -6.179 1.506 -4.519 633 HB3 LEU 98 2HB LEU 98 -4.044 0.540 -2.720 634 HG LEU 98 HG LEU 98 -2.697 0.431 -4.717 635 HD11 LEU 98 1HD1 LEU 98 -4.037 -0.947 -6.272 636 HD12 LEU 98 2HD1 LEU 98 -5.511 -0.509 -5.397 637 HD13 LEU 98 3HD1 LEU 98 -4.205 -1.410 -4.586 638 HD21 LEU 98 3HD2 LEU 98 -4.905 1.783 -6.269 639 HD22 LEU 98 1HD2 LEU 98 -3.296 1.351 -6.841 640 HD23 LEU 98 2HD2 LEU 98 -3.474 2.642 -5.637 641 H LEU 99 H LEU 99 -6.076 1.496 -0.930 642 HA LEU 99 HA LEU 99 -6.932 -1.198 -0.529 643 HB3 LEU 99 2HB LEU 99 -7.628 -0.216 1.715 644 HG LEU 99 HG LEU 99 -5.522 -0.444 2.422 645 HD11 LEU 99 1HD1 LEU 99 -3.561 -0.638 1.159 646 HD12 LEU 99 2HD1 LEU 99 -4.223 0.270 -0.221 647 HD13 LEU 99 3HD1 LEU 99 -4.839 -1.349 0.182 648 HD21 LEU 99 3HD2 LEU 99 -4.858 2.188 1.113 649 HD22 LEU 99 1HD2 LEU 99 -4.035 1.421 2.502 650 HD23 LEU 99 2HD2 LEU 99 -5.688 2.020 2.670 651 H ASP 100 H ASP 100 -8.689 1.702 -1.428 652 HA ASP 100 HA ASP 100 -11.361 0.682 -0.726 653 HB3 ASP 100 2HB ASP 100 -10.293 3.108 -2.221 654 H GLN 101 H GLN 101 -9.149 0.685 -3.424 655 HA GLN 101 HA GLN 101 -11.258 0.115 -5.410 656 HB3 GLN 101 2HB GLN 101 -9.325 0.161 -7.002 657 HG3 GLN 101 2HG GLN 101 -8.609 2.609 -6.182 658 HE21 GLN 101 1HE2 GLN 101 -10.137 4.559 -6.933 659 HE22 GLN 101 2HE2 GLN 101 -11.169 4.070 -8.210 660 H MET 102 H MET 102 -9.011 -1.530 -3.343 661 HA MET 102 HA MET 102 -8.955 -4.043 -4.796 662 HB3 MET 102 2HB MET 102 -7.610 -4.707 -2.765 663 HG3 MET 102 2HG MET 102 -6.699 -2.176 -4.169 664 HE1 MET 102 3HE MET 102 -5.687 -5.394 -1.954 665 HE2 MET 102 1HE MET 102 -5.479 -5.730 -3.688 666 HE3 MET 102 2HE MET 102 -4.053 -5.617 -2.617 667 H LYS 103 H LYS 103 -11.557 -2.971 -3.129 668 HA LYS 103 HA LYS 103 -12.013 -4.656 -0.983 669 HB3 LYS 103 2HB LYS 103 -14.454 -4.329 -1.462 670 HG3 LYS 103 2HG LYS 103 -14.292 -1.741 -2.073 671 HD3 LYS 103 2HD LYS 103 -14.587 -2.920 0.338 672 HE3 LYS 103 2HE LYS 103 -11.998 -1.329 0.460 673 HZ1 LYS 103 3HZ LYS 103 -13.599 -1.264 2.439 674 HZ2 LYS 103 1HZ LYS 103 -12.050 -1.682 2.719 675 HZ3 LYS 103 2HZ LYS 103 -13.186 -2.852 2.670 676 H ASN 104 H ASN 104 -12.165 -5.655 -4.373 677 HA ASN 104 HA ASN 104 -13.450 -8.250 -3.638 678 HB3 ASN 104 2HB ASN 104 -13.755 -8.401 -6.179 679 HD21 ASN 104 1HD2 ASN 104 -14.812 -5.119 -5.194 680 HD22 ASN 104 2HD2 ASN 104 -16.453 -5.615 -4.841 681 H TYR 105 H TYR 105 -10.384 -7.262 -3.537 682 HA TYR 105 HA TYR 105 -9.058 -8.920 -5.503 683 HB3 TYR 105 2HB TYR 105 -8.161 -7.547 -2.936 684 HD1 TYR 105 1HD TYR 105 -6.854 -8.754 -6.290 685 HD2 TYR 105 2HD TYR 105 -6.098 -8.190 -2.057 686 HE1 TYR 105 1HE TYR 105 -4.724 -9.902 -6.525 687 HE2 TYR 105 2HE TYR 105 -3.885 -9.234 -2.327 688 HH TYR 105 HH TYR 105 -2.983 -10.878 -5.335 689 H ARG 106 H ARG 106 -7.715 -10.747 -5.126 690 HA ARG 106 HA ARG 106 -8.334 -12.496 -2.805 691 HB3 ARG 106 2HB ARG 106 -8.260 -14.392 -4.380 692 HG3 ARG 106 2HG ARG 106 -10.433 -12.908 -5.665 693 HD3 ARG 106 2HD ARG 106 -11.780 -14.288 -3.944 694 HE ARG 106 HE ARG 106 -10.428 -16.376 -5.306 695 HH11 ARG 106 1HH1 ARG 106 -12.597 -13.555 -5.924 696 HH12 ARG 106 2HH1 ARG 106 -13.043 -14.134 -7.487 697 HH21 ARG 106 1HH2 ARG 106 -11.297 -17.206 -7.271 698 HH22 ARG 106 2HH2 ARG 106 -12.531 -16.311 -8.126 699 H GLY 107 H GLY 107 -6.335 -12.313 -1.754 700 HA2 GLY 107 1HA GLY 107 -4.085 -13.641 -2.380 701 HA3 GLY 107 2HA GLY 107 -3.802 -12.115 -3.214 702 H GLU 108 H GLU 108 -2.249 -11.110 -1.810 703 HA GLU 108 HA GLU 108 -3.142 -10.717 1.002 704 HB3 GLU 108 2HB GLU 108 -1.001 -11.276 1.901 705 HG3 GLU 108 2HG GLU 108 -1.771 -13.619 0.151 706 H VAL 109 H VAL 109 -1.779 -9.219 2.175 707 HA VAL 109 HA VAL 109 -0.921 -6.943 0.450 708 HB VAL 109 HB VAL 109 -2.260 -6.790 3.202 709 HG11 VAL 109 1HG1 VAL 109 -2.456 -4.387 2.690 710 HG12 VAL 109 2HG1 VAL 109 -0.772 -4.889 2.772 711 HG13 VAL 109 3HG1 VAL 109 -1.529 -4.612 1.193 712 HG21 VAL 109 3HG2 VAL 109 -4.180 -5.849 1.930 713 HG22 VAL 109 1HG2 VAL 109 -3.461 -6.471 0.439 714 HG23 VAL 109 2HG2 VAL 109 -3.924 -7.590 1.727 715 H ALA 110 H ALA 110 1.135 -6.281 0.642 716 HA ALA 110 HA ALA 110 2.249 -6.287 3.334 717 HB1 ALA 110 1HB ALA 110 3.544 -7.652 0.980 718 HB2 ALA 110 2HB ALA 110 4.545 -6.850 2.223 719 HB3 ALA 110 3HB ALA 110 3.449 -8.172 2.653 720 H SER 111 H SER 111 3.833 -4.579 3.585 721 HA SER 111 HA SER 111 3.810 -2.566 1.442 722 HB3 SER 111 2HB SER 111 3.000 -2.049 4.338 723 HG SER 111 HG SER 111 3.759 -0.150 3.339 724 H PHE 112 H PHE 112 5.607 -1.160 1.502 725 HA PHE 112 HA PHE 112 7.809 -1.887 3.358 726 HB3 PHE 112 2HB PHE 112 7.900 -3.340 1.425 727 HD1 PHE 112 1HD PHE 112 6.030 -2.907 -0.355 728 HD2 PHE 112 2HD PHE 112 9.917 -1.017 -0.432 729 HE1 PHE 112 1HE PHE 112 5.684 -2.212 -2.690 730 HE2 PHE 112 2HE PHE 112 9.522 -0.295 -2.733 731 HZ PHE 112 HZ PHE 112 7.397 -0.884 -3.886 732 H PHE 113 H PHE 113 8.430 0.049 4.326 733 HA PHE 113 HA PHE 113 8.279 2.527 2.660 734 HB3 PHE 113 2HB PHE 113 6.953 2.863 4.527 735 HD1 PHE 113 1HD PHE 113 9.994 2.991 6.677 736 HD2 PHE 113 2HD PHE 113 6.251 1.051 5.891 737 HE1 PHE 113 1HE PHE 113 10.140 1.876 8.846 738 HE2 PHE 113 2HE PHE 113 6.426 -0.165 8.061 739 HZ PHE 113 HZ PHE 113 8.345 0.246 9.552 740 H THR 114 H THR 114 9.956 4.147 3.000 741 HA THR 114 HA THR 114 12.684 2.981 3.333 742 HB THR 114 HB THR 114 13.340 4.775 1.687 743 HG1 THR 114 1HG THR 114 10.573 4.867 1.018 744 HG21 THR 114 3HG2 THR 114 12.525 3.558 -0.304 745 HG22 THR 114 1HG2 THR 114 11.398 2.638 0.712 746 HG23 THR 114 2HG2 THR 114 13.151 2.492 0.963 747 H SER 115 H SER 115 10.859 4.297 5.329 748 HA SER 115 HA SER 115 12.451 6.677 6.129 749 HB3 SER 115 2HB SER 115 9.761 7.098 6.888 750 HG SER 115 HG SER 115 10.881 7.954 4.407 751 H ALA 116 H ALA 116 13.436 5.867 7.736 752 HA ALA 116 HA ALA 116 11.903 4.608 9.977 753 HB1 ALA 116 1HB ALA 116 14.080 3.687 10.733 754 HB2 ALA 116 2HB ALA 116 13.446 2.991 9.231 755 HB3 ALA 116 3HB ALA 116 14.775 4.179 9.185 756 H GLY 117 H GLY 117 13.007 7.530 9.000 757 HA2 GLY 117 1HA GLY 117 15.147 8.275 10.640 758 HA3 GLY 117 2HA GLY 117 13.971 9.409 9.949 759 H THR 118 H THR 118 11.827 9.483 11.137 760 HA THR 118 HA THR 118 12.298 9.405 14.067 761 HB THR 118 HB THR 118 10.237 11.194 12.826 762 HG1 THR 118 1HG THR 118 11.716 12.707 12.303 763 HG21 THR 118 3HG2 THR 118 10.991 12.655 14.639 764 HG22 THR 118 1HG2 THR 118 12.334 11.551 15.018 765 HG23 THR 118 2HG2 THR 118 10.650 11.046 15.293 766 H ASN 119 H ASN 119 10.781 7.563 11.815 767 HA ASN 119 HA ASN 119 8.558 6.832 13.640 768 HB3 ASN 119 2HB ASN 119 7.339 6.240 11.417 769 HD21 ASN 119 1HD2 ASN 119 6.532 7.042 13.787 770 HD22 ASN 119 2HD2 ASN 119 5.713 8.562 13.726 771 H HIS 120 H HIS 120 8.243 4.708 13.827 772 HA HIS 120 HA HIS 120 9.032 2.947 11.709 773 HB3 HIS 120 2HB HIS 120 10.169 2.406 14.473 774 HD1 HIS 120 1HD HIS 120 10.950 -0.109 14.737 775 HD2 HIS 120 2HD HIS 120 9.938 1.062 10.821 776 HE1 HIS 120 1HE HIS 120 11.079 -2.206 13.284 777 H LYS 121 H LYS 121 8.251 2.161 15.128 778 HA LYS 121 HA LYS 121 6.155 0.536 14.180 779 HB3 LYS 121 2HB LYS 121 6.159 1.260 17.080 780 HG3 LYS 121 2HG LYS 121 6.739 -1.389 16.899 781 HD3 LYS 121 2HD LYS 121 3.870 -0.412 16.606 782 HE3 LYS 121 2HE LYS 121 3.496 -2.438 18.092 783 HZ1 LYS 121 3HZ LYS 121 3.079 -2.674 15.743 784 HZ2 LYS 121 1HZ LYS 121 3.655 -4.069 16.382 785 HZ3 LYS 121 2HZ LYS 121 4.651 -3.151 15.460 786 H ALA 122 H ALA 122 5.908 4.040 14.817 787 HA ALA 122 HA ALA 122 3.125 4.032 15.493 788 HB1 ALA 122 1HB ALA 122 3.195 6.322 14.539 789 HB2 ALA 122 2HB ALA 122 4.562 6.050 15.635 790 HB3 ALA 122 3HB ALA 122 4.793 5.989 13.865 791 H TYR 123 H TYR 123 4.916 4.008 12.379 792 HA TYR 123 HA TYR 123 2.718 4.391 10.655 793 HB3 TYR 123 2HB TYR 123 5.299 2.859 10.155 794 HD1 TYR 123 2HD TYR 123 3.739 5.744 8.323 795 HD2 TYR 123 1HD TYR 123 4.472 1.477 8.337 796 HE1 TYR 123 2HE TYR 123 3.287 5.668 5.916 797 HE2 TYR 123 1HE TYR 123 3.899 1.384 5.937 798 HH TYR 123 HH TYR 123 2.920 4.269 4.070 799 H VAL 124 H VAL 124 4.104 1.431 12.108 800 HA VAL 124 HA VAL 124 2.701 -0.402 10.478 801 HB VAL 124 HB VAL 124 3.750 -0.705 13.322 802 HG11 VAL 124 1HG1 VAL 124 2.893 -2.810 11.288 803 HG12 VAL 124 2HG1 VAL 124 3.816 -3.162 12.761 804 HG13 VAL 124 3HG1 VAL 124 2.181 -2.507 12.883 805 HG21 VAL 124 3HG2 VAL 124 4.992 -1.243 10.579 806 HG22 VAL 124 1HG2 VAL 124 5.555 -0.074 11.784 807 HG23 VAL 124 2HG2 VAL 124 5.689 -1.803 12.102 808 H SER 125 H SER 125 1.708 1.236 13.509 809 HA SER 125 HA SER 125 -0.810 -0.196 13.623 810 HB3 SER 125 2HB SER 125 -0.154 2.462 14.908 811 HG SER 125 HG SER 125 -1.574 1.575 16.522 812 H HIS 126 H HIS 126 0.221 3.096 12.535 813 HA HIS 126 HA HIS 126 -2.301 3.989 11.754 814 HB3 HIS 126 2HB HIS 126 -1.023 5.533 10.247 815 HD1 HIS 126 1HD HIS 126 1.655 6.596 11.755 816 HD2 HIS 126 2HD HIS 126 -2.154 5.726 13.304 817 HE1 HIS 126 1HE HIS 126 1.412 7.960 13.945 818 H PHE 127 H PHE 127 -0.016 2.026 9.837 819 HA PHE 127 HA PHE 127 -1.501 2.177 7.391 820 HB3 PHE 127 2HB PHE 127 0.477 0.102 8.435 821 HD1 PHE 127 1HD PHE 127 -1.099 1.502 5.338 822 HD2 PHE 127 2HD PHE 127 0.651 -1.923 7.215 823 HE1 PHE 127 1HE PHE 127 -1.431 0.199 3.224 824 HE2 PHE 127 2HE PHE 127 0.285 -3.250 5.144 825 HZ PHE 127 HZ PHE 127 -0.760 -2.189 3.152 826 H ASN 128 H ASN 128 -1.438 -0.155 10.116 827 HA ASN 128 HA ASN 128 -3.006 -2.170 8.979 828 HB3 ASN 128 2HB ASN 128 -3.752 -2.307 11.618 829 HD21 ASN 128 1HD2 ASN 128 -0.316 -2.525 11.553 830 HD22 ASN 128 2HD2 ASN 128 -0.263 -4.250 11.165 831 H GLU 129 H GLU 129 -4.122 0.732 10.784 832 HA GLU 129 HA GLU 129 -6.854 0.040 10.723 833 HB3 GLU 129 2HB GLU 129 -7.258 2.441 11.134 834 HG3 GLU 129 2HG GLU 129 -5.950 2.892 13.057 835 H TRP 130 H TRP 130 -4.871 1.741 8.282 836 HA TRP 130 HA TRP 130 -7.264 2.422 6.712 837 HB3 TRP 130 2HB TRP 130 -5.504 3.358 5.203 838 HD1 TRP 130 HD TRP 130 -6.948 4.079 8.542 839 HE1 TRP 130 1HE TRP 130 -6.741 6.581 9.065 840 HE3 TRP 130 3HE TRP 130 -3.419 5.366 5.045 841 HZ2 TRP 130 2HZ TRP 130 -5.028 8.811 8.241 842 HZ3 TRP 130 3HZ TRP 130 -2.449 7.647 5.043 843 HH2 TRP 130 HH TRP 130 -3.250 9.358 6.643 844 H ALA 131 H ALA 131 -5.191 -0.298 7.096 845 HA ALA 131 HA ALA 131 -5.602 -1.310 4.333 846 HB1 ALA 131 1HB ALA 131 -3.322 -1.405 5.280 847 HB2 ALA 131 2HB ALA 131 -3.924 -2.389 6.637 848 HB3 ALA 131 3HB ALA 131 -3.971 -3.029 4.982 849 H ASP 132 H ASP 132 -6.663 -1.780 7.603 850 HA ASP 132 HA ASP 132 -7.493 -4.241 7.949 851 HB3 ASP 132 2HB ASP 132 -9.239 -1.819 8.560 852 H GLY 133 H GLY 133 -8.744 -5.682 7.075 853 HA2 GLY 133 1HA GLY 133 -10.928 -6.261 6.105 854 HA3 GLY 133 2HA GLY 133 -10.708 -4.951 4.941 855 H LEU 134 H LEU 134 -7.675 -5.822 4.889 856 HA LEU 134 HA LEU 134 -8.041 -8.196 3.094 857 HB3 LEU 134 2HB LEU 134 -6.166 -7.216 1.781 858 HG LEU 134 HG LEU 134 -8.652 -5.487 1.969 859 HD11 LEU 134 1HD1 LEU 134 -6.286 -5.463 0.068 860 HD12 LEU 134 2HD1 LEU 134 -6.908 -4.130 1.065 861 HD13 LEU 134 3HD1 LEU 134 -7.856 -4.705 -0.311 862 HD21 LEU 134 3HD2 LEU 134 -9.273 -6.619 -0.142 863 HD22 LEU 134 1HD2 LEU 134 -9.131 -7.771 1.195 864 HD23 LEU 134 2HD2 LEU 134 -7.831 -7.664 -0.011 865 H ASN 135 H ASN 135 -5.936 -9.366 2.724 866 HA ASN 135 HA ASN 135 -5.243 -10.254 5.399 867 HB3 ASN 135 2HB ASN 135 -4.345 -11.473 2.754 868 HD21 ASN 135 1HD2 ASN 135 -2.632 -12.874 3.538 869 HD22 ASN 135 2HD2 ASN 135 -2.789 -13.812 4.967 870 H VAL 136 H VAL 136 -3.873 -8.472 6.084 871 HA VAL 136 HA VAL 136 -1.424 -8.094 4.583 872 HB VAL 136 HB VAL 136 -2.398 -6.086 5.208 873 HG11 VAL 136 1HG1 VAL 136 -3.874 -6.707 6.870 874 HG12 VAL 136 2HG1 VAL 136 -2.558 -7.161 7.998 875 HG13 VAL 136 3HG1 VAL 136 -2.839 -5.448 7.553 876 HG21 VAL 136 3HG2 VAL 136 -0.081 -6.437 7.137 877 HG22 VAL 136 1HG2 VAL 136 0.059 -6.068 5.399 878 HG23 VAL 136 2HG2 VAL 136 -0.729 -4.923 6.497 879 H ILE 137 H ILE 137 0.284 -9.194 4.777 880 HA ILE 137 HA ILE 137 1.061 -10.434 7.363 881 HB ILE 137 HB ILE 137 1.906 -12.278 6.260 882 HG13 ILE 137 2HG1 ILE 137 1.718 -12.629 3.769 883 HG21 ILE 137 1HG2 ILE 137 -0.014 -13.290 5.229 884 HG22 ILE 137 2HG2 ILE 137 -0.572 -12.221 6.530 885 HG23 ILE 137 3HG2 ILE 137 -0.717 -11.727 4.823 886 HD11 ILE 137 3HD1 ILE 137 2.060 -9.661 3.516 887 HD12 ILE 137 1HD1 ILE 137 1.949 -10.873 2.236 888 HD13 ILE 137 2HD1 ILE 137 0.509 -10.470 3.195 889 H GLY 138 H GLY 138 1.823 -7.850 5.472 890 HA2 GLY 138 1HA GLY 138 4.665 -7.881 6.358 891 HA3 GLY 138 2HA GLY 138 4.215 -7.537 4.686 892 H VAL 139 H VAL 139 4.924 -6.240 7.621 893 HA VAL 139 HA VAL 139 4.520 -3.605 6.452 894 HB VAL 139 HB VAL 139 3.848 -3.793 9.393 895 HG11 VAL 139 1HG1 VAL 139 2.621 -1.693 8.822 896 HG12 VAL 139 2HG1 VAL 139 4.345 -1.595 8.386 897 HG13 VAL 139 3HG1 VAL 139 3.122 -1.867 7.137 898 HG21 VAL 139 3HG2 VAL 139 2.137 -5.271 8.439 899 HG22 VAL 139 1HG2 VAL 139 1.432 -3.736 8.924 900 HG23 VAL 139 2HG2 VAL 139 1.747 -4.052 7.206 901 H ALA 140 H ALA 140 6.729 -3.464 6.081 902 HA ALA 140 HA ALA 140 8.550 -3.356 8.376 903 HB1 ALA 140 1HB ALA 140 8.549 -5.757 7.475 904 HB2 ALA 140 2HB ALA 140 9.236 -5.103 5.974 905 HB3 ALA 140 3HB ALA 140 10.113 -4.957 7.497 906 H ARG 141 H ARG 141 10.934 -2.853 7.200 907 HA ARG 141 HA ARG 141 10.471 -0.765 5.160 908 HB3 ARG 141 2HB ARG 141 11.103 0.231 7.299 909 HG3 ARG 141 2HG ARG 141 13.649 -1.423 7.147 910 HD3 ARG 141 2HD ARG 141 12.725 0.560 9.276 911 HE ARG 141 HE ARG 141 15.491 -0.218 9.134 912 HH11 ARG 141 1HH1 ARG 141 12.368 -1.350 10.499 913 HH12 ARG 141 2HH1 ARG 141 13.101 -2.689 11.303 914 HH21 ARG 141 1HH2 ARG 141 16.432 -1.689 10.688 915 HH22 ARG 141 2HH2 ARG 141 15.428 -2.773 11.553 916 H ASP 142 H ASP 142 12.411 -0.353 3.894 917 HA ASP 142 HA ASP 142 13.586 -1.088 2.116 918 HB3 ASP 142 2HB ASP 142 15.689 -2.341 2.674 919 H ASP 143 H ASP 143 14.887 -3.792 1.822 920 HA ASP 143 HA ASP 143 12.512 -5.262 0.878 921 HB3 ASP 143 2HB ASP 143 13.924 -4.796 -0.966 922 H SER 144 H SER 144 14.100 -5.232 3.680 923 HA SER 144 HA SER 144 15.373 -7.708 3.934 924 HB3 SER 144 2HB SER 144 13.873 -6.344 6.199 925 HG SER 144 HG SER 144 15.261 -7.452 7.422 926 H GLU 145 H GLU 145 11.842 -7.051 4.139 927 HA GLU 145 HA GLU 145 11.413 -9.822 5.147 928 HB3 GLU 145 2HB GLU 145 9.208 -9.018 5.812 929 HG3 GLU 145 2HG GLU 145 11.120 -6.956 6.917 930 H VAL 146 H VAL 146 11.755 -8.628 2.176 931 HA VAL 146 HA VAL 146 9.400 -9.272 0.763 932 HB VAL 146 HB VAL 146 12.360 -9.403 0.062 933 HG11 VAL 146 1HG1 VAL 146 10.039 -9.483 -1.902 934 HG12 VAL 146 2HG1 VAL 146 11.760 -9.304 -2.309 935 HG13 VAL 146 3HG1 VAL 146 11.167 -10.811 -1.604 936 HG21 VAL 146 3HG2 VAL 146 11.319 -7.187 0.746 937 HG22 VAL 146 1HG2 VAL 146 11.952 -7.236 -0.889 938 HG23 VAL 146 2HG2 VAL 146 10.183 -7.378 -0.586 939 H ASP 147 H ASP 147 11.956 -11.338 1.965 940 HA ASP 147 HA ASP 147 11.395 -13.747 0.621 941 HB3 ASP 147 2HB ASP 147 12.638 -13.425 3.353 942 H LYS 148 H LYS 148 9.379 -12.329 2.785 943 HA LYS 148 HA LYS 148 7.992 -14.899 3.418 944 HB3 LYS 148 2HB LYS 148 8.951 -14.179 5.445 945 HG3 LYS 148 2HG LYS 148 7.855 -11.453 4.816 946 HD3 LYS 148 2HD LYS 148 8.878 -10.851 7.113 947 HE3 LYS 148 2HE LYS 148 6.171 -12.204 7.215 948 HZ1 LYS 148 3HZ LYS 148 6.800 -10.954 9.167 949 HZ2 LYS 148 1HZ LYS 148 5.627 -10.113 8.370 950 HZ3 LYS 148 2HZ LYS 148 7.213 -9.642 8.288 951 H TRP 149 H TRP 149 7.825 -12.154 1.638 952 HA TRP 149 HA TRP 149 4.836 -12.059 1.736 953 HB3 TRP 149 2HB TRP 149 4.980 -9.866 0.789 954 HD1 TRP 149 HD TRP 149 5.274 -10.863 3.939 955 HE1 TRP 149 1HE TRP 149 6.083 -9.122 5.593 956 HE3 TRP 149 3HE TRP 149 7.560 -7.634 0.686 957 HZ2 TRP 149 2HZ TRP 149 7.108 -6.391 5.482 958 HZ3 TRP 149 3HZ TRP 149 8.359 -5.452 1.453 959 HH2 TRP 149 HH TRP 149 8.075 -4.766 3.852 960 H SER 150 H SER 150 6.442 -14.180 0.256 961 HA SER 150 HA SER 150 4.730 -14.126 -2.017 962 HB3 SER 150 2HB SER 150 7.132 -14.605 -3.290 963 HG SER 150 HG SER 150 5.685 -12.169 -3.069 964 H LYS 151 H LYS 151 7.281 -15.708 -0.125 965 HA LYS 151 HA LYS 151 7.645 -17.972 -1.529 966 HB3 LYS 151 2HB LYS 151 7.975 -19.099 0.790 967 HG3 LYS 151 2HG LYS 151 9.642 -16.617 0.383 968 HD3 LYS 151 2HD LYS 151 10.156 -19.510 1.205 969 HE3 LYS 151 2HE LYS 151 12.161 -17.256 1.119 970 HZ1 LYS 151 3HZ LYS 151 13.708 -18.958 1.194 971 HZ2 LYS 151 1HZ LYS 151 12.653 -20.144 0.810 972 HZ3 LYS 151 2HZ LYS 151 12.582 -19.435 2.306
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