NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
542314 | 2lkk | 17303 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 2 H1 SER 2 6.554 -11.806 -11.650 2 H2 SER 2 H2 SER 2 5.833 -10.665 -10.765 3 HA SER 2 HA SER 2 7.119 -12.338 -9.493 4 HB2 SER 2 HB2 SER 2 8.977 -12.519 -11.159 5 HB3 SER 2 HB3 SER 2 9.437 -10.842 -10.855 6 HG SER 2 HG SER 2 9.529 -13.033 -9.042 7 H PHE 3 H PHE 3 6.269 -11.423 -7.761 8 HA PHE 3 HA PHE 3 6.716 -8.525 -7.044 9 HB2 PHE 3 HB2 PHE 3 4.860 -10.718 -5.966 10 HB3 PHE 3 HB3 PHE 3 5.111 -9.283 -5.030 11 HD1 PHE 3 HD2 PHE 3 4.404 -7.036 -5.826 12 HD2 PHE 3 HD1 PHE 3 3.612 -10.564 -8.164 13 HE1 PHE 3 HE2 PHE 3 2.688 -5.814 -7.126 14 HE2 PHE 3 HE1 PHE 3 1.892 -9.336 -9.405 15 HZ PHE 3 HZ PHE 3 1.411 -6.967 -8.867 16 H SER 4 H SER 4 8.261 -11.407 -5.803 17 HA SER 4 HA SER 4 8.799 -10.522 -3.152 18 HB2 SER 4 HB2 SER 4 10.509 -12.337 -4.925 19 HB3 SER 4 HB3 SER 4 10.803 -12.089 -3.202 20 HG SER 4 HG SER 4 9.417 -13.896 -3.684 21 H GLY 5 H GLY 5 9.902 -8.894 -2.255 22 HA2 GLY 5 HA2 GLY 5 12.625 -8.090 -2.727 23 HA3 GLY 5 HA3 GLY 5 11.667 -7.074 -3.805 24 H LYS 6 H LYS 6 13.222 -5.941 -1.975 25 HA LYS 6 HA LYS 6 11.373 -4.803 0.227 26 HB2 LYS 6 HB2 LYS 6 14.415 -4.870 -0.072 27 HB3 LYS 6 HB3 LYS 6 13.599 -3.931 1.150 28 HG2 LYS 6 HG2 LYS 6 12.640 -5.988 2.222 29 HG3 LYS 6 HG3 LYS 6 13.350 -7.001 0.965 30 HD2 LYS 6 HD2 LYS 6 15.664 -6.173 1.606 31 HD3 LYS 6 HD3 LYS 6 14.989 -5.217 2.907 32 HE2 LYS 6 HE2 LYS 6 14.740 -8.312 2.674 33 HE3 LYS 6 HE3 LYS 6 16.024 -7.491 3.555 34 HZ1 LYS 6 HZ1 LYS 6 13.053 -7.466 4.233 35 HZ2 LYS 6 HZ2 LYS 6 14.087 -6.357 4.886 36 HZ3 LYS 6 HZ3 LYS 6 14.290 -7.970 5.188 37 H TYR 7 H TYR 7 10.287 -3.367 -1.148 38 HA TYR 7 HA TYR 7 11.776 -1.847 -3.270 39 HB2 TYR 7 HB2 TYR 7 8.775 -1.709 -2.556 40 HB3 TYR 7 HB3 TYR 7 9.520 -0.981 -3.942 41 HD1 TYR 7 HD2 TYR 7 8.794 -4.350 -2.380 42 HD2 TYR 7 HD1 TYR 7 9.615 -2.206 -6.022 43 HE1 TYR 7 HE2 TYR 7 8.268 -6.338 -3.662 44 HE2 TYR 7 HE1 TYR 7 9.043 -4.229 -7.312 45 HH TYR 7 HH TYR 7 8.131 -7.253 -5.662 46 H GLN 8 H GLN 8 12.866 -0.019 -2.689 47 HA GLN 8 HA GLN 8 11.909 1.661 -0.398 48 HB2 GLN 8 HB2 GLN 8 14.379 1.262 -0.888 49 HB3 GLN 8 HB3 GLN 8 14.235 2.407 -2.224 50 HG2 GLN 8 HG2 GLN 8 13.387 4.172 -0.554 51 HG3 GLN 8 HG3 GLN 8 13.564 3.000 0.747 52 HE21 GLN 8 HE21 GLN 8 14.718 5.036 1.402 53 HE22 GLN 8 HE22 GLN 8 16.523 5.044 1.011 54 H LEU 9 H LEU 9 10.884 3.515 -0.387 55 HA LEU 9 HA LEU 9 9.247 4.308 -2.693 56 HB2 LEU 9 HB2 LEU 9 8.434 4.332 -0.381 57 HB3 LEU 9 HB3 LEU 9 9.615 5.541 0.079 58 HG LEU 9 HG LEU 9 8.482 7.241 -1.420 59 HD11 LEU 9 HD11 LEU 9 6.161 6.731 -2.305 60 HD12 LEU 9 HD12 LEU 9 6.389 5.010 -1.889 61 HD13 LEU 9 HD13 LEU 9 7.397 5.774 -3.127 62 HD21 LEU 9 HD21 LEU 9 6.646 5.868 0.646 63 HD22 LEU 9 HD22 LEU 9 6.486 7.539 0.055 64 HD23 LEU 9 HD23 LEU 9 7.902 7.072 1.005 65 H GLN 10 H GLN 10 9.493 5.758 -4.189 66 HA GLN 10 HA GLN 10 11.786 7.791 -4.087 67 HB2 GLN 10 HB2 GLN 10 10.365 6.480 -6.477 68 HB3 GLN 10 HB3 GLN 10 11.600 7.709 -6.619 69 HG2 GLN 10 HG2 GLN 10 12.114 5.007 -5.194 70 HG3 GLN 10 HG3 GLN 10 12.230 5.241 -6.911 71 HE21 GLN 10 HE21 GLN 10 14.447 4.486 -6.417 72 HE22 GLN 10 HE22 GLN 10 15.697 5.733 -5.906 73 H SER 11 H SER 11 8.576 7.539 -5.613 74 HA SER 11 HA SER 11 8.078 10.506 -4.899 75 HB2 SER 11 HB2 SER 11 8.520 10.195 -7.338 76 HB3 SER 11 HB3 SER 11 7.194 9.046 -7.457 77 HG SER 11 HG SER 11 7.072 11.822 -6.865 78 H GLN 12 H GLN 12 6.194 11.049 -3.996 79 HA GLN 12 HA GLN 12 3.992 8.959 -3.583 80 HB2 GLN 12 HB2 GLN 12 5.642 9.219 -1.590 81 HB3 GLN 12 HB3 GLN 12 5.017 10.858 -1.384 82 HG2 GLN 12 HG2 GLN 12 2.797 10.045 -0.810 83 HG3 GLN 12 HG3 GLN 12 3.121 8.440 -1.414 84 HE21 GLN 12 HE21 GLN 12 4.991 10.450 0.962 85 HE22 GLN 12 HE22 GLN 12 4.742 9.223 2.299 86 H GLU 13 H GLU 13 2.320 9.770 -4.706 87 HA GLU 13 HA GLU 13 2.163 12.627 -5.444 88 HB2 GLU 13 HB2 GLU 13 1.848 10.573 -6.916 89 HB3 GLU 13 HB3 GLU 13 0.352 10.239 -6.069 90 HG2 GLU 13 HG2 GLU 13 -0.490 12.590 -6.956 91 HG3 GLU 13 HG3 GLU 13 0.976 12.625 -7.934 92 H ASN 14 H ASN 14 -1.001 11.390 -4.963 93 HA ASN 14 HA ASN 14 -1.705 13.697 -3.255 94 HB2 ASN 14 HB2 ASN 14 -3.387 11.376 -4.359 95 HB3 ASN 14 HB3 ASN 14 -4.065 12.622 -3.408 96 HD21 ASN 14 HD21 ASN 14 -3.214 11.833 -6.612 97 HD22 ASN 14 HD22 ASN 14 -3.593 13.517 -7.247 98 H PHE 15 H PHE 15 -0.047 12.640 -1.624 99 HA PHE 15 HA PHE 15 -1.311 11.039 0.539 100 HB2 PHE 15 HB2 PHE 15 1.186 11.286 0.021 101 HB3 PHE 15 HB3 PHE 15 1.165 12.863 0.747 102 HD1 PHE 15 HD1 PHE 15 0.744 13.066 3.261 103 HD2 PHE 15 HD2 PHE 15 1.187 9.237 1.376 104 HE1 PHE 15 HE1 PHE 15 1.333 12.044 5.419 105 HE2 PHE 15 HE2 PHE 15 1.793 8.243 3.531 106 HZ PHE 15 HZ PHE 15 1.848 9.642 5.569 107 H GLU 16 H GLU 16 -0.552 14.565 0.514 108 HA GLU 16 HA GLU 16 -2.012 15.353 2.883 109 HB2 GLU 16 HB2 GLU 16 -1.053 16.765 0.335 110 HB3 GLU 16 HB3 GLU 16 -2.193 17.630 1.304 111 HG2 GLU 16 HG2 GLU 16 0.357 16.499 2.636 112 HG3 GLU 16 HG3 GLU 16 0.346 18.037 1.771 113 H ALA 17 H ALA 17 -3.316 15.349 -0.443 114 HA ALA 17 HA ALA 17 -6.054 16.136 0.313 115 HB1 ALA 17 HB1 ALA 17 -5.058 14.642 -2.212 116 HB2 ALA 17 HB2 ALA 17 -6.602 15.504 -2.036 117 HB3 ALA 17 HB3 ALA 17 -5.087 16.411 -1.995 118 H PHE 18 H PHE 18 -4.598 12.894 0.064 119 HA PHE 18 HA PHE 18 -7.223 11.450 0.438 120 HB2 PHE 18 HB2 PHE 18 -5.281 10.539 -0.916 121 HB3 PHE 18 HB3 PHE 18 -4.326 10.395 0.526 122 HD1 PHE 18 HD2 PHE 18 -4.994 8.684 2.308 123 HD2 PHE 18 HD1 PHE 18 -6.960 8.829 -1.516 124 HE1 PHE 18 HE2 PHE 18 -5.704 6.347 2.575 125 HE2 PHE 18 HE1 PHE 18 -7.672 6.501 -1.230 126 HZ PHE 18 HZ PHE 18 -7.036 5.252 0.818 127 H MET 19 H MET 19 -4.346 11.936 2.579 128 HA MET 19 HA MET 19 -5.616 10.655 4.896 129 HB2 MET 19 HB2 MET 19 -3.210 12.541 4.713 130 HB3 MET 19 HB3 MET 19 -3.794 11.804 6.201 131 HG2 MET 19 HG2 MET 19 -1.908 10.497 5.319 132 HG3 MET 19 HG3 MET 19 -3.382 9.512 5.378 133 HE1 MET 19 HE1 MET 19 -2.578 7.822 2.165 134 HE2 MET 19 HE2 MET 19 -1.213 8.152 3.258 135 HE3 MET 19 HE3 MET 19 -2.826 7.739 3.930 136 H LYS 20 H LYS 20 -5.600 14.133 3.962 137 HA LYS 20 HA LYS 20 -7.312 14.917 6.291 138 HB2 LYS 20 HB2 LYS 20 -6.594 16.351 3.672 139 HB3 LYS 20 HB3 LYS 20 -7.901 16.937 4.677 140 HG2 LYS 20 HG2 LYS 20 -6.368 17.064 6.685 141 HG3 LYS 20 HG3 LYS 20 -5.005 16.591 5.692 142 HD2 LYS 20 HD2 LYS 20 -6.756 19.001 4.869 143 HD3 LYS 20 HD3 LYS 20 -5.663 19.204 6.196 144 HE2 LYS 20 HE2 LYS 20 -4.623 18.135 3.470 145 HE3 LYS 20 HE3 LYS 20 -4.879 19.860 3.745 146 HZ1 LYS 20 HZ1 LYS 20 -2.536 19.219 4.361 147 HZ2 LYS 20 HZ2 LYS 20 -3.053 18.145 5.427 148 HZ3 LYS 20 HZ3 LYS 20 -3.354 19.744 5.759 149 H ALA 21 H ALA 21 -8.186 13.850 2.902 150 HA ALA 21 HA ALA 21 -11.081 14.148 3.295 151 HB1 ALA 21 HB1 ALA 21 -11.239 12.640 1.295 152 HB2 ALA 21 HB2 ALA 21 -10.024 13.908 1.045 153 HB3 ALA 21 HB3 ALA 21 -9.508 12.247 1.430 154 H ILE 22 H ILE 22 -8.944 11.370 4.099 155 HA ILE 22 HA ILE 22 -11.327 9.795 5.137 156 HB ILE 22 HB ILE 22 -9.855 7.970 5.671 157 HG12 ILE 22 HG12 ILE 22 -7.453 9.433 4.460 158 HG13 ILE 22 HG13 ILE 22 -7.735 9.409 6.187 159 HG21 ILE 22 HG21 ILE 22 -9.303 7.251 3.366 160 HG22 ILE 22 HG22 ILE 22 -10.822 8.168 3.349 161 HG23 ILE 22 HG23 ILE 22 -9.314 8.934 2.797 162 HD11 ILE 22 HD11 ILE 22 -7.302 6.886 4.447 163 HD12 ILE 22 HD12 ILE 22 -6.121 7.637 5.538 164 HD13 ILE 22 HD13 ILE 22 -7.594 6.888 6.207 165 H GLY 23 H GLY 23 -9.620 12.253 6.533 166 HA2 GLY 23 HA2 GLY 23 -10.117 13.115 8.763 167 HA3 GLY 23 HA3 GLY 23 -10.733 11.563 9.257 168 H LEU 24 H LEU 24 -7.430 12.410 8.071 169 HA LEU 24 HA LEU 24 -6.352 11.626 10.813 170 HB2 LEU 24 HB2 LEU 24 -5.374 11.191 7.979 171 HB3 LEU 24 HB3 LEU 24 -4.148 11.680 9.092 172 HG LEU 24 HG LEU 24 -5.067 9.793 10.725 173 HD11 LEU 24 HD11 LEU 24 -7.179 9.278 9.444 174 HD12 LEU 24 HD12 LEU 24 -6.137 7.860 9.580 175 HD13 LEU 24 HD13 LEU 24 -6.217 8.760 8.044 176 HD21 LEU 24 HD21 LEU 24 -2.851 9.741 9.633 177 HD22 LEU 24 HD22 LEU 24 -3.566 9.068 8.143 178 HD23 LEU 24 HD23 LEU 24 -3.588 8.128 9.665 179 HA PRO 25 HA PRO 25 -4.861 15.663 11.825 180 HB2 PRO 25 HB2 PRO 25 -2.594 15.132 13.421 181 HB3 PRO 25 HB3 PRO 25 -4.254 14.929 13.894 182 HG2 PRO 25 HG2 PRO 25 -2.271 12.857 12.929 183 HG3 PRO 25 HG3 PRO 25 -3.491 12.646 14.201 184 HD2 PRO 25 HD2 PRO 25 -3.636 11.734 11.518 185 HD3 PRO 25 HD3 PRO 25 -5.067 11.921 12.552 186 H GLU 26 H GLU 26 -3.708 17.307 11.002 187 HA GLU 26 HA GLU 26 -1.875 17.051 8.813 188 HB2 GLU 26 HB2 GLU 26 -2.522 19.415 10.618 189 HB3 GLU 26 HB3 GLU 26 -1.542 19.498 9.194 190 HG2 GLU 26 HG2 GLU 26 -3.632 18.394 7.917 191 HG3 GLU 26 HG3 GLU 26 -4.549 18.883 9.328 192 H GLU 27 H GLU 27 -1.058 17.419 12.208 193 HA GLU 27 HA GLU 27 1.853 17.770 11.961 194 HB2 GLU 27 HB2 GLU 27 0.625 18.281 13.987 195 HB3 GLU 27 HB3 GLU 27 0.028 16.649 14.181 196 HG2 GLU 27 HG2 GLU 27 3.066 17.191 14.314 197 HG3 GLU 27 HG3 GLU 27 2.020 17.558 15.675 198 H LEU 28 H LEU 28 0.018 14.669 12.395 199 HA LEU 28 HA LEU 28 2.434 13.008 11.864 200 HB2 LEU 28 HB2 LEU 28 -0.454 12.044 11.622 201 HB3 LEU 28 HB3 LEU 28 0.985 11.064 11.789 202 HG LEU 28 HG LEU 28 -0.227 12.877 13.959 203 HD11 LEU 28 HD11 LEU 28 -0.008 9.788 13.807 204 HD12 LEU 28 HD12 LEU 28 -1.490 10.710 13.481 205 HD13 LEU 28 HD13 LEU 28 -0.778 10.729 15.106 206 HD21 LEU 28 HD21 LEU 28 2.154 10.980 14.412 207 HD22 LEU 28 HD22 LEU 28 1.394 12.092 15.563 208 HD23 LEU 28 HD23 LEU 28 2.309 12.743 14.207 209 H ILE 29 H ILE 29 -0.068 14.289 9.742 210 HA ILE 29 HA ILE 29 0.686 12.773 7.311 211 HB ILE 29 HB ILE 29 -0.782 15.460 7.481 212 HG12 ILE 29 HG12 ILE 29 -1.990 12.663 7.031 213 HG13 ILE 29 HG13 ILE 29 -1.938 13.401 8.588 214 HG21 ILE 29 HG21 ILE 29 -0.732 13.506 5.073 215 HG22 ILE 29 HG22 ILE 29 -1.565 15.067 5.161 216 HG23 ILE 29 HG23 ILE 29 0.189 15.034 5.146 217 HD11 ILE 29 HD11 ILE 29 -3.350 15.358 7.832 218 HD12 ILE 29 HD12 ILE 29 -3.502 14.616 6.219 219 HD13 ILE 29 HD13 ILE 29 -4.179 13.804 7.638 220 H GLN 30 H GLN 30 1.562 16.065 8.455 221 HA GLN 30 HA GLN 30 3.607 16.619 6.412 222 HB2 GLN 30 HB2 GLN 30 2.927 17.756 9.161 223 HB3 GLN 30 HB3 GLN 30 4.504 18.104 8.555 224 HG2 GLN 30 HG2 GLN 30 2.655 19.847 8.060 225 HG3 GLN 30 HG3 GLN 30 3.823 19.465 6.825 226 HE21 GLN 30 HE21 GLN 30 0.549 18.337 7.735 227 HE22 GLN 30 HE22 GLN 30 0.035 18.249 5.960 228 H LYS 31 H LYS 31 3.828 14.499 9.149 229 HA LYS 31 HA LYS 31 6.858 14.270 9.016 230 HB2 LYS 31 HB2 LYS 31 4.658 12.810 10.600 231 HB3 LYS 31 HB3 LYS 31 6.303 12.223 10.575 232 HG2 LYS 31 HG2 LYS 31 7.194 14.286 11.585 233 HG3 LYS 31 HG3 LYS 31 5.623 15.096 11.470 234 HD2 LYS 31 HD2 LYS 31 4.562 13.524 13.013 235 HD3 LYS 31 HD3 LYS 31 5.969 12.455 13.024 236 HE2 LYS 31 HE2 LYS 31 7.365 14.150 14.204 237 HE3 LYS 31 HE3 LYS 31 6.060 15.365 14.091 238 HZ1 LYS 31 HZ1 LYS 31 4.610 14.041 15.424 239 HZ2 LYS 31 HZ2 LYS 31 6.036 13.986 16.279 240 HZ3 LYS 31 HZ3 LYS 31 5.607 12.651 15.366 241 H GLY 32 H GLY 32 4.105 12.027 8.266 242 HA2 GLY 32 HA2 GLY 32 5.896 10.107 6.833 243 HA3 GLY 32 HA3 GLY 32 4.161 10.004 6.897 244 H LYS 33 H LYS 33 4.431 12.970 5.538 245 HA LYS 33 HA LYS 33 3.952 12.002 2.842 246 HB2 LYS 33 HB2 LYS 33 3.764 14.295 2.143 247 HB3 LYS 33 HB3 LYS 33 2.939 14.044 3.663 248 HG2 LYS 33 HG2 LYS 33 4.747 15.155 4.941 249 HG3 LYS 33 HG3 LYS 33 5.739 15.340 3.522 250 HD2 LYS 33 HD2 LYS 33 2.949 16.595 3.747 251 HD3 LYS 33 HD3 LYS 33 4.381 17.399 4.334 252 HE2 LYS 33 HE2 LYS 33 4.110 16.469 1.384 253 HE3 LYS 33 HE3 LYS 33 3.567 18.043 1.948 254 HZ1 LYS 33 HZ1 LYS 33 6.013 17.916 1.052 255 HZ2 LYS 33 HZ2 LYS 33 6.454 17.141 2.398 256 HZ3 LYS 33 HZ3 LYS 33 5.861 18.653 2.531 257 H ASP 34 H ASP 34 7.004 13.446 4.007 258 HA ASP 34 HA ASP 34 8.260 12.990 1.253 259 HB2 ASP 34 HB2 ASP 34 9.296 14.651 3.629 260 HB3 ASP 34 HB3 ASP 34 9.995 14.590 2.025 261 H ILE 35 H ILE 35 8.266 11.150 4.045 262 HA ILE 35 HA ILE 35 11.170 10.487 4.213 263 HB ILE 35 HB ILE 35 8.742 9.100 5.460 264 HG12 ILE 35 HG12 ILE 35 10.879 10.853 6.852 265 HG13 ILE 35 HG13 ILE 35 9.368 11.503 6.261 266 HG21 ILE 35 HG21 ILE 35 11.729 8.548 6.098 267 HG22 ILE 35 HG22 ILE 35 10.339 7.871 6.978 268 HG23 ILE 35 HG23 ILE 35 10.612 7.414 5.304 269 HD11 ILE 35 HD11 ILE 35 9.553 9.361 8.480 270 HD12 ILE 35 HD12 ILE 35 9.138 11.078 8.659 271 HD13 ILE 35 HD13 ILE 35 8.041 10.000 7.788 272 H LYS 36 H LYS 36 12.182 9.440 2.612 273 HA LYS 36 HA LYS 36 10.884 7.447 0.806 274 HB2 LYS 36 HB2 LYS 36 13.845 8.242 1.115 275 HB3 LYS 36 HB3 LYS 36 13.243 7.067 -0.030 276 HG2 LYS 36 HG2 LYS 36 11.657 8.926 -0.967 277 HG3 LYS 36 HG3 LYS 36 12.615 10.079 -0.037 278 HD2 LYS 36 HD2 LYS 36 14.730 9.222 -1.231 279 HD3 LYS 36 HD3 LYS 36 13.738 8.045 -2.095 280 HE2 LYS 36 HE2 LYS 36 12.370 10.063 -3.057 281 HE3 LYS 36 HE3 LYS 36 13.589 11.130 -2.370 282 HZ1 LYS 36 HZ1 LYS 36 14.176 8.877 -4.340 283 HZ2 LYS 36 HZ2 LYS 36 15.316 9.868 -3.705 284 HZ3 LYS 36 HZ3 LYS 36 14.171 10.477 -4.721 285 H GLY 37 H GLY 37 10.117 6.184 2.711 286 HA2 GLY 37 HA2 GLY 37 11.993 4.265 4.030 287 HA3 GLY 37 HA3 GLY 37 10.246 4.264 4.176 288 H VAL 38 H VAL 38 11.285 1.959 4.212 289 HA VAL 38 HA VAL 38 11.353 0.656 1.462 290 HB VAL 38 HB VAL 38 11.955 -0.508 4.229 291 HG11 VAL 38 HG11 VAL 38 12.290 -1.870 1.472 292 HG12 VAL 38 HG12 VAL 38 12.902 -2.508 3.021 293 HG13 VAL 38 HG13 VAL 38 11.163 -2.370 2.753 294 HG21 VAL 38 HG21 VAL 38 14.350 -0.591 3.429 295 HG22 VAL 38 HG22 VAL 38 13.884 0.168 1.886 296 HG23 VAL 38 HG23 VAL 38 13.764 1.077 3.407 297 H SER 39 H SER 39 9.763 -0.494 0.621 298 HA SER 39 HA SER 39 7.368 -1.420 2.320 299 HB2 SER 39 HB2 SER 39 7.498 -0.443 -0.576 300 HB3 SER 39 HB3 SER 39 6.111 -1.288 0.084 301 HG SER 39 HG SER 39 5.791 0.931 0.226 302 H GLU 40 H GLU 40 7.970 -3.420 2.698 303 HA GLU 40 HA GLU 40 9.329 -5.199 0.683 304 HB2 GLU 40 HB2 GLU 40 9.817 -5.067 3.230 305 HB3 GLU 40 HB3 GLU 40 8.291 -5.854 3.479 306 HG2 GLU 40 HG2 GLU 40 9.046 -7.938 2.360 307 HG3 GLU 40 HG3 GLU 40 10.570 -7.188 1.896 308 H ILE 41 H ILE 41 8.553 -7.016 -0.261 309 HA ILE 41 HA ILE 41 5.852 -8.108 0.546 310 HB ILE 41 HB ILE 41 6.519 -7.735 -2.451 311 HG12 ILE 41 HG12 ILE 41 4.313 -6.231 -0.904 312 HG13 ILE 41 HG13 ILE 41 5.852 -5.532 -1.361 313 HG21 ILE 41 HG21 ILE 41 5.114 -9.801 -1.995 314 HG22 ILE 41 HG22 ILE 41 3.917 -8.808 -1.128 315 HG23 ILE 41 HG23 ILE 41 4.187 -8.603 -2.875 316 HD11 ILE 41 HD11 ILE 41 3.732 -6.489 -3.381 317 HD12 ILE 41 HD12 ILE 41 4.230 -4.833 -3.027 318 HD13 ILE 41 HD13 ILE 41 5.374 -5.936 -3.817 319 H VAL 42 H VAL 42 6.155 -10.266 0.892 320 HA VAL 42 HA VAL 42 8.248 -11.838 -0.725 321 HB VAL 42 HB VAL 42 6.939 -12.901 1.818 322 HG11 VAL 42 HG11 VAL 42 9.659 -13.564 0.513 323 HG12 VAL 42 HG12 VAL 42 8.940 -14.369 1.926 324 HG13 VAL 42 HG13 VAL 42 8.185 -14.537 0.330 325 HG21 VAL 42 HG21 VAL 42 8.025 -10.815 2.611 326 HG22 VAL 42 HG22 VAL 42 8.914 -12.231 3.182 327 HG23 VAL 42 HG23 VAL 42 9.552 -11.270 1.820 328 H GLN 43 H GLN 43 7.263 -12.719 -2.492 329 HA GLN 43 HA GLN 43 4.345 -13.418 -2.526 330 HB2 GLN 43 HB2 GLN 43 5.504 -12.295 -4.416 331 HB3 GLN 43 HB3 GLN 43 6.530 -13.698 -4.674 332 HG2 GLN 43 HG2 GLN 43 4.507 -15.096 -5.253 333 HG3 GLN 43 HG3 GLN 43 3.451 -13.738 -4.891 334 HE21 GLN 43 HE21 GLN 43 2.717 -14.277 -7.079 335 HE22 GLN 43 HE22 GLN 43 3.583 -13.498 -8.510 336 H ASN 44 H ASN 44 3.817 -15.213 -1.356 337 HA ASN 44 HA ASN 44 5.270 -17.881 -1.930 338 HB2 ASN 44 HB2 ASN 44 3.559 -17.117 0.523 339 HB3 ASN 44 HB3 ASN 44 4.354 -18.639 0.247 340 HD21 ASN 44 HD21 ASN 44 5.043 -15.240 0.878 341 HD22 ASN 44 HD22 ASN 44 6.673 -15.629 1.619 342 H GLY 45 H GLY 45 3.862 -17.538 -3.961 343 HA2 GLY 45 HA2 GLY 45 2.110 -18.507 -5.334 344 HA3 GLY 45 HA3 GLY 45 1.622 -19.507 -3.981 345 H LYS 46 H LYS 46 -0.018 -18.745 -2.649 346 HA LYS 46 HA LYS 46 -1.758 -16.439 -3.643 347 HB2 LYS 46 HB2 LYS 46 -2.292 -18.647 -1.556 348 HB3 LYS 46 HB3 LYS 46 -3.385 -17.321 -1.877 349 HG2 LYS 46 HG2 LYS 46 -3.733 -18.068 -4.253 350 HG3 LYS 46 HG3 LYS 46 -2.540 -19.327 -4.039 351 HD2 LYS 46 HD2 LYS 46 -4.261 -20.694 -3.577 352 HD3 LYS 46 HD3 LYS 46 -4.185 -20.087 -1.955 353 HE2 LYS 46 HE2 LYS 46 -6.101 -19.118 -4.212 354 HE3 LYS 46 HE3 LYS 46 -6.518 -20.241 -2.925 355 HZ1 LYS 46 HZ1 LYS 46 -7.270 -18.116 -2.112 356 HZ2 LYS 46 HZ2 LYS 46 -5.955 -17.310 -2.675 357 HZ3 LYS 46 HZ3 LYS 46 -5.831 -18.279 -1.333 358 H HIS 47 H HIS 47 0.346 -17.237 -0.870 359 HA HIS 47 HA HIS 47 -0.780 -14.946 0.795 360 HB2 HIS 47 HB2 HIS 47 1.224 -17.183 1.477 361 HB3 HIS 47 HB3 HIS 47 0.925 -15.826 2.534 362 HD1 HIS 47 HD1 HIS 47 -0.759 -19.089 1.409 363 HD2 HIS 47 HD2 HIS 47 -1.490 -15.587 3.758 364 HE1 HIS 47 HE1 HIS 47 -2.908 -19.385 2.817 365 H PHE 48 H PHE 48 -0.043 -13.034 0.303 366 HA PHE 48 HA PHE 48 2.881 -12.544 -0.495 367 HB2 PHE 48 HB2 PHE 48 0.277 -10.966 -0.815 368 HB3 PHE 48 HB3 PHE 48 1.821 -10.210 -0.994 369 HD1 PHE 48 HD1 PHE 48 0.328 -13.494 -2.375 370 HD2 PHE 48 HD2 PHE 48 2.212 -9.720 -3.209 371 HE1 PHE 48 HE1 PHE 48 0.233 -13.966 -4.775 372 HE2 PHE 48 HE2 PHE 48 2.075 -10.200 -5.604 373 HZ PHE 48 HZ PHE 48 1.109 -12.304 -6.403 374 H LYS 49 H LYS 49 4.037 -12.344 1.351 375 HA LYS 49 HA LYS 49 2.886 -11.052 3.847 376 HB2 LYS 49 HB2 LYS 49 5.655 -12.283 3.421 377 HB3 LYS 49 HB3 LYS 49 5.064 -11.651 4.939 378 HG2 LYS 49 HG2 LYS 49 3.279 -13.329 5.078 379 HG3 LYS 49 HG3 LYS 49 3.597 -13.900 3.456 380 HD2 LYS 49 HD2 LYS 49 6.059 -14.428 4.370 381 HD3 LYS 49 HD3 LYS 49 5.376 -14.218 5.970 382 HE2 LYS 49 HE2 LYS 49 4.448 -16.253 3.814 383 HE3 LYS 49 HE3 LYS 49 5.516 -16.620 5.163 384 HZ1 LYS 49 HZ1 LYS 49 3.231 -17.240 5.873 385 HZ2 LYS 49 HZ2 LYS 49 2.571 -15.812 5.397 386 HZ3 LYS 49 HZ3 LYS 49 3.511 -15.820 6.671 387 H PHE 50 H PHE 50 2.970 -8.964 4.118 388 HA PHE 50 HA PHE 50 5.209 -7.389 2.769 389 HB2 PHE 50 HB2 PHE 50 3.904 -5.501 2.423 390 HB3 PHE 50 HB3 PHE 50 3.138 -6.887 1.738 391 HD1 PHE 50 HD2 PHE 50 2.699 -5.444 5.329 392 HD2 PHE 50 HD1 PHE 50 1.041 -5.963 1.400 393 HE1 PHE 50 HE2 PHE 50 0.645 -4.380 6.055 394 HE2 PHE 50 HE1 PHE 50 -1.027 -4.909 2.142 395 HZ PHE 50 HZ PHE 50 -1.241 -4.101 4.481 396 H THR 51 H THR 51 6.341 -5.864 3.657 397 HA THR 51 HA THR 51 5.828 -5.105 6.614 398 HB THR 51 HB THR 51 8.668 -5.336 5.489 399 HG1 THR 51 HG1 THR 51 8.617 -7.372 5.795 400 HG21 THR 51 HG21 THR 51 8.472 -3.893 7.477 401 HG22 THR 51 HG22 THR 51 9.352 -5.396 7.841 402 HG23 THR 51 HG23 THR 51 7.674 -5.211 8.381 403 H ILE 52 H ILE 52 4.754 -3.208 6.123 404 HA ILE 52 HA ILE 52 5.950 -1.331 4.035 405 HB ILE 52 HB ILE 52 3.137 -1.381 5.197 406 HG12 ILE 52 HG12 ILE 52 3.392 -3.358 3.855 407 HG13 ILE 52 HG13 ILE 52 2.352 -2.249 3.006 408 HG21 ILE 52 HG21 ILE 52 2.479 0.161 3.337 409 HG22 ILE 52 HG22 ILE 52 3.645 0.926 4.414 410 HG23 ILE 52 HG23 ILE 52 4.177 0.308 2.830 411 HD11 ILE 52 HD11 ILE 52 5.324 -2.858 2.339 412 HD12 ILE 52 HD12 ILE 52 3.912 -3.383 1.421 413 HD13 ILE 52 HD13 ILE 52 4.333 -1.656 1.469 414 H THR 53 H THR 53 6.707 0.571 4.461 415 HA THR 53 HA THR 53 6.760 1.655 7.298 416 HB THR 53 HB THR 53 8.401 3.357 6.368 417 HG1 THR 53 HG1 THR 53 8.658 1.517 4.232 418 HG21 THR 53 HG21 THR 53 10.336 1.790 6.313 419 HG22 THR 53 HG22 THR 53 9.240 0.392 6.172 420 HG23 THR 53 HG23 THR 53 9.233 1.392 7.645 421 H ALA 54 H ALA 54 5.087 2.757 7.808 422 HA ALA 54 HA ALA 54 3.821 4.898 5.980 423 HB1 ALA 54 HB1 ALA 54 2.901 3.571 8.631 424 HB2 ALA 54 HB2 ALA 54 2.011 4.839 7.778 425 HB3 ALA 54 HB3 ALA 54 2.251 3.258 6.999 426 H GLY 55 H GLY 55 6.050 5.812 6.291 427 HA2 GLY 55 HA2 GLY 55 7.217 7.808 6.984 428 HA3 GLY 55 HA3 GLY 55 5.971 8.186 8.159 429 H SER 56 H SER 56 6.129 7.301 10.202 430 HA SER 56 HA SER 56 8.826 6.167 11.087 431 HB2 SER 56 HB2 SER 56 6.533 7.181 12.868 432 HB3 SER 56 HB3 SER 56 8.146 6.725 13.391 433 HG SER 56 HG SER 56 7.603 9.083 12.990 434 H LYS 57 H LYS 57 5.409 5.134 10.938 435 HA LYS 57 HA LYS 57 5.887 2.813 12.804 436 HB2 LYS 57 HB2 LYS 57 3.711 4.150 12.800 437 HB3 LYS 57 HB3 LYS 57 3.340 3.486 11.216 438 HG2 LYS 57 HG2 LYS 57 3.526 1.107 12.302 439 HG3 LYS 57 HG3 LYS 57 3.708 1.907 13.860 440 HD2 LYS 57 HD2 LYS 57 1.407 2.983 13.527 441 HD3 LYS 57 HD3 LYS 57 1.278 2.181 11.958 442 HE2 LYS 57 HE2 LYS 57 1.571 -0.107 13.163 443 HE3 LYS 57 HE3 LYS 57 1.538 0.749 14.708 444 HZ1 LYS 57 HZ1 LYS 57 -0.706 0.568 12.656 445 HZ2 LYS 57 HZ2 LYS 57 -0.786 1.641 13.926 446 HZ3 LYS 57 HZ3 LYS 57 -0.755 -0.013 14.104 447 H VAL 58 H VAL 58 6.399 0.830 12.220 448 HA VAL 58 HA VAL 58 6.446 -0.058 9.315 449 HB VAL 58 HB VAL 58 7.503 -1.490 11.817 450 HG11 VAL 58 HG11 VAL 58 7.922 -2.141 8.821 451 HG12 VAL 58 HG12 VAL 58 8.737 -2.965 10.176 452 HG13 VAL 58 HG13 VAL 58 6.985 -3.121 9.970 453 HG21 VAL 58 HG21 VAL 58 8.873 0.584 11.309 454 HG22 VAL 58 HG22 VAL 58 9.798 -0.889 10.979 455 HG23 VAL 58 HG23 VAL 58 9.093 0.040 9.634 456 H ILE 59 H ILE 59 4.541 -0.747 8.583 457 HA ILE 59 HA ILE 59 2.540 -2.215 10.405 458 HB ILE 59 HB ILE 59 2.057 -0.818 7.718 459 HG12 ILE 59 HG12 ILE 59 1.099 0.030 10.532 460 HG13 ILE 59 HG13 ILE 59 2.467 0.755 9.704 461 HG21 ILE 59 HG21 ILE 59 0.001 -2.139 9.632 462 HG22 ILE 59 HG22 ILE 59 -0.394 -1.256 8.143 463 HG23 ILE 59 HG23 ILE 59 0.487 -2.777 8.038 464 HD11 ILE 59 HD11 ILE 59 -0.471 0.944 8.825 465 HD12 ILE 59 HD12 ILE 59 0.616 2.244 9.348 466 HD13 ILE 59 HD13 ILE 59 0.884 1.449 7.777 467 H GLN 60 H GLN 60 3.246 -4.295 10.351 468 HA GLN 60 HA GLN 60 3.692 -5.620 7.653 469 HB2 GLN 60 HB2 GLN 60 5.088 -7.221 8.622 470 HB3 GLN 60 HB3 GLN 60 5.644 -5.620 9.016 471 HG2 GLN 60 HG2 GLN 60 4.154 -7.461 10.985 472 HG3 GLN 60 HG3 GLN 60 5.895 -7.374 10.837 473 HE21 GLN 60 HE21 GLN 60 6.972 -5.492 11.692 474 HE22 GLN 60 HE22 GLN 60 6.035 -4.293 12.734 475 H ASN 61 H ASN 61 2.408 -7.009 6.935 476 HA ASN 61 HA ASN 61 0.534 -8.738 8.430 477 HB2 ASN 61 HB2 ASN 61 -0.754 -6.467 6.750 478 HB3 ASN 61 HB3 ASN 61 -1.594 -7.906 7.256 479 HD21 ASN 61 HD21 ASN 61 -0.243 -4.952 8.489 480 HD22 ASN 61 HD22 ASN 61 -1.187 -5.051 10.053 481 H GLU 62 H GLU 62 -0.737 -10.153 6.819 482 HA GLU 62 HA GLU 62 0.689 -10.302 4.132 483 HB2 GLU 62 HB2 GLU 62 1.046 -12.561 4.150 484 HB3 GLU 62 HB3 GLU 62 1.682 -11.921 5.656 485 HG2 GLU 62 HG2 GLU 62 -0.283 -12.944 6.914 486 HG3 GLU 62 HG3 GLU 62 -0.922 -13.579 5.394 487 H PHE 63 H PHE 63 -0.450 -10.501 2.404 488 HA PHE 63 HA PHE 63 -3.460 -10.823 2.701 489 HB2 PHE 63 HB2 PHE 63 -3.934 -9.633 0.726 490 HB3 PHE 63 HB3 PHE 63 -3.107 -8.709 1.910 491 HD1 PHE 63 HD1 PHE 63 -0.754 -7.848 1.400 492 HD2 PHE 63 HD2 PHE 63 -2.901 -10.217 -1.473 493 HE1 PHE 63 HE1 PHE 63 0.782 -7.098 -0.405 494 HE2 PHE 63 HE2 PHE 63 -1.391 -9.423 -3.248 495 HZ PHE 63 HZ PHE 63 0.448 -7.852 -2.697 496 H THR 64 H THR 64 -4.522 -12.329 1.839 497 HA THR 64 HA THR 64 -3.134 -14.489 0.227 498 HB THR 64 HB THR 64 -5.910 -14.599 1.542 499 HG1 THR 64 HG1 THR 64 -3.903 -15.979 2.754 500 HG21 THR 64 HG21 THR 64 -5.489 -16.425 -0.128 501 HG22 THR 64 HG22 THR 64 -5.508 -17.079 1.527 502 HG23 THR 64 HG23 THR 64 -3.952 -16.849 0.680 503 H VAL 65 H VAL 65 -3.272 -14.228 -1.926 504 HA VAL 65 HA VAL 65 -5.366 -12.652 -3.297 505 HB VAL 65 HB VAL 65 -3.240 -14.526 -4.400 506 HG11 VAL 65 HG11 VAL 65 -5.029 -14.293 -6.164 507 HG12 VAL 65 HG12 VAL 65 -4.834 -12.526 -6.120 508 HG13 VAL 65 HG13 VAL 65 -3.495 -13.562 -6.647 509 HG21 VAL 65 HG21 VAL 65 -3.329 -11.419 -4.316 510 HG22 VAL 65 HG22 VAL 65 -2.286 -12.443 -3.304 511 HG23 VAL 65 HG23 VAL 65 -2.030 -12.378 -5.055 512 H GLY 66 H GLY 66 -7.385 -13.295 -3.624 513 HA2 GLY 66 HA2 GLY 66 -9.163 -14.762 -4.509 514 HA3 GLY 66 HA3 GLY 66 -8.110 -16.150 -4.469 515 H GLU 67 H GLU 67 -7.884 -14.854 -1.392 516 HA GLU 67 HA GLU 67 -10.449 -15.900 -0.327 517 HB2 GLU 67 HB2 GLU 67 -7.770 -17.271 0.446 518 HB3 GLU 67 HB3 GLU 67 -9.124 -17.281 1.543 519 HG2 GLU 67 HG2 GLU 67 -9.365 -18.461 -1.298 520 HG3 GLU 67 HG3 GLU 67 -8.925 -19.390 0.133 521 H GLU 68 H GLU 68 -10.844 -15.289 1.888 522 HA GLU 68 HA GLU 68 -10.355 -12.540 2.275 523 HB2 GLU 68 HB2 GLU 68 -11.426 -12.629 4.408 524 HB3 GLU 68 HB3 GLU 68 -12.301 -13.541 3.216 525 HG2 GLU 68 HG2 GLU 68 -12.028 -15.589 4.321 526 HG3 GLU 68 HG3 GLU 68 -10.395 -15.228 4.840 527 H CYS 69 H CYS 69 -8.965 -11.231 3.166 528 HA CYS 69 HA CYS 69 -6.952 -12.194 5.241 529 HB2 CYS 69 HB2 CYS 69 -5.116 -10.906 3.971 530 HB3 CYS 69 HB3 CYS 69 -5.636 -12.491 3.393 531 HG CYS 69 HG CYS 69 -6.952 -11.732 1.348 532 H GLU 70 H GLU 70 -6.673 -10.930 6.781 533 HA GLU 70 HA GLU 70 -8.042 -8.248 6.963 534 HB2 GLU 70 HB2 GLU 70 -7.772 -8.342 9.367 535 HB3 GLU 70 HB3 GLU 70 -8.748 -9.606 8.682 536 HG2 GLU 70 HG2 GLU 70 -6.924 -11.297 8.960 537 HG3 GLU 70 HG3 GLU 70 -5.830 -10.017 9.460 538 H LEU 71 H LEU 71 -6.999 -6.494 6.459 539 HA LEU 71 HA LEU 71 -4.029 -6.139 7.226 540 HB2 LEU 71 HB2 LEU 71 -5.540 -4.808 4.902 541 HB3 LEU 71 HB3 LEU 71 -3.844 -4.601 5.289 542 HG LEU 71 HG LEU 71 -5.171 -7.171 4.230 543 HD11 LEU 71 HD11 LEU 71 -4.886 -5.273 2.581 544 HD12 LEU 71 HD12 LEU 71 -3.873 -6.655 2.153 545 HD13 LEU 71 HD13 LEU 71 -3.152 -5.224 2.924 546 HD21 LEU 71 HD21 LEU 71 -2.834 -8.113 4.019 547 HD22 LEU 71 HD22 LEU 71 -3.273 -7.845 5.699 548 HD23 LEU 71 HD23 LEU 71 -2.176 -6.706 4.874 549 H GLU 72 H GLU 72 -3.426 -4.312 8.322 550 HA GLU 72 HA GLU 72 -5.470 -2.646 9.704 551 HB2 GLU 72 HB2 GLU 72 -3.153 -3.315 10.605 552 HB3 GLU 72 HB3 GLU 72 -2.423 -2.209 9.446 553 HG2 GLU 72 HG2 GLU 72 -3.818 -0.292 10.595 554 HG3 GLU 72 HG3 GLU 72 -4.291 -1.472 11.812 555 H THR 73 H THR 73 -6.099 -0.686 9.405 556 HA THR 73 HA THR 73 -5.496 0.807 6.798 557 HB THR 73 HB THR 73 -7.700 -0.019 6.647 558 HG1 THR 73 HG1 THR 73 -8.633 2.363 7.494 559 HG21 THR 73 HG21 THR 73 -9.587 0.514 8.274 560 HG22 THR 73 HG22 THR 73 -8.371 1.180 9.400 561 HG23 THR 73 HG23 THR 73 -8.373 -0.556 8.982 562 H MET 74 H MET 74 -5.946 3.053 6.925 563 HA MET 74 HA MET 74 -4.474 4.421 9.235 564 HB2 MET 74 HB2 MET 74 -5.461 5.511 6.532 565 HB3 MET 74 HB3 MET 74 -4.956 6.578 7.825 566 HG2 MET 74 HG2 MET 74 -3.121 4.462 6.546 567 HG3 MET 74 HG3 MET 74 -3.105 6.199 6.226 568 HE1 MET 74 HE1 MET 74 -2.314 3.358 8.852 569 HE2 MET 74 HE2 MET 74 -1.002 3.802 7.720 570 HE3 MET 74 HE3 MET 74 -0.820 4.128 9.472 571 H THR 75 H THR 75 -7.652 4.938 7.630 572 HA THR 75 HA THR 75 -8.817 5.755 10.348 573 HB THR 75 HB THR 75 -10.154 5.988 7.609 574 HG1 THR 75 HG1 THR 75 -9.819 8.306 8.202 575 HG21 THR 75 HG21 THR 75 -10.960 7.247 10.322 576 HG22 THR 75 HG22 THR 75 -11.819 5.897 9.535 577 HG23 THR 75 HG23 THR 75 -11.785 7.492 8.766 578 H GLY 76 H GLY 76 -9.738 4.177 11.398 579 HA2 GLY 76 HA2 GLY 76 -11.728 2.474 11.241 580 HA3 GLY 76 HA3 GLY 76 -10.851 1.645 9.996 581 H GLU 77 H GLU 77 -9.409 0.016 10.635 582 HA GLU 77 HA GLU 77 -8.627 -0.555 13.352 583 HB2 GLU 77 HB2 GLU 77 -10.167 -2.187 14.141 584 HB3 GLU 77 HB3 GLU 77 -10.934 -0.642 13.950 585 HG2 GLU 77 HG2 GLU 77 -11.490 -3.205 12.350 586 HG3 GLU 77 HG3 GLU 77 -12.521 -2.255 13.383 587 H LYS 78 H LYS 78 -10.092 -2.720 11.043 588 HA LYS 78 HA LYS 78 -7.603 -3.561 9.748 589 HB2 LYS 78 HB2 LYS 78 -7.807 -4.777 12.254 590 HB3 LYS 78 HB3 LYS 78 -8.738 -5.939 11.336 591 HG2 LYS 78 HG2 LYS 78 -6.730 -6.107 9.700 592 HG3 LYS 78 HG3 LYS 78 -5.896 -4.926 10.719 593 HD2 LYS 78 HD2 LYS 78 -6.072 -6.547 12.699 594 HD3 LYS 78 HD3 LYS 78 -6.914 -7.694 11.656 595 HE2 LYS 78 HE2 LYS 78 -4.807 -7.688 10.103 596 HE3 LYS 78 HE3 LYS 78 -3.974 -6.715 11.311 597 HZ1 LYS 78 HZ1 LYS 78 -4.373 -8.553 12.963 598 HZ2 LYS 78 HZ2 LYS 78 -3.686 -9.234 11.615 599 HZ3 LYS 78 HZ3 LYS 78 -5.321 -9.387 11.902 600 H VAL 79 H VAL 79 -8.230 -3.941 7.772 601 HA VAL 79 HA VAL 79 -11.165 -4.564 7.238 602 HB VAL 79 HB VAL 79 -10.226 -2.408 6.472 603 HG11 VAL 79 HG11 VAL 79 -8.865 -2.177 4.423 604 HG12 VAL 79 HG12 VAL 79 -7.926 -2.971 5.693 605 HG13 VAL 79 HG13 VAL 79 -8.591 -3.931 4.357 606 HG21 VAL 79 HG21 VAL 79 -11.223 -4.138 4.135 607 HG22 VAL 79 HG22 VAL 79 -12.259 -3.409 5.393 608 HG23 VAL 79 HG23 VAL 79 -11.336 -2.370 4.297 609 H LYS 80 H LYS 80 -11.791 -6.424 6.357 610 HA LYS 80 HA LYS 80 -9.758 -8.429 5.349 611 HB2 LYS 80 HB2 LYS 80 -12.734 -8.751 5.946 612 HB3 LYS 80 HB3 LYS 80 -11.808 -9.940 5.046 613 HG2 LYS 80 HG2 LYS 80 -10.080 -10.010 6.933 614 HG3 LYS 80 HG3 LYS 80 -11.139 -8.992 7.912 615 HD2 LYS 80 HD2 LYS 80 -12.931 -10.808 7.776 616 HD3 LYS 80 HD3 LYS 80 -11.880 -11.745 6.719 617 HE2 LYS 80 HE2 LYS 80 -10.085 -11.754 8.641 618 HE3 LYS 80 HE3 LYS 80 -11.292 -11.023 9.693 619 HZ1 LYS 80 HZ1 LYS 80 -11.446 -13.498 9.866 620 HZ2 LYS 80 HZ2 LYS 80 -11.516 -13.684 8.221 621 HZ3 LYS 80 HZ3 LYS 80 -12.792 -13.041 8.991 622 H THR 81 H THR 81 -8.975 -7.525 3.627 623 HA THR 81 HA THR 81 -10.753 -6.818 1.220 624 HB THR 81 HB THR 81 -9.620 -4.917 2.266 625 HG1 THR 81 HG1 THR 81 -8.610 -5.590 -0.298 626 HG21 THR 81 HG21 THR 81 -7.434 -6.103 3.075 627 HG22 THR 81 HG22 THR 81 -7.225 -4.540 2.301 628 HG23 THR 81 HG23 THR 81 -6.869 -6.016 1.391 629 H VAL 82 H VAL 82 -10.759 -8.530 -0.130 630 HA VAL 82 HA VAL 82 -8.316 -10.299 -0.366 631 HB VAL 82 HB VAL 82 -10.461 -11.477 -0.153 632 HG11 VAL 82 HG11 VAL 82 -11.798 -12.015 -2.203 633 HG12 VAL 82 HG12 VAL 82 -12.006 -10.305 -1.742 634 HG13 VAL 82 HG13 VAL 82 -10.950 -10.746 -3.115 635 HG21 VAL 82 HG21 VAL 82 -8.899 -12.146 -2.734 636 HG22 VAL 82 HG22 VAL 82 -8.366 -12.535 -1.088 637 HG23 VAL 82 HG23 VAL 82 -9.862 -13.247 -1.720 638 H VAL 83 H VAL 83 -7.012 -10.409 -2.053 639 HA VAL 83 HA VAL 83 -7.189 -8.131 -4.078 640 HB VAL 83 HB VAL 83 -4.640 -9.624 -3.275 641 HG11 VAL 83 HG11 VAL 83 -3.514 -7.561 -4.092 642 HG12 VAL 83 HG12 VAL 83 -4.527 -8.240 -5.383 643 HG13 VAL 83 HG13 VAL 83 -5.075 -6.806 -4.490 644 HG21 VAL 83 HG21 VAL 83 -4.058 -7.632 -1.771 645 HG22 VAL 83 HG22 VAL 83 -5.734 -7.087 -1.872 646 HG23 VAL 83 HG23 VAL 83 -5.359 -8.641 -1.128 647 H GLN 84 H GLN 84 -7.355 -8.517 -6.181 648 HA GLN 84 HA GLN 84 -7.060 -11.391 -7.247 649 HB2 GLN 84 HB2 GLN 84 -8.729 -9.013 -8.201 650 HB3 GLN 84 HB3 GLN 84 -8.298 -10.276 -9.313 651 HG2 GLN 84 HG2 GLN 84 -10.528 -10.701 -8.461 652 HG3 GLN 84 HG3 GLN 84 -9.457 -12.018 -8.065 653 HE21 GLN 84 HE21 GLN 84 -9.347 -12.592 -5.903 654 HE22 GLN 84 HE22 GLN 84 -10.263 -11.671 -4.595 655 H LEU 85 H LEU 85 -5.720 -11.834 -8.917 656 HA LEU 85 HA LEU 85 -3.595 -9.743 -9.573 657 HB2 LEU 85 HB2 LEU 85 -2.857 -11.503 -8.011 658 HB3 LEU 85 HB3 LEU 85 -3.391 -12.766 -9.107 659 HG LEU 85 HG LEU 85 -1.702 -12.126 -10.776 660 HD11 LEU 85 HD11 LEU 85 -0.658 -10.062 -8.710 661 HD12 LEU 85 HD12 LEU 85 -1.387 -9.668 -10.286 662 HD13 LEU 85 HD13 LEU 85 0.150 -10.514 -10.211 663 HD21 LEU 85 HD21 LEU 85 0.322 -12.922 -9.463 664 HD22 LEU 85 HD22 LEU 85 -1.133 -13.864 -9.087 665 HD23 LEU 85 HD23 LEU 85 -0.560 -12.625 -7.947 666 H GLU 86 H GLU 86 -3.458 -9.180 -11.621 667 HA GLU 86 HA GLU 86 -4.195 -11.151 -13.870 668 HB2 GLU 86 HB2 GLU 86 -5.540 -8.984 -13.734 669 HB3 GLU 86 HB3 GLU 86 -4.047 -8.119 -14.045 670 HG2 GLU 86 HG2 GLU 86 -3.842 -9.397 -16.298 671 HG3 GLU 86 HG3 GLU 86 -5.459 -10.037 -15.993 672 H GLY 87 H GLY 87 -2.674 -11.752 -15.131 673 HA2 GLY 87 HA2 GLY 87 -0.480 -12.254 -16.090 674 HA3 GLY 87 HA3 GLY 87 -0.387 -10.512 -16.175 675 H ASP 88 H ASP 88 -0.270 -11.849 -13.119 676 HA ASP 88 HA ASP 88 1.344 -11.860 -11.405 677 HB2 ASP 88 HB2 ASP 88 2.389 -13.675 -12.868 678 HB3 ASP 88 HB3 ASP 88 3.557 -12.475 -13.396 679 H ASN 89 H ASN 89 0.757 -9.358 -12.892 680 HA ASN 89 HA ASN 89 2.707 -7.672 -11.282 681 HB2 ASN 89 HB2 ASN 89 3.454 -6.331 -12.934 682 HB3 ASN 89 HB3 ASN 89 3.513 -7.883 -13.695 683 HD21 ASN 89 HD21 ASN 89 3.233 -4.982 -14.604 684 HD22 ASN 89 HD22 ASN 89 1.898 -5.117 -15.874 685 H LYS 90 H LYS 90 -0.591 -7.730 -12.553 686 HA LYS 90 HA LYS 90 -1.139 -5.014 -11.228 687 HB2 LYS 90 HB2 LYS 90 -2.793 -6.774 -13.094 688 HB3 LYS 90 HB3 LYS 90 -3.372 -5.256 -12.454 689 HG2 LYS 90 HG2 LYS 90 -1.753 -3.949 -13.739 690 HG3 LYS 90 HG3 LYS 90 -0.826 -5.386 -14.185 691 HD2 LYS 90 HD2 LYS 90 -2.853 -6.321 -15.389 692 HD3 LYS 90 HD3 LYS 90 -3.762 -4.869 -15.060 693 HE2 LYS 90 HE2 LYS 90 -1.122 -5.014 -16.698 694 HE3 LYS 90 HE3 LYS 90 -2.744 -5.099 -17.389 695 HZ1 LYS 90 HZ1 LYS 90 -1.960 -2.748 -17.468 696 HZ2 LYS 90 HZ2 LYS 90 -1.612 -2.690 -15.860 697 HZ3 LYS 90 HZ3 LYS 90 -3.177 -2.815 -16.354 698 H LEU 91 H LEU 91 -1.612 -5.238 -9.109 699 HA LEU 91 HA LEU 91 -3.472 -7.484 -8.125 700 HB2 LEU 91 HB2 LEU 91 -1.488 -5.626 -6.746 701 HB3 LEU 91 HB3 LEU 91 -2.641 -6.509 -5.817 702 HG LEU 91 HG LEU 91 -0.582 -7.856 -7.660 703 HD11 LEU 91 HD11 LEU 91 0.514 -6.578 -5.800 704 HD12 LEU 91 HD12 LEU 91 0.658 -8.317 -5.497 705 HD13 LEU 91 HD13 LEU 91 -0.552 -7.348 -4.613 706 HD21 LEU 91 HD21 LEU 91 -2.585 -9.340 -7.137 707 HD22 LEU 91 HD22 LEU 91 -2.304 -9.105 -5.400 708 HD23 LEU 91 HD23 LEU 91 -1.097 -9.944 -6.384 709 H VAL 92 H VAL 92 -5.572 -6.915 -8.007 710 HA VAL 92 HA VAL 92 -6.325 -4.032 -7.247 711 HB VAL 92 HB VAL 92 -8.373 -4.252 -8.492 712 HG11 VAL 92 HG11 VAL 92 -6.008 -4.944 -10.335 713 HG12 VAL 92 HG12 VAL 92 -7.479 -4.042 -10.771 714 HG13 VAL 92 HG13 VAL 92 -6.304 -3.345 -9.634 715 HG21 VAL 92 HG21 VAL 92 -8.837 -6.074 -10.147 716 HG22 VAL 92 HG22 VAL 92 -7.455 -7.009 -9.530 717 HG23 VAL 92 HG23 VAL 92 -8.864 -6.695 -8.488 718 H THR 93 H THR 93 -7.368 -3.654 -5.388 719 HA THR 93 HA THR 93 -9.290 -5.760 -4.319 720 HB THR 93 HB THR 93 -7.022 -6.085 -3.280 721 HG1 THR 93 HG1 THR 93 -8.782 -6.954 -2.337 722 HG21 THR 93 HG21 THR 93 -6.223 -3.802 -2.721 723 HG22 THR 93 HG22 THR 93 -6.413 -4.753 -1.239 724 HG23 THR 93 HG23 THR 93 -7.629 -3.531 -1.648 725 H THR 94 H THR 94 -10.394 -4.988 -2.321 726 HA THR 94 HA THR 94 -11.610 -2.194 -2.770 727 HB THR 94 HB THR 94 -13.208 -4.709 -1.997 728 HG1 THR 94 HG1 THR 94 -14.181 -4.419 -3.975 729 HG21 THR 94 HG21 THR 94 -14.201 -2.590 -1.038 730 HG22 THR 94 HG22 THR 94 -15.232 -3.253 -2.317 731 HG23 THR 94 HG23 THR 94 -14.197 -1.842 -2.654 732 H PHE 95 H PHE 95 -10.637 -1.167 -1.112 733 HA PHE 95 HA PHE 95 -10.077 -2.555 1.530 734 HB2 PHE 95 HB2 PHE 95 -8.506 -1.019 -0.095 735 HB3 PHE 95 HB3 PHE 95 -9.333 0.279 0.688 736 HD1 PHE 95 HD2 PHE 95 -7.141 -2.655 1.189 737 HD2 PHE 95 HD1 PHE 95 -8.478 1.059 2.885 738 HE1 PHE 95 HE2 PHE 95 -5.434 -2.839 2.951 739 HE2 PHE 95 HE1 PHE 95 -6.741 0.893 4.603 740 HZ PHE 95 HZ PHE 95 -5.239 -1.078 4.681 741 H LYS 96 H LYS 96 -10.321 0.406 2.719 742 HA LYS 96 HA LYS 96 -13.172 0.095 3.754 743 HB2 LYS 96 HB2 LYS 96 -11.060 2.242 4.377 744 HB3 LYS 96 HB3 LYS 96 -12.613 2.138 5.150 745 HG2 LYS 96 HG2 LYS 96 -10.459 -0.062 5.348 746 HG3 LYS 96 HG3 LYS 96 -10.565 1.292 6.437 747 HD2 LYS 96 HD2 LYS 96 -12.814 -0.809 6.108 748 HD3 LYS 96 HD3 LYS 96 -11.518 -0.889 7.290 749 HE2 LYS 96 HE2 LYS 96 -12.297 1.427 8.206 750 HE3 LYS 96 HE3 LYS 96 -13.741 1.248 7.210 751 HZ1 LYS 96 HZ1 LYS 96 -12.825 -0.806 9.306 752 HZ2 LYS 96 HZ2 LYS 96 -14.196 -0.937 8.413 753 HZ3 LYS 96 HZ3 LYS 96 -13.996 0.228 9.566 754 H ASN 97 H ASN 97 -14.308 0.452 1.724 755 HA ASN 97 HA ASN 97 -15.061 1.500 -0.216 756 HB2 ASN 97 HB2 ASN 97 -15.141 3.906 1.684 757 HB3 ASN 97 HB3 ASN 97 -15.986 3.761 0.166 758 HD21 ASN 97 HD21 ASN 97 -17.913 2.542 0.072 759 HD22 ASN 97 HD22 ASN 97 -18.641 1.864 1.622 760 H ILE 98 H ILE 98 -12.265 1.347 -0.235 761 HA ILE 98 HA ILE 98 -11.531 3.588 -2.227 762 HB ILE 98 HB ILE 98 -9.695 2.159 -0.227 763 HG12 ILE 98 HG12 ILE 98 -9.989 5.175 0.005 764 HG13 ILE 98 HG13 ILE 98 -11.330 4.237 0.587 765 HG21 ILE 98 HG21 ILE 98 -8.399 2.764 -2.268 766 HG22 ILE 98 HG22 ILE 98 -8.944 4.453 -2.149 767 HG23 ILE 98 HG23 ILE 98 -7.887 3.751 -0.898 768 HD11 ILE 98 HD11 ILE 98 -9.954 2.973 2.179 769 HD12 ILE 98 HD12 ILE 98 -8.454 3.699 1.563 770 HD13 ILE 98 HD13 ILE 98 -9.660 4.710 2.402 771 H LYS 99 H LYS 99 -10.820 2.824 -4.179 772 HA LYS 99 HA LYS 99 -10.540 -0.204 -4.574 773 HB2 LYS 99 HB2 LYS 99 -12.163 1.068 -6.019 774 HB3 LYS 99 HB3 LYS 99 -10.861 1.972 -6.697 775 HG2 LYS 99 HG2 LYS 99 -10.468 0.360 -8.238 776 HG3 LYS 99 HG3 LYS 99 -10.006 -0.791 -7.023 777 HD2 LYS 99 HD2 LYS 99 -12.845 -0.286 -8.114 778 HD3 LYS 99 HD3 LYS 99 -11.829 -1.640 -8.528 779 HE2 LYS 99 HE2 LYS 99 -13.023 -1.115 -5.705 780 HE3 LYS 99 HE3 LYS 99 -13.722 -2.179 -6.911 781 HZ1 LYS 99 HZ1 LYS 99 -11.639 -3.574 -6.811 782 HZ2 LYS 99 HZ2 LYS 99 -12.327 -3.442 -5.306 783 HZ3 LYS 99 HZ3 LYS 99 -10.990 -2.584 -5.664 784 H SER 100 H SER 100 -8.556 -0.768 -3.999 785 HA SER 100 HA SER 100 -6.133 0.990 -4.512 786 HB2 SER 100 HB2 SER 100 -6.524 0.038 -2.241 787 HB3 SER 100 HB3 SER 100 -6.385 -1.594 -2.878 788 HG SER 100 HG SER 100 -4.239 -1.109 -3.512 789 H VAL 101 H VAL 101 -5.104 0.771 -6.339 790 HA VAL 101 HA VAL 101 -4.920 -1.946 -7.784 791 HB VAL 101 HB VAL 101 -4.850 0.919 -8.906 792 HG11 VAL 101 HG11 VAL 101 -3.390 -0.539 -10.300 793 HG12 VAL 101 HG12 VAL 101 -4.682 -1.748 -10.463 794 HG13 VAL 101 HG13 VAL 101 -4.858 -0.128 -11.190 795 HG21 VAL 101 HG21 VAL 101 -6.995 0.344 -10.082 796 HG22 VAL 101 HG22 VAL 101 -7.050 -1.231 -9.252 797 HG23 VAL 101 HG23 VAL 101 -7.192 0.277 -8.326 798 H THR 102 H THR 102 -2.970 -2.828 -7.267 799 HA THR 102 HA THR 102 -0.514 -1.023 -7.092 800 HB THR 102 HB THR 102 -0.465 -3.915 -6.191 801 HG1 THR 102 HG1 THR 102 -0.915 -1.772 -4.396 802 HG21 THR 102 HG21 THR 102 1.187 -1.487 -5.255 803 HG22 THR 102 HG22 THR 102 1.719 -2.672 -6.469 804 HG23 THR 102 HG23 THR 102 1.421 -3.196 -4.809 805 H GLU 103 H GLU 103 0.747 -0.928 -8.964 806 HA GLU 103 HA GLU 103 0.674 -3.375 -10.815 807 HB2 GLU 103 HB2 GLU 103 -0.467 -1.247 -11.727 808 HB3 GLU 103 HB3 GLU 103 1.146 -0.561 -11.840 809 HG2 GLU 103 HG2 GLU 103 1.897 -2.412 -13.375 810 HG3 GLU 103 HG3 GLU 103 0.358 -3.229 -13.199 811 H LEU 104 H LEU 104 2.492 -4.274 -11.281 812 HA LEU 104 HA LEU 104 5.163 -3.019 -10.468 813 HB2 LEU 104 HB2 LEU 104 4.161 -5.553 -9.905 814 HB3 LEU 104 HB3 LEU 104 5.065 -5.911 -11.346 815 HG LEU 104 HG LEU 104 6.088 -4.694 -8.708 816 HD11 LEU 104 HD11 LEU 104 5.642 -7.182 -8.771 817 HD12 LEU 104 HD12 LEU 104 7.373 -6.836 -8.588 818 HD13 LEU 104 HD13 LEU 104 6.732 -7.356 -10.158 819 HD21 LEU 104 HD21 LEU 104 7.755 -5.206 -11.260 820 HD22 LEU 104 HD22 LEU 104 8.433 -4.857 -9.649 821 HD23 LEU 104 HD23 LEU 104 7.477 -3.630 -10.487 822 H ASN 105 H ASN 105 6.222 -1.988 -12.050 823 HA ASN 105 HA ASN 105 5.892 -2.874 -15.005 824 HB2 ASN 105 HB2 ASN 105 6.395 -0.091 -13.779 825 HB3 ASN 105 HB3 ASN 105 6.738 -0.463 -15.449 826 HD21 ASN 105 HD21 ASN 105 4.040 -0.388 -13.156 827 HD22 ASN 105 HD22 ASN 105 2.775 -0.253 -14.485 828 H GLY 106 H GLY 106 7.387 -4.547 -14.588 829 HA2 GLY 106 HA2 GLY 106 9.611 -5.437 -15.129 830 HA3 GLY 106 HA3 GLY 106 10.271 -3.814 -15.198 831 H ASP 107 H ASP 107 11.086 -2.936 -13.316 832 HA ASP 107 HA ASP 107 10.890 -4.492 -10.676 833 HB2 ASP 107 HB2 ASP 107 13.499 -3.469 -11.958 834 HB3 ASP 107 HB3 ASP 107 13.366 -3.879 -10.263 835 H ILE 108 H ILE 108 9.475 -2.080 -11.647 836 HA ILE 108 HA ILE 108 9.917 -0.465 -9.111 837 HB ILE 108 HB ILE 108 9.387 1.574 -9.993 838 HG12 ILE 108 HG12 ILE 108 9.574 1.702 -12.723 839 HG13 ILE 108 HG13 ILE 108 8.709 0.197 -12.601 840 HG21 ILE 108 HG21 ILE 108 11.668 0.417 -11.674 841 HG22 ILE 108 HG22 ILE 108 11.401 2.140 -11.297 842 HG23 ILE 108 HG23 ILE 108 11.762 0.997 -9.995 843 HD11 ILE 108 HD11 ILE 108 6.922 1.382 -11.169 844 HD12 ILE 108 HD12 ILE 108 7.845 2.893 -11.322 845 HD13 ILE 108 HD13 ILE 108 7.118 2.137 -12.766 846 H ILE 109 H ILE 109 8.127 -0.224 -7.876 847 HA ILE 109 HA ILE 109 5.529 -1.389 -8.977 848 HB ILE 109 HB ILE 109 6.695 -2.737 -7.179 849 HG12 ILE 109 HG12 ILE 109 3.888 -1.826 -6.357 850 HG13 ILE 109 HG13 ILE 109 4.191 -2.842 -7.759 851 HG21 ILE 109 HG21 ILE 109 7.469 -0.852 -5.659 852 HG22 ILE 109 HG22 ILE 109 5.787 -0.527 -5.200 853 HG23 ILE 109 HG23 ILE 109 6.552 -2.073 -4.775 854 HD11 ILE 109 HD11 ILE 109 3.574 -4.243 -5.783 855 HD12 ILE 109 HD12 ILE 109 5.230 -4.632 -6.318 856 HD13 ILE 109 HD13 ILE 109 4.960 -3.629 -4.874 857 H THR 110 H THR 110 3.739 -0.237 -8.955 858 HA THR 110 HA THR 110 3.729 2.374 -7.371 859 HB THR 110 HB THR 110 3.751 2.553 -9.932 860 HG1 THR 110 HG1 THR 110 2.896 4.075 -8.075 861 HG21 THR 110 HG21 THR 110 1.664 2.639 -11.160 862 HG22 THR 110 HG22 THR 110 0.735 2.094 -9.741 863 HG23 THR 110 HG23 THR 110 1.900 0.992 -10.512 864 H ASN 111 H ASN 111 2.178 2.716 -5.943 865 HA ASN 111 HA ASN 111 -0.118 0.667 -5.731 866 HB2 ASN 111 HB2 ASN 111 1.578 0.572 -3.814 867 HB3 ASN 111 HB3 ASN 111 1.055 2.176 -3.331 868 HD21 ASN 111 HD21 ASN 111 -0.815 2.226 -2.046 869 HD22 ASN 111 HD22 ASN 111 -1.893 0.752 -1.811 870 H THR 112 H THR 112 -1.794 1.612 -6.687 871 HA THR 112 HA THR 112 -2.270 4.625 -6.364 872 HB THR 112 HB THR 112 -3.409 2.754 -8.493 873 HG1 THR 112 HG1 THR 112 -1.086 2.997 -8.446 874 HG21 THR 112 HG21 THR 112 -3.762 4.861 -9.783 875 HG22 THR 112 HG22 THR 112 -3.091 5.831 -8.452 876 HG23 THR 112 HG23 THR 112 -4.635 4.965 -8.237 877 H MET 113 H MET 113 -3.426 4.813 -4.551 878 HA MET 113 HA MET 113 -5.887 3.080 -3.994 879 HB2 MET 113 HB2 MET 113 -4.350 5.086 -2.292 880 HB3 MET 113 HB3 MET 113 -5.963 4.577 -1.857 881 HG2 MET 113 HG2 MET 113 -5.164 2.117 -1.971 882 HG3 MET 113 HG3 MET 113 -3.511 2.742 -2.086 883 HE1 MET 113 HE1 MET 113 -3.594 0.996 0.300 884 HE2 MET 113 HE2 MET 113 -4.653 1.429 1.675 885 HE3 MET 113 HE3 MET 113 -5.376 0.954 0.119 886 H THR 114 H THR 114 -7.427 3.638 -5.280 887 HA THR 114 HA THR 114 -8.067 6.532 -5.927 888 HB THR 114 HB THR 114 -9.589 5.713 -7.642 889 HG1 THR 114 HG1 THR 114 -8.743 3.141 -6.752 890 HG21 THR 114 HG21 THR 114 -7.181 6.031 -8.288 891 HG22 THR 114 HG22 THR 114 -7.976 4.746 -9.227 892 HG23 THR 114 HG23 THR 114 -6.859 4.317 -7.911 893 H LEU 115 H LEU 115 -9.294 7.580 -4.591 894 HA LEU 115 HA LEU 115 -11.786 6.277 -3.297 895 HB2 LEU 115 HB2 LEU 115 -10.050 6.795 -1.652 896 HB3 LEU 115 HB3 LEU 115 -9.858 8.423 -2.258 897 HG LEU 115 HG LEU 115 -12.154 9.042 -1.465 898 HD11 LEU 115 HD11 LEU 115 -12.248 6.213 -0.209 899 HD12 LEU 115 HD12 LEU 115 -13.310 6.808 -1.500 900 HD13 LEU 115 HD13 LEU 115 -13.393 7.531 0.113 901 HD21 LEU 115 HD21 LEU 115 -10.138 9.430 -0.034 902 HD22 LEU 115 HD22 LEU 115 -10.312 7.814 0.688 903 HD23 LEU 115 HD23 LEU 115 -11.555 9.061 0.965 904 H GLY 116 H GLY 116 -12.684 6.730 -5.434 905 HA2 GLY 116 HA2 GLY 116 -14.326 7.957 -6.732 906 HA3 GLY 116 HA3 GLY 116 -14.391 9.180 -5.485 907 H ASP 117 H ASP 117 -12.974 10.890 -5.625 908 HA ASP 117 HA ASP 117 -11.796 11.551 -8.385 909 HB2 ASP 117 HB2 ASP 117 -12.575 13.416 -6.044 910 HB3 ASP 117 HB3 ASP 117 -11.783 13.942 -7.518 911 H ILE 118 H ILE 118 -10.844 10.941 -5.075 912 HA ILE 118 HA ILE 118 -8.158 12.299 -5.265 913 HB ILE 118 HB ILE 118 -9.215 10.388 -3.131 914 HG12 ILE 118 HG12 ILE 118 -10.731 12.318 -3.125 915 HG13 ILE 118 HG13 ILE 118 -9.856 12.086 -1.639 916 HG21 ILE 118 HG21 ILE 118 -6.831 12.374 -2.995 917 HG22 ILE 118 HG22 ILE 118 -7.438 11.384 -1.655 918 HG23 ILE 118 HG23 ILE 118 -6.703 10.604 -3.058 919 HD11 ILE 118 HD11 ILE 118 -9.107 14.250 -3.719 920 HD12 ILE 118 HD12 ILE 118 -10.067 14.512 -2.237 921 HD13 ILE 118 HD13 ILE 118 -8.370 14.025 -2.104 922 H VAL 119 H VAL 119 -6.543 11.313 -6.342 923 HA VAL 119 HA VAL 119 -6.336 8.239 -6.456 924 HB VAL 119 HB VAL 119 -5.216 10.351 -8.384 925 HG11 VAL 119 HG11 VAL 119 -3.789 8.298 -8.393 926 HG12 VAL 119 HG12 VAL 119 -5.224 7.272 -8.648 927 HG13 VAL 119 HG13 VAL 119 -4.699 8.420 -9.902 928 HG21 VAL 119 HG21 VAL 119 -7.605 8.408 -8.799 929 HG22 VAL 119 HG22 VAL 119 -7.718 10.172 -8.650 930 HG23 VAL 119 HG23 VAL 119 -6.901 9.467 -10.049 931 H PHE 120 H PHE 120 -5.264 7.915 -4.469 932 HA PHE 120 HA PHE 120 -2.695 9.400 -3.843 933 HB2 PHE 120 HB2 PHE 120 -4.047 9.009 -1.967 934 HB3 PHE 120 HB3 PHE 120 -4.316 7.330 -2.336 935 HD1 PHE 120 HD2 PHE 120 -1.062 9.339 -2.089 936 HD2 PHE 120 HD1 PHE 120 -3.401 6.082 -0.524 937 HE1 PHE 120 HE2 PHE 120 0.856 8.573 -0.794 938 HE2 PHE 120 HE1 PHE 120 -1.459 5.324 0.769 939 HZ PHE 120 HZ PHE 120 0.686 6.565 0.635 940 H LYS 121 H LYS 121 -1.241 8.944 -5.349 941 HA LYS 121 HA LYS 121 -0.558 6.039 -5.982 942 HB2 LYS 121 HB2 LYS 121 -1.313 7.661 -7.764 943 HB3 LYS 121 HB3 LYS 121 0.176 8.553 -7.545 944 HG2 LYS 121 HG2 LYS 121 1.516 6.480 -8.156 945 HG3 LYS 121 HG3 LYS 121 0.016 5.575 -8.357 946 HD2 LYS 121 HD2 LYS 121 -0.735 7.240 -10.137 947 HD3 LYS 121 HD3 LYS 121 0.770 8.134 -9.929 948 HE2 LYS 121 HE2 LYS 121 2.096 6.034 -10.609 949 HE3 LYS 121 HE3 LYS 121 0.580 5.155 -10.828 950 HZ1 LYS 121 HZ1 LYS 121 1.280 7.706 -12.299 951 HZ2 LYS 121 HZ2 LYS 121 -0.092 6.853 -12.530 952 HZ3 LYS 121 HZ3 LYS 121 1.354 6.204 -12.983 953 H ARG 122 H ARG 122 0.990 5.185 -4.819 954 HA ARG 122 HA ARG 122 3.595 6.687 -4.203 955 HB2 ARG 122 HB2 ARG 122 2.540 3.900 -3.405 956 HB3 ARG 122 HB3 ARG 122 4.242 4.251 -3.353 957 HG2 ARG 122 HG2 ARG 122 3.780 6.264 -1.829 958 HG3 ARG 122 HG3 ARG 122 2.103 5.716 -1.692 959 HD2 ARG 122 HD2 ARG 122 2.898 3.489 -0.785 960 HD3 ARG 122 HD3 ARG 122 4.567 3.935 -1.114 961 HE ARG 122 HE ARG 122 3.510 5.980 0.677 962 HH11 ARG 122 HH11 ARG 122 4.680 2.650 0.681 963 HH12 ARG 122 HH12 ARG 122 5.257 2.845 2.418 964 HH21 ARG 122 HH21 ARG 122 4.140 6.073 2.612 965 HH22 ARG 122 HH22 ARG 122 4.944 4.643 3.450 966 H ILE 123 H ILE 123 5.516 6.242 -5.197 967 HA ILE 123 HA ILE 123 5.684 4.026 -7.324 968 HB ILE 123 HB ILE 123 6.924 6.826 -7.578 969 HG12 ILE 123 HG12 ILE 123 5.428 6.712 -9.848 970 HG13 ILE 123 HG13 ILE 123 4.438 5.621 -8.913 971 HG21 ILE 123 HG21 ILE 123 6.985 4.446 -9.553 972 HG22 ILE 123 HG22 ILE 123 7.659 6.066 -9.857 973 HG23 ILE 123 HG23 ILE 123 8.365 5.044 -8.604 974 HD11 ILE 123 HD11 ILE 123 3.556 7.953 -8.809 975 HD12 ILE 123 HD12 ILE 123 4.125 7.554 -7.181 976 HD13 ILE 123 HD13 ILE 123 5.110 8.580 -8.238 977 H SER 124 H SER 124 6.912 2.535 -6.358 978 HA SER 124 HA SER 124 9.444 3.371 -4.811 979 HB2 SER 124 HB2 SER 124 7.508 1.017 -4.234 980 HB3 SER 124 HB3 SER 124 8.993 1.361 -3.346 981 HG SER 124 HG SER 124 6.543 2.382 -2.925 982 H LYS 125 H LYS 125 11.341 2.214 -5.171 983 HA LYS 125 HA LYS 125 11.326 0.462 -7.677 984 HB2 LYS 125 HB2 LYS 125 12.593 2.558 -7.805 985 HB3 LYS 125 HB3 LYS 125 13.601 2.107 -6.428 986 HG2 LYS 125 HG2 LYS 125 14.672 0.309 -7.621 987 HG3 LYS 125 HG3 LYS 125 13.427 0.208 -8.842 988 HD2 LYS 125 HD2 LYS 125 14.156 2.696 -9.502 989 HD3 LYS 125 HD3 LYS 125 15.607 2.362 -8.581 990 HE2 LYS 125 HE2 LYS 125 14.486 0.711 -10.983 991 HE3 LYS 125 HE3 LYS 125 15.746 1.926 -11.124 992 HZ1 LYS 125 HZ1 LYS 125 16.006 -0.597 -9.471 993 HZ2 LYS 125 HZ2 LYS 125 17.188 0.523 -9.612 994 HZ3 LYS 125 HZ3 LYS 125 16.737 -0.369 -10.922 995 H ARG 126 H ARG 126 12.062 -1.605 -7.659 996 HA ARG 126 HA ARG 126 12.133 -3.131 -5.228 997 HB2 ARG 126 HB2 ARG 126 11.532 -3.781 -7.676 998 HB3 ARG 126 HB3 ARG 126 13.253 -3.906 -7.988 999 HG2 ARG 126 HG2 ARG 126 13.343 -5.727 -6.120 1000 HG3 ARG 126 HG3 ARG 126 11.584 -5.565 -5.983 1001 HD2 ARG 126 HD2 ARG 126 11.491 -5.990 -8.579 1002 HD3 ARG 126 HD3 ARG 126 13.205 -6.416 -8.477 1003 HE ARG 126 HE ARG 126 11.804 -8.067 -6.512 1004 HH11 ARG 126 HH11 ARG 126 11.907 -7.702 -10.049 1005 HH12 ARG 126 HH12 ARG 126 11.116 -9.355 -10.215 1006 HH21 ARG 126 HH21 ARG 126 11.027 -9.868 -6.822 1007 HH22 ARG 126 HH22 ARG 126 10.638 -10.527 -8.497 1008 H ILE 127 H ILE 127 13.649 -3.609 -3.819 1009 HA ILE 127 HA ILE 127 16.598 -3.567 -4.442 1010 HB ILE 127 HB ILE 127 15.134 -1.702 -2.494 1011 HG12 ILE 127 HG12 ILE 127 17.530 -1.229 -4.356 1012 HG13 ILE 127 HG13 ILE 127 15.856 -0.900 -4.764 1013 HG21 ILE 127 HG21 ILE 127 18.053 -2.506 -2.040 1014 HG22 ILE 127 HG22 ILE 127 17.152 -1.213 -1.185 1015 HG23 ILE 127 HG23 ILE 127 16.669 -2.900 -0.990 1016 HD11 ILE 127 HD11 ILE 127 15.674 0.799 -2.925 1017 HD12 ILE 127 HD12 ILE 127 17.405 0.592 -2.565 1018 HD13 ILE 127 HD13 ILE 127 16.894 1.216 -4.147 1019 H21 OLA 128 H21 OLA 128 4.012 9.382 15.101 1020 H22 OLA 128 H22 OLA 128 4.991 8.190 14.279 1021 H31 OLA 128 H31 OLA 128 3.775 10.656 12.836 1022 H32 OLA 128 H32 OLA 128 2.891 9.149 13.043 1023 H41 OLA 128 H41 OLA 128 4.666 7.905 11.746 1024 H42 OLA 128 H42 OLA 128 5.577 9.402 11.568 1025 H51 OLA 128 H51 OLA 128 4.409 9.107 9.499 1026 H52 OLA 128 H52 OLA 128 3.597 10.425 10.319 1027 H61 OLA 128 H61 OLA 128 1.771 8.828 11.071 1028 H62 OLA 128 H62 OLA 128 2.621 7.485 10.308 1029 H71 OLA 128 H71 OLA 128 2.374 8.590 8.051 1030 H72 OLA 128 H72 OLA 128 1.565 9.972 8.803 1031 H81 OLA 128 H81 OLA 128 -0.269 8.413 9.656 1032 H82 OLA 128 H82 OLA 128 0.528 7.047 8.889 1033 H9 OLA 128 H9 OLA 128 -0.870 9.444 7.510 1034 H10 OLA 128 H10 OLA 128 -0.899 8.250 5.550 1035 H111 OLA 128 H111 OLA 128 0.096 5.743 6.884 1036 H112 OLA 128 H112 OLA 128 1.439 6.631 6.158 1037 H121 OLA 128 H121 OLA 128 0.254 6.616 3.934 1038 H122 OLA 128 H122 OLA 128 -1.125 5.780 4.642 1039 H131 OLA 128 H131 OLA 128 0.274 3.763 5.106 1040 H132 OLA 128 H132 OLA 128 1.732 4.601 4.560 1041 H141 OLA 128 H141 OLA 128 0.740 4.904 2.270 1042 H142 OLA 128 H142 OLA 128 -0.745 4.104 2.774 1043 H151 OLA 128 H151 OLA 128 0.556 1.965 3.197 1044 H152 OLA 128 H152 OLA 128 2.042 2.781 2.726 1045 H161 OLA 128 H161 OLA 128 0.967 3.299 0.446 1046 H162 OLA 128 H162 OLA 128 -0.431 2.346 0.903 1047 H171 OLA 128 H171 OLA 128 2.446 1.187 0.876 1048 H172 OLA 128 H172 OLA 128 1.433 1.223 -0.549 1049 H181 OLA 128 H181 OLA 128 1.309 -1.004 0.635 1050 H182 OLA 128 H182 OLA 128 0.592 -0.227 2.057 1051 H183 OLA 128 H183 OLA 128 -0.285 -0.241 0.504 1052 H21 OLA 129 H21 OLA 129 5.485 -0.749 -2.170 1053 H22 OLA 129 H22 OLA 129 4.326 -0.206 -3.370 1054 H31 OLA 129 H31 OLA 129 2.420 -0.498 -1.820 1055 H32 OLA 129 H32 OLA 129 3.496 -0.821 -0.466 1056 H41 OLA 129 H41 OLA 129 4.346 -2.894 -1.597 1057 H42 OLA 129 H42 OLA 129 3.279 -2.620 -2.968 1058 H51 OLA 129 H51 OLA 129 2.268 -2.995 -0.063 1059 H52 OLA 129 H52 OLA 129 2.509 -4.337 -1.165 1060 H61 OLA 129 H61 OLA 129 0.814 -3.471 -2.740 1061 H62 OLA 129 H62 OLA 129 0.641 -1.978 -1.821 1062 H71 OLA 129 H71 OLA 129 -0.257 -3.255 0.142 1063 H72 OLA 129 H72 OLA 129 -0.058 -4.780 -0.726 1064 H81 OLA 129 H81 OLA 129 -1.662 -4.037 -2.506 1065 H82 OLA 129 H82 OLA 129 -1.809 -2.448 -1.782 1066 H9 OLA 129 H9 OLA 129 -3.088 -5.057 -0.859 1067 H10 OLA 129 H10 OLA 129 -4.205 -3.913 0.819 1068 H111 OLA 129 H111 OLA 129 -4.083 -1.430 0.892 1069 H112 OLA 129 H112 OLA 129 -2.491 -1.397 0.153 1070 H121 OLA 129 H121 OLA 129 -1.456 -2.448 2.173 1071 H122 OLA 129 H122 OLA 129 -3.038 -2.715 2.903 1072 H131 OLA 129 H131 OLA 129 -3.412 -0.180 2.906 1073 H132 OLA 129 H132 OLA 129 -1.765 0.045 2.342 1074 H141 OLA 129 H141 OLA 129 -0.944 -1.234 4.422 1075 H142 OLA 129 H142 OLA 129 -2.608 -1.363 4.962 1076 H151 OLA 129 H151 OLA 129 -0.927 1.210 4.727 1077 H152 OLA 129 H152 OLA 129 -1.488 0.406 6.168 1078 H161 OLA 129 H161 OLA 129 -3.125 1.995 6.180 1079 H162 OLA 129 H162 OLA 129 -3.951 0.882 5.110 1080 H171 OLA 129 H171 OLA 129 -2.818 2.215 3.118 1081 H172 OLA 129 H172 OLA 129 -2.310 3.379 4.335 1082 H181 OLA 129 H181 OLA 129 -4.761 3.778 4.961 1083 H182 OLA 129 H182 OLA 129 -4.433 4.133 3.251 1084 H183 OLA 129 H183 OLA 129 -5.251 2.622 3.702 Start of MODEL 2 1 H1 SER 2 H1 SER 2 6.497 -11.237 -11.561 2 H2 SER 2 H2 SER 2 5.755 -10.235 -10.537 3 HA SER 2 HA SER 2 7.088 -11.980 -9.460 4 HB2 SER 2 HB2 SER 2 8.872 -11.994 -11.223 5 HB3 SER 2 HB3 SER 2 9.376 -10.373 -10.736 6 HG SER 2 HG SER 2 9.471 -12.774 -9.208 7 H PHE 3 H PHE 3 6.224 -11.191 -7.677 8 HA PHE 3 HA PHE 3 6.740 -8.374 -6.675 9 HB2 PHE 3 HB2 PHE 3 4.798 -10.599 -5.808 10 HB3 PHE 3 HB3 PHE 3 4.994 -9.151 -4.876 11 HD1 PHE 3 HD2 PHE 3 4.274 -6.928 -5.724 12 HD2 PHE 3 HD1 PHE 3 3.671 -10.486 -8.070 13 HE1 PHE 3 HE2 PHE 3 2.597 -5.751 -7.116 14 HE2 PHE 3 HE1 PHE 3 1.991 -9.305 -9.406 15 HZ PHE 3 HZ PHE 3 1.432 -6.943 -8.908 16 H SER 4 H SER 4 8.480 -11.181 -5.975 17 HA SER 4 HA SER 4 8.928 -10.671 -3.106 18 HB2 SER 4 HB2 SER 4 10.544 -12.352 -5.087 19 HB3 SER 4 HB3 SER 4 10.909 -12.238 -3.362 20 HG SER 4 HG SER 4 9.477 -13.986 -3.902 21 H GLY 5 H GLY 5 9.891 -8.919 -2.265 22 HA2 GLY 5 HA2 GLY 5 12.662 -8.157 -2.631 23 HA3 GLY 5 HA3 GLY 5 11.736 -7.145 -3.740 24 H LYS 6 H LYS 6 13.215 -5.960 -1.953 25 HA LYS 6 HA LYS 6 11.354 -4.817 0.236 26 HB2 LYS 6 HB2 LYS 6 14.396 -4.852 -0.066 27 HB3 LYS 6 HB3 LYS 6 13.574 -3.898 1.138 28 HG2 LYS 6 HG2 LYS 6 12.633 -5.945 2.250 29 HG3 LYS 6 HG3 LYS 6 13.356 -6.973 1.013 30 HD2 LYS 6 HD2 LYS 6 15.660 -6.104 1.641 31 HD3 LYS 6 HD3 LYS 6 14.971 -5.136 2.926 32 HE2 LYS 6 HE2 LYS 6 14.762 -8.238 2.742 33 HE3 LYS 6 HE3 LYS 6 16.033 -7.386 3.613 34 HZ1 LYS 6 HZ1 LYS 6 13.060 -7.390 4.283 35 HZ2 LYS 6 HZ2 LYS 6 14.078 -6.257 4.921 36 HZ3 LYS 6 HZ3 LYS 6 14.301 -7.862 5.249 37 H TYR 7 H TYR 7 10.245 -3.433 -1.183 38 HA TYR 7 HA TYR 7 11.734 -1.918 -3.319 39 HB2 TYR 7 HB2 TYR 7 8.713 -1.893 -2.659 40 HB3 TYR 7 HB3 TYR 7 9.447 -1.131 -4.032 41 HD1 TYR 7 HD2 TYR 7 8.861 -4.541 -2.489 42 HD2 TYR 7 HD1 TYR 7 9.609 -2.344 -6.114 43 HE1 TYR 7 HE2 TYR 7 8.520 -6.578 -3.800 44 HE2 TYR 7 HE1 TYR 7 9.210 -4.388 -7.418 45 HH TYR 7 HH TYR 7 8.877 -6.618 -7.332 46 H GLN 8 H GLN 8 12.801 -0.094 -2.686 47 HA GLN 8 HA GLN 8 11.783 1.575 -0.426 48 HB2 GLN 8 HB2 GLN 8 14.258 1.144 -0.875 49 HB3 GLN 8 HB3 GLN 8 14.152 2.299 -2.206 50 HG2 GLN 8 HG2 GLN 8 13.320 4.071 -0.538 51 HG3 GLN 8 HG3 GLN 8 13.453 2.887 0.758 52 HE21 GLN 8 HE21 GLN 8 14.649 4.922 1.413 53 HE22 GLN 8 HE22 GLN 8 16.461 4.863 1.060 54 H LEU 9 H LEU 9 10.810 3.458 -0.409 55 HA LEU 9 HA LEU 9 9.204 4.288 -2.723 56 HB2 LEU 9 HB2 LEU 9 8.381 4.312 -0.413 57 HB3 LEU 9 HB3 LEU 9 9.576 5.504 0.056 58 HG LEU 9 HG LEU 9 8.472 7.224 -1.440 59 HD11 LEU 9 HD11 LEU 9 6.145 6.743 -2.336 60 HD12 LEU 9 HD12 LEU 9 6.360 5.016 -1.934 61 HD13 LEU 9 HD13 LEU 9 7.378 5.784 -3.161 62 HD21 LEU 9 HD21 LEU 9 6.606 5.866 0.609 63 HD22 LEU 9 HD22 LEU 9 6.474 7.543 0.025 64 HD23 LEU 9 HD23 LEU 9 7.877 7.050 0.981 65 H GLN 10 H GLN 10 9.471 5.744 -4.205 66 HA GLN 10 HA GLN 10 11.776 7.762 -4.078 67 HB2 GLN 10 HB2 GLN 10 10.365 6.469 -6.483 68 HB3 GLN 10 HB3 GLN 10 11.606 7.693 -6.611 69 HG2 GLN 10 HG2 GLN 10 12.097 4.982 -5.195 70 HG3 GLN 10 HG3 GLN 10 12.228 5.224 -6.910 71 HE21 GLN 10 HE21 GLN 10 14.434 4.433 -6.343 72 HE22 GLN 10 HE22 GLN 10 15.687 5.682 -5.846 73 H SER 11 H SER 11 8.576 7.534 -5.633 74 HA SER 11 HA SER 11 8.087 10.500 -4.908 75 HB2 SER 11 HB2 SER 11 8.535 10.191 -7.346 76 HB3 SER 11 HB3 SER 11 7.204 9.049 -7.471 77 HG SER 11 HG SER 11 7.092 11.825 -6.872 78 H GLN 12 H GLN 12 6.203 11.048 -4.004 79 HA GLN 12 HA GLN 12 3.994 8.963 -3.603 80 HB2 GLN 12 HB2 GLN 12 5.639 9.220 -1.605 81 HB3 GLN 12 HB3 GLN 12 5.015 10.860 -1.399 82 HG2 GLN 12 HG2 GLN 12 2.793 10.048 -0.829 83 HG3 GLN 12 HG3 GLN 12 3.115 8.444 -1.439 84 HE21 GLN 12 HE21 GLN 12 4.986 10.440 0.947 85 HE22 GLN 12 HE22 GLN 12 4.732 9.209 2.279 86 H GLU 13 H GLU 13 2.317 9.773 -4.719 87 HA GLU 13 HA GLU 13 2.160 12.631 -5.457 88 HB2 GLU 13 HB2 GLU 13 1.846 10.577 -6.930 89 HB3 GLU 13 HB3 GLU 13 0.351 10.242 -6.082 90 HG2 GLU 13 HG2 GLU 13 -0.492 12.594 -6.967 91 HG3 GLU 13 HG3 GLU 13 0.971 12.627 -7.948 92 H ASN 14 H ASN 14 -1.002 11.394 -4.977 93 HA ASN 14 HA ASN 14 -1.707 13.699 -3.266 94 HB2 ASN 14 HB2 ASN 14 -3.390 11.379 -4.371 95 HB3 ASN 14 HB3 ASN 14 -4.067 12.626 -3.420 96 HD21 ASN 14 HD21 ASN 14 -3.219 11.834 -6.623 97 HD22 ASN 14 HD22 ASN 14 -3.596 13.518 -7.259 98 H PHE 15 H PHE 15 -0.050 12.640 -1.635 99 HA PHE 15 HA PHE 15 -1.314 11.038 0.527 100 HB2 PHE 15 HB2 PHE 15 1.183 11.286 0.009 101 HB3 PHE 15 HB3 PHE 15 1.162 12.862 0.736 102 HD1 PHE 15 HD1 PHE 15 0.738 13.064 3.251 103 HD2 PHE 15 HD2 PHE 15 1.186 9.237 1.362 104 HE1 PHE 15 HE1 PHE 15 1.328 12.041 5.408 105 HE2 PHE 15 HE2 PHE 15 1.793 8.242 3.517 106 HZ PHE 15 HZ PHE 15 1.845 9.639 5.556 107 H GLU 16 H GLU 16 -0.556 14.564 0.502 108 HA GLU 16 HA GLU 16 -2.012 15.353 2.873 109 HB2 GLU 16 HB2 GLU 16 -1.056 16.763 0.323 110 HB3 GLU 16 HB3 GLU 16 -2.198 17.628 1.289 111 HG2 GLU 16 HG2 GLU 16 0.352 16.503 2.625 112 HG3 GLU 16 HG3 GLU 16 0.340 18.039 1.758 113 H ALA 17 H ALA 17 -3.325 15.350 -0.450 114 HA ALA 17 HA ALA 17 -6.061 16.135 0.314 115 HB1 ALA 17 HB1 ALA 17 -5.071 14.643 -2.215 116 HB2 ALA 17 HB2 ALA 17 -6.615 15.505 -2.034 117 HB3 ALA 17 HB3 ALA 17 -5.100 16.412 -1.997 118 H PHE 18 H PHE 18 -4.603 12.895 0.060 119 HA PHE 18 HA PHE 18 -7.225 11.446 0.437 120 HB2 PHE 18 HB2 PHE 18 -5.281 10.540 -0.918 121 HB3 PHE 18 HB3 PHE 18 -4.326 10.397 0.523 122 HD1 PHE 18 HD2 PHE 18 -4.990 8.686 2.306 123 HD2 PHE 18 HD1 PHE 18 -6.958 8.827 -1.516 124 HE1 PHE 18 HE2 PHE 18 -5.699 6.349 2.576 125 HE2 PHE 18 HE1 PHE 18 -7.668 6.498 -1.228 126 HZ PHE 18 HZ PHE 18 -7.030 5.252 0.821 127 H MET 19 H MET 19 -4.346 11.937 2.575 128 HA MET 19 HA MET 19 -5.613 10.656 4.895 129 HB2 MET 19 HB2 MET 19 -3.209 12.545 4.708 130 HB3 MET 19 HB3 MET 19 -3.791 11.810 6.197 131 HG2 MET 19 HG2 MET 19 -1.905 10.504 5.314 132 HG3 MET 19 HG3 MET 19 -3.377 9.517 5.378 133 HE1 MET 19 HE1 MET 19 -2.574 7.821 2.167 134 HE2 MET 19 HE2 MET 19 -1.212 8.155 3.262 135 HE3 MET 19 HE3 MET 19 -2.825 7.742 3.932 136 H LYS 20 H LYS 20 -5.602 14.134 3.958 137 HA LYS 20 HA LYS 20 -7.312 14.918 6.288 138 HB2 LYS 20 HB2 LYS 20 -6.599 16.350 3.667 139 HB3 LYS 20 HB3 LYS 20 -7.906 16.935 4.673 140 HG2 LYS 20 HG2 LYS 20 -6.370 17.067 6.679 141 HG3 LYS 20 HG3 LYS 20 -5.008 16.594 5.685 142 HD2 LYS 20 HD2 LYS 20 -6.763 19.001 4.863 143 HD3 LYS 20 HD3 LYS 20 -5.667 19.207 6.187 144 HE2 LYS 20 HE2 LYS 20 -4.631 18.136 3.460 145 HE3 LYS 20 HE3 LYS 20 -4.888 19.861 3.733 146 HZ1 LYS 20 HZ1 LYS 20 -2.544 19.222 4.346 147 HZ2 LYS 20 HZ2 LYS 20 -3.058 18.149 5.413 148 HZ3 LYS 20 HZ3 LYS 20 -3.359 19.747 5.745 149 H ALA 21 H ALA 21 -8.189 13.846 2.902 150 HA ALA 21 HA ALA 21 -11.084 14.139 3.299 151 HB1 ALA 21 HB1 ALA 21 -11.242 12.628 1.302 152 HB2 ALA 21 HB2 ALA 21 -10.029 13.897 1.048 153 HB3 ALA 21 HB3 ALA 21 -9.511 12.238 1.435 154 H ILE 22 H ILE 22 -8.941 11.366 4.104 155 HA ILE 22 HA ILE 22 -11.321 9.790 5.148 156 HB ILE 22 HB ILE 22 -9.846 7.966 5.682 157 HG12 ILE 22 HG12 ILE 22 -7.448 9.431 4.464 158 HG13 ILE 22 HG13 ILE 22 -7.726 9.407 6.193 159 HG21 ILE 22 HG21 ILE 22 -9.298 7.245 3.376 160 HG22 ILE 22 HG22 ILE 22 -10.817 8.162 3.361 161 HG23 ILE 22 HG23 ILE 22 -9.310 8.927 2.806 162 HD11 ILE 22 HD11 ILE 22 -7.294 6.884 4.451 163 HD12 ILE 22 HD12 ILE 22 -6.112 7.636 5.542 164 HD13 ILE 22 HD13 ILE 22 -7.584 6.885 6.211 165 H GLY 23 H GLY 23 -9.616 12.251 6.537 166 HA2 GLY 23 HA2 GLY 23 -10.109 13.116 8.767 167 HA3 GLY 23 HA3 GLY 23 -10.723 11.564 9.264 168 H LEU 24 H LEU 24 -7.423 12.413 8.073 169 HA LEU 24 HA LEU 24 -6.340 11.632 10.814 170 HB2 LEU 24 HB2 LEU 24 -5.366 11.193 7.979 171 HB3 LEU 24 HB3 LEU 24 -4.138 11.683 9.089 172 HG LEU 24 HG LEU 24 -5.057 9.798 10.725 173 HD11 LEU 24 HD11 LEU 24 -7.170 9.282 9.445 174 HD12 LEU 24 HD12 LEU 24 -6.127 7.864 9.583 175 HD13 LEU 24 HD13 LEU 24 -6.207 8.762 8.046 176 HD21 LEU 24 HD21 LEU 24 -2.841 9.745 9.634 177 HD22 LEU 24 HD22 LEU 24 -3.557 9.070 8.145 178 HD23 LEU 24 HD23 LEU 24 -3.579 8.132 9.668 179 HA PRO 25 HA PRO 25 -4.846 15.671 11.818 180 HB2 PRO 25 HB2 PRO 25 -2.577 15.142 13.409 181 HB3 PRO 25 HB3 PRO 25 -4.235 14.940 13.886 182 HG2 PRO 25 HG2 PRO 25 -2.255 12.867 12.920 183 HG3 PRO 25 HG3 PRO 25 -3.471 12.658 14.195 184 HD2 PRO 25 HD2 PRO 25 -3.623 11.741 11.514 185 HD3 PRO 25 HD3 PRO 25 -5.052 11.931 12.551 186 H GLU 26 H GLU 26 -3.696 17.314 10.990 187 HA GLU 26 HA GLU 26 -1.867 17.056 8.798 188 HB2 GLU 26 HB2 GLU 26 -2.512 19.422 10.602 189 HB3 GLU 26 HB3 GLU 26 -1.535 19.504 9.176 190 HG2 GLU 26 HG2 GLU 26 -3.626 18.398 7.903 191 HG3 GLU 26 HG3 GLU 26 -4.541 18.886 9.316 192 H GLU 27 H GLU 27 -1.043 17.429 12.191 193 HA GLU 27 HA GLU 27 1.868 17.781 11.936 194 HB2 GLU 27 HB2 GLU 27 0.645 18.295 13.965 195 HB3 GLU 27 HB3 GLU 27 0.049 16.663 14.163 196 HG2 GLU 27 HG2 GLU 27 3.087 17.206 14.287 197 HG3 GLU 27 HG3 GLU 27 2.045 17.575 15.651 198 H LEU 28 H LEU 28 0.035 14.680 12.379 199 HA LEU 28 HA LEU 28 2.449 13.019 11.846 200 HB2 LEU 28 HB2 LEU 28 -0.439 12.054 11.610 201 HB3 LEU 28 HB3 LEU 28 1.001 11.075 11.777 202 HG LEU 28 HG LEU 28 -0.209 12.890 13.945 203 HD11 LEU 28 HD11 LEU 28 0.012 9.801 13.798 204 HD12 LEU 28 HD12 LEU 28 -1.471 10.722 13.473 205 HD13 LEU 28 HD13 LEU 28 -0.757 10.744 15.097 206 HD21 LEU 28 HD21 LEU 28 2.173 10.996 14.399 207 HD22 LEU 28 HD22 LEU 28 1.415 12.111 15.548 208 HD23 LEU 28 HD23 LEU 28 2.328 12.758 14.190 209 H ILE 29 H ILE 29 -0.058 14.297 9.728 210 HA ILE 29 HA ILE 29 0.689 12.778 7.297 211 HB ILE 29 HB ILE 29 -0.777 15.466 7.467 212 HG12 ILE 29 HG12 ILE 29 -1.986 12.668 7.022 213 HG13 ILE 29 HG13 ILE 29 -1.931 13.408 8.578 214 HG21 ILE 29 HG21 ILE 29 -0.733 13.510 5.061 215 HG22 ILE 29 HG22 ILE 29 -1.565 15.071 5.149 216 HG23 ILE 29 HG23 ILE 29 0.188 15.038 5.130 217 HD11 ILE 29 HD11 ILE 29 -3.345 15.364 7.823 218 HD12 ILE 29 HD12 ILE 29 -3.500 14.620 6.211 219 HD13 ILE 29 HD13 ILE 29 -4.174 13.810 7.633 220 H GLN 30 H GLN 30 1.570 16.070 8.433 221 HA GLN 30 HA GLN 30 3.611 16.620 6.384 222 HB2 GLN 30 HB2 GLN 30 2.937 17.762 9.132 223 HB3 GLN 30 HB3 GLN 30 4.513 18.108 8.522 224 HG2 GLN 30 HG2 GLN 30 2.666 19.852 8.027 225 HG3 GLN 30 HG3 GLN 30 3.830 19.465 6.790 226 HE21 GLN 30 HE21 GLN 30 0.556 18.346 7.714 227 HE22 GLN 30 HE22 GLN 30 0.035 18.254 5.941 228 H LYS 31 H LYS 31 3.837 14.506 9.125 229 HA LYS 31 HA LYS 31 6.866 14.273 8.984 230 HB2 LYS 31 HB2 LYS 31 4.670 12.819 10.578 231 HB3 LYS 31 HB3 LYS 31 6.314 12.231 10.550 232 HG2 LYS 31 HG2 LYS 31 7.209 14.297 11.553 233 HG3 LYS 31 HG3 LYS 31 5.637 15.106 11.440 234 HD2 LYS 31 HD2 LYS 31 4.581 13.537 12.990 235 HD3 LYS 31 HD3 LYS 31 5.988 12.470 12.999 236 HE2 LYS 31 HE2 LYS 31 7.387 14.169 14.171 237 HE3 LYS 31 HE3 LYS 31 6.080 15.381 14.060 238 HZ1 LYS 31 HZ1 LYS 31 4.635 14.057 15.399 239 HZ2 LYS 31 HZ2 LYS 31 6.064 14.007 16.250 240 HZ3 LYS 31 HZ3 LYS 31 5.636 12.670 15.341 241 H GLY 32 H GLY 32 4.108 12.034 8.246 242 HA2 GLY 32 HA2 GLY 32 5.888 10.105 6.816 243 HA3 GLY 32 HA3 GLY 32 4.153 10.009 6.881 244 H LYS 33 H LYS 33 4.426 12.969 5.514 245 HA LYS 33 HA LYS 33 3.944 11.996 2.822 246 HB2 LYS 33 HB2 LYS 33 3.761 14.288 2.118 247 HB3 LYS 33 HB3 LYS 33 2.937 14.042 3.640 248 HG2 LYS 33 HG2 LYS 33 4.748 15.152 4.914 249 HG3 LYS 33 HG3 LYS 33 5.740 15.330 3.494 250 HD2 LYS 33 HD2 LYS 33 2.954 16.594 3.716 251 HD3 LYS 33 HD3 LYS 33 4.388 17.395 4.302 252 HE2 LYS 33 HE2 LYS 33 4.115 16.459 1.354 253 HE3 LYS 33 HE3 LYS 33 3.577 18.036 1.914 254 HZ1 LYS 33 HZ1 LYS 33 6.022 17.900 1.019 255 HZ2 LYS 33 HZ2 LYS 33 6.461 17.126 2.365 256 HZ3 LYS 33 HZ3 LYS 33 5.873 18.640 2.496 257 H ASP 34 H ASP 34 7.002 13.431 3.980 258 HA ASP 34 HA ASP 34 8.252 12.968 1.224 259 HB2 ASP 34 HB2 ASP 34 9.298 14.628 3.597 260 HB3 ASP 34 HB3 ASP 34 9.994 14.563 1.991 261 H ILE 35 H ILE 35 8.253 11.128 4.013 262 HA ILE 35 HA ILE 35 11.155 10.455 4.180 263 HB ILE 35 HB ILE 35 8.723 9.080 5.434 264 HG12 ILE 35 HG12 ILE 35 10.871 10.827 6.817 265 HG13 ILE 35 HG13 ILE 35 9.361 11.482 6.229 266 HG21 ILE 35 HG21 ILE 35 11.708 8.516 6.066 267 HG22 ILE 35 HG22 ILE 35 10.318 7.846 6.950 268 HG23 ILE 35 HG23 ILE 35 10.584 7.385 5.276 269 HD11 ILE 35 HD11 ILE 35 9.546 9.343 8.452 270 HD12 ILE 35 HD12 ILE 35 9.137 11.063 8.629 271 HD13 ILE 35 HD13 ILE 35 8.033 9.986 7.764 272 H LYS 36 H LYS 36 12.159 9.404 2.579 273 HA LYS 36 HA LYS 36 10.855 7.414 0.775 274 HB2 LYS 36 HB2 LYS 36 13.819 8.200 1.088 275 HB3 LYS 36 HB3 LYS 36 13.216 7.026 -0.058 276 HG2 LYS 36 HG2 LYS 36 11.640 8.889 -1.003 277 HG3 LYS 36 HG3 LYS 36 12.594 10.039 -0.066 278 HD2 LYS 36 HD2 LYS 36 14.716 9.168 -1.247 279 HD3 LYS 36 HD3 LYS 36 13.717 8.009 -2.127 280 HE2 LYS 36 HE2 LYS 36 12.378 10.053 -3.080 281 HE3 LYS 36 HE3 LYS 36 13.604 11.099 -2.374 282 HZ1 LYS 36 HZ1 LYS 36 14.183 8.855 -4.357 283 HZ2 LYS 36 HZ2 LYS 36 15.326 9.835 -3.709 284 HZ3 LYS 36 HZ3 LYS 36 14.192 10.459 -4.729 285 H GLY 37 H GLY 37 10.082 6.149 2.673 286 HA2 GLY 37 HA2 GLY 37 11.957 4.231 3.998 287 HA3 GLY 37 HA3 GLY 37 10.212 4.238 4.149 288 H VAL 38 H VAL 38 11.282 1.932 4.186 289 HA VAL 38 HA VAL 38 11.348 0.610 1.455 290 HB VAL 38 HB VAL 38 11.881 -0.539 4.242 291 HG11 VAL 38 HG11 VAL 38 12.239 -1.932 1.504 292 HG12 VAL 38 HG12 VAL 38 12.829 -2.562 3.066 293 HG13 VAL 38 HG13 VAL 38 11.094 -2.407 2.778 294 HG21 VAL 38 HG21 VAL 38 14.288 -0.661 3.488 295 HG22 VAL 38 HG22 VAL 38 13.862 0.088 1.929 296 HG23 VAL 38 HG23 VAL 38 13.725 1.015 3.438 297 H SER 39 H SER 39 9.758 -0.545 0.588 298 HA SER 39 HA SER 39 7.335 -1.435 2.260 299 HB2 SER 39 HB2 SER 39 7.487 -0.473 -0.635 300 HB3 SER 39 HB3 SER 39 6.090 -1.300 0.028 301 HG SER 39 HG SER 39 5.792 0.927 0.166 302 H GLU 40 H GLU 40 8.001 -3.402 2.680 303 HA GLU 40 HA GLU 40 9.329 -5.229 0.694 304 HB2 GLU 40 HB2 GLU 40 9.824 -5.051 3.245 305 HB3 GLU 40 HB3 GLU 40 8.300 -5.833 3.505 306 HG2 GLU 40 HG2 GLU 40 9.054 -7.933 2.408 307 HG3 GLU 40 HG3 GLU 40 10.578 -7.188 1.936 308 H ILE 41 H ILE 41 8.524 -7.040 -0.235 309 HA ILE 41 HA ILE 41 5.840 -8.124 0.622 310 HB ILE 41 HB ILE 41 6.398 -7.724 -2.374 311 HG12 ILE 41 HG12 ILE 41 4.259 -6.156 -0.822 312 HG13 ILE 41 HG13 ILE 41 5.824 -5.504 -1.266 313 HG21 ILE 41 HG21 ILE 41 4.960 -9.754 -1.858 314 HG22 ILE 41 HG22 ILE 41 3.824 -8.728 -0.947 315 HG23 ILE 41 HG23 ILE 41 4.027 -8.534 -2.704 316 HD11 ILE 41 HD11 ILE 41 3.709 -6.420 -3.310 317 HD12 ILE 41 HD12 ILE 41 4.262 -4.777 -2.978 318 HD13 ILE 41 HD13 ILE 41 5.376 -5.935 -3.726 319 H VAL 42 H VAL 42 6.176 -10.274 0.947 320 HA VAL 42 HA VAL 42 8.251 -11.818 -0.715 321 HB VAL 42 HB VAL 42 6.932 -12.917 1.809 322 HG11 VAL 42 HG11 VAL 42 9.651 -13.578 0.500 323 HG12 VAL 42 HG12 VAL 42 8.926 -14.395 1.903 324 HG13 VAL 42 HG13 VAL 42 8.173 -14.542 0.305 325 HG21 VAL 42 HG21 VAL 42 8.029 -10.843 2.626 326 HG22 VAL 42 HG22 VAL 42 8.910 -12.270 3.182 327 HG23 VAL 42 HG23 VAL 42 9.553 -11.297 1.831 328 H GLN 43 H GLN 43 7.273 -12.676 -2.503 329 HA GLN 43 HA GLN 43 4.366 -13.390 -2.557 330 HB2 GLN 43 HB2 GLN 43 5.549 -12.249 -4.425 331 HB3 GLN 43 HB3 GLN 43 6.557 -13.660 -4.700 332 HG2 GLN 43 HG2 GLN 43 4.528 -15.027 -5.305 333 HG3 GLN 43 HG3 GLN 43 3.478 -13.674 -4.907 334 HE21 GLN 43 HE21 GLN 43 2.777 -14.288 -7.122 335 HE22 GLN 43 HE22 GLN 43 3.605 -13.439 -8.537 336 H ASN 44 H ASN 44 3.841 -15.190 -1.385 337 HA ASN 44 HA ASN 44 5.287 -17.857 -1.980 338 HB2 ASN 44 HB2 ASN 44 3.574 -17.122 0.479 339 HB3 ASN 44 HB3 ASN 44 4.388 -18.631 0.191 340 HD21 ASN 44 HD21 ASN 44 5.023 -15.236 0.866 341 HD22 ASN 44 HD22 ASN 44 6.661 -15.605 1.598 342 H GLY 45 H GLY 45 3.867 -17.501 -4.007 343 HA2 GLY 45 HA2 GLY 45 2.114 -18.477 -5.376 344 HA3 GLY 45 HA3 GLY 45 1.639 -19.485 -4.025 345 H LYS 46 H LYS 46 0.013 -18.728 -2.665 346 HA LYS 46 HA LYS 46 -1.749 -16.431 -3.644 347 HB2 LYS 46 HB2 LYS 46 -2.263 -18.652 -1.567 348 HB3 LYS 46 HB3 LYS 46 -3.363 -17.330 -1.876 349 HG2 LYS 46 HG2 LYS 46 -3.712 -18.067 -4.258 350 HG3 LYS 46 HG3 LYS 46 -2.520 -19.327 -4.048 351 HD2 LYS 46 HD2 LYS 46 -4.238 -20.696 -3.585 352 HD3 LYS 46 HD3 LYS 46 -4.164 -20.089 -1.963 353 HE2 LYS 46 HE2 LYS 46 -6.079 -19.120 -4.221 354 HE3 LYS 46 HE3 LYS 46 -6.496 -20.245 -2.935 355 HZ1 LYS 46 HZ1 LYS 46 -7.250 -18.121 -2.122 356 HZ2 LYS 46 HZ2 LYS 46 -5.934 -17.314 -2.681 357 HZ3 LYS 46 HZ3 LYS 46 -5.813 -18.284 -1.341 358 H HIS 47 H HIS 47 0.369 -17.239 -0.884 359 HA HIS 47 HA HIS 47 -0.758 -14.959 0.796 360 HB2 HIS 47 HB2 HIS 47 1.251 -17.197 1.461 361 HB3 HIS 47 HB3 HIS 47 0.956 -15.844 2.525 362 HD1 HIS 47 HD1 HIS 47 -0.727 -19.106 1.399 363 HD2 HIS 47 HD2 HIS 47 -1.464 -15.604 3.747 364 HE1 HIS 47 HE1 HIS 47 -2.878 -19.404 2.804 365 H PHE 48 H PHE 48 -0.029 -13.043 0.315 366 HA PHE 48 HA PHE 48 2.891 -12.538 -0.488 367 HB2 PHE 48 HB2 PHE 48 0.279 -10.972 -0.798 368 HB3 PHE 48 HB3 PHE 48 1.820 -10.210 -0.980 369 HD1 PHE 48 HD1 PHE 48 0.363 -13.511 -2.365 370 HD2 PHE 48 HD2 PHE 48 2.175 -9.701 -3.199 371 HE1 PHE 48 HE1 PHE 48 0.264 -13.977 -4.766 372 HE2 PHE 48 HE2 PHE 48 2.038 -10.181 -5.594 373 HZ PHE 48 HZ PHE 48 1.111 -12.296 -6.392 374 H LYS 49 H LYS 49 4.048 -12.348 1.358 375 HA LYS 49 HA LYS 49 2.895 -11.076 3.864 376 HB2 LYS 49 HB2 LYS 49 5.660 -12.313 3.431 377 HB3 LYS 49 HB3 LYS 49 5.071 -11.690 4.954 378 HG2 LYS 49 HG2 LYS 49 3.279 -13.359 5.081 379 HG3 LYS 49 HG3 LYS 49 3.593 -13.920 3.454 380 HD2 LYS 49 HD2 LYS 49 6.054 -14.465 4.362 381 HD3 LYS 49 HD3 LYS 49 5.372 -14.267 5.963 382 HE2 LYS 49 HE2 LYS 49 4.434 -16.277 3.789 383 HE3 LYS 49 HE3 LYS 49 5.504 -16.662 5.131 384 HZ1 LYS 49 HZ1 LYS 49 3.216 -17.280 5.840 385 HZ2 LYS 49 HZ2 LYS 49 2.562 -15.842 5.382 386 HZ3 LYS 49 HZ3 LYS 49 3.506 -15.870 6.652 387 H PHE 50 H PHE 50 2.972 -8.987 4.136 388 HA PHE 50 HA PHE 50 5.217 -7.410 2.804 389 HB2 PHE 50 HB2 PHE 50 3.913 -5.525 2.449 390 HB3 PHE 50 HB3 PHE 50 3.141 -6.912 1.773 391 HD1 PHE 50 HD2 PHE 50 2.709 -5.469 5.364 392 HD2 PHE 50 HD1 PHE 50 1.055 -5.960 1.429 393 HE1 PHE 50 HE2 PHE 50 0.665 -4.386 6.088 394 HE2 PHE 50 HE1 PHE 50 -1.003 -4.886 2.170 395 HZ PHE 50 HZ PHE 50 -1.215 -4.082 4.509 396 H THR 51 H THR 51 6.345 -5.867 3.686 397 HA THR 51 HA THR 51 5.827 -5.104 6.637 398 HB THR 51 HB THR 51 8.670 -5.340 5.519 399 HG1 THR 51 HG1 THR 51 8.621 -7.371 5.835 400 HG21 THR 51 HG21 THR 51 8.475 -3.882 7.491 401 HG22 THR 51 HG22 THR 51 9.350 -5.383 7.874 402 HG23 THR 51 HG23 THR 51 7.670 -5.188 8.407 403 H ILE 52 H ILE 52 4.751 -3.216 6.125 404 HA ILE 52 HA ILE 52 5.950 -1.352 4.026 405 HB ILE 52 HB ILE 52 3.131 -1.400 5.174 406 HG12 ILE 52 HG12 ILE 52 3.396 -3.381 3.841 407 HG13 ILE 52 HG13 ILE 52 2.354 -2.277 2.987 408 HG21 ILE 52 HG21 ILE 52 2.480 0.136 3.307 409 HG22 ILE 52 HG22 ILE 52 3.640 0.906 4.386 410 HG23 ILE 52 HG23 ILE 52 4.180 0.283 2.806 411 HD11 ILE 52 HD11 ILE 52 5.327 -2.886 2.325 412 HD12 ILE 52 HD12 ILE 52 3.915 -3.412 1.407 413 HD13 ILE 52 HD13 ILE 52 4.336 -1.686 1.449 414 H THR 53 H THR 53 6.702 0.550 4.448 415 HA THR 53 HA THR 53 6.754 1.644 7.278 416 HB THR 53 HB THR 53 8.390 3.343 6.340 417 HG1 THR 53 HG1 THR 53 8.626 1.512 4.193 418 HG21 THR 53 HG21 THR 53 10.325 1.780 6.267 419 HG22 THR 53 HG22 THR 53 9.232 0.381 6.121 420 HG23 THR 53 HG23 THR 53 9.231 1.369 7.601 421 H ALA 54 H ALA 54 5.078 2.742 7.792 422 HA ALA 54 HA ALA 54 3.802 4.879 5.967 423 HB1 ALA 54 HB1 ALA 54 2.894 3.553 8.623 424 HB2 ALA 54 HB2 ALA 54 1.998 4.816 7.770 425 HB3 ALA 54 HB3 ALA 54 2.240 3.235 6.993 426 H GLY 55 H GLY 55 6.029 5.799 6.270 427 HA2 GLY 55 HA2 GLY 55 7.194 7.799 6.957 428 HA3 GLY 55 HA3 GLY 55 5.950 8.176 8.134 429 H SER 56 H SER 56 6.128 7.314 10.183 430 HA SER 56 HA SER 56 8.823 6.169 11.055 431 HB2 SER 56 HB2 SER 56 6.544 7.190 12.848 432 HB3 SER 56 HB3 SER 56 8.160 6.733 13.360 433 HG SER 56 HG SER 56 7.619 9.091 12.960 434 H LYS 57 H LYS 57 5.406 5.140 10.915 435 HA LYS 57 HA LYS 57 5.882 2.825 12.791 436 HB2 LYS 57 HB2 LYS 57 3.705 4.162 12.780 437 HB3 LYS 57 HB3 LYS 57 3.335 3.491 11.199 438 HG2 LYS 57 HG2 LYS 57 3.525 1.116 12.296 439 HG3 LYS 57 HG3 LYS 57 3.705 1.924 13.850 440 HD2 LYS 57 HD2 LYS 57 1.402 2.995 13.511 441 HD3 LYS 57 HD3 LYS 57 1.275 2.183 11.947 442 HE2 LYS 57 HE2 LYS 57 1.573 -0.097 13.167 443 HE3 LYS 57 HE3 LYS 57 1.538 0.770 14.706 444 HZ1 LYS 57 HZ1 LYS 57 -0.705 0.569 12.655 445 HZ2 LYS 57 HZ2 LYS 57 -0.789 1.651 13.916 446 HZ3 LYS 57 HZ3 LYS 57 -0.753 -0.002 14.107 447 H VAL 58 H VAL 58 6.402 0.845 12.212 448 HA VAL 58 HA VAL 58 6.450 -0.054 9.310 449 HB VAL 58 HB VAL 58 7.516 -1.467 11.819 450 HG11 VAL 58 HG11 VAL 58 7.938 -2.131 8.827 451 HG12 VAL 58 HG12 VAL 58 8.757 -2.944 10.186 452 HG13 VAL 58 HG13 VAL 58 7.006 -3.111 9.981 453 HG21 VAL 58 HG21 VAL 58 8.874 0.611 11.300 454 HG22 VAL 58 HG22 VAL 58 9.808 -0.857 10.976 455 HG23 VAL 58 HG23 VAL 58 9.096 0.061 9.627 456 H ILE 59 H ILE 59 4.545 -0.752 8.582 457 HA ILE 59 HA ILE 59 2.553 -2.221 10.414 458 HB ILE 59 HB ILE 59 2.060 -0.838 7.721 459 HG12 ILE 59 HG12 ILE 59 1.108 0.021 10.533 460 HG13 ILE 59 HG13 ILE 59 2.469 0.747 9.696 461 HG21 ILE 59 HG21 ILE 59 0.011 -2.154 9.647 462 HG22 ILE 59 HG22 ILE 59 -0.388 -1.282 8.152 463 HG23 ILE 59 HG23 ILE 59 0.497 -2.801 8.057 464 HD11 ILE 59 HD11 ILE 59 -0.473 0.920 8.828 465 HD12 ILE 59 HD12 ILE 59 0.611 2.227 9.340 466 HD13 ILE 59 HD13 ILE 59 0.876 1.424 7.772 467 H GLN 60 H GLN 60 3.250 -4.302 10.367 468 HA GLN 60 HA GLN 60 3.699 -5.637 7.675 469 HB2 GLN 60 HB2 GLN 60 5.090 -7.239 8.653 470 HB3 GLN 60 HB3 GLN 60 5.650 -5.638 9.037 471 HG2 GLN 60 HG2 GLN 60 4.156 -7.462 11.017 472 HG3 GLN 60 HG3 GLN 60 5.898 -7.380 10.869 473 HE21 GLN 60 HE21 GLN 60 6.978 -5.486 11.701 474 HE22 GLN 60 HE22 GLN 60 6.043 -4.281 12.739 475 H ASN 61 H ASN 61 2.419 -7.029 6.960 476 HA ASN 61 HA ASN 61 0.539 -8.752 8.453 477 HB2 ASN 61 HB2 ASN 61 -0.742 -6.477 6.776 478 HB3 ASN 61 HB3 ASN 61 -1.586 -7.917 7.275 479 HD21 ASN 61 HD21 ASN 61 -0.243 -4.965 8.516 480 HD22 ASN 61 HD22 ASN 61 -1.185 -5.070 10.080 481 H GLU 62 H GLU 62 -0.724 -10.174 6.845 482 HA GLU 62 HA GLU 62 0.698 -10.318 4.155 483 HB2 GLU 62 HB2 GLU 62 1.053 -12.576 4.167 484 HB3 GLU 62 HB3 GLU 62 1.691 -11.942 5.676 485 HG2 GLU 62 HG2 GLU 62 -0.271 -12.970 6.932 486 HG3 GLU 62 HG3 GLU 62 -0.918 -13.592 5.411 487 H PHE 63 H PHE 63 -0.441 -10.517 2.428 488 HA PHE 63 HA PHE 63 -3.451 -10.844 2.724 489 HB2 PHE 63 HB2 PHE 63 -3.927 -9.649 0.752 490 HB3 PHE 63 HB3 PHE 63 -3.104 -8.727 1.940 491 HD1 PHE 63 HD1 PHE 63 -0.750 -7.858 1.434 492 HD2 PHE 63 HD2 PHE 63 -2.895 -10.218 -1.448 493 HE1 PHE 63 HE1 PHE 63 0.783 -7.098 -0.369 494 HE2 PHE 63 HE2 PHE 63 -1.389 -9.412 -3.221 495 HZ PHE 63 HZ PHE 63 0.448 -7.842 -2.665 496 H THR 64 H THR 64 -4.511 -12.348 1.854 497 HA THR 64 HA THR 64 -3.119 -14.500 0.236 498 HB THR 64 HB THR 64 -5.895 -14.623 1.547 499 HG1 THR 64 HG1 THR 64 -3.879 -15.999 2.752 500 HG21 THR 64 HG21 THR 64 -5.466 -16.440 -0.131 501 HG22 THR 64 HG22 THR 64 -5.485 -17.101 1.521 502 HG23 THR 64 HG23 THR 64 -3.929 -16.863 0.677 503 H VAL 65 H VAL 65 -3.254 -14.230 -1.916 504 HA VAL 65 HA VAL 65 -5.348 -12.652 -3.284 505 HB VAL 65 HB VAL 65 -3.219 -14.520 -4.391 506 HG11 VAL 65 HG11 VAL 65 -5.004 -14.287 -6.158 507 HG12 VAL 65 HG12 VAL 65 -4.815 -12.519 -6.108 508 HG13 VAL 65 HG13 VAL 65 -3.471 -13.549 -6.636 509 HG21 VAL 65 HG21 VAL 65 -3.312 -11.413 -4.298 510 HG22 VAL 65 HG22 VAL 65 -2.269 -12.439 -3.288 511 HG23 VAL 65 HG23 VAL 65 -2.011 -12.369 -5.038 512 H GLY 66 H GLY 66 -7.366 -13.296 -3.613 513 HA2 GLY 66 HA2 GLY 66 -9.142 -14.763 -4.506 514 HA3 GLY 66 HA3 GLY 66 -8.088 -16.150 -4.467 515 H GLU 67 H GLU 67 -7.867 -14.861 -1.386 516 HA GLU 67 HA GLU 67 -10.433 -15.912 -0.328 517 HB2 GLU 67 HB2 GLU 67 -7.753 -17.282 0.447 518 HB3 GLU 67 HB3 GLU 67 -9.109 -17.296 1.541 519 HG2 GLU 67 HG2 GLU 67 -9.342 -18.469 -1.304 520 HG3 GLU 67 HG3 GLU 67 -8.905 -19.402 0.126 521 H GLU 68 H GLU 68 -10.838 -15.299 1.881 522 HA GLU 68 HA GLU 68 -10.347 -12.552 2.274 523 HB2 GLU 68 HB2 GLU 68 -11.427 -12.641 4.402 524 HB3 GLU 68 HB3 GLU 68 -12.297 -13.553 3.205 525 HG2 GLU 68 HG2 GLU 68 -12.036 -15.597 4.315 526 HG3 GLU 68 HG3 GLU 68 -10.401 -15.245 4.832 527 H CYS 69 H CYS 69 -8.958 -11.245 3.169 528 HA CYS 69 HA CYS 69 -6.955 -12.209 5.253 529 HB2 CYS 69 HB2 CYS 69 -5.110 -10.933 3.988 530 HB3 CYS 69 HB3 CYS 69 -5.637 -12.514 3.403 531 HG CYS 69 HG CYS 69 -6.942 -11.743 1.357 532 H GLU 70 H GLU 70 -6.663 -10.940 6.788 533 HA GLU 70 HA GLU 70 -8.033 -8.258 6.966 534 HB2 GLU 70 HB2 GLU 70 -7.763 -8.349 9.369 535 HB3 GLU 70 HB3 GLU 70 -8.738 -9.615 8.685 536 HG2 GLU 70 HG2 GLU 70 -6.914 -11.304 8.967 537 HG3 GLU 70 HG3 GLU 70 -5.820 -10.023 9.465 538 H LEU 71 H LEU 71 -6.991 -6.501 6.464 539 HA LEU 71 HA LEU 71 -4.021 -6.147 7.233 540 HB2 LEU 71 HB2 LEU 71 -5.531 -4.819 4.905 541 HB3 LEU 71 HB3 LEU 71 -3.839 -4.601 5.298 542 HG LEU 71 HG LEU 71 -5.143 -7.181 4.233 543 HD11 LEU 71 HD11 LEU 71 -4.864 -5.284 2.584 544 HD12 LEU 71 HD12 LEU 71 -3.831 -6.654 2.164 545 HD13 LEU 71 HD13 LEU 71 -3.133 -5.215 2.939 546 HD21 LEU 71 HD21 LEU 71 -2.793 -8.102 4.031 547 HD22 LEU 71 HD22 LEU 71 -3.250 -7.845 5.709 548 HD23 LEU 71 HD23 LEU 71 -2.156 -6.692 4.898 549 H GLU 72 H GLU 72 -3.419 -4.321 8.329 550 HA GLU 72 HA GLU 72 -5.465 -2.654 9.710 551 HB2 GLU 72 HB2 GLU 72 -3.146 -3.323 10.610 552 HB3 GLU 72 HB3 GLU 72 -2.417 -2.216 9.453 553 HG2 GLU 72 HG2 GLU 72 -3.816 -0.302 10.605 554 HG3 GLU 72 HG3 GLU 72 -4.284 -1.484 11.821 555 H THR 73 H THR 73 -6.088 -0.690 9.416 556 HA THR 73 HA THR 73 -5.488 0.802 6.808 557 HB THR 73 HB THR 73 -7.693 -0.023 6.659 558 HG1 THR 73 HG1 THR 73 -8.624 2.359 7.506 559 HG21 THR 73 HG21 THR 73 -9.577 0.511 8.289 560 HG22 THR 73 HG22 THR 73 -8.359 1.177 9.413 561 HG23 THR 73 HG23 THR 73 -8.362 -0.559 8.996 562 H MET 74 H MET 74 -5.939 3.048 6.936 563 HA MET 74 HA MET 74 -4.464 4.416 9.244 564 HB2 MET 74 HB2 MET 74 -5.454 5.508 6.543 565 HB3 MET 74 HB3 MET 74 -4.948 6.575 7.835 566 HG2 MET 74 HG2 MET 74 -3.114 4.460 6.554 567 HG3 MET 74 HG3 MET 74 -3.099 6.196 6.234 568 HE1 MET 74 HE1 MET 74 -2.298 3.356 8.858 569 HE2 MET 74 HE2 MET 74 -0.992 3.803 7.720 570 HE3 MET 74 HE3 MET 74 -0.802 4.128 9.471 571 H THR 75 H THR 75 -7.643 4.935 7.641 572 HA THR 75 HA THR 75 -8.807 5.752 10.359 573 HB THR 75 HB THR 75 -10.144 5.984 7.621 574 HG1 THR 75 HG1 THR 75 -9.808 8.303 8.212 575 HG21 THR 75 HG21 THR 75 -10.948 7.245 10.333 576 HG22 THR 75 HG22 THR 75 -11.808 5.896 9.548 577 HG23 THR 75 HG23 THR 75 -11.774 7.490 8.777 578 H GLY 76 H GLY 76 -9.726 4.175 11.411 579 HA2 GLY 76 HA2 GLY 76 -11.716 2.471 11.256 580 HA3 GLY 76 HA3 GLY 76 -10.841 1.642 10.010 581 H GLU 77 H GLU 77 -9.399 0.012 10.648 582 HA GLU 77 HA GLU 77 -8.614 -0.559 13.363 583 HB2 GLU 77 HB2 GLU 77 -10.153 -2.189 14.156 584 HB3 GLU 77 HB3 GLU 77 -10.920 -0.644 13.966 585 HG2 GLU 77 HG2 GLU 77 -11.480 -3.207 12.367 586 HG3 GLU 77 HG3 GLU 77 -12.509 -2.256 13.401 587 H LYS 78 H LYS 78 -10.084 -2.721 11.056 588 HA LYS 78 HA LYS 78 -7.598 -3.564 9.758 589 HB2 LYS 78 HB2 LYS 78 -7.797 -4.780 12.263 590 HB3 LYS 78 HB3 LYS 78 -8.731 -5.942 11.348 591 HG2 LYS 78 HG2 LYS 78 -6.727 -6.112 9.706 592 HG3 LYS 78 HG3 LYS 78 -5.891 -4.931 10.723 593 HD2 LYS 78 HD2 LYS 78 -6.063 -6.553 12.704 594 HD3 LYS 78 HD3 LYS 78 -6.906 -7.700 11.661 595 HE2 LYS 78 HE2 LYS 78 -4.802 -7.691 10.106 596 HE3 LYS 78 HE3 LYS 78 -3.968 -6.717 11.312 597 HZ1 LYS 78 HZ1 LYS 78 -4.360 -8.556 12.964 598 HZ2 LYS 78 HZ2 LYS 78 -3.675 -9.235 11.615 599 HZ3 LYS 78 HZ3 LYS 78 -5.309 -9.391 11.905 600 H VAL 79 H VAL 79 -8.225 -3.951 7.782 601 HA VAL 79 HA VAL 79 -11.162 -4.574 7.252 602 HB VAL 79 HB VAL 79 -10.228 -2.416 6.487 603 HG11 VAL 79 HG11 VAL 79 -8.867 -2.180 4.439 604 HG12 VAL 79 HG12 VAL 79 -7.927 -2.974 5.707 605 HG13 VAL 79 HG13 VAL 79 -8.590 -3.934 4.370 606 HG21 VAL 79 HG21 VAL 79 -11.220 -4.145 4.148 607 HG22 VAL 79 HG22 VAL 79 -12.259 -3.421 5.407 608 HG23 VAL 79 HG23 VAL 79 -11.338 -2.377 4.313 609 H LYS 80 H LYS 80 -11.786 -6.432 6.366 610 HA LYS 80 HA LYS 80 -9.751 -8.436 5.359 611 HB2 LYS 80 HB2 LYS 80 -12.728 -8.760 5.949 612 HB3 LYS 80 HB3 LYS 80 -11.800 -9.946 5.050 613 HG2 LYS 80 HG2 LYS 80 -10.075 -10.019 6.941 614 HG3 LYS 80 HG3 LYS 80 -11.138 -9.004 7.918 615 HD2 LYS 80 HD2 LYS 80 -12.929 -10.821 7.773 616 HD3 LYS 80 HD3 LYS 80 -11.874 -11.755 6.717 617 HE2 LYS 80 HE2 LYS 80 -10.085 -11.768 8.644 618 HE3 LYS 80 HE3 LYS 80 -11.295 -11.039 9.694 619 HZ1 LYS 80 HZ1 LYS 80 -11.450 -13.515 9.861 620 HZ2 LYS 80 HZ2 LYS 80 -11.516 -13.697 8.215 621 HZ3 LYS 80 HZ3 LYS 80 -12.793 -13.055 8.984 622 H THR 81 H THR 81 -8.965 -7.540 3.637 623 HA THR 81 HA THR 81 -10.739 -6.821 1.230 624 HB THR 81 HB THR 81 -9.603 -4.925 2.283 625 HG1 THR 81 HG1 THR 81 -8.595 -5.595 -0.283 626 HG21 THR 81 HG21 THR 81 -7.421 -6.118 3.091 627 HG22 THR 81 HG22 THR 81 -7.207 -4.553 2.322 628 HG23 THR 81 HG23 THR 81 -6.853 -6.027 1.408 629 H VAL 82 H VAL 82 -10.748 -8.536 -0.116 630 HA VAL 82 HA VAL 82 -8.306 -10.305 -0.356 631 HB VAL 82 HB VAL 82 -10.453 -11.481 -0.142 632 HG11 VAL 82 HG11 VAL 82 -11.785 -12.024 -2.193 633 HG12 VAL 82 HG12 VAL 82 -11.994 -10.313 -1.738 634 HG13 VAL 82 HG13 VAL 82 -10.935 -10.758 -3.107 635 HG21 VAL 82 HG21 VAL 82 -8.885 -12.157 -2.716 636 HG22 VAL 82 HG22 VAL 82 -8.355 -12.541 -1.068 637 HG23 VAL 82 HG23 VAL 82 -9.850 -13.255 -1.701 638 H VAL 83 H VAL 83 -7.004 -10.416 -2.044 639 HA VAL 83 HA VAL 83 -7.180 -8.137 -4.067 640 HB VAL 83 HB VAL 83 -4.631 -9.627 -3.259 641 HG11 VAL 83 HG11 VAL 83 -3.505 -7.562 -4.067 642 HG12 VAL 83 HG12 VAL 83 -4.515 -8.235 -5.363 643 HG13 VAL 83 HG13 VAL 83 -5.065 -6.805 -4.466 644 HG21 VAL 83 HG21 VAL 83 -4.055 -7.637 -1.749 645 HG22 VAL 83 HG22 VAL 83 -5.734 -7.096 -1.851 646 HG23 VAL 83 HG23 VAL 83 -5.355 -8.652 -1.111 647 H GLN 84 H GLN 84 -7.328 -8.519 -6.174 648 HA GLN 84 HA GLN 84 -7.019 -11.392 -7.241 649 HB2 GLN 84 HB2 GLN 84 -8.705 -9.027 -8.197 650 HB3 GLN 84 HB3 GLN 84 -8.266 -10.290 -9.306 651 HG2 GLN 84 HG2 GLN 84 -10.491 -10.730 -8.458 652 HG3 GLN 84 HG3 GLN 84 -9.413 -12.037 -8.049 653 HE21 GLN 84 HE21 GLN 84 -9.280 -12.578 -5.875 654 HE22 GLN 84 HE22 GLN 84 -10.219 -11.662 -4.581 655 H LEU 85 H LEU 85 -5.672 -11.825 -8.908 656 HA LEU 85 HA LEU 85 -3.566 -9.715 -9.566 657 HB2 LEU 85 HB2 LEU 85 -2.812 -11.479 -8.012 658 HB3 LEU 85 HB3 LEU 85 -3.338 -12.739 -9.114 659 HG LEU 85 HG LEU 85 -1.657 -12.070 -10.784 660 HD11 LEU 85 HD11 LEU 85 -0.626 -10.019 -8.700 661 HD12 LEU 85 HD12 LEU 85 -1.356 -9.616 -10.273 662 HD13 LEU 85 HD13 LEU 85 0.188 -10.452 -10.203 663 HD21 LEU 85 HD21 LEU 85 0.374 -12.866 -9.481 664 HD22 LEU 85 HD22 LEU 85 -1.075 -13.822 -9.117 665 HD23 LEU 85 HD23 LEU 85 -0.512 -12.593 -7.962 666 H GLU 86 H GLU 86 -3.449 -9.144 -11.616 667 HA GLU 86 HA GLU 86 -4.184 -11.116 -13.864 668 HB2 GLU 86 HB2 GLU 86 -5.503 -8.923 -13.719 669 HB3 GLU 86 HB3 GLU 86 -3.997 -8.090 -14.059 670 HG2 GLU 86 HG2 GLU 86 -3.844 -9.391 -16.298 671 HG3 GLU 86 HG3 GLU 86 -5.467 -10.003 -15.968 672 H GLY 87 H GLY 87 -2.659 -11.745 -15.103 673 HA2 GLY 87 HA2 GLY 87 -0.467 -12.260 -16.061 674 HA3 GLY 87 HA3 GLY 87 -0.384 -10.521 -16.187 675 H ASP 88 H ASP 88 -0.241 -11.792 -13.106 676 HA ASP 88 HA ASP 88 1.391 -11.797 -11.404 677 HB2 ASP 88 HB2 ASP 88 2.470 -13.593 -12.856 678 HB3 ASP 88 HB3 ASP 88 3.593 -12.367 -13.426 679 H ASN 89 H ASN 89 0.730 -9.305 -12.896 680 HA ASN 89 HA ASN 89 2.676 -7.583 -11.319 681 HB2 ASN 89 HB2 ASN 89 3.393 -6.257 -12.991 682 HB3 ASN 89 HB3 ASN 89 3.440 -7.810 -13.752 683 HD21 ASN 89 HD21 ASN 89 3.144 -4.913 -14.661 684 HD22 ASN 89 HD22 ASN 89 1.792 -5.055 -15.912 685 H LYS 90 H LYS 90 -0.641 -7.669 -12.553 686 HA LYS 90 HA LYS 90 -1.174 -4.963 -11.194 687 HB2 LYS 90 HB2 LYS 90 -2.882 -6.675 -13.050 688 HB3 LYS 90 HB3 LYS 90 -3.412 -5.149 -12.389 689 HG2 LYS 90 HG2 LYS 90 -1.802 -3.867 -13.704 690 HG3 LYS 90 HG3 LYS 90 -0.901 -5.315 -14.165 691 HD2 LYS 90 HD2 LYS 90 -2.962 -6.221 -15.336 692 HD3 LYS 90 HD3 LYS 90 -3.838 -4.750 -15.002 693 HE2 LYS 90 HE2 LYS 90 -1.215 -4.950 -16.665 694 HE3 LYS 90 HE3 LYS 90 -2.842 -5.025 -17.344 695 HZ1 LYS 90 HZ1 LYS 90 -2.033 -2.684 -17.454 696 HZ2 LYS 90 HZ2 LYS 90 -1.677 -2.609 -15.849 697 HZ3 LYS 90 HZ3 LYS 90 -3.245 -2.725 -16.334 698 H LEU 91 H LEU 91 -1.615 -5.217 -9.076 699 HA LEU 91 HA LEU 91 -3.467 -7.469 -8.096 700 HB2 LEU 91 HB2 LEU 91 -1.489 -5.610 -6.712 701 HB3 LEU 91 HB3 LEU 91 -2.636 -6.500 -5.785 702 HG LEU 91 HG LEU 91 -0.569 -7.827 -7.632 703 HD11 LEU 91 HD11 LEU 91 0.502 -6.559 -5.745 704 HD12 LEU 91 HD12 LEU 91 0.663 -8.301 -5.471 705 HD13 LEU 91 HD13 LEU 91 -0.562 -7.360 -4.579 706 HD21 LEU 91 HD21 LEU 91 -2.571 -9.325 -7.132 707 HD22 LEU 91 HD22 LEU 91 -2.298 -9.105 -5.392 708 HD23 LEU 91 HD23 LEU 91 -1.084 -9.930 -6.379 709 H VAL 92 H VAL 92 -5.567 -6.902 -8.008 710 HA VAL 92 HA VAL 92 -6.338 -4.028 -7.238 711 HB VAL 92 HB VAL 92 -8.385 -4.259 -8.479 712 HG11 VAL 92 HG11 VAL 92 -6.020 -4.949 -10.324 713 HG12 VAL 92 HG12 VAL 92 -7.494 -4.053 -10.760 714 HG13 VAL 92 HG13 VAL 92 -6.320 -3.349 -9.627 715 HG21 VAL 92 HG21 VAL 92 -8.845 -6.088 -10.128 716 HG22 VAL 92 HG22 VAL 92 -7.459 -7.016 -9.511 717 HG23 VAL 92 HG23 VAL 92 -8.866 -6.705 -8.467 718 H THR 93 H THR 93 -7.368 -3.658 -5.369 719 HA THR 93 HA THR 93 -9.283 -5.768 -4.299 720 HB THR 93 HB THR 93 -7.013 -6.089 -3.266 721 HG1 THR 93 HG1 THR 93 -8.770 -6.961 -2.320 722 HG21 THR 93 HG21 THR 93 -6.215 -3.806 -2.709 723 HG22 THR 93 HG22 THR 93 -6.401 -4.757 -1.225 724 HG23 THR 93 HG23 THR 93 -7.620 -3.537 -1.633 725 H THR 94 H THR 94 -10.388 -5.002 -2.300 726 HA THR 94 HA THR 94 -11.613 -2.211 -2.748 727 HB THR 94 HB THR 94 -13.200 -4.732 -1.972 728 HG1 THR 94 HG1 THR 94 -14.178 -4.444 -3.948 729 HG21 THR 94 HG21 THR 94 -14.199 -2.617 -1.009 730 HG22 THR 94 HG22 THR 94 -15.230 -3.283 -2.287 731 HG23 THR 94 HG23 THR 94 -14.202 -1.868 -2.625 732 H PHE 95 H PHE 95 -10.640 -1.180 -1.093 733 HA PHE 95 HA PHE 95 -10.077 -2.562 1.552 734 HB2 PHE 95 HB2 PHE 95 -8.507 -1.031 -0.079 735 HB3 PHE 95 HB3 PHE 95 -9.333 0.269 0.701 736 HD1 PHE 95 HD2 PHE 95 -7.146 -2.667 1.212 737 HD2 PHE 95 HD1 PHE 95 -8.472 1.057 2.893 738 HE1 PHE 95 HE2 PHE 95 -5.439 -2.849 2.975 739 HE2 PHE 95 HE1 PHE 95 -6.736 0.893 4.611 740 HZ PHE 95 HZ PHE 95 -5.239 -1.081 4.698 741 H LYS 96 H LYS 96 -10.317 0.396 2.739 742 HA LYS 96 HA LYS 96 -13.168 0.093 3.773 743 HB2 LYS 96 HB2 LYS 96 -11.052 2.236 4.394 744 HB3 LYS 96 HB3 LYS 96 -12.604 2.135 5.168 745 HG2 LYS 96 HG2 LYS 96 -10.452 -0.066 5.366 746 HG3 LYS 96 HG3 LYS 96 -10.558 1.287 6.454 747 HD2 LYS 96 HD2 LYS 96 -12.806 -0.814 6.127 748 HD3 LYS 96 HD3 LYS 96 -11.510 -0.891 7.309 749 HE2 LYS 96 HE2 LYS 96 -12.291 1.425 8.223 750 HE3 LYS 96 HE3 LYS 96 -13.735 1.244 7.227 751 HZ1 LYS 96 HZ1 LYS 96 -12.817 -0.808 9.325 752 HZ2 LYS 96 HZ2 LYS 96 -14.189 -0.940 8.432 753 HZ3 LYS 96 HZ3 LYS 96 -13.989 0.226 9.585 754 H ASN 97 H ASN 97 -14.305 0.453 1.744 755 HA ASN 97 HA ASN 97 -15.056 1.503 -0.196 756 HB2 ASN 97 HB2 ASN 97 -15.129 3.909 1.704 757 HB3 ASN 97 HB3 ASN 97 -15.974 3.767 0.186 758 HD21 ASN 97 HD21 ASN 97 -17.905 2.555 0.094 759 HD22 ASN 97 HD22 ASN 97 -18.635 1.878 1.644 760 H ILE 98 H ILE 98 -12.258 1.346 -0.212 761 HA ILE 98 HA ILE 98 -11.522 3.583 -2.209 762 HB ILE 98 HB ILE 98 -9.686 2.155 -0.207 763 HG12 ILE 98 HG12 ILE 98 -9.978 5.173 0.019 764 HG13 ILE 98 HG13 ILE 98 -11.320 4.235 0.604 765 HG21 ILE 98 HG21 ILE 98 -8.392 2.756 -2.250 766 HG22 ILE 98 HG22 ILE 98 -8.936 4.445 -2.134 767 HG23 ILE 98 HG23 ILE 98 -7.877 3.745 -0.883 768 HD11 ILE 98 HD11 ILE 98 -9.944 2.974 2.198 769 HD12 ILE 98 HD12 ILE 98 -8.443 3.699 1.579 770 HD13 ILE 98 HD13 ILE 98 -9.648 4.711 2.417 771 H LYS 99 H LYS 99 -10.814 2.813 -4.159 772 HA LYS 99 HA LYS 99 -10.533 -0.215 -4.547 773 HB2 LYS 99 HB2 LYS 99 -12.160 1.048 -5.992 774 HB3 LYS 99 HB3 LYS 99 -10.862 1.954 -6.676 775 HG2 LYS 99 HG2 LYS 99 -10.460 0.338 -8.211 776 HG3 LYS 99 HG3 LYS 99 -10.005 -0.812 -6.992 777 HD2 LYS 99 HD2 LYS 99 -12.840 -0.302 -8.091 778 HD3 LYS 99 HD3 LYS 99 -11.825 -1.658 -8.503 779 HE2 LYS 99 HE2 LYS 99 -13.025 -1.131 -5.682 780 HE3 LYS 99 HE3 LYS 99 -13.721 -2.196 -6.890 781 HZ1 LYS 99 HZ1 LYS 99 -11.640 -3.592 -6.784 782 HZ2 LYS 99 HZ2 LYS 99 -12.330 -3.458 -5.280 783 HZ3 LYS 99 HZ3 LYS 99 -10.992 -2.601 -5.637 784 H SER 100 H SER 100 -8.547 -0.773 -3.971 785 HA SER 100 HA SER 100 -6.126 0.985 -4.493 786 HB2 SER 100 HB2 SER 100 -6.511 0.032 -2.221 787 HB3 SER 100 HB3 SER 100 -6.371 -1.599 -2.859 788 HG SER 100 HG SER 100 -4.228 -1.111 -3.497 789 H VAL 101 H VAL 101 -5.105 0.767 -6.324 790 HA VAL 101 HA VAL 101 -4.922 -1.951 -7.769 791 HB VAL 101 HB VAL 101 -4.865 0.914 -8.893 792 HG11 VAL 101 HG11 VAL 101 -3.408 -0.541 -10.293 793 HG12 VAL 101 HG12 VAL 101 -4.698 -1.754 -10.448 794 HG13 VAL 101 HG13 VAL 101 -4.882 -0.134 -11.176 795 HG21 VAL 101 HG21 VAL 101 -7.014 0.332 -10.057 796 HG22 VAL 101 HG22 VAL 101 -7.062 -1.241 -9.224 797 HG23 VAL 101 HG23 VAL 101 -7.202 0.268 -8.300 798 H THR 102 H THR 102 -2.967 -2.824 -7.236 799 HA THR 102 HA THR 102 -0.517 -1.012 -7.088 800 HB THR 102 HB THR 102 -0.439 -3.906 -6.203 801 HG1 THR 102 HG1 THR 102 -0.913 -1.771 -4.401 802 HG21 THR 102 HG21 THR 102 1.194 -1.467 -5.264 803 HG22 THR 102 HG22 THR 102 1.732 -2.649 -6.478 804 HG23 THR 102 HG23 THR 102 1.439 -3.174 -4.815 805 H GLU 103 H GLU 103 0.711 -0.890 -8.979 806 HA GLU 103 HA GLU 103 0.620 -3.318 -10.853 807 HB2 GLU 103 HB2 GLU 103 -0.512 -1.180 -11.744 808 HB3 GLU 103 HB3 GLU 103 1.102 -0.496 -11.850 809 HG2 GLU 103 HG2 GLU 103 1.853 -2.328 -13.404 810 HG3 GLU 103 HG3 GLU 103 0.318 -3.152 -13.235 811 H LEU 104 H LEU 104 2.431 -4.218 -11.326 812 HA LEU 104 HA LEU 104 5.109 -2.970 -10.536 813 HB2 LEU 104 HB2 LEU 104 4.091 -5.496 -9.960 814 HB3 LEU 104 HB3 LEU 104 5.010 -5.869 -11.390 815 HG LEU 104 HG LEU 104 6.031 -4.550 -8.796 816 HD11 LEU 104 HD11 LEU 104 5.491 -7.034 -8.715 817 HD12 LEU 104 HD12 LEU 104 7.209 -6.704 -8.471 818 HD13 LEU 104 HD13 LEU 104 6.636 -7.322 -10.035 819 HD21 LEU 104 HD21 LEU 104 7.673 -5.295 -11.311 820 HD22 LEU 104 HD22 LEU 104 8.372 -4.830 -9.740 821 HD23 LEU 104 HD23 LEU 104 7.435 -3.659 -10.671 822 H ASN 105 H ASN 105 6.191 -1.967 -12.099 823 HA ASN 105 HA ASN 105 5.870 -2.847 -15.059 824 HB2 ASN 105 HB2 ASN 105 6.381 -0.064 -13.835 825 HB3 ASN 105 HB3 ASN 105 6.725 -0.442 -15.503 826 HD21 ASN 105 HD21 ASN 105 4.025 -0.333 -13.214 827 HD22 ASN 105 HD22 ASN 105 2.761 -0.199 -14.544 828 H GLY 106 H GLY 106 7.353 -4.526 -14.645 829 HA2 GLY 106 HA2 GLY 106 9.574 -5.427 -15.172 830 HA3 GLY 106 HA3 GLY 106 10.244 -3.808 -15.231 831 H ASP 107 H ASP 107 11.081 -2.959 -13.352 832 HA ASP 107 HA ASP 107 10.855 -4.521 -10.715 833 HB2 ASP 107 HB2 ASP 107 13.473 -3.500 -11.976 834 HB3 ASP 107 HB3 ASP 107 13.328 -3.917 -10.285 835 H ILE 108 H ILE 108 9.467 -2.081 -11.699 836 HA ILE 108 HA ILE 108 9.899 -0.485 -9.147 837 HB ILE 108 HB ILE 108 9.383 1.556 -10.015 838 HG12 ILE 108 HG12 ILE 108 9.546 1.710 -12.740 839 HG13 ILE 108 HG13 ILE 108 8.682 0.203 -12.630 840 HG21 ILE 108 HG21 ILE 108 11.640 0.397 -11.726 841 HG22 ILE 108 HG22 ILE 108 11.392 2.117 -11.324 842 HG23 ILE 108 HG23 ILE 108 11.754 0.953 -10.041 843 HD11 ILE 108 HD11 ILE 108 6.903 1.372 -11.174 844 HD12 ILE 108 HD12 ILE 108 7.827 2.884 -11.313 845 HD13 ILE 108 HD13 ILE 108 7.091 2.147 -12.763 846 H ILE 109 H ILE 109 8.113 -0.225 -7.919 847 HA ILE 109 HA ILE 109 5.513 -1.409 -8.996 848 HB ILE 109 HB ILE 109 6.697 -2.771 -7.224 849 HG12 ILE 109 HG12 ILE 109 3.918 -1.836 -6.331 850 HG13 ILE 109 HG13 ILE 109 4.175 -2.850 -7.743 851 HG21 ILE 109 HG21 ILE 109 7.522 -0.900 -5.714 852 HG22 ILE 109 HG22 ILE 109 5.853 -0.573 -5.208 853 HG23 ILE 109 HG23 ILE 109 6.623 -2.125 -4.817 854 HD11 ILE 109 HD11 ILE 109 3.591 -4.248 -5.755 855 HD12 ILE 109 HD12 ILE 109 5.228 -4.655 -6.332 856 HD13 ILE 109 HD13 ILE 109 5.005 -3.654 -4.878 857 H THR 110 H THR 110 3.735 -0.233 -8.982 858 HA THR 110 HA THR 110 3.740 2.366 -7.374 859 HB THR 110 HB THR 110 3.759 2.556 -9.933 860 HG1 THR 110 HG1 THR 110 2.897 4.074 -8.070 861 HG21 THR 110 HG21 THR 110 1.675 2.648 -11.162 862 HG22 THR 110 HG22 THR 110 0.743 2.102 -9.746 863 HG23 THR 110 HG23 THR 110 1.909 1.000 -10.516 864 H ASN 111 H ASN 111 2.186 2.715 -5.944 865 HA ASN 111 HA ASN 111 -0.115 0.673 -5.736 866 HB2 ASN 111 HB2 ASN 111 1.575 0.577 -3.815 867 HB3 ASN 111 HB3 ASN 111 1.052 2.180 -3.334 868 HD21 ASN 111 HD21 ASN 111 -0.813 2.226 -2.044 869 HD22 ASN 111 HD22 ASN 111 -1.899 0.756 -1.819 870 H THR 112 H THR 112 -1.794 1.612 -6.690 871 HA THR 112 HA THR 112 -2.273 4.625 -6.370 872 HB THR 112 HB THR 112 -3.414 2.750 -8.494 873 HG1 THR 112 HG1 THR 112 -1.092 2.996 -8.453 874 HG21 THR 112 HG21 THR 112 -3.773 4.855 -9.787 875 HG22 THR 112 HG22 THR 112 -3.101 5.827 -8.457 876 HG23 THR 112 HG23 THR 112 -4.643 4.959 -8.239 877 H MET 113 H MET 113 -3.426 4.814 -4.555 878 HA MET 113 HA MET 113 -5.882 3.077 -3.991 879 HB2 MET 113 HB2 MET 113 -4.346 5.087 -2.294 880 HB3 MET 113 HB3 MET 113 -5.958 4.579 -1.856 881 HG2 MET 113 HG2 MET 113 -5.160 2.119 -1.967 882 HG3 MET 113 HG3 MET 113 -3.507 2.743 -2.086 883 HE1 MET 113 HE1 MET 113 -5.392 0.969 0.131 884 HE2 MET 113 HE2 MET 113 -3.609 0.992 0.299 885 HE3 MET 113 HE3 MET 113 -4.652 1.438 1.681 886 H THR 114 H THR 114 -7.428 3.630 -5.272 887 HA THR 114 HA THR 114 -8.075 6.522 -5.924 888 HB THR 114 HB THR 114 -9.601 5.695 -7.632 889 HG1 THR 114 HG1 THR 114 -8.745 3.128 -6.740 890 HG21 THR 114 HG21 THR 114 -7.195 6.018 -8.286 891 HG22 THR 114 HG22 THR 114 -7.989 4.728 -9.219 892 HG23 THR 114 HG23 THR 114 -6.867 4.306 -7.906 893 H LEU 115 H LEU 115 -9.298 7.570 -4.583 894 HA LEU 115 HA LEU 115 -11.784 6.264 -3.279 895 HB2 LEU 115 HB2 LEU 115 -10.044 6.788 -1.640 896 HB3 LEU 115 HB3 LEU 115 -9.853 8.414 -2.251 897 HG LEU 115 HG LEU 115 -12.146 9.037 -1.452 898 HD11 LEU 115 HD11 LEU 115 -12.238 6.210 -0.189 899 HD12 LEU 115 HD12 LEU 115 -13.304 6.804 -1.479 900 HD13 LEU 115 HD13 LEU 115 -13.382 7.530 0.133 901 HD21 LEU 115 HD21 LEU 115 -10.125 9.426 -0.028 902 HD22 LEU 115 HD22 LEU 115 -10.298 7.811 0.698 903 HD23 LEU 115 HD23 LEU 115 -11.539 9.060 0.977 904 H GLY 116 H GLY 116 -12.689 6.711 -5.413 905 HA2 GLY 116 HA2 GLY 116 -14.339 7.934 -6.708 906 HA3 GLY 116 HA3 GLY 116 -14.403 9.158 -5.462 907 H ASP 117 H ASP 117 -12.982 10.867 -5.605 908 HA ASP 117 HA ASP 117 -11.820 11.531 -8.370 909 HB2 ASP 117 HB2 ASP 117 -12.595 13.396 -6.028 910 HB3 ASP 117 HB3 ASP 117 -11.810 13.923 -7.505 911 H ILE 118 H ILE 118 -10.855 10.927 -5.063 912 HA ILE 118 HA ILE 118 -8.173 12.290 -5.266 913 HB ILE 118 HB ILE 118 -9.212 10.379 -3.123 914 HG12 ILE 118 HG12 ILE 118 -10.737 12.303 -3.113 915 HG13 ILE 118 HG13 ILE 118 -9.853 12.077 -1.631 916 HG21 ILE 118 HG21 ILE 118 -6.836 12.375 -3.008 917 HG22 ILE 118 HG22 ILE 118 -7.431 11.391 -1.659 918 HG23 ILE 118 HG23 ILE 118 -6.702 10.605 -3.062 919 HD11 ILE 118 HD11 ILE 118 -9.125 14.241 -3.718 920 HD12 ILE 118 HD12 ILE 118 -10.078 14.501 -2.231 921 HD13 ILE 118 HD13 ILE 118 -8.378 14.021 -2.108 922 H VAL 119 H VAL 119 -6.559 11.306 -6.346 923 HA VAL 119 HA VAL 119 -6.346 8.232 -6.457 924 HB VAL 119 HB VAL 119 -5.234 10.343 -8.390 925 HG11 VAL 119 HG11 VAL 119 -3.806 8.290 -8.399 926 HG12 VAL 119 HG12 VAL 119 -5.241 7.263 -8.649 927 HG13 VAL 119 HG13 VAL 119 -4.719 8.409 -9.907 928 HG21 VAL 119 HG21 VAL 119 -7.622 8.397 -8.796 929 HG22 VAL 119 HG22 VAL 119 -7.736 10.161 -8.650 930 HG23 VAL 119 HG23 VAL 119 -6.922 9.454 -10.050 931 H PHE 120 H PHE 120 -5.268 7.912 -4.474 932 HA PHE 120 HA PHE 120 -2.701 9.403 -3.853 933 HB2 PHE 120 HB2 PHE 120 -4.049 9.011 -1.975 934 HB3 PHE 120 HB3 PHE 120 -4.318 7.332 -2.344 935 HD1 PHE 120 HD2 PHE 120 -1.060 9.336 -2.104 936 HD2 PHE 120 HD1 PHE 120 -3.408 6.091 -0.525 937 HE1 PHE 120 HE2 PHE 120 0.857 8.567 -0.808 938 HE2 PHE 120 HE1 PHE 120 -1.466 5.331 0.767 939 HZ PHE 120 HZ PHE 120 0.683 6.564 0.627 940 H LYS 121 H LYS 121 -1.245 8.949 -5.359 941 HA LYS 121 HA LYS 121 -0.562 6.044 -5.993 942 HB2 LYS 121 HB2 LYS 121 -1.318 7.665 -7.775 943 HB3 LYS 121 HB3 LYS 121 0.171 8.556 -7.558 944 HG2 LYS 121 HG2 LYS 121 1.510 6.482 -8.168 945 HG3 LYS 121 HG3 LYS 121 0.009 5.577 -8.366 946 HD2 LYS 121 HD2 LYS 121 -0.743 7.239 -10.149 947 HD3 LYS 121 HD3 LYS 121 0.764 8.132 -9.944 948 HE2 LYS 121 HE2 LYS 121 2.086 6.028 -10.620 949 HE3 LYS 121 HE3 LYS 121 0.569 5.151 -10.836 950 HZ1 LYS 121 HZ1 LYS 121 1.273 7.696 -12.314 951 HZ2 LYS 121 HZ2 LYS 121 -0.102 6.847 -12.540 952 HZ3 LYS 121 HZ3 LYS 121 1.342 6.193 -12.994 953 H ARG 122 H ARG 122 0.986 5.191 -4.829 954 HA ARG 122 HA ARG 122 3.592 6.693 -4.216 955 HB2 ARG 122 HB2 ARG 122 2.538 3.903 -3.421 956 HB3 ARG 122 HB3 ARG 122 4.239 4.261 -3.364 957 HG2 ARG 122 HG2 ARG 122 3.769 6.267 -1.837 958 HG3 ARG 122 HG3 ARG 122 2.091 5.716 -1.705 959 HD2 ARG 122 HD2 ARG 122 2.887 3.488 -0.805 960 HD3 ARG 122 HD3 ARG 122 4.557 3.936 -1.130 961 HE ARG 122 HE ARG 122 3.498 5.972 0.668 962 HH11 ARG 122 HH11 ARG 122 4.675 2.644 0.654 963 HH12 ARG 122 HH12 ARG 122 5.250 2.829 2.393 964 HH21 ARG 122 HH21 ARG 122 4.125 6.054 2.607 965 HH22 ARG 122 HH22 ARG 122 4.932 4.620 3.436 966 H ILE 123 H ILE 123 5.508 6.254 -5.224 967 HA ILE 123 HA ILE 123 5.668 4.034 -7.348 968 HB ILE 123 HB ILE 123 6.919 6.829 -7.595 969 HG12 ILE 123 HG12 ILE 123 5.419 6.731 -9.862 970 HG13 ILE 123 HG13 ILE 123 4.426 5.638 -8.932 971 HG21 ILE 123 HG21 ILE 123 6.965 4.455 -9.578 972 HG22 ILE 123 HG22 ILE 123 7.647 6.073 -9.878 973 HG23 ILE 123 HG23 ILE 123 8.350 5.042 -8.630 974 HD11 ILE 123 HD11 ILE 123 3.554 7.974 -8.818 975 HD12 ILE 123 HD12 ILE 123 4.115 7.560 -7.191 976 HD13 ILE 123 HD13 ILE 123 5.108 8.590 -8.237 977 H SER 124 H SER 124 6.888 2.533 -6.387 978 HA SER 124 HA SER 124 9.423 3.348 -4.838 979 HB2 SER 124 HB2 SER 124 7.468 1.001 -4.297 980 HB3 SER 124 HB3 SER 124 8.958 1.308 -3.406 981 HG SER 124 HG SER 124 6.521 2.361 -2.967 982 H LYS 125 H LYS 125 11.312 2.160 -5.171 983 HA LYS 125 HA LYS 125 11.314 0.426 -7.696 984 HB2 LYS 125 HB2 LYS 125 12.549 2.543 -7.823 985 HB3 LYS 125 HB3 LYS 125 13.565 2.106 -6.449 986 HG2 LYS 125 HG2 LYS 125 14.667 0.331 -7.647 987 HG3 LYS 125 HG3 LYS 125 13.424 0.212 -8.869 988 HD2 LYS 125 HD2 LYS 125 14.102 2.713 -9.521 989 HD3 LYS 125 HD3 LYS 125 15.557 2.415 -8.595 990 HE2 LYS 125 HE2 LYS 125 14.491 0.735 -11.002 991 HE3 LYS 125 HE3 LYS 125 15.711 1.990 -11.140 992 HZ1 LYS 125 HZ1 LYS 125 16.050 -0.522 -9.486 993 HZ2 LYS 125 HZ2 LYS 125 17.195 0.636 -9.627 994 HZ3 LYS 125 HZ3 LYS 125 16.775 -0.271 -10.937 995 H ARG 126 H ARG 126 12.097 -1.631 -7.682 996 HA ARG 126 HA ARG 126 12.177 -3.164 -5.270 997 HB2 ARG 126 HB2 ARG 126 11.661 -3.824 -7.723 998 HB3 ARG 126 HB3 ARG 126 13.392 -3.907 -7.996 999 HG2 ARG 126 HG2 ARG 126 13.512 -5.723 -6.151 1000 HG3 ARG 126 HG3 ARG 126 11.758 -5.580 -5.970 1001 HD2 ARG 126 HD2 ARG 126 11.629 -6.019 -8.579 1002 HD3 ARG 126 HD3 ARG 126 13.335 -6.466 -8.480 1003 HE ARG 126 HE ARG 126 11.927 -8.062 -6.474 1004 HH11 ARG 126 HH11 ARG 126 11.992 -7.753 -10.021 1005 HH12 ARG 126 HH12 ARG 126 11.244 -9.430 -10.149 1006 HH21 ARG 126 HH21 ARG 126 11.137 -9.868 -6.748 1007 HH22 ARG 126 HH22 ARG 126 10.723 -10.538 -8.417 1008 H ILE 127 H ILE 127 13.656 -3.576 -3.809 1009 HA ILE 127 HA ILE 127 16.621 -3.544 -4.367 1010 HB ILE 127 HB ILE 127 15.100 -1.694 -2.446 1011 HG12 ILE 127 HG12 ILE 127 17.510 -1.234 -4.291 1012 HG13 ILE 127 HG13 ILE 127 15.839 -0.851 -4.665 1013 HG21 ILE 127 HG21 ILE 127 18.004 -2.497 -1.914 1014 HG22 ILE 127 HG22 ILE 127 17.073 -1.212 -1.076 1015 HG23 ILE 127 HG23 ILE 127 16.589 -2.903 -0.909 1016 HD11 ILE 127 HD11 ILE 127 15.754 0.815 -2.768 1017 HD12 ILE 127 HD12 ILE 127 17.492 0.558 -2.489 1018 HD13 ILE 127 HD13 ILE 127 16.929 1.227 -4.036 1019 H21 OLA 128 H21 OLA 128 4.041 9.404 15.089 1020 H22 OLA 128 H22 OLA 128 5.013 8.208 14.265 1021 H31 OLA 128 H31 OLA 128 3.797 10.674 12.824 1022 H32 OLA 128 H32 OLA 128 2.913 9.168 13.035 1023 H41 OLA 128 H41 OLA 128 4.682 7.922 11.733 1024 H42 OLA 128 H42 OLA 128 5.593 9.419 11.550 1025 H51 OLA 128 H51 OLA 128 4.418 9.125 9.486 1026 H52 OLA 128 H52 OLA 128 3.605 10.440 10.310 1027 H61 OLA 128 H61 OLA 128 1.786 8.837 11.067 1028 H62 OLA 128 H62 OLA 128 2.637 7.497 10.300 1029 H71 OLA 128 H71 OLA 128 2.378 8.601 8.045 1030 H72 OLA 128 H72 OLA 128 1.571 9.982 8.799 1031 H81 OLA 128 H81 OLA 128 -0.259 8.423 9.660 1032 H82 OLA 128 H82 OLA 128 0.536 7.057 8.891 1033 H9 OLA 128 H9 OLA 128 -0.867 9.453 7.515 1034 H10 OLA 128 H10 OLA 128 -0.902 8.256 5.556 1035 H111 OLA 128 H111 OLA 128 0.095 5.750 6.889 1036 H112 OLA 128 H112 OLA 128 1.439 6.637 6.163 1037 H121 OLA 128 H121 OLA 128 0.254 6.623 3.939 1038 H122 OLA 128 H122 OLA 128 -1.127 5.789 4.647 1039 H131 OLA 128 H131 OLA 128 0.267 3.769 5.108 1040 H132 OLA 128 H132 OLA 128 1.728 4.605 4.564 1041 H141 OLA 128 H141 OLA 128 0.736 4.915 2.274 1042 H142 OLA 128 H142 OLA 128 -0.751 4.117 2.777 1043 H151 OLA 128 H151 OLA 128 0.543 1.973 3.194 1044 H152 OLA 128 H152 OLA 128 2.034 2.786 2.728 1045 H161 OLA 128 H161 OLA 128 0.965 3.315 0.448 1046 H162 OLA 128 H162 OLA 128 -0.438 2.366 0.899 1047 H171 OLA 128 H171 OLA 128 2.434 1.196 0.872 1048 H172 OLA 128 H172 OLA 128 1.422 1.240 -0.553 1049 H181 OLA 128 H181 OLA 128 1.288 -0.990 0.626 1050 H182 OLA 128 H182 OLA 128 0.574 -0.213 2.050 1051 H183 OLA 128 H183 OLA 128 -0.303 -0.220 0.497 1052 H21 OLA 129 H21 OLA 129 5.454 -0.743 -2.209 1053 H22 OLA 129 H22 OLA 129 4.284 -0.205 -3.400 1054 H31 OLA 129 H31 OLA 129 2.393 -0.484 -1.825 1055 H32 OLA 129 H32 OLA 129 3.483 -0.798 -0.480 1056 H41 OLA 129 H41 OLA 129 4.319 -2.877 -1.593 1057 H42 OLA 129 H42 OLA 129 3.253 -2.614 -2.968 1058 H51 OLA 129 H51 OLA 129 2.243 -2.974 -0.061 1059 H52 OLA 129 H52 OLA 129 2.481 -4.319 -1.159 1060 H61 OLA 129 H61 OLA 129 0.790 -3.447 -2.742 1061 H62 OLA 129 H62 OLA 129 0.611 -1.962 -1.812 1062 H71 OLA 129 H71 OLA 129 -0.282 -3.255 0.142 1063 H72 OLA 129 H72 OLA 129 -0.079 -4.774 -0.737 1064 H81 OLA 129 H81 OLA 129 -1.688 -4.028 -2.509 1065 H82 OLA 129 H82 OLA 129 -1.835 -2.441 -1.783 1066 H9 OLA 129 H9 OLA 129 -3.114 -5.050 -0.863 1067 H10 OLA 129 H10 OLA 129 -4.225 -3.910 0.822 1068 H111 OLA 129 H111 OLA 129 -4.100 -1.428 0.901 1069 H112 OLA 129 H112 OLA 129 -2.511 -1.393 0.156 1070 H121 OLA 129 H121 OLA 129 -1.468 -2.450 2.170 1071 H122 OLA 129 H122 OLA 129 -3.047 -2.718 2.906 1072 H131 OLA 129 H131 OLA 129 -3.420 -0.182 2.914 1073 H132 OLA 129 H132 OLA 129 -1.775 0.043 2.344 1074 H141 OLA 129 H141 OLA 129 -0.947 -1.240 4.419 1075 H142 OLA 129 H142 OLA 129 -2.609 -1.369 4.965 1076 H151 OLA 129 H151 OLA 129 -0.925 1.202 4.729 1077 H152 OLA 129 H152 OLA 129 -1.485 0.398 6.171 1078 H161 OLA 129 H161 OLA 129 -3.119 1.990 6.188 1079 H162 OLA 129 H162 OLA 129 -3.948 0.880 5.118 1080 H171 OLA 129 H171 OLA 129 -2.815 2.213 3.125 1081 H172 OLA 129 H172 OLA 129 -2.305 3.375 4.342 1082 H181 OLA 129 H181 OLA 129 -4.755 3.777 4.972 1083 H182 OLA 129 H182 OLA 129 -4.428 4.133 3.262 1084 H183 OLA 129 H183 OLA 129 -5.248 2.622 3.712 Start of MODEL 3 1 H1 SER 2 H1 SER 2 6.502 -11.241 -11.555 2 H2 SER 2 H2 SER 2 5.759 -10.239 -10.532 3 HA SER 2 HA SER 2 7.091 -11.983 -9.454 4 HB2 SER 2 HB2 SER 2 8.876 -11.997 -11.216 5 HB3 SER 2 HB3 SER 2 9.380 -10.377 -10.729 6 HG SER 2 HG SER 2 9.474 -12.777 -9.200 7 H PHE 3 H PHE 3 6.226 -11.194 -7.671 8 HA PHE 3 HA PHE 3 6.742 -8.376 -6.670 9 HB2 PHE 3 HB2 PHE 3 4.799 -10.601 -5.803 10 HB3 PHE 3 HB3 PHE 3 4.995 -9.153 -4.872 11 HD1 PHE 3 HD2 PHE 3 4.277 -6.929 -5.720 12 HD2 PHE 3 HD1 PHE 3 3.672 -10.488 -8.065 13 HE1 PHE 3 HE2 PHE 3 2.601 -5.752 -7.113 14 HE2 PHE 3 HE1 PHE 3 1.992 -9.306 -9.401 15 HZ PHE 3 HZ PHE 3 1.435 -6.943 -8.905 16 H SER 4 H SER 4 8.482 -11.182 -5.969 17 HA SER 4 HA SER 4 8.928 -10.672 -3.100 18 HB2 SER 4 HB2 SER 4 10.546 -12.353 -5.079 19 HB3 SER 4 HB3 SER 4 10.910 -12.239 -3.355 20 HG SER 4 HG SER 4 9.478 -13.986 -3.894 21 H GLY 5 H GLY 5 9.891 -8.919 -2.259 22 HA2 GLY 5 HA2 GLY 5 12.662 -8.158 -2.624 23 HA3 GLY 5 HA3 GLY 5 11.737 -7.146 -3.734 24 H LYS 6 H LYS 6 13.215 -5.961 -1.947 25 HA LYS 6 HA LYS 6 11.354 -4.816 0.242 26 HB2 LYS 6 HB2 LYS 6 14.396 -4.852 -0.059 27 HB3 LYS 6 HB3 LYS 6 13.574 -3.897 1.145 28 HG2 LYS 6 HG2 LYS 6 12.632 -5.944 2.257 29 HG3 LYS 6 HG3 LYS 6 13.354 -6.973 1.020 30 HD2 LYS 6 HD2 LYS 6 15.659 -6.105 1.647 31 HD3 LYS 6 HD3 LYS 6 14.971 -5.136 2.932 32 HE2 LYS 6 HE2 LYS 6 14.759 -8.238 2.749 33 HE3 LYS 6 HE3 LYS 6 16.032 -7.387 3.619 34 HZ1 LYS 6 HZ1 LYS 6 13.059 -7.388 4.291 35 HZ2 LYS 6 HZ2 LYS 6 14.078 -6.257 4.928 36 HZ3 LYS 6 HZ3 LYS 6 14.299 -7.862 5.255 37 H TYR 7 H TYR 7 10.245 -3.433 -1.178 38 HA TYR 7 HA TYR 7 11.735 -1.919 -3.314 39 HB2 TYR 7 HB2 TYR 7 8.714 -1.894 -2.656 40 HB3 TYR 7 HB3 TYR 7 9.448 -1.133 -4.028 41 HD1 TYR 7 HD2 TYR 7 8.861 -4.542 -2.484 42 HD2 TYR 7 HD1 TYR 7 9.611 -2.346 -6.109 43 HE1 TYR 7 HE2 TYR 7 8.521 -6.579 -3.794 44 HE2 TYR 7 HE1 TYR 7 9.212 -4.391 -7.413 45 HH TYR 7 HH TYR 7 8.880 -6.621 -7.326 46 H GLN 8 H GLN 8 12.801 -0.095 -2.681 47 HA GLN 8 HA GLN 8 11.782 1.574 -0.422 48 HB2 GLN 8 HB2 GLN 8 14.257 1.144 -0.870 49 HB3 GLN 8 HB3 GLN 8 14.152 2.299 -2.201 50 HG2 GLN 8 HG2 GLN 8 13.320 4.071 -0.534 51 HG3 GLN 8 HG3 GLN 8 13.452 2.887 0.763 52 HE21 GLN 8 HE21 GLN 8 14.647 4.922 1.418 53 HE22 GLN 8 HE22 GLN 8 16.459 4.862 1.066 54 H LEU 9 H LEU 9 10.810 3.458 -0.407 55 HA LEU 9 HA LEU 9 9.205 4.287 -2.721 56 HB2 LEU 9 HB2 LEU 9 8.381 4.313 -0.412 57 HB3 LEU 9 HB3 LEU 9 9.575 5.505 0.057 58 HG LEU 9 HG LEU 9 8.473 7.224 -1.440 59 HD11 LEU 9 HD11 LEU 9 6.146 6.742 -2.337 60 HD12 LEU 9 HD12 LEU 9 6.361 5.016 -1.934 61 HD13 LEU 9 HD13 LEU 9 7.378 5.783 -3.161 62 HD21 LEU 9 HD21 LEU 9 6.606 5.867 0.609 63 HD22 LEU 9 HD22 LEU 9 6.474 7.544 0.024 64 HD23 LEU 9 HD23 LEU 9 7.877 7.051 0.981 65 H GLN 10 H GLN 10 9.472 5.743 -4.204 66 HA GLN 10 HA GLN 10 11.777 7.761 -4.077 67 HB2 GLN 10 HB2 GLN 10 10.367 6.467 -6.482 68 HB3 GLN 10 HB3 GLN 10 11.608 7.690 -6.610 69 HG2 GLN 10 HG2 GLN 10 12.098 4.980 -5.193 70 HG3 GLN 10 HG3 GLN 10 12.231 5.222 -6.908 71 HE21 GLN 10 HE21 GLN 10 14.436 4.429 -6.337 72 HE22 GLN 10 HE22 GLN 10 15.689 5.679 -5.840 73 H SER 11 H SER 11 8.577 7.532 -5.633 74 HA SER 11 HA SER 11 8.088 10.498 -4.910 75 HB2 SER 11 HB2 SER 11 8.537 10.189 -7.348 76 HB3 SER 11 HB3 SER 11 7.206 9.046 -7.472 77 HG SER 11 HG SER 11 7.094 11.822 -6.874 78 H GLN 12 H GLN 12 6.204 11.046 -4.006 79 HA GLN 12 HA GLN 12 3.995 8.962 -3.604 80 HB2 GLN 12 HB2 GLN 12 5.640 9.220 -1.607 81 HB3 GLN 12 HB3 GLN 12 5.016 10.860 -1.402 82 HG2 GLN 12 HG2 GLN 12 2.794 10.049 -0.832 83 HG3 GLN 12 HG3 GLN 12 3.116 8.445 -1.441 84 HE21 GLN 12 HE21 GLN 12 4.987 10.442 0.945 85 HE22 GLN 12 HE22 GLN 12 4.733 9.211 2.277 86 H GLU 13 H GLU 13 2.319 9.772 -4.722 87 HA GLU 13 HA GLU 13 2.163 12.629 -5.462 88 HB2 GLU 13 HB2 GLU 13 1.849 10.575 -6.934 89 HB3 GLU 13 HB3 GLU 13 0.353 10.240 -6.085 90 HG2 GLU 13 HG2 GLU 13 -0.490 12.592 -6.972 91 HG3 GLU 13 HG3 GLU 13 0.974 12.625 -7.952 92 H ASN 14 H ASN 14 -1.000 11.393 -4.981 93 HA ASN 14 HA ASN 14 -1.705 13.698 -3.272 94 HB2 ASN 14 HB2 ASN 14 -3.388 11.378 -4.376 95 HB3 ASN 14 HB3 ASN 14 -4.065 12.626 -3.426 96 HD21 ASN 14 HD21 ASN 14 -3.217 11.832 -6.628 97 HD22 ASN 14 HD22 ASN 14 -3.594 13.516 -7.265 98 H PHE 15 H PHE 15 -0.049 12.641 -1.640 99 HA PHE 15 HA PHE 15 -1.313 11.040 0.522 100 HB2 PHE 15 HB2 PHE 15 1.184 11.289 0.005 101 HB3 PHE 15 HB3 PHE 15 1.162 12.865 0.732 102 HD1 PHE 15 HD1 PHE 15 0.738 13.067 3.246 103 HD2 PHE 15 HD2 PHE 15 1.186 9.240 1.359 104 HE1 PHE 15 HE1 PHE 15 1.327 12.044 5.404 105 HE2 PHE 15 HE2 PHE 15 1.792 8.245 3.514 106 HZ PHE 15 HZ PHE 15 1.844 9.642 5.552 107 H GLU 16 H GLU 16 -0.557 14.567 0.496 108 HA GLU 16 HA GLU 16 -2.013 15.356 2.866 109 HB2 GLU 16 HB2 GLU 16 -1.057 16.765 0.316 110 HB3 GLU 16 HB3 GLU 16 -2.199 17.630 1.282 111 HG2 GLU 16 HG2 GLU 16 0.351 16.506 2.619 112 HG3 GLU 16 HG3 GLU 16 0.339 18.042 1.751 113 H ALA 17 H ALA 17 -3.325 15.351 -0.456 114 HA ALA 17 HA ALA 17 -6.061 16.136 0.306 115 HB1 ALA 17 HB1 ALA 17 -5.071 14.643 -2.222 116 HB2 ALA 17 HB2 ALA 17 -6.615 15.505 -2.042 117 HB3 ALA 17 HB3 ALA 17 -5.100 16.412 -2.004 118 H PHE 18 H PHE 18 -4.603 12.896 0.054 119 HA PHE 18 HA PHE 18 -7.225 11.447 0.431 120 HB2 PHE 18 HB2 PHE 18 -5.280 10.540 -0.924 121 HB3 PHE 18 HB3 PHE 18 -4.325 10.398 0.518 122 HD1 PHE 18 HD2 PHE 18 -4.990 8.687 2.302 123 HD2 PHE 18 HD1 PHE 18 -6.957 8.827 -1.522 124 HE1 PHE 18 HE2 PHE 18 -5.699 6.351 2.572 125 HE2 PHE 18 HE1 PHE 18 -7.667 6.498 -1.233 126 HZ PHE 18 HZ PHE 18 -7.030 5.253 0.817 127 H MET 19 H MET 19 -4.346 11.939 2.569 128 HA MET 19 HA MET 19 -5.613 10.658 4.889 129 HB2 MET 19 HB2 MET 19 -3.209 12.547 4.702 130 HB3 MET 19 HB3 MET 19 -3.791 11.812 6.191 131 HG2 MET 19 HG2 MET 19 -1.905 10.506 5.309 132 HG3 MET 19 HG3 MET 19 -3.376 9.520 5.372 133 HE1 MET 19 HE1 MET 19 -2.574 7.823 2.162 134 HE2 MET 19 HE2 MET 19 -1.212 8.157 3.257 135 HE3 MET 19 HE3 MET 19 -2.826 7.744 3.927 136 H LYS 20 H LYS 20 -5.602 14.136 3.952 137 HA LYS 20 HA LYS 20 -7.313 14.920 6.281 138 HB2 LYS 20 HB2 LYS 20 -6.600 16.352 3.659 139 HB3 LYS 20 HB3 LYS 20 -7.906 16.937 4.666 140 HG2 LYS 20 HG2 LYS 20 -6.371 17.068 6.671 141 HG3 LYS 20 HG3 LYS 20 -5.008 16.596 5.677 142 HD2 LYS 20 HD2 LYS 20 -6.764 19.003 4.855 143 HD3 LYS 20 HD3 LYS 20 -5.668 19.209 6.180 144 HE2 LYS 20 HE2 LYS 20 -4.633 18.139 3.452 145 HE3 LYS 20 HE3 LYS 20 -4.890 19.863 3.726 146 HZ1 LYS 20 HZ1 LYS 20 -2.546 19.225 4.338 147 HZ2 LYS 20 HZ2 LYS 20 -3.059 18.152 5.406 148 HZ3 LYS 20 HZ3 LYS 20 -3.361 19.751 5.737 149 H ALA 21 H ALA 21 -8.189 13.847 2.895 150 HA ALA 21 HA ALA 21 -11.084 14.141 3.291 151 HB1 ALA 21 HB1 ALA 21 -11.242 12.629 1.294 152 HB2 ALA 21 HB2 ALA 21 -10.029 13.898 1.041 153 HB3 ALA 21 HB3 ALA 21 -9.511 12.239 1.428 154 H ILE 22 H ILE 22 -8.941 11.367 4.098 155 HA ILE 22 HA ILE 22 -11.321 9.791 5.142 156 HB ILE 22 HB ILE 22 -9.846 7.968 5.676 157 HG12 ILE 22 HG12 ILE 22 -7.448 9.433 4.459 158 HG13 ILE 22 HG13 ILE 22 -7.727 9.410 6.187 159 HG21 ILE 22 HG21 ILE 22 -9.298 7.247 3.371 160 HG22 ILE 22 HG22 ILE 22 -10.817 8.163 3.356 161 HG23 ILE 22 HG23 ILE 22 -9.310 8.928 2.800 162 HD11 ILE 22 HD11 ILE 22 -7.293 6.886 4.447 163 HD12 ILE 22 HD12 ILE 22 -6.111 7.639 5.537 164 HD13 ILE 22 HD13 ILE 22 -7.584 6.888 6.207 165 H GLY 23 H GLY 23 -9.617 12.254 6.530 166 HA2 GLY 23 HA2 GLY 23 -10.110 13.119 8.760 167 HA3 GLY 23 HA3 GLY 23 -10.724 11.567 9.258 168 H LEU 24 H LEU 24 -7.424 12.416 8.066 169 HA LEU 24 HA LEU 24 -6.341 11.637 10.808 170 HB2 LEU 24 HB2 LEU 24 -5.366 11.197 7.974 171 HB3 LEU 24 HB3 LEU 24 -4.140 11.687 9.084 172 HG LEU 24 HG LEU 24 -5.059 9.803 10.721 173 HD11 LEU 24 HD11 LEU 24 -7.171 9.285 9.439 174 HD12 LEU 24 HD12 LEU 24 -6.128 7.868 9.578 175 HD13 LEU 24 HD13 LEU 24 -6.207 8.766 8.041 176 HD21 LEU 24 HD21 LEU 24 -2.842 9.750 9.630 177 HD22 LEU 24 HD22 LEU 24 -3.557 9.074 8.141 178 HD23 LEU 24 HD23 LEU 24 -3.580 8.137 9.664 179 HA PRO 25 HA PRO 25 -4.849 15.676 11.811 180 HB2 PRO 25 HB2 PRO 25 -2.580 15.149 13.403 181 HB3 PRO 25 HB3 PRO 25 -4.238 14.947 13.880 182 HG2 PRO 25 HG2 PRO 25 -2.258 12.873 12.916 183 HG3 PRO 25 HG3 PRO 25 -3.475 12.664 14.190 184 HD2 PRO 25 HD2 PRO 25 -3.625 11.747 11.509 185 HD3 PRO 25 HD3 PRO 25 -5.054 11.936 12.545 186 H GLU 26 H GLU 26 -3.699 17.320 10.982 187 HA GLU 26 HA GLU 26 -1.869 17.061 8.791 188 HB2 GLU 26 HB2 GLU 26 -2.515 19.427 10.594 189 HB3 GLU 26 HB3 GLU 26 -1.537 19.509 9.168 190 HG2 GLU 26 HG2 GLU 26 -3.628 18.402 7.896 191 HG3 GLU 26 HG3 GLU 26 -4.544 18.890 9.308 192 H GLU 27 H GLU 27 -1.046 17.435 12.184 193 HA GLU 27 HA GLU 27 1.865 17.787 11.929 194 HB2 GLU 27 HB2 GLU 27 0.642 18.302 13.957 195 HB3 GLU 27 HB3 GLU 27 0.045 16.670 14.156 196 HG2 GLU 27 HG2 GLU 27 3.084 17.213 14.281 197 HG3 GLU 27 HG3 GLU 27 2.041 17.584 15.644 198 H LEU 28 H LEU 28 0.032 14.687 12.374 199 HA LEU 28 HA LEU 28 2.447 13.025 11.842 200 HB2 LEU 28 HB2 LEU 28 -0.442 12.059 11.607 201 HB3 LEU 28 HB3 LEU 28 0.998 11.081 11.774 202 HG LEU 28 HG LEU 28 -0.212 12.897 13.941 203 HD11 LEU 28 HD11 LEU 28 0.010 9.809 13.796 204 HD12 LEU 28 HD12 LEU 28 -1.474 10.728 13.470 205 HD13 LEU 28 HD13 LEU 28 -0.760 10.752 15.094 206 HD21 LEU 28 HD21 LEU 28 2.170 11.004 14.397 207 HD22 LEU 28 HD22 LEU 28 1.411 12.120 15.545 208 HD23 LEU 28 HD23 LEU 28 2.324 12.767 14.186 209 H ILE 29 H ILE 29 -0.060 14.302 9.722 210 HA ILE 29 HA ILE 29 0.687 12.782 7.293 211 HB ILE 29 HB ILE 29 -0.779 15.469 7.462 212 HG12 ILE 29 HG12 ILE 29 -1.987 12.672 7.017 213 HG13 ILE 29 HG13 ILE 29 -1.932 13.412 8.573 214 HG21 ILE 29 HG21 ILE 29 -0.734 13.514 5.055 215 HG22 ILE 29 HG22 ILE 29 -1.566 15.074 5.144 216 HG23 ILE 29 HG23 ILE 29 0.187 15.042 5.125 217 HD11 ILE 29 HD11 ILE 29 -3.347 15.367 7.817 218 HD12 ILE 29 HD12 ILE 29 -3.501 14.623 6.205 219 HD13 ILE 29 HD13 ILE 29 -4.175 13.813 7.626 220 H GLN 30 H GLN 30 1.568 16.075 8.428 221 HA GLN 30 HA GLN 30 3.610 16.623 6.379 222 HB2 GLN 30 HB2 GLN 30 2.935 17.767 9.126 223 HB3 GLN 30 HB3 GLN 30 4.511 18.113 8.517 224 HG2 GLN 30 HG2 GLN 30 2.664 19.856 8.020 225 HG3 GLN 30 HG3 GLN 30 3.828 19.468 6.783 226 HE21 GLN 30 HE21 GLN 30 0.554 18.350 7.707 227 HE22 GLN 30 HE22 GLN 30 0.034 18.257 5.934 228 H LYS 31 H LYS 31 3.835 14.510 9.121 229 HA LYS 31 HA LYS 31 6.864 14.277 8.981 230 HB2 LYS 31 HB2 LYS 31 4.667 12.824 10.574 231 HB3 LYS 31 HB3 LYS 31 6.311 12.235 10.547 232 HG2 LYS 31 HG2 LYS 31 7.206 14.302 11.550 233 HG3 LYS 31 HG3 LYS 31 5.634 15.111 11.437 234 HD2 LYS 31 HD2 LYS 31 4.578 13.542 12.986 235 HD3 LYS 31 HD3 LYS 31 5.985 12.475 12.996 236 HE2 LYS 31 HE2 LYS 31 7.383 14.174 14.168 237 HE3 LYS 31 HE3 LYS 31 6.077 15.387 14.056 238 HZ1 LYS 31 HZ1 LYS 31 4.631 14.065 15.395 239 HZ2 LYS 31 HZ2 LYS 31 6.060 14.014 16.247 240 HZ3 LYS 31 HZ3 LYS 31 5.631 12.676 15.338 241 H GLY 32 H GLY 32 4.105 12.038 8.242 242 HA2 GLY 32 HA2 GLY 32 5.886 10.107 6.815 243 HA3 GLY 32 HA3 GLY 32 4.150 10.013 6.878 244 H LYS 33 H LYS 33 4.424 12.972 5.511 245 HA LYS 33 HA LYS 33 3.944 11.998 2.819 246 HB2 LYS 33 HB2 LYS 33 3.763 14.291 2.114 247 HB3 LYS 33 HB3 LYS 33 2.937 14.045 3.634 248 HG2 LYS 33 HG2 LYS 33 4.747 15.154 4.911 249 HG3 LYS 33 HG3 LYS 33 5.741 15.333 3.492 250 HD2 LYS 33 HD2 LYS 33 2.955 16.597 3.710 251 HD3 LYS 33 HD3 LYS 33 4.388 17.398 4.297 252 HE2 LYS 33 HE2 LYS 33 4.119 16.461 1.350 253 HE3 LYS 33 HE3 LYS 33 3.580 18.038 1.908 254 HZ1 LYS 33 HZ1 LYS 33 6.027 17.903 1.017 255 HZ2 LYS 33 HZ2 LYS 33 6.464 17.128 2.364 256 HZ3 LYS 33 HZ3 LYS 33 5.875 18.642 2.494 257 H ASP 34 H ASP 34 7.001 13.434 3.978 258 HA ASP 34 HA ASP 34 8.254 12.970 1.224 259 HB2 ASP 34 HB2 ASP 34 9.298 14.630 3.598 260 HB3 ASP 34 HB3 ASP 34 9.997 14.564 1.993 261 H ILE 35 H ILE 35 8.252 11.130 4.013 262 HA ILE 35 HA ILE 35 11.154 10.456 4.182 263 HB ILE 35 HB ILE 35 8.721 9.083 5.434 264 HG12 ILE 35 HG12 ILE 35 10.868 10.828 6.819 265 HG13 ILE 35 HG13 ILE 35 9.359 11.484 6.230 266 HG21 ILE 35 HG21 ILE 35 11.705 8.517 6.068 267 HG22 ILE 35 HG22 ILE 35 10.314 7.847 6.952 268 HG23 ILE 35 HG23 ILE 35 10.581 7.387 5.278 269 HD11 ILE 35 HD11 ILE 35 9.542 9.345 8.453 270 HD12 ILE 35 HD12 ILE 35 9.133 11.065 8.630 271 HD13 ILE 35 HD13 ILE 35 8.030 9.989 7.764 272 H LYS 36 H LYS 36 12.158 9.405 2.581 273 HA LYS 36 HA LYS 36 10.854 7.415 0.777 274 HB2 LYS 36 HB2 LYS 36 13.817 8.200 1.090 275 HB3 LYS 36 HB3 LYS 36 13.215 7.026 -0.055 276 HG2 LYS 36 HG2 LYS 36 11.640 8.888 -1.001 277 HG3 LYS 36 HG3 LYS 36 12.593 10.039 -0.064 278 HD2 LYS 36 HD2 LYS 36 14.716 9.168 -1.244 279 HD3 LYS 36 HD3 LYS 36 13.718 8.009 -2.124 280 HE2 LYS 36 HE2 LYS 36 12.378 10.051 -3.079 281 HE3 LYS 36 HE3 LYS 36 13.604 11.098 -2.373 282 HZ1 LYS 36 HZ1 LYS 36 14.184 8.854 -4.354 283 HZ2 LYS 36 HZ2 LYS 36 15.327 9.834 -3.706 284 HZ3 LYS 36 HZ3 LYS 36 14.194 10.457 -4.727 285 H GLY 37 H GLY 37 10.080 6.150 2.675 286 HA2 GLY 37 HA2 GLY 37 11.954 4.233 4.001 287 HA3 GLY 37 HA3 GLY 37 10.210 4.239 4.151 288 H VAL 38 H VAL 38 11.279 1.934 4.190 289 HA VAL 38 HA VAL 38 11.346 0.610 1.459 290 HB VAL 38 HB VAL 38 11.878 -0.538 4.246 291 HG11 VAL 38 HG11 VAL 38 12.238 -1.931 1.509 292 HG12 VAL 38 HG12 VAL 38 12.826 -2.561 3.072 293 HG13 VAL 38 HG13 VAL 38 11.092 -2.406 2.783 294 HG21 VAL 38 HG21 VAL 38 14.286 -0.659 3.494 295 HG22 VAL 38 HG22 VAL 38 13.860 0.089 1.935 296 HG23 VAL 38 HG23 VAL 38 13.723 1.016 3.443 297 H SER 39 H SER 39 9.757 -0.544 0.591 298 HA SER 39 HA SER 39 7.333 -1.434 2.263 299 HB2 SER 39 HB2 SER 39 7.487 -0.473 -0.633 300 HB3 SER 39 HB3 SER 39 6.089 -1.299 0.031 301 HG SER 39 HG SER 39 5.791 0.927 0.168 302 H GLU 40 H GLU 40 8.000 -3.400 2.684 303 HA GLU 40 HA GLU 40 9.328 -5.228 0.699 304 HB2 GLU 40 HB2 GLU 40 9.822 -5.049 3.250 305 HB3 GLU 40 HB3 GLU 40 8.298 -5.832 3.510 306 HG2 GLU 40 HG2 GLU 40 9.053 -7.932 2.414 307 HG3 GLU 40 HG3 GLU 40 10.577 -7.187 1.942 308 H ILE 41 H ILE 41 8.524 -7.039 -0.229 309 HA ILE 41 HA ILE 41 5.839 -8.123 0.627 310 HB ILE 41 HB ILE 41 6.398 -7.725 -2.369 311 HG12 ILE 41 HG12 ILE 41 4.259 -6.155 -0.819 312 HG13 ILE 41 HG13 ILE 41 5.824 -5.504 -1.263 313 HG21 ILE 41 HG21 ILE 41 4.959 -9.754 -1.852 314 HG22 ILE 41 HG22 ILE 41 3.824 -8.727 -0.942 315 HG23 ILE 41 HG23 ILE 41 4.027 -8.534 -2.700 316 HD11 ILE 41 HD11 ILE 41 3.710 -6.421 -3.307 317 HD12 ILE 41 HD12 ILE 41 4.264 -4.777 -2.976 318 HD13 ILE 41 HD13 ILE 41 5.378 -5.936 -3.722 319 H VAL 42 H VAL 42 6.176 -10.274 0.953 320 HA VAL 42 HA VAL 42 8.251 -11.818 -0.708 321 HB VAL 42 HB VAL 42 6.930 -12.916 1.816 322 HG11 VAL 42 HG11 VAL 42 9.650 -13.577 0.508 323 HG12 VAL 42 HG12 VAL 42 8.925 -14.394 1.911 324 HG13 VAL 42 HG13 VAL 42 8.172 -14.542 0.312 325 HG21 VAL 42 HG21 VAL 42 8.028 -10.842 2.633 326 HG22 VAL 42 HG22 VAL 42 8.908 -12.269 3.189 327 HG23 VAL 42 HG23 VAL 42 9.552 -11.297 1.838 328 H GLN 43 H GLN 43 7.273 -12.676 -2.497 329 HA GLN 43 HA GLN 43 4.367 -13.390 -2.551 330 HB2 GLN 43 HB2 GLN 43 5.550 -12.250 -4.419 331 HB3 GLN 43 HB3 GLN 43 6.558 -13.661 -4.693 332 HG2 GLN 43 HG2 GLN 43 4.529 -15.028 -5.299 333 HG3 GLN 43 HG3 GLN 43 3.479 -13.676 -4.901 334 HE21 GLN 43 HE21 GLN 43 2.779 -14.291 -7.116 335 HE22 GLN 43 HE22 GLN 43 3.608 -13.443 -8.532 336 H ASN 44 H ASN 44 3.841 -15.191 -1.378 337 HA ASN 44 HA ASN 44 5.288 -17.857 -1.973 338 HB2 ASN 44 HB2 ASN 44 3.574 -17.122 0.486 339 HB3 ASN 44 HB3 ASN 44 4.388 -18.631 0.198 340 HD21 ASN 44 HD21 ASN 44 5.022 -15.235 0.873 341 HD22 ASN 44 HD22 ASN 44 6.660 -15.604 1.605 342 H GLY 45 H GLY 45 3.868 -17.502 -4.000 343 HA2 GLY 45 HA2 GLY 45 2.117 -18.479 -5.370 344 HA3 GLY 45 HA3 GLY 45 1.641 -19.487 -4.018 345 H LYS 46 H LYS 46 0.014 -18.729 -2.660 346 HA LYS 46 HA LYS 46 -1.748 -16.433 -3.639 347 HB2 LYS 46 HB2 LYS 46 -2.262 -18.654 -1.562 348 HB3 LYS 46 HB3 LYS 46 -3.362 -17.332 -1.872 349 HG2 LYS 46 HG2 LYS 46 -3.711 -18.069 -4.253 350 HG3 LYS 46 HG3 LYS 46 -2.518 -19.329 -4.043 351 HD2 LYS 46 HD2 LYS 46 -4.236 -20.698 -3.580 352 HD3 LYS 46 HD3 LYS 46 -4.162 -20.091 -1.959 353 HE2 LYS 46 HE2 LYS 46 -6.077 -19.123 -4.217 354 HE3 LYS 46 HE3 LYS 46 -6.494 -20.247 -2.931 355 HZ1 LYS 46 HZ1 LYS 46 -7.249 -18.124 -2.119 356 HZ2 LYS 46 HZ2 LYS 46 -5.933 -17.316 -2.677 357 HZ3 LYS 46 HZ3 LYS 46 -5.812 -18.286 -1.336 358 H HIS 47 H HIS 47 0.370 -17.239 -0.879 359 HA HIS 47 HA HIS 47 -0.758 -14.959 0.801 360 HB2 HIS 47 HB2 HIS 47 1.250 -17.197 1.467 361 HB3 HIS 47 HB3 HIS 47 0.955 -15.844 2.530 362 HD1 HIS 47 HD1 HIS 47 -0.728 -19.106 1.404 363 HD2 HIS 47 HD2 HIS 47 -1.465 -15.604 3.752 364 HE1 HIS 47 HE1 HIS 47 -2.879 -19.404 2.809 365 H PHE 48 H PHE 48 -0.029 -13.044 0.320 366 HA PHE 48 HA PHE 48 2.891 -12.539 -0.483 367 HB2 PHE 48 HB2 PHE 48 0.279 -10.973 -0.794 368 HB3 PHE 48 HB3 PHE 48 1.820 -10.211 -0.976 369 HD1 PHE 48 HD1 PHE 48 0.362 -13.511 -2.360 370 HD2 PHE 48 HD2 PHE 48 2.176 -9.703 -3.194 371 HE1 PHE 48 HE1 PHE 48 0.264 -13.979 -4.761 372 HE2 PHE 48 HE2 PHE 48 2.041 -10.183 -5.589 373 HZ PHE 48 HZ PHE 48 1.112 -12.299 -6.387 374 H LYS 49 H LYS 49 4.048 -12.347 1.364 375 HA LYS 49 HA LYS 49 2.893 -11.074 3.869 376 HB2 LYS 49 HB2 LYS 49 5.658 -12.312 3.437 377 HB3 LYS 49 HB3 LYS 49 5.069 -11.688 4.960 378 HG2 LYS 49 HG2 LYS 49 3.277 -13.357 5.086 379 HG3 LYS 49 HG3 LYS 49 3.591 -13.919 3.460 380 HD2 LYS 49 HD2 LYS 49 6.053 -14.463 4.369 381 HD3 LYS 49 HD3 LYS 49 5.370 -14.265 5.970 382 HE2 LYS 49 HE2 LYS 49 4.433 -16.276 3.796 383 HE3 LYS 49 HE3 LYS 49 5.502 -16.661 5.139 384 HZ1 LYS 49 HZ1 LYS 49 3.214 -17.278 5.847 385 HZ2 LYS 49 HZ2 LYS 49 2.560 -15.841 5.388 386 HZ3 LYS 49 HZ3 LYS 49 3.503 -15.868 6.659 387 H PHE 50 H PHE 50 2.970 -8.986 4.141 388 HA PHE 50 HA PHE 50 5.216 -7.410 2.808 389 HB2 PHE 50 HB2 PHE 50 3.911 -5.525 2.452 390 HB3 PHE 50 HB3 PHE 50 3.141 -6.912 1.776 391 HD1 PHE 50 HD2 PHE 50 2.707 -5.468 5.367 392 HD2 PHE 50 HD1 PHE 50 1.055 -5.960 1.431 393 HE1 PHE 50 HE2 PHE 50 0.662 -4.385 6.089 394 HE2 PHE 50 HE1 PHE 50 -1.004 -4.886 2.170 395 HZ PHE 50 HZ PHE 50 -1.217 -4.081 4.510 396 H THR 51 H THR 51 6.343 -5.866 3.690 397 HA THR 51 HA THR 51 5.824 -5.102 6.641 398 HB THR 51 HB THR 51 8.667 -5.338 5.524 399 HG1 THR 51 HG1 THR 51 8.618 -7.368 5.841 400 HG21 THR 51 HG21 THR 51 8.471 -3.879 7.495 401 HG22 THR 51 HG22 THR 51 9.346 -5.380 7.879 402 HG23 THR 51 HG23 THR 51 7.666 -5.184 8.411 403 H ILE 52 H ILE 52 4.748 -3.214 6.127 404 HA ILE 52 HA ILE 52 5.947 -1.351 4.028 405 HB ILE 52 HB ILE 52 3.128 -1.398 5.176 406 HG12 ILE 52 HG12 ILE 52 3.393 -3.380 3.843 407 HG13 ILE 52 HG13 ILE 52 2.352 -2.276 2.988 408 HG21 ILE 52 HG21 ILE 52 2.477 0.137 3.308 409 HG22 ILE 52 HG22 ILE 52 3.638 0.908 4.386 410 HG23 ILE 52 HG23 ILE 52 4.178 0.283 2.807 411 HD11 ILE 52 HD11 ILE 52 5.325 -2.885 2.328 412 HD12 ILE 52 HD12 ILE 52 3.913 -3.412 1.410 413 HD13 ILE 52 HD13 ILE 52 4.335 -1.686 1.451 414 H THR 53 H THR 53 6.699 0.552 4.450 415 HA THR 53 HA THR 53 6.751 1.647 7.280 416 HB THR 53 HB THR 53 8.386 3.346 6.341 417 HG1 THR 53 HG1 THR 53 8.623 1.513 4.195 418 HG21 THR 53 HG21 THR 53 10.322 1.783 6.270 419 HG22 THR 53 HG22 THR 53 9.228 0.383 6.124 420 HG23 THR 53 HG23 THR 53 9.227 1.372 7.604 421 H ALA 54 H ALA 54 5.075 2.745 7.793 422 HA ALA 54 HA ALA 54 3.799 4.881 5.967 423 HB1 ALA 54 HB1 ALA 54 2.890 3.556 8.623 424 HB2 ALA 54 HB2 ALA 54 1.994 4.819 7.769 425 HB3 ALA 54 HB3 ALA 54 2.236 3.238 6.993 426 H GLY 55 H GLY 55 6.026 5.801 6.271 427 HA2 GLY 55 HA2 GLY 55 7.190 7.801 6.957 428 HA3 GLY 55 HA3 GLY 55 5.946 8.178 8.134 429 H SER 56 H SER 56 6.124 7.318 10.183 430 HA SER 56 HA SER 56 8.818 6.172 11.056 431 HB2 SER 56 HB2 SER 56 6.538 7.195 12.848 432 HB3 SER 56 HB3 SER 56 8.153 6.737 13.362 433 HG SER 56 HG SER 56 7.614 9.096 12.960 434 H LYS 57 H LYS 57 5.401 5.144 10.916 435 HA LYS 57 HA LYS 57 5.876 2.830 12.792 436 HB2 LYS 57 HB2 LYS 57 3.699 4.167 12.780 437 HB3 LYS 57 HB3 LYS 57 3.329 3.494 11.199 438 HG2 LYS 57 HG2 LYS 57 3.519 1.121 12.297 439 HG3 LYS 57 HG3 LYS 57 3.699 1.929 13.851 440 HD2 LYS 57 HD2 LYS 57 1.395 3.000 13.510 441 HD3 LYS 57 HD3 LYS 57 1.270 2.187 11.947 442 HE2 LYS 57 HE2 LYS 57 1.567 -0.092 13.168 443 HE3 LYS 57 HE3 LYS 57 1.531 0.775 14.706 444 HZ1 LYS 57 HZ1 LYS 57 -0.711 0.573 12.655 445 HZ2 LYS 57 HZ2 LYS 57 -0.795 1.655 13.916 446 HZ3 LYS 57 HZ3 LYS 57 -0.760 0.003 14.107 447 H VAL 58 H VAL 58 6.396 0.849 12.214 448 HA VAL 58 HA VAL 58 6.445 -0.050 9.312 449 HB VAL 58 HB VAL 58 7.511 -1.463 11.822 450 HG11 VAL 58 HG11 VAL 58 7.933 -2.127 8.830 451 HG12 VAL 58 HG12 VAL 58 8.752 -2.940 10.189 452 HG13 VAL 58 HG13 VAL 58 7.002 -3.107 9.984 453 HG21 VAL 58 HG21 VAL 58 8.869 0.615 11.303 454 HG22 VAL 58 HG22 VAL 58 9.802 -0.853 10.979 455 HG23 VAL 58 HG23 VAL 58 9.091 0.065 9.630 456 H ILE 59 H ILE 59 4.541 -0.750 8.584 457 HA ILE 59 HA ILE 59 2.548 -2.217 10.415 458 HB ILE 59 HB ILE 59 2.056 -0.836 7.721 459 HG12 ILE 59 HG12 ILE 59 1.102 0.024 10.533 460 HG13 ILE 59 HG13 ILE 59 2.465 0.750 9.697 461 HG21 ILE 59 HG21 ILE 59 0.006 -2.152 9.647 462 HG22 ILE 59 HG22 ILE 59 -0.392 -1.280 8.152 463 HG23 ILE 59 HG23 ILE 59 0.493 -2.799 8.057 464 HD11 ILE 59 HD11 ILE 59 -0.477 0.922 8.825 465 HD12 ILE 59 HD12 ILE 59 0.606 2.229 9.339 466 HD13 ILE 59 HD13 ILE 59 0.872 1.426 7.771 467 H GLN 60 H GLN 60 3.246 -4.299 10.369 468 HA GLN 60 HA GLN 60 3.696 -5.635 7.679 469 HB2 GLN 60 HB2 GLN 60 5.086 -7.237 8.658 470 HB3 GLN 60 HB3 GLN 60 5.647 -5.635 9.040 471 HG2 GLN 60 HG2 GLN 60 4.152 -7.458 11.022 472 HG3 GLN 60 HG3 GLN 60 5.894 -7.376 10.874 473 HE21 GLN 60 HE21 GLN 60 6.974 -5.482 11.705 474 HE22 GLN 60 HE22 GLN 60 6.039 -4.276 12.742 475 H ASN 61 H ASN 61 2.416 -7.027 6.964 476 HA ASN 61 HA ASN 61 0.536 -8.750 8.456 477 HB2 ASN 61 HB2 ASN 61 -0.745 -6.476 6.777 478 HB3 ASN 61 HB3 ASN 61 -1.589 -7.916 7.277 479 HD21 ASN 61 HD21 ASN 61 -0.247 -4.963 8.517 480 HD22 ASN 61 HD22 ASN 61 -1.189 -5.067 10.081 481 H GLU 62 H GLU 62 -0.727 -10.172 6.848 482 HA GLU 62 HA GLU 62 0.696 -10.317 4.158 483 HB2 GLU 62 HB2 GLU 62 1.051 -12.575 4.172 484 HB3 GLU 62 HB3 GLU 62 1.688 -11.941 5.680 485 HG2 GLU 62 HG2 GLU 62 -0.274 -12.968 6.935 486 HG3 GLU 62 HG3 GLU 62 -0.921 -13.591 5.414 487 H PHE 63 H PHE 63 -0.442 -10.517 2.431 488 HA PHE 63 HA PHE 63 -3.452 -10.844 2.726 489 HB2 PHE 63 HB2 PHE 63 -3.927 -9.649 0.753 490 HB3 PHE 63 HB3 PHE 63 -3.105 -8.727 1.941 491 HD1 PHE 63 HD1 PHE 63 -0.751 -7.858 1.436 492 HD2 PHE 63 HD2 PHE 63 -2.895 -10.219 -1.446 493 HE1 PHE 63 HE1 PHE 63 0.783 -7.098 -0.367 494 HE2 PHE 63 HE2 PHE 63 -1.388 -9.414 -3.219 495 HZ PHE 63 HZ PHE 63 0.449 -7.843 -2.662 496 H THR 64 H THR 64 -4.512 -12.349 1.857 497 HA THR 64 HA THR 64 -3.119 -14.501 0.240 498 HB THR 64 HB THR 64 -5.895 -14.624 1.550 499 HG1 THR 64 HG1 THR 64 -3.880 -15.999 2.756 500 HG21 THR 64 HG21 THR 64 -5.466 -16.442 -0.127 501 HG22 THR 64 HG22 THR 64 -5.485 -17.102 1.525 502 HG23 THR 64 HG23 THR 64 -3.929 -16.863 0.681 503 H VAL 65 H VAL 65 -3.253 -14.232 -1.913 504 HA VAL 65 HA VAL 65 -5.348 -12.655 -3.282 505 HB VAL 65 HB VAL 65 -3.218 -14.523 -4.387 506 HG11 VAL 65 HG11 VAL 65 -5.003 -14.291 -6.154 507 HG12 VAL 65 HG12 VAL 65 -4.814 -12.522 -6.106 508 HG13 VAL 65 HG13 VAL 65 -3.470 -13.553 -6.633 509 HG21 VAL 65 HG21 VAL 65 -3.312 -11.416 -4.296 510 HG22 VAL 65 HG22 VAL 65 -2.268 -12.441 -3.285 511 HG23 VAL 65 HG23 VAL 65 -2.010 -12.371 -5.035 512 H GLY 66 H GLY 66 -7.365 -13.299 -3.611 513 HA2 GLY 66 HA2 GLY 66 -9.141 -14.766 -4.504 514 HA3 GLY 66 HA3 GLY 66 -8.087 -16.153 -4.463 515 H GLU 67 H GLU 67 -7.867 -14.863 -1.383 516 HA GLU 67 HA GLU 67 -10.433 -15.914 -0.326 517 HB2 GLU 67 HB2 GLU 67 -7.754 -17.282 0.452 518 HB3 GLU 67 HB3 GLU 67 -9.111 -17.297 1.544 519 HG2 GLU 67 HG2 GLU 67 -9.341 -18.471 -1.300 520 HG3 GLU 67 HG3 GLU 67 -8.905 -19.403 0.131 521 H GLU 68 H GLU 68 -10.839 -15.300 1.884 522 HA GLU 68 HA GLU 68 -10.348 -12.552 2.276 523 HB2 GLU 68 HB2 GLU 68 -11.429 -12.641 4.403 524 HB3 GLU 68 HB3 GLU 68 -12.298 -13.553 3.206 525 HG2 GLU 68 HG2 GLU 68 -12.039 -15.597 4.318 526 HG3 GLU 68 HG3 GLU 68 -10.403 -15.245 4.834 527 H CYS 69 H CYS 69 -8.959 -11.245 3.170 528 HA CYS 69 HA CYS 69 -6.957 -12.209 5.254 529 HB2 CYS 69 HB2 CYS 69 -5.112 -10.933 3.990 530 HB3 CYS 69 HB3 CYS 69 -5.638 -12.514 3.405 531 HG CYS 69 HG CYS 69 -6.942 -11.743 1.359 532 H GLU 70 H GLU 70 -6.665 -10.939 6.789 533 HA GLU 70 HA GLU 70 -8.034 -8.256 6.966 534 HB2 GLU 70 HB2 GLU 70 -7.765 -8.347 9.369 535 HB3 GLU 70 HB3 GLU 70 -8.740 -9.613 8.686 536 HG2 GLU 70 HG2 GLU 70 -6.916 -11.302 8.968 537 HG3 GLU 70 HG3 GLU 70 -5.822 -10.021 9.466 538 H LEU 71 H LEU 71 -6.993 -6.500 6.464 539 HA LEU 71 HA LEU 71 -4.023 -6.145 7.233 540 HB2 LEU 71 HB2 LEU 71 -5.533 -4.818 4.905 541 HB3 LEU 71 HB3 LEU 71 -3.841 -4.600 5.297 542 HG LEU 71 HG LEU 71 -5.145 -7.180 4.233 543 HD11 LEU 71 HD11 LEU 71 -4.865 -5.284 2.584 544 HD12 LEU 71 HD12 LEU 71 -3.833 -6.654 2.164 545 HD13 LEU 71 HD13 LEU 71 -3.134 -5.215 2.939 546 HD21 LEU 71 HD21 LEU 71 -2.796 -8.101 4.032 547 HD22 LEU 71 HD22 LEU 71 -3.252 -7.844 5.710 548 HD23 LEU 71 HD23 LEU 71 -2.158 -6.691 4.899 549 H GLU 72 H GLU 72 -3.422 -4.318 8.328 550 HA GLU 72 HA GLU 72 -5.468 -2.651 9.708 551 HB2 GLU 72 HB2 GLU 72 -3.150 -3.320 10.610 552 HB3 GLU 72 HB3 GLU 72 -2.421 -2.213 9.453 553 HG2 GLU 72 HG2 GLU 72 -3.820 -0.299 10.603 554 HG3 GLU 72 HG3 GLU 72 -4.289 -1.480 11.820 555 H THR 73 H THR 73 -6.091 -0.687 9.413 556 HA THR 73 HA THR 73 -5.491 0.805 6.805 557 HB THR 73 HB THR 73 -7.695 -0.021 6.656 558 HG1 THR 73 HG1 THR 73 -8.627 2.362 7.503 559 HG21 THR 73 HG21 THR 73 -9.579 0.514 8.286 560 HG22 THR 73 HG22 THR 73 -8.362 1.180 9.410 561 HG23 THR 73 HG23 THR 73 -8.365 -0.556 8.993 562 H MET 74 H MET 74 -5.941 3.051 6.932 563 HA MET 74 HA MET 74 -4.465 4.419 9.239 564 HB2 MET 74 HB2 MET 74 -5.455 5.510 6.538 565 HB3 MET 74 HB3 MET 74 -4.949 6.577 7.830 566 HG2 MET 74 HG2 MET 74 -3.115 4.462 6.550 567 HG3 MET 74 HG3 MET 74 -3.100 6.198 6.229 568 HE1 MET 74 HE1 MET 74 -0.993 3.807 7.717 569 HE2 MET 74 HE2 MET 74 -0.803 4.134 9.468 570 HE3 MET 74 HE3 MET 74 -2.298 3.361 8.856 571 H THR 75 H THR 75 -7.645 4.938 7.637 572 HA THR 75 HA THR 75 -8.808 5.755 10.355 573 HB THR 75 HB THR 75 -10.146 5.987 7.617 574 HG1 THR 75 HG1 THR 75 -9.809 8.306 8.207 575 HG21 THR 75 HG21 THR 75 -10.949 7.249 10.328 576 HG22 THR 75 HG22 THR 75 -11.810 5.900 9.543 577 HG23 THR 75 HG23 THR 75 -11.775 7.494 8.772 578 H GLY 76 H GLY 76 -9.728 4.179 11.406 579 HA2 GLY 76 HA2 GLY 76 -11.719 2.476 11.251 580 HA3 GLY 76 HA3 GLY 76 -10.844 1.646 10.006 581 H GLU 77 H GLU 77 -9.402 0.016 10.645 582 HA GLU 77 HA GLU 77 -8.618 -0.554 13.360 583 HB2 GLU 77 HB2 GLU 77 -10.157 -2.184 14.154 584 HB3 GLU 77 HB3 GLU 77 -10.924 -0.639 13.962 585 HG2 GLU 77 HG2 GLU 77 -11.484 -3.203 12.365 586 HG3 GLU 77 HG3 GLU 77 -12.513 -2.252 13.399 587 H LYS 78 H LYS 78 -10.087 -2.718 11.054 588 HA LYS 78 HA LYS 78 -7.601 -3.561 9.757 589 HB2 LYS 78 HB2 LYS 78 -7.801 -4.776 12.262 590 HB3 LYS 78 HB3 LYS 78 -8.735 -5.938 11.347 591 HG2 LYS 78 HG2 LYS 78 -6.731 -6.109 9.706 592 HG3 LYS 78 HG3 LYS 78 -5.894 -4.928 10.722 593 HD2 LYS 78 HD2 LYS 78 -6.068 -6.549 12.704 594 HD3 LYS 78 HD3 LYS 78 -6.910 -7.696 11.661 595 HE2 LYS 78 HE2 LYS 78 -4.806 -7.688 10.106 596 HE3 LYS 78 HE3 LYS 78 -3.972 -6.713 11.312 597 HZ1 LYS 78 HZ1 LYS 78 -4.365 -8.551 12.965 598 HZ2 LYS 78 HZ2 LYS 78 -3.679 -9.230 11.617 599 HZ3 LYS 78 HZ3 LYS 78 -5.313 -9.387 11.906 600 H VAL 79 H VAL 79 -8.228 -3.949 7.781 601 HA VAL 79 HA VAL 79 -11.164 -4.572 7.249 602 HB VAL 79 HB VAL 79 -10.230 -2.415 6.484 603 HG11 VAL 79 HG11 VAL 79 -8.868 -2.180 4.436 604 HG12 VAL 79 HG12 VAL 79 -7.929 -2.972 5.706 605 HG13 VAL 79 HG13 VAL 79 -8.591 -3.933 4.369 606 HG21 VAL 79 HG21 VAL 79 -11.221 -4.145 4.145 607 HG22 VAL 79 HG22 VAL 79 -12.260 -3.420 5.403 608 HG23 VAL 79 HG23 VAL 79 -11.339 -2.377 4.309 609 H LYS 80 H LYS 80 -11.788 -6.431 6.365 610 HA LYS 80 HA LYS 80 -9.753 -8.435 5.359 611 HB2 LYS 80 HB2 LYS 80 -12.729 -8.759 5.949 612 HB3 LYS 80 HB3 LYS 80 -11.801 -9.946 5.050 613 HG2 LYS 80 HG2 LYS 80 -10.077 -10.018 6.941 614 HG3 LYS 80 HG3 LYS 80 -11.140 -9.003 7.918 615 HD2 LYS 80 HD2 LYS 80 -12.930 -10.820 7.774 616 HD3 LYS 80 HD3 LYS 80 -11.874 -11.754 6.718 617 HE2 LYS 80 HE2 LYS 80 -10.085 -11.766 8.645 618 HE3 LYS 80 HE3 LYS 80 -11.296 -11.036 9.695 619 HZ1 LYS 80 HZ1 LYS 80 -11.449 -13.512 9.863 620 HZ2 LYS 80 HZ2 LYS 80 -11.516 -13.695 8.217 621 HZ3 LYS 80 HZ3 LYS 80 -12.793 -13.053 8.986 622 H THR 81 H THR 81 -8.966 -7.539 3.637 623 HA THR 81 HA THR 81 -10.740 -6.821 1.229 624 HB THR 81 HB THR 81 -9.604 -4.925 2.281 625 HG1 THR 81 HG1 THR 81 -8.596 -5.596 -0.284 626 HG21 THR 81 HG21 THR 81 -6.854 -6.027 1.407 627 HG22 THR 81 HG22 THR 81 -7.422 -6.118 3.090 628 HG23 THR 81 HG23 THR 81 -7.208 -4.553 2.321 629 H VAL 82 H VAL 82 -10.749 -8.537 -0.117 630 HA VAL 82 HA VAL 82 -8.306 -10.305 -0.355 631 HB VAL 82 HB VAL 82 -10.453 -11.482 -0.141 632 HG11 VAL 82 HG11 VAL 82 -11.784 -12.026 -2.193 633 HG12 VAL 82 HG12 VAL 82 -11.994 -10.314 -1.738 634 HG13 VAL 82 HG13 VAL 82 -10.933 -10.760 -3.107 635 HG21 VAL 82 HG21 VAL 82 -8.884 -12.159 -2.715 636 HG22 VAL 82 HG22 VAL 82 -8.354 -12.542 -1.066 637 HG23 VAL 82 HG23 VAL 82 -9.849 -13.256 -1.700 638 H VAL 83 H VAL 83 -7.003 -10.417 -2.043 639 HA VAL 83 HA VAL 83 -7.179 -8.139 -4.066 640 HB VAL 83 HB VAL 83 -4.630 -9.629 -3.256 641 HG11 VAL 83 HG11 VAL 83 -3.504 -7.564 -4.065 642 HG12 VAL 83 HG12 VAL 83 -4.514 -8.238 -5.361 643 HG13 VAL 83 HG13 VAL 83 -5.063 -6.807 -4.465 644 HG21 VAL 83 HG21 VAL 83 -4.055 -7.637 -1.747 645 HG22 VAL 83 HG22 VAL 83 -5.733 -7.097 -1.851 646 HG23 VAL 83 HG23 VAL 83 -5.355 -8.652 -1.110 647 H GLN 84 H GLN 84 -7.327 -8.522 -6.173 648 HA GLN 84 HA GLN 84 -7.017 -11.395 -7.239 649 HB2 GLN 84 HB2 GLN 84 -8.702 -9.030 -8.196 650 HB3 GLN 84 HB3 GLN 84 -8.263 -10.294 -9.304 651 HG2 GLN 84 HG2 GLN 84 -10.488 -10.733 -8.457 652 HG3 GLN 84 HG3 GLN 84 -9.410 -12.040 -8.048 653 HE21 GLN 84 HE21 GLN 84 -9.280 -12.583 -5.874 654 HE22 GLN 84 HE22 GLN 84 -10.218 -11.666 -4.580 655 H LEU 85 H LEU 85 -5.669 -11.829 -8.904 656 HA LEU 85 HA LEU 85 -3.562 -9.720 -9.563 657 HB2 LEU 85 HB2 LEU 85 -2.809 -11.483 -8.008 658 HB3 LEU 85 HB3 LEU 85 -3.335 -12.743 -9.110 659 HG LEU 85 HG LEU 85 -1.654 -12.075 -10.780 660 HD11 LEU 85 HD11 LEU 85 -0.622 -10.024 -8.696 661 HD12 LEU 85 HD12 LEU 85 -1.353 -9.621 -10.269 662 HD13 LEU 85 HD13 LEU 85 0.191 -10.458 -10.199 663 HD21 LEU 85 HD21 LEU 85 0.377 -12.872 -9.476 664 HD22 LEU 85 HD22 LEU 85 -1.073 -13.827 -9.113 665 HD23 LEU 85 HD23 LEU 85 -0.510 -12.598 -7.957 666 H GLU 86 H GLU 86 -3.445 -9.150 -11.613 667 HA GLU 86 HA GLU 86 -4.179 -11.123 -13.860 668 HB2 GLU 86 HB2 GLU 86 -5.500 -8.931 -13.717 669 HB3 GLU 86 HB3 GLU 86 -3.995 -8.097 -14.057 670 HG2 GLU 86 HG2 GLU 86 -3.838 -9.398 -16.296 671 HG3 GLU 86 HG3 GLU 86 -5.461 -10.012 -15.966 672 H GLY 87 H GLY 87 -2.654 -11.752 -15.099 673 HA2 GLY 87 HA2 GLY 87 -0.461 -12.266 -16.056 674 HA3 GLY 87 HA3 GLY 87 -0.379 -10.527 -16.183 675 H ASP 88 H ASP 88 -0.236 -11.799 -13.101 676 HA ASP 88 HA ASP 88 1.396 -11.803 -11.399 677 HB2 ASP 88 HB2 ASP 88 2.475 -13.599 -12.852 678 HB3 ASP 88 HB3 ASP 88 3.598 -12.372 -13.421 679 H ASN 89 H ASN 89 0.736 -9.310 -12.893 680 HA ASN 89 HA ASN 89 2.680 -7.588 -11.315 681 HB2 ASN 89 HB2 ASN 89 3.398 -6.263 -12.987 682 HB3 ASN 89 HB3 ASN 89 3.446 -7.816 -13.747 683 HD21 ASN 89 HD21 ASN 89 3.150 -4.920 -14.658 684 HD22 ASN 89 HD22 ASN 89 1.799 -5.063 -15.910 685 H LYS 90 H LYS 90 -0.636 -7.676 -12.550 686 HA LYS 90 HA LYS 90 -1.171 -4.968 -11.194 687 HB2 LYS 90 HB2 LYS 90 -2.876 -6.683 -13.050 688 HB3 LYS 90 HB3 LYS 90 -3.408 -5.157 -12.391 689 HG2 LYS 90 HG2 LYS 90 -1.798 -3.874 -13.705 690 HG3 LYS 90 HG3 LYS 90 -0.894 -5.322 -14.163 691 HD2 LYS 90 HD2 LYS 90 -2.952 -6.231 -15.337 692 HD3 LYS 90 HD3 LYS 90 -3.831 -4.761 -15.005 693 HE2 LYS 90 HE2 LYS 90 -1.206 -4.957 -16.664 694 HE3 LYS 90 HE3 LYS 90 -2.831 -5.035 -17.345 695 HZ1 LYS 90 HZ1 LYS 90 -2.027 -2.692 -17.455 696 HZ2 LYS 90 HZ2 LYS 90 -1.671 -2.617 -15.849 697 HZ3 LYS 90 HZ3 LYS 90 -3.239 -2.735 -16.335 698 H LEU 91 H LEU 91 -1.612 -5.221 -9.076 699 HA LEU 91 HA LEU 91 -3.465 -7.472 -8.095 700 HB2 LEU 91 HB2 LEU 91 -1.487 -5.613 -6.711 701 HB3 LEU 91 HB3 LEU 91 -2.635 -6.503 -5.784 702 HG LEU 91 HG LEU 91 -0.566 -7.830 -7.630 703 HD11 LEU 91 HD11 LEU 91 0.504 -6.561 -5.744 704 HD12 LEU 91 HD12 LEU 91 0.665 -8.303 -5.469 705 HD13 LEU 91 HD13 LEU 91 -0.561 -7.362 -4.577 706 HD21 LEU 91 HD21 LEU 91 -2.569 -9.328 -7.130 707 HD22 LEU 91 HD22 LEU 91 -2.297 -9.107 -5.389 708 HD23 LEU 91 HD23 LEU 91 -1.082 -9.933 -6.375 709 H VAL 92 H VAL 92 -5.565 -6.906 -8.007 710 HA VAL 92 HA VAL 92 -6.335 -4.031 -7.238 711 HB VAL 92 HB VAL 92 -8.382 -4.262 -8.480 712 HG11 VAL 92 HG11 VAL 92 -6.016 -4.953 -10.324 713 HG12 VAL 92 HG12 VAL 92 -7.491 -4.057 -10.761 714 HG13 VAL 92 HG13 VAL 92 -6.317 -3.353 -9.628 715 HG21 VAL 92 HG21 VAL 92 -8.842 -6.091 -10.128 716 HG22 VAL 92 HG22 VAL 92 -7.456 -7.020 -9.511 717 HG23 VAL 92 HG23 VAL 92 -8.863 -6.708 -8.468 718 H THR 93 H THR 93 -7.366 -3.660 -5.370 719 HA THR 93 HA THR 93 -9.283 -5.770 -4.301 720 HB THR 93 HB THR 93 -7.013 -6.091 -3.266 721 HG1 THR 93 HG1 THR 93 -8.770 -6.962 -2.321 722 HG21 THR 93 HG21 THR 93 -6.216 -3.808 -2.709 723 HG22 THR 93 HG22 THR 93 -6.402 -4.758 -1.226 724 HG23 THR 93 HG23 THR 93 -7.620 -3.538 -1.634 725 H THR 94 H THR 94 -10.388 -5.003 -2.302 726 HA THR 94 HA THR 94 -11.613 -2.212 -2.751 727 HB THR 94 HB THR 94 -13.201 -4.732 -1.976 728 HG1 THR 94 HG1 THR 94 -14.178 -4.445 -3.952 729 HG21 THR 94 HG21 THR 94 -14.200 -2.618 -1.014 730 HG22 THR 94 HG22 THR 94 -15.230 -3.284 -2.292 731 HG23 THR 94 HG23 THR 94 -14.202 -1.869 -2.629 732 H PHE 95 H PHE 95 -10.640 -1.181 -1.096 733 HA PHE 95 HA PHE 95 -10.078 -2.562 1.549 734 HB2 PHE 95 HB2 PHE 95 -8.507 -1.032 -0.082 735 HB3 PHE 95 HB3 PHE 95 -9.334 0.269 0.697 736 HD1 PHE 95 HD2 PHE 95 -7.147 -2.667 1.210 737 HD2 PHE 95 HD1 PHE 95 -8.474 1.057 2.889 738 HE1 PHE 95 HE2 PHE 95 -5.440 -2.848 2.974 739 HE2 PHE 95 HE1 PHE 95 -6.738 0.894 4.608 740 HZ PHE 95 HZ PHE 95 -5.241 -1.080 4.696 741 H LYS 96 H LYS 96 -10.318 0.396 2.736 742 HA LYS 96 HA LYS 96 -13.170 0.094 3.768 743 HB2 LYS 96 HB2 LYS 96 -11.053 2.237 4.390 744 HB3 LYS 96 HB3 LYS 96 -12.606 2.136 5.164 745 HG2 LYS 96 HG2 LYS 96 -10.454 -0.066 5.363 746 HG3 LYS 96 HG3 LYS 96 -10.560 1.288 6.450 747 HD2 LYS 96 HD2 LYS 96 -12.809 -0.813 6.123 748 HD3 LYS 96 HD3 LYS 96 -11.513 -0.890 7.305 749 HE2 LYS 96 HE2 LYS 96 -12.293 1.426 8.219 750 HE3 LYS 96 HE3 LYS 96 -13.737 1.245 7.223 751 HZ1 LYS 96 HZ1 LYS 96 -12.820 -0.806 9.321 752 HZ2 LYS 96 HZ2 LYS 96 -14.191 -0.938 8.428 753 HZ3 LYS 96 HZ3 LYS 96 -13.992 0.228 9.580 754 H ASN 97 H ASN 97 -14.305 0.454 1.739 755 HA ASN 97 HA ASN 97 -15.056 1.504 -0.202 756 HB2 ASN 97 HB2 ASN 97 -15.129 3.910 1.698 757 HB3 ASN 97 HB3 ASN 97 -15.974 3.768 0.180 758 HD21 ASN 97 HD21 ASN 97 -17.904 2.555 0.087 759 HD22 ASN 97 HD22 ASN 97 -18.635 1.879 1.637 760 H ILE 98 H ILE 98 -12.258 1.346 -0.216 761 HA ILE 98 HA ILE 98 -11.521 3.582 -2.214 762 HB ILE 98 HB ILE 98 -9.686 2.155 -0.211 763 HG12 ILE 98 HG12 ILE 98 -9.978 5.172 0.014 764 HG13 ILE 98 HG13 ILE 98 -11.319 4.235 0.599 765 HG21 ILE 98 HG21 ILE 98 -8.391 2.755 -2.254 766 HG22 ILE 98 HG22 ILE 98 -8.934 4.444 -2.138 767 HG23 ILE 98 HG23 ILE 98 -7.877 3.744 -0.887 768 HD11 ILE 98 HD11 ILE 98 -9.943 2.975 2.194 769 HD12 ILE 98 HD12 ILE 98 -8.442 3.699 1.575 770 HD13 ILE 98 HD13 ILE 98 -9.648 4.712 2.412 771 H LYS 99 H LYS 99 -10.813 2.812 -4.164 772 HA LYS 99 HA LYS 99 -10.531 -0.217 -4.550 773 HB2 LYS 99 HB2 LYS 99 -12.157 1.044 -5.996 774 HB3 LYS 99 HB3 LYS 99 -10.860 1.951 -6.680 775 HG2 LYS 99 HG2 LYS 99 -10.455 0.334 -8.213 776 HG3 LYS 99 HG3 LYS 99 -10.002 -0.815 -6.994 777 HD2 LYS 99 HD2 LYS 99 -12.836 -0.305 -8.096 778 HD3 LYS 99 HD3 LYS 99 -11.820 -1.661 -8.507 779 HE2 LYS 99 HE2 LYS 99 -13.023 -1.133 -5.688 780 HE3 LYS 99 HE3 LYS 99 -13.719 -2.199 -6.896 781 HZ1 LYS 99 HZ1 LYS 99 -11.638 -3.595 -6.787 782 HZ2 LYS 99 HZ2 LYS 99 -12.329 -3.461 -5.284 783 HZ3 LYS 99 HZ3 LYS 99 -10.991 -2.604 -5.640 784 H SER 100 H SER 100 -8.546 -0.775 -3.973 785 HA SER 100 HA SER 100 -6.125 0.983 -4.495 786 HB2 SER 100 HB2 SER 100 -6.511 0.031 -2.223 787 HB3 SER 100 HB3 SER 100 -6.371 -1.601 -2.860 788 HG SER 100 HG SER 100 -4.226 -1.113 -3.497 789 H VAL 101 H VAL 101 -5.103 0.764 -6.326 790 HA VAL 101 HA VAL 101 -4.919 -1.954 -7.769 791 HB VAL 101 HB VAL 101 -4.863 0.911 -8.894 792 HG11 VAL 101 HG11 VAL 101 -3.406 -0.545 -10.294 793 HG12 VAL 101 HG12 VAL 101 -4.696 -1.758 -10.449 794 HG13 VAL 101 HG13 VAL 101 -4.880 -0.138 -11.177 795 HG21 VAL 101 HG21 VAL 101 -7.012 0.328 -10.059 796 HG22 VAL 101 HG22 VAL 101 -7.060 -1.244 -9.225 797 HG23 VAL 101 HG23 VAL 101 -7.200 0.265 -8.301 798 H THR 102 H THR 102 -2.964 -2.827 -7.236 799 HA THR 102 HA THR 102 -0.514 -1.014 -7.088 800 HB THR 102 HB THR 102 -0.437 -3.909 -6.203 801 HG1 THR 102 HG1 THR 102 -0.912 -1.773 -4.402 802 HG21 THR 102 HG21 THR 102 1.196 -1.470 -5.264 803 HG22 THR 102 HG22 THR 102 1.735 -2.652 -6.477 804 HG23 THR 102 HG23 THR 102 1.441 -3.176 -4.815 805 H GLU 103 H GLU 103 0.714 -0.894 -8.979 806 HA GLU 103 HA GLU 103 0.624 -3.322 -10.852 807 HB2 GLU 103 HB2 GLU 103 -0.508 -1.184 -11.744 808 HB3 GLU 103 HB3 GLU 103 1.106 -0.501 -11.851 809 HG2 GLU 103 HG2 GLU 103 1.857 -2.334 -13.403 810 HG3 GLU 103 HG3 GLU 103 0.322 -3.157 -13.233 811 H LEU 104 H LEU 104 2.435 -4.222 -11.324 812 HA LEU 104 HA LEU 104 5.113 -2.973 -10.534 813 HB2 LEU 104 HB2 LEU 104 4.095 -5.499 -9.956 814 HB3 LEU 104 HB3 LEU 104 5.014 -5.873 -11.385 815 HG LEU 104 HG LEU 104 6.035 -4.552 -8.793 816 HD11 LEU 104 HD11 LEU 104 5.495 -7.036 -8.709 817 HD12 LEU 104 HD12 LEU 104 7.214 -6.706 -8.466 818 HD13 LEU 104 HD13 LEU 104 6.640 -7.325 -10.030 819 HD21 LEU 104 HD21 LEU 104 7.677 -5.299 -11.307 820 HD22 LEU 104 HD22 LEU 104 8.376 -4.832 -9.736 821 HD23 LEU 104 HD23 LEU 104 7.439 -3.662 -10.668 822 H ASN 105 H ASN 105 6.195 -1.972 -12.096 823 HA ASN 105 HA ASN 105 5.875 -2.853 -15.056 824 HB2 ASN 105 HB2 ASN 105 6.385 -0.070 -13.833 825 HB3 ASN 105 HB3 ASN 105 6.730 -0.448 -15.501 826 HD21 ASN 105 HD21 ASN 105 4.030 -0.339 -13.213 827 HD22 ASN 105 HD22 ASN 105 2.766 -0.205 -14.544 828 H GLY 106 H GLY 106 7.357 -4.532 -14.641 829 HA2 GLY 106 HA2 GLY 106 9.579 -5.433 -15.167 830 HA3 GLY 106 HA3 GLY 106 10.249 -3.814 -15.226 831 H ASP 107 H ASP 107 11.085 -2.964 -13.347 832 HA ASP 107 HA ASP 107 10.859 -4.525 -10.710 833 HB2 ASP 107 HB2 ASP 107 13.477 -3.504 -11.971 834 HB3 ASP 107 HB3 ASP 107 13.332 -3.920 -10.279 835 H ILE 108 H ILE 108 9.472 -2.085 -11.696 836 HA ILE 108 HA ILE 108 9.902 -0.488 -9.144 837 HB ILE 108 HB ILE 108 9.387 1.553 -10.013 838 HG12 ILE 108 HG12 ILE 108 9.550 1.706 -12.738 839 HG13 ILE 108 HG13 ILE 108 8.686 0.199 -12.628 840 HG21 ILE 108 HG21 ILE 108 11.644 0.392 -11.724 841 HG22 ILE 108 HG22 ILE 108 11.396 2.113 -11.322 842 HG23 ILE 108 HG23 ILE 108 11.758 0.949 -10.039 843 HD11 ILE 108 HD11 ILE 108 6.907 1.368 -11.173 844 HD12 ILE 108 HD12 ILE 108 7.831 2.880 -11.312 845 HD13 ILE 108 HD13 ILE 108 7.095 2.143 -12.762 846 H ILE 109 H ILE 109 8.116 -0.227 -7.917 847 HA ILE 109 HA ILE 109 5.516 -1.412 -8.994 848 HB ILE 109 HB ILE 109 6.700 -2.773 -7.221 849 HG12 ILE 109 HG12 ILE 109 3.921 -1.838 -6.329 850 HG13 ILE 109 HG13 ILE 109 4.178 -2.853 -7.740 851 HG21 ILE 109 HG21 ILE 109 7.525 -0.901 -5.712 852 HG22 ILE 109 HG22 ILE 109 5.855 -0.573 -5.207 853 HG23 ILE 109 HG23 ILE 109 6.625 -2.125 -4.815 854 HD11 ILE 109 HD11 ILE 109 3.594 -4.249 -5.751 855 HD12 ILE 109 HD12 ILE 109 5.231 -4.657 -6.328 856 HD13 ILE 109 HD13 ILE 109 5.009 -3.655 -4.875 857 H THR 110 H THR 110 3.738 -0.236 -8.981 858 HA THR 110 HA THR 110 3.742 2.364 -7.374 859 HB THR 110 HB THR 110 3.761 2.553 -9.934 860 HG1 THR 110 HG1 THR 110 2.899 4.071 -8.071 861 HG21 THR 110 HG21 THR 110 1.678 2.643 -11.163 862 HG22 THR 110 HG22 THR 110 0.745 2.098 -9.746 863 HG23 THR 110 HG23 THR 110 1.912 0.996 -10.517 864 H ASN 111 H ASN 111 2.187 2.714 -5.945 865 HA ASN 111 HA ASN 111 -0.113 0.671 -5.737 866 HB2 ASN 111 HB2 ASN 111 1.576 0.575 -3.816 867 HB3 ASN 111 HB3 ASN 111 1.053 2.179 -3.335 868 HD21 ASN 111 HD21 ASN 111 -0.813 2.224 -2.045 869 HD22 ASN 111 HD22 ASN 111 -1.899 0.755 -1.821 870 H THR 112 H THR 112 -1.792 1.610 -6.691 871 HA THR 112 HA THR 112 -2.271 4.623 -6.372 872 HB THR 112 HB THR 112 -3.412 2.747 -8.496 873 HG1 THR 112 HG1 THR 112 -1.089 2.994 -8.455 874 HG21 THR 112 HG21 THR 112 -3.771 4.852 -9.789 875 HG22 THR 112 HG22 THR 112 -3.100 5.824 -8.459 876 HG23 THR 112 HG23 THR 112 -4.641 4.956 -8.242 877 H MET 113 H MET 113 -3.425 4.813 -4.558 878 HA MET 113 HA MET 113 -5.881 3.076 -3.993 879 HB2 MET 113 HB2 MET 113 -4.346 5.087 -2.296 880 HB3 MET 113 HB3 MET 113 -5.957 4.578 -1.859 881 HG2 MET 113 HG2 MET 113 -5.159 2.118 -1.969 882 HG3 MET 113 HG3 MET 113 -3.506 2.743 -2.087 883 HE1 MET 113 HE1 MET 113 -4.653 1.437 1.679 884 HE2 MET 113 HE2 MET 113 -5.392 0.968 0.129 885 HE3 MET 113 HE3 MET 113 -3.609 0.992 0.297 886 H THR 114 H THR 114 -7.426 3.628 -5.275 887 HA THR 114 HA THR 114 -8.073 6.520 -5.928 888 HB THR 114 HB THR 114 -9.599 5.692 -7.636 889 HG1 THR 114 HG1 THR 114 -8.743 3.125 -6.743 890 HG21 THR 114 HG21 THR 114 -7.194 6.015 -8.290 891 HG22 THR 114 HG22 THR 114 -7.987 4.725 -9.223 892 HG23 THR 114 HG23 THR 114 -6.865 4.303 -7.909 893 H LEU 115 H LEU 115 -9.297 7.568 -4.588 894 HA LEU 115 HA LEU 115 -11.783 6.263 -3.283 895 HB2 LEU 115 HB2 LEU 115 -10.043 6.788 -1.645 896 HB3 LEU 115 HB3 LEU 115 -9.852 8.413 -2.257 897 HG LEU 115 HG LEU 115 -12.145 9.036 -1.458 898 HD11 LEU 115 HD11 LEU 115 -12.237 6.210 -0.194 899 HD12 LEU 115 HD12 LEU 115 -13.303 6.803 -1.484 900 HD13 LEU 115 HD13 LEU 115 -13.381 7.530 0.128 901 HD21 LEU 115 HD21 LEU 115 -10.124 9.426 -0.033 902 HD22 LEU 115 HD22 LEU 115 -10.297 7.811 0.693 903 HD23 LEU 115 HD23 LEU 115 -11.538 9.060 0.971 904 H GLY 116 H GLY 116 -12.688 6.710 -5.419 905 HA2 GLY 116 HA2 GLY 116 -14.338 7.932 -6.714 906 HA3 GLY 116 HA3 GLY 116 -14.401 9.156 -5.468 907 H ASP 117 H ASP 117 -12.980 10.865 -5.611 908 HA ASP 117 HA ASP 117 -11.819 11.529 -8.376 909 HB2 ASP 117 HB2 ASP 117 -12.594 13.394 -6.034 910 HB3 ASP 117 HB3 ASP 117 -11.808 13.921 -7.510 911 H ILE 118 H ILE 118 -10.853 10.925 -5.068 912 HA ILE 118 HA ILE 118 -8.172 12.289 -5.272 913 HB ILE 118 HB ILE 118 -9.211 10.378 -3.129 914 HG12 ILE 118 HG12 ILE 118 -10.736 12.301 -3.119 915 HG13 ILE 118 HG13 ILE 118 -9.852 12.076 -1.637 916 HG21 ILE 118 HG21 ILE 118 -6.835 12.375 -3.014 917 HG22 ILE 118 HG22 ILE 118 -7.429 11.391 -1.666 918 HG23 ILE 118 HG23 ILE 118 -6.701 10.605 -3.068 919 HD11 ILE 118 HD11 ILE 118 -9.125 14.240 -3.725 920 HD12 ILE 118 HD12 ILE 118 -10.078 14.499 -2.238 921 HD13 ILE 118 HD13 ILE 118 -8.377 14.021 -2.115 922 H VAL 119 H VAL 119 -6.557 11.304 -6.352 923 HA VAL 119 HA VAL 119 -6.344 8.230 -6.461 924 HB VAL 119 HB VAL 119 -5.233 10.340 -8.396 925 HG11 VAL 119 HG11 VAL 119 -3.804 8.287 -8.403 926 HG12 VAL 119 HG12 VAL 119 -5.239 7.260 -8.653 927 HG13 VAL 119 HG13 VAL 119 -4.717 8.405 -9.911 928 HG21 VAL 119 HG21 VAL 119 -7.621 8.394 -8.801 929 HG22 VAL 119 HG22 VAL 119 -7.735 10.158 -8.655 930 HG23 VAL 119 HG23 VAL 119 -6.920 9.450 -10.054 931 H PHE 120 H PHE 120 -5.267 7.911 -4.478 932 HA PHE 120 HA PHE 120 -2.700 9.402 -3.857 933 HB2 PHE 120 HB2 PHE 120 -4.048 9.011 -1.979 934 HB3 PHE 120 HB3 PHE 120 -4.317 7.331 -2.348 935 HD1 PHE 120 HD2 PHE 120 -1.060 9.337 -2.107 936 HD2 PHE 120 HD1 PHE 120 -3.406 6.090 -0.529 937 HE1 PHE 120 HE2 PHE 120 0.857 8.570 -0.811 938 HE2 PHE 120 HE1 PHE 120 -1.465 5.331 0.764 939 HZ PHE 120 HZ PHE 120 0.684 6.566 0.624 940 H LYS 121 H LYS 121 -1.244 8.947 -5.363 941 HA LYS 121 HA LYS 121 -0.561 6.042 -5.996 942 HB2 LYS 121 HB2 LYS 121 -1.316 7.662 -7.779 943 HB3 LYS 121 HB3 LYS 121 0.173 8.554 -7.562 944 HG2 LYS 121 HG2 LYS 121 1.513 6.479 -8.170 945 HG3 LYS 121 HG3 LYS 121 0.012 5.575 -8.369 946 HD2 LYS 121 HD2 LYS 121 -0.739 7.236 -10.152 947 HD3 LYS 121 HD3 LYS 121 0.767 8.129 -9.947 948 HE2 LYS 121 HE2 LYS 121 2.091 6.027 -10.621 949 HE3 LYS 121 HE3 LYS 121 0.574 5.149 -10.839 950 HZ1 LYS 121 HZ1 LYS 121 1.278 7.694 -12.316 951 HZ2 LYS 121 HZ2 LYS 121 -0.097 6.844 -12.543 952 HZ3 LYS 121 HZ3 LYS 121 1.348 6.191 -12.996 953 H ARG 122 H ARG 122 0.987 5.190 -4.831 954 HA ARG 122 HA ARG 122 3.594 6.691 -4.218 955 HB2 ARG 122 HB2 ARG 122 2.539 3.902 -3.422 956 HB3 ARG 122 HB3 ARG 122 4.240 4.260 -3.364 957 HG2 ARG 122 HG2 ARG 122 3.769 6.267 -1.838 958 HG3 ARG 122 HG3 ARG 122 2.092 5.716 -1.707 959 HD2 ARG 122 HD2 ARG 122 2.887 3.488 -0.805 960 HD3 ARG 122 HD3 ARG 122 4.557 3.936 -1.130 961 HE ARG 122 HE ARG 122 3.498 5.973 0.667 962 HH11 ARG 122 HH11 ARG 122 4.674 2.644 0.655 963 HH12 ARG 122 HH12 ARG 122 5.248 2.830 2.393 964 HH21 ARG 122 HH21 ARG 122 4.124 6.056 2.606 965 HH22 ARG 122 HH22 ARG 122 4.930 4.622 3.436 966 H ILE 123 H ILE 123 5.509 6.252 -5.225 967 HA ILE 123 HA ILE 123 5.670 4.031 -7.348 968 HB ILE 123 HB ILE 123 6.921 6.827 -7.596 969 HG12 ILE 123 HG12 ILE 123 5.421 6.728 -9.863 970 HG13 ILE 123 HG13 ILE 123 4.428 5.635 -8.933 971 HG21 ILE 123 HG21 ILE 123 6.967 4.452 -9.578 972 HG22 ILE 123 HG22 ILE 123 7.649 6.070 -9.879 973 HG23 ILE 123 HG23 ILE 123 8.352 5.040 -8.630 974 HD11 ILE 123 HD11 ILE 123 3.556 7.971 -8.819 975 HD12 ILE 123 HD12 ILE 123 4.118 7.558 -7.192 976 HD13 ILE 123 HD13 ILE 123 5.111 8.588 -8.239 977 H SER 124 H SER 124 6.890 2.532 -6.386 978 HA SER 124 HA SER 124 9.425 3.347 -4.837 979 HB2 SER 124 HB2 SER 124 7.470 1.000 -4.295 980 HB3 SER 124 HB3 SER 124 8.959 1.307 -3.404 981 HG SER 124 HG SER 124 6.522 2.361 -2.966 982 H LYS 125 H LYS 125 11.313 2.158 -5.168 983 HA LYS 125 HA LYS 125 11.316 0.424 -7.692 984 HB2 LYS 125 HB2 LYS 125 12.552 2.541 -7.819 985 HB3 LYS 125 HB3 LYS 125 13.567 2.104 -6.445 986 HG2 LYS 125 HG2 LYS 125 14.670 0.329 -7.642 987 HG3 LYS 125 HG3 LYS 125 13.427 0.210 -8.864 988 HD2 LYS 125 HD2 LYS 125 14.106 2.711 -9.517 989 HD3 LYS 125 HD3 LYS 125 15.560 2.413 -8.590 990 HE2 LYS 125 HE2 LYS 125 14.495 0.733 -10.997 991 HE3 LYS 125 HE3 LYS 125 15.715 1.988 -11.135 992 HZ1 LYS 125 HZ1 LYS 125 16.053 -0.524 -9.480 993 HZ2 LYS 125 HZ2 LYS 125 17.198 0.634 -9.620 994 HZ3 LYS 125 HZ3 LYS 125 16.780 -0.273 -10.930 995 H ARG 126 H ARG 126 12.099 -1.633 -7.677 996 HA ARG 126 HA ARG 126 12.179 -3.166 -5.265 997 HB2 ARG 126 HB2 ARG 126 11.664 -3.826 -7.718 998 HB3 ARG 126 HB3 ARG 126 13.394 -3.909 -7.991 999 HG2 ARG 126 HG2 ARG 126 13.514 -5.724 -6.144 1000 HG3 ARG 126 HG3 ARG 126 11.760 -5.582 -5.965 1001 HD2 ARG 126 HD2 ARG 126 11.632 -6.022 -8.573 1002 HD3 ARG 126 HD3 ARG 126 13.338 -6.469 -8.473 1003 HE ARG 126 HE ARG 126 11.929 -8.064 -6.467 1004 HH11 ARG 126 HH11 ARG 126 11.996 -7.756 -10.014 1005 HH12 ARG 126 HH12 ARG 126 11.248 -9.433 -10.141 1006 HH21 ARG 126 HH21 ARG 126 11.139 -9.870 -6.741 1007 HH22 ARG 126 HH22 ARG 126 10.726 -10.540 -8.410 1008 H ILE 127 H ILE 127 13.657 -3.578 -3.803 1009 HA ILE 127 HA ILE 127 16.622 -3.545 -4.360 1010 HB ILE 127 HB ILE 127 15.101 -1.694 -2.440 1011 HG12 ILE 127 HG12 ILE 127 17.511 -1.235 -4.284 1012 HG13 ILE 127 HG13 ILE 127 15.840 -0.853 -4.659 1013 HG21 ILE 127 HG21 ILE 127 18.004 -2.498 -1.906 1014 HG22 ILE 127 HG22 ILE 127 17.073 -1.212 -1.070 1015 HG23 ILE 127 HG23 ILE 127 16.589 -2.903 -0.902 1016 HD11 ILE 127 HD11 ILE 127 15.754 0.814 -2.763 1017 HD12 ILE 127 HD12 ILE 127 17.491 0.558 -2.483 1018 HD13 ILE 127 HD13 ILE 127 16.929 1.226 -4.031 1019 H21 OLA 128 H21 OLA 128 4.035 9.411 15.087 1020 H22 OLA 128 H22 OLA 128 5.007 8.214 14.264 1021 H31 OLA 128 H31 OLA 128 3.792 10.680 12.821 1022 H32 OLA 128 H32 OLA 128 2.907 9.174 13.032 1023 H41 OLA 128 H41 OLA 128 4.677 7.926 11.732 1024 H42 OLA 128 H42 OLA 128 5.589 9.424 11.549 1025 H51 OLA 128 H51 OLA 128 4.415 9.129 9.484 1026 H52 OLA 128 H52 OLA 128 3.601 10.444 10.307 1027 H61 OLA 128 H61 OLA 128 1.782 8.842 11.064 1028 H62 OLA 128 H62 OLA 128 2.633 7.502 10.299 1029 H71 OLA 128 H71 OLA 128 2.376 8.605 8.042 1030 H72 OLA 128 H72 OLA 128 1.568 9.986 8.795 1031 H81 OLA 128 H81 OLA 128 -0.262 8.427 9.656 1032 H82 OLA 128 H82 OLA 128 0.534 7.061 8.887 1033 H9 OLA 128 H9 OLA 128 -0.869 9.456 7.510 1034 H10 OLA 128 H10 OLA 128 -0.902 8.259 5.551 1035 H111 OLA 128 H111 OLA 128 0.093 5.754 6.885 1036 H112 OLA 128 H112 OLA 128 1.438 6.640 6.160 1037 H121 OLA 128 H121 OLA 128 0.254 6.625 3.935 1038 H122 OLA 128 H122 OLA 128 -1.127 5.792 4.643 1039 H131 OLA 128 H131 OLA 128 0.266 3.772 5.106 1040 H132 OLA 128 H132 OLA 128 1.727 4.607 4.562 1041 H141 OLA 128 H141 OLA 128 0.736 4.916 2.271 1042 H142 OLA 128 H142 OLA 128 -0.751 4.118 2.774 1043 H151 OLA 128 H151 OLA 128 0.542 1.975 3.192 1044 H152 OLA 128 H152 OLA 128 2.033 2.787 2.726 1045 H161 OLA 128 H161 OLA 128 0.964 3.315 0.446 1046 H162 OLA 128 H162 OLA 128 -0.439 2.366 0.897 1047 H171 OLA 128 H171 OLA 128 2.433 1.196 0.872 1048 H172 OLA 128 H172 OLA 128 1.422 1.240 -0.553 1049 H181 OLA 128 H181 OLA 128 1.288 -0.990 0.626 1050 H182 OLA 128 H182 OLA 128 0.573 -0.212 2.049 1051 H183 OLA 128 H183 OLA 128 -0.303 -0.221 0.496 1052 H21 OLA 129 H21 OLA 129 5.454 -0.743 -2.208 1053 H22 OLA 129 H22 OLA 129 4.285 -0.205 -3.399 1054 H31 OLA 129 H31 OLA 129 2.394 -0.484 -1.825 1055 H32 OLA 129 H32 OLA 129 3.483 -0.798 -0.479 1056 H41 OLA 129 H41 OLA 129 4.320 -2.876 -1.591 1057 H42 OLA 129 H42 OLA 129 3.254 -2.614 -2.967 1058 H51 OLA 129 H51 OLA 129 2.243 -2.974 -0.060 1059 H52 OLA 129 H52 OLA 129 2.481 -4.319 -1.159 1060 H61 OLA 129 H61 OLA 129 0.791 -3.446 -2.742 1061 H62 OLA 129 H62 OLA 129 0.611 -1.962 -1.811 1062 H71 OLA 129 H71 OLA 129 -0.282 -3.256 0.142 1063 H72 OLA 129 H72 OLA 129 -0.078 -4.774 -0.737 1064 H81 OLA 129 H81 OLA 129 -1.687 -4.029 -2.509 1065 H82 OLA 129 H82 OLA 129 -1.834 -2.442 -1.784 1066 H9 OLA 129 H9 OLA 129 -3.113 -5.051 -0.863 1067 H10 OLA 129 H10 OLA 129 -4.225 -3.911 0.820 1068 H111 OLA 129 H111 OLA 129 -4.101 -1.429 0.900 1069 H112 OLA 129 H112 OLA 129 -2.512 -1.394 0.155 1070 H121 OLA 129 H121 OLA 129 -1.469 -2.450 2.169 1071 H122 OLA 129 H122 OLA 129 -3.048 -2.718 2.905 1072 H131 OLA 129 H131 OLA 129 -3.421 -0.182 2.913 1073 H132 OLA 129 H132 OLA 129 -1.776 0.043 2.342 1074 H141 OLA 129 H141 OLA 129 -0.948 -1.240 4.418 1075 H142 OLA 129 H142 OLA 129 -2.610 -1.368 4.964 1076 H151 OLA 129 H151 OLA 129 -0.925 1.202 4.728 1077 H152 OLA 129 H152 OLA 129 -1.486 0.398 6.169 1078 H161 OLA 129 H161 OLA 129 -3.119 1.991 6.185 1079 H162 OLA 129 H162 OLA 129 -3.949 0.881 5.116 1080 H171 OLA 129 H171 OLA 129 -2.816 2.213 3.122 1081 H172 OLA 129 H172 OLA 129 -2.305 3.375 4.339 1082 H181 OLA 129 H181 OLA 129 -4.756 3.777 4.969 1083 H182 OLA 129 H182 OLA 129 -4.429 4.133 3.258 1084 H183 OLA 129 H183 OLA 129 -5.248 2.622 3.709 Start of MODEL 4 1 H1 SER 2 H1 SER 2 6.498 -11.236 -11.562 2 H2 SER 2 H2 SER 2 5.756 -10.235 -10.538 3 HA SER 2 HA SER 2 7.088 -11.979 -9.461 4 HB2 SER 2 HB2 SER 2 8.873 -11.993 -11.224 5 HB3 SER 2 HB3 SER 2 9.377 -10.372 -10.736 6 HG SER 2 HG SER 2 9.471 -12.774 -9.209 7 H PHE 3 H PHE 3 6.223 -11.191 -7.678 8 HA PHE 3 HA PHE 3 6.740 -8.374 -6.676 9 HB2 PHE 3 HB2 PHE 3 4.796 -10.599 -5.810 10 HB3 PHE 3 HB3 PHE 3 4.992 -9.151 -4.878 11 HD1 PHE 3 HD2 PHE 3 4.276 -6.927 -5.725 12 HD2 PHE 3 HD1 PHE 3 3.669 -10.484 -8.071 13 HE1 PHE 3 HE2 PHE 3 2.600 -5.748 -7.116 14 HE2 PHE 3 HE1 PHE 3 1.989 -9.300 -9.406 15 HZ PHE 3 HZ PHE 3 1.433 -6.938 -8.909 16 H SER 4 H SER 4 8.479 -11.181 -5.976 17 HA SER 4 HA SER 4 8.926 -10.672 -3.107 18 HB2 SER 4 HB2 SER 4 10.543 -12.352 -5.087 19 HB3 SER 4 HB3 SER 4 10.907 -12.239 -3.363 20 HG SER 4 HG SER 4 9.474 -13.986 -3.903 21 H GLY 5 H GLY 5 9.889 -8.920 -2.264 22 HA2 GLY 5 HA2 GLY 5 12.660 -8.159 -2.629 23 HA3 GLY 5 HA3 GLY 5 11.735 -7.146 -3.738 24 H LYS 6 H LYS 6 13.214 -5.963 -1.950 25 HA LYS 6 HA LYS 6 11.352 -4.819 0.239 26 HB2 LYS 6 HB2 LYS 6 14.394 -4.855 -0.062 27 HB3 LYS 6 HB3 LYS 6 13.572 -3.901 1.142 28 HG2 LYS 6 HG2 LYS 6 12.631 -5.949 2.253 29 HG3 LYS 6 HG3 LYS 6 13.353 -6.977 1.016 30 HD2 LYS 6 HD2 LYS 6 15.657 -6.109 1.643 31 HD3 LYS 6 HD3 LYS 6 14.970 -5.141 2.929 32 HE2 LYS 6 HE2 LYS 6 14.758 -8.243 2.743 33 HE3 LYS 6 HE3 LYS 6 16.030 -7.393 3.614 34 HZ1 LYS 6 HZ1 LYS 6 13.057 -7.394 4.285 35 HZ2 LYS 6 HZ2 LYS 6 14.076 -6.264 4.924 36 HZ3 LYS 6 HZ3 LYS 6 14.298 -7.869 5.250 37 H TYR 7 H TYR 7 10.244 -3.435 -1.180 38 HA TYR 7 HA TYR 7 11.734 -1.920 -3.316 39 HB2 TYR 7 HB2 TYR 7 8.713 -1.894 -2.657 40 HB3 TYR 7 HB3 TYR 7 9.447 -1.133 -4.029 41 HD1 TYR 7 HD2 TYR 7 8.859 -4.543 -2.487 42 HD2 TYR 7 HD1 TYR 7 9.610 -2.345 -6.111 43 HE1 TYR 7 HE2 TYR 7 8.519 -6.579 -3.798 44 HE2 TYR 7 HE1 TYR 7 9.211 -4.389 -7.416 45 HH TYR 7 HH TYR 7 8.878 -6.618 -7.330 46 H GLN 8 H GLN 8 12.801 -0.097 -2.681 47 HA GLN 8 HA GLN 8 11.782 1.572 -0.421 48 HB2 GLN 8 HB2 GLN 8 14.257 1.140 -0.868 49 HB3 GLN 8 HB3 GLN 8 14.153 2.296 -2.199 50 HG2 GLN 8 HG2 GLN 8 13.321 4.068 -0.531 51 HG3 GLN 8 HG3 GLN 8 13.452 2.883 0.765 52 HE21 GLN 8 HE21 GLN 8 14.648 4.917 1.422 53 HE22 GLN 8 HE22 GLN 8 16.460 4.856 1.070 54 H LEU 9 H LEU 9 10.810 3.455 -0.404 55 HA LEU 9 HA LEU 9 9.206 4.286 -2.719 56 HB2 LEU 9 HB2 LEU 9 8.382 4.311 -0.409 57 HB3 LEU 9 HB3 LEU 9 9.577 5.502 0.061 58 HG LEU 9 HG LEU 9 8.474 7.223 -1.436 59 HD11 LEU 9 HD11 LEU 9 6.148 6.742 -2.333 60 HD12 LEU 9 HD12 LEU 9 6.362 5.016 -1.931 61 HD13 LEU 9 HD13 LEU 9 7.380 5.784 -3.158 62 HD21 LEU 9 HD21 LEU 9 7.879 7.049 0.985 63 HD22 LEU 9 HD22 LEU 9 6.607 5.865 0.612 64 HD23 LEU 9 HD23 LEU 9 6.476 7.542 0.029 65 H GLN 10 H GLN 10 9.474 5.743 -4.200 66 HA GLN 10 HA GLN 10 11.779 7.761 -4.072 67 HB2 GLN 10 HB2 GLN 10 10.369 6.468 -6.478 68 HB3 GLN 10 HB3 GLN 10 11.610 7.692 -6.605 69 HG2 GLN 10 HG2 GLN 10 12.099 4.980 -5.190 70 HG3 GLN 10 HG3 GLN 10 12.232 5.223 -6.904 71 HE21 GLN 10 HE21 GLN 10 14.437 4.429 -6.333 72 HE22 GLN 10 HE22 GLN 10 15.690 5.678 -5.836 73 H SER 11 H SER 11 8.579 7.534 -5.628 74 HA SER 11 HA SER 11 8.091 10.499 -4.904 75 HB2 SER 11 HB2 SER 11 8.540 10.191 -7.341 76 HB3 SER 11 HB3 SER 11 7.208 9.049 -7.467 77 HG SER 11 HG SER 11 7.097 11.825 -6.867 78 H GLN 12 H GLN 12 6.207 11.047 -3.999 79 HA GLN 12 HA GLN 12 3.997 8.963 -3.599 80 HB2 GLN 12 HB2 GLN 12 5.642 9.220 -1.601 81 HB3 GLN 12 HB3 GLN 12 5.019 10.859 -1.395 82 HG2 GLN 12 HG2 GLN 12 2.796 10.049 -0.826 83 HG3 GLN 12 HG3 GLN 12 3.118 8.445 -1.436 84 HE21 GLN 12 HE21 GLN 12 4.989 10.440 0.952 85 HE22 GLN 12 HE22 GLN 12 4.735 9.208 2.283 86 H GLU 13 H GLU 13 2.322 9.774 -4.716 87 HA GLU 13 HA GLU 13 2.166 12.632 -5.454 88 HB2 GLU 13 HB2 GLU 13 1.852 10.579 -6.927 89 HB3 GLU 13 HB3 GLU 13 0.356 10.244 -6.079 90 HG2 GLU 13 HG2 GLU 13 -0.486 12.596 -6.965 91 HG3 GLU 13 HG3 GLU 13 0.978 12.630 -7.945 92 H ASN 14 H ASN 14 -0.997 11.396 -4.975 93 HA ASN 14 HA ASN 14 -1.702 13.701 -3.264 94 HB2 ASN 14 HB2 ASN 14 -3.385 11.381 -4.370 95 HB3 ASN 14 HB3 ASN 14 -4.062 12.629 -3.419 96 HD21 ASN 14 HD21 ASN 14 -3.214 11.836 -6.622 97 HD22 ASN 14 HD22 ASN 14 -3.590 13.521 -7.258 98 H PHE 15 H PHE 15 -0.046 12.642 -1.633 99 HA PHE 15 HA PHE 15 -1.311 11.040 0.528 100 HB2 PHE 15 HB2 PHE 15 1.186 11.288 0.011 101 HB3 PHE 15 HB3 PHE 15 1.165 12.864 0.739 102 HD1 PHE 15 HD1 PHE 15 0.741 13.065 3.254 103 HD2 PHE 15 HD2 PHE 15 1.188 9.238 1.364 104 HE1 PHE 15 HE1 PHE 15 1.329 12.040 5.411 105 HE2 PHE 15 HE2 PHE 15 1.794 8.242 3.519 106 HZ PHE 15 HZ PHE 15 1.846 9.638 5.558 107 H GLU 16 H GLU 16 -0.553 14.566 0.505 108 HA GLU 16 HA GLU 16 -2.009 15.354 2.876 109 HB2 GLU 16 HB2 GLU 16 -1.052 16.765 0.327 110 HB3 GLU 16 HB3 GLU 16 -2.194 17.629 1.292 111 HG2 GLU 16 HG2 GLU 16 0.355 16.504 2.630 112 HG3 GLU 16 HG3 GLU 16 0.343 18.040 1.763 113 H ALA 17 H ALA 17 -3.321 15.352 -0.447 114 HA ALA 17 HA ALA 17 -6.057 16.138 0.316 115 HB1 ALA 17 HB1 ALA 17 -5.067 14.646 -2.213 116 HB2 ALA 17 HB2 ALA 17 -6.611 15.508 -2.033 117 HB3 ALA 17 HB3 ALA 17 -5.096 16.415 -1.994 118 H PHE 18 H PHE 18 -4.600 12.897 0.061 119 HA PHE 18 HA PHE 18 -7.222 11.449 0.437 120 HB2 PHE 18 HB2 PHE 18 -5.278 10.542 -0.918 121 HB3 PHE 18 HB3 PHE 18 -4.323 10.399 0.523 122 HD1 PHE 18 HD2 PHE 18 -4.988 8.687 2.306 123 HD2 PHE 18 HD1 PHE 18 -6.955 8.830 -1.518 124 HE1 PHE 18 HE2 PHE 18 -5.697 6.351 2.574 125 HE2 PHE 18 HE1 PHE 18 -7.665 6.501 -1.230 126 HZ PHE 18 HZ PHE 18 -7.029 5.254 0.819 127 H MET 19 H MET 19 -4.344 11.939 2.576 128 HA MET 19 HA MET 19 -5.611 10.657 4.894 129 HB2 MET 19 HB2 MET 19 -3.207 12.545 4.709 130 HB3 MET 19 HB3 MET 19 -3.790 11.810 6.198 131 HG2 MET 19 HG2 MET 19 -1.903 10.503 5.315 132 HG3 MET 19 HG3 MET 19 -3.375 9.517 5.378 133 HE1 MET 19 HE1 MET 19 -1.210 8.155 3.262 134 HE2 MET 19 HE2 MET 19 -2.824 7.742 3.932 135 HE3 MET 19 HE3 MET 19 -2.573 7.822 2.167 136 H LYS 20 H LYS 20 -5.600 14.135 3.959 137 HA LYS 20 HA LYS 20 -7.311 14.918 6.289 138 HB2 LYS 20 HB2 LYS 20 -6.597 16.351 3.668 139 HB3 LYS 20 HB3 LYS 20 -7.904 16.936 4.674 140 HG2 LYS 20 HG2 LYS 20 -6.368 17.066 6.680 141 HG3 LYS 20 HG3 LYS 20 -5.006 16.594 5.686 142 HD2 LYS 20 HD2 LYS 20 -6.761 19.001 4.866 143 HD3 LYS 20 HD3 LYS 20 -5.665 19.207 6.190 144 HE2 LYS 20 HE2 LYS 20 -4.630 18.138 3.462 145 HE3 LYS 20 HE3 LYS 20 -4.887 19.863 3.737 146 HZ1 LYS 20 HZ1 LYS 20 -2.542 19.224 4.349 147 HZ2 LYS 20 HZ2 LYS 20 -3.056 18.150 5.416 148 HZ3 LYS 20 HZ3 LYS 20 -3.358 19.749 5.748 149 H ALA 21 H ALA 21 -8.187 13.847 2.902 150 HA ALA 21 HA ALA 21 -11.081 14.141 3.298 151 HB1 ALA 21 HB1 ALA 21 -11.239 12.630 1.300 152 HB2 ALA 21 HB2 ALA 21 -10.026 13.899 1.047 153 HB3 ALA 21 HB3 ALA 21 -9.508 12.240 1.434 154 H ILE 22 H ILE 22 -8.939 11.366 4.103 155 HA ILE 22 HA ILE 22 -11.319 9.790 5.146 156 HB ILE 22 HB ILE 22 -9.845 7.967 5.679 157 HG12 ILE 22 HG12 ILE 22 -7.446 9.431 4.463 158 HG13 ILE 22 HG13 ILE 22 -7.725 9.407 6.192 159 HG21 ILE 22 HG21 ILE 22 -9.296 7.246 3.374 160 HG22 ILE 22 HG22 ILE 22 -10.815 8.163 3.359 161 HG23 ILE 22 HG23 ILE 22 -9.308 8.928 2.804 162 HD11 ILE 22 HD11 ILE 22 -7.292 6.885 4.450 163 HD12 ILE 22 HD12 ILE 22 -6.110 7.636 5.541 164 HD13 ILE 22 HD13 ILE 22 -7.583 6.886 6.209 165 H GLY 23 H GLY 23 -9.615 12.251 6.536 166 HA2 GLY 23 HA2 GLY 23 -10.108 13.116 8.766 167 HA3 GLY 23 HA3 GLY 23 -10.723 11.564 9.263 168 H LEU 24 H LEU 24 -7.422 12.412 8.072 169 HA LEU 24 HA LEU 24 -6.340 11.632 10.814 170 HB2 LEU 24 HB2 LEU 24 -5.365 11.193 7.979 171 HB3 LEU 24 HB3 LEU 24 -4.138 11.683 9.090 172 HG LEU 24 HG LEU 24 -5.058 9.798 10.726 173 HD11 LEU 24 HD11 LEU 24 -7.169 9.281 9.443 174 HD12 LEU 24 HD12 LEU 24 -6.127 7.864 9.582 175 HD13 LEU 24 HD13 LEU 24 -6.206 8.762 8.045 176 HD21 LEU 24 HD21 LEU 24 -2.841 9.745 9.636 177 HD22 LEU 24 HD22 LEU 24 -3.555 9.071 8.146 178 HD23 LEU 24 HD23 LEU 24 -3.578 8.132 9.668 179 HA PRO 25 HA PRO 25 -4.848 15.670 11.819 180 HB2 PRO 25 HB2 PRO 25 -2.579 15.142 13.412 181 HB3 PRO 25 HB3 PRO 25 -4.237 14.939 13.888 182 HG2 PRO 25 HG2 PRO 25 -2.257 12.866 12.923 183 HG3 PRO 25 HG3 PRO 25 -3.474 12.657 14.197 184 HD2 PRO 25 HD2 PRO 25 -3.624 11.741 11.515 185 HD3 PRO 25 HD3 PRO 25 -5.054 11.930 12.552 186 H GLU 26 H GLU 26 -3.696 17.314 10.992 187 HA GLU 26 HA GLU 26 -1.866 17.056 8.801 188 HB2 GLU 26 HB2 GLU 26 -2.512 19.422 10.605 189 HB3 GLU 26 HB3 GLU 26 -1.534 19.503 9.180 190 HG2 GLU 26 HG2 GLU 26 -3.624 18.398 7.905 191 HG3 GLU 26 HG3 GLU 26 -4.540 18.885 9.318 192 H GLU 27 H GLU 27 -1.044 17.427 12.195 193 HA GLU 27 HA GLU 27 1.867 17.778 11.941 194 HB2 GLU 27 HB2 GLU 27 0.644 18.292 13.969 195 HB3 GLU 27 HB3 GLU 27 0.047 16.661 14.166 196 HG2 GLU 27 HG2 GLU 27 3.086 17.202 14.292 197 HG3 GLU 27 HG3 GLU 27 2.043 17.571 15.656 198 H LEU 28 H LEU 28 0.033 14.678 12.382 199 HA LEU 28 HA LEU 28 2.447 13.017 11.850 200 HB2 LEU 28 HB2 LEU 28 -0.442 12.052 11.613 201 HB3 LEU 28 HB3 LEU 28 0.998 11.073 11.780 202 HG LEU 28 HG LEU 28 -0.211 12.888 13.948 203 HD11 LEU 28 HD11 LEU 28 0.008 9.799 13.801 204 HD12 LEU 28 HD12 LEU 28 -1.475 10.720 13.475 205 HD13 LEU 28 HD13 LEU 28 -0.761 10.742 15.099 206 HD21 LEU 28 HD21 LEU 28 2.169 10.992 14.402 207 HD22 LEU 28 HD22 LEU 28 1.411 12.107 15.552 208 HD23 LEU 28 HD23 LEU 28 2.325 12.754 14.193 209 H ILE 29 H ILE 29 -0.058 14.296 9.731 210 HA ILE 29 HA ILE 29 0.689 12.777 7.300 211 HB ILE 29 HB ILE 29 -0.776 15.465 7.471 212 HG12 ILE 29 HG12 ILE 29 -1.986 12.668 7.024 213 HG13 ILE 29 HG13 ILE 29 -1.931 13.407 8.581 214 HG21 ILE 29 HG21 ILE 29 -0.731 13.511 5.063 215 HG22 ILE 29 HG22 ILE 29 -1.564 15.071 5.152 216 HG23 ILE 29 HG23 ILE 29 0.190 15.038 5.134 217 HD11 ILE 29 HD11 ILE 29 -3.345 15.364 7.825 218 HD12 ILE 29 HD12 ILE 29 -3.499 14.621 6.213 219 HD13 ILE 29 HD13 ILE 29 -4.173 13.810 7.634 220 H GLN 30 H GLN 30 1.570 16.069 8.438 221 HA GLN 30 HA GLN 30 3.613 16.618 6.390 222 HB2 GLN 30 HB2 GLN 30 2.938 17.760 9.137 223 HB3 GLN 30 HB3 GLN 30 4.514 18.106 8.528 224 HG2 GLN 30 HG2 GLN 30 2.667 19.850 8.033 225 HG3 GLN 30 HG3 GLN 30 3.832 19.463 6.795 226 HE21 GLN 30 HE21 GLN 30 0.557 18.345 7.718 227 HE22 GLN 30 HE22 GLN 30 0.037 18.253 5.945 228 H LYS 31 H LYS 31 3.837 14.503 9.130 229 HA LYS 31 HA LYS 31 6.866 14.270 8.991 230 HB2 LYS 31 HB2 LYS 31 4.668 12.816 10.583 231 HB3 LYS 31 HB3 LYS 31 6.312 12.227 10.555 232 HG2 LYS 31 HG2 LYS 31 7.207 14.292 11.559 233 HG3 LYS 31 HG3 LYS 31 5.636 15.102 11.447 234 HD2 LYS 31 HD2 LYS 31 4.579 13.533 12.995 235 HD3 LYS 31 HD3 LYS 31 5.985 12.465 13.004 236 HE2 LYS 31 HE2 LYS 31 7.384 14.164 14.177 237 HE3 LYS 31 HE3 LYS 31 6.078 15.376 14.066 238 HZ1 LYS 31 HZ1 LYS 31 4.632 14.053 15.404 239 HZ2 LYS 31 HZ2 LYS 31 6.060 14.002 16.256 240 HZ3 LYS 31 HZ3 LYS 31 5.632 12.665 15.347 241 H GLY 32 H GLY 32 4.107 12.031 8.250 242 HA2 GLY 32 HA2 GLY 32 5.887 10.102 6.821 243 HA3 GLY 32 HA3 GLY 32 4.152 10.007 6.884 244 H LYS 33 H LYS 33 4.427 12.967 5.519 245 HA LYS 33 HA LYS 33 3.946 11.995 2.826 246 HB2 LYS 33 HB2 LYS 33 3.766 14.288 2.123 247 HB3 LYS 33 HB3 LYS 33 2.940 14.042 3.643 248 HG2 LYS 33 HG2 LYS 33 4.750 15.150 4.920 249 HG3 LYS 33 HG3 LYS 33 5.744 15.329 3.502 250 HD2 LYS 33 HD2 LYS 33 2.958 16.593 3.721 251 HD3 LYS 33 HD3 LYS 33 4.391 17.394 4.309 252 HE2 LYS 33 HE2 LYS 33 4.122 16.459 1.360 253 HE3 LYS 33 HE3 LYS 33 3.584 18.036 1.920 254 HZ1 LYS 33 HZ1 LYS 33 6.030 17.900 1.028 255 HZ2 LYS 33 HZ2 LYS 33 6.467 17.125 2.375 256 HZ3 LYS 33 HZ3 LYS 33 5.879 18.639 2.506 257 H ASP 34 H ASP 34 7.004 13.430 3.987 258 HA ASP 34 HA ASP 34 8.257 12.967 1.232 259 HB2 ASP 34 HB2 ASP 34 9.301 14.625 3.607 260 HB3 ASP 34 HB3 ASP 34 9.999 14.561 2.002 261 H ILE 35 H ILE 35 8.254 11.126 4.021 262 HA ILE 35 HA ILE 35 11.156 10.451 4.189 263 HB ILE 35 HB ILE 35 8.723 9.077 5.440 264 HG12 ILE 35 HG12 ILE 35 10.870 10.822 6.826 265 HG13 ILE 35 HG13 ILE 35 9.361 11.478 6.237 266 HG21 ILE 35 HG21 ILE 35 11.707 8.510 6.074 267 HG22 ILE 35 HG22 ILE 35 10.316 7.841 6.957 268 HG23 ILE 35 HG23 ILE 35 10.583 7.381 5.283 269 HD11 ILE 35 HD11 ILE 35 9.543 9.338 8.459 270 HD12 ILE 35 HD12 ILE 35 9.135 11.057 8.637 271 HD13 ILE 35 HD13 ILE 35 8.032 9.982 7.770 272 H LYS 36 H LYS 36 12.160 9.401 2.587 273 HA LYS 36 HA LYS 36 10.856 7.412 0.782 274 HB2 LYS 36 HB2 LYS 36 13.819 8.196 1.095 275 HB3 LYS 36 HB3 LYS 36 13.217 7.022 -0.051 276 HG2 LYS 36 HG2 LYS 36 11.642 8.886 -0.996 277 HG3 LYS 36 HG3 LYS 36 12.596 10.036 -0.058 278 HD2 LYS 36 HD2 LYS 36 14.718 9.165 -1.238 279 HD3 LYS 36 HD3 LYS 36 13.720 8.007 -2.119 280 HE2 LYS 36 HE2 LYS 36 12.381 10.050 -3.072 281 HE3 LYS 36 HE3 LYS 36 13.607 11.096 -2.366 282 HZ1 LYS 36 HZ1 LYS 36 14.186 8.853 -4.349 283 HZ2 LYS 36 HZ2 LYS 36 15.330 9.832 -3.700 284 HZ3 LYS 36 HZ3 LYS 36 14.196 10.456 -4.720 285 H GLY 37 H GLY 37 10.081 6.146 2.679 286 HA2 GLY 37 HA2 GLY 37 11.955 4.227 4.003 287 HA3 GLY 37 HA3 GLY 37 10.210 4.234 4.154 288 H VAL 38 H VAL 38 11.279 1.928 4.191 289 HA VAL 38 HA VAL 38 11.346 0.607 1.460 290 HB VAL 38 HB VAL 38 11.877 -0.543 4.246 291 HG11 VAL 38 HG11 VAL 38 12.236 -1.935 1.508 292 HG12 VAL 38 HG12 VAL 38 12.825 -2.566 3.071 293 HG13 VAL 38 HG13 VAL 38 11.090 -2.411 2.782 294 HG21 VAL 38 HG21 VAL 38 14.285 -0.665 3.494 295 HG22 VAL 38 HG22 VAL 38 13.860 0.084 1.935 296 HG23 VAL 38 HG23 VAL 38 13.723 1.010 3.444 297 H SER 39 H SER 39 9.757 -0.547 0.591 298 HA SER 39 HA SER 39 7.332 -1.438 2.262 299 HB2 SER 39 HB2 SER 39 7.486 -0.475 -0.633 300 HB3 SER 39 HB3 SER 39 6.088 -1.301 0.030 301 HG SER 39 HG SER 39 5.791 0.926 0.168 302 H GLU 40 H GLU 40 7.998 -3.404 2.681 303 HA GLU 40 HA GLU 40 9.326 -5.231 0.695 304 HB2 GLU 40 HB2 GLU 40 9.820 -5.053 3.247 305 HB3 GLU 40 HB3 GLU 40 8.297 -5.836 3.506 306 HG2 GLU 40 HG2 GLU 40 9.051 -7.935 2.409 307 HG3 GLU 40 HG3 GLU 40 10.575 -7.190 1.937 308 H ILE 41 H ILE 41 8.522 -7.041 -0.234 309 HA ILE 41 HA ILE 41 5.837 -8.125 0.622 310 HB ILE 41 HB ILE 41 6.396 -7.725 -2.375 311 HG12 ILE 41 HG12 ILE 41 4.257 -6.156 -0.823 312 HG13 ILE 41 HG13 ILE 41 5.822 -5.505 -1.266 313 HG21 ILE 41 HG21 ILE 41 3.821 -8.728 -0.948 314 HG22 ILE 41 HG22 ILE 41 4.025 -8.534 -2.705 315 HG23 ILE 41 HG23 ILE 41 4.957 -9.755 -1.859 316 HD11 ILE 41 HD11 ILE 41 4.262 -4.776 -2.979 317 HD12 ILE 41 HD12 ILE 41 5.376 -5.935 -3.726 318 HD13 ILE 41 HD13 ILE 41 3.708 -6.420 -3.311 319 H VAL 42 H VAL 42 6.173 -10.276 0.946 320 HA VAL 42 HA VAL 42 8.248 -11.819 -0.716 321 HB VAL 42 HB VAL 42 6.928 -12.919 1.807 322 HG11 VAL 42 HG11 VAL 42 9.647 -13.580 0.499 323 HG12 VAL 42 HG12 VAL 42 8.922 -14.397 1.901 324 HG13 VAL 42 HG13 VAL 42 8.169 -14.544 0.302 325 HG21 VAL 42 HG21 VAL 42 8.025 -10.846 2.625 326 HG22 VAL 42 HG22 VAL 42 8.905 -12.273 3.181 327 HG23 VAL 42 HG23 VAL 42 9.550 -11.300 1.830 328 H GLN 43 H GLN 43 7.270 -12.676 -2.505 329 HA GLN 43 HA GLN 43 4.363 -13.390 -2.560 330 HB2 GLN 43 HB2 GLN 43 5.546 -12.249 -4.427 331 HB3 GLN 43 HB3 GLN 43 6.555 -13.659 -4.703 332 HG2 GLN 43 HG2 GLN 43 4.525 -15.026 -5.308 333 HG3 GLN 43 HG3 GLN 43 3.475 -13.674 -4.910 334 HE21 GLN 43 HE21 GLN 43 2.775 -14.287 -7.126 335 HE22 GLN 43 HE22 GLN 43 3.604 -13.439 -8.541 336 H ASN 44 H ASN 44 3.837 -15.191 -1.388 337 HA ASN 44 HA ASN 44 5.283 -17.857 -1.984 338 HB2 ASN 44 HB2 ASN 44 3.570 -17.123 0.475 339 HB3 ASN 44 HB3 ASN 44 4.384 -18.632 0.186 340 HD21 ASN 44 HD21 ASN 44 5.019 -15.237 0.863 341 HD22 ASN 44 HD22 ASN 44 6.657 -15.607 1.594 342 H GLY 45 H GLY 45 3.863 -17.501 -4.011 343 HA2 GLY 45 HA2 GLY 45 2.111 -18.476 -5.381 344 HA3 GLY 45 HA3 GLY 45 1.635 -19.485 -4.030 345 H LYS 46 H LYS 46 0.009 -18.727 -2.671 346 HA LYS 46 HA LYS 46 -1.753 -16.430 -3.649 347 HB2 LYS 46 HB2 LYS 46 -2.267 -18.652 -1.573 348 HB3 LYS 46 HB3 LYS 46 -3.367 -17.329 -1.882 349 HG2 LYS 46 HG2 LYS 46 -3.716 -18.065 -4.264 350 HG3 LYS 46 HG3 LYS 46 -2.524 -19.325 -4.054 351 HD2 LYS 46 HD2 LYS 46 -4.242 -20.694 -3.592 352 HD3 LYS 46 HD3 LYS 46 -4.168 -20.088 -1.970 353 HE2 LYS 46 HE2 LYS 46 -6.083 -19.118 -4.227 354 HE3 LYS 46 HE3 LYS 46 -6.500 -20.243 -2.942 355 HZ1 LYS 46 HZ1 LYS 46 -7.254 -18.120 -2.128 356 HZ2 LYS 46 HZ2 LYS 46 -5.937 -17.313 -2.687 357 HZ3 LYS 46 HZ3 LYS 46 -5.817 -18.283 -1.346 358 H HIS 47 H HIS 47 0.365 -17.239 -0.889 359 HA HIS 47 HA HIS 47 -0.762 -14.960 0.792 360 HB2 HIS 47 HB2 HIS 47 1.246 -17.199 1.456 361 HB3 HIS 47 HB3 HIS 47 0.952 -15.846 2.521 362 HD1 HIS 47 HD1 HIS 47 -0.732 -19.107 1.393 363 HD2 HIS 47 HD2 HIS 47 -1.468 -15.606 3.743 364 HE1 HIS 47 HE1 HIS 47 -2.883 -19.405 2.799 365 H PHE 48 H PHE 48 -0.032 -13.044 0.312 366 HA PHE 48 HA PHE 48 2.888 -12.539 -0.491 367 HB2 PHE 48 HB2 PHE 48 0.276 -10.973 -0.801 368 HB3 PHE 48 HB3 PHE 48 1.817 -10.211 -0.982 369 HD1 PHE 48 HD1 PHE 48 0.358 -13.510 -2.368 370 HD2 PHE 48 HD2 PHE 48 2.174 -9.702 -3.201 371 HE1 PHE 48 HE1 PHE 48 0.261 -13.976 -4.770 372 HE2 PHE 48 HE2 PHE 48 2.038 -10.181 -5.596 373 HZ PHE 48 HZ PHE 48 1.109 -12.296 -6.395 374 H LYS 49 H LYS 49 4.045 -12.349 1.356 375 HA LYS 49 HA LYS 49 2.891 -11.078 3.862 376 HB2 LYS 49 HB2 LYS 49 5.656 -12.315 3.429 377 HB3 LYS 49 HB3 LYS 49 5.067 -11.693 4.952 378 HG2 LYS 49 HG2 LYS 49 3.274 -13.361 5.078 379 HG3 LYS 49 HG3 LYS 49 3.588 -13.922 3.451 380 HD2 LYS 49 HD2 LYS 49 6.050 -14.468 4.359 381 HD3 LYS 49 HD3 LYS 49 5.368 -14.271 5.960 382 HE2 LYS 49 HE2 LYS 49 4.429 -16.280 3.785 383 HE3 LYS 49 HE3 LYS 49 5.498 -16.666 5.127 384 HZ1 LYS 49 HZ1 LYS 49 3.210 -17.283 5.835 385 HZ2 LYS 49 HZ2 LYS 49 2.557 -15.845 5.378 386 HZ3 LYS 49 HZ3 LYS 49 3.501 -15.874 6.648 387 H PHE 50 H PHE 50 2.968 -8.989 4.135 388 HA PHE 50 HA PHE 50 5.214 -7.413 2.803 389 HB2 PHE 50 HB2 PHE 50 3.910 -5.527 2.448 390 HB3 PHE 50 HB3 PHE 50 3.138 -6.914 1.772 391 HD1 PHE 50 HD2 PHE 50 2.705 -5.473 5.364 392 HD2 PHE 50 HD1 PHE 50 1.053 -5.959 1.428 393 HE1 PHE 50 HE2 PHE 50 0.661 -4.389 6.087 394 HE2 PHE 50 HE1 PHE 50 -1.005 -4.885 2.167 395 HZ PHE 50 HZ PHE 50 -1.217 -4.082 4.508 396 H THR 51 H THR 51 6.341 -5.869 3.686 397 HA THR 51 HA THR 51 5.823 -5.107 6.638 398 HB THR 51 HB THR 51 8.666 -5.343 5.520 399 HG1 THR 51 HG1 THR 51 8.617 -7.374 5.836 400 HG21 THR 51 HG21 THR 51 8.471 -3.885 7.492 401 HG22 THR 51 HG22 THR 51 9.345 -5.387 7.875 402 HG23 THR 51 HG23 THR 51 7.666 -5.191 8.407 403 H ILE 52 H ILE 52 4.747 -3.219 6.125 404 HA ILE 52 HA ILE 52 5.947 -1.355 4.027 405 HB ILE 52 HB ILE 52 3.127 -1.402 5.175 406 HG12 ILE 52 HG12 ILE 52 3.392 -3.383 3.842 407 HG13 ILE 52 HG13 ILE 52 2.351 -2.278 2.987 408 HG21 ILE 52 HG21 ILE 52 2.477 0.134 3.308 409 HG22 ILE 52 HG22 ILE 52 3.638 0.904 4.387 410 HG23 ILE 52 HG23 ILE 52 4.177 0.281 2.807 411 HD11 ILE 52 HD11 ILE 52 5.324 -2.888 2.326 412 HD12 ILE 52 HD12 ILE 52 3.912 -3.414 1.408 413 HD13 ILE 52 HD13 ILE 52 4.334 -1.687 1.450 414 H THR 53 H THR 53 6.699 0.548 4.450 415 HA THR 53 HA THR 53 6.751 1.641 7.281 416 HB THR 53 HB THR 53 8.387 3.340 6.344 417 HG1 THR 53 HG1 THR 53 8.623 1.509 4.196 418 HG21 THR 53 HG21 THR 53 10.322 1.776 6.271 419 HG22 THR 53 HG22 THR 53 9.228 0.377 6.124 420 HG23 THR 53 HG23 THR 53 9.227 1.364 7.605 421 H ALA 54 H ALA 54 5.075 2.739 7.795 422 HA ALA 54 HA ALA 54 3.800 4.876 5.970 423 HB1 ALA 54 HB1 ALA 54 2.890 3.550 8.625 424 HB2 ALA 54 HB2 ALA 54 1.995 4.814 7.773 425 HB3 ALA 54 HB3 ALA 54 2.236 3.233 6.995 426 H GLY 55 H GLY 55 6.027 5.796 6.275 427 HA2 GLY 55 HA2 GLY 55 7.192 7.795 6.962 428 HA3 GLY 55 HA3 GLY 55 5.948 8.172 8.140 429 H SER 56 H SER 56 6.126 7.310 10.188 430 HA SER 56 HA SER 56 8.820 6.164 11.060 431 HB2 SER 56 HB2 SER 56 6.540 7.185 12.853 432 HB3 SER 56 HB3 SER 56 8.155 6.727 13.366 433 HG SER 56 HG SER 56 7.615 9.086 12.966 434 H LYS 57 H LYS 57 5.402 5.135 10.919 435 HA LYS 57 HA LYS 57 5.877 2.820 12.794 436 HB2 LYS 57 HB2 LYS 57 3.701 4.157 12.783 437 HB3 LYS 57 HB3 LYS 57 3.331 3.486 11.201 438 HG2 LYS 57 HG2 LYS 57 3.520 1.111 12.298 439 HG3 LYS 57 HG3 LYS 57 3.701 1.918 13.852 440 HD2 LYS 57 HD2 LYS 57 1.397 2.990 13.514 441 HD3 LYS 57 HD3 LYS 57 1.271 2.179 11.949 442 HE2 LYS 57 HE2 LYS 57 1.568 -0.102 13.168 443 HE3 LYS 57 HE3 LYS 57 1.534 0.764 14.708 444 HZ1 LYS 57 HZ1 LYS 57 -0.710 0.564 12.657 445 HZ2 LYS 57 HZ2 LYS 57 -0.793 1.645 13.919 446 HZ3 LYS 57 HZ3 LYS 57 -0.758 -0.007 14.109 447 H VAL 58 H VAL 58 6.397 0.840 12.215 448 HA VAL 58 HA VAL 58 6.446 -0.058 9.312 449 HB VAL 58 HB VAL 58 7.512 -1.472 11.821 450 HG11 VAL 58 HG11 VAL 58 7.934 -2.134 8.828 451 HG12 VAL 58 HG12 VAL 58 8.753 -2.948 10.187 452 HG13 VAL 58 HG13 VAL 58 7.003 -3.115 9.982 453 HG21 VAL 58 HG21 VAL 58 8.870 0.606 11.303 454 HG22 VAL 58 HG22 VAL 58 9.804 -0.862 10.979 455 HG23 VAL 58 HG23 VAL 58 9.092 0.057 9.630 456 H ILE 59 H ILE 59 4.541 -0.756 8.584 457 HA ILE 59 HA ILE 59 2.549 -2.225 10.415 458 HB ILE 59 HB ILE 59 2.056 -0.841 7.722 459 HG12 ILE 59 HG12 ILE 59 1.103 0.016 10.534 460 HG13 ILE 59 HG13 ILE 59 2.466 0.742 9.699 461 HG21 ILE 59 HG21 ILE 59 0.007 -2.159 9.647 462 HG22 ILE 59 HG22 ILE 59 -0.391 -1.286 8.152 463 HG23 ILE 59 HG23 ILE 59 0.494 -2.804 8.056 464 HD11 ILE 59 HD11 ILE 59 -0.476 0.916 8.828 465 HD12 ILE 59 HD12 ILE 59 0.607 2.223 9.342 466 HD13 ILE 59 HD13 ILE 59 0.873 1.421 7.774 467 H GLN 60 H GLN 60 3.246 -4.307 10.367 468 HA GLN 60 HA GLN 60 3.695 -5.641 7.675 469 HB2 GLN 60 HB2 GLN 60 5.085 -7.244 8.653 470 HB3 GLN 60 HB3 GLN 60 5.646 -5.643 9.036 471 HG2 GLN 60 HG2 GLN 60 4.151 -7.467 11.017 472 HG3 GLN 60 HG3 GLN 60 5.893 -7.385 10.868 473 HE21 GLN 60 HE21 GLN 60 6.974 -5.492 11.701 474 HE22 GLN 60 HE22 GLN 60 6.040 -4.287 12.739 475 H ASN 61 H ASN 61 2.414 -7.032 6.959 476 HA ASN 61 HA ASN 61 0.534 -8.756 8.451 477 HB2 ASN 61 HB2 ASN 61 -0.746 -6.480 6.774 478 HB3 ASN 61 HB3 ASN 61 -1.591 -7.920 7.273 479 HD21 ASN 61 HD21 ASN 61 -0.248 -4.968 8.515 480 HD22 ASN 61 HD22 ASN 61 -1.189 -5.074 10.079 481 H GLU 62 H GLU 62 -0.728 -10.177 6.842 482 HA GLU 62 HA GLU 62 0.694 -10.320 4.152 483 HB2 GLU 62 HB2 GLU 62 1.049 -12.578 4.164 484 HB3 GLU 62 HB3 GLU 62 1.686 -11.945 5.673 485 HG2 GLU 62 HG2 GLU 62 -0.276 -12.973 6.928 486 HG3 GLU 62 HG3 GLU 62 -0.923 -13.594 5.406 487 H PHE 63 H PHE 63 -0.444 -10.518 2.425 488 HA PHE 63 HA PHE 63 -3.454 -10.845 2.720 489 HB2 PHE 63 HB2 PHE 63 -3.929 -9.649 0.748 490 HB3 PHE 63 HB3 PHE 63 -3.107 -8.727 1.937 491 HD1 PHE 63 HD1 PHE 63 -0.752 -7.859 1.432 492 HD2 PHE 63 HD2 PHE 63 -2.897 -10.217 -1.452 493 HE1 PHE 63 HE1 PHE 63 0.782 -7.098 -0.370 494 HE2 PHE 63 HE2 PHE 63 -1.390 -9.411 -3.224 495 HZ PHE 63 HZ PHE 63 0.447 -7.842 -2.666 496 H THR 64 H THR 64 -4.514 -12.348 1.850 497 HA THR 64 HA THR 64 -3.122 -14.501 0.232 498 HB THR 64 HB THR 64 -5.899 -14.623 1.542 499 HG1 THR 64 HG1 THR 64 -3.883 -16.000 2.748 500 HG21 THR 64 HG21 THR 64 -5.470 -16.440 -0.136 501 HG22 THR 64 HG22 THR 64 -5.489 -17.101 1.515 502 HG23 THR 64 HG23 THR 64 -3.933 -16.863 0.672 503 H VAL 65 H VAL 65 -3.257 -14.230 -1.921 504 HA VAL 65 HA VAL 65 -5.351 -12.651 -3.288 505 HB VAL 65 HB VAL 65 -3.222 -14.519 -4.395 506 HG11 VAL 65 HG11 VAL 65 -5.007 -14.285 -6.162 507 HG12 VAL 65 HG12 VAL 65 -4.817 -12.517 -6.112 508 HG13 VAL 65 HG13 VAL 65 -3.474 -13.547 -6.640 509 HG21 VAL 65 HG21 VAL 65 -3.315 -11.412 -4.302 510 HG22 VAL 65 HG22 VAL 65 -2.272 -12.438 -3.292 511 HG23 VAL 65 HG23 VAL 65 -2.014 -12.368 -5.042 512 H GLY 66 H GLY 66 -7.369 -13.294 -3.618 513 HA2 GLY 66 HA2 GLY 66 -9.146 -14.760 -4.511 514 HA3 GLY 66 HA3 GLY 66 -8.092 -16.148 -4.472 515 H GLU 67 H GLU 67 -7.871 -14.859 -1.391 516 HA GLU 67 HA GLU 67 -10.438 -15.910 -0.334 517 HB2 GLU 67 HB2 GLU 67 -7.759 -17.279 0.443 518 HB3 GLU 67 HB3 GLU 67 -9.116 -17.294 1.535 519 HG2 GLU 67 HG2 GLU 67 -9.345 -18.467 -1.310 520 HG3 GLU 67 HG3 GLU 67 -8.910 -19.399 0.121 521 H GLU 68 H GLU 68 -10.843 -15.296 1.876 522 HA GLU 68 HA GLU 68 -10.351 -12.550 2.270 523 HB2 GLU 68 HB2 GLU 68 -11.432 -12.639 4.397 524 HB3 GLU 68 HB3 GLU 68 -12.302 -13.550 3.200 525 HG2 GLU 68 HG2 GLU 68 -12.043 -15.595 4.310 526 HG3 GLU 68 HG3 GLU 68 -10.407 -15.244 4.826 527 H CYS 69 H CYS 69 -8.961 -11.243 3.164 528 HA CYS 69 HA CYS 69 -6.959 -12.209 5.248 529 HB2 CYS 69 HB2 CYS 69 -5.114 -10.934 3.984 530 HB3 CYS 69 HB3 CYS 69 -5.641 -12.514 3.399 531 HG CYS 69 HG CYS 69 -6.945 -11.742 1.353 532 H GLU 70 H GLU 70 -6.667 -10.941 6.784 533 HA GLU 70 HA GLU 70 -8.035 -8.258 6.962 534 HB2 GLU 70 HB2 GLU 70 -7.766 -8.350 9.365 535 HB3 GLU 70 HB3 GLU 70 -8.741 -9.615 8.681 536 HG2 GLU 70 HG2 GLU 70 -6.918 -11.305 8.962 537 HG3 GLU 70 HG3 GLU 70 -5.824 -10.025 9.461 538 H LEU 71 H LEU 71 -6.993 -6.502 6.461 539 HA LEU 71 HA LEU 71 -4.023 -6.148 7.229 540 HB2 LEU 71 HB2 LEU 71 -5.533 -4.820 4.902 541 HB3 LEU 71 HB3 LEU 71 -3.841 -4.602 5.295 542 HG LEU 71 HG LEU 71 -5.145 -7.181 4.230 543 HD11 LEU 71 HD11 LEU 71 -4.866 -5.284 2.581 544 HD12 LEU 71 HD12 LEU 71 -3.833 -6.654 2.161 545 HD13 LEU 71 HD13 LEU 71 -3.135 -5.216 2.936 546 HD21 LEU 71 HD21 LEU 71 -2.796 -8.103 4.028 547 HD22 LEU 71 HD22 LEU 71 -3.253 -7.846 5.706 548 HD23 LEU 71 HD23 LEU 71 -2.159 -6.693 4.895 549 H GLU 72 H GLU 72 -3.422 -4.322 8.326 550 HA GLU 72 HA GLU 72 -5.468 -2.655 9.707 551 HB2 GLU 72 HB2 GLU 72 -3.150 -3.326 10.608 552 HB3 GLU 72 HB3 GLU 72 -2.420 -2.217 9.452 553 HG2 GLU 72 HG2 GLU 72 -3.819 -0.304 10.604 554 HG3 GLU 72 HG3 GLU 72 -4.289 -1.486 11.819 555 H THR 73 H THR 73 -6.090 -0.691 9.413 556 HA THR 73 HA THR 73 -5.489 0.802 6.806 557 HB THR 73 HB THR 73 -7.694 -0.023 6.656 558 HG1 THR 73 HG1 THR 73 -8.625 2.360 7.504 559 HG21 THR 73 HG21 THR 73 -9.578 0.511 8.286 560 HG22 THR 73 HG22 THR 73 -8.361 1.177 9.411 561 HG23 THR 73 HG23 THR 73 -8.364 -0.559 8.993 562 H MET 74 H MET 74 -5.939 3.048 6.934 563 HA MET 74 HA MET 74 -4.464 4.415 9.243 564 HB2 MET 74 HB2 MET 74 -5.453 5.508 6.541 565 HB3 MET 74 HB3 MET 74 -4.947 6.574 7.834 566 HG2 MET 74 HG2 MET 74 -3.114 4.459 6.553 567 HG3 MET 74 HG3 MET 74 -3.098 6.195 6.234 568 HE1 MET 74 HE1 MET 74 -0.801 4.128 9.471 569 HE2 MET 74 HE2 MET 74 -2.297 3.355 8.858 570 HE3 MET 74 HE3 MET 74 -0.991 3.802 7.720 571 H THR 75 H THR 75 -7.643 4.936 7.639 572 HA THR 75 HA THR 75 -8.807 5.752 10.357 573 HB THR 75 HB THR 75 -10.144 5.984 7.618 574 HG1 THR 75 HG1 THR 75 -9.807 8.303 8.210 575 HG21 THR 75 HG21 THR 75 -10.948 7.245 10.330 576 HG22 THR 75 HG22 THR 75 -11.808 5.896 9.544 577 HG23 THR 75 HG23 THR 75 -11.773 7.490 8.774 578 H GLY 76 H GLY 76 -9.727 4.175 11.408 579 HA2 GLY 76 HA2 GLY 76 -11.718 2.472 11.252 580 HA3 GLY 76 HA3 GLY 76 -10.842 1.642 10.006 581 H GLU 77 H GLU 77 -9.401 0.012 10.645 582 HA GLU 77 HA GLU 77 -8.617 -0.559 13.360 583 HB2 GLU 77 HB2 GLU 77 -10.156 -2.189 14.152 584 HB3 GLU 77 HB3 GLU 77 -10.923 -0.644 13.962 585 HG2 GLU 77 HG2 GLU 77 -11.483 -3.206 12.363 586 HG3 GLU 77 HG3 GLU 77 -12.512 -2.256 13.398 587 H LYS 78 H LYS 78 -10.086 -2.721 11.053 588 HA LYS 78 HA LYS 78 -7.601 -3.565 9.755 589 HB2 LYS 78 HB2 LYS 78 -7.800 -4.781 12.260 590 HB3 LYS 78 HB3 LYS 78 -8.735 -5.943 11.344 591 HG2 LYS 78 HG2 LYS 78 -6.731 -6.113 9.703 592 HG3 LYS 78 HG3 LYS 78 -5.894 -4.932 10.720 593 HD2 LYS 78 HD2 LYS 78 -6.068 -6.554 12.701 594 HD3 LYS 78 HD3 LYS 78 -6.910 -7.701 11.658 595 HE2 LYS 78 HE2 LYS 78 -4.806 -7.692 10.102 596 HE3 LYS 78 HE3 LYS 78 -3.972 -6.719 11.309 597 HZ1 LYS 78 HZ1 LYS 78 -4.365 -8.558 12.961 598 HZ2 LYS 78 HZ2 LYS 78 -3.680 -9.236 11.612 599 HZ3 LYS 78 HZ3 LYS 78 -5.314 -9.392 11.901 600 H VAL 79 H VAL 79 -8.227 -3.951 7.779 601 HA VAL 79 HA VAL 79 -11.164 -4.573 7.247 602 HB VAL 79 HB VAL 79 -10.229 -2.415 6.483 603 HG11 VAL 79 HG11 VAL 79 -8.868 -2.179 4.436 604 HG12 VAL 79 HG12 VAL 79 -7.928 -2.973 5.704 605 HG13 VAL 79 HG13 VAL 79 -8.591 -3.933 4.367 606 HG21 VAL 79 HG21 VAL 79 -11.221 -4.144 4.143 607 HG22 VAL 79 HG22 VAL 79 -12.260 -3.420 5.402 608 HG23 VAL 79 HG23 VAL 79 -11.338 -2.376 4.309 609 H LYS 80 H LYS 80 -11.788 -6.431 6.362 610 HA LYS 80 HA LYS 80 -9.754 -8.435 5.355 611 HB2 LYS 80 HB2 LYS 80 -12.730 -8.758 5.946 612 HB3 LYS 80 HB3 LYS 80 -11.802 -9.945 5.045 613 HG2 LYS 80 HG2 LYS 80 -10.078 -10.019 6.936 614 HG3 LYS 80 HG3 LYS 80 -11.140 -9.004 7.914 615 HD2 LYS 80 HD2 LYS 80 -12.931 -10.820 7.770 616 HD3 LYS 80 HD3 LYS 80 -11.877 -11.754 6.712 617 HE2 LYS 80 HE2 LYS 80 -10.086 -11.768 8.638 618 HE3 LYS 80 HE3 LYS 80 -11.296 -11.039 9.689 619 HZ1 LYS 80 HZ1 LYS 80 -11.450 -13.514 9.856 620 HZ2 LYS 80 HZ2 LYS 80 -11.519 -13.696 8.210 621 HZ3 LYS 80 HZ3 LYS 80 -12.795 -13.054 8.980 622 H THR 81 H THR 81 -8.967 -7.537 3.634 623 HA THR 81 HA THR 81 -10.741 -6.818 1.226 624 HB THR 81 HB THR 81 -9.605 -4.923 2.279 625 HG1 THR 81 HG1 THR 81 -8.597 -5.593 -0.287 626 HG21 THR 81 HG21 THR 81 -7.422 -6.116 3.087 627 HG22 THR 81 HG22 THR 81 -7.208 -4.552 2.319 628 HG23 THR 81 HG23 THR 81 -6.855 -6.025 1.403 629 H VAL 82 H VAL 82 -10.750 -8.533 -0.121 630 HA VAL 82 HA VAL 82 -8.308 -10.302 -0.360 631 HB VAL 82 HB VAL 82 -10.456 -11.478 -0.147 632 HG11 VAL 82 HG11 VAL 82 -11.788 -12.020 -2.199 633 HG12 VAL 82 HG12 VAL 82 -11.996 -10.309 -1.743 634 HG13 VAL 82 HG13 VAL 82 -10.936 -10.754 -3.112 635 HG21 VAL 82 HG21 VAL 82 -8.887 -12.154 -2.721 636 HG22 VAL 82 HG22 VAL 82 -8.358 -12.538 -1.072 637 HG23 VAL 82 HG23 VAL 82 -9.853 -13.252 -1.706 638 H VAL 83 H VAL 83 -7.006 -10.414 -2.048 639 HA VAL 83 HA VAL 83 -7.180 -8.134 -4.070 640 HB VAL 83 HB VAL 83 -4.632 -9.625 -3.261 641 HG11 VAL 83 HG11 VAL 83 -3.505 -7.560 -4.069 642 HG12 VAL 83 HG12 VAL 83 -4.515 -8.234 -5.365 643 HG13 VAL 83 HG13 VAL 83 -5.065 -6.803 -4.468 644 HG21 VAL 83 HG21 VAL 83 -4.056 -7.635 -1.751 645 HG22 VAL 83 HG22 VAL 83 -5.735 -7.094 -1.854 646 HG23 VAL 83 HG23 VAL 83 -5.357 -8.649 -1.114 647 H GLN 84 H GLN 84 -7.328 -8.516 -6.177 648 HA GLN 84 HA GLN 84 -7.019 -11.389 -7.245 649 HB2 GLN 84 HB2 GLN 84 -8.704 -9.023 -8.200 650 HB3 GLN 84 HB3 GLN 84 -8.265 -10.286 -9.309 651 HG2 GLN 84 HG2 GLN 84 -10.491 -10.725 -8.462 652 HG3 GLN 84 HG3 GLN 84 -9.413 -12.033 -8.054 653 HE21 GLN 84 HE21 GLN 84 -9.284 -12.578 -5.881 654 HE22 GLN 84 HE22 GLN 84 -10.221 -11.661 -4.586 655 H LEU 85 H LEU 85 -5.673 -11.822 -8.911 656 HA LEU 85 HA LEU 85 -3.565 -9.713 -9.569 657 HB2 LEU 85 HB2 LEU 85 -2.812 -11.478 -8.015 658 HB3 LEU 85 HB3 LEU 85 -3.339 -12.737 -9.117 659 HG LEU 85 HG LEU 85 -1.658 -12.068 -10.787 660 HD11 LEU 85 HD11 LEU 85 -0.625 -10.019 -8.702 661 HD12 LEU 85 HD12 LEU 85 -1.355 -9.615 -10.275 662 HD13 LEU 85 HD13 LEU 85 0.188 -10.452 -10.205 663 HD21 LEU 85 HD21 LEU 85 0.373 -12.867 -9.484 664 HD22 LEU 85 HD22 LEU 85 -1.077 -13.822 -9.121 665 HD23 LEU 85 HD23 LEU 85 -0.513 -12.594 -7.965 666 H GLU 86 H GLU 86 -3.448 -9.142 -11.618 667 HA GLU 86 HA GLU 86 -4.183 -11.113 -13.867 668 HB2 GLU 86 HB2 GLU 86 -5.503 -8.922 -13.722 669 HB3 GLU 86 HB3 GLU 86 -3.998 -8.087 -14.061 670 HG2 GLU 86 HG2 GLU 86 -3.842 -9.387 -16.301 671 HG3 GLU 86 HG3 GLU 86 -5.465 -10.001 -15.972 672 H GLY 87 H GLY 87 -2.658 -11.742 -15.106 673 HA2 GLY 87 HA2 GLY 87 -0.465 -12.256 -16.064 674 HA3 GLY 87 HA3 GLY 87 -0.383 -10.517 -16.189 675 H ASP 88 H ASP 88 -0.240 -11.791 -13.108 676 HA ASP 88 HA ASP 88 1.392 -11.797 -11.406 677 HB2 ASP 88 HB2 ASP 88 2.471 -13.591 -12.861 678 HB3 ASP 88 HB3 ASP 88 3.594 -12.365 -13.429 679 H ASN 89 H ASN 89 0.733 -9.303 -12.899 680 HA ASN 89 HA ASN 89 2.678 -7.582 -11.320 681 HB2 ASN 89 HB2 ASN 89 3.396 -6.256 -12.990 682 HB3 ASN 89 HB3 ASN 89 3.444 -7.809 -13.752 683 HD21 ASN 89 HD21 ASN 89 3.149 -4.912 -14.661 684 HD22 ASN 89 HD22 ASN 89 1.798 -5.054 -15.913 685 H LYS 90 H LYS 90 -0.638 -7.668 -12.554 686 HA LYS 90 HA LYS 90 -1.172 -4.961 -11.197 687 HB2 LYS 90 HB2 LYS 90 -2.877 -6.675 -13.054 688 HB3 LYS 90 HB3 LYS 90 -3.409 -5.149 -12.394 689 HG2 LYS 90 HG2 LYS 90 -1.799 -3.866 -13.707 690 HG3 LYS 90 HG3 LYS 90 -0.896 -5.313 -14.166 691 HD2 LYS 90 HD2 LYS 90 -2.954 -6.221 -15.340 692 HD3 LYS 90 HD3 LYS 90 -3.832 -4.751 -15.008 693 HE2 LYS 90 HE2 LYS 90 -1.207 -4.947 -16.667 694 HE3 LYS 90 HE3 LYS 90 -2.833 -5.024 -17.348 695 HZ1 LYS 90 HZ1 LYS 90 -2.028 -2.681 -17.456 696 HZ2 LYS 90 HZ2 LYS 90 -1.672 -2.607 -15.851 697 HZ3 LYS 90 HZ3 LYS 90 -3.240 -2.725 -16.336 698 H LEU 91 H LEU 91 -1.613 -5.215 -9.078 699 HA LEU 91 HA LEU 91 -3.466 -7.467 -8.099 700 HB2 LEU 91 HB2 LEU 91 -1.488 -5.609 -6.714 701 HB3 LEU 91 HB3 LEU 91 -2.636 -6.499 -5.788 702 HG LEU 91 HG LEU 91 -0.568 -7.826 -7.635 703 HD11 LEU 91 HD11 LEU 91 0.503 -6.558 -5.747 704 HD12 LEU 91 HD12 LEU 91 0.663 -8.300 -5.474 705 HD13 LEU 91 HD13 LEU 91 -0.562 -7.359 -4.581 706 HD21 LEU 91 HD21 LEU 91 -2.571 -9.323 -7.135 707 HD22 LEU 91 HD22 LEU 91 -2.299 -9.103 -5.394 708 HD23 LEU 91 HD23 LEU 91 -1.084 -9.929 -6.381 709 H VAL 92 H VAL 92 -5.566 -6.899 -8.011 710 HA VAL 92 HA VAL 92 -6.336 -4.025 -7.240 711 HB VAL 92 HB VAL 92 -8.383 -4.255 -8.482 712 HG11 VAL 92 HG11 VAL 92 -6.018 -4.946 -10.326 713 HG12 VAL 92 HG12 VAL 92 -7.492 -4.049 -10.763 714 HG13 VAL 92 HG13 VAL 92 -6.317 -3.346 -9.629 715 HG21 VAL 92 HG21 VAL 92 -8.843 -6.083 -10.131 716 HG22 VAL 92 HG22 VAL 92 -7.457 -7.012 -9.514 717 HG23 VAL 92 HG23 VAL 92 -8.865 -6.701 -8.471 718 H THR 93 H THR 93 -7.367 -3.655 -5.372 719 HA THR 93 HA THR 93 -9.283 -5.765 -4.303 720 HB THR 93 HB THR 93 -7.014 -6.087 -3.269 721 HG1 THR 93 HG1 THR 93 -8.771 -6.958 -2.324 722 HG21 THR 93 HG21 THR 93 -6.216 -3.804 -2.711 723 HG22 THR 93 HG22 THR 93 -6.403 -4.755 -1.228 724 HG23 THR 93 HG23 THR 93 -7.620 -3.534 -1.636 725 H THR 94 H THR 94 -10.389 -4.999 -2.305 726 HA THR 94 HA THR 94 -11.613 -2.208 -2.752 727 HB THR 94 HB THR 94 -13.201 -4.728 -1.977 728 HG1 THR 94 HG1 THR 94 -14.178 -4.439 -3.953 729 HG21 THR 94 HG21 THR 94 -14.200 -2.614 -1.014 730 HG22 THR 94 HG22 THR 94 -15.230 -3.280 -2.292 731 HG23 THR 94 HG23 THR 94 -14.202 -1.865 -2.629 732 H PHE 95 H PHE 95 -10.640 -1.177 -1.096 733 HA PHE 95 HA PHE 95 -10.078 -2.560 1.548 734 HB2 PHE 95 HB2 PHE 95 -8.507 -1.029 -0.082 735 HB3 PHE 95 HB3 PHE 95 -9.333 0.271 0.698 736 HD1 PHE 95 HD2 PHE 95 -7.147 -2.665 1.209 737 HD2 PHE 95 HD1 PHE 95 -8.473 1.059 2.890 738 HE1 PHE 95 HE2 PHE 95 -5.440 -2.847 2.972 739 HE2 PHE 95 HE1 PHE 95 -6.737 0.894 4.609 740 HZ PHE 95 HZ PHE 95 -5.241 -1.080 4.695 741 H LYS 96 H LYS 96 -10.317 0.398 2.736 742 HA LYS 96 HA LYS 96 -13.170 0.096 3.768 743 HB2 LYS 96 HB2 LYS 96 -11.052 2.238 4.392 744 HB3 LYS 96 HB3 LYS 96 -12.605 2.137 5.165 745 HG2 LYS 96 HG2 LYS 96 -10.453 -0.066 5.363 746 HG3 LYS 96 HG3 LYS 96 -10.559 1.287 6.451 747 HD2 LYS 96 HD2 LYS 96 -12.808 -0.813 6.123 748 HD3 LYS 96 HD3 LYS 96 -11.512 -0.891 7.305 749 HE2 LYS 96 HE2 LYS 96 -12.292 1.425 8.220 750 HE3 LYS 96 HE3 LYS 96 -13.736 1.245 7.224 751 HZ1 LYS 96 HZ1 LYS 96 -12.819 -0.808 9.321 752 HZ2 LYS 96 HZ2 LYS 96 -14.191 -0.939 8.428 753 HZ3 LYS 96 HZ3 LYS 96 -13.991 0.226 9.581 754 H ASN 97 H ASN 97 -14.305 0.458 1.740 755 HA ASN 97 HA ASN 97 -15.055 1.510 -0.200 756 HB2 ASN 97 HB2 ASN 97 -15.126 3.915 1.701 757 HB3 ASN 97 HB3 ASN 97 -15.971 3.774 0.183 758 HD21 ASN 97 HD21 ASN 97 -17.903 2.565 0.089 759 HD22 ASN 97 HD22 ASN 97 -18.634 1.887 1.638 760 H ILE 98 H ILE 98 -12.257 1.350 -0.215 761 HA ILE 98 HA ILE 98 -11.519 3.586 -2.212 762 HB ILE 98 HB ILE 98 -9.684 2.158 -0.210 763 HG12 ILE 98 HG12 ILE 98 -9.975 5.175 0.017 764 HG13 ILE 98 HG13 ILE 98 -11.317 4.239 0.602 765 HG21 ILE 98 HG21 ILE 98 -8.389 2.758 -2.253 766 HG22 ILE 98 HG22 ILE 98 -8.932 4.448 -2.136 767 HG23 ILE 98 HG23 ILE 98 -7.875 3.746 -0.885 768 HD11 ILE 98 HD11 ILE 98 -9.942 2.977 2.195 769 HD12 ILE 98 HD12 ILE 98 -8.441 3.701 1.577 770 HD13 ILE 98 HD13 ILE 98 -9.646 4.714 2.415 771 H LYS 99 H LYS 99 -10.811 2.817 -4.162 772 HA LYS 99 HA LYS 99 -10.530 -0.212 -4.550 773 HB2 LYS 99 HB2 LYS 99 -12.156 1.050 -5.996 774 HB3 LYS 99 HB3 LYS 99 -10.859 1.957 -6.679 775 HG2 LYS 99 HG2 LYS 99 -10.455 0.340 -8.213 776 HG3 LYS 99 HG3 LYS 99 -10.002 -0.810 -6.994 777 HD2 LYS 99 HD2 LYS 99 -12.835 -0.298 -8.096 778 HD3 LYS 99 HD3 LYS 99 -11.820 -1.654 -8.507 779 HE2 LYS 99 HE2 LYS 99 -13.023 -1.127 -5.688 780 HE3 LYS 99 HE3 LYS 99 -13.719 -2.192 -6.896 781 HZ1 LYS 99 HZ1 LYS 99 -11.638 -3.588 -6.788 782 HZ2 LYS 99 HZ2 LYS 99 -12.330 -3.455 -5.285 783 HZ3 LYS 99 HZ3 LYS 99 -10.991 -2.598 -5.641 784 H SER 100 H SER 100 -8.545 -0.770 -3.972 785 HA SER 100 HA SER 100 -6.124 0.987 -4.494 786 HB2 SER 100 HB2 SER 100 -6.510 0.034 -2.223 787 HB3 SER 100 HB3 SER 100 -6.370 -1.597 -2.860 788 HG SER 100 HG SER 100 -4.226 -1.109 -3.497 789 H VAL 101 H VAL 101 -5.102 0.769 -6.325 790 HA VAL 101 HA VAL 101 -4.919 -1.949 -7.770 791 HB VAL 101 HB VAL 101 -4.862 0.917 -8.893 792 HG11 VAL 101 HG11 VAL 101 -3.405 -0.539 -10.294 793 HG12 VAL 101 HG12 VAL 101 -4.695 -1.751 -10.450 794 HG13 VAL 101 HG13 VAL 101 -4.879 -0.131 -11.177 795 HG21 VAL 101 HG21 VAL 101 -7.011 0.336 -10.059 796 HG22 VAL 101 HG22 VAL 101 -7.060 -1.238 -9.226 797 HG23 VAL 101 HG23 VAL 101 -7.199 0.271 -8.301 798 H THR 102 H THR 102 -2.965 -2.822 -7.238 799 HA THR 102 HA THR 102 -0.514 -1.010 -7.088 800 HB THR 102 HB THR 102 -0.437 -3.905 -6.205 801 HG1 THR 102 HG1 THR 102 -0.912 -1.770 -4.403 802 HG21 THR 102 HG21 THR 102 1.196 -1.467 -5.264 803 HG22 THR 102 HG22 THR 102 1.735 -2.649 -6.479 804 HG23 THR 102 HG23 THR 102 1.441 -3.174 -4.817 805 H GLU 103 H GLU 103 0.714 -0.889 -8.979 806 HA GLU 103 HA GLU 103 0.623 -3.316 -10.854 807 HB2 GLU 103 HB2 GLU 103 -0.508 -1.177 -11.745 808 HB3 GLU 103 HB3 GLU 103 1.106 -0.494 -11.851 809 HG2 GLU 103 HG2 GLU 103 1.856 -2.327 -13.404 810 HG3 GLU 103 HG3 GLU 103 0.321 -3.150 -13.235 811 H LEU 104 H LEU 104 2.434 -4.216 -11.327 812 HA LEU 104 HA LEU 104 5.112 -2.968 -10.535 813 HB2 LEU 104 HB2 LEU 104 4.093 -5.494 -9.960 814 HB3 LEU 104 HB3 LEU 104 5.013 -5.868 -11.389 815 HG LEU 104 HG LEU 104 6.034 -4.549 -8.795 816 HD11 LEU 104 HD11 LEU 104 5.493 -7.033 -8.714 817 HD12 LEU 104 HD12 LEU 104 7.212 -6.704 -8.471 818 HD13 LEU 104 HD13 LEU 104 6.638 -7.321 -10.035 819 HD21 LEU 104 HD21 LEU 104 7.675 -5.294 -11.311 820 HD22 LEU 104 HD22 LEU 104 8.375 -4.829 -9.739 821 HD23 LEU 104 HD23 LEU 104 7.438 -3.658 -10.670 822 H ASN 105 H ASN 105 6.195 -1.966 -12.098 823 HA ASN 105 HA ASN 105 5.874 -2.845 -15.058 824 HB2 ASN 105 HB2 ASN 105 6.385 -0.063 -13.834 825 HB3 ASN 105 HB3 ASN 105 6.730 -0.441 -15.502 826 HD21 ASN 105 HD21 ASN 105 4.029 -0.332 -13.214 827 HD22 ASN 105 HD22 ASN 105 2.766 -0.197 -14.544 828 H GLY 106 H GLY 106 7.357 -4.525 -14.644 829 HA2 GLY 106 HA2 GLY 106 9.578 -5.427 -15.170 830 HA3 GLY 106 HA3 GLY 106 10.248 -3.808 -15.229 831 H ASP 107 H ASP 107 11.085 -2.959 -13.350 832 HA ASP 107 HA ASP 107 10.858 -4.521 -10.713 833 HB2 ASP 107 HB2 ASP 107 13.476 -3.500 -11.973 834 HB3 ASP 107 HB3 ASP 107 13.331 -3.918 -10.282 835 H ILE 108 H ILE 108 9.471 -2.080 -11.697 836 HA ILE 108 HA ILE 108 9.903 -0.485 -9.145 837 HB ILE 108 HB ILE 108 9.388 1.556 -10.012 838 HG12 ILE 108 HG12 ILE 108 9.551 1.711 -12.737 839 HG13 ILE 108 HG13 ILE 108 8.687 0.204 -12.628 840 HG21 ILE 108 HG21 ILE 108 11.645 0.397 -11.724 841 HG22 ILE 108 HG22 ILE 108 11.397 2.117 -11.321 842 HG23 ILE 108 HG23 ILE 108 11.759 0.953 -10.038 843 HD11 ILE 108 HD11 ILE 108 6.908 1.373 -11.172 844 HD12 ILE 108 HD12 ILE 108 7.832 2.885 -11.311 845 HD13 ILE 108 HD13 ILE 108 7.096 2.149 -12.761 846 H ILE 109 H ILE 109 8.116 -0.224 -7.917 847 HA ILE 109 HA ILE 109 5.516 -1.408 -8.995 848 HB ILE 109 HB ILE 109 6.700 -2.770 -7.223 849 HG12 ILE 109 HG12 ILE 109 3.920 -1.835 -6.330 850 HG13 ILE 109 HG13 ILE 109 4.178 -2.849 -7.742 851 HG21 ILE 109 HG21 ILE 109 7.525 -0.899 -5.713 852 HG22 ILE 109 HG22 ILE 109 5.855 -0.571 -5.207 853 HG23 ILE 109 HG23 ILE 109 6.625 -2.124 -4.816 854 HD11 ILE 109 HD11 ILE 109 3.593 -4.246 -5.754 855 HD12 ILE 109 HD12 ILE 109 5.231 -4.654 -6.331 856 HD13 ILE 109 HD13 ILE 109 5.008 -3.653 -4.877 857 H THR 110 H THR 110 3.738 -0.231 -8.981 858 HA THR 110 HA THR 110 3.743 2.367 -7.373 859 HB THR 110 HB THR 110 3.762 2.558 -9.932 860 HG1 THR 110 HG1 THR 110 2.901 4.075 -8.069 861 HG21 THR 110 HG21 THR 110 1.679 2.650 -11.162 862 HG22 THR 110 HG22 THR 110 0.746 2.103 -9.745 863 HG23 THR 110 HG23 THR 110 1.912 1.002 -10.516 864 H ASN 111 H ASN 111 2.188 2.717 -5.944 865 HA ASN 111 HA ASN 111 -0.113 0.674 -5.737 866 HB2 ASN 111 HB2 ASN 111 1.576 0.577 -3.815 867 HB3 ASN 111 HB3 ASN 111 1.053 2.180 -3.333 868 HD21 ASN 111 HD21 ASN 111 -0.812 2.226 -2.044 869 HD22 ASN 111 HD22 ASN 111 -1.899 0.756 -1.821 870 H THR 112 H THR 112 -1.792 1.614 -6.691 871 HA THR 112 HA THR 112 -2.270 4.628 -6.370 872 HB THR 112 HB THR 112 -3.410 2.753 -8.495 873 HG1 THR 112 HG1 THR 112 -1.088 2.999 -8.453 874 HG21 THR 112 HG21 THR 112 -3.769 4.858 -9.787 875 HG22 THR 112 HG22 THR 112 -3.098 5.830 -8.457 876 HG23 THR 112 HG23 THR 112 -4.639 4.961 -8.240 877 H MET 113 H MET 113 -3.423 4.817 -4.556 878 HA MET 113 HA MET 113 -5.880 3.080 -3.992 879 HB2 MET 113 HB2 MET 113 -4.344 5.089 -2.294 880 HB3 MET 113 HB3 MET 113 -5.956 4.581 -1.857 881 HG2 MET 113 HG2 MET 113 -5.158 2.121 -1.968 882 HG3 MET 113 HG3 MET 113 -3.504 2.745 -2.086 883 HE1 MET 113 HE1 MET 113 -3.608 0.993 0.298 884 HE2 MET 113 HE2 MET 113 -4.653 1.439 1.680 885 HE3 MET 113 HE3 MET 113 -5.392 0.970 0.129 886 H THR 114 H THR 114 -7.425 3.633 -5.273 887 HA THR 114 HA THR 114 -8.071 6.525 -5.925 888 HB THR 114 HB THR 114 -9.597 5.699 -7.633 889 HG1 THR 114 HG1 THR 114 -8.741 3.131 -6.742 890 HG21 THR 114 HG21 THR 114 -7.192 6.021 -8.287 891 HG22 THR 114 HG22 THR 114 -7.986 4.731 -9.220 892 HG23 THR 114 HG23 THR 114 -6.864 4.309 -7.907 893 H LEU 115 H LEU 115 -9.295 7.573 -4.584 894 HA LEU 115 HA LEU 115 -11.781 6.268 -3.280 895 HB2 LEU 115 HB2 LEU 115 -10.041 6.792 -1.642 896 HB3 LEU 115 HB3 LEU 115 -9.850 8.417 -2.253 897 HG LEU 115 HG LEU 115 -12.143 9.041 -1.454 898 HD11 LEU 115 HD11 LEU 115 -12.235 6.214 -0.190 899 HD12 LEU 115 HD12 LEU 115 -13.301 6.807 -1.479 900 HD13 LEU 115 HD13 LEU 115 -13.378 7.534 0.132 901 HD21 LEU 115 HD21 LEU 115 -10.121 9.430 -0.030 902 HD22 LEU 115 HD22 LEU 115 -10.294 7.816 0.696 903 HD23 LEU 115 HD23 LEU 115 -11.535 9.064 0.975 904 H GLY 116 H GLY 116 -12.686 6.715 -5.415 905 HA2 GLY 116 HA2 GLY 116 -14.335 7.938 -6.710 906 HA3 GLY 116 HA3 GLY 116 -14.399 9.162 -5.464 907 H ASP 117 H ASP 117 -12.978 10.870 -5.606 908 HA ASP 117 HA ASP 117 -11.816 11.536 -8.371 909 HB2 ASP 117 HB2 ASP 117 -12.591 13.400 -6.028 910 HB3 ASP 117 HB3 ASP 117 -11.805 13.927 -7.504 911 H ILE 118 H ILE 118 -10.851 10.930 -5.063 912 HA ILE 118 HA ILE 118 -8.169 12.294 -5.266 913 HB ILE 118 HB ILE 118 -9.208 10.383 -3.124 914 HG12 ILE 118 HG12 ILE 118 -10.733 12.306 -3.113 915 HG13 ILE 118 HG13 ILE 118 -9.849 12.080 -1.631 916 HG21 ILE 118 HG21 ILE 118 -6.832 12.379 -3.009 917 HG22 ILE 118 HG22 ILE 118 -7.426 11.395 -1.660 918 HG23 ILE 118 HG23 ILE 118 -6.698 10.608 -3.063 919 HD11 ILE 118 HD11 ILE 118 -9.122 14.244 -3.718 920 HD12 ILE 118 HD12 ILE 118 -10.075 14.504 -2.231 921 HD13 ILE 118 HD13 ILE 118 -8.374 14.025 -2.108 922 H VAL 119 H VAL 119 -6.554 11.309 -6.346 923 HA VAL 119 HA VAL 119 -6.342 8.235 -6.457 924 HB VAL 119 HB VAL 119 -5.230 10.346 -8.390 925 HG11 VAL 119 HG11 VAL 119 -3.802 8.293 -8.398 926 HG12 VAL 119 HG12 VAL 119 -5.237 7.266 -8.648 927 HG13 VAL 119 HG13 VAL 119 -4.715 8.411 -9.907 928 HG21 VAL 119 HG21 VAL 119 -7.618 8.400 -8.796 929 HG22 VAL 119 HG22 VAL 119 -7.732 10.164 -8.650 930 HG23 VAL 119 HG23 VAL 119 -6.918 9.457 -10.049 931 H PHE 120 H PHE 120 -5.264 7.915 -4.474 932 HA PHE 120 HA PHE 120 -2.698 9.405 -3.852 933 HB2 PHE 120 HB2 PHE 120 -4.046 9.014 -1.975 934 HB3 PHE 120 HB3 PHE 120 -4.315 7.334 -2.344 935 HD1 PHE 120 HD2 PHE 120 -1.057 9.338 -2.102 936 HD2 PHE 120 HD1 PHE 120 -3.405 6.092 -0.526 937 HE1 PHE 120 HE2 PHE 120 0.860 8.570 -0.806 938 HE2 PHE 120 HE1 PHE 120 -1.464 5.332 0.767 939 HZ PHE 120 HZ PHE 120 0.685 6.566 0.628 940 H LYS 121 H LYS 121 -1.241 8.951 -5.358 941 HA LYS 121 HA LYS 121 -0.559 6.046 -5.993 942 HB2 LYS 121 HB2 LYS 121 -1.314 7.667 -7.775 943 HB3 LYS 121 HB3 LYS 121 0.176 8.558 -7.557 944 HG2 LYS 121 HG2 LYS 121 1.515 6.484 -8.166 945 HG3 LYS 121 HG3 LYS 121 0.013 5.580 -8.366 946 HD2 LYS 121 HD2 LYS 121 -0.736 7.243 -10.148 947 HD3 LYS 121 HD3 LYS 121 0.770 8.135 -9.942 948 HE2 LYS 121 HE2 LYS 121 2.093 6.032 -10.617 949 HE3 LYS 121 HE3 LYS 121 0.576 5.155 -10.836 950 HZ1 LYS 121 HZ1 LYS 121 1.281 7.702 -12.311 951 HZ2 LYS 121 HZ2 LYS 121 -0.094 6.851 -12.540 952 HZ3 LYS 121 HZ3 LYS 121 1.351 6.199 -12.992 953 H ARG 122 H ARG 122 0.989 5.193 -4.828 954 HA ARG 122 HA ARG 122 3.595 6.693 -4.214 955 HB2 ARG 122 HB2 ARG 122 2.540 3.904 -3.419 956 HB3 ARG 122 HB3 ARG 122 4.241 4.261 -3.362 957 HG2 ARG 122 HG2 ARG 122 3.771 6.267 -1.834 958 HG3 ARG 122 HG3 ARG 122 2.093 5.716 -1.704 959 HD2 ARG 122 HD2 ARG 122 2.888 3.488 -0.803 960 HD3 ARG 122 HD3 ARG 122 4.558 3.936 -1.128 961 HE ARG 122 HE ARG 122 3.500 5.972 0.670 962 HH11 ARG 122 HH11 ARG 122 4.675 2.643 0.656 963 HH12 ARG 122 HH12 ARG 122 5.249 2.827 2.395 964 HH21 ARG 122 HH21 ARG 122 4.126 6.053 2.609 965 HH22 ARG 122 HH22 ARG 122 4.931 4.619 3.439 966 H ILE 123 H ILE 123 5.511 6.254 -5.221 967 HA ILE 123 HA ILE 123 5.671 4.035 -7.346 968 HB ILE 123 HB ILE 123 6.923 6.830 -7.592 969 HG12 ILE 123 HG12 ILE 123 5.422 6.733 -9.859 970 HG13 ILE 123 HG13 ILE 123 4.430 5.640 -8.929 971 HG21 ILE 123 HG21 ILE 123 6.968 4.456 -9.576 972 HG22 ILE 123 HG22 ILE 123 7.650 6.074 -9.875 973 HG23 ILE 123 HG23 ILE 123 8.353 5.043 -8.628 974 HD11 ILE 123 HD11 ILE 123 3.558 7.976 -8.814 975 HD12 ILE 123 HD12 ILE 123 4.119 7.562 -7.188 976 HD13 ILE 123 HD13 ILE 123 5.113 8.592 -8.233 977 H SER 124 H SER 124 6.891 2.534 -6.384 978 HA SER 124 HA SER 124 9.426 3.348 -4.835 979 HB2 SER 124 HB2 SER 124 7.470 1.001 -4.295 980 HB3 SER 124 HB3 SER 124 8.959 1.307 -3.404 981 HG SER 124 HG SER 124 6.523 2.361 -2.965 982 H LYS 125 H LYS 125 11.314 2.158 -5.166 983 HA LYS 125 HA LYS 125 11.317 0.426 -7.692 984 HB2 LYS 125 HB2 LYS 125 12.552 2.543 -7.817 985 HB3 LYS 125 HB3 LYS 125 13.568 2.105 -6.443 986 HG2 LYS 125 HG2 LYS 125 14.670 0.330 -7.641 987 HG3 LYS 125 HG3 LYS 125 13.427 0.212 -8.864 988 HD2 LYS 125 HD2 LYS 125 14.106 2.713 -9.515 989 HD3 LYS 125 HD3 LYS 125 15.561 2.414 -8.588 990 HE2 LYS 125 HE2 LYS 125 14.496 0.736 -10.996 991 HE3 LYS 125 HE3 LYS 125 15.716 1.991 -11.133 992 HZ1 LYS 125 HZ1 LYS 125 16.054 -0.522 -9.480 993 HZ2 LYS 125 HZ2 LYS 125 17.199 0.636 -9.620 994 HZ3 LYS 125 HZ3 LYS 125 16.780 -0.271 -10.930 995 H ARG 126 H ARG 126 12.099 -1.631 -7.678 996 HA ARG 126 HA ARG 126 12.178 -3.166 -5.267 997 HB2 ARG 126 HB2 ARG 126 11.663 -3.824 -7.720 998 HB3 ARG 126 HB3 ARG 126 13.393 -3.907 -7.993 999 HG2 ARG 126 HG2 ARG 126 13.513 -5.724 -6.148 1000 HG3 ARG 126 HG3 ARG 126 11.758 -5.581 -5.968 1001 HD2 ARG 126 HD2 ARG 126 11.630 -6.019 -8.577 1002 HD3 ARG 126 HD3 ARG 126 13.337 -6.467 -8.477 1003 HE ARG 126 HE ARG 126 11.927 -8.063 -6.472 1004 HH11 ARG 126 HH11 ARG 126 11.994 -7.753 -10.019 1005 HH12 ARG 126 HH12 ARG 126 11.245 -9.430 -10.148 1006 HH21 ARG 126 HH21 ARG 126 11.137 -9.868 -6.747 1007 HH22 ARG 126 HH22 ARG 126 10.723 -10.538 -8.417 1008 H ILE 127 H ILE 127 13.656 -3.579 -3.805 1009 HA ILE 127 HA ILE 127 16.621 -3.546 -4.362 1010 HB ILE 127 HB ILE 127 15.100 -1.697 -2.441 1011 HG12 ILE 127 HG12 ILE 127 17.510 -1.237 -4.285 1012 HG13 ILE 127 HG13 ILE 127 15.839 -0.854 -4.659 1013 HG21 ILE 127 HG21 ILE 127 18.003 -2.501 -1.908 1014 HG22 ILE 127 HG22 ILE 127 17.073 -1.216 -1.070 1015 HG23 ILE 127 HG23 ILE 127 16.588 -2.907 -0.904 1016 HD11 ILE 127 HD11 ILE 127 15.754 0.811 -2.762 1017 HD12 ILE 127 HD12 ILE 127 17.492 0.555 -2.482 1018 HD13 ILE 127 HD13 ILE 127 16.930 1.224 -4.029 1019 H21 OLA 128 H21 OLA 128 4.036 9.400 15.093 1020 H22 OLA 128 H22 OLA 128 5.008 8.203 14.270 1021 H31 OLA 128 H31 OLA 128 3.793 10.670 12.829 1022 H32 OLA 128 H32 OLA 128 2.909 9.164 13.038 1023 H41 OLA 128 H41 OLA 128 4.679 7.918 11.737 1024 H42 OLA 128 H42 OLA 128 5.590 9.415 11.555 1025 H51 OLA 128 H51 OLA 128 4.417 9.122 9.490 1026 H52 OLA 128 H52 OLA 128 3.603 10.437 10.314 1027 H61 OLA 128 H61 OLA 128 1.783 8.834 11.069 1028 H62 OLA 128 H62 OLA 128 2.634 7.494 10.303 1029 H71 OLA 128 H71 OLA 128 2.378 8.599 8.047 1030 H72 OLA 128 H72 OLA 128 1.570 9.980 8.801 1031 H81 OLA 128 H81 OLA 128 -0.260 8.421 9.661 1032 H82 OLA 128 H82 OLA 128 0.535 7.055 8.892 1033 H9 OLA 128 H9 OLA 128 -0.867 9.451 7.516 1034 H10 OLA 128 H10 OLA 128 -0.901 8.255 5.556 1035 H111 OLA 128 H111 OLA 128 0.095 5.749 6.889 1036 H112 OLA 128 H112 OLA 128 1.440 6.636 6.164 1037 H121 OLA 128 H121 OLA 128 0.255 6.623 3.939 1038 H122 OLA 128 H122 OLA 128 -1.126 5.790 4.647 1039 H131 OLA 128 H131 OLA 128 0.267 3.769 5.108 1040 H132 OLA 128 H132 OLA 128 1.728 4.604 4.564 1041 H141 OLA 128 H141 OLA 128 0.738 4.914 2.274 1042 H142 OLA 128 H142 OLA 128 -0.750 4.117 2.776 1043 H151 OLA 128 H151 OLA 128 0.543 1.973 3.193 1044 H152 OLA 128 H152 OLA 128 2.034 2.785 2.728 1045 H161 OLA 128 H161 OLA 128 0.965 3.315 0.448 1046 H162 OLA 128 H162 OLA 128 -0.438 2.367 0.898 1047 H171 OLA 128 H171 OLA 128 2.434 1.195 0.872 1048 H172 OLA 128 H172 OLA 128 1.423 1.240 -0.553 1049 H181 OLA 128 H181 OLA 128 1.288 -0.990 0.625 1050 H182 OLA 128 H182 OLA 128 0.573 -0.213 2.049 1051 H183 OLA 128 H183 OLA 128 -0.303 -0.220 0.495 1052 H21 OLA 129 H21 OLA 129 5.454 -0.743 -2.208 1053 H22 OLA 129 H22 OLA 129 4.285 -0.204 -3.400 1054 H31 OLA 129 H31 OLA 129 2.394 -0.483 -1.826 1055 H32 OLA 129 H32 OLA 129 3.483 -0.798 -0.480 1056 H41 OLA 129 H41 OLA 129 4.319 -2.876 -1.594 1057 H42 OLA 129 H42 OLA 129 3.253 -2.613 -2.969 1058 H51 OLA 129 H51 OLA 129 2.242 -2.974 -0.062 1059 H52 OLA 129 H52 OLA 129 2.480 -4.318 -1.162 1060 H61 OLA 129 H61 OLA 129 0.790 -3.445 -2.744 1061 H62 OLA 129 H62 OLA 129 0.611 -1.960 -1.812 1062 H71 OLA 129 H71 OLA 129 -0.283 -3.256 0.140 1063 H72 OLA 129 H72 OLA 129 -0.079 -4.773 -0.740 1064 H81 OLA 129 H81 OLA 129 -1.688 -4.027 -2.511 1065 H82 OLA 129 H82 OLA 129 -1.835 -2.440 -1.785 1066 H9 OLA 129 H9 OLA 129 -3.115 -5.049 -0.866 1067 H10 OLA 129 H10 OLA 129 -4.226 -3.910 0.819 1068 H111 OLA 129 H111 OLA 129 -4.101 -1.427 0.899 1069 H112 OLA 129 H112 OLA 129 -2.512 -1.392 0.154 1070 H121 OLA 129 H121 OLA 129 -1.469 -2.450 2.168 1071 H122 OLA 129 H122 OLA 129 -3.048 -2.718 2.903 1072 H131 OLA 129 H131 OLA 129 -3.420 -0.182 2.913 1073 H132 OLA 129 H132 OLA 129 -1.776 0.043 2.342 1074 H141 OLA 129 H141 OLA 129 -0.948 -1.241 4.417 1075 H142 OLA 129 H142 OLA 129 -2.610 -1.369 4.963 1076 H151 OLA 129 H151 OLA 129 -0.925 1.201 4.728 1077 H152 OLA 129 H152 OLA 129 -1.486 0.396 6.169 1078 H161 OLA 129 H161 OLA 129 -3.119 1.990 6.186 1079 H162 OLA 129 H162 OLA 129 -3.949 0.880 5.117 1080 H171 OLA 129 H171 OLA 129 -2.815 2.213 3.123 1081 H172 OLA 129 H172 OLA 129 -2.304 3.374 4.341 1082 H181 OLA 129 H181 OLA 129 -4.754 3.777 4.971 1083 H182 OLA 129 H182 OLA 129 -4.427 4.133 3.260 1084 H183 OLA 129 H183 OLA 129 -5.247 2.623 3.711 Start of MODEL 5 1 H1 SER 2 H1 SER 2 6.503 -11.243 -11.553 2 H2 SER 2 H2 SER 2 5.761 -10.240 -10.530 3 HA SER 2 HA SER 2 7.093 -11.984 -9.452 4 HB2 SER 2 HB2 SER 2 8.878 -11.998 -11.214 5 HB3 SER 2 HB3 SER 2 9.382 -10.378 -10.727 6 HG SER 2 HG SER 2 9.476 -12.778 -9.198 7 H PHE 3 H PHE 3 6.227 -11.194 -7.670 8 HA PHE 3 HA PHE 3 6.744 -8.377 -6.669 9 HB2 PHE 3 HB2 PHE 3 4.800 -10.601 -5.802 10 HB3 PHE 3 HB3 PHE 3 4.996 -9.153 -4.870 11 HD1 PHE 3 HD2 PHE 3 4.279 -6.930 -5.720 12 HD2 PHE 3 HD1 PHE 3 3.674 -10.489 -8.063 13 HE1 PHE 3 HE2 PHE 3 2.603 -5.752 -7.113 14 HE2 PHE 3 HE1 PHE 3 1.994 -9.307 -9.400 15 HZ PHE 3 HZ PHE 3 1.437 -6.944 -8.904 16 H SER 4 H SER 4 8.484 -11.183 -5.967 17 HA SER 4 HA SER 4 8.929 -10.672 -3.098 18 HB2 SER 4 HB2 SER 4 10.547 -12.353 -5.077 19 HB3 SER 4 HB3 SER 4 10.911 -12.239 -3.352 20 HG SER 4 HG SER 4 9.479 -13.987 -3.892 21 H GLY 5 H GLY 5 9.892 -8.920 -2.256 22 HA2 GLY 5 HA2 GLY 5 12.662 -8.158 -2.621 23 HA3 GLY 5 HA3 GLY 5 11.737 -7.146 -3.731 24 H LYS 6 H LYS 6 13.216 -5.961 -1.943 25 HA LYS 6 HA LYS 6 11.353 -4.817 0.245 26 HB2 LYS 6 HB2 LYS 6 14.396 -4.851 -0.056 27 HB3 LYS 6 HB3 LYS 6 13.573 -3.898 1.148 28 HG2 LYS 6 HG2 LYS 6 12.632 -5.945 2.260 29 HG3 LYS 6 HG3 LYS 6 13.355 -6.973 1.023 30 HD2 LYS 6 HD2 LYS 6 15.659 -6.104 1.651 31 HD3 LYS 6 HD3 LYS 6 14.970 -5.136 2.936 32 HE2 LYS 6 HE2 LYS 6 14.760 -8.238 2.752 33 HE3 LYS 6 HE3 LYS 6 16.031 -7.386 3.622 34 HZ1 LYS 6 HZ1 LYS 6 13.058 -7.389 4.293 35 HZ2 LYS 6 HZ2 LYS 6 14.077 -6.257 4.931 36 HZ3 LYS 6 HZ3 LYS 6 14.298 -7.863 5.258 37 H TYR 7 H TYR 7 10.245 -3.433 -1.176 38 HA TYR 7 HA TYR 7 11.735 -1.919 -3.311 39 HB2 TYR 7 HB2 TYR 7 8.714 -1.894 -2.654 40 HB3 TYR 7 HB3 TYR 7 9.448 -1.133 -4.026 41 HD1 TYR 7 HD2 TYR 7 8.861 -4.542 -2.482 42 HD2 TYR 7 HD1 TYR 7 9.612 -2.346 -6.107 43 HE1 TYR 7 HE2 TYR 7 8.521 -6.579 -3.793 44 HE2 TYR 7 HE1 TYR 7 9.214 -4.391 -7.411 45 HH TYR 7 HH TYR 7 8.881 -6.621 -7.324 46 H GLN 8 H GLN 8 12.801 -0.095 -2.678 47 HA GLN 8 HA GLN 8 11.782 1.574 -0.419 48 HB2 GLN 8 HB2 GLN 8 14.257 1.143 -0.866 49 HB3 GLN 8 HB3 GLN 8 14.153 2.298 -2.197 50 HG2 GLN 8 HG2 GLN 8 13.320 4.071 -0.531 51 HG3 GLN 8 HG3 GLN 8 13.451 2.887 0.766 52 HE21 GLN 8 HE21 GLN 8 14.647 4.922 1.422 53 HE22 GLN 8 HE22 GLN 8 16.459 4.861 1.070 54 H LEU 9 H LEU 9 10.809 3.458 -0.404 55 HA LEU 9 HA LEU 9 9.205 4.287 -2.719 56 HB2 LEU 9 HB2 LEU 9 8.380 4.313 -0.410 57 HB3 LEU 9 HB3 LEU 9 9.575 5.504 0.059 58 HG LEU 9 HG LEU 9 8.473 7.224 -1.438 59 HD11 LEU 9 HD11 LEU 9 6.146 6.742 -2.336 60 HD12 LEU 9 HD12 LEU 9 6.361 5.016 -1.933 61 HD13 LEU 9 HD13 LEU 9 7.379 5.783 -3.160 62 HD21 LEU 9 HD21 LEU 9 7.876 7.051 0.982 63 HD22 LEU 9 HD22 LEU 9 6.605 5.867 0.610 64 HD23 LEU 9 HD23 LEU 9 6.474 7.544 0.025 65 H GLN 10 H GLN 10 9.473 5.742 -4.202 66 HA GLN 10 HA GLN 10 11.778 7.761 -4.074 67 HB2 GLN 10 HB2 GLN 10 10.369 6.466 -6.480 68 HB3 GLN 10 HB3 GLN 10 11.610 7.690 -6.607 69 HG2 GLN 10 HG2 GLN 10 12.099 4.979 -5.190 70 HG3 GLN 10 HG3 GLN 10 12.233 5.221 -6.904 71 HE21 GLN 10 HE21 GLN 10 14.437 4.428 -6.332 72 HE22 GLN 10 HE22 GLN 10 15.690 5.678 -5.835 73 H SER 11 H SER 11 8.579 7.532 -5.631 74 HA SER 11 HA SER 11 8.090 10.498 -4.908 75 HB2 SER 11 HB2 SER 11 8.539 10.188 -7.346 76 HB3 SER 11 HB3 SER 11 7.208 9.046 -7.471 77 HG SER 11 HG SER 11 7.096 11.822 -6.873 78 H GLN 12 H GLN 12 6.206 11.046 -4.005 79 HA GLN 12 HA GLN 12 3.996 8.962 -3.604 80 HB2 GLN 12 HB2 GLN 12 5.640 9.220 -1.606 81 HB3 GLN 12 HB3 GLN 12 5.016 10.860 -1.401 82 HG2 GLN 12 HG2 GLN 12 2.794 10.049 -0.832 83 HG3 GLN 12 HG3 GLN 12 3.116 8.445 -1.441 84 HE21 GLN 12 HE21 GLN 12 4.987 10.441 0.946 85 HE22 GLN 12 HE22 GLN 12 4.732 9.211 2.278 86 H GLU 13 H GLU 13 2.320 9.772 -4.722 87 HA GLU 13 HA GLU 13 2.164 12.629 -5.462 88 HB2 GLU 13 HB2 GLU 13 1.851 10.575 -6.934 89 HB3 GLU 13 HB3 GLU 13 0.355 10.240 -6.086 90 HG2 GLU 13 HG2 GLU 13 -0.488 12.591 -6.973 91 HG3 GLU 13 HG3 GLU 13 0.976 12.625 -7.953 92 H ASN 14 H ASN 14 -0.999 11.393 -4.983 93 HA ASN 14 HA ASN 14 -1.704 13.698 -3.273 94 HB2 ASN 14 HB2 ASN 14 -3.387 11.378 -4.378 95 HB3 ASN 14 HB3 ASN 14 -4.064 12.626 -3.428 96 HD21 ASN 14 HD21 ASN 14 -3.215 11.832 -6.631 97 HD22 ASN 14 HD22 ASN 14 -3.591 13.515 -7.268 98 H PHE 15 H PHE 15 -0.048 12.640 -1.641 99 HA PHE 15 HA PHE 15 -1.314 11.040 0.521 100 HB2 PHE 15 HB2 PHE 15 1.184 11.288 0.004 101 HB3 PHE 15 HB3 PHE 15 1.161 12.864 0.731 102 HD1 PHE 15 HD1 PHE 15 0.737 13.067 3.245 103 HD2 PHE 15 HD2 PHE 15 1.185 9.239 1.358 104 HE1 PHE 15 HE1 PHE 15 1.325 12.044 5.403 105 HE2 PHE 15 HE2 PHE 15 1.791 8.245 3.514 106 HZ PHE 15 HZ PHE 15 1.842 9.642 5.552 107 H GLU 16 H GLU 16 -0.557 14.566 0.495 108 HA GLU 16 HA GLU 16 -2.014 15.355 2.865 109 HB2 GLU 16 HB2 GLU 16 -1.056 16.764 0.315 110 HB3 GLU 16 HB3 GLU 16 -2.198 17.630 1.279 111 HG2 GLU 16 HG2 GLU 16 0.350 16.506 2.619 112 HG3 GLU 16 HG3 GLU 16 0.339 18.042 1.751 113 H ALA 17 H ALA 17 -3.324 15.351 -0.458 114 HA ALA 17 HA ALA 17 -6.061 16.136 0.303 115 HB1 ALA 17 HB1 ALA 17 -5.070 14.643 -2.224 116 HB2 ALA 17 HB2 ALA 17 -6.614 15.505 -2.045 117 HB3 ALA 17 HB3 ALA 17 -5.099 16.412 -2.007 118 H PHE 18 H PHE 18 -4.603 12.896 0.051 119 HA PHE 18 HA PHE 18 -7.225 11.447 0.427 120 HB2 PHE 18 HB2 PHE 18 -5.280 10.540 -0.927 121 HB3 PHE 18 HB3 PHE 18 -4.325 10.398 0.515 122 HD1 PHE 18 HD2 PHE 18 -4.991 8.687 2.298 123 HD2 PHE 18 HD1 PHE 18 -6.957 8.827 -1.525 124 HE1 PHE 18 HE2 PHE 18 -5.700 6.351 2.568 125 HE2 PHE 18 HE1 PHE 18 -7.667 6.498 -1.237 126 HZ PHE 18 HZ PHE 18 -7.031 5.253 0.813 127 H MET 19 H MET 19 -4.347 11.939 2.567 128 HA MET 19 HA MET 19 -5.615 10.659 4.886 129 HB2 MET 19 HB2 MET 19 -3.211 12.547 4.699 130 HB3 MET 19 HB3 MET 19 -3.794 11.813 6.189 131 HG2 MET 19 HG2 MET 19 -1.907 10.506 5.307 132 HG3 MET 19 HG3 MET 19 -3.379 9.520 5.371 133 HE1 MET 19 HE1 MET 19 -1.213 8.156 3.256 134 HE2 MET 19 HE2 MET 19 -2.827 7.744 3.927 135 HE3 MET 19 HE3 MET 19 -2.576 7.822 2.161 136 H LYS 20 H LYS 20 -5.604 14.136 3.948 137 HA LYS 20 HA LYS 20 -7.316 14.920 6.277 138 HB2 LYS 20 HB2 LYS 20 -6.602 16.352 3.655 139 HB3 LYS 20 HB3 LYS 20 -7.909 16.937 4.661 140 HG2 LYS 20 HG2 LYS 20 -6.374 17.069 6.667 141 HG3 LYS 20 HG3 LYS 20 -5.011 16.597 5.673 142 HD2 LYS 20 HD2 LYS 20 -6.767 19.003 4.851 143 HD3 LYS 20 HD3 LYS 20 -5.671 19.209 6.176 144 HE2 LYS 20 HE2 LYS 20 -4.635 18.139 3.449 145 HE3 LYS 20 HE3 LYS 20 -4.893 19.864 3.722 146 HZ1 LYS 20 HZ1 LYS 20 -2.548 19.226 4.335 147 HZ2 LYS 20 HZ2 LYS 20 -3.062 18.153 5.402 148 HZ3 LYS 20 HZ3 LYS 20 -3.364 19.752 5.734 149 H ALA 21 H ALA 21 -8.191 13.847 2.891 150 HA ALA 21 HA ALA 21 -11.085 14.140 3.285 151 HB1 ALA 21 HB1 ALA 21 -11.242 12.628 1.289 152 HB2 ALA 21 HB2 ALA 21 -10.029 13.897 1.035 153 HB3 ALA 21 HB3 ALA 21 -9.511 12.238 1.423 154 H ILE 22 H ILE 22 -8.943 11.367 4.093 155 HA ILE 22 HA ILE 22 -11.323 9.791 5.136 156 HB ILE 22 HB ILE 22 -9.848 7.968 5.671 157 HG12 ILE 22 HG12 ILE 22 -7.449 9.433 4.455 158 HG13 ILE 22 HG13 ILE 22 -7.729 9.409 6.183 159 HG21 ILE 22 HG21 ILE 22 -9.299 7.246 3.366 160 HG22 ILE 22 HG22 ILE 22 -10.818 8.163 3.350 161 HG23 ILE 22 HG23 ILE 22 -9.311 8.928 2.795 162 HD11 ILE 22 HD11 ILE 22 -7.294 6.886 4.443 163 HD12 ILE 22 HD12 ILE 22 -6.113 7.638 5.534 164 HD13 ILE 22 HD13 ILE 22 -7.586 6.888 6.203 165 H GLY 23 H GLY 23 -9.619 12.253 6.525 166 HA2 GLY 23 HA2 GLY 23 -10.114 13.119 8.755 167 HA3 GLY 23 HA3 GLY 23 -10.728 11.567 9.252 168 H LEU 24 H LEU 24 -7.427 12.416 8.062 169 HA LEU 24 HA LEU 24 -6.345 11.637 10.805 170 HB2 LEU 24 HB2 LEU 24 -5.369 11.197 7.970 171 HB3 LEU 24 HB3 LEU 24 -4.143 11.688 9.081 172 HG LEU 24 HG LEU 24 -5.063 9.803 10.717 173 HD11 LEU 24 HD11 LEU 24 -7.174 9.286 9.434 174 HD12 LEU 24 HD12 LEU 24 -6.131 7.868 9.574 175 HD13 LEU 24 HD13 LEU 24 -6.209 8.766 8.037 176 HD21 LEU 24 HD21 LEU 24 -2.846 9.751 9.628 177 HD22 LEU 24 HD22 LEU 24 -3.559 9.076 8.138 178 HD23 LEU 24 HD23 LEU 24 -3.582 8.138 9.662 179 HA PRO 25 HA PRO 25 -4.854 15.677 11.807 180 HB2 PRO 25 HB2 PRO 25 -2.586 15.150 13.401 181 HB3 PRO 25 HB3 PRO 25 -4.244 14.948 13.876 182 HG2 PRO 25 HG2 PRO 25 -2.263 12.875 12.913 183 HG3 PRO 25 HG3 PRO 25 -3.480 12.666 14.187 184 HD2 PRO 25 HD2 PRO 25 -3.630 11.748 11.506 185 HD3 PRO 25 HD3 PRO 25 -5.059 11.938 12.542 186 H GLU 26 H GLU 26 -3.703 17.321 10.979 187 HA GLU 26 HA GLU 26 -1.872 17.061 8.789 188 HB2 GLU 26 HB2 GLU 26 -2.519 19.428 10.591 189 HB3 GLU 26 HB3 GLU 26 -1.540 19.509 9.166 190 HG2 GLU 26 HG2 GLU 26 -3.630 18.403 7.892 191 HG3 GLU 26 HG3 GLU 26 -4.547 18.890 9.304 192 H GLU 27 H GLU 27 -1.051 17.435 12.183 193 HA GLU 27 HA GLU 27 1.860 17.787 11.929 194 HB2 GLU 27 HB2 GLU 27 0.636 18.302 13.957 195 HB3 GLU 27 HB3 GLU 27 0.039 16.670 14.155 196 HG2 GLU 27 HG2 GLU 27 3.078 17.212 14.281 197 HG3 GLU 27 HG3 GLU 27 2.035 17.582 15.644 198 H LEU 28 H LEU 28 0.026 14.687 12.372 199 HA LEU 28 HA LEU 28 2.441 13.025 11.841 200 HB2 LEU 28 HB2 LEU 28 -0.447 12.060 11.605 201 HB3 LEU 28 HB3 LEU 28 0.992 11.081 11.772 202 HG LEU 28 HG LEU 28 -0.218 12.897 13.940 203 HD11 LEU 28 HD11 LEU 28 0.002 9.808 13.794 204 HD12 LEU 28 HD12 LEU 28 -1.481 10.729 13.467 205 HD13 LEU 28 HD13 LEU 28 -0.767 10.752 15.092 206 HD21 LEU 28 HD21 LEU 28 2.318 12.765 14.185 207 HD22 LEU 28 HD22 LEU 28 2.163 11.002 14.396 208 HD23 LEU 28 HD23 LEU 28 1.405 12.119 15.544 209 H ILE 29 H ILE 29 -0.064 14.303 9.721 210 HA ILE 29 HA ILE 29 0.684 12.782 7.291 211 HB ILE 29 HB ILE 29 -0.782 15.470 7.460 212 HG12 ILE 29 HG12 ILE 29 -1.990 12.672 7.015 213 HG13 ILE 29 HG13 ILE 29 -1.936 13.413 8.571 214 HG21 ILE 29 HG21 ILE 29 -0.736 13.514 5.054 215 HG22 ILE 29 HG22 ILE 29 -1.568 15.075 5.141 216 HG23 ILE 29 HG23 ILE 29 0.185 15.042 5.123 217 HD11 ILE 29 HD11 ILE 29 -3.350 15.368 7.814 218 HD12 ILE 29 HD12 ILE 29 -3.503 14.624 6.202 219 HD13 ILE 29 HD13 ILE 29 -4.178 13.814 7.623 220 H GLN 30 H GLN 30 1.565 16.075 8.427 221 HA GLN 30 HA GLN 30 3.607 16.623 6.380 222 HB2 GLN 30 HB2 GLN 30 2.932 17.767 9.125 223 HB3 GLN 30 HB3 GLN 30 4.508 18.113 8.517 224 HG2 GLN 30 HG2 GLN 30 2.661 19.856 8.019 225 HG3 GLN 30 HG3 GLN 30 3.826 19.468 6.782 226 HE21 GLN 30 HE21 GLN 30 0.551 18.350 7.706 227 HE22 GLN 30 HE22 GLN 30 0.031 18.257 5.933 228 H LYS 31 H LYS 31 3.831 14.510 9.121 229 HA LYS 31 HA LYS 31 6.861 14.277 8.983 230 HB2 LYS 31 HB2 LYS 31 4.662 12.824 10.575 231 HB3 LYS 31 HB3 LYS 31 6.306 12.235 10.549 232 HG2 LYS 31 HG2 LYS 31 7.201 14.302 11.552 233 HG3 LYS 31 HG3 LYS 31 5.630 15.111 11.438 234 HD2 LYS 31 HD2 LYS 31 4.572 13.543 12.987 235 HD3 LYS 31 HD3 LYS 31 5.979 12.475 12.997 236 HE2 LYS 31 HE2 LYS 31 7.377 14.175 14.170 237 HE3 LYS 31 HE3 LYS 31 6.070 15.387 14.057 238 HZ1 LYS 31 HZ1 LYS 31 4.624 14.064 15.396 239 HZ2 LYS 31 HZ2 LYS 31 6.053 14.014 16.249 240 HZ3 LYS 31 HZ3 LYS 31 5.625 12.676 15.339 241 H GLY 32 H GLY 32 4.102 12.038 8.243 242 HA2 GLY 32 HA2 GLY 32 5.883 10.107 6.816 243 HA3 GLY 32 HA3 GLY 32 4.148 10.013 6.879 244 H LYS 33 H LYS 33 4.423 12.972 5.512 245 HA LYS 33 HA LYS 33 3.943 11.998 2.819 246 HB2 LYS 33 HB2 LYS 33 3.762 14.290 2.115 247 HB3 LYS 33 HB3 LYS 33 2.936 14.044 3.635 248 HG2 LYS 33 HG2 LYS 33 4.745 15.154 4.911 249 HG3 LYS 33 HG3 LYS 33 5.740 15.332 3.493 250 HD2 LYS 33 HD2 LYS 33 2.953 16.596 3.710 251 HD3 LYS 33 HD3 LYS 33 4.386 17.398 4.298 252 HE2 LYS 33 HE2 LYS 33 4.118 16.461 1.350 253 HE3 LYS 33 HE3 LYS 33 3.579 18.038 1.909 254 HZ1 LYS 33 HZ1 LYS 33 6.026 17.902 1.018 255 HZ2 LYS 33 HZ2 LYS 33 6.463 17.128 2.365 256 HZ3 LYS 33 HZ3 LYS 33 5.875 18.642 2.495 257 H ASP 34 H ASP 34 7.000 13.434 3.980 258 HA ASP 34 HA ASP 34 8.254 12.970 1.226 259 HB2 ASP 34 HB2 ASP 34 9.297 14.629 3.600 260 HB3 ASP 34 HB3 ASP 34 9.996 14.564 1.995 261 H ILE 35 H ILE 35 8.251 11.130 4.015 262 HA ILE 35 HA ILE 35 11.153 10.456 4.185 263 HB ILE 35 HB ILE 35 8.719 9.082 5.436 264 HG12 ILE 35 HG12 ILE 35 10.866 10.828 6.821 265 HG13 ILE 35 HG13 ILE 35 9.357 11.483 6.232 266 HG21 ILE 35 HG21 ILE 35 11.703 8.517 6.071 267 HG22 ILE 35 HG22 ILE 35 10.312 7.847 6.954 268 HG23 ILE 35 HG23 ILE 35 10.580 7.386 5.280 269 HD11 ILE 35 HD11 ILE 35 9.539 9.345 8.455 270 HD12 ILE 35 HD12 ILE 35 9.130 11.065 8.632 271 HD13 ILE 35 HD13 ILE 35 8.027 9.989 7.765 272 H LYS 36 H LYS 36 12.157 9.405 2.583 273 HA LYS 36 HA LYS 36 10.854 7.415 0.779 274 HB2 LYS 36 HB2 LYS 36 13.817 8.200 1.093 275 HB3 LYS 36 HB3 LYS 36 13.215 7.025 -0.052 276 HG2 LYS 36 HG2 LYS 36 11.640 8.888 -0.999 277 HG3 LYS 36 HG3 LYS 36 12.594 10.039 -0.061 278 HD2 LYS 36 HD2 LYS 36 14.716 9.167 -1.240 279 HD3 LYS 36 HD3 LYS 36 13.718 8.008 -2.121 280 HE2 LYS 36 HE2 LYS 36 12.379 10.051 -3.076 281 HE3 LYS 36 HE3 LYS 36 13.605 11.098 -2.369 282 HZ1 LYS 36 HZ1 LYS 36 14.185 8.853 -4.351 283 HZ2 LYS 36 HZ2 LYS 36 15.328 9.833 -3.703 284 HZ3 LYS 36 HZ3 LYS 36 14.195 10.456 -4.724 285 H GLY 37 H GLY 37 10.079 6.150 2.677 286 HA2 GLY 37 HA2 GLY 37 11.953 4.233 4.004 287 HA3 GLY 37 HA3 GLY 37 10.208 4.239 4.153 288 H VAL 38 H VAL 38 11.277 1.934 4.192 289 HA VAL 38 HA VAL 38 11.345 0.610 1.462 290 HB VAL 38 HB VAL 38 11.876 -0.538 4.249 291 HG11 VAL 38 HG11 VAL 38 12.236 -1.932 1.512 292 HG12 VAL 38 HG12 VAL 38 12.824 -2.562 3.075 293 HG13 VAL 38 HG13 VAL 38 11.089 -2.406 2.786 294 HG21 VAL 38 HG21 VAL 38 14.284 -0.660 3.497 295 HG22 VAL 38 HG22 VAL 38 13.859 0.088 1.938 296 HG23 VAL 38 HG23 VAL 38 13.721 1.016 3.446 297 H SER 39 H SER 39 9.756 -0.545 0.594 298 HA SER 39 HA SER 39 7.331 -1.435 2.265 299 HB2 SER 39 HB2 SER 39 7.486 -0.474 -0.631 300 HB3 SER 39 HB3 SER 39 6.088 -1.300 0.032 301 HG SER 39 HG SER 39 5.790 0.927 0.169 302 H GLU 40 H GLU 40 7.998 -3.401 2.685 303 HA GLU 40 HA GLU 40 9.327 -5.229 0.701 304 HB2 GLU 40 HB2 GLU 40 9.821 -5.049 3.252 305 HB3 GLU 40 HB3 GLU 40 8.297 -5.832 3.511 306 HG2 GLU 40 HG2 GLU 40 9.052 -7.932 2.416 307 HG3 GLU 40 HG3 GLU 40 10.576 -7.187 1.944 308 H ILE 41 H ILE 41 8.523 -7.040 -0.228 309 HA ILE 41 HA ILE 41 5.839 -8.123 0.628 310 HB ILE 41 HB ILE 41 6.398 -7.725 -2.368 311 HG12 ILE 41 HG12 ILE 41 4.259 -6.156 -0.818 312 HG13 ILE 41 HG13 ILE 41 5.824 -5.505 -1.261 313 HG21 ILE 41 HG21 ILE 41 3.824 -8.728 -0.942 314 HG22 ILE 41 HG22 ILE 41 4.028 -8.535 -2.699 315 HG23 ILE 41 HG23 ILE 41 4.960 -9.755 -1.852 316 HD11 ILE 41 HD11 ILE 41 4.264 -4.778 -2.975 317 HD12 ILE 41 HD12 ILE 41 5.378 -5.936 -3.721 318 HD13 ILE 41 HD13 ILE 41 3.711 -6.422 -3.306 319 H VAL 42 H VAL 42 6.175 -10.274 0.954 320 HA VAL 42 HA VAL 42 8.250 -11.818 -0.706 321 HB VAL 42 HB VAL 42 6.930 -12.916 1.817 322 HG11 VAL 42 HG11 VAL 42 9.650 -13.577 0.510 323 HG12 VAL 42 HG12 VAL 42 8.925 -14.394 1.913 324 HG13 VAL 42 HG13 VAL 42 8.173 -14.542 0.314 325 HG21 VAL 42 HG21 VAL 42 8.027 -10.843 2.634 326 HG22 VAL 42 HG22 VAL 42 8.907 -12.269 3.191 327 HG23 VAL 42 HG23 VAL 42 9.552 -11.297 1.839 328 H GLN 43 H GLN 43 7.274 -12.676 -2.495 329 HA GLN 43 HA GLN 43 4.367 -13.391 -2.550 330 HB2 GLN 43 HB2 GLN 43 5.550 -12.251 -4.418 331 HB3 GLN 43 HB3 GLN 43 6.559 -13.661 -4.692 332 HG2 GLN 43 HG2 GLN 43 4.531 -15.029 -5.298 333 HG3 GLN 43 HG3 GLN 43 3.480 -13.677 -4.901 334 HE21 GLN 43 HE21 GLN 43 2.780 -14.292 -7.116 335 HE22 GLN 43 HE22 GLN 43 3.609 -13.443 -8.531 336 H ASN 44 H ASN 44 3.841 -15.191 -1.378 337 HA ASN 44 HA ASN 44 5.288 -17.858 -1.972 338 HB2 ASN 44 HB2 ASN 44 3.574 -17.123 0.487 339 HB3 ASN 44 HB3 ASN 44 4.388 -18.631 0.200 340 HD21 ASN 44 HD21 ASN 44 5.022 -15.236 0.874 341 HD22 ASN 44 HD22 ASN 44 6.660 -15.605 1.606 342 H GLY 45 H GLY 45 3.868 -17.503 -3.999 343 HA2 GLY 45 HA2 GLY 45 2.116 -18.480 -5.368 344 HA3 GLY 45 HA3 GLY 45 1.641 -19.487 -4.017 345 H LYS 46 H LYS 46 0.014 -18.729 -2.658 346 HA LYS 46 HA LYS 46 -1.748 -16.433 -3.638 347 HB2 LYS 46 HB2 LYS 46 -2.262 -18.654 -1.561 348 HB3 LYS 46 HB3 LYS 46 -3.362 -17.332 -1.871 349 HG2 LYS 46 HG2 LYS 46 -3.711 -18.069 -4.252 350 HG3 LYS 46 HG3 LYS 46 -2.518 -19.329 -4.041 351 HD2 LYS 46 HD2 LYS 46 -4.236 -20.698 -3.579 352 HD3 LYS 46 HD3 LYS 46 -4.163 -20.090 -1.957 353 HE2 LYS 46 HE2 LYS 46 -6.077 -19.123 -4.216 354 HE3 LYS 46 HE3 LYS 46 -6.495 -20.247 -2.930 355 HZ1 LYS 46 HZ1 LYS 46 -7.249 -18.123 -2.118 356 HZ2 LYS 46 HZ2 LYS 46 -5.933 -17.316 -2.676 357 HZ3 LYS 46 HZ3 LYS 46 -5.812 -18.286 -1.335 358 H HIS 47 H HIS 47 0.370 -17.240 -0.877 359 HA HIS 47 HA HIS 47 -0.758 -14.960 0.802 360 HB2 HIS 47 HB2 HIS 47 1.250 -17.198 1.468 361 HB3 HIS 47 HB3 HIS 47 0.955 -15.844 2.531 362 HD1 HIS 47 HD1 HIS 47 -0.728 -19.106 1.406 363 HD2 HIS 47 HD2 HIS 47 -1.465 -15.604 3.753 364 HE1 HIS 47 HE1 HIS 47 -2.879 -19.404 2.812 365 H PHE 48 H PHE 48 -0.029 -13.044 0.321 366 HA PHE 48 HA PHE 48 2.891 -12.539 -0.482 367 HB2 PHE 48 HB2 PHE 48 0.279 -10.974 -0.794 368 HB3 PHE 48 HB3 PHE 48 1.820 -10.212 -0.975 369 HD1 PHE 48 HD1 PHE 48 0.362 -13.512 -2.359 370 HD2 PHE 48 HD2 PHE 48 2.177 -9.704 -3.194 371 HE1 PHE 48 HE1 PHE 48 0.265 -13.980 -4.760 372 HE2 PHE 48 HE2 PHE 48 2.042 -10.184 -5.589 373 HZ PHE 48 HZ PHE 48 1.114 -12.300 -6.386 374 H LYS 49 H LYS 49 4.047 -12.348 1.365 375 HA LYS 49 HA LYS 49 2.892 -11.075 3.870 376 HB2 LYS 49 HB2 LYS 49 5.658 -12.312 3.438 377 HB3 LYS 49 HB3 LYS 49 5.068 -11.689 4.961 378 HG2 LYS 49 HG2 LYS 49 3.276 -13.357 5.087 379 HG3 LYS 49 HG3 LYS 49 3.591 -13.919 3.461 380 HD2 LYS 49 HD2 LYS 49 6.052 -14.464 4.370 381 HD3 LYS 49 HD3 LYS 49 5.370 -14.266 5.971 382 HE2 LYS 49 HE2 LYS 49 4.432 -16.276 3.797 383 HE3 LYS 49 HE3 LYS 49 5.501 -16.661 5.140 384 HZ1 LYS 49 HZ1 LYS 49 3.213 -17.279 5.847 385 HZ2 LYS 49 HZ2 LYS 49 2.560 -15.841 5.389 386 HZ3 LYS 49 HZ3 LYS 49 3.503 -15.869 6.660 387 H PHE 50 H PHE 50 2.969 -8.986 4.141 388 HA PHE 50 HA PHE 50 5.215 -7.410 2.809 389 HB2 PHE 50 HB2 PHE 50 3.910 -5.525 2.453 390 HB3 PHE 50 HB3 PHE 50 3.139 -6.913 1.777 391 HD1 PHE 50 HD2 PHE 50 2.705 -5.469 5.368 392 HD2 PHE 50 HD1 PHE 50 1.055 -5.957 1.432 393 HE1 PHE 50 HE2 PHE 50 0.661 -4.385 6.090 394 HE2 PHE 50 HE1 PHE 50 -1.004 -4.883 2.170 395 HZ PHE 50 HZ PHE 50 -1.217 -4.079 4.510 396 H THR 51 H THR 51 6.342 -5.866 3.691 397 HA THR 51 HA THR 51 5.823 -5.102 6.642 398 HB THR 51 HB THR 51 8.666 -5.338 5.525 399 HG1 THR 51 HG1 THR 51 8.617 -7.368 5.842 400 HG21 THR 51 HG21 THR 51 8.470 -3.879 7.496 401 HG22 THR 51 HG22 THR 51 9.345 -5.380 7.880 402 HG23 THR 51 HG23 THR 51 7.665 -5.184 8.412 403 H ILE 52 H ILE 52 4.747 -3.214 6.129 404 HA ILE 52 HA ILE 52 5.946 -1.351 4.029 405 HB ILE 52 HB ILE 52 3.126 -1.398 5.177 406 HG12 ILE 52 HG12 ILE 52 3.392 -3.380 3.845 407 HG13 ILE 52 HG13 ILE 52 2.351 -2.276 2.990 408 HG21 ILE 52 HG21 ILE 52 2.476 0.137 3.309 409 HG22 ILE 52 HG22 ILE 52 3.636 0.908 4.388 410 HG23 ILE 52 HG23 ILE 52 4.176 0.283 2.809 411 HD11 ILE 52 HD11 ILE 52 5.324 -2.885 2.329 412 HD12 ILE 52 HD12 ILE 52 3.912 -3.412 1.411 413 HD13 ILE 52 HD13 ILE 52 4.333 -1.686 1.452 414 H THR 53 H THR 53 6.698 0.552 4.451 415 HA THR 53 HA THR 53 6.749 1.647 7.282 416 HB THR 53 HB THR 53 8.385 3.346 6.343 417 HG1 THR 53 HG1 THR 53 8.622 1.514 4.197 418 HG21 THR 53 HG21 THR 53 10.320 1.783 6.272 419 HG22 THR 53 HG22 THR 53 9.227 0.383 6.126 420 HG23 THR 53 HG23 THR 53 9.225 1.372 7.606 421 H ALA 54 H ALA 54 5.072 2.745 7.795 422 HA ALA 54 HA ALA 54 3.797 4.881 5.968 423 HB1 ALA 54 HB1 ALA 54 2.887 3.556 8.624 424 HB2 ALA 54 HB2 ALA 54 1.991 4.819 7.770 425 HB3 ALA 54 HB3 ALA 54 2.234 3.238 6.994 426 H GLY 55 H GLY 55 6.023 5.801 6.273 427 HA2 GLY 55 HA2 GLY 55 7.188 7.801 6.959 428 HA3 GLY 55 HA3 GLY 55 5.943 8.178 8.136 429 H SER 56 H SER 56 6.121 7.318 10.185 430 HA SER 56 HA SER 56 8.816 6.173 11.058 431 HB2 SER 56 HB2 SER 56 6.535 7.195 12.849 432 HB3 SER 56 HB3 SER 56 8.150 6.738 13.364 433 HG SER 56 HG SER 56 7.610 9.096 12.962 434 H LYS 57 H LYS 57 5.398 5.143 10.917 435 HA LYS 57 HA LYS 57 5.874 2.829 12.794 436 HB2 LYS 57 HB2 LYS 57 3.697 4.166 12.782 437 HB3 LYS 57 HB3 LYS 57 3.327 3.494 11.200 438 HG2 LYS 57 HG2 LYS 57 3.517 1.120 12.298 439 HG3 LYS 57 HG3 LYS 57 3.697 1.928 13.852 440 HD2 LYS 57 HD2 LYS 57 1.394 2.999 13.513 441 HD3 LYS 57 HD3 LYS 57 1.267 2.187 11.949 442 HE2 LYS 57 HE2 LYS 57 1.565 -0.093 13.169 443 HE3 LYS 57 HE3 LYS 57 1.530 0.774 14.708 444 HZ1 LYS 57 HZ1 LYS 57 -0.713 0.573 12.657 445 HZ2 LYS 57 HZ2 LYS 57 -0.796 1.654 13.919 446 HZ3 LYS 57 HZ3 LYS 57 -0.761 0.001 14.109 447 H VAL 58 H VAL 58 6.394 0.849 12.216 448 HA VAL 58 HA VAL 58 6.444 -0.050 9.313 449 HB VAL 58 HB VAL 58 7.509 -1.463 11.824 450 HG11 VAL 58 HG11 VAL 58 7.933 -2.127 8.832 451 HG12 VAL 58 HG12 VAL 58 8.752 -2.940 10.191 452 HG13 VAL 58 HG13 VAL 58 7.001 -3.107 9.986 453 HG21 VAL 58 HG21 VAL 58 8.867 0.615 11.305 454 HG22 VAL 58 HG22 VAL 58 9.801 -0.853 10.982 455 HG23 VAL 58 HG23 VAL 58 9.090 0.065 9.632 456 H ILE 59 H ILE 59 4.539 -0.750 8.585 457 HA ILE 59 HA ILE 59 2.547 -2.218 10.417 458 HB ILE 59 HB ILE 59 2.055 -0.835 7.723 459 HG12 ILE 59 HG12 ILE 59 1.101 0.023 10.535 460 HG13 ILE 59 HG13 ILE 59 2.463 0.749 9.699 461 HG21 ILE 59 HG21 ILE 59 0.005 -2.153 9.648 462 HG22 ILE 59 HG22 ILE 59 -0.393 -1.280 8.153 463 HG23 ILE 59 HG23 ILE 59 0.492 -2.799 8.058 464 HD11 ILE 59 HD11 ILE 59 -0.479 0.922 8.829 465 HD12 ILE 59 HD12 ILE 59 0.603 2.229 9.343 466 HD13 ILE 59 HD13 ILE 59 0.870 1.427 7.774 467 H GLN 60 H GLN 60 3.245 -4.299 10.371 468 HA GLN 60 HA GLN 60 3.695 -5.635 7.680 469 HB2 GLN 60 HB2 GLN 60 5.085 -7.237 8.659 470 HB3 GLN 60 HB3 GLN 60 5.645 -5.635 9.041 471 HG2 GLN 60 HG2 GLN 60 4.151 -7.458 11.023 472 HG3 GLN 60 HG3 GLN 60 5.893 -7.376 10.875 473 HE21 GLN 60 HE21 GLN 60 6.972 -5.482 11.706 474 HE22 GLN 60 HE22 GLN 60 6.037 -4.277 12.743 475 H ASN 61 H ASN 61 2.415 -7.027 6.965 476 HA ASN 61 HA ASN 61 0.535 -8.750 8.457 477 HB2 ASN 61 HB2 ASN 61 -0.746 -6.476 6.778 478 HB3 ASN 61 HB3 ASN 61 -1.590 -7.916 7.278 479 HD21 ASN 61 HD21 ASN 61 -0.248 -4.962 8.518 480 HD22 ASN 61 HD22 ASN 61 -1.190 -5.067 10.082 481 H GLU 62 H GLU 62 -0.727 -10.173 6.849 482 HA GLU 62 HA GLU 62 0.696 -10.317 4.160 483 HB2 GLU 62 HB2 GLU 62 1.051 -12.575 4.173 484 HB3 GLU 62 HB3 GLU 62 1.688 -11.941 5.682 485 HG2 GLU 62 HG2 GLU 62 -0.274 -12.969 6.937 486 HG3 GLU 62 HG3 GLU 62 -0.921 -13.591 5.415 487 H PHE 63 H PHE 63 -0.442 -10.517 2.432 488 HA PHE 63 HA PHE 63 -3.452 -10.844 2.726 489 HB2 PHE 63 HB2 PHE 63 -3.927 -9.649 0.754 490 HB3 PHE 63 HB3 PHE 63 -3.105 -8.727 1.942 491 HD1 PHE 63 HD1 PHE 63 -0.750 -7.859 1.437 492 HD2 PHE 63 HD2 PHE 63 -2.894 -10.219 -1.445 493 HE1 PHE 63 HE1 PHE 63 0.784 -7.099 -0.365 494 HE2 PHE 63 HE2 PHE 63 -1.387 -9.413 -3.218 495 HZ PHE 63 HZ PHE 63 0.450 -7.843 -2.661 496 H THR 64 H THR 64 -4.512 -12.348 1.858 497 HA THR 64 HA THR 64 -3.119 -14.501 0.241 498 HB THR 64 HB THR 64 -5.896 -14.623 1.550 499 HG1 THR 64 HG1 THR 64 -3.880 -15.999 2.758 500 HG21 THR 64 HG21 THR 64 -5.466 -16.442 -0.126 501 HG22 THR 64 HG22 THR 64 -5.485 -17.102 1.526 502 HG23 THR 64 HG23 THR 64 -3.929 -16.863 0.683 503 H VAL 65 H VAL 65 -3.253 -14.232 -1.912 504 HA VAL 65 HA VAL 65 -5.347 -12.655 -3.281 505 HB VAL 65 HB VAL 65 -3.218 -14.523 -4.386 506 HG11 VAL 65 HG11 VAL 65 -5.002 -14.291 -6.153 507 HG12 VAL 65 HG12 VAL 65 -4.813 -12.522 -6.105 508 HG13 VAL 65 HG13 VAL 65 -3.469 -13.553 -6.632 509 HG21 VAL 65 HG21 VAL 65 -3.311 -11.416 -4.295 510 HG22 VAL 65 HG22 VAL 65 -2.268 -12.441 -3.284 511 HG23 VAL 65 HG23 VAL 65 -2.009 -12.372 -5.034 512 H GLY 66 H GLY 66 -7.365 -13.298 -3.610 513 HA2 GLY 66 HA2 GLY 66 -9.141 -14.766 -4.503 514 HA3 GLY 66 HA3 GLY 66 -8.087 -16.153 -4.462 515 H GLU 67 H GLU 67 -7.866 -14.862 -1.383 516 HA GLU 67 HA GLU 67 -10.433 -15.912 -0.325 517 HB2 GLU 67 HB2 GLU 67 -7.754 -17.281 0.453 518 HB3 GLU 67 HB3 GLU 67 -9.111 -17.295 1.545 519 HG2 GLU 67 HG2 GLU 67 -9.340 -18.470 -1.299 520 HG3 GLU 67 HG3 GLU 67 -8.905 -19.401 0.132 521 H GLU 68 H GLU 68 -10.839 -15.298 1.884 522 HA GLU 68 HA GLU 68 -10.348 -12.551 2.276 523 HB2 GLU 68 HB2 GLU 68 -11.430 -12.639 4.403 524 HB3 GLU 68 HB3 GLU 68 -12.299 -13.551 3.207 525 HG2 GLU 68 HG2 GLU 68 -12.040 -15.595 4.318 526 HG3 GLU 68 HG3 GLU 68 -10.404 -15.244 4.834 527 H CYS 69 H CYS 69 -8.959 -11.243 3.170 528 HA CYS 69 HA CYS 69 -6.957 -12.208 5.255 529 HB2 CYS 69 HB2 CYS 69 -5.112 -10.933 3.991 530 HB3 CYS 69 HB3 CYS 69 -5.638 -12.514 3.406 531 HG CYS 69 HG CYS 69 -6.942 -11.742 1.360 532 H GLU 70 H GLU 70 -6.665 -10.938 6.790 533 HA GLU 70 HA GLU 70 -8.035 -8.255 6.966 534 HB2 GLU 70 HB2 GLU 70 -7.765 -8.346 9.370 535 HB3 GLU 70 HB3 GLU 70 -8.740 -9.611 8.686 536 HG2 GLU 70 HG2 GLU 70 -6.916 -11.300 8.969 537 HG3 GLU 70 HG3 GLU 70 -5.823 -10.019 9.467 538 H LEU 71 H LEU 71 -6.993 -6.499 6.464 539 HA LEU 71 HA LEU 71 -4.023 -6.143 7.233 540 HB2 LEU 71 HB2 LEU 71 -5.533 -4.818 4.904 541 HB3 LEU 71 HB3 LEU 71 -3.841 -4.599 5.297 542 HG LEU 71 HG LEU 71 -5.144 -7.179 4.233 543 HD11 LEU 71 HD11 LEU 71 -4.865 -5.284 2.583 544 HD12 LEU 71 HD12 LEU 71 -3.832 -6.654 2.164 545 HD13 LEU 71 HD13 LEU 71 -3.134 -5.214 2.939 546 HD21 LEU 71 HD21 LEU 71 -2.795 -8.100 4.033 547 HD22 LEU 71 HD22 LEU 71 -3.252 -7.843 5.710 548 HD23 LEU 71 HD23 LEU 71 -2.158 -6.690 4.899 549 H GLU 72 H GLU 72 -3.423 -4.317 8.328 550 HA GLU 72 HA GLU 72 -5.469 -2.650 9.707 551 HB2 GLU 72 HB2 GLU 72 -3.151 -3.319 10.610 552 HB3 GLU 72 HB3 GLU 72 -2.422 -2.212 9.454 553 HG2 GLU 72 HG2 GLU 72 -3.821 -0.298 10.603 554 HG3 GLU 72 HG3 GLU 72 -4.291 -1.479 11.820 555 H THR 73 H THR 73 -6.092 -0.686 9.412 556 HA THR 73 HA THR 73 -5.490 0.805 6.804 557 HB THR 73 HB THR 73 -7.695 -0.021 6.655 558 HG1 THR 73 HG1 THR 73 -8.627 2.362 7.500 559 HG21 THR 73 HG21 THR 73 -9.580 0.515 8.283 560 HG22 THR 73 HG22 THR 73 -8.363 1.181 9.408 561 HG23 THR 73 HG23 THR 73 -8.366 -0.555 8.991 562 H MET 74 H MET 74 -5.941 3.051 6.931 563 HA MET 74 HA MET 74 -4.467 4.421 9.238 564 HB2 MET 74 HB2 MET 74 -5.456 5.511 6.536 565 HB3 MET 74 HB3 MET 74 -4.950 6.578 7.828 566 HG2 MET 74 HG2 MET 74 -3.116 4.462 6.550 567 HG3 MET 74 HG3 MET 74 -3.101 6.199 6.229 568 HE1 MET 74 HE1 MET 74 -0.994 3.807 7.717 569 HE2 MET 74 HE2 MET 74 -0.805 4.134 9.468 570 HE3 MET 74 HE3 MET 74 -2.300 3.361 8.855 571 H THR 75 H THR 75 -7.646 4.939 7.633 572 HA THR 75 HA THR 75 -8.811 5.757 10.350 573 HB THR 75 HB THR 75 -10.147 5.987 7.611 574 HG1 THR 75 HG1 THR 75 -9.812 8.306 8.202 575 HG21 THR 75 HG21 THR 75 -10.953 7.249 10.322 576 HG22 THR 75 HG22 THR 75 -11.812 5.899 9.536 577 HG23 THR 75 HG23 THR 75 -11.777 7.493 8.765 578 H GLY 76 H GLY 76 -9.731 4.180 11.402 579 HA2 GLY 76 HA2 GLY 76 -11.721 2.476 11.247 580 HA3 GLY 76 HA3 GLY 76 -10.845 1.646 10.002 581 H GLU 77 H GLU 77 -9.403 0.017 10.643 582 HA GLU 77 HA GLU 77 -8.620 -0.552 13.358 583 HB2 GLU 77 HB2 GLU 77 -10.159 -2.182 14.151 584 HB3 GLU 77 HB3 GLU 77 -10.926 -0.637 13.960 585 HG2 GLU 77 HG2 GLU 77 -11.485 -3.201 12.363 586 HG3 GLU 77 HG3 GLU 77 -12.515 -2.250 13.396 587 H LYS 78 H LYS 78 -10.088 -2.716 11.052 588 HA LYS 78 HA LYS 78 -7.602 -3.560 9.756 589 HB2 LYS 78 HB2 LYS 78 -7.802 -4.774 12.262 590 HB3 LYS 78 HB3 LYS 78 -8.735 -5.937 11.347 591 HG2 LYS 78 HG2 LYS 78 -6.732 -6.108 9.706 592 HG3 LYS 78 HG3 LYS 78 -5.895 -4.926 10.722 593 HD2 LYS 78 HD2 LYS 78 -6.068 -6.547 12.704 594 HD3 LYS 78 HD3 LYS 78 -6.911 -7.694 11.661 595 HE2 LYS 78 HE2 LYS 78 -4.806 -7.686 10.107 596 HE3 LYS 78 HE3 LYS 78 -3.973 -6.711 11.313 597 HZ1 LYS 78 HZ1 LYS 78 -4.365 -8.549 12.966 598 HZ2 LYS 78 HZ2 LYS 78 -3.679 -9.229 11.618 599 HZ3 LYS 78 HZ3 LYS 78 -5.313 -9.385 11.906 600 H VAL 79 H VAL 79 -8.228 -3.947 7.780 601 HA VAL 79 HA VAL 79 -11.164 -4.571 7.248 602 HB VAL 79 HB VAL 79 -10.230 -2.414 6.483 603 HG11 VAL 79 HG11 VAL 79 -8.868 -2.178 4.435 604 HG12 VAL 79 HG12 VAL 79 -7.928 -2.971 5.704 605 HG13 VAL 79 HG13 VAL 79 -8.590 -3.932 4.367 606 HG21 VAL 79 HG21 VAL 79 -11.221 -4.144 4.144 607 HG22 VAL 79 HG22 VAL 79 -12.260 -3.419 5.401 608 HG23 VAL 79 HG23 VAL 79 -11.338 -2.376 4.308 609 H LYS 80 H LYS 80 -11.788 -6.430 6.364 610 HA LYS 80 HA LYS 80 -9.752 -8.433 5.359 611 HB2 LYS 80 HB2 LYS 80 -12.729 -8.758 5.949 612 HB3 LYS 80 HB3 LYS 80 -11.800 -9.945 5.050 613 HG2 LYS 80 HG2 LYS 80 -10.076 -10.017 6.941 614 HG3 LYS 80 HG3 LYS 80 -11.139 -9.001 7.918 615 HD2 LYS 80 HD2 LYS 80 -12.929 -10.818 7.775 616 HD3 LYS 80 HD3 LYS 80 -11.874 -11.752 6.718 617 HE2 LYS 80 HE2 LYS 80 -10.085 -11.765 8.644 618 HE3 LYS 80 HE3 LYS 80 -11.295 -11.035 9.695 619 HZ1 LYS 80 HZ1 LYS 80 -11.449 -13.510 9.863 620 HZ2 LYS 80 HZ2 LYS 80 -11.516 -13.694 8.218 621 HZ3 LYS 80 HZ3 LYS 80 -12.793 -13.051 8.987 622 H THR 81 H THR 81 -8.966 -7.537 3.637 623 HA THR 81 HA THR 81 -10.739 -6.820 1.228 624 HB THR 81 HB THR 81 -9.604 -4.924 2.280 625 HG1 THR 81 HG1 THR 81 -8.595 -5.595 -0.285 626 HG21 THR 81 HG21 THR 81 -7.207 -4.552 2.320 627 HG22 THR 81 HG22 THR 81 -6.853 -6.026 1.406 628 HG23 THR 81 HG23 THR 81 -7.421 -6.116 3.089 629 H VAL 82 H VAL 82 -10.748 -8.536 -0.117 630 HA VAL 82 HA VAL 82 -8.305 -10.305 -0.355 631 HB VAL 82 HB VAL 82 -10.453 -11.480 -0.141 632 HG11 VAL 82 HG11 VAL 82 -11.784 -12.024 -2.193 633 HG12 VAL 82 HG12 VAL 82 -11.993 -10.313 -1.739 634 HG13 VAL 82 HG13 VAL 82 -10.933 -10.759 -3.107 635 HG21 VAL 82 HG21 VAL 82 -8.883 -12.158 -2.714 636 HG22 VAL 82 HG22 VAL 82 -8.354 -12.541 -1.066 637 HG23 VAL 82 HG23 VAL 82 -9.849 -13.256 -1.699 638 H VAL 83 H VAL 83 -7.002 -10.417 -2.042 639 HA VAL 83 HA VAL 83 -7.177 -8.139 -4.066 640 HB VAL 83 HB VAL 83 -4.629 -9.629 -3.256 641 HG11 VAL 83 HG11 VAL 83 -3.502 -7.564 -4.065 642 HG12 VAL 83 HG12 VAL 83 -4.512 -8.238 -5.360 643 HG13 VAL 83 HG13 VAL 83 -5.062 -6.807 -4.465 644 HG21 VAL 83 HG21 VAL 83 -4.054 -7.637 -1.747 645 HG22 VAL 83 HG22 VAL 83 -5.732 -7.097 -1.851 646 HG23 VAL 83 HG23 VAL 83 -5.354 -8.652 -1.109 647 H GLN 84 H GLN 84 -7.325 -8.522 -6.173 648 HA GLN 84 HA GLN 84 -7.015 -11.395 -7.239 649 HB2 GLN 84 HB2 GLN 84 -8.701 -9.031 -8.196 650 HB3 GLN 84 HB3 GLN 84 -8.261 -10.294 -9.304 651 HG2 GLN 84 HG2 GLN 84 -10.487 -10.734 -8.457 652 HG3 GLN 84 HG3 GLN 84 -9.408 -12.040 -8.047 653 HE21 GLN 84 HE21 GLN 84 -9.279 -12.584 -5.875 654 HE22 GLN 84 HE22 GLN 84 -10.217 -11.667 -4.581 655 H LEU 85 H LEU 85 -5.668 -11.829 -8.904 656 HA LEU 85 HA LEU 85 -3.561 -9.720 -9.563 657 HB2 LEU 85 HB2 LEU 85 -2.808 -11.483 -8.008 658 HB3 LEU 85 HB3 LEU 85 -3.333 -12.743 -9.110 659 HG LEU 85 HG LEU 85 -1.652 -12.075 -10.779 660 HD11 LEU 85 HD11 LEU 85 -0.621 -10.024 -8.695 661 HD12 LEU 85 HD12 LEU 85 -1.351 -9.621 -10.269 662 HD13 LEU 85 HD13 LEU 85 0.193 -10.458 -10.198 663 HD21 LEU 85 HD21 LEU 85 0.378 -12.872 -9.476 664 HD22 LEU 85 HD22 LEU 85 -1.071 -13.827 -9.112 665 HD23 LEU 85 HD23 LEU 85 -0.508 -12.598 -7.957 666 H GLU 86 H GLU 86 -3.443 -9.149 -11.613 667 HA GLU 86 HA GLU 86 -4.177 -11.122 -13.861 668 HB2 GLU 86 HB2 GLU 86 -5.498 -8.930 -13.717 669 HB3 GLU 86 HB3 GLU 86 -3.992 -8.096 -14.057 670 HG2 GLU 86 HG2 GLU 86 -3.836 -9.398 -16.295 671 HG3 GLU 86 HG3 GLU 86 -5.460 -10.011 -15.966 672 H GLY 87 H GLY 87 -2.652 -11.752 -15.099 673 HA2 GLY 87 HA2 GLY 87 -0.460 -12.267 -16.056 674 HA3 GLY 87 HA3 GLY 87 -0.377 -10.527 -16.182 675 H ASP 88 H ASP 88 -0.234 -11.799 -13.101 676 HA ASP 88 HA ASP 88 1.397 -11.804 -11.399 677 HB2 ASP 88 HB2 ASP 88 2.477 -13.599 -12.851 678 HB3 ASP 88 HB3 ASP 88 3.599 -12.373 -13.420 679 H ASN 89 H ASN 89 0.738 -9.310 -12.893 680 HA ASN 89 HA ASN 89 2.682 -7.589 -11.314 681 HB2 ASN 89 HB2 ASN 89 3.400 -6.263 -12.986 682 HB3 ASN 89 HB3 ASN 89 3.448 -7.816 -13.747 683 HD21 ASN 89 HD21 ASN 89 3.153 -4.920 -14.657 684 HD22 ASN 89 HD22 ASN 89 1.802 -5.063 -15.909 685 H LYS 90 H LYS 90 -0.634 -7.675 -12.550 686 HA LYS 90 HA LYS 90 -1.168 -4.968 -11.193 687 HB2 LYS 90 HB2 LYS 90 -2.874 -6.683 -13.049 688 HB3 LYS 90 HB3 LYS 90 -3.406 -5.156 -12.390 689 HG2 LYS 90 HG2 LYS 90 -1.795 -3.874 -13.704 690 HG3 LYS 90 HG3 LYS 90 -0.892 -5.322 -14.163 691 HD2 LYS 90 HD2 LYS 90 -2.951 -6.230 -15.336 692 HD3 LYS 90 HD3 LYS 90 -3.829 -4.760 -15.004 693 HE2 LYS 90 HE2 LYS 90 -1.204 -4.958 -16.664 694 HE3 LYS 90 HE3 LYS 90 -2.830 -5.035 -17.344 695 HZ1 LYS 90 HZ1 LYS 90 -2.024 -2.692 -17.454 696 HZ2 LYS 90 HZ2 LYS 90 -1.668 -2.617 -15.849 697 HZ3 LYS 90 HZ3 LYS 90 -3.236 -2.735 -16.335 698 H LEU 91 H LEU 91 -1.609 -5.222 -9.075 699 HA LEU 91 HA LEU 91 -3.462 -7.473 -8.094 700 HB2 LEU 91 HB2 LEU 91 -1.485 -5.614 -6.710 701 HB3 LEU 91 HB3 LEU 91 -2.633 -6.503 -5.784 702 HG LEU 91 HG LEU 91 -0.564 -7.831 -7.629 703 HD11 LEU 91 HD11 LEU 91 0.506 -6.562 -5.743 704 HD12 LEU 91 HD12 LEU 91 0.667 -8.304 -5.468 705 HD13 LEU 91 HD13 LEU 91 -0.559 -7.362 -4.576 706 HD21 LEU 91 HD21 LEU 91 -2.567 -9.328 -7.129 707 HD22 LEU 91 HD22 LEU 91 -2.295 -9.107 -5.389 708 HD23 LEU 91 HD23 LEU 91 -1.080 -9.933 -6.375 709 H VAL 92 H VAL 92 -5.562 -6.906 -8.007 710 HA VAL 92 HA VAL 92 -6.333 -4.031 -7.239 711 HB VAL 92 HB VAL 92 -8.380 -4.262 -8.481 712 HG11 VAL 92 HG11 VAL 92 -6.014 -4.954 -10.324 713 HG12 VAL 92 HG12 VAL 92 -7.488 -4.058 -10.762 714 HG13 VAL 92 HG13 VAL 92 -6.314 -3.353 -9.628 715 HG21 VAL 92 HG21 VAL 92 -8.839 -6.092 -10.129 716 HG22 VAL 92 HG22 VAL 92 -7.453 -7.020 -9.511 717 HG23 VAL 92 HG23 VAL 92 -8.861 -6.708 -8.468 718 H THR 93 H THR 93 -7.364 -3.660 -5.371 719 HA THR 93 HA THR 93 -9.281 -5.771 -4.301 720 HB THR 93 HB THR 93 -7.011 -6.091 -3.267 721 HG1 THR 93 HG1 THR 93 -8.768 -6.962 -2.321 722 HG21 THR 93 HG21 THR 93 -6.214 -3.807 -2.710 723 HG22 THR 93 HG22 THR 93 -6.401 -4.757 -1.226 724 HG23 THR 93 HG23 THR 93 -7.619 -3.537 -1.635 725 H THR 94 H THR 94 -10.387 -5.003 -2.304 726 HA THR 94 HA THR 94 -11.612 -2.212 -2.753 727 HB THR 94 HB THR 94 -13.199 -4.733 -1.977 728 HG1 THR 94 HG1 THR 94 -14.176 -4.445 -3.954 729 HG21 THR 94 HG21 THR 94 -14.199 -2.618 -1.015 730 HG22 THR 94 HG22 THR 94 -15.229 -3.285 -2.293 731 HG23 THR 94 HG23 THR 94 -14.200 -1.870 -2.631 732 H PHE 95 H PHE 95 -10.639 -1.181 -1.098 733 HA PHE 95 HA PHE 95 -10.077 -2.561 1.548 734 HB2 PHE 95 HB2 PHE 95 -8.506 -1.031 -0.083 735 HB3 PHE 95 HB3 PHE 95 -9.333 0.269 0.695 736 HD1 PHE 95 HD2 PHE 95 -7.146 -2.666 1.209 737 HD2 PHE 95 HD1 PHE 95 -8.474 1.058 2.888 738 HE1 PHE 95 HE2 PHE 95 -5.440 -2.847 2.973 739 HE2 PHE 95 HE1 PHE 95 -6.738 0.896 4.607 740 HZ PHE 95 HZ PHE 95 -5.242 -1.078 4.695 741 H LYS 96 H LYS 96 -10.318 0.397 2.734 742 HA LYS 96 HA LYS 96 -13.170 0.095 3.765 743 HB2 LYS 96 HB2 LYS 96 -11.053 2.238 4.388 744 HB3 LYS 96 HB3 LYS 96 -12.606 2.137 5.161 745 HG2 LYS 96 HG2 LYS 96 -10.454 -0.064 5.360 746 HG3 LYS 96 HG3 LYS 96 -10.560 1.289 6.448 747 HD2 LYS 96 HD2 LYS 96 -12.809 -0.812 6.120 748 HD3 LYS 96 HD3 LYS 96 -11.513 -0.889 7.303 749 HE2 LYS 96 HE2 LYS 96 -12.295 1.427 8.216 750 HE3 LYS 96 HE3 LYS 96 -13.738 1.246 7.219 751 HZ1 LYS 96 HZ1 LYS 96 -12.821 -0.805 9.318 752 HZ2 LYS 96 HZ2 LYS 96 -14.192 -0.937 8.424 753 HZ3 LYS 96 HZ3 LYS 96 -13.993 0.229 9.577 754 H ASN 97 H ASN 97 -14.305 0.455 1.736 755 HA ASN 97 HA ASN 97 -15.055 1.505 -0.205 756 HB2 ASN 97 HB2 ASN 97 -15.128 3.912 1.695 757 HB3 ASN 97 HB3 ASN 97 -15.972 3.770 0.176 758 HD21 ASN 97 HD21 ASN 97 -17.903 2.558 0.083 759 HD22 ASN 97 HD22 ASN 97 -18.634 1.882 1.632 760 H ILE 98 H ILE 98 -12.257 1.347 -0.219 761 HA ILE 98 HA ILE 98 -11.520 3.582 -2.218 762 HB ILE 98 HB ILE 98 -9.685 2.155 -0.214 763 HG12 ILE 98 HG12 ILE 98 -9.976 5.173 0.011 764 HG13 ILE 98 HG13 ILE 98 -11.318 4.236 0.596 765 HG21 ILE 98 HG21 ILE 98 -8.389 2.755 -2.257 766 HG22 ILE 98 HG22 ILE 98 -8.933 4.444 -2.141 767 HG23 ILE 98 HG23 ILE 98 -7.875 3.744 -0.890 768 HD11 ILE 98 HD11 ILE 98 -9.943 2.976 2.191 769 HD12 ILE 98 HD12 ILE 98 -8.442 3.700 1.573 770 HD13 ILE 98 HD13 ILE 98 -9.647 4.713 2.409 771 H LYS 99 H LYS 99 -10.811 2.811 -4.167 772 HA LYS 99 HA LYS 99 -10.529 -0.218 -4.552 773 HB2 LYS 99 HB2 LYS 99 -12.155 1.043 -6.000 774 HB3 LYS 99 HB3 LYS 99 -10.858 1.949 -6.683 775 HG2 LYS 99 HG2 LYS 99 -10.452 0.332 -8.216 776 HG3 LYS 99 HG3 LYS 99 -9.999 -0.817 -6.995 777 HD2 LYS 99 HD2 LYS 99 -12.832 -0.307 -8.099 778 HD3 LYS 99 HD3 LYS 99 -11.817 -1.663 -8.509 779 HE2 LYS 99 HE2 LYS 99 -13.021 -1.134 -5.691 780 HE3 LYS 99 HE3 LYS 99 -13.716 -2.200 -6.899 781 HZ1 LYS 99 HZ1 LYS 99 -11.635 -3.596 -6.788 782 HZ2 LYS 99 HZ2 LYS 99 -12.327 -3.462 -5.286 783 HZ3 LYS 99 HZ3 LYS 99 -10.989 -2.605 -5.641 784 H SER 100 H SER 100 -8.544 -0.775 -3.974 785 HA SER 100 HA SER 100 -6.123 0.983 -4.496 786 HB2 SER 100 HB2 SER 100 -6.509 0.031 -2.224 787 HB3 SER 100 HB3 SER 100 -6.369 -1.601 -2.860 788 HG SER 100 HG SER 100 -4.225 -1.113 -3.497 789 H VAL 101 H VAL 101 -5.101 0.764 -6.327 790 HA VAL 101 HA VAL 101 -4.917 -1.955 -7.770 791 HB VAL 101 HB VAL 101 -4.860 0.910 -8.895 792 HG11 VAL 101 HG11 VAL 101 -3.403 -0.546 -10.295 793 HG12 VAL 101 HG12 VAL 101 -4.693 -1.759 -10.450 794 HG13 VAL 101 HG13 VAL 101 -4.877 -0.140 -11.178 795 HG21 VAL 101 HG21 VAL 101 -7.009 0.327 -10.060 796 HG22 VAL 101 HG22 VAL 101 -7.057 -1.245 -9.226 797 HG23 VAL 101 HG23 VAL 101 -7.197 0.264 -8.302 798 H THR 102 H THR 102 -2.962 -2.827 -7.236 799 HA THR 102 HA THR 102 -0.512 -1.015 -7.088 800 HB THR 102 HB THR 102 -0.435 -3.909 -6.202 801 HG1 THR 102 HG1 THR 102 -0.910 -1.773 -4.402 802 HG21 THR 102 HG21 THR 102 1.198 -1.470 -5.263 803 HG22 THR 102 HG22 THR 102 1.737 -2.652 -6.477 804 HG23 THR 102 HG23 THR 102 1.443 -3.176 -4.814 805 H GLU 103 H GLU 103 0.716 -0.894 -8.979 806 HA GLU 103 HA GLU 103 0.626 -3.322 -10.852 807 HB2 GLU 103 HB2 GLU 103 -0.506 -1.185 -11.744 808 HB3 GLU 103 HB3 GLU 103 1.109 -0.501 -11.850 809 HG2 GLU 103 HG2 GLU 103 1.860 -2.334 -13.402 810 HG3 GLU 103 HG3 GLU 103 0.325 -3.158 -13.233 811 H LEU 104 H LEU 104 2.437 -4.223 -11.323 812 HA LEU 104 HA LEU 104 5.115 -2.974 -10.532 813 HB2 LEU 104 HB2 LEU 104 4.096 -5.500 -9.956 814 HB3 LEU 104 HB3 LEU 104 5.017 -5.874 -11.384 815 HG LEU 104 HG LEU 104 6.037 -4.554 -8.791 816 HD11 LEU 104 HD11 LEU 104 5.496 -7.038 -8.709 817 HD12 LEU 104 HD12 LEU 104 7.215 -6.708 -8.465 818 HD13 LEU 104 HD13 LEU 104 6.642 -7.326 -10.029 819 HD21 LEU 104 HD21 LEU 104 7.679 -5.299 -11.306 820 HD22 LEU 104 HD22 LEU 104 8.378 -4.834 -9.734 821 HD23 LEU 104 HD23 LEU 104 7.441 -3.663 -10.665 822 H ASN 105 H ASN 105 6.198 -1.973 -12.095 823 HA ASN 105 HA ASN 105 5.879 -2.854 -15.055 824 HB2 ASN 105 HB2 ASN 105 6.389 -0.071 -13.832 825 HB3 ASN 105 HB3 ASN 105 6.734 -0.449 -15.500 826 HD21 ASN 105 HD21 ASN 105 4.033 -0.339 -13.212 827 HD22 ASN 105 HD22 ASN 105 2.769 -0.206 -14.543 828 H GLY 106 H GLY 106 7.361 -4.533 -14.639 829 HA2 GLY 106 HA2 GLY 106 9.583 -5.434 -15.164 830 HA3 GLY 106 HA3 GLY 106 10.252 -3.815 -15.224 831 H ASP 107 H ASP 107 11.089 -2.965 -13.345 832 HA ASP 107 HA ASP 107 10.861 -4.525 -10.707 833 HB2 ASP 107 HB2 ASP 107 13.480 -3.505 -11.968 834 HB3 ASP 107 HB3 ASP 107 13.334 -3.921 -10.276 835 H ILE 108 H ILE 108 9.475 -2.085 -11.694 836 HA ILE 108 HA ILE 108 9.905 -0.488 -9.142 837 HB ILE 108 HB ILE 108 9.389 1.552 -10.011 838 HG12 ILE 108 HG12 ILE 108 9.554 1.705 -12.736 839 HG13 ILE 108 HG13 ILE 108 8.689 0.198 -12.626 840 HG21 ILE 108 HG21 ILE 108 11.647 0.392 -11.721 841 HG22 ILE 108 HG22 ILE 108 11.399 2.112 -11.320 842 HG23 ILE 108 HG23 ILE 108 11.761 0.949 -10.036 843 HD11 ILE 108 HD11 ILE 108 6.910 1.368 -11.171 844 HD12 ILE 108 HD12 ILE 108 7.834 2.880 -11.310 845 HD13 ILE 108 HD13 ILE 108 7.099 2.142 -12.761 846 H ILE 109 H ILE 109 8.117 -0.227 -7.915 847 HA ILE 109 HA ILE 109 5.519 -1.412 -8.993 848 HB ILE 109 HB ILE 109 6.702 -2.773 -7.220 849 HG12 ILE 109 HG12 ILE 109 3.922 -1.838 -6.328 850 HG13 ILE 109 HG13 ILE 109 4.180 -2.853 -7.739 851 HG21 ILE 109 HG21 ILE 109 7.526 -0.901 -5.710 852 HG22 ILE 109 HG22 ILE 109 5.856 -0.573 -5.205 853 HG23 ILE 109 HG23 ILE 109 6.627 -2.125 -4.813 854 HD11 ILE 109 HD11 ILE 109 3.595 -4.250 -5.750 855 HD12 ILE 109 HD12 ILE 109 5.233 -4.657 -6.327 856 HD13 ILE 109 HD13 ILE 109 5.010 -3.655 -4.873 857 H THR 110 H THR 110 3.740 -0.236 -8.980 858 HA THR 110 HA THR 110 3.744 2.363 -7.374 859 HB THR 110 HB THR 110 3.764 2.552 -9.933 860 HG1 THR 110 HG1 THR 110 2.902 4.071 -8.071 861 HG21 THR 110 HG21 THR 110 1.681 2.643 -11.163 862 HG22 THR 110 HG22 THR 110 0.748 2.098 -9.746 863 HG23 THR 110 HG23 THR 110 1.915 0.996 -10.516 864 H ASN 111 H ASN 111 2.189 2.713 -5.945 865 HA ASN 111 HA ASN 111 -0.112 0.671 -5.737 866 HB2 ASN 111 HB2 ASN 111 1.577 0.575 -3.815 867 HB3 ASN 111 HB3 ASN 111 1.053 2.179 -3.334 868 HD21 ASN 111 HD21 ASN 111 -0.812 2.224 -2.046 869 HD22 ASN 111 HD22 ASN 111 -1.899 0.755 -1.822 870 H THR 112 H THR 112 -1.790 1.609 -6.692 871 HA THR 112 HA THR 112 -2.269 4.623 -6.374 872 HB THR 112 HB THR 112 -3.409 2.746 -8.498 873 HG1 THR 112 HG1 THR 112 -1.087 2.993 -8.455 874 HG21 THR 112 HG21 THR 112 -3.768 4.851 -9.791 875 HG22 THR 112 HG22 THR 112 -3.097 5.824 -8.461 876 HG23 THR 112 HG23 THR 112 -4.639 4.955 -8.244 877 H MET 113 H MET 113 -3.423 4.813 -4.560 878 HA MET 113 HA MET 113 -5.880 3.076 -3.996 879 HB2 MET 113 HB2 MET 113 -4.345 5.087 -2.299 880 HB3 MET 113 HB3 MET 113 -5.957 4.579 -1.862 881 HG2 MET 113 HG2 MET 113 -5.158 2.118 -1.971 882 HG3 MET 113 HG3 MET 113 -3.505 2.743 -2.089 883 HE1 MET 113 HE1 MET 113 -3.609 0.993 0.297 884 HE2 MET 113 HE2 MET 113 -4.654 1.439 1.678 885 HE3 MET 113 HE3 MET 113 -5.392 0.969 0.127 886 H THR 114 H THR 114 -7.425 3.627 -5.277 887 HA THR 114 HA THR 114 -8.072 6.519 -5.931 888 HB THR 114 HB THR 114 -9.597 5.691 -7.639 889 HG1 THR 114 HG1 THR 114 -8.740 3.124 -6.746 890 HG21 THR 114 HG21 THR 114 -7.192 6.014 -8.293 891 HG22 THR 114 HG22 THR 114 -7.985 4.723 -9.225 892 HG23 THR 114 HG23 THR 114 -6.863 4.302 -7.912 893 H LEU 115 H LEU 115 -9.295 7.568 -4.591 894 HA LEU 115 HA LEU 115 -11.782 6.263 -3.287 895 HB2 LEU 115 HB2 LEU 115 -10.043 6.788 -1.649 896 HB3 LEU 115 HB3 LEU 115 -9.852 8.414 -2.261 897 HG LEU 115 HG LEU 115 -12.145 9.037 -1.463 898 HD11 LEU 115 HD11 LEU 115 -12.236 6.211 -0.197 899 HD12 LEU 115 HD12 LEU 115 -13.302 6.803 -1.487 900 HD13 LEU 115 HD13 LEU 115 -13.380 7.531 0.124 901 HD21 LEU 115 HD21 LEU 115 -10.124 9.428 -0.039 902 HD22 LEU 115 HD22 LEU 115 -10.297 7.814 0.689 903 HD23 LEU 115 HD23 LEU 115 -11.538 9.062 0.966 904 H GLY 116 H GLY 116 -12.687 6.709 -5.423 905 HA2 GLY 116 HA2 GLY 116 -14.336 7.930 -6.719 906 HA3 GLY 116 HA3 GLY 116 -14.400 9.154 -5.474 907 H ASP 117 H ASP 117 -12.979 10.864 -5.616 908 HA ASP 117 HA ASP 117 -11.817 11.528 -8.381 909 HB2 ASP 117 HB2 ASP 117 -12.593 13.393 -6.040 910 HB3 ASP 117 HB3 ASP 117 -11.807 13.920 -7.516 911 H ILE 118 H ILE 118 -10.852 10.925 -5.073 912 HA ILE 118 HA ILE 118 -8.171 12.288 -5.277 913 HB ILE 118 HB ILE 118 -9.210 10.378 -3.133 914 HG12 ILE 118 HG12 ILE 118 -10.735 12.301 -3.124 915 HG13 ILE 118 HG13 ILE 118 -9.852 12.077 -1.642 916 HG21 ILE 118 HG21 ILE 118 -6.834 12.375 -3.019 917 HG22 ILE 118 HG22 ILE 118 -7.429 11.392 -1.669 918 HG23 ILE 118 HG23 ILE 118 -6.700 10.605 -3.072 919 HD11 ILE 118 HD11 ILE 118 -9.125 14.240 -3.730 920 HD12 ILE 118 HD12 ILE 118 -10.078 14.500 -2.243 921 HD13 ILE 118 HD13 ILE 118 -8.377 14.022 -2.120 922 H VAL 119 H VAL 119 -6.556 11.304 -6.355 923 HA VAL 119 HA VAL 119 -6.343 8.230 -6.464 924 HB VAL 119 HB VAL 119 -5.231 10.339 -8.398 925 HG11 VAL 119 HG11 VAL 119 -3.802 8.286 -8.405 926 HG12 VAL 119 HG12 VAL 119 -5.237 7.259 -8.654 927 HG13 VAL 119 HG13 VAL 119 -4.715 8.404 -9.913 928 HG21 VAL 119 HG21 VAL 119 -7.619 8.392 -8.804 929 HG22 VAL 119 HG22 VAL 119 -7.733 10.157 -8.658 930 HG23 VAL 119 HG23 VAL 119 -6.918 9.448 -10.057 931 H PHE 120 H PHE 120 -5.265 7.910 -4.481 932 HA PHE 120 HA PHE 120 -2.699 9.402 -3.859 933 HB2 PHE 120 HB2 PHE 120 -4.048 9.011 -1.982 934 HB3 PHE 120 HB3 PHE 120 -4.316 7.332 -2.350 935 HD1 PHE 120 HD2 PHE 120 -1.059 9.336 -2.109 936 HD2 PHE 120 HD1 PHE 120 -3.406 6.091 -0.531 937 HE1 PHE 120 HE2 PHE 120 0.858 8.569 -0.812 938 HE2 PHE 120 HE1 PHE 120 -1.465 5.332 0.763 939 HZ PHE 120 HZ PHE 120 0.683 6.566 0.623 940 H LYS 121 H LYS 121 -1.242 8.947 -5.364 941 HA LYS 121 HA LYS 121 -0.559 6.042 -5.997 942 HB2 LYS 121 HB2 LYS 121 -1.314 7.662 -7.780 943 HB3 LYS 121 HB3 LYS 121 0.175 8.554 -7.562 944 HG2 LYS 121 HG2 LYS 121 1.515 6.479 -8.170 945 HG3 LYS 121 HG3 LYS 121 0.014 5.574 -8.370 946 HD2 LYS 121 HD2 LYS 121 -0.736 7.236 -10.153 947 HD3 LYS 121 HD3 LYS 121 0.771 8.129 -9.947 948 HE2 LYS 121 HE2 LYS 121 2.094 6.026 -10.621 949 HE3 LYS 121 HE3 LYS 121 0.577 5.148 -10.839 950 HZ1 LYS 121 HZ1 LYS 121 1.283 7.694 -12.316 951 HZ2 LYS 121 HZ2 LYS 121 -0.092 6.843 -12.544 952 HZ3 LYS 121 HZ3 LYS 121 1.353 6.191 -12.996 953 H ARG 122 H ARG 122 0.989 5.190 -4.831 954 HA ARG 122 HA ARG 122 3.595 6.691 -4.217 955 HB2 ARG 122 HB2 ARG 122 2.540 3.902 -3.422 956 HB3 ARG 122 HB3 ARG 122 4.241 4.260 -3.364 957 HG2 ARG 122 HG2 ARG 122 3.770 6.267 -1.838 958 HG3 ARG 122 HG3 ARG 122 2.092 5.716 -1.707 959 HD2 ARG 122 HD2 ARG 122 2.888 3.488 -0.805 960 HD3 ARG 122 HD3 ARG 122 4.557 3.936 -1.130 961 HE ARG 122 HE ARG 122 3.498 5.973 0.667 962 HH11 ARG 122 HH11 ARG 122 4.674 2.644 0.656 963 HH12 ARG 122 HH12 ARG 122 5.248 2.830 2.394 964 HH21 ARG 122 HH21 ARG 122 4.123 6.056 2.606 965 HH22 ARG 122 HH22 ARG 122 4.929 4.622 3.437 966 H ILE 123 H ILE 123 5.510 6.252 -5.224 967 HA ILE 123 HA ILE 123 5.672 4.031 -7.347 968 HB ILE 123 HB ILE 123 6.923 6.827 -7.595 969 HG12 ILE 123 HG12 ILE 123 5.424 6.728 -9.862 970 HG13 ILE 123 HG13 ILE 123 4.431 5.635 -8.932 971 HG21 ILE 123 HG21 ILE 123 6.969 4.452 -9.577 972 HG22 ILE 123 HG22 ILE 123 7.652 6.070 -9.877 973 HG23 ILE 123 HG23 ILE 123 8.354 5.040 -8.629 974 HD11 ILE 123 HD11 ILE 123 3.558 7.971 -8.819 975 HD12 ILE 123 HD12 ILE 123 4.119 7.558 -7.192 976 HD13 ILE 123 HD13 ILE 123 5.113 8.587 -8.238 977 H SER 124 H SER 124 6.892 2.532 -6.384 978 HA SER 124 HA SER 124 9.426 3.347 -4.835 979 HB2 SER 124 HB2 SER 124 7.471 1.000 -4.294 980 HB3 SER 124 HB3 SER 124 8.960 1.307 -3.402 981 HG SER 124 HG SER 124 6.523 2.361 -2.965 982 H LYS 125 H LYS 125 11.314 2.158 -5.165 983 HA LYS 125 HA LYS 125 11.318 0.423 -7.689 984 HB2 LYS 125 HB2 LYS 125 12.553 2.541 -7.816 985 HB3 LYS 125 HB3 LYS 125 13.569 2.104 -6.441 986 HG2 LYS 125 HG2 LYS 125 14.672 0.328 -7.638 987 HG3 LYS 125 HG3 LYS 125 13.429 0.209 -8.861 988 HD2 LYS 125 HD2 LYS 125 14.108 2.711 -9.513 989 HD3 LYS 125 HD3 LYS 125 15.562 2.412 -8.586 990 HE2 LYS 125 HE2 LYS 125 14.498 0.732 -10.993 991 HE3 LYS 125 HE3 LYS 125 15.718 1.988 -11.131 992 HZ1 LYS 125 HZ1 LYS 125 16.056 -0.525 -9.475 993 HZ2 LYS 125 HZ2 LYS 125 17.201 0.634 -9.616 994 HZ3 LYS 125 HZ3 LYS 125 16.782 -0.274 -10.926 995 H ARG 126 H ARG 126 12.101 -1.634 -7.674 996 HA ARG 126 HA ARG 126 12.180 -3.166 -5.262 997 HB2 ARG 126 HB2 ARG 126 11.666 -3.827 -7.715 998 HB3 ARG 126 HB3 ARG 126 13.396 -3.910 -7.987 999 HG2 ARG 126 HG2 ARG 126 13.515 -5.725 -6.141 1000 HG3 ARG 126 HG3 ARG 126 11.761 -5.583 -5.962 1001 HD2 ARG 126 HD2 ARG 126 11.634 -6.022 -8.570 1002 HD3 ARG 126 HD3 ARG 126 13.340 -6.469 -8.470 1003 HE ARG 126 HE ARG 126 11.931 -8.065 -6.464 1004 HH11 ARG 126 HH11 ARG 126 11.998 -7.757 -10.012 1005 HH12 ARG 126 HH12 ARG 126 11.250 -9.433 -10.139 1006 HH21 ARG 126 HH21 ARG 126 11.141 -9.870 -6.738 1007 HH22 ARG 126 HH22 ARG 126 10.728 -10.541 -8.408 1008 H ILE 127 H ILE 127 13.657 -3.578 -3.800 1009 HA ILE 127 HA ILE 127 16.623 -3.545 -4.355 1010 HB ILE 127 HB ILE 127 15.101 -1.695 -2.436 1011 HG12 ILE 127 HG12 ILE 127 17.511 -1.236 -4.280 1012 HG13 ILE 127 HG13 ILE 127 15.841 -0.853 -4.654 1013 HG21 ILE 127 HG21 ILE 127 18.004 -2.498 -1.901 1014 HG22 ILE 127 HG22 ILE 127 17.073 -1.213 -1.065 1015 HG23 ILE 127 HG23 ILE 127 16.588 -2.904 -0.898 1016 HD11 ILE 127 HD11 ILE 127 15.755 0.813 -2.758 1017 HD12 ILE 127 HD12 ILE 127 17.492 0.557 -2.478 1018 HD13 ILE 127 HD13 ILE 127 16.930 1.226 -4.026 1019 H21 OLA 128 H21 OLA 128 4.030 9.411 15.088 1020 H22 OLA 128 H22 OLA 128 5.003 8.214 14.265 1021 H31 OLA 128 H31 OLA 128 3.788 10.680 12.822 1022 H32 OLA 128 H32 OLA 128 2.903 9.173 13.033 1023 H41 OLA 128 H41 OLA 128 4.674 7.927 11.733 1024 H42 OLA 128 H42 OLA 128 5.585 9.425 11.550 1025 H51 OLA 128 H51 OLA 128 4.412 9.130 9.485 1026 H52 OLA 128 H52 OLA 128 3.598 10.445 10.308 1027 H61 OLA 128 H61 OLA 128 1.779 8.842 11.064 1028 H62 OLA 128 H62 OLA 128 2.630 7.502 10.299 1029 H71 OLA 128 H71 OLA 128 2.374 8.605 8.042 1030 H72 OLA 128 H72 OLA 128 1.566 9.986 8.795 1031 H81 OLA 128 H81 OLA 128 -0.265 8.427 9.655 1032 H82 OLA 128 H82 OLA 128 0.532 7.061 8.887 1033 H9 OLA 128 H9 OLA 128 -0.871 9.456 7.509 1034 H10 OLA 128 H10 OLA 128 -0.904 8.259 5.550 1035 H111 OLA 128 H111 OLA 128 0.092 5.754 6.885 1036 H112 OLA 128 H112 OLA 128 1.437 6.640 6.160 1037 H121 OLA 128 H121 OLA 128 0.253 6.625 3.935 1038 H122 OLA 128 H122 OLA 128 -1.128 5.792 4.642 1039 H131 OLA 128 H131 OLA 128 0.265 3.772 5.105 1040 H132 OLA 128 H132 OLA 128 1.726 4.607 4.561 1041 H141 OLA 128 H141 OLA 128 0.736 4.916 2.271 1042 H142 OLA 128 H142 OLA 128 -0.751 4.119 2.773 1043 H151 OLA 128 H151 OLA 128 0.542 1.975 3.192 1044 H152 OLA 128 H152 OLA 128 2.032 2.787 2.726 1045 H161 OLA 128 H161 OLA 128 0.965 3.315 0.446 1046 H162 OLA 128 H162 OLA 128 -0.439 2.367 0.896 1047 H171 OLA 128 H171 OLA 128 2.434 1.196 0.872 1048 H172 OLA 128 H172 OLA 128 1.423 1.240 -0.553 1049 H181 OLA 128 H181 OLA 128 1.288 -0.990 0.626 1050 H182 OLA 128 H182 OLA 128 0.573 -0.212 2.049 1051 H183 OLA 128 H183 OLA 128 -0.303 -0.220 0.495 1052 H21 OLA 129 H21 OLA 129 5.455 -0.743 -2.207 1053 H22 OLA 129 H22 OLA 129 4.286 -0.205 -3.399 1054 H31 OLA 129 H31 OLA 129 2.394 -0.484 -1.825 1055 H32 OLA 129 H32 OLA 129 3.483 -0.798 -0.479 1056 H41 OLA 129 H41 OLA 129 4.320 -2.877 -1.591 1057 H42 OLA 129 H42 OLA 129 3.254 -2.614 -2.967 1058 H51 OLA 129 H51 OLA 129 2.243 -2.974 -0.060 1059 H52 OLA 129 H52 OLA 129 2.481 -4.319 -1.158 1060 H61 OLA 129 H61 OLA 129 0.791 -3.447 -2.742 1061 H62 OLA 129 H62 OLA 129 0.611 -1.962 -1.811 1062 H71 OLA 129 H71 OLA 129 -0.282 -3.256 0.142 1063 H72 OLA 129 H72 OLA 129 -0.078 -4.774 -0.737 1064 H81 OLA 129 H81 OLA 129 -1.687 -4.029 -2.509 1065 H82 OLA 129 H82 OLA 129 -1.834 -2.441 -1.784 1066 H9 OLA 129 H9 OLA 129 -3.113 -5.050 -0.863 1067 H10 OLA 129 H10 OLA 129 -4.225 -3.910 0.820 1068 H111 OLA 129 H111 OLA 129 -4.101 -1.427 0.899 1069 H112 OLA 129 H112 OLA 129 -2.512 -1.393 0.155 1070 H121 OLA 129 H121 OLA 129 -1.469 -2.449 2.169 1071 H122 OLA 129 H122 OLA 129 -3.048 -2.716 2.904 1072 H131 OLA 129 H131 OLA 129 -3.421 -0.180 2.912 1073 H132 OLA 129 H132 OLA 129 -1.776 0.044 2.341 1074 H141 OLA 129 H141 OLA 129 -0.949 -1.238 4.418 1075 H142 OLA 129 H142 OLA 129 -2.611 -1.366 4.963 1076 H151 OLA 129 H151 OLA 129 -0.926 1.204 4.727 1077 H152 OLA 129 H152 OLA 129 -1.488 0.400 6.168 1078 H161 OLA 129 H161 OLA 129 -3.121 1.993 6.184 1079 H162 OLA 129 H162 OLA 129 -3.950 0.883 5.115 1080 H171 OLA 129 H171 OLA 129 -2.817 2.214 3.121 1081 H172 OLA 129 H172 OLA 129 -2.306 3.377 4.338 1082 H181 OLA 129 H181 OLA 129 -4.756 3.779 4.967 1083 H182 OLA 129 H182 OLA 129 -4.429 4.135 3.256 1084 H183 OLA 129 H183 OLA 129 -5.249 2.624 3.708 Start of MODEL 6 1 H1 SER 2 H1 SER 2 6.507 -11.286 -11.536 2 H2 SER 2 H2 SER 2 5.769 -10.274 -10.518 3 HA SER 2 HA SER 2 7.099 -12.016 -9.432 4 HB2 SER 2 HB2 SER 2 8.886 -12.040 -11.191 5 HB3 SER 2 HB3 SER 2 9.388 -10.415 -10.715 6 HG SER 2 HG SER 2 9.483 -12.805 -9.170 7 H PHE 3 H PHE 3 6.238 -11.220 -7.650 8 HA PHE 3 HA PHE 3 6.747 -8.395 -6.669 9 HB2 PHE 3 HB2 PHE 3 4.808 -10.621 -5.791 10 HB3 PHE 3 HB3 PHE 3 5.003 -9.170 -4.863 11 HD1 PHE 3 HD2 PHE 3 4.287 -6.947 -5.719 12 HD2 PHE 3 HD1 PHE 3 3.681 -10.514 -8.051 13 HE1 PHE 3 HE2 PHE 3 2.614 -5.773 -7.119 14 HE2 PHE 3 HE1 PHE 3 2.004 -9.336 -9.393 15 HZ PHE 3 HZ PHE 3 1.446 -6.971 -8.905 16 H SER 4 H SER 4 8.491 -11.196 -5.942 17 HA SER 4 HA SER 4 8.935 -10.658 -3.080 18 HB2 SER 4 HB2 SER 4 10.562 -12.349 -5.043 19 HB3 SER 4 HB3 SER 4 10.922 -12.221 -3.318 20 HG SER 4 HG SER 4 9.497 -13.978 -3.852 21 H GLY 5 H GLY 5 9.908 -8.912 -2.237 22 HA2 GLY 5 HA2 GLY 5 12.668 -8.135 -2.618 23 HA3 GLY 5 HA3 GLY 5 11.737 -7.131 -3.730 24 H LYS 6 H LYS 6 13.220 -5.940 -1.941 25 HA LYS 6 HA LYS 6 11.356 -4.794 0.246 26 HB2 LYS 6 HB2 LYS 6 14.397 -4.820 -0.064 27 HB3 LYS 6 HB3 LYS 6 13.576 -3.865 1.140 28 HG2 LYS 6 HG2 LYS 6 12.647 -5.907 2.264 29 HG3 LYS 6 HG3 LYS 6 13.360 -6.941 1.026 30 HD2 LYS 6 HD2 LYS 6 15.669 -6.075 1.632 31 HD3 LYS 6 HD3 LYS 6 14.994 -5.097 2.916 32 HE2 LYS 6 HE2 LYS 6 14.769 -8.199 2.754 33 HE3 LYS 6 HE3 LYS 6 16.056 -7.350 3.603 34 HZ1 LYS 6 HZ1 LYS 6 13.091 -7.326 4.311 35 HZ2 LYS 6 HZ2 LYS 6 14.127 -6.201 4.931 36 HZ3 LYS 6 HZ3 LYS 6 14.339 -7.807 5.262 37 H TYR 7 H TYR 7 10.238 -3.420 -1.179 38 HA TYR 7 HA TYR 7 11.717 -1.901 -3.317 39 HB2 TYR 7 HB2 TYR 7 8.699 -1.881 -2.645 40 HB3 TYR 7 HB3 TYR 7 9.424 -1.112 -4.018 41 HD1 TYR 7 HD2 TYR 7 8.862 -4.532 -2.487 42 HD2 TYR 7 HD1 TYR 7 9.573 -2.311 -6.105 43 HE1 TYR 7 HE2 TYR 7 8.515 -6.562 -3.807 44 HE2 TYR 7 HE1 TYR 7 9.168 -4.348 -7.418 45 HH TYR 7 HH TYR 7 8.846 -6.579 -7.341 46 H GLN 8 H GLN 8 12.784 -0.074 -2.695 47 HA GLN 8 HA GLN 8 11.768 1.599 -0.434 48 HB2 GLN 8 HB2 GLN 8 14.245 1.162 -0.879 49 HB3 GLN 8 HB3 GLN 8 14.142 2.318 -2.209 50 HG2 GLN 8 HG2 GLN 8 13.308 4.089 -0.541 51 HG3 GLN 8 HG3 GLN 8 13.440 2.904 0.754 52 HE21 GLN 8 HE21 GLN 8 14.635 4.942 1.408 53 HE22 GLN 8 HE22 GLN 8 16.447 4.883 1.056 54 H LEU 9 H LEU 9 10.798 3.484 -0.427 55 HA LEU 9 HA LEU 9 9.199 4.310 -2.745 56 HB2 LEU 9 HB2 LEU 9 8.374 4.357 -0.439 57 HB3 LEU 9 HB3 LEU 9 9.579 5.540 0.026 58 HG LEU 9 HG LEU 9 8.494 7.265 -1.476 59 HD11 LEU 9 HD11 LEU 9 6.162 6.797 -2.375 60 HD12 LEU 9 HD12 LEU 9 6.374 5.069 -1.979 61 HD13 LEU 9 HD13 LEU 9 7.395 5.840 -3.201 62 HD21 LEU 9 HD21 LEU 9 7.890 7.102 0.943 63 HD22 LEU 9 HD22 LEU 9 6.610 5.928 0.570 64 HD23 LEU 9 HD23 LEU 9 6.494 7.605 -0.018 65 H GLN 10 H GLN 10 9.470 5.755 -4.235 66 HA GLN 10 HA GLN 10 11.783 7.766 -4.124 67 HB2 GLN 10 HB2 GLN 10 10.371 6.455 -6.519 68 HB3 GLN 10 HB3 GLN 10 11.613 7.676 -6.658 69 HG2 GLN 10 HG2 GLN 10 12.105 4.982 -5.210 70 HG3 GLN 10 HG3 GLN 10 12.228 5.196 -6.928 71 HE21 GLN 10 HE21 GLN 10 14.441 4.434 -6.411 72 HE22 GLN 10 HE22 GLN 10 15.694 5.683 -5.910 73 H SER 11 H SER 11 8.587 7.536 -5.684 74 HA SER 11 HA SER 11 8.101 10.508 -4.977 75 HB2 SER 11 HB2 SER 11 8.535 10.170 -7.415 76 HB3 SER 11 HB3 SER 11 7.200 9.030 -7.518 77 HG SER 11 HG SER 11 7.100 11.813 -6.951 78 H GLN 12 H GLN 12 6.222 11.067 -4.065 79 HA GLN 12 HA GLN 12 4.009 8.991 -3.639 80 HB2 GLN 12 HB2 GLN 12 5.656 9.252 -1.648 81 HB3 GLN 12 HB3 GLN 12 5.046 10.898 -1.451 82 HG2 GLN 12 HG2 GLN 12 2.820 10.111 -0.868 83 HG3 GLN 12 HG3 GLN 12 3.122 8.501 -1.472 84 HE21 GLN 12 HE21 GLN 12 5.002 10.498 0.912 85 HE22 GLN 12 HE22 GLN 12 4.753 9.262 2.240 86 H GLU 13 H GLU 13 2.322 9.797 -4.742 87 HA GLU 13 HA GLU 13 2.153 12.654 -5.482 88 HB2 GLU 13 HB2 GLU 13 1.830 10.598 -6.951 89 HB3 GLU 13 HB3 GLU 13 0.343 10.262 -6.090 90 HG2 GLU 13 HG2 GLU 13 -0.508 12.615 -6.969 91 HG3 GLU 13 HG3 GLU 13 0.946 12.645 -7.963 92 H ASN 14 H ASN 14 -1.002 11.414 -4.975 93 HA ASN 14 HA ASN 14 -1.694 13.717 -3.258 94 HB2 ASN 14 HB2 ASN 14 -3.385 11.400 -4.358 95 HB3 ASN 14 HB3 ASN 14 -4.056 12.647 -3.401 96 HD21 ASN 14 HD21 ASN 14 -3.224 11.861 -6.611 97 HD22 ASN 14 HD22 ASN 14 -3.605 13.546 -7.241 98 H PHE 15 H PHE 15 -0.032 12.655 -1.633 99 HA PHE 15 HA PHE 15 -1.292 11.056 0.532 100 HB2 PHE 15 HB2 PHE 15 1.205 11.309 0.015 101 HB3 PHE 15 HB3 PHE 15 1.180 12.884 0.745 102 HD1 PHE 15 HD1 PHE 15 0.741 13.078 3.262 103 HD2 PHE 15 HD2 PHE 15 1.225 9.261 1.362 104 HE1 PHE 15 HE1 PHE 15 1.327 12.051 5.419 105 HE2 PHE 15 HE2 PHE 15 1.835 8.264 3.514 106 HZ PHE 15 HZ PHE 15 1.863 9.652 5.560 107 H GLU 16 H GLU 16 -0.538 14.582 0.507 108 HA GLU 16 HA GLU 16 -1.991 15.370 2.880 109 HB2 GLU 16 HB2 GLU 16 -1.037 16.780 0.330 110 HB3 GLU 16 HB3 GLU 16 -2.179 17.645 1.295 111 HG2 GLU 16 HG2 GLU 16 0.371 16.521 2.633 112 HG3 GLU 16 HG3 GLU 16 0.359 18.057 1.764 113 H ALA 17 H ALA 17 -3.309 15.372 -0.440 114 HA ALA 17 HA ALA 17 -6.043 16.158 0.329 115 HB1 ALA 17 HB1 ALA 17 -5.060 14.667 -2.203 116 HB2 ALA 17 HB2 ALA 17 -6.602 15.533 -2.019 117 HB3 ALA 17 HB3 ALA 17 -5.084 16.435 -1.983 118 H PHE 18 H PHE 18 -4.590 12.917 0.071 119 HA PHE 18 HA PHE 18 -7.210 11.468 0.450 120 HB2 PHE 18 HB2 PHE 18 -5.269 10.561 -0.906 121 HB3 PHE 18 HB3 PHE 18 -4.308 10.427 0.533 122 HD1 PHE 18 HD2 PHE 18 -4.943 8.709 2.313 123 HD2 PHE 18 HD1 PHE 18 -6.955 8.846 -1.487 124 HE1 PHE 18 HE2 PHE 18 -5.629 6.365 2.582 125 HE2 PHE 18 HE1 PHE 18 -7.643 6.511 -1.198 126 HZ PHE 18 HZ PHE 18 -6.971 5.263 0.839 127 H MET 19 H MET 19 -4.333 11.963 2.589 128 HA MET 19 HA MET 19 -5.599 10.686 4.910 129 HB2 MET 19 HB2 MET 19 -3.200 12.580 4.720 130 HB3 MET 19 HB3 MET 19 -3.783 11.849 6.212 131 HG2 MET 19 HG2 MET 19 -1.890 10.547 5.335 132 HG3 MET 19 HG3 MET 19 -3.359 9.556 5.408 133 HE1 MET 19 HE1 MET 19 -1.179 8.202 3.330 134 HE2 MET 19 HE2 MET 19 -2.799 7.770 3.972 135 HE3 MET 19 HE3 MET 19 -2.515 7.840 2.211 136 H LYS 20 H LYS 20 -5.590 14.163 3.969 137 HA LYS 20 HA LYS 20 -7.301 14.950 6.296 138 HB2 LYS 20 HB2 LYS 20 -6.585 16.377 3.673 139 HB3 LYS 20 HB3 LYS 20 -7.892 16.966 4.677 140 HG2 LYS 20 HG2 LYS 20 -6.358 17.099 6.683 141 HG3 LYS 20 HG3 LYS 20 -4.995 16.622 5.692 142 HD2 LYS 20 HD2 LYS 20 -6.745 19.031 4.863 143 HD3 LYS 20 HD3 LYS 20 -5.649 19.237 6.188 144 HE2 LYS 20 HE2 LYS 20 -4.614 18.158 3.464 145 HE3 LYS 20 HE3 LYS 20 -4.868 19.884 3.733 146 HZ1 LYS 20 HZ1 LYS 20 -2.525 19.243 4.349 147 HZ2 LYS 20 HZ2 LYS 20 -3.042 18.173 5.418 148 HZ3 LYS 20 HZ3 LYS 20 -3.341 19.773 5.746 149 H ALA 21 H ALA 21 -8.176 13.872 2.913 150 HA ALA 21 HA ALA 21 -11.071 14.166 3.305 151 HB1 ALA 21 HB1 ALA 21 -11.226 12.650 1.311 152 HB2 ALA 21 HB2 ALA 21 -10.013 13.918 1.056 153 HB3 ALA 21 HB3 ALA 21 -9.496 12.260 1.448 154 H ILE 22 H ILE 22 -8.929 11.395 4.121 155 HA ILE 22 HA ILE 22 -11.310 9.822 5.166 156 HB ILE 22 HB ILE 22 -9.836 7.999 5.706 157 HG12 ILE 22 HG12 ILE 22 -7.438 9.474 4.498 158 HG13 ILE 22 HG13 ILE 22 -7.719 9.430 6.226 159 HG21 ILE 22 HG21 ILE 22 -9.287 7.272 3.404 160 HG22 ILE 22 HG22 ILE 22 -10.804 8.193 3.383 161 HG23 ILE 22 HG23 ILE 22 -9.292 8.952 2.829 162 HD11 ILE 22 HD11 ILE 22 -7.266 6.933 4.454 163 HD12 ILE 22 HD12 ILE 22 -6.097 7.673 5.566 164 HD13 ILE 22 HD13 ILE 22 -7.572 6.905 6.211 165 H GLY 23 H GLY 23 -9.607 12.288 6.548 166 HA2 GLY 23 HA2 GLY 23 -10.102 13.163 8.773 167 HA3 GLY 23 HA3 GLY 23 -10.719 11.614 9.276 168 H LEU 24 H LEU 24 -7.415 12.455 8.088 169 HA LEU 24 HA LEU 24 -6.340 11.682 10.835 170 HB2 LEU 24 HB2 LEU 24 -5.366 11.222 8.004 171 HB3 LEU 24 HB3 LEU 24 -4.137 11.712 9.112 172 HG LEU 24 HG LEU 24 -5.069 9.842 10.759 173 HD11 LEU 24 HD11 LEU 24 -7.181 9.326 9.479 174 HD12 LEU 24 HD12 LEU 24 -6.145 7.904 9.626 175 HD13 LEU 24 HD13 LEU 24 -6.219 8.794 8.084 176 HD21 LEU 24 HD21 LEU 24 -2.850 9.772 9.672 177 HD22 LEU 24 HD22 LEU 24 -3.566 9.090 8.186 178 HD23 LEU 24 HD23 LEU 24 -3.595 8.163 9.716 179 HA PRO 25 HA PRO 25 -4.829 15.714 11.828 180 HB2 PRO 25 HB2 PRO 25 -2.557 15.181 13.417 181 HB3 PRO 25 HB3 PRO 25 -4.215 14.986 13.897 182 HG2 PRO 25 HG2 PRO 25 -2.245 12.904 12.927 183 HG3 PRO 25 HG3 PRO 25 -3.456 12.701 14.209 184 HD2 PRO 25 HD2 PRO 25 -3.627 11.776 11.535 185 HD3 PRO 25 HD3 PRO 25 -5.052 11.984 12.574 186 H GLU 26 H GLU 26 -3.677 17.353 10.996 187 HA GLU 26 HA GLU 26 -1.850 17.088 8.804 188 HB2 GLU 26 HB2 GLU 26 -2.491 19.459 10.603 189 HB3 GLU 26 HB3 GLU 26 -1.515 19.536 9.176 190 HG2 GLU 26 HG2 GLU 26 -3.609 18.430 7.908 191 HG3 GLU 26 HG3 GLU 26 -4.522 18.923 9.321 192 H GLU 27 H GLU 27 -1.021 17.468 12.196 193 HA GLU 27 HA GLU 27 1.890 17.816 11.934 194 HB2 GLU 27 HB2 GLU 27 0.672 18.333 13.965 195 HB3 GLU 27 HB3 GLU 27 0.076 16.702 14.167 196 HG2 GLU 27 HG2 GLU 27 3.115 17.246 14.282 197 HG3 GLU 27 HG3 GLU 27 2.076 17.616 15.649 198 H LEU 28 H LEU 28 0.055 14.719 12.385 199 HA LEU 28 HA LEU 28 2.466 13.053 11.854 200 HB2 LEU 28 HB2 LEU 28 -0.425 12.094 11.616 201 HB3 LEU 28 HB3 LEU 28 1.012 11.112 11.785 202 HG LEU 28 HG LEU 28 -0.198 12.930 13.950 203 HD11 LEU 28 HD11 LEU 28 0.022 9.841 13.806 204 HD12 LEU 28 HD12 LEU 28 -1.461 10.761 13.477 205 HD13 LEU 28 HD13 LEU 28 -0.750 10.785 15.102 206 HD21 LEU 28 HD21 LEU 28 2.338 12.796 14.199 207 HD22 LEU 28 HD22 LEU 28 2.181 11.034 14.410 208 HD23 LEU 28 HD23 LEU 28 1.422 12.151 15.557 209 H ILE 29 H ILE 29 -0.042 14.329 9.735 210 HA ILE 29 HA ILE 29 0.702 12.806 7.306 211 HB ILE 29 HB ILE 29 -0.763 15.494 7.472 212 HG12 ILE 29 HG12 ILE 29 -1.975 12.696 7.037 213 HG13 ILE 29 HG13 ILE 29 -1.916 13.439 8.591 214 HG21 ILE 29 HG21 ILE 29 -0.723 13.530 5.072 215 HG22 ILE 29 HG22 ILE 29 -1.556 15.091 5.156 216 HG23 ILE 29 HG23 ILE 29 0.197 15.058 5.134 217 HD11 ILE 29 HD11 ILE 29 -3.329 15.396 7.836 218 HD12 ILE 29 HD12 ILE 29 -3.488 14.650 6.225 219 HD13 ILE 29 HD13 ILE 29 -4.160 13.842 7.649 220 H GLN 30 H GLN 30 1.585 16.098 8.437 221 HA GLN 30 HA GLN 30 3.622 16.649 6.385 222 HB2 GLN 30 HB2 GLN 30 2.955 17.788 9.135 223 HB3 GLN 30 HB3 GLN 30 4.530 18.134 8.523 224 HG2 GLN 30 HG2 GLN 30 2.681 19.879 8.033 225 HG3 GLN 30 HG3 GLN 30 3.844 19.494 6.794 226 HE21 GLN 30 HE21 GLN 30 0.572 18.371 7.718 227 HE22 GLN 30 HE22 GLN 30 0.051 18.281 5.946 228 H LYS 31 H LYS 31 3.854 14.533 9.125 229 HA LYS 31 HA LYS 31 6.883 14.300 8.975 230 HB2 LYS 31 HB2 LYS 31 4.692 12.849 10.578 231 HB3 LYS 31 HB3 LYS 31 6.335 12.260 10.545 232 HG2 LYS 31 HG2 LYS 31 7.234 14.330 11.539 233 HG3 LYS 31 HG3 LYS 31 5.661 15.137 11.432 234 HD2 LYS 31 HD2 LYS 31 4.614 13.567 12.989 235 HD3 LYS 31 HD3 LYS 31 6.027 12.508 13.000 236 HE2 LYS 31 HE2 LYS 31 7.419 14.224 14.158 237 HE3 LYS 31 HE3 LYS 31 6.104 15.427 14.042 238 HZ1 LYS 31 HZ1 LYS 31 4.671 14.101 15.394 239 HZ2 LYS 31 HZ2 LYS 31 6.102 14.071 16.242 240 HZ3 LYS 31 HZ3 LYS 31 5.685 12.722 15.345 241 H GLY 32 H GLY 32 4.121 12.063 8.243 242 HA2 GLY 32 HA2 GLY 32 5.894 10.128 6.811 243 HA3 GLY 32 HA3 GLY 32 4.158 10.042 6.872 244 H LYS 33 H LYS 33 4.429 12.998 5.512 245 HA LYS 33 HA LYS 33 3.954 12.030 2.817 246 HB2 LYS 33 HB2 LYS 33 3.765 14.324 2.118 247 HB3 LYS 33 HB3 LYS 33 2.941 14.073 3.639 248 HG2 LYS 33 HG2 LYS 33 4.749 15.183 4.916 249 HG3 LYS 33 HG3 LYS 33 5.744 15.363 3.498 250 HD2 LYS 33 HD2 LYS 33 2.958 16.627 3.714 251 HD3 LYS 33 HD3 LYS 33 4.390 17.427 4.305 252 HE2 LYS 33 HE2 LYS 33 4.128 16.495 1.356 253 HE3 LYS 33 HE3 LYS 33 3.588 18.072 1.916 254 HZ1 LYS 33 HZ1 LYS 33 6.038 17.935 1.030 255 HZ2 LYS 33 HZ2 LYS 33 6.470 17.161 2.378 256 HZ3 LYS 33 HZ3 LYS 33 5.882 18.675 2.506 257 H ASP 34 H ASP 34 7.010 13.456 3.987 258 HA ASP 34 HA ASP 34 8.263 13.012 1.228 259 HB2 ASP 34 HB2 ASP 34 9.304 14.660 3.611 260 HB3 ASP 34 HB3 ASP 34 10.006 14.601 2.007 261 H ILE 35 H ILE 35 8.258 11.156 4.006 262 HA ILE 35 HA ILE 35 11.161 10.478 4.168 263 HB ILE 35 HB ILE 35 8.727 9.107 5.423 264 HG12 ILE 35 HG12 ILE 35 10.882 10.843 6.809 265 HG13 ILE 35 HG13 ILE 35 9.374 11.505 6.223 266 HG21 ILE 35 HG21 ILE 35 11.711 8.532 6.049 267 HG22 ILE 35 HG22 ILE 35 10.320 7.864 6.934 268 HG23 ILE 35 HG23 ILE 35 10.583 7.407 5.258 269 HD11 ILE 35 HD11 ILE 35 9.549 9.359 8.439 270 HD12 ILE 35 HD12 ILE 35 9.148 11.080 8.622 271 HD13 ILE 35 HD13 ILE 35 8.040 10.012 7.752 272 H LYS 36 H LYS 36 12.160 9.424 2.564 273 HA LYS 36 HA LYS 36 10.845 7.442 0.759 274 HB2 LYS 36 HB2 LYS 36 13.811 8.214 1.068 275 HB3 LYS 36 HB3 LYS 36 13.204 7.038 -0.074 276 HG2 LYS 36 HG2 LYS 36 11.637 8.899 -1.028 277 HG3 LYS 36 HG3 LYS 36 12.590 10.053 -0.093 278 HD2 LYS 36 HD2 LYS 36 14.713 9.181 -1.265 279 HD3 LYS 36 HD3 LYS 36 13.721 8.013 -2.140 280 HE2 LYS 36 HE2 LYS 36 12.377 10.045 -3.110 281 HE3 LYS 36 HE3 LYS 36 13.600 11.099 -2.411 282 HZ1 LYS 36 HZ1 LYS 36 14.185 8.843 -4.378 283 HZ2 LYS 36 HZ2 LYS 36 15.327 9.825 -3.733 284 HZ3 LYS 36 HZ3 LYS 36 14.196 10.444 -4.758 285 H GLY 37 H GLY 37 10.065 6.177 2.652 286 HA2 GLY 37 HA2 GLY 37 11.929 4.258 3.985 287 HA3 GLY 37 HA3 GLY 37 10.183 4.266 4.126 288 H VAL 38 H VAL 38 11.264 1.962 4.174 289 HA VAL 38 HA VAL 38 11.332 0.632 1.447 290 HB VAL 38 HB VAL 38 11.874 -0.505 4.236 291 HG11 VAL 38 HG11 VAL 38 12.230 -1.908 1.504 292 HG12 VAL 38 HG12 VAL 38 12.826 -2.530 3.067 293 HG13 VAL 38 HG13 VAL 38 11.090 -2.382 2.783 294 HG21 VAL 38 HG21 VAL 38 14.280 -0.622 3.477 295 HG22 VAL 38 HG22 VAL 38 13.848 0.118 1.916 296 HG23 VAL 38 HG23 VAL 38 13.712 1.052 3.421 297 H SER 39 H SER 39 9.746 -0.529 0.586 298 HA SER 39 HA SER 39 7.324 -1.420 2.260 299 HB2 SER 39 HB2 SER 39 7.483 -0.464 -0.637 300 HB3 SER 39 HB3 SER 39 6.084 -1.287 0.025 301 HG SER 39 HG SER 39 5.795 0.950 0.159 302 H GLU 40 H GLU 40 8.007 -3.381 2.691 303 HA GLU 40 HA GLU 40 9.340 -5.213 0.718 304 HB2 GLU 40 HB2 GLU 40 9.844 -5.014 3.259 305 HB3 GLU 40 HB3 GLU 40 8.323 -5.790 3.540 306 HG2 GLU 40 HG2 GLU 40 9.072 -7.906 2.460 307 HG3 GLU 40 HG3 GLU 40 10.594 -7.165 1.975 308 H ILE 41 H ILE 41 8.553 -7.034 -0.206 309 HA ILE 41 HA ILE 41 5.880 -8.142 0.657 310 HB ILE 41 HB ILE 41 6.445 -7.733 -2.339 311 HG12 ILE 41 HG12 ILE 41 4.273 -6.217 -0.784 312 HG13 ILE 41 HG13 ILE 41 5.825 -5.531 -1.222 313 HG21 ILE 41 HG21 ILE 41 3.883 -8.794 -0.929 314 HG22 ILE 41 HG22 ILE 41 4.084 -8.575 -2.684 315 HG23 ILE 41 HG23 ILE 41 5.037 -9.789 -1.853 316 HD11 ILE 41 HD11 ILE 41 4.245 -4.819 -2.922 317 HD12 ILE 41 HD12 ILE 41 5.388 -5.940 -3.685 318 HD13 ILE 41 HD13 ILE 41 3.732 -6.470 -3.277 319 H VAL 42 H VAL 42 6.209 -10.298 0.966 320 HA VAL 42 HA VAL 42 8.287 -11.836 -0.699 321 HB VAL 42 HB VAL 42 6.984 -12.935 1.834 322 HG11 VAL 42 HG11 VAL 42 9.694 -13.598 0.506 323 HG12 VAL 42 HG12 VAL 42 8.979 -14.415 1.914 324 HG13 VAL 42 HG13 VAL 42 8.215 -14.562 0.320 325 HG21 VAL 42 HG21 VAL 42 8.088 -10.864 2.644 326 HG22 VAL 42 HG22 VAL 42 8.971 -12.292 3.194 327 HG23 VAL 42 HG23 VAL 42 9.608 -11.320 1.838 328 H GLN 43 H GLN 43 7.299 -12.698 -2.480 329 HA GLN 43 HA GLN 43 4.392 -13.415 -2.517 330 HB2 GLN 43 HB2 GLN 43 5.554 -12.273 -4.392 331 HB3 GLN 43 HB3 GLN 43 6.578 -13.673 -4.667 332 HG2 GLN 43 HG2 GLN 43 4.568 -15.062 -5.275 333 HG3 GLN 43 HG3 GLN 43 3.499 -13.726 -4.873 334 HE21 GLN 43 HE21 GLN 43 2.798 -14.321 -7.090 335 HE22 GLN 43 HE22 GLN 43 3.619 -13.454 -8.499 336 H ASN 44 H ASN 44 3.861 -15.226 -1.357 337 HA ASN 44 HA ASN 44 5.313 -17.886 -1.965 338 HB2 ASN 44 HB2 ASN 44 3.617 -17.161 0.509 339 HB3 ASN 44 HB3 ASN 44 4.427 -18.670 0.208 340 HD21 ASN 44 HD21 ASN 44 5.079 -15.275 0.884 341 HD22 ASN 44 HD22 ASN 44 6.719 -15.653 1.607 342 H GLY 45 H GLY 45 3.891 -17.543 -3.982 343 HA2 GLY 45 HA2 GLY 45 2.136 -18.523 -5.344 344 HA3 GLY 45 HA3 GLY 45 1.662 -19.524 -3.987 345 H LYS 46 H LYS 46 0.015 -18.777 -2.653 346 HA LYS 46 HA LYS 46 -1.731 -16.470 -3.635 347 HB2 LYS 46 HB2 LYS 46 -2.266 -18.699 -1.572 348 HB3 LYS 46 HB3 LYS 46 -3.359 -17.370 -1.879 349 HG2 LYS 46 HG2 LYS 46 -3.694 -18.091 -4.269 350 HG3 LYS 46 HG3 LYS 46 -2.511 -19.360 -4.056 351 HD2 LYS 46 HD2 LYS 46 -4.244 -20.718 -3.614 352 HD3 LYS 46 HD3 LYS 46 -4.176 -20.121 -1.988 353 HE2 LYS 46 HE2 LYS 46 -6.068 -19.125 -4.253 354 HE3 LYS 46 HE3 LYS 46 -6.502 -20.254 -2.977 355 HZ1 LYS 46 HZ1 LYS 46 -7.247 -18.132 -2.154 356 HZ2 LYS 46 HZ2 LYS 46 -5.924 -17.328 -2.702 357 HZ3 LYS 46 HZ3 LYS 46 -5.814 -18.306 -1.366 358 H HIS 47 H HIS 47 0.378 -17.280 -0.874 359 HA HIS 47 HA HIS 47 -0.754 -15.002 0.808 360 HB2 HIS 47 HB2 HIS 47 1.231 -17.258 1.482 361 HB3 HIS 47 HB3 HIS 47 0.956 -15.899 2.542 362 HD1 HIS 47 HD1 HIS 47 -0.759 -19.148 1.442 363 HD2 HIS 47 HD2 HIS 47 -1.480 -15.610 3.740 364 HE1 HIS 47 HE1 HIS 47 -2.922 -19.409 2.837 365 H PHE 48 H PHE 48 -0.001 -13.091 0.359 366 HA PHE 48 HA PHE 48 2.926 -12.613 -0.444 367 HB2 PHE 48 HB2 PHE 48 0.328 -11.028 -0.776 368 HB3 PHE 48 HB3 PHE 48 1.880 -10.285 -0.956 369 HD1 PHE 48 HD1 PHE 48 0.356 -13.556 -2.333 370 HD2 PHE 48 HD2 PHE 48 2.270 -9.798 -3.169 371 HE1 PHE 48 HE1 PHE 48 0.241 -14.018 -4.736 372 HE2 PHE 48 HE2 PHE 48 2.108 -10.266 -5.563 373 HZ PHE 48 HZ PHE 48 1.127 -12.355 -6.362 374 H LYS 49 H LYS 49 4.094 -12.376 1.386 375 HA LYS 49 HA LYS 49 2.931 -11.102 3.891 376 HB2 LYS 49 HB2 LYS 49 5.697 -12.339 3.456 377 HB3 LYS 49 HB3 LYS 49 5.114 -11.711 4.979 378 HG2 LYS 49 HG2 LYS 49 3.327 -13.381 5.123 379 HG3 LYS 49 HG3 LYS 49 3.628 -13.946 3.495 380 HD2 LYS 49 HD2 LYS 49 6.101 -14.481 4.392 381 HD3 LYS 49 HD3 LYS 49 5.419 -14.294 5.995 382 HE2 LYS 49 HE2 LYS 49 4.490 -16.296 3.809 383 HE3 LYS 49 HE3 LYS 49 5.559 -16.684 5.151 384 HZ1 LYS 49 HZ1 LYS 49 3.272 -17.315 5.853 385 HZ2 LYS 49 HZ2 LYS 49 2.613 -15.878 5.400 386 HZ3 LYS 49 HZ3 LYS 49 3.554 -15.907 6.673 387 H PHE 50 H PHE 50 3.019 -9.012 4.172 388 HA PHE 50 HA PHE 50 5.280 -7.439 2.851 389 HB2 PHE 50 HB2 PHE 50 3.955 -5.524 2.535 390 HB3 PHE 50 HB3 PHE 50 3.247 -6.904 1.785 391 HD1 PHE 50 HD2 PHE 50 2.777 -5.317 5.313 392 HD2 PHE 50 HD1 PHE 50 1.037 -6.356 1.530 393 HE1 PHE 50 HE2 PHE 50 0.650 -4.375 6.030 394 HE2 PHE 50 HE1 PHE 50 -1.096 -5.438 2.258 395 HZ PHE 50 HZ PHE 50 -1.311 -4.426 4.517 396 H THR 51 H THR 51 6.383 -5.889 3.733 397 HA THR 51 HA THR 51 5.836 -5.102 6.672 398 HB THR 51 HB THR 51 8.688 -5.329 5.572 399 HG1 THR 51 HG1 THR 51 8.644 -7.359 5.878 400 HG21 THR 51 HG21 THR 51 8.464 -3.877 7.550 401 HG22 THR 51 HG22 THR 51 9.347 -5.374 7.936 402 HG23 THR 51 HG23 THR 51 7.661 -5.193 8.454 403 H ILE 52 H ILE 52 4.765 -3.209 6.155 404 HA ILE 52 HA ILE 52 5.972 -1.355 4.051 405 HB ILE 52 HB ILE 52 3.145 -1.403 5.181 406 HG12 ILE 52 HG12 ILE 52 3.426 -3.389 3.860 407 HG13 ILE 52 HG13 ILE 52 2.385 -2.294 2.993 408 HG21 ILE 52 HG21 ILE 52 2.502 0.117 3.295 409 HG22 ILE 52 HG22 ILE 52 3.647 0.899 4.384 410 HG23 ILE 52 HG23 ILE 52 4.207 0.272 2.814 411 HD11 ILE 52 HD11 ILE 52 5.367 -2.889 2.357 412 HD12 ILE 52 HD12 ILE 52 3.966 -3.442 1.439 413 HD13 ILE 52 HD13 ILE 52 4.367 -1.711 1.459 414 H THR 53 H THR 53 6.704 0.562 4.460 415 HA THR 53 HA THR 53 6.759 1.656 7.290 416 HB THR 53 HB THR 53 8.393 3.354 6.352 417 HG1 THR 53 HG1 THR 53 8.620 1.529 4.198 418 HG21 THR 53 HG21 THR 53 10.328 1.792 6.270 419 HG22 THR 53 HG22 THR 53 9.236 0.392 6.119 420 HG23 THR 53 HG23 THR 53 9.236 1.373 7.604 421 H ALA 54 H ALA 54 5.093 2.760 7.811 422 HA ALA 54 HA ALA 54 3.813 4.897 5.988 423 HB1 ALA 54 HB1 ALA 54 2.908 3.568 8.644 424 HB2 ALA 54 HB2 ALA 54 2.005 4.823 7.785 425 HB3 ALA 54 HB3 ALA 54 2.259 3.242 7.015 426 H GLY 55 H GLY 55 6.041 5.818 6.298 427 HA2 GLY 55 HA2 GLY 55 7.195 7.825 6.985 428 HA3 GLY 55 HA3 GLY 55 5.948 8.197 8.161 429 H SER 56 H SER 56 6.120 7.317 10.207 430 HA SER 56 HA SER 56 8.820 6.172 11.076 431 HB2 SER 56 HB2 SER 56 6.555 7.211 12.876 432 HB3 SER 56 HB3 SER 56 8.168 6.740 13.383 433 HG SER 56 HG SER 56 7.655 9.104 12.985 434 H LYS 57 H LYS 57 5.397 5.157 10.943 435 HA LYS 57 HA LYS 57 5.867 2.840 12.816 436 HB2 LYS 57 HB2 LYS 57 3.687 4.173 12.799 437 HB3 LYS 57 HB3 LYS 57 3.324 3.502 11.216 438 HG2 LYS 57 HG2 LYS 57 3.521 1.126 12.314 439 HG3 LYS 57 HG3 LYS 57 3.685 1.935 13.869 440 HD2 LYS 57 HD2 LYS 57 1.377 2.988 13.518 441 HD3 LYS 57 HD3 LYS 57 1.268 2.184 11.948 442 HE2 LYS 57 HE2 LYS 57 1.576 -0.101 13.160 443 HE3 LYS 57 HE3 LYS 57 1.516 0.758 14.702 444 HZ1 LYS 57 HZ1 LYS 57 -0.704 0.540 12.626 445 HZ2 LYS 57 HZ2 LYS 57 -0.810 1.621 13.886 446 HZ3 LYS 57 HZ3 LYS 57 -0.761 -0.031 14.080 447 H VAL 58 H VAL 58 6.392 0.862 12.238 448 HA VAL 58 HA VAL 58 6.451 -0.035 9.335 449 HB VAL 58 HB VAL 58 7.514 -1.446 11.849 450 HG11 VAL 58 HG11 VAL 58 7.948 -2.106 8.858 451 HG12 VAL 58 HG12 VAL 58 8.764 -2.919 10.219 452 HG13 VAL 58 HG13 VAL 58 7.014 -3.090 10.008 453 HG21 VAL 58 HG21 VAL 58 8.868 0.636 11.335 454 HG22 VAL 58 HG22 VAL 58 9.807 -0.829 11.011 455 HG23 VAL 58 HG23 VAL 58 9.095 0.089 9.661 456 H ILE 59 H ILE 59 4.552 -0.742 8.601 457 HA ILE 59 HA ILE 59 2.555 -2.206 10.430 458 HB ILE 59 HB ILE 59 2.064 -0.826 7.735 459 HG12 ILE 59 HG12 ILE 59 1.123 0.048 10.545 460 HG13 ILE 59 HG13 ILE 59 2.483 0.768 9.700 461 HG21 ILE 59 HG21 ILE 59 0.014 -2.126 9.670 462 HG22 ILE 59 HG22 ILE 59 -0.383 -1.261 8.171 463 HG23 ILE 59 HG23 ILE 59 0.496 -2.784 8.084 464 HD11 ILE 59 HD11 ILE 59 -0.463 0.941 8.841 465 HD12 ILE 59 HD12 ILE 59 0.621 2.250 9.347 466 HD13 ILE 59 HD13 ILE 59 0.883 1.442 7.781 467 H GLN 60 H GLN 60 3.216 -4.297 10.377 468 HA GLN 60 HA GLN 60 3.677 -5.623 7.683 469 HB2 GLN 60 HB2 GLN 60 5.063 -7.231 8.667 470 HB3 GLN 60 HB3 GLN 60 5.625 -5.630 9.050 471 HG2 GLN 60 HG2 GLN 60 4.122 -7.447 11.030 472 HG3 GLN 60 HG3 GLN 60 5.864 -7.371 10.886 473 HE21 GLN 60 HE21 GLN 60 6.947 -5.472 11.708 474 HE22 GLN 60 HE22 GLN 60 6.014 -4.264 12.744 475 H ASN 61 H ASN 61 2.408 -7.021 6.960 476 HA ASN 61 HA ASN 61 0.532 -8.752 8.456 477 HB2 ASN 61 HB2 ASN 61 -0.766 -6.517 6.733 478 HB3 ASN 61 HB3 ASN 61 -1.592 -7.956 7.249 479 HD21 ASN 61 HD21 ASN 61 -0.186 -5.022 8.525 480 HD22 ASN 61 HD22 ASN 61 -1.214 -5.077 10.036 481 H GLU 62 H GLU 62 -0.696 -10.209 6.868 482 HA GLU 62 HA GLU 62 0.727 -10.366 4.181 483 HB2 GLU 62 HB2 GLU 62 1.099 -12.615 4.204 484 HB3 GLU 62 HB3 GLU 62 1.726 -11.977 5.714 485 HG2 GLU 62 HG2 GLU 62 -0.229 -13.020 6.964 486 HG3 GLU 62 HG3 GLU 62 -0.875 -13.639 5.441 487 H PHE 63 H PHE 63 -0.411 -10.594 2.456 488 HA PHE 63 HA PHE 63 -3.425 -10.894 2.758 489 HB2 PHE 63 HB2 PHE 63 -3.889 -9.671 0.804 490 HB3 PHE 63 HB3 PHE 63 -2.997 -8.767 1.962 491 HD1 PHE 63 HD1 PHE 63 -0.585 -8.102 1.440 492 HD2 PHE 63 HD2 PHE 63 -2.964 -10.208 -1.444 493 HE1 PHE 63 HE1 PHE 63 0.950 -7.382 -0.381 494 HE2 PHE 63 HE2 PHE 63 -1.455 -9.450 -3.237 495 HZ PHE 63 HZ PHE 63 0.496 -8.015 -2.688 496 H THR 64 H THR 64 -4.522 -12.348 1.831 497 HA THR 64 HA THR 64 -3.133 -14.526 0.233 498 HB THR 64 HB THR 64 -5.920 -14.643 1.519 499 HG1 THR 64 HG1 THR 64 -3.901 -16.008 2.748 500 HG21 THR 64 HG21 THR 64 -5.461 -16.461 -0.152 501 HG22 THR 64 HG22 THR 64 -5.501 -17.122 1.500 502 HG23 THR 64 HG23 THR 64 -3.935 -16.878 0.677 503 H VAL 65 H VAL 65 -3.256 -14.252 -1.917 504 HA VAL 65 HA VAL 65 -5.343 -12.658 -3.292 505 HB VAL 65 HB VAL 65 -3.209 -14.524 -4.394 506 HG11 VAL 65 HG11 VAL 65 -4.989 -14.276 -6.166 507 HG12 VAL 65 HG12 VAL 65 -4.791 -12.509 -6.108 508 HG13 VAL 65 HG13 VAL 65 -3.451 -13.544 -6.636 509 HG21 VAL 65 HG21 VAL 65 -3.296 -11.417 -4.286 510 HG22 VAL 65 HG22 VAL 65 -2.257 -12.450 -3.278 511 HG23 VAL 65 HG23 VAL 65 -1.994 -12.371 -5.027 512 H GLY 66 H GLY 66 -7.360 -13.308 -3.624 513 HA2 GLY 66 HA2 GLY 66 -9.131 -14.780 -4.519 514 HA3 GLY 66 HA3 GLY 66 -8.073 -16.164 -4.477 515 H GLU 67 H GLU 67 -7.863 -14.851 -1.401 516 HA GLU 67 HA GLU 67 -10.426 -15.904 -0.340 517 HB2 GLU 67 HB2 GLU 67 -7.744 -17.264 0.441 518 HB3 GLU 67 HB3 GLU 67 -9.093 -17.268 1.543 519 HG2 GLU 67 HG2 GLU 67 -9.342 -18.467 -1.289 520 HG3 GLU 67 HG3 GLU 67 -8.898 -19.386 0.148 521 H GLU 68 H GLU 68 -10.818 -15.300 1.886 522 HA GLU 68 HA GLU 68 -10.343 -12.541 2.264 523 HB2 GLU 68 HB2 GLU 68 -11.421 -12.636 4.397 524 HB3 GLU 68 HB3 GLU 68 -12.293 -13.543 3.198 525 HG2 GLU 68 HG2 GLU 68 -11.991 -15.610 4.284 526 HG3 GLU 68 HG3 GLU 68 -10.385 -15.208 4.855 527 H CYS 69 H CYS 69 -8.966 -11.229 3.168 528 HA CYS 69 HA CYS 69 -6.960 -12.192 5.251 529 HB2 CYS 69 HB2 CYS 69 -5.131 -10.852 4.003 530 HB3 CYS 69 HB3 CYS 69 -5.612 -12.451 3.433 531 HG CYS 69 HG CYS 69 -6.928 -11.732 1.371 532 H GLU 70 H GLU 70 -6.775 -10.962 6.825 533 HA GLU 70 HA GLU 70 -8.147 -8.280 7.013 534 HB2 GLU 70 HB2 GLU 70 -7.905 -8.389 9.420 535 HB3 GLU 70 HB3 GLU 70 -8.876 -9.648 8.719 536 HG2 GLU 70 HG2 GLU 70 -7.066 -11.345 9.015 537 HG3 GLU 70 HG3 GLU 70 -5.965 -10.072 9.516 538 H LEU 71 H LEU 71 -7.075 -6.536 6.508 539 HA LEU 71 HA LEU 71 -4.107 -6.221 7.296 540 HB2 LEU 71 HB2 LEU 71 -5.542 -4.909 4.921 541 HB3 LEU 71 HB3 LEU 71 -3.832 -4.819 5.286 542 HG LEU 71 HG LEU 71 -5.368 -7.330 4.376 543 HD11 LEU 71 HD11 LEU 71 -4.941 -5.431 2.660 544 HD12 LEU 71 HD12 LEU 71 -4.311 -7.020 2.218 545 HD13 LEU 71 HD13 LEU 71 -3.214 -5.761 2.834 546 HD21 LEU 71 HD21 LEU 71 -3.154 -8.472 4.158 547 HD22 LEU 71 HD22 LEU 71 -3.429 -8.016 5.830 548 HD23 LEU 71 HD23 LEU 71 -2.311 -7.056 4.827 549 H GLU 72 H GLU 72 -3.455 -4.359 8.304 550 HA GLU 72 HA GLU 72 -5.469 -2.639 9.651 551 HB2 GLU 72 HB2 GLU 72 -3.156 -3.336 10.553 552 HB3 GLU 72 HB3 GLU 72 -2.416 -2.242 9.392 553 HG2 GLU 72 HG2 GLU 72 -3.782 -0.307 10.540 554 HG3 GLU 72 HG3 GLU 72 -4.280 -1.479 11.754 555 H THR 73 H THR 73 -5.980 -0.633 9.404 556 HA THR 73 HA THR 73 -5.398 0.859 6.790 557 HB THR 73 HB THR 73 -7.609 0.005 6.630 558 HG1 THR 73 HG1 THR 73 -8.573 2.376 7.451 559 HG21 THR 73 HG21 THR 73 -9.503 0.526 8.241 560 HG22 THR 73 HG22 THR 73 -8.306 1.216 9.374 561 HG23 THR 73 HG23 THR 73 -8.282 -0.521 8.969 562 H MET 74 H MET 74 -5.933 3.106 6.969 563 HA MET 74 HA MET 74 -4.468 4.457 9.299 564 HB2 MET 74 HB2 MET 74 -5.423 5.557 6.588 565 HB3 MET 74 HB3 MET 74 -4.952 6.623 7.896 566 HG2 MET 74 HG2 MET 74 -3.086 4.530 6.636 567 HG3 MET 74 HG3 MET 74 -3.071 6.269 6.324 568 HE1 MET 74 HE1 MET 74 -0.788 4.197 9.563 569 HE2 MET 74 HE2 MET 74 -2.274 3.416 8.939 570 HE3 MET 74 HE3 MET 74 -0.969 3.885 7.809 571 H THR 75 H THR 75 -7.615 5.001 7.639 572 HA THR 75 HA THR 75 -8.844 5.755 10.343 573 HB THR 75 HB THR 75 -10.120 6.019 7.579 574 HG1 THR 75 HG1 THR 75 -9.812 8.333 8.223 575 HG21 THR 75 HG21 THR 75 -10.997 7.232 10.290 576 HG22 THR 75 HG22 THR 75 -11.829 5.891 9.462 577 HG23 THR 75 HG23 THR 75 -11.786 7.497 8.718 578 H GLY 76 H GLY 76 -9.779 4.164 11.353 579 HA2 GLY 76 HA2 GLY 76 -11.749 2.438 11.132 580 HA3 GLY 76 HA3 GLY 76 -10.827 1.631 9.903 581 H GLU 77 H GLU 77 -9.418 -0.003 10.572 582 HA GLU 77 HA GLU 77 -8.641 -0.554 13.290 583 HB2 GLU 77 HB2 GLU 77 -10.174 -2.175 14.106 584 HB3 GLU 77 HB3 GLU 77 -10.944 -0.633 13.902 585 HG2 GLU 77 HG2 GLU 77 -11.505 -3.213 12.331 586 HG3 GLU 77 HG3 GLU 77 -12.531 -2.258 13.363 587 H LYS 78 H LYS 78 -10.115 -2.737 11.006 588 HA LYS 78 HA LYS 78 -7.626 -3.609 9.724 589 HB2 LYS 78 HB2 LYS 78 -7.861 -4.791 12.248 590 HB3 LYS 78 HB3 LYS 78 -8.787 -5.959 11.334 591 HG2 LYS 78 HG2 LYS 78 -6.761 -6.155 9.723 592 HG3 LYS 78 HG3 LYS 78 -5.930 -4.972 10.743 593 HD2 LYS 78 HD2 LYS 78 -6.152 -6.576 12.735 594 HD3 LYS 78 HD3 LYS 78 -6.996 -7.720 11.690 595 HE2 LYS 78 HE2 LYS 78 -4.863 -7.755 10.170 596 HE3 LYS 78 HE3 LYS 78 -4.034 -6.796 11.390 597 HZ1 LYS 78 HZ1 LYS 78 -4.500 -8.622 13.039 598 HZ2 LYS 78 HZ2 LYS 78 -3.809 -9.325 11.706 599 HZ3 LYS 78 HZ3 LYS 78 -5.449 -9.437 11.966 600 H VAL 79 H VAL 79 -8.268 -3.975 7.749 601 HA VAL 79 HA VAL 79 -11.204 -4.603 7.225 602 HB VAL 79 HB VAL 79 -10.271 -2.450 6.458 603 HG11 VAL 79 HG11 VAL 79 -8.906 -2.213 4.415 604 HG12 VAL 79 HG12 VAL 79 -7.969 -3.007 5.685 605 HG13 VAL 79 HG13 VAL 79 -8.628 -3.967 4.346 606 HG21 VAL 79 HG21 VAL 79 -11.257 -4.177 4.115 607 HG22 VAL 79 HG22 VAL 79 -12.298 -3.446 5.367 608 HG23 VAL 79 HG23 VAL 79 -11.368 -2.409 4.275 609 H LYS 80 H LYS 80 -11.838 -6.457 6.337 610 HA LYS 80 HA LYS 80 -9.816 -8.475 5.331 611 HB2 LYS 80 HB2 LYS 80 -12.799 -8.772 5.908 612 HB3 LYS 80 HB3 LYS 80 -11.874 -9.969 5.021 613 HG2 LYS 80 HG2 LYS 80 -10.165 -10.047 6.927 614 HG3 LYS 80 HG3 LYS 80 -11.229 -9.020 7.891 615 HD2 LYS 80 HD2 LYS 80 -13.032 -10.823 7.738 616 HD3 LYS 80 HD3 LYS 80 -11.976 -11.769 6.693 617 HE2 LYS 80 HE2 LYS 80 -10.203 -11.787 8.637 618 HE3 LYS 80 HE3 LYS 80 -11.421 -11.051 9.674 619 HZ1 LYS 80 HZ1 LYS 80 -11.591 -13.523 9.846 620 HZ2 LYS 80 HZ2 LYS 80 -11.628 -13.712 8.201 621 HZ3 LYS 80 HZ3 LYS 80 -12.919 -13.064 8.945 622 H THR 81 H THR 81 -9.025 -7.537 3.621 623 HA THR 81 HA THR 81 -10.792 -6.855 1.199 624 HB THR 81 HB THR 81 -9.663 -4.950 2.257 625 HG1 THR 81 HG1 THR 81 -8.653 -5.605 -0.312 626 HG21 THR 81 HG21 THR 81 -7.272 -4.577 2.310 627 HG22 THR 81 HG22 THR 81 -6.913 -6.022 1.352 628 HG23 THR 81 HG23 THR 81 -7.468 -6.161 3.037 629 H VAL 82 H VAL 82 -10.778 -8.554 -0.166 630 HA VAL 82 HA VAL 82 -8.327 -10.316 -0.388 631 HB VAL 82 HB VAL 82 -10.458 -11.512 -0.195 632 HG11 VAL 82 HG11 VAL 82 -11.789 -12.040 -2.252 633 HG12 VAL 82 HG12 VAL 82 -12.010 -10.336 -1.774 634 HG13 VAL 82 HG13 VAL 82 -10.948 -10.756 -3.151 635 HG21 VAL 82 HG21 VAL 82 -8.889 -12.145 -2.781 636 HG22 VAL 82 HG22 VAL 82 -8.354 -12.547 -1.138 637 HG23 VAL 82 HG23 VAL 82 -9.846 -13.262 -1.779 638 H VAL 83 H VAL 83 -7.014 -10.412 -2.068 639 HA VAL 83 HA VAL 83 -7.182 -8.123 -4.081 640 HB VAL 83 HB VAL 83 -4.640 -9.620 -3.268 641 HG11 VAL 83 HG11 VAL 83 -3.505 -7.551 -4.065 642 HG12 VAL 83 HG12 VAL 83 -4.511 -8.220 -5.367 643 HG13 VAL 83 HG13 VAL 83 -5.062 -6.792 -4.468 644 HG21 VAL 83 HG21 VAL 83 -4.060 -7.667 -1.740 645 HG22 VAL 83 HG22 VAL 83 -5.716 -7.070 -1.872 646 HG23 VAL 83 HG23 VAL 83 -5.400 -8.637 -1.121 647 H GLN 84 H GLN 84 -7.337 -8.503 -6.185 648 HA GLN 84 HA GLN 84 -7.032 -11.372 -7.259 649 HB2 GLN 84 HB2 GLN 84 -8.692 -8.990 -8.216 650 HB3 GLN 84 HB3 GLN 84 -8.253 -10.248 -9.330 651 HG2 GLN 84 HG2 GLN 84 -10.490 -10.674 -8.496 652 HG3 GLN 84 HG3 GLN 84 -9.423 -11.995 -8.102 653 HE21 GLN 84 HE21 GLN 84 -9.341 -12.591 -5.947 654 HE22 GLN 84 HE22 GLN 84 -10.257 -11.673 -4.637 655 H LEU 85 H LEU 85 -5.679 -11.810 -8.916 656 HA LEU 85 HA LEU 85 -3.556 -9.714 -9.565 657 HB2 LEU 85 HB2 LEU 85 -2.821 -11.472 -7.999 658 HB3 LEU 85 HB3 LEU 85 -3.342 -12.736 -9.100 659 HG LEU 85 HG LEU 85 -1.648 -12.082 -10.758 660 HD11 LEU 85 HD11 LEU 85 -0.639 -10.008 -8.687 661 HD12 LEU 85 HD12 LEU 85 -1.350 -9.625 -10.274 662 HD13 LEU 85 HD13 LEU 85 0.194 -10.457 -10.174 663 HD21 LEU 85 HD21 LEU 85 0.376 -12.864 -9.435 664 HD22 LEU 85 HD22 LEU 85 -1.075 -13.817 -9.068 665 HD23 LEU 85 HD23 LEU 85 -0.519 -12.574 -7.924 666 H GLU 86 H GLU 86 -3.442 -9.142 -11.618 667 HA GLU 86 HA GLU 86 -4.179 -11.118 -13.862 668 HB2 GLU 86 HB2 GLU 86 -5.464 -8.893 -13.720 669 HB3 GLU 86 HB3 GLU 86 -3.942 -8.099 -14.088 670 HG2 GLU 86 HG2 GLU 86 -3.838 -9.435 -16.307 671 HG3 GLU 86 HG3 GLU 86 -5.470 -10.011 -15.952 672 H GLY 87 H GLY 87 -2.650 -11.777 -15.086 673 HA2 GLY 87 HA2 GLY 87 -0.459 -12.312 -16.033 674 HA3 GLY 87 HA3 GLY 87 -0.369 -10.575 -16.183 675 H ASP 88 H ASP 88 -0.242 -11.798 -13.085 676 HA ASP 88 HA ASP 88 1.382 -11.801 -11.379 677 HB2 ASP 88 HB2 ASP 88 2.470 -13.611 -12.804 678 HB3 ASP 88 HB3 ASP 88 3.596 -12.391 -13.380 679 H ASN 89 H ASN 89 0.703 -9.325 -12.862 680 HA ASN 89 HA ASN 89 2.656 -7.592 -11.313 681 HB2 ASN 89 HB2 ASN 89 3.362 -6.271 -12.988 682 HB3 ASN 89 HB3 ASN 89 3.401 -7.820 -13.753 683 HD21 ASN 89 HD21 ASN 89 3.082 -4.906 -14.631 684 HD22 ASN 89 HD22 ASN 89 1.722 -5.042 -15.874 685 H LYS 90 H LYS 90 -0.671 -7.672 -12.540 686 HA LYS 90 HA LYS 90 -1.180 -4.968 -11.167 687 HB2 LYS 90 HB2 LYS 90 -2.956 -6.655 -12.983 688 HB3 LYS 90 HB3 LYS 90 -3.426 -5.110 -12.325 689 HG2 LYS 90 HG2 LYS 90 -1.806 -3.886 -13.685 690 HG3 LYS 90 HG3 LYS 90 -0.965 -5.365 -14.159 691 HD2 LYS 90 HD2 LYS 90 -3.099 -6.203 -15.266 692 HD3 LYS 90 HD3 LYS 90 -3.893 -4.685 -14.937 693 HE2 LYS 90 HE2 LYS 90 -1.313 -5.038 -16.642 694 HE3 LYS 90 HE3 LYS 90 -2.950 -5.057 -17.296 695 HZ1 LYS 90 HZ1 LYS 90 -2.021 -2.753 -17.455 696 HZ2 LYS 90 HZ2 LYS 90 -1.682 -2.664 -15.846 697 HZ3 LYS 90 HZ3 LYS 90 -3.247 -2.722 -16.350 698 H LEU 91 H LEU 91 -1.588 -5.216 -9.043 699 HA LEU 91 HA LEU 91 -3.434 -7.456 -8.034 700 HB2 LEU 91 HB2 LEU 91 -1.396 -5.619 -6.701 701 HB3 LEU 91 HB3 LEU 91 -2.557 -6.466 -5.739 702 HG LEU 91 HG LEU 91 -0.538 -7.850 -7.601 703 HD11 LEU 91 HD11 LEU 91 0.563 -6.619 -5.708 704 HD12 LEU 91 HD12 LEU 91 0.679 -8.367 -5.439 705 HD13 LEU 91 HD13 LEU 91 -0.524 -7.395 -4.546 706 HD21 LEU 91 HD21 LEU 91 -2.560 -9.316 -7.118 707 HD22 LEU 91 HD22 LEU 91 -2.305 -9.100 -5.375 708 HD23 LEU 91 HD23 LEU 91 -1.093 -9.946 -6.348 709 H VAL 92 H VAL 92 -5.525 -6.872 -8.011 710 HA VAL 92 HA VAL 92 -6.297 -4.005 -7.224 711 HB VAL 92 HB VAL 92 -8.330 -4.221 -8.495 712 HG11 VAL 92 HG11 VAL 92 -5.932 -4.890 -10.305 713 HG12 VAL 92 HG12 VAL 92 -7.402 -3.997 -10.761 714 HG13 VAL 92 HG13 VAL 92 -6.252 -3.296 -9.602 715 HG21 VAL 92 HG21 VAL 92 -8.765 -6.034 -10.167 716 HG22 VAL 92 HG22 VAL 92 -7.387 -6.968 -9.540 717 HG23 VAL 92 HG23 VAL 92 -8.809 -6.668 -8.513 718 H THR 93 H THR 93 -7.377 -3.635 -5.384 719 HA THR 93 HA THR 93 -9.292 -5.761 -4.341 720 HB THR 93 HB THR 93 -7.033 -6.079 -3.281 721 HG1 THR 93 HG1 THR 93 -8.795 -6.959 -2.353 722 HG21 THR 93 HG21 THR 93 -6.251 -3.794 -2.717 723 HG22 THR 93 HG22 THR 93 -6.444 -4.748 -1.237 724 HG23 THR 93 HG23 THR 93 -7.664 -3.531 -1.652 725 H THR 94 H THR 94 -10.419 -5.010 -2.348 726 HA THR 94 HA THR 94 -11.667 -2.229 -2.798 727 HB THR 94 HB THR 94 -13.234 -4.768 -2.042 728 HG1 THR 94 HG1 THR 94 -14.193 -4.495 -4.025 729 HG21 THR 94 HG21 THR 94 -14.265 -2.667 -1.084 730 HG22 THR 94 HG22 THR 94 -15.277 -3.342 -2.372 731 HG23 THR 94 HG23 THR 94 -14.262 -1.915 -2.698 732 H PHE 95 H PHE 95 -10.701 -1.197 -1.135 733 HA PHE 95 HA PHE 95 -10.157 -2.581 1.511 734 HB2 PHE 95 HB2 PHE 95 -8.569 -1.079 -0.122 735 HB3 PHE 95 HB3 PHE 95 -9.400 0.237 0.630 736 HD1 PHE 95 HD2 PHE 95 -7.239 -2.704 1.215 737 HD2 PHE 95 HD1 PHE 95 -8.528 1.074 2.795 738 HE1 PHE 95 HE2 PHE 95 -5.558 -2.875 3.010 739 HE2 PHE 95 HE1 PHE 95 -6.812 0.927 4.537 740 HZ PHE 95 HZ PHE 95 -5.361 -1.076 4.697 741 H LYS 96 H LYS 96 -10.344 0.333 2.737 742 HA LYS 96 HA LYS 96 -13.201 0.104 3.758 743 HB2 LYS 96 HB2 LYS 96 -11.035 2.200 4.379 744 HB3 LYS 96 HB3 LYS 96 -12.584 2.126 5.162 745 HG2 LYS 96 HG2 LYS 96 -10.461 -0.104 5.344 746 HG3 LYS 96 HG3 LYS 96 -10.557 1.244 6.440 747 HD2 LYS 96 HD2 LYS 96 -12.802 -0.858 6.102 748 HD3 LYS 96 HD3 LYS 96 -11.521 -0.911 7.304 749 HE2 LYS 96 HE2 LYS 96 -12.340 1.405 8.182 750 HE3 LYS 96 HE3 LYS 96 -13.766 1.201 7.165 751 HZ1 LYS 96 HZ1 LYS 96 -12.861 -0.832 9.286 752 HZ2 LYS 96 HZ2 LYS 96 -14.225 -0.969 8.384 753 HZ3 LYS 96 HZ3 LYS 96 -14.037 0.202 9.534 754 H ASN 97 H ASN 97 -14.330 0.507 1.727 755 HA ASN 97 HA ASN 97 -15.065 1.597 -0.196 756 HB2 ASN 97 HB2 ASN 97 -15.080 3.985 1.729 757 HB3 ASN 97 HB3 ASN 97 -15.933 3.875 0.212 758 HD21 ASN 97 HD21 ASN 97 -17.887 2.698 0.112 759 HD22 ASN 97 HD22 ASN 97 -18.628 2.028 1.659 760 H ILE 98 H ILE 98 -12.248 1.405 -0.187 761 HA ILE 98 HA ILE 98 -11.491 3.630 -2.189 762 HB ILE 98 HB ILE 98 -9.664 2.193 -0.183 763 HG12 ILE 98 HG12 ILE 98 -9.940 5.213 0.030 764 HG13 ILE 98 HG13 ILE 98 -11.287 4.285 0.619 765 HG21 ILE 98 HG21 ILE 98 -8.370 2.779 -2.233 766 HG22 ILE 98 HG22 ILE 98 -8.905 4.471 -2.123 767 HG23 ILE 98 HG23 ILE 98 -7.845 3.773 -0.874 768 HD11 ILE 98 HD11 ILE 98 -9.921 3.027 2.220 769 HD12 ILE 98 HD12 ILE 98 -8.414 3.735 1.598 770 HD13 ILE 98 HD13 ILE 98 -9.611 4.763 2.429 771 H LYS 99 H LYS 99 -10.813 2.851 -4.139 772 HA LYS 99 HA LYS 99 -10.549 -0.181 -4.526 773 HB2 LYS 99 HB2 LYS 99 -12.184 1.076 -5.957 774 HB3 LYS 99 HB3 LYS 99 -10.898 1.996 -6.645 775 HG2 LYS 99 HG2 LYS 99 -10.477 0.392 -8.188 776 HG3 LYS 99 HG3 LYS 99 -10.036 -0.773 -6.978 777 HD2 LYS 99 HD2 LYS 99 -12.866 -0.235 -8.079 778 HD3 LYS 99 HD3 LYS 99 -11.854 -1.585 -8.515 779 HE2 LYS 99 HE2 LYS 99 -13.051 -1.106 -5.684 780 HE3 LYS 99 HE3 LYS 99 -13.751 -2.148 -6.910 781 HZ1 LYS 99 HZ1 LYS 99 -11.666 -3.545 -6.832 782 HZ2 LYS 99 HZ2 LYS 99 -12.362 -3.446 -5.329 783 HZ3 LYS 99 HZ3 LYS 99 -11.023 -2.580 -5.662 784 H SER 100 H SER 100 -8.557 -0.750 -3.974 785 HA SER 100 HA SER 100 -6.140 1.010 -4.511 786 HB2 SER 100 HB2 SER 100 -6.484 0.048 -2.242 787 HB3 SER 100 HB3 SER 100 -6.364 -1.582 -2.889 788 HG SER 100 HG SER 100 -4.230 -1.093 -3.573 789 H VAL 101 H VAL 101 -5.184 0.817 -6.374 790 HA VAL 101 HA VAL 101 -5.006 -1.887 -7.848 791 HB VAL 101 HB VAL 101 -4.978 1.005 -8.914 792 HG11 VAL 101 HG11 VAL 101 -3.478 -0.374 -10.340 793 HG12 VAL 101 HG12 VAL 101 -4.737 -1.612 -10.543 794 HG13 VAL 101 HG13 VAL 101 -4.952 0.025 -11.225 795 HG21 VAL 101 HG21 VAL 101 -7.107 0.419 -10.105 796 HG22 VAL 101 HG22 VAL 101 -7.122 -1.189 -9.342 797 HG23 VAL 101 HG23 VAL 101 -7.307 0.275 -8.353 798 H THR 102 H THR 102 -3.052 -2.742 -7.254 799 HA THR 102 HA THR 102 -0.615 -0.912 -7.121 800 HB THR 102 HB THR 102 -0.742 -3.740 -6.017 801 HG1 THR 102 HG1 THR 102 -0.826 -1.594 -4.262 802 HG21 THR 102 HG21 THR 102 1.145 -1.375 -5.360 803 HG22 THR 102 HG22 THR 102 1.570 -2.792 -6.344 804 HG23 THR 102 HG23 THR 102 1.185 -2.994 -4.629 805 H GLU 103 H GLU 103 0.650 -0.870 -8.977 806 HA GLU 103 HA GLU 103 0.573 -3.346 -10.785 807 HB2 GLU 103 HB2 GLU 103 -0.551 -1.232 -11.733 808 HB3 GLU 103 HB3 GLU 103 1.056 -0.535 -11.826 809 HG2 GLU 103 HG2 GLU 103 1.842 -2.372 -13.354 810 HG3 GLU 103 HG3 GLU 103 0.313 -3.209 -13.197 811 H LEU 104 H LEU 104 2.393 -4.244 -11.284 812 HA LEU 104 HA LEU 104 5.069 -2.994 -10.487 813 HB2 LEU 104 HB2 LEU 104 4.053 -5.529 -9.934 814 HB3 LEU 104 HB3 LEU 104 4.967 -5.886 -11.371 815 HG LEU 104 HG LEU 104 5.991 -4.616 -8.755 816 HD11 LEU 104 HD11 LEU 104 5.466 -7.111 -8.751 817 HD12 LEU 104 HD12 LEU 104 7.179 -6.769 -8.485 818 HD13 LEU 104 HD13 LEU 104 6.624 -7.348 -10.070 819 HD21 LEU 104 HD21 LEU 104 7.631 -5.278 -11.294 820 HD22 LEU 104 HD22 LEU 104 8.335 -4.863 -9.711 821 HD23 LEU 104 HD23 LEU 104 7.391 -3.665 -10.599 822 H ASN 105 H ASN 105 6.164 -1.992 -12.050 823 HA ASN 105 HA ASN 105 5.834 -2.863 -15.013 824 HB2 ASN 105 HB2 ASN 105 6.351 -0.084 -13.784 825 HB3 ASN 105 HB3 ASN 105 6.694 -0.459 -15.453 826 HD21 ASN 105 HD21 ASN 105 3.998 -0.341 -13.164 827 HD22 ASN 105 HD22 ASN 105 2.732 -0.220 -14.493 828 H GLY 106 H GLY 106 7.311 -4.549 -14.592 829 HA2 GLY 106 HA2 GLY 106 9.528 -5.459 -15.120 830 HA3 GLY 106 HA3 GLY 106 10.202 -3.842 -15.191 831 H ASP 107 H ASP 107 11.031 -2.975 -13.314 832 HA ASP 107 HA ASP 107 10.830 -4.534 -10.673 833 HB2 ASP 107 HB2 ASP 107 13.435 -3.497 -11.951 834 HB3 ASP 107 HB3 ASP 107 13.303 -3.915 -10.258 835 H ILE 108 H ILE 108 9.418 -2.110 -11.649 836 HA ILE 108 HA ILE 108 9.854 -0.503 -9.105 837 HB ILE 108 HB ILE 108 9.331 1.536 -9.983 838 HG12 ILE 108 HG12 ILE 108 9.502 1.664 -12.716 839 HG13 ILE 108 HG13 ILE 108 8.630 0.164 -12.587 840 HG21 ILE 108 HG21 ILE 108 11.595 0.375 -11.684 841 HG22 ILE 108 HG22 ILE 108 11.338 2.097 -11.295 842 HG23 ILE 108 HG23 ILE 108 11.704 0.945 -10.003 843 HD11 ILE 108 HD11 ILE 108 6.860 1.359 -11.140 844 HD12 ILE 108 HD12 ILE 108 7.790 2.865 -11.305 845 HD13 ILE 108 HD13 ILE 108 7.047 2.110 -12.742 846 H ILE 109 H ILE 109 8.069 -0.257 -7.869 847 HA ILE 109 HA ILE 109 5.464 -1.418 -8.959 848 HB ILE 109 HB ILE 109 6.610 -2.793 -7.183 849 HG12 ILE 109 HG12 ILE 109 3.831 -1.813 -6.319 850 HG13 ILE 109 HG13 ILE 109 4.097 -2.845 -7.715 851 HG21 ILE 109 HG21 ILE 109 7.457 -0.928 -5.671 852 HG22 ILE 109 HG22 ILE 109 5.791 -0.588 -5.165 853 HG23 ILE 109 HG23 ILE 109 6.548 -2.149 -4.779 854 HD11 ILE 109 HD11 ILE 109 3.469 -4.217 -5.724 855 HD12 ILE 109 HD12 ILE 109 5.113 -4.644 -6.270 856 HD13 ILE 109 HD13 ILE 109 4.874 -3.627 -4.829 857 H THR 110 H THR 110 3.711 -0.218 -8.985 858 HA THR 110 HA THR 110 3.729 2.403 -7.416 859 HB THR 110 HB THR 110 3.695 2.560 -9.974 860 HG1 THR 110 HG1 THR 110 2.859 4.089 -8.112 861 HG21 THR 110 HG21 THR 110 1.583 2.615 -11.162 862 HG22 THR 110 HG22 THR 110 0.689 2.064 -9.723 863 HG23 THR 110 HG23 THR 110 1.858 0.977 -10.510 864 H ASN 111 H ASN 111 2.173 2.785 -5.982 865 HA ASN 111 HA ASN 111 -0.093 0.706 -5.674 866 HB2 ASN 111 HB2 ASN 111 1.693 0.734 -3.814 867 HB3 ASN 111 HB3 ASN 111 1.117 2.329 -3.372 868 HD21 ASN 111 HD21 ASN 111 -0.894 2.437 -2.262 869 HD22 ASN 111 HD22 ASN 111 -1.779 0.898 -1.773 870 H THR 112 H THR 112 -1.778 1.635 -6.701 871 HA THR 112 HA THR 112 -2.280 4.645 -6.403 872 HB THR 112 HB THR 112 -3.408 2.749 -8.514 873 HG1 THR 112 HG1 THR 112 -1.087 3.011 -8.467 874 HG21 THR 112 HG21 THR 112 -3.775 4.842 -9.823 875 HG22 THR 112 HG22 THR 112 -3.118 5.828 -8.496 876 HG23 THR 112 HG23 THR 112 -4.654 4.947 -8.281 877 H MET 113 H MET 113 -3.423 4.836 -4.588 878 HA MET 113 HA MET 113 -5.875 3.101 -3.996 879 HB2 MET 113 HB2 MET 113 -4.241 5.069 -2.351 880 HB3 MET 113 HB3 MET 113 -5.857 4.642 -1.844 881 HG2 MET 113 HG2 MET 113 -5.297 2.222 -1.731 882 HG3 MET 113 HG3 MET 113 -3.672 2.532 -2.370 883 HE1 MET 113 HE1 MET 113 -3.336 0.969 -0.330 884 HE2 MET 113 HE2 MET 113 -2.955 1.617 1.287 885 HE3 MET 113 HE3 MET 113 -4.651 1.246 0.849 886 H THR 114 H THR 114 -7.420 3.661 -5.267 887 HA THR 114 HA THR 114 -8.079 6.550 -5.906 888 HB THR 114 HB THR 114 -9.617 5.727 -7.603 889 HG1 THR 114 HG1 THR 114 -8.767 3.156 -6.713 890 HG21 THR 114 HG21 THR 114 -7.216 6.041 -8.276 891 HG22 THR 114 HG22 THR 114 -8.019 4.752 -9.201 892 HG23 THR 114 HG23 THR 114 -6.888 4.330 -7.896 893 H LEU 115 H LEU 115 -9.292 7.600 -4.560 894 HA LEU 115 HA LEU 115 -11.773 6.301 -3.239 895 HB2 LEU 115 HB2 LEU 115 -10.024 6.831 -1.612 896 HB3 LEU 115 HB3 LEU 115 -9.833 8.453 -2.232 897 HG LEU 115 HG LEU 115 -12.123 9.083 -1.424 898 HD11 LEU 115 HD11 LEU 115 -12.207 6.266 -0.140 899 HD12 LEU 115 HD12 LEU 115 -13.280 6.849 -1.428 900 HD13 LEU 115 HD13 LEU 115 -13.349 7.588 0.178 901 HD21 LEU 115 HD21 LEU 115 -10.093 9.483 -0.017 902 HD22 LEU 115 HD22 LEU 115 -10.259 7.873 0.720 903 HD23 LEU 115 HD23 LEU 115 -11.499 9.122 1.001 904 H GLY 116 H GLY 116 -12.685 6.741 -5.374 905 HA2 GLY 116 HA2 GLY 116 -14.336 7.961 -6.671 906 HA3 GLY 116 HA3 GLY 116 -14.396 9.189 -5.429 907 H ASP 117 H ASP 117 -12.987 10.904 -5.588 908 HA ASP 117 HA ASP 117 -11.819 11.550 -8.354 909 HB2 ASP 117 HB2 ASP 117 -12.589 13.426 -6.020 910 HB3 ASP 117 HB3 ASP 117 -11.806 13.945 -7.500 911 H ILE 118 H ILE 118 -10.851 10.957 -5.046 912 HA ILE 118 HA ILE 118 -8.167 12.318 -5.253 913 HB ILE 118 HB ILE 118 -9.218 10.412 -3.110 914 HG12 ILE 118 HG12 ILE 118 -10.727 12.348 -3.104 915 HG13 ILE 118 HG13 ILE 118 -9.849 12.115 -1.620 916 HG21 ILE 118 HG21 ILE 118 -6.826 12.389 -2.987 917 HG22 ILE 118 HG22 ILE 118 -7.433 11.407 -1.642 918 HG23 ILE 118 HG23 ILE 118 -6.707 10.618 -3.044 919 HD11 ILE 118 HD11 ILE 118 -9.097 14.272 -3.706 920 HD12 ILE 118 HD12 ILE 118 -10.053 14.541 -2.221 921 HD13 ILE 118 HD13 ILE 118 -8.357 14.047 -2.093 922 H VAL 119 H VAL 119 -6.552 11.329 -6.330 923 HA VAL 119 HA VAL 119 -6.346 8.254 -6.433 924 HB VAL 119 HB VAL 119 -5.230 10.353 -8.377 925 HG11 VAL 119 HG11 VAL 119 -3.808 8.297 -8.378 926 HG12 VAL 119 HG12 VAL 119 -5.246 7.271 -8.615 927 HG13 VAL 119 HG13 VAL 119 -4.726 8.406 -9.884 928 HG21 VAL 119 HG21 VAL 119 -7.627 8.415 -8.771 929 HG22 VAL 119 HG22 VAL 119 -7.732 10.180 -8.634 930 HG23 VAL 119 HG23 VAL 119 -6.923 9.461 -10.031 931 H PHE 120 H PHE 120 -5.263 7.934 -4.455 932 HA PHE 120 HA PHE 120 -2.694 9.423 -3.839 933 HB2 PHE 120 HB2 PHE 120 -4.041 9.024 -1.959 934 HB3 PHE 120 HB3 PHE 120 -4.302 7.343 -2.331 935 HD1 PHE 120 HD2 PHE 120 -1.043 9.350 -2.101 936 HD2 PHE 120 HD1 PHE 120 -3.395 6.117 -0.510 937 HE1 PHE 120 HE2 PHE 120 0.875 8.585 -0.803 938 HE2 PHE 120 HE1 PHE 120 -1.452 5.358 0.787 939 HZ PHE 120 HZ PHE 120 0.698 6.587 0.640 940 H LYS 121 H LYS 121 -1.243 8.968 -5.349 941 HA LYS 121 HA LYS 121 -0.562 6.062 -5.984 942 HB2 LYS 121 HB2 LYS 121 -1.343 7.670 -7.764 943 HB3 LYS 121 HB3 LYS 121 0.144 8.571 -7.567 944 HG2 LYS 121 HG2 LYS 121 1.489 6.506 -8.185 945 HG3 LYS 121 HG3 LYS 121 -0.005 5.585 -8.351 946 HD2 LYS 121 HD2 LYS 121 -0.802 7.225 -10.136 947 HD3 LYS 121 HD3 LYS 121 0.702 8.130 -9.966 948 HE2 LYS 121 HE2 LYS 121 2.027 6.029 -10.643 949 HE3 LYS 121 HE3 LYS 121 0.512 5.139 -10.824 950 HZ1 LYS 121 HZ1 LYS 121 1.174 7.673 -12.341 951 HZ2 LYS 121 HZ2 LYS 121 -0.200 6.811 -12.535 952 HZ3 LYS 121 HZ3 LYS 121 1.241 6.163 -13.006 953 H ARG 122 H ARG 122 1.000 5.221 -4.825 954 HA ARG 122 HA ARG 122 3.609 6.738 -4.259 955 HB2 ARG 122 HB2 ARG 122 2.607 3.943 -3.428 956 HB3 ARG 122 HB3 ARG 122 4.296 4.343 -3.378 957 HG2 ARG 122 HG2 ARG 122 3.798 6.332 -1.853 958 HG3 ARG 122 HG3 ARG 122 2.125 5.767 -1.724 959 HD2 ARG 122 HD2 ARG 122 2.932 3.547 -0.823 960 HD3 ARG 122 HD3 ARG 122 4.600 4.000 -1.143 961 HE ARG 122 HE ARG 122 3.538 6.031 0.656 962 HH11 ARG 122 HH11 ARG 122 4.700 2.694 0.641 963 HH12 ARG 122 HH12 ARG 122 5.264 2.873 2.384 964 HH21 ARG 122 HH21 ARG 122 4.151 6.101 2.605 965 HH22 ARG 122 HH22 ARG 122 4.946 4.659 3.432 966 H ILE 123 H ILE 123 5.527 6.255 -5.254 967 HA ILE 123 HA ILE 123 5.660 4.020 -7.363 968 HB ILE 123 HB ILE 123 6.926 6.806 -7.650 969 HG12 ILE 123 HG12 ILE 123 5.419 6.679 -9.914 970 HG13 ILE 123 HG13 ILE 123 4.424 5.606 -8.963 971 HG21 ILE 123 HG21 ILE 123 6.958 4.404 -9.599 972 HG22 ILE 123 HG22 ILE 123 7.646 6.015 -9.924 973 HG23 ILE 123 HG23 ILE 123 8.348 4.999 -8.663 974 HD11 ILE 123 HD11 ILE 123 3.561 7.944 -8.881 975 HD12 ILE 123 HD12 ILE 123 4.134 7.561 -7.251 976 HD13 ILE 123 HD13 ILE 123 5.122 8.567 -8.325 977 H SER 124 H SER 124 6.865 2.524 -6.372 978 HA SER 124 HA SER 124 9.409 3.343 -4.842 979 HB2 SER 124 HB2 SER 124 7.442 1.011 -4.280 980 HB3 SER 124 HB3 SER 124 8.929 1.323 -3.387 981 HG SER 124 HG SER 124 6.493 2.395 -2.975 982 H LYS 125 H LYS 125 11.299 2.175 -5.189 983 HA LYS 125 HA LYS 125 11.290 0.413 -7.690 984 HB2 LYS 125 HB2 LYS 125 12.528 2.527 -7.839 985 HB3 LYS 125 HB3 LYS 125 13.549 2.099 -6.465 986 HG2 LYS 125 HG2 LYS 125 14.643 0.311 -7.653 987 HG3 LYS 125 HG3 LYS 125 13.395 0.186 -8.870 988 HD2 LYS 125 HD2 LYS 125 14.078 2.682 -9.543 989 HD3 LYS 125 HD3 LYS 125 15.537 2.382 -8.624 990 HE2 LYS 125 HE2 LYS 125 14.446 0.693 -11.013 991 HE3 LYS 125 HE3 LYS 125 15.674 1.939 -11.166 992 HZ1 LYS 125 HZ1 LYS 125 16.005 -0.565 -9.498 993 HZ2 LYS 125 HZ2 LYS 125 17.158 0.583 -9.654 994 HZ3 LYS 125 HZ3 LYS 125 16.723 -0.329 -10.955 995 H ARG 126 H ARG 126 12.069 -1.641 -7.667 996 HA ARG 126 HA ARG 126 12.158 -3.167 -5.251 997 HB2 ARG 126 HB2 ARG 126 11.637 -3.832 -7.703 998 HB3 ARG 126 HB3 ARG 126 13.367 -3.916 -7.977 999 HG2 ARG 126 HG2 ARG 126 13.484 -5.727 -6.123 1000 HG3 ARG 126 HG3 ARG 126 11.728 -5.586 -5.951 1001 HD2 ARG 126 HD2 ARG 126 11.608 -6.031 -8.556 1002 HD3 ARG 126 HD3 ARG 126 13.317 -6.468 -8.456 1003 HE ARG 126 HE ARG 126 11.916 -8.073 -6.452 1004 HH11 ARG 126 HH11 ARG 126 11.983 -7.761 -9.999 1005 HH12 ARG 126 HH12 ARG 126 11.246 -9.443 -10.128 1006 HH21 ARG 126 HH21 ARG 126 11.139 -9.882 -6.728 1007 HH22 ARG 126 HH22 ARG 126 10.731 -10.556 -8.397 1008 H ILE 127 H ILE 127 13.644 -3.566 -3.791 1009 HA ILE 127 HA ILE 127 16.607 -3.531 -4.362 1010 HB ILE 127 HB ILE 127 15.087 -1.671 -2.451 1011 HG12 ILE 127 HG12 ILE 127 17.493 -1.220 -4.301 1012 HG13 ILE 127 HG13 ILE 127 15.821 -0.845 -4.676 1013 HG21 ILE 127 HG21 ILE 127 17.992 -2.464 -1.914 1014 HG22 ILE 127 HG22 ILE 127 17.059 -1.175 -1.086 1015 HG23 ILE 127 HG23 ILE 127 16.578 -2.865 -0.906 1016 HD11 ILE 127 HD11 ILE 127 15.733 0.836 -2.794 1017 HD12 ILE 127 HD12 ILE 127 17.471 0.586 -2.512 1018 HD13 ILE 127 HD13 ILE 127 16.908 1.241 -4.065 1019 H21 OLA 128 H21 OLA 128 4.097 9.470 15.128 1020 H22 OLA 128 H22 OLA 128 5.053 8.261 14.303 1021 H31 OLA 128 H31 OLA 128 3.845 10.734 12.865 1022 H32 OLA 128 H32 OLA 128 2.959 9.228 13.078 1023 H41 OLA 128 H41 OLA 128 4.720 7.979 11.769 1024 H42 OLA 128 H42 OLA 128 5.633 9.475 11.580 1025 H51 OLA 128 H51 OLA 128 4.446 9.184 9.522 1026 H52 OLA 128 H52 OLA 128 3.637 10.499 10.352 1027 H61 OLA 128 H61 OLA 128 1.826 8.892 11.123 1028 H62 OLA 128 H62 OLA 128 2.670 7.555 10.343 1029 H71 OLA 128 H71 OLA 128 2.384 8.653 8.095 1030 H72 OLA 128 H72 OLA 128 1.603 10.047 8.853 1031 H81 OLA 128 H81 OLA 128 -0.239 8.526 9.740 1032 H82 OLA 128 H82 OLA 128 0.529 7.138 8.981 1033 H9 OLA 128 H9 OLA 128 -0.866 9.528 7.591 1034 H10 OLA 128 H10 OLA 128 -0.901 8.319 5.636 1035 H111 OLA 128 H111 OLA 128 0.099 5.823 6.978 1036 H112 OLA 128 H112 OLA 128 1.449 6.711 6.266 1037 H121 OLA 128 H121 OLA 128 0.283 6.700 4.033 1038 H122 OLA 128 H122 OLA 128 -1.099 5.856 4.725 1039 H131 OLA 128 H131 OLA 128 0.287 3.838 5.176 1040 H132 OLA 128 H132 OLA 128 1.760 4.681 4.676 1041 H141 OLA 128 H141 OLA 128 0.836 5.018 2.371 1042 H142 OLA 128 H142 OLA 128 -0.675 4.240 2.825 1043 H151 OLA 128 H151 OLA 128 0.577 2.069 3.251 1044 H152 OLA 128 H152 OLA 128 2.088 2.863 2.823 1045 H161 OLA 128 H161 OLA 128 1.089 3.443 0.532 1046 H162 OLA 128 H162 OLA 128 -0.349 2.528 0.928 1047 H171 OLA 128 H171 OLA 128 2.480 1.256 0.968 1048 H172 OLA 128 H172 OLA 128 1.540 1.390 -0.500 1049 H181 OLA 128 H181 OLA 128 -0.298 -0.008 0.420 1050 H182 OLA 128 H182 OLA 128 1.242 -0.868 0.567 1051 H183 OLA 128 H183 OLA 128 0.518 -0.120 2.004 1052 H21 OLA 129 H21 OLA 129 5.475 -0.667 -2.217 1053 H22 OLA 129 H22 OLA 129 4.263 -0.172 -3.382 1054 H31 OLA 129 H31 OLA 129 2.405 -0.559 -1.821 1055 H32 OLA 129 H32 OLA 129 3.496 -0.717 -0.447 1056 H41 OLA 129 H41 OLA 129 4.502 -2.786 -1.411 1057 H42 OLA 129 H42 OLA 129 3.475 -2.672 -2.833 1058 H51 OLA 129 H51 OLA 129 2.246 -2.835 0.001 1059 H52 OLA 129 H52 OLA 129 2.830 -4.282 -0.792 1060 H61 OLA 129 H61 OLA 129 1.301 -4.005 -2.689 1061 H62 OLA 129 H62 OLA 129 0.765 -2.422 -2.108 1062 H71 OLA 129 H71 OLA 129 -0.208 -3.500 -0.048 1063 H72 OLA 129 H72 OLA 129 0.354 -5.080 -0.591 1064 H81 OLA 129 H81 OLA 129 -1.071 -4.848 -2.701 1065 H82 OLA 129 H82 OLA 129 -1.652 -3.291 -2.144 1066 H9 OLA 129 H9 OLA 129 -2.418 -6.071 -1.146 1067 H10 OLA 129 H10 OLA 129 -3.957 -5.158 0.321 1068 H111 OLA 129 H111 OLA 129 -4.416 -2.711 0.333 1069 H112 OLA 129 H112 OLA 129 -2.871 -2.342 -0.415 1070 H121 OLA 129 H121 OLA 129 -1.687 -3.205 1.717 1071 H122 OLA 129 H122 OLA 129 -3.269 -3.442 2.460 1072 H131 OLA 129 H131 OLA 129 -3.749 -0.953 2.086 1073 H132 OLA 129 H132 OLA 129 -2.134 -0.773 1.431 1074 H141 OLA 129 H141 OLA 129 -1.188 -1.646 3.667 1075 H142 OLA 129 H142 OLA 129 -2.817 -1.636 4.330 1076 H151 OLA 129 H151 OLA 129 -1.378 0.834 3.154 1077 H152 OLA 129 H152 OLA 129 -1.368 0.425 4.862 1078 H161 OLA 129 H161 OLA 129 -3.787 0.777 5.082 1079 H162 OLA 129 H162 OLA 129 -4.004 0.899 3.342 1080 H171 OLA 129 H171 OLA 129 -2.492 2.981 3.342 1081 H172 OLA 129 H172 OLA 129 -2.493 2.920 5.104 1082 H181 OLA 129 H181 OLA 129 -4.997 3.223 3.276 1083 H182 OLA 129 H182 OLA 129 -5.066 3.127 5.051 1084 H183 OLA 129 H183 OLA 129 -4.262 4.506 4.264 Start of MODEL 7 1 H1 SER 2 H1 SER 2 6.497 -11.242 -11.558 2 H2 SER 2 H2 SER 2 5.755 -10.239 -10.534 3 HA SER 2 HA SER 2 7.087 -11.984 -9.457 4 HB2 SER 2 HB2 SER 2 8.871 -11.999 -11.219 5 HB3 SER 2 HB3 SER 2 9.376 -10.378 -10.732 6 HG SER 2 HG SER 2 9.469 -12.779 -9.204 7 H PHE 3 H PHE 3 6.221 -11.195 -7.674 8 HA PHE 3 HA PHE 3 6.739 -8.378 -6.673 9 HB2 PHE 3 HB2 PHE 3 4.795 -10.602 -5.806 10 HB3 PHE 3 HB3 PHE 3 4.991 -9.154 -4.875 11 HD1 PHE 3 HD2 PHE 3 4.274 -6.930 -5.723 12 HD2 PHE 3 HD1 PHE 3 3.669 -10.488 -8.068 13 HE1 PHE 3 HE2 PHE 3 2.600 -5.751 -7.116 14 HE2 PHE 3 HE1 PHE 3 1.990 -9.304 -9.405 15 HZ PHE 3 HZ PHE 3 1.434 -6.942 -8.908 16 H SER 4 H SER 4 8.477 -11.185 -5.972 17 HA SER 4 HA SER 4 8.923 -10.676 -3.102 18 HB2 SER 4 HB2 SER 4 10.540 -12.357 -5.082 19 HB3 SER 4 HB3 SER 4 10.904 -12.244 -3.357 20 HG SER 4 HG SER 4 9.471 -13.991 -3.898 21 H GLY 5 H GLY 5 9.887 -8.924 -2.260 22 HA2 GLY 5 HA2 GLY 5 12.658 -8.164 -2.624 23 HA3 GLY 5 HA3 GLY 5 11.734 -7.151 -3.734 24 H LYS 6 H LYS 6 13.212 -5.968 -1.946 25 HA LYS 6 HA LYS 6 11.350 -4.823 0.243 26 HB2 LYS 6 HB2 LYS 6 14.393 -4.860 -0.058 27 HB3 LYS 6 HB3 LYS 6 13.571 -3.906 1.146 28 HG2 LYS 6 HG2 LYS 6 12.628 -5.952 2.257 29 HG3 LYS 6 HG3 LYS 6 13.350 -6.981 1.020 30 HD2 LYS 6 HD2 LYS 6 15.655 -6.114 1.648 31 HD3 LYS 6 HD3 LYS 6 14.967 -5.146 2.934 32 HE2 LYS 6 HE2 LYS 6 14.754 -8.247 2.748 33 HE3 LYS 6 HE3 LYS 6 16.026 -7.397 3.619 34 HZ1 LYS 6 HZ1 LYS 6 13.054 -7.398 4.290 35 HZ2 LYS 6 HZ2 LYS 6 14.072 -6.267 4.929 36 HZ3 LYS 6 HZ3 LYS 6 14.293 -7.872 5.255 37 H TYR 7 H TYR 7 10.243 -3.439 -1.178 38 HA TYR 7 HA TYR 7 11.734 -1.924 -3.313 39 HB2 TYR 7 HB2 TYR 7 8.713 -1.898 -2.655 40 HB3 TYR 7 HB3 TYR 7 9.448 -1.137 -4.027 41 HD1 TYR 7 HD2 TYR 7 8.859 -4.546 -2.484 42 HD2 TYR 7 HD1 TYR 7 9.611 -2.349 -6.108 43 HE1 TYR 7 HE2 TYR 7 8.518 -6.582 -3.796 44 HE2 TYR 7 HE1 TYR 7 9.211 -4.392 -7.414 45 HH TYR 7 HH TYR 7 8.878 -6.622 -7.328 46 H GLN 8 H GLN 8 12.801 -0.101 -2.678 47 HA GLN 8 HA GLN 8 11.782 1.568 -0.419 48 HB2 GLN 8 HB2 GLN 8 14.257 1.136 -0.866 49 HB3 GLN 8 HB3 GLN 8 14.154 2.291 -2.196 50 HG2 GLN 8 HG2 GLN 8 13.322 4.063 -0.529 51 HG3 GLN 8 HG3 GLN 8 13.452 2.879 0.767 52 HE21 GLN 8 HE21 GLN 8 14.649 4.913 1.424 53 HE22 GLN 8 HE22 GLN 8 16.461 4.851 1.073 54 H LEU 9 H LEU 9 10.811 3.452 -0.403 55 HA LEU 9 HA LEU 9 9.207 4.283 -2.718 56 HB2 LEU 9 HB2 LEU 9 8.383 4.308 -0.409 57 HB3 LEU 9 HB3 LEU 9 9.578 5.499 0.062 58 HG LEU 9 HG LEU 9 8.477 7.220 -1.435 59 HD11 LEU 9 HD11 LEU 9 6.150 6.740 -2.333 60 HD12 LEU 9 HD12 LEU 9 6.364 5.014 -1.931 61 HD13 LEU 9 HD13 LEU 9 7.383 5.781 -3.158 62 HD21 LEU 9 HD21 LEU 9 7.881 7.047 0.985 63 HD22 LEU 9 HD22 LEU 9 6.608 5.864 0.612 64 HD23 LEU 9 HD23 LEU 9 6.478 7.540 0.028 65 H GLN 10 H GLN 10 9.476 5.739 -4.199 66 HA GLN 10 HA GLN 10 11.783 7.756 -4.071 67 HB2 GLN 10 HB2 GLN 10 10.373 6.464 -6.477 68 HB3 GLN 10 HB3 GLN 10 11.614 7.686 -6.604 69 HG2 GLN 10 HG2 GLN 10 12.102 4.975 -5.188 70 HG3 GLN 10 HG3 GLN 10 12.235 5.217 -6.903 71 HE21 GLN 10 HE21 GLN 10 14.439 4.423 -6.331 72 HE22 GLN 10 HE22 GLN 10 15.693 5.671 -5.834 73 H SER 11 H SER 11 8.583 7.530 -5.628 74 HA SER 11 HA SER 11 8.096 10.496 -4.904 75 HB2 SER 11 HB2 SER 11 8.545 10.187 -7.342 76 HB3 SER 11 HB3 SER 11 7.214 9.045 -7.467 77 HG SER 11 HG SER 11 7.103 11.821 -6.868 78 H GLN 12 H GLN 12 6.212 11.045 -4.001 79 HA GLN 12 HA GLN 12 4.001 8.961 -3.601 80 HB2 GLN 12 HB2 GLN 12 5.645 9.218 -1.602 81 HB3 GLN 12 HB3 GLN 12 5.022 10.857 -1.396 82 HG2 GLN 12 HG2 GLN 12 2.800 10.047 -0.828 83 HG3 GLN 12 HG3 GLN 12 3.121 8.443 -1.437 84 HE21 GLN 12 HE21 GLN 12 4.992 10.438 0.950 85 HE22 GLN 12 HE22 GLN 12 4.737 9.207 2.282 86 H GLU 13 H GLU 13 2.326 9.772 -4.718 87 HA GLU 13 HA GLU 13 2.171 12.630 -5.456 88 HB2 GLU 13 HB2 GLU 13 1.856 10.577 -6.929 89 HB3 GLU 13 HB3 GLU 13 0.360 10.243 -6.081 90 HG2 GLU 13 HG2 GLU 13 -0.481 12.595 -6.967 91 HG3 GLU 13 HG3 GLU 13 0.983 12.628 -7.947 92 H ASN 14 H ASN 14 -0.993 11.395 -4.977 93 HA ASN 14 HA ASN 14 -1.697 13.700 -3.266 94 HB2 ASN 14 HB2 ASN 14 -3.381 11.381 -4.372 95 HB3 ASN 14 HB3 ASN 14 -4.057 12.629 -3.422 96 HD21 ASN 14 HD21 ASN 14 -3.209 11.836 -6.625 97 HD22 ASN 14 HD22 ASN 14 -3.584 13.520 -7.261 98 H PHE 15 H PHE 15 -0.041 12.641 -1.635 99 HA PHE 15 HA PHE 15 -1.308 11.039 0.526 100 HB2 PHE 15 HB2 PHE 15 1.190 11.286 0.010 101 HB3 PHE 15 HB3 PHE 15 1.169 12.862 0.737 102 HD1 PHE 15 HD1 PHE 15 0.744 13.064 3.251 103 HD2 PHE 15 HD2 PHE 15 1.191 9.237 1.363 104 HE1 PHE 15 HE1 PHE 15 1.331 12.041 5.409 105 HE2 PHE 15 HE2 PHE 15 1.796 8.242 3.518 106 HZ PHE 15 HZ PHE 15 1.847 9.638 5.557 107 H GLU 16 H GLU 16 -0.548 14.565 0.502 108 HA GLU 16 HA GLU 16 -2.005 15.354 2.872 109 HB2 GLU 16 HB2 GLU 16 -1.046 16.764 0.324 110 HB3 GLU 16 HB3 GLU 16 -2.188 17.630 1.288 111 HG2 GLU 16 HG2 GLU 16 0.360 16.504 2.628 112 HG3 GLU 16 HG3 GLU 16 0.349 18.040 1.760 113 H ALA 17 H ALA 17 -3.315 15.353 -0.451 114 HA ALA 17 HA ALA 17 -6.051 16.139 0.311 115 HB1 ALA 17 HB1 ALA 17 -5.061 14.647 -2.217 116 HB2 ALA 17 HB2 ALA 17 -6.605 15.509 -2.037 117 HB3 ALA 17 HB3 ALA 17 -5.089 16.416 -1.999 118 H PHE 18 H PHE 18 -4.596 12.898 0.057 119 HA PHE 18 HA PHE 18 -7.218 11.451 0.433 120 HB2 PHE 18 HB2 PHE 18 -5.274 10.543 -0.921 121 HB3 PHE 18 HB3 PHE 18 -4.319 10.400 0.520 122 HD1 PHE 18 HD2 PHE 18 -4.986 8.689 2.303 123 HD2 PHE 18 HD1 PHE 18 -6.952 8.831 -1.521 124 HE1 PHE 18 HE2 PHE 18 -5.696 6.353 2.572 125 HE2 PHE 18 HE1 PHE 18 -7.663 6.503 -1.233 126 HZ PHE 18 HZ PHE 18 -7.027 5.256 0.817 127 H MET 19 H MET 19 -4.340 11.940 2.573 128 HA MET 19 HA MET 19 -5.609 10.659 4.891 129 HB2 MET 19 HB2 MET 19 -3.204 12.547 4.706 130 HB3 MET 19 HB3 MET 19 -3.787 11.812 6.195 131 HG2 MET 19 HG2 MET 19 -1.901 10.505 5.313 132 HG3 MET 19 HG3 MET 19 -3.374 9.519 5.376 133 HE1 MET 19 HE1 MET 19 -2.823 7.743 3.930 134 HE2 MET 19 HE2 MET 19 -2.571 7.823 2.165 135 HE3 MET 19 HE3 MET 19 -1.209 8.155 3.261 136 H LYS 20 H LYS 20 -5.596 14.137 3.955 137 HA LYS 20 HA LYS 20 -7.307 14.921 6.284 138 HB2 LYS 20 HB2 LYS 20 -6.592 16.354 3.664 139 HB3 LYS 20 HB3 LYS 20 -7.899 16.940 4.669 140 HG2 LYS 20 HG2 LYS 20 -6.364 17.069 6.676 141 HG3 LYS 20 HG3 LYS 20 -5.001 16.597 5.682 142 HD2 LYS 20 HD2 LYS 20 -6.756 19.005 4.862 143 HD3 LYS 20 HD3 LYS 20 -5.660 19.209 6.187 144 HE2 LYS 20 HE2 LYS 20 -4.625 18.140 3.459 145 HE3 LYS 20 HE3 LYS 20 -4.881 19.865 3.733 146 HZ1 LYS 20 HZ1 LYS 20 -2.537 19.225 4.345 147 HZ2 LYS 20 HZ2 LYS 20 -3.052 18.152 5.412 148 HZ3 LYS 20 HZ3 LYS 20 -3.352 19.751 5.744 149 H ALA 21 H ALA 21 -8.183 13.850 2.898 150 HA ALA 21 HA ALA 21 -11.077 14.145 3.292 151 HB1 ALA 21 HB1 ALA 21 -11.234 12.634 1.295 152 HB2 ALA 21 HB2 ALA 21 -10.021 13.903 1.042 153 HB3 ALA 21 HB3 ALA 21 -9.504 12.243 1.430 154 H ILE 22 H ILE 22 -8.936 11.370 4.099 155 HA ILE 22 HA ILE 22 -11.317 9.795 5.142 156 HB ILE 22 HB ILE 22 -9.844 7.971 5.676 157 HG12 ILE 22 HG12 ILE 22 -7.444 9.435 4.460 158 HG13 ILE 22 HG13 ILE 22 -7.724 9.411 6.188 159 HG21 ILE 22 HG21 ILE 22 -9.295 7.250 3.371 160 HG22 ILE 22 HG22 ILE 22 -10.814 8.168 3.355 161 HG23 ILE 22 HG23 ILE 22 -9.306 8.932 2.800 162 HD11 ILE 22 HD11 ILE 22 -7.291 6.888 4.447 163 HD12 ILE 22 HD12 ILE 22 -6.109 7.639 5.538 164 HD13 ILE 22 HD13 ILE 22 -7.582 6.889 6.207 165 H GLY 23 H GLY 23 -9.612 12.256 6.532 166 HA2 GLY 23 HA2 GLY 23 -10.106 13.122 8.761 167 HA3 GLY 23 HA3 GLY 23 -10.721 11.570 9.258 168 H LEU 24 H LEU 24 -7.420 12.417 8.068 169 HA LEU 24 HA LEU 24 -6.339 11.636 10.811 170 HB2 LEU 24 HB2 LEU 24 -5.363 11.197 7.976 171 HB3 LEU 24 HB3 LEU 24 -4.136 11.686 9.087 172 HG LEU 24 HG LEU 24 -5.058 9.801 10.723 173 HD11 LEU 24 HD11 LEU 24 -7.169 9.286 9.440 174 HD12 LEU 24 HD12 LEU 24 -6.127 7.868 9.579 175 HD13 LEU 24 HD13 LEU 24 -6.205 8.766 8.042 176 HD21 LEU 24 HD21 LEU 24 -2.840 9.748 9.634 177 HD22 LEU 24 HD22 LEU 24 -3.554 9.074 8.144 178 HD23 LEU 24 HD23 LEU 24 -3.578 8.135 9.666 179 HA PRO 25 HA PRO 25 -4.845 15.675 11.815 180 HB2 PRO 25 HB2 PRO 25 -2.576 15.145 13.409 181 HB3 PRO 25 HB3 PRO 25 -4.235 14.944 13.884 182 HG2 PRO 25 HG2 PRO 25 -2.255 12.869 12.920 183 HG3 PRO 25 HG3 PRO 25 -3.473 12.661 14.194 184 HD2 PRO 25 HD2 PRO 25 -3.623 11.744 11.512 185 HD3 PRO 25 HD3 PRO 25 -5.052 11.935 12.548 186 H GLU 26 H GLU 26 -3.693 17.317 10.988 187 HA GLU 26 HA GLU 26 -1.862 17.058 8.798 188 HB2 GLU 26 HB2 GLU 26 -2.507 19.425 10.602 189 HB3 GLU 26 HB3 GLU 26 -1.528 19.506 9.176 190 HG2 GLU 26 HG2 GLU 26 -3.619 18.401 7.902 191 HG3 GLU 26 HG3 GLU 26 -4.535 18.890 9.314 192 H GLU 27 H GLU 27 -1.040 17.430 12.192 193 HA GLU 27 HA GLU 27 1.871 17.780 11.938 194 HB2 GLU 27 HB2 GLU 27 0.647 18.294 13.966 195 HB3 GLU 27 HB3 GLU 27 0.049 16.663 14.163 196 HG2 GLU 27 HG2 GLU 27 3.089 17.203 14.290 197 HG3 GLU 27 HG3 GLU 27 2.045 17.573 15.653 198 H LEU 28 H LEU 28 0.035 14.680 12.380 199 HA LEU 28 HA LEU 28 2.449 13.018 11.848 200 HB2 LEU 28 HB2 LEU 28 -0.440 12.054 11.611 201 HB3 LEU 28 HB3 LEU 28 0.999 11.075 11.778 202 HG LEU 28 HG LEU 28 -0.210 12.890 13.946 203 HD11 LEU 28 HD11 LEU 28 0.008 9.801 13.799 204 HD12 LEU 28 HD12 LEU 28 -1.474 10.723 13.473 205 HD13 LEU 28 HD13 LEU 28 -0.761 10.745 15.097 206 HD21 LEU 28 HD21 LEU 28 2.326 12.756 14.192 207 HD22 LEU 28 HD22 LEU 28 2.170 10.993 14.401 208 HD23 LEU 28 HD23 LEU 28 1.412 12.109 15.550 209 H ILE 29 H ILE 29 -0.056 14.298 9.728 210 HA ILE 29 HA ILE 29 0.691 12.778 7.298 211 HB ILE 29 HB ILE 29 -0.773 15.466 7.468 212 HG12 ILE 29 HG12 ILE 29 -1.983 12.670 7.022 213 HG13 ILE 29 HG13 ILE 29 -1.928 13.409 8.578 214 HG21 ILE 29 HG21 ILE 29 -0.728 13.512 5.061 215 HG22 ILE 29 HG22 ILE 29 -1.560 15.073 5.149 216 HG23 ILE 29 HG23 ILE 29 0.193 15.039 5.131 217 HD11 ILE 29 HD11 ILE 29 -3.341 15.366 7.822 218 HD12 ILE 29 HD12 ILE 29 -3.495 14.622 6.209 219 HD13 ILE 29 HD13 ILE 29 -4.171 13.812 7.630 220 H GLN 30 H GLN 30 1.574 16.070 8.435 221 HA GLN 30 HA GLN 30 3.617 16.618 6.388 222 HB2 GLN 30 HB2 GLN 30 2.942 17.761 9.134 223 HB3 GLN 30 HB3 GLN 30 4.518 18.106 8.526 224 HG2 GLN 30 HG2 GLN 30 2.672 19.851 8.029 225 HG3 GLN 30 HG3 GLN 30 3.837 19.463 6.792 226 HE21 GLN 30 HE21 GLN 30 0.562 18.345 7.715 227 HE22 GLN 30 HE22 GLN 30 0.042 18.254 5.942 228 H LYS 31 H LYS 31 3.840 14.503 9.128 229 HA LYS 31 HA LYS 31 6.869 14.269 8.990 230 HB2 LYS 31 HB2 LYS 31 4.670 12.816 10.581 231 HB3 LYS 31 HB3 LYS 31 6.314 12.226 10.554 232 HG2 LYS 31 HG2 LYS 31 7.210 14.292 11.558 233 HG3 LYS 31 HG3 LYS 31 5.639 15.102 11.445 234 HD2 LYS 31 HD2 LYS 31 4.581 13.534 12.993 235 HD3 LYS 31 HD3 LYS 31 5.987 12.465 13.003 236 HE2 LYS 31 HE2 LYS 31 7.386 14.164 14.176 237 HE3 LYS 31 HE3 LYS 31 6.080 15.377 14.064 238 HZ1 LYS 31 HZ1 LYS 31 4.634 14.054 15.403 239 HZ2 LYS 31 HZ2 LYS 31 6.062 14.003 16.255 240 HZ3 LYS 31 HZ3 LYS 31 5.633 12.666 15.345 241 H GLY 32 H GLY 32 4.109 12.031 8.249 242 HA2 GLY 32 HA2 GLY 32 5.890 10.101 6.820 243 HA3 GLY 32 HA3 GLY 32 4.154 10.007 6.883 244 H LYS 33 H LYS 33 4.430 12.966 5.518 245 HA LYS 33 HA LYS 33 3.949 11.994 2.825 246 HB2 LYS 33 HB2 LYS 33 3.769 14.287 2.121 247 HB3 LYS 33 HB3 LYS 33 2.943 14.041 3.642 248 HG2 LYS 33 HG2 LYS 33 4.754 15.149 4.918 249 HG3 LYS 33 HG3 LYS 33 5.747 15.327 3.499 250 HD2 LYS 33 HD2 LYS 33 2.962 16.593 3.719 251 HD3 LYS 33 HD3 LYS 33 4.396 17.393 4.306 252 HE2 LYS 33 HE2 LYS 33 4.125 16.458 1.358 253 HE3 LYS 33 HE3 LYS 33 3.588 18.035 1.918 254 HZ1 LYS 33 HZ1 LYS 33 6.034 17.897 1.025 255 HZ2 LYS 33 HZ2 LYS 33 6.471 17.123 2.372 256 HZ3 LYS 33 HZ3 LYS 33 5.884 18.637 2.502 257 H ASP 34 H ASP 34 7.007 13.428 3.986 258 HA ASP 34 HA ASP 34 8.260 12.964 1.231 259 HB2 ASP 34 HB2 ASP 34 9.304 14.623 3.605 260 HB3 ASP 34 HB3 ASP 34 10.003 14.558 2.000 261 H ILE 35 H ILE 35 8.257 11.124 4.020 262 HA ILE 35 HA ILE 35 11.158 10.448 4.188 263 HB ILE 35 HB ILE 35 8.725 9.075 5.440 264 HG12 ILE 35 HG12 ILE 35 10.873 10.820 6.825 265 HG13 ILE 35 HG13 ILE 35 9.363 11.476 6.237 266 HG21 ILE 35 HG21 ILE 35 11.709 8.508 6.074 267 HG22 ILE 35 HG22 ILE 35 10.317 7.839 6.957 268 HG23 ILE 35 HG23 ILE 35 10.585 7.379 5.283 269 HD11 ILE 35 HD11 ILE 35 9.545 9.337 8.459 270 HD12 ILE 35 HD12 ILE 35 9.137 11.056 8.636 271 HD13 ILE 35 HD13 ILE 35 8.034 9.981 7.769 272 H LYS 36 H LYS 36 12.163 9.397 2.587 273 HA LYS 36 HA LYS 36 10.858 7.408 0.782 274 HB2 LYS 36 HB2 LYS 36 13.822 8.191 1.097 275 HB3 LYS 36 HB3 LYS 36 13.219 7.018 -0.049 276 HG2 LYS 36 HG2 LYS 36 11.645 8.882 -0.995 277 HG3 LYS 36 HG3 LYS 36 12.600 10.032 -0.058 278 HD2 LYS 36 HD2 LYS 36 14.722 9.159 -1.237 279 HD3 LYS 36 HD3 LYS 36 13.723 8.001 -2.118 280 HE2 LYS 36 HE2 LYS 36 12.386 10.045 -3.072 281 HE3 LYS 36 HE3 LYS 36 13.612 11.091 -2.365 282 HZ1 LYS 36 HZ1 LYS 36 14.191 8.846 -4.347 283 HZ2 LYS 36 HZ2 LYS 36 15.334 9.825 -3.699 284 HZ3 LYS 36 HZ3 LYS 36 14.202 10.450 -4.719 285 H GLY 37 H GLY 37 10.082 6.144 2.679 286 HA2 GLY 37 HA2 GLY 37 11.955 4.224 4.005 287 HA3 GLY 37 HA3 GLY 37 10.210 4.232 4.155 288 H VAL 38 H VAL 38 11.279 1.926 4.193 289 HA VAL 38 HA VAL 38 11.346 0.603 1.462 290 HB VAL 38 HB VAL 38 11.876 -0.546 4.249 291 HG11 VAL 38 HG11 VAL 38 12.236 -1.939 1.511 292 HG12 VAL 38 HG12 VAL 38 12.824 -2.570 3.073 293 HG13 VAL 38 HG13 VAL 38 11.089 -2.414 2.784 294 HG21 VAL 38 HG21 VAL 38 14.284 -0.669 3.496 295 HG22 VAL 38 HG22 VAL 38 13.859 0.080 1.938 296 HG23 VAL 38 HG23 VAL 38 13.722 1.007 3.446 297 H SER 39 H SER 39 9.756 -0.550 0.593 298 HA SER 39 HA SER 39 7.331 -1.440 2.264 299 HB2 SER 39 HB2 SER 39 7.486 -0.478 -0.632 300 HB3 SER 39 HB3 SER 39 6.088 -1.303 0.031 301 HG SER 39 HG SER 39 5.791 0.923 0.169 302 H GLU 40 H GLU 40 7.997 -3.406 2.684 303 HA GLU 40 HA GLU 40 9.324 -5.234 0.699 304 HB2 GLU 40 HB2 GLU 40 9.818 -5.056 3.250 305 HB3 GLU 40 HB3 GLU 40 8.294 -5.838 3.509 306 HG2 GLU 40 HG2 GLU 40 9.048 -7.938 2.413 307 HG3 GLU 40 HG3 GLU 40 10.572 -7.194 1.941 308 H ILE 41 H ILE 41 8.520 -7.044 -0.231 309 HA ILE 41 HA ILE 41 5.834 -8.127 0.625 310 HB ILE 41 HB ILE 41 6.394 -7.728 -2.372 311 HG12 ILE 41 HG12 ILE 41 4.255 -6.158 -0.821 312 HG13 ILE 41 HG13 ILE 41 5.821 -5.508 -1.264 313 HG21 ILE 41 HG21 ILE 41 3.819 -8.730 -0.946 314 HG22 ILE 41 HG22 ILE 41 4.024 -8.536 -2.703 315 HG23 ILE 41 HG23 ILE 41 4.955 -9.757 -1.857 316 HD11 ILE 41 HD11 ILE 41 4.261 -4.779 -2.977 317 HD12 ILE 41 HD12 ILE 41 5.375 -5.938 -3.724 318 HD13 ILE 41 HD13 ILE 41 3.707 -6.422 -3.310 319 H VAL 42 H VAL 42 6.170 -10.278 0.949 320 HA VAL 42 HA VAL 42 8.244 -11.823 -0.711 321 HB VAL 42 HB VAL 42 6.923 -12.921 1.812 322 HG11 VAL 42 HG11 VAL 42 9.643 -13.583 0.504 323 HG12 VAL 42 HG12 VAL 42 8.918 -14.400 1.907 324 HG13 VAL 42 HG13 VAL 42 8.165 -14.547 0.308 325 HG21 VAL 42 HG21 VAL 42 8.021 -10.848 2.629 326 HG22 VAL 42 HG22 VAL 42 8.901 -12.275 3.186 327 HG23 VAL 42 HG23 VAL 42 9.545 -11.302 1.835 328 H GLN 43 H GLN 43 7.267 -12.680 -2.501 329 HA GLN 43 HA GLN 43 4.360 -13.392 -2.556 330 HB2 GLN 43 HB2 GLN 43 5.544 -12.252 -4.423 331 HB3 GLN 43 HB3 GLN 43 6.551 -13.663 -4.698 332 HG2 GLN 43 HG2 GLN 43 4.522 -15.029 -5.304 333 HG3 GLN 43 HG3 GLN 43 3.472 -13.676 -4.907 334 HE21 GLN 43 HE21 GLN 43 2.772 -14.289 -7.122 335 HE22 GLN 43 HE22 GLN 43 3.602 -13.440 -8.537 336 H ASN 44 H ASN 44 3.833 -15.193 -1.384 337 HA ASN 44 HA ASN 44 5.278 -17.860 -1.979 338 HB2 ASN 44 HB2 ASN 44 3.564 -17.124 0.479 339 HB3 ASN 44 HB3 ASN 44 4.377 -18.634 0.192 340 HD21 ASN 44 HD21 ASN 44 5.015 -15.239 0.867 341 HD22 ASN 44 HD22 ASN 44 6.653 -15.610 1.599 342 H GLY 45 H GLY 45 3.858 -17.503 -4.006 343 HA2 GLY 45 HA2 GLY 45 2.106 -18.478 -5.377 344 HA3 GLY 45 HA3 GLY 45 1.630 -19.486 -4.026 345 H LYS 46 H LYS 46 0.003 -18.728 -2.667 346 HA LYS 46 HA LYS 46 -1.758 -16.431 -3.646 347 HB2 LYS 46 HB2 LYS 46 -2.273 -18.652 -1.570 348 HB3 LYS 46 HB3 LYS 46 -3.372 -17.329 -1.879 349 HG2 LYS 46 HG2 LYS 46 -3.721 -18.065 -4.261 350 HG3 LYS 46 HG3 LYS 46 -2.529 -19.325 -4.051 351 HD2 LYS 46 HD2 LYS 46 -4.248 -20.694 -3.589 352 HD3 LYS 46 HD3 LYS 46 -4.175 -20.087 -1.967 353 HE2 LYS 46 HE2 LYS 46 -6.088 -19.117 -4.225 354 HE3 LYS 46 HE3 LYS 46 -6.507 -20.242 -2.940 355 HZ1 LYS 46 HZ1 LYS 46 -7.260 -18.118 -2.127 356 HZ2 LYS 46 HZ2 LYS 46 -5.943 -17.311 -2.685 357 HZ3 LYS 46 HZ3 LYS 46 -5.824 -18.282 -1.344 358 H HIS 47 H HIS 47 0.360 -17.239 -0.886 359 HA HIS 47 HA HIS 47 -0.767 -14.959 0.795 360 HB2 HIS 47 HB2 HIS 47 1.240 -17.199 1.460 361 HB3 HIS 47 HB3 HIS 47 0.946 -15.846 2.524 362 HD1 HIS 47 HD1 HIS 47 -0.739 -19.106 1.397 363 HD2 HIS 47 HD2 HIS 47 -1.475 -15.604 3.745 364 HE1 HIS 47 HE1 HIS 47 -2.891 -19.403 2.802 365 H PHE 48 H PHE 48 -0.037 -13.044 0.315 366 HA PHE 48 HA PHE 48 2.884 -12.540 -0.488 367 HB2 PHE 48 HB2 PHE 48 0.273 -10.973 -0.799 368 HB3 PHE 48 HB3 PHE 48 1.814 -10.212 -0.979 369 HD1 PHE 48 HD1 PHE 48 0.355 -13.511 -2.366 370 HD2 PHE 48 HD2 PHE 48 2.172 -9.703 -3.198 371 HE1 PHE 48 HE1 PHE 48 0.257 -13.977 -4.767 372 HE2 PHE 48 HE2 PHE 48 2.036 -10.182 -5.593 373 HZ PHE 48 HZ PHE 48 1.107 -12.297 -6.392 374 H LYS 49 H LYS 49 4.040 -12.351 1.359 375 HA LYS 49 HA LYS 49 2.886 -11.078 3.865 376 HB2 LYS 49 HB2 LYS 49 5.651 -12.317 3.432 377 HB3 LYS 49 HB3 LYS 49 5.062 -11.694 4.956 378 HG2 LYS 49 HG2 LYS 49 3.269 -13.362 5.081 379 HG3 LYS 49 HG3 LYS 49 3.583 -13.923 3.454 380 HD2 LYS 49 HD2 LYS 49 6.044 -14.469 4.363 381 HD3 LYS 49 HD3 LYS 49 5.361 -14.271 5.964 382 HE2 LYS 49 HE2 LYS 49 4.422 -16.280 3.789 383 HE3 LYS 49 HE3 LYS 49 5.492 -16.667 5.131 384 HZ1 LYS 49 HZ1 LYS 49 3.203 -17.283 5.839 385 HZ2 LYS 49 HZ2 LYS 49 2.551 -15.845 5.381 386 HZ3 LYS 49 HZ3 LYS 49 3.494 -15.874 6.652 387 H PHE 50 H PHE 50 2.964 -8.990 4.137 388 HA PHE 50 HA PHE 50 5.211 -7.414 2.806 389 HB2 PHE 50 HB2 PHE 50 3.907 -5.528 2.450 390 HB3 PHE 50 HB3 PHE 50 3.135 -6.915 1.774 391 HD1 PHE 50 HD2 PHE 50 2.702 -5.473 5.365 392 HD2 PHE 50 HD1 PHE 50 1.051 -5.959 1.429 393 HE1 PHE 50 HE2 PHE 50 0.658 -4.388 6.088 394 HE2 PHE 50 HE1 PHE 50 -1.007 -4.884 2.168 395 HZ PHE 50 HZ PHE 50 -1.220 -4.081 4.508 396 H THR 51 H THR 51 6.338 -5.871 3.689 397 HA THR 51 HA THR 51 5.819 -5.108 6.640 398 HB THR 51 HB THR 51 8.663 -5.346 5.523 399 HG1 THR 51 HG1 THR 51 8.613 -7.376 5.840 400 HG21 THR 51 HG21 THR 51 8.468 -3.887 7.495 401 HG22 THR 51 HG22 THR 51 9.342 -5.389 7.878 402 HG23 THR 51 HG23 THR 51 7.662 -5.192 8.410 403 H ILE 52 H ILE 52 4.745 -3.220 6.127 404 HA ILE 52 HA ILE 52 5.945 -1.356 4.029 405 HB ILE 52 HB ILE 52 3.126 -1.402 5.176 406 HG12 ILE 52 HG12 ILE 52 3.390 -3.383 3.843 407 HG13 ILE 52 HG13 ILE 52 2.350 -2.278 2.988 408 HG21 ILE 52 HG21 ILE 52 2.477 0.134 3.308 409 HG22 ILE 52 HG22 ILE 52 3.637 0.904 4.388 410 HG23 ILE 52 HG23 ILE 52 4.177 0.280 2.808 411 HD11 ILE 52 HD11 ILE 52 5.322 -2.889 2.328 412 HD12 ILE 52 HD12 ILE 52 3.911 -3.415 1.409 413 HD13 ILE 52 HD13 ILE 52 4.333 -1.689 1.451 414 H THR 53 H THR 53 6.698 0.546 4.452 415 HA THR 53 HA THR 53 6.750 1.640 7.282 416 HB THR 53 HB THR 53 8.387 3.338 6.345 417 HG1 THR 53 HG1 THR 53 8.623 1.506 4.198 418 HG21 THR 53 HG21 THR 53 10.321 1.774 6.273 419 HG22 THR 53 HG22 THR 53 9.227 0.375 6.126 420 HG23 THR 53 HG23 THR 53 9.226 1.362 7.607 421 H ALA 54 H ALA 54 5.075 2.738 7.796 422 HA ALA 54 HA ALA 54 3.800 4.876 5.970 423 HB1 ALA 54 HB1 ALA 54 2.890 3.550 8.625 424 HB2 ALA 54 HB2 ALA 54 1.995 4.815 7.772 425 HB3 ALA 54 HB3 ALA 54 2.236 3.234 6.996 426 H GLY 55 H GLY 55 6.027 5.795 6.275 427 HA2 GLY 55 HA2 GLY 55 7.193 7.794 6.962 428 HA3 GLY 55 HA3 GLY 55 5.949 8.171 8.139 429 H SER 56 H SER 56 6.126 7.310 10.188 430 HA SER 56 HA SER 56 8.820 6.163 11.060 431 HB2 SER 56 HB2 SER 56 6.540 7.185 12.852 432 HB3 SER 56 HB3 SER 56 8.155 6.727 13.366 433 HG SER 56 HG SER 56 7.616 9.086 12.965 434 H LYS 57 H LYS 57 5.402 5.136 10.919 435 HA LYS 57 HA LYS 57 5.876 2.821 12.795 436 HB2 LYS 57 HB2 LYS 57 3.700 4.159 12.782 437 HB3 LYS 57 HB3 LYS 57 3.330 3.487 11.201 438 HG2 LYS 57 HG2 LYS 57 3.518 1.113 12.299 439 HG3 LYS 57 HG3 LYS 57 3.698 1.921 13.853 440 HD2 LYS 57 HD2 LYS 57 1.395 2.993 13.513 441 HD3 LYS 57 HD3 LYS 57 1.269 2.181 11.949 442 HE2 LYS 57 HE2 LYS 57 1.565 -0.099 13.169 443 HE3 LYS 57 HE3 LYS 57 1.530 0.768 14.708 444 HZ1 LYS 57 HZ1 LYS 57 -0.713 0.568 12.656 445 HZ2 LYS 57 HZ2 LYS 57 -0.795 1.650 13.918 446 HZ3 LYS 57 HZ3 LYS 57 -0.762 -0.003 14.108 447 H VAL 58 H VAL 58 6.395 0.840 12.216 448 HA VAL 58 HA VAL 58 6.444 -0.058 9.313 449 HB VAL 58 HB VAL 58 7.509 -1.472 11.823 450 HG11 VAL 58 HG11 VAL 58 7.932 -2.135 8.831 451 HG12 VAL 58 HG12 VAL 58 8.751 -2.949 10.190 452 HG13 VAL 58 HG13 VAL 58 7.000 -3.115 9.984 453 HG21 VAL 58 HG21 VAL 58 8.868 0.605 11.306 454 HG22 VAL 58 HG22 VAL 58 9.801 -0.863 10.982 455 HG23 VAL 58 HG23 VAL 58 9.090 0.056 9.632 456 H ILE 59 H ILE 59 4.540 -0.756 8.585 457 HA ILE 59 HA ILE 59 2.547 -2.224 10.416 458 HB ILE 59 HB ILE 59 2.055 -0.841 7.723 459 HG12 ILE 59 HG12 ILE 59 1.101 0.018 10.535 460 HG13 ILE 59 HG13 ILE 59 2.464 0.743 9.699 461 HG21 ILE 59 HG21 ILE 59 0.005 -2.157 9.647 462 HG22 ILE 59 HG22 ILE 59 -0.393 -1.284 8.153 463 HG23 ILE 59 HG23 ILE 59 0.491 -2.803 8.057 464 HD11 ILE 59 HD11 ILE 59 -0.477 0.918 8.828 465 HD12 ILE 59 HD12 ILE 59 0.606 2.224 9.342 466 HD13 ILE 59 HD13 ILE 59 0.873 1.422 7.774 467 H GLN 60 H GLN 60 3.243 -4.306 10.369 468 HA GLN 60 HA GLN 60 3.692 -5.641 7.677 469 HB2 GLN 60 HB2 GLN 60 5.080 -7.244 8.655 470 HB3 GLN 60 HB3 GLN 60 5.642 -5.644 9.039 471 HG2 GLN 60 HG2 GLN 60 4.146 -7.466 11.019 472 HG3 GLN 60 HG3 GLN 60 5.888 -7.386 10.871 473 HE21 GLN 60 HE21 GLN 60 6.969 -5.493 11.703 474 HE22 GLN 60 HE22 GLN 60 6.036 -4.287 12.741 475 H ASN 61 H ASN 61 2.410 -7.032 6.961 476 HA ASN 61 HA ASN 61 0.529 -8.754 8.453 477 HB2 ASN 61 HB2 ASN 61 -0.750 -6.479 6.775 478 HB3 ASN 61 HB3 ASN 61 -1.595 -7.918 7.274 479 HD21 ASN 61 HD21 ASN 61 -0.251 -4.966 8.516 480 HD22 ASN 61 HD22 ASN 61 -1.194 -5.071 10.079 481 H GLU 62 H GLU 62 -0.733 -10.176 6.844 482 HA GLU 62 HA GLU 62 0.690 -10.320 4.155 483 HB2 GLU 62 HB2 GLU 62 1.044 -12.578 4.167 484 HB3 GLU 62 HB3 GLU 62 1.681 -11.945 5.676 485 HG2 GLU 62 HG2 GLU 62 -0.282 -12.972 6.931 486 HG3 GLU 62 HG3 GLU 62 -0.929 -13.593 5.409 487 H PHE 63 H PHE 63 -0.448 -10.518 2.427 488 HA PHE 63 HA PHE 63 -3.458 -10.843 2.721 489 HB2 PHE 63 HB2 PHE 63 -3.933 -9.647 0.749 490 HB3 PHE 63 HB3 PHE 63 -3.110 -8.725 1.938 491 HD1 PHE 63 HD1 PHE 63 -0.754 -7.859 1.433 492 HD2 PHE 63 HD2 PHE 63 -2.900 -10.216 -1.450 493 HE1 PHE 63 HE1 PHE 63 0.780 -7.099 -0.368 494 HE2 PHE 63 HE2 PHE 63 -1.393 -9.411 -3.222 495 HZ PHE 63 HZ PHE 63 0.446 -7.843 -2.664 496 H THR 64 H THR 64 -4.519 -12.346 1.851 497 HA THR 64 HA THR 64 -3.127 -14.499 0.234 498 HB THR 64 HB THR 64 -5.904 -14.620 1.543 499 HG1 THR 64 HG1 THR 64 -3.889 -15.998 2.749 500 HG21 THR 64 HG21 THR 64 -5.475 -16.438 -0.135 501 HG22 THR 64 HG22 THR 64 -5.496 -17.099 1.517 502 HG23 THR 64 HG23 THR 64 -3.939 -16.861 0.674 503 H VAL 65 H VAL 65 -3.261 -14.229 -1.919 504 HA VAL 65 HA VAL 65 -5.355 -12.650 -3.288 505 HB VAL 65 HB VAL 65 -3.226 -14.519 -4.393 506 HG11 VAL 65 HG11 VAL 65 -5.010 -14.285 -6.161 507 HG12 VAL 65 HG12 VAL 65 -4.820 -12.517 -6.111 508 HG13 VAL 65 HG13 VAL 65 -3.477 -13.548 -6.639 509 HG21 VAL 65 HG21 VAL 65 -3.318 -11.412 -4.301 510 HG22 VAL 65 HG22 VAL 65 -2.275 -12.438 -3.290 511 HG23 VAL 65 HG23 VAL 65 -2.017 -12.368 -5.040 512 H GLY 66 H GLY 66 -7.373 -13.292 -3.617 513 HA2 GLY 66 HA2 GLY 66 -9.149 -14.758 -4.511 514 HA3 GLY 66 HA3 GLY 66 -8.096 -16.146 -4.471 515 H GLU 67 H GLU 67 -7.875 -14.857 -1.390 516 HA GLU 67 HA GLU 67 -10.443 -15.906 -0.333 517 HB2 GLU 67 HB2 GLU 67 -7.764 -17.277 0.443 518 HB3 GLU 67 HB3 GLU 67 -9.121 -17.291 1.536 519 HG2 GLU 67 HG2 GLU 67 -9.353 -18.464 -1.308 520 HG3 GLU 67 HG3 GLU 67 -8.917 -19.396 0.122 521 H GLU 68 H GLU 68 -10.848 -15.293 1.876 522 HA GLU 68 HA GLU 68 -10.355 -12.546 2.270 523 HB2 GLU 68 HB2 GLU 68 -11.437 -12.635 4.397 524 HB3 GLU 68 HB3 GLU 68 -12.307 -13.546 3.200 525 HG2 GLU 68 HG2 GLU 68 -12.048 -15.590 4.310 526 HG3 GLU 68 HG3 GLU 68 -10.412 -15.240 4.826 527 H CYS 69 H CYS 69 -8.966 -11.240 3.165 528 HA CYS 69 HA CYS 69 -6.964 -12.206 5.249 529 HB2 CYS 69 HB2 CYS 69 -5.118 -10.931 3.986 530 HB3 CYS 69 HB3 CYS 69 -5.646 -12.512 3.400 531 HG CYS 69 HG CYS 69 -6.949 -11.739 1.354 532 H GLU 70 H GLU 70 -6.672 -10.937 6.785 533 HA GLU 70 HA GLU 70 -8.040 -8.254 6.962 534 HB2 GLU 70 HB2 GLU 70 -7.771 -8.345 9.365 535 HB3 GLU 70 HB3 GLU 70 -8.746 -9.610 8.681 536 HG2 GLU 70 HG2 GLU 70 -6.923 -11.300 8.963 537 HG3 GLU 70 HG3 GLU 70 -5.829 -10.020 9.462 538 H LEU 71 H LEU 71 -6.997 -6.498 6.461 539 HA LEU 71 HA LEU 71 -4.027 -6.144 7.230 540 HB2 LEU 71 HB2 LEU 71 -5.536 -4.817 4.902 541 HB3 LEU 71 HB3 LEU 71 -3.843 -4.599 5.295 542 HG LEU 71 HG LEU 71 -5.149 -7.178 4.230 543 HD11 LEU 71 HD11 LEU 71 -4.868 -5.282 2.581 544 HD12 LEU 71 HD12 LEU 71 -3.836 -6.652 2.161 545 HD13 LEU 71 HD13 LEU 71 -3.137 -5.214 2.937 546 HD21 LEU 71 HD21 LEU 71 -2.800 -8.101 4.029 547 HD22 LEU 71 HD22 LEU 71 -3.257 -7.844 5.707 548 HD23 LEU 71 HD23 LEU 71 -2.162 -6.691 4.896 549 H GLU 72 H GLU 72 -3.425 -4.319 8.326 550 HA GLU 72 HA GLU 72 -5.471 -2.651 9.706 551 HB2 GLU 72 HB2 GLU 72 -3.153 -3.322 10.608 552 HB3 GLU 72 HB3 GLU 72 -2.423 -2.214 9.452 553 HG2 GLU 72 HG2 GLU 72 -3.822 -0.300 10.603 554 HG3 GLU 72 HG3 GLU 72 -4.292 -1.482 11.819 555 H THR 73 H THR 73 -6.093 -0.687 9.412 556 HA THR 73 HA THR 73 -5.490 0.805 6.804 557 HB THR 73 HB THR 73 -7.695 -0.019 6.655 558 HG1 THR 73 HG1 THR 73 -8.626 2.364 7.501 559 HG21 THR 73 HG21 THR 73 -9.580 0.516 8.283 560 HG22 THR 73 HG22 THR 73 -8.362 1.182 9.409 561 HG23 THR 73 HG23 THR 73 -8.366 -0.554 8.991 562 H MET 74 H MET 74 -5.939 3.052 6.932 563 HA MET 74 HA MET 74 -4.465 4.419 9.241 564 HB2 MET 74 HB2 MET 74 -5.453 5.511 6.539 565 HB3 MET 74 HB3 MET 74 -4.946 6.577 7.832 566 HG2 MET 74 HG2 MET 74 -3.114 4.461 6.552 567 HG3 MET 74 HG3 MET 74 -3.097 6.198 6.232 568 HE1 MET 74 HE1 MET 74 -0.993 3.803 7.719 569 HE2 MET 74 HE2 MET 74 -0.803 4.128 9.470 570 HE3 MET 74 HE3 MET 74 -2.299 3.357 8.857 571 H THR 75 H THR 75 -7.643 4.940 7.636 572 HA THR 75 HA THR 75 -8.808 5.757 10.354 573 HB THR 75 HB THR 75 -10.144 5.989 7.615 574 HG1 THR 75 HG1 THR 75 -9.807 8.308 8.206 575 HG21 THR 75 HG21 THR 75 -10.948 7.251 10.326 576 HG22 THR 75 HG22 THR 75 -11.809 5.902 9.540 577 HG23 THR 75 HG23 THR 75 -11.773 7.496 8.769 578 H GLY 76 H GLY 76 -9.728 4.180 11.405 579 HA2 GLY 76 HA2 GLY 76 -11.720 2.478 11.249 580 HA3 GLY 76 HA3 GLY 76 -10.844 1.648 10.004 581 H GLU 77 H GLU 77 -9.403 0.018 10.643 582 HA GLU 77 HA GLU 77 -8.620 -0.553 13.358 583 HB2 GLU 77 HB2 GLU 77 -10.160 -2.183 14.151 584 HB3 GLU 77 HB3 GLU 77 -10.926 -0.637 13.960 585 HG2 GLU 77 HG2 GLU 77 -11.487 -3.200 12.361 586 HG3 GLU 77 HG3 GLU 77 -12.516 -2.249 13.395 587 H LYS 78 H LYS 78 -10.090 -2.716 11.051 588 HA LYS 78 HA LYS 78 -7.604 -3.560 9.754 589 HB2 LYS 78 HB2 LYS 78 -7.805 -4.776 12.259 590 HB3 LYS 78 HB3 LYS 78 -8.739 -5.937 11.344 591 HG2 LYS 78 HG2 LYS 78 -6.736 -6.108 9.703 592 HG3 LYS 78 HG3 LYS 78 -5.898 -4.928 10.720 593 HD2 LYS 78 HD2 LYS 78 -6.073 -6.550 12.701 594 HD3 LYS 78 HD3 LYS 78 -6.916 -7.696 11.658 595 HE2 LYS 78 HE2 LYS 78 -4.811 -7.689 10.103 596 HE3 LYS 78 HE3 LYS 78 -3.977 -6.715 11.310 597 HZ1 LYS 78 HZ1 LYS 78 -4.371 -8.554 12.962 598 HZ2 LYS 78 HZ2 LYS 78 -3.686 -9.233 11.613 599 HZ3 LYS 78 HZ3 LYS 78 -5.320 -9.388 11.902 600 H VAL 79 H VAL 79 -8.231 -3.946 7.778 601 HA VAL 79 HA VAL 79 -11.167 -4.568 7.246 602 HB VAL 79 HB VAL 79 -10.231 -2.411 6.482 603 HG11 VAL 79 HG11 VAL 79 -8.870 -2.175 4.434 604 HG12 VAL 79 HG12 VAL 79 -7.931 -2.969 5.703 605 HG13 VAL 79 HG13 VAL 79 -8.593 -3.929 4.365 606 HG21 VAL 79 HG21 VAL 79 -11.224 -4.139 4.142 607 HG22 VAL 79 HG22 VAL 79 -12.262 -3.415 5.400 608 HG23 VAL 79 HG23 VAL 79 -11.340 -2.371 4.307 609 H LYS 80 H LYS 80 -11.792 -6.426 6.361 610 HA LYS 80 HA LYS 80 -9.758 -8.430 5.354 611 HB2 LYS 80 HB2 LYS 80 -12.734 -8.753 5.945 612 HB3 LYS 80 HB3 LYS 80 -11.807 -9.940 5.045 613 HG2 LYS 80 HG2 LYS 80 -10.082 -10.014 6.935 614 HG3 LYS 80 HG3 LYS 80 -11.144 -8.998 7.913 615 HD2 LYS 80 HD2 LYS 80 -12.936 -10.815 7.769 616 HD3 LYS 80 HD3 LYS 80 -11.881 -11.749 6.712 617 HE2 LYS 80 HE2 LYS 80 -10.091 -11.762 8.638 618 HE3 LYS 80 HE3 LYS 80 -11.301 -11.033 9.689 619 HZ1 LYS 80 HZ1 LYS 80 -11.455 -13.509 9.856 620 HZ2 LYS 80 HZ2 LYS 80 -11.523 -13.691 8.211 621 HZ3 LYS 80 HZ3 LYS 80 -12.800 -13.049 8.980 622 H THR 81 H THR 81 -8.971 -7.535 3.633 623 HA THR 81 HA THR 81 -10.743 -6.815 1.225 624 HB THR 81 HB THR 81 -9.607 -4.920 2.278 625 HG1 THR 81 HG1 THR 81 -8.598 -5.590 -0.287 626 HG21 THR 81 HG21 THR 81 -7.210 -4.550 2.318 627 HG22 THR 81 HG22 THR 81 -6.857 -6.024 1.403 628 HG23 THR 81 HG23 THR 81 -7.425 -6.114 3.087 629 H VAL 82 H VAL 82 -10.753 -8.529 -0.122 630 HA VAL 82 HA VAL 82 -8.312 -10.300 -0.360 631 HB VAL 82 HB VAL 82 -10.460 -11.475 -0.147 632 HG11 VAL 82 HG11 VAL 82 -11.791 -12.017 -2.200 633 HG12 VAL 82 HG12 VAL 82 -11.999 -10.305 -1.744 634 HG13 VAL 82 HG13 VAL 82 -10.939 -10.751 -3.113 635 HG21 VAL 82 HG21 VAL 82 -8.891 -12.152 -2.721 636 HG22 VAL 82 HG22 VAL 82 -8.362 -12.536 -1.072 637 HG23 VAL 82 HG23 VAL 82 -9.857 -13.249 -1.706 638 H VAL 83 H VAL 83 -7.009 -10.412 -2.048 639 HA VAL 83 HA VAL 83 -7.182 -8.133 -4.071 640 HB VAL 83 HB VAL 83 -4.634 -9.625 -3.261 641 HG11 VAL 83 HG11 VAL 83 -3.507 -7.560 -4.068 642 HG12 VAL 83 HG12 VAL 83 -4.517 -8.233 -5.365 643 HG13 VAL 83 HG13 VAL 83 -5.066 -6.802 -4.468 644 HG21 VAL 83 HG21 VAL 83 -4.059 -7.634 -1.751 645 HG22 VAL 83 HG22 VAL 83 -5.737 -7.093 -1.854 646 HG23 VAL 83 HG23 VAL 83 -5.360 -8.648 -1.114 647 H GLN 84 H GLN 84 -7.330 -8.514 -6.177 648 HA GLN 84 HA GLN 84 -7.021 -11.388 -7.245 649 HB2 GLN 84 HB2 GLN 84 -8.706 -9.022 -8.201 650 HB3 GLN 84 HB3 GLN 84 -8.267 -10.284 -9.310 651 HG2 GLN 84 HG2 GLN 84 -10.493 -10.724 -8.463 652 HG3 GLN 84 HG3 GLN 84 -9.415 -12.031 -8.054 653 HE21 GLN 84 HE21 GLN 84 -9.285 -12.574 -5.881 654 HE22 GLN 84 HE22 GLN 84 -10.224 -11.658 -4.587 655 H LEU 85 H LEU 85 -5.674 -11.821 -8.911 656 HA LEU 85 HA LEU 85 -3.566 -9.713 -9.568 657 HB2 LEU 85 HB2 LEU 85 -2.814 -11.477 -8.014 658 HB3 LEU 85 HB3 LEU 85 -3.340 -12.736 -9.116 659 HG LEU 85 HG LEU 85 -1.659 -12.068 -10.785 660 HD11 LEU 85 HD11 LEU 85 -0.627 -10.018 -8.701 661 HD12 LEU 85 HD12 LEU 85 -1.357 -9.615 -10.274 662 HD13 LEU 85 HD13 LEU 85 0.187 -10.451 -10.203 663 HD21 LEU 85 HD21 LEU 85 0.372 -12.866 -9.482 664 HD22 LEU 85 HD22 LEU 85 -1.078 -13.821 -9.119 665 HD23 LEU 85 HD23 LEU 85 -0.515 -12.593 -7.963 666 H GLU 86 H GLU 86 -3.449 -9.141 -11.618 667 HA GLU 86 HA GLU 86 -4.184 -11.112 -13.866 668 HB2 GLU 86 HB2 GLU 86 -5.501 -8.918 -13.721 669 HB3 GLU 86 HB3 GLU 86 -3.995 -8.086 -14.062 670 HG2 GLU 86 HG2 GLU 86 -3.842 -9.388 -16.301 671 HG3 GLU 86 HG3 GLU 86 -5.466 -9.998 -15.971 672 H GLY 87 H GLY 87 -2.659 -11.743 -15.105 673 HA2 GLY 87 HA2 GLY 87 -0.467 -12.260 -16.061 674 HA3 GLY 87 HA3 GLY 87 -0.383 -10.520 -16.188 675 H ASP 88 H ASP 88 -0.241 -11.791 -13.106 676 HA ASP 88 HA ASP 88 1.390 -11.798 -11.404 677 HB2 ASP 88 HB2 ASP 88 2.469 -13.594 -12.856 678 HB3 ASP 88 HB3 ASP 88 3.592 -12.369 -13.425 679 H ASN 89 H ASN 89 0.732 -9.304 -12.896 680 HA ASN 89 HA ASN 89 2.677 -7.584 -11.319 681 HB2 ASN 89 HB2 ASN 89 3.396 -6.258 -12.990 682 HB3 ASN 89 HB3 ASN 89 3.442 -7.811 -13.751 683 HD21 ASN 89 HD21 ASN 89 3.149 -4.914 -14.660 684 HD22 ASN 89 HD22 ASN 89 1.797 -5.055 -15.912 685 H LYS 90 H LYS 90 -0.639 -7.668 -12.554 686 HA LYS 90 HA LYS 90 -1.171 -4.961 -11.195 687 HB2 LYS 90 HB2 LYS 90 -2.880 -6.672 -13.051 688 HB3 LYS 90 HB3 LYS 90 -3.408 -5.145 -12.390 689 HG2 LYS 90 HG2 LYS 90 -1.797 -3.865 -13.706 690 HG3 LYS 90 HG3 LYS 90 -0.896 -5.314 -14.165 691 HD2 LYS 90 HD2 LYS 90 -2.958 -6.219 -15.337 692 HD3 LYS 90 HD3 LYS 90 -3.832 -4.747 -15.005 693 HE2 LYS 90 HE2 LYS 90 -1.209 -4.950 -16.665 694 HE3 LYS 90 HE3 LYS 90 -2.835 -5.024 -17.345 695 HZ1 LYS 90 HZ1 LYS 90 -2.025 -2.683 -17.456 696 HZ2 LYS 90 HZ2 LYS 90 -1.669 -2.607 -15.850 697 HZ3 LYS 90 HZ3 LYS 90 -3.238 -2.723 -16.337 698 H LEU 91 H LEU 91 -1.612 -5.216 -9.076 699 HA LEU 91 HA LEU 91 -3.466 -7.467 -8.097 700 HB2 LEU 91 HB2 LEU 91 -1.488 -5.609 -6.712 701 HB3 LEU 91 HB3 LEU 91 -2.636 -6.499 -5.786 702 HG LEU 91 HG LEU 91 -0.568 -7.826 -7.633 703 HD11 LEU 91 HD11 LEU 91 0.503 -6.558 -5.746 704 HD12 LEU 91 HD12 LEU 91 0.663 -8.301 -5.472 705 HD13 LEU 91 HD13 LEU 91 -0.563 -7.359 -4.579 706 HD21 LEU 91 HD21 LEU 91 -2.571 -9.323 -7.134 707 HD22 LEU 91 HD22 LEU 91 -2.299 -9.103 -5.393 708 HD23 LEU 91 HD23 LEU 91 -1.085 -9.929 -6.379 709 H VAL 92 H VAL 92 -5.566 -6.899 -8.011 710 HA VAL 92 HA VAL 92 -6.336 -4.024 -7.241 711 HB VAL 92 HB VAL 92 -8.382 -4.254 -8.483 712 HG11 VAL 92 HG11 VAL 92 -6.016 -4.946 -10.327 713 HG12 VAL 92 HG12 VAL 92 -7.490 -4.049 -10.764 714 HG13 VAL 92 HG13 VAL 92 -6.316 -3.345 -9.631 715 HG21 VAL 92 HG21 VAL 92 -8.842 -6.082 -10.132 716 HG22 VAL 92 HG22 VAL 92 -7.457 -7.012 -9.515 717 HG23 VAL 92 HG23 VAL 92 -8.865 -6.699 -8.472 718 H THR 93 H THR 93 -7.366 -3.653 -5.373 719 HA THR 93 HA THR 93 -9.284 -5.763 -4.304 720 HB THR 93 HB THR 93 -7.015 -6.085 -3.270 721 HG1 THR 93 HG1 THR 93 -8.773 -6.956 -2.325 722 HG21 THR 93 HG21 THR 93 -6.216 -3.803 -2.712 723 HG22 THR 93 HG22 THR 93 -6.404 -4.753 -1.229 724 HG23 THR 93 HG23 THR 93 -7.621 -3.532 -1.637 725 H THR 94 H THR 94 -10.390 -4.996 -2.306 726 HA THR 94 HA THR 94 -11.613 -2.205 -2.754 727 HB THR 94 HB THR 94 -13.202 -4.724 -1.979 728 HG1 THR 94 HG1 THR 94 -14.179 -4.435 -3.955 729 HG21 THR 94 HG21 THR 94 -14.200 -2.610 -1.016 730 HG22 THR 94 HG22 THR 94 -15.231 -3.275 -2.294 731 HG23 THR 94 HG23 THR 94 -14.201 -1.861 -2.631 732 H PHE 95 H PHE 95 -10.639 -1.174 -1.098 733 HA PHE 95 HA PHE 95 -10.078 -2.557 1.546 734 HB2 PHE 95 HB2 PHE 95 -8.507 -1.026 -0.084 735 HB3 PHE 95 HB3 PHE 95 -9.333 0.274 0.696 736 HD1 PHE 95 HD2 PHE 95 -7.148 -2.663 1.208 737 HD2 PHE 95 HD1 PHE 95 -8.473 1.061 2.888 738 HE1 PHE 95 HE2 PHE 95 -5.441 -2.846 2.972 739 HE2 PHE 95 HE1 PHE 95 -6.738 0.897 4.607 740 HZ PHE 95 HZ PHE 95 -5.242 -1.078 4.695 741 H LYS 96 H LYS 96 -10.318 0.402 2.733 742 HA LYS 96 HA LYS 96 -13.170 0.101 3.765 743 HB2 LYS 96 HB2 LYS 96 -11.052 2.242 4.389 744 HB3 LYS 96 HB3 LYS 96 -12.605 2.142 5.162 745 HG2 LYS 96 HG2 LYS 96 -10.455 -0.061 5.360 746 HG3 LYS 96 HG3 LYS 96 -10.559 1.292 6.448 747 HD2 LYS 96 HD2 LYS 96 -12.810 -0.807 6.120 748 HD3 LYS 96 HD3 LYS 96 -11.514 -0.885 7.303 749 HE2 LYS 96 HE2 LYS 96 -12.293 1.431 8.217 750 HE3 LYS 96 HE3 LYS 96 -13.737 1.252 7.220 751 HZ1 LYS 96 HZ1 LYS 96 -12.822 -0.801 9.318 752 HZ2 LYS 96 HZ2 LYS 96 -14.193 -0.932 8.425 753 HZ3 LYS 96 HZ3 LYS 96 -13.992 0.234 9.578 754 H ASN 97 H ASN 97 -14.305 0.462 1.736 755 HA ASN 97 HA ASN 97 -15.054 1.513 -0.204 756 HB2 ASN 97 HB2 ASN 97 -15.126 3.919 1.697 757 HB3 ASN 97 HB3 ASN 97 -15.970 3.778 0.178 758 HD21 ASN 97 HD21 ASN 97 -17.903 2.569 0.084 759 HD22 ASN 97 HD22 ASN 97 -18.634 1.891 1.633 760 H ILE 98 H ILE 98 -12.257 1.353 -0.219 761 HA ILE 98 HA ILE 98 -11.518 3.589 -2.216 762 HB ILE 98 HB ILE 98 -9.684 2.160 -0.212 763 HG12 ILE 98 HG12 ILE 98 -9.974 5.178 0.014 764 HG13 ILE 98 HG13 ILE 98 -11.316 4.242 0.598 765 HG21 ILE 98 HG21 ILE 98 -8.388 2.760 -2.255 766 HG22 ILE 98 HG22 ILE 98 -8.930 4.450 -2.139 767 HG23 ILE 98 HG23 ILE 98 -7.873 3.748 -0.888 768 HD11 ILE 98 HD11 ILE 98 -9.942 2.980 2.192 769 HD12 ILE 98 HD12 ILE 98 -8.440 3.703 1.575 770 HD13 ILE 98 HD13 ILE 98 -9.645 4.716 2.412 771 H LYS 99 H LYS 99 -10.810 2.819 -4.166 772 HA LYS 99 HA LYS 99 -10.529 -0.210 -4.553 773 HB2 LYS 99 HB2 LYS 99 -12.155 1.053 -5.999 774 HB3 LYS 99 HB3 LYS 99 -10.857 1.959 -6.682 775 HG2 LYS 99 HG2 LYS 99 -10.453 0.342 -8.216 776 HG3 LYS 99 HG3 LYS 99 -10.000 -0.808 -6.996 777 HD2 LYS 99 HD2 LYS 99 -12.834 -0.296 -8.099 778 HD3 LYS 99 HD3 LYS 99 -11.819 -1.652 -8.510 779 HE2 LYS 99 HE2 LYS 99 -13.023 -1.124 -5.691 780 HE3 LYS 99 HE3 LYS 99 -13.718 -2.189 -6.899 781 HZ1 LYS 99 HZ1 LYS 99 -11.638 -3.586 -6.790 782 HZ2 LYS 99 HZ2 LYS 99 -12.330 -3.452 -5.287 783 HZ3 LYS 99 HZ3 LYS 99 -10.991 -2.595 -5.643 784 H SER 100 H SER 100 -8.545 -0.769 -3.975 785 HA SER 100 HA SER 100 -6.122 0.988 -4.496 786 HB2 SER 100 HB2 SER 100 -6.509 0.036 -2.224 787 HB3 SER 100 HB3 SER 100 -6.370 -1.596 -2.862 788 HG SER 100 HG SER 100 -4.225 -1.108 -3.498 789 H VAL 101 H VAL 101 -5.100 0.770 -6.327 790 HA VAL 101 HA VAL 101 -4.918 -1.949 -7.771 791 HB VAL 101 HB VAL 101 -4.859 0.916 -8.895 792 HG11 VAL 101 HG11 VAL 101 -3.402 -0.540 -10.295 793 HG12 VAL 101 HG12 VAL 101 -4.693 -1.752 -10.450 794 HG13 VAL 101 HG13 VAL 101 -4.876 -0.132 -11.178 795 HG21 VAL 101 HG21 VAL 101 -7.008 0.336 -10.061 796 HG22 VAL 101 HG22 VAL 101 -7.057 -1.237 -9.227 797 HG23 VAL 101 HG23 VAL 101 -7.197 0.272 -8.303 798 H THR 102 H THR 102 -2.963 -2.822 -7.237 799 HA THR 102 HA THR 102 -0.512 -1.011 -7.088 800 HB THR 102 HB THR 102 -0.436 -3.906 -6.203 801 HG1 THR 102 HG1 THR 102 -0.911 -1.771 -4.402 802 HG21 THR 102 HG21 THR 102 1.197 -1.468 -5.263 803 HG22 THR 102 HG22 THR 102 1.736 -2.650 -6.477 804 HG23 THR 102 HG23 THR 102 1.442 -3.174 -4.815 805 H GLU 103 H GLU 103 0.715 -0.890 -8.979 806 HA GLU 103 HA GLU 103 0.624 -3.317 -10.854 807 HB2 GLU 103 HB2 GLU 103 -0.506 -1.179 -11.745 808 HB3 GLU 103 HB3 GLU 103 1.108 -0.496 -11.850 809 HG2 GLU 103 HG2 GLU 103 1.859 -2.328 -13.403 810 HG3 GLU 103 HG3 GLU 103 0.323 -3.151 -13.235 811 H LEU 104 H LEU 104 2.435 -4.219 -11.325 812 HA LEU 104 HA LEU 104 5.113 -2.972 -10.534 813 HB2 LEU 104 HB2 LEU 104 4.093 -5.497 -9.959 814 HB3 LEU 104 HB3 LEU 104 5.013 -5.872 -11.388 815 HG LEU 104 HG LEU 104 6.034 -4.554 -8.793 816 HD11 LEU 104 HD11 LEU 104 5.492 -7.037 -8.713 817 HD12 LEU 104 HD12 LEU 104 7.211 -6.709 -8.469 818 HD13 LEU 104 HD13 LEU 104 6.638 -7.326 -10.033 819 HD21 LEU 104 HD21 LEU 104 7.676 -5.298 -11.309 820 HD22 LEU 104 HD22 LEU 104 8.375 -4.834 -9.737 821 HD23 LEU 104 HD23 LEU 104 7.439 -3.662 -10.667 822 H ASN 105 H ASN 105 6.197 -1.970 -12.096 823 HA ASN 105 HA ASN 105 5.877 -2.849 -15.056 824 HB2 ASN 105 HB2 ASN 105 6.388 -0.067 -13.832 825 HB3 ASN 105 HB3 ASN 105 6.733 -0.445 -15.500 826 HD21 ASN 105 HD21 ASN 105 4.032 -0.335 -13.212 827 HD22 ASN 105 HD22 ASN 105 2.769 -0.200 -14.543 828 H GLY 106 H GLY 106 7.358 -4.530 -14.642 829 HA2 GLY 106 HA2 GLY 106 9.579 -5.432 -15.168 830 HA3 GLY 106 HA3 GLY 106 10.250 -3.813 -15.226 831 H ASP 107 H ASP 107 11.087 -2.965 -13.346 832 HA ASP 107 HA ASP 107 10.858 -4.527 -10.710 833 HB2 ASP 107 HB2 ASP 107 13.477 -3.507 -11.969 834 HB3 ASP 107 HB3 ASP 107 13.331 -3.924 -10.278 835 H ILE 108 H ILE 108 9.473 -2.085 -11.695 836 HA ILE 108 HA ILE 108 9.904 -0.490 -9.142 837 HB ILE 108 HB ILE 108 9.390 1.551 -10.010 838 HG12 ILE 108 HG12 ILE 108 9.554 1.706 -12.735 839 HG13 ILE 108 HG13 ILE 108 8.689 0.200 -12.626 840 HG21 ILE 108 HG21 ILE 108 11.647 0.391 -11.721 841 HG22 ILE 108 HG22 ILE 108 11.400 2.111 -11.319 842 HG23 ILE 108 HG23 ILE 108 11.761 0.947 -10.036 843 HD11 ILE 108 HD11 ILE 108 6.911 1.369 -11.170 844 HD12 ILE 108 HD12 ILE 108 7.835 2.881 -11.309 845 HD13 ILE 108 HD13 ILE 108 7.099 2.144 -12.759 846 H ILE 109 H ILE 109 8.117 -0.228 -7.915 847 HA ILE 109 HA ILE 109 5.517 -1.411 -8.994 848 HB ILE 109 HB ILE 109 6.700 -2.774 -7.221 849 HG12 ILE 109 HG12 ILE 109 3.921 -1.838 -6.329 850 HG13 ILE 109 HG13 ILE 109 4.178 -2.852 -7.741 851 HG21 ILE 109 HG21 ILE 109 7.525 -0.903 -5.711 852 HG22 ILE 109 HG22 ILE 109 5.856 -0.575 -5.206 853 HG23 ILE 109 HG23 ILE 109 6.625 -2.127 -4.814 854 HD11 ILE 109 HD11 ILE 109 3.593 -4.249 -5.753 855 HD12 ILE 109 HD12 ILE 109 5.230 -4.658 -6.330 856 HD13 ILE 109 HD13 ILE 109 5.007 -3.656 -4.876 857 H THR 110 H THR 110 3.739 -0.234 -8.980 858 HA THR 110 HA THR 110 3.745 2.365 -7.373 859 HB THR 110 HB THR 110 3.766 2.555 -9.932 860 HG1 THR 110 HG1 THR 110 2.904 4.073 -8.069 861 HG21 THR 110 HG21 THR 110 1.683 2.648 -11.162 862 HG22 THR 110 HG22 THR 110 0.749 2.103 -9.746 863 HG23 THR 110 HG23 THR 110 1.915 1.000 -10.516 864 H ASN 111 H ASN 111 2.191 2.714 -5.943 865 HA ASN 111 HA ASN 111 -0.111 0.673 -5.736 866 HB2 ASN 111 HB2 ASN 111 1.577 0.576 -3.815 867 HB3 ASN 111 HB3 ASN 111 1.055 2.180 -3.333 868 HD21 ASN 111 HD21 ASN 111 -0.811 2.226 -2.044 869 HD22 ASN 111 HD22 ASN 111 -1.898 0.757 -1.821 870 H THR 112 H THR 112 -1.789 1.613 -6.691 871 HA THR 112 HA THR 112 -2.266 4.627 -6.372 872 HB THR 112 HB THR 112 -3.407 2.752 -8.496 873 HG1 THR 112 HG1 THR 112 -1.085 2.997 -8.454 874 HG21 THR 112 HG21 THR 112 -3.765 4.857 -9.789 875 HG22 THR 112 HG22 THR 112 -3.094 5.829 -8.459 876 HG23 THR 112 HG23 THR 112 -4.636 4.961 -8.242 877 H MET 113 H MET 113 -3.420 4.817 -4.557 878 HA MET 113 HA MET 113 -5.878 3.081 -3.994 879 HB2 MET 113 HB2 MET 113 -4.342 5.090 -2.296 880 HB3 MET 113 HB3 MET 113 -5.954 4.582 -1.860 881 HG2 MET 113 HG2 MET 113 -5.156 2.122 -1.970 882 HG3 MET 113 HG3 MET 113 -3.503 2.746 -2.087 883 HE1 MET 113 HE1 MET 113 -5.390 0.971 0.127 884 HE2 MET 113 HE2 MET 113 -3.607 0.995 0.298 885 HE3 MET 113 HE3 MET 113 -4.654 1.440 1.678 886 H THR 114 H THR 114 -7.423 3.634 -5.276 887 HA THR 114 HA THR 114 -8.068 6.526 -5.928 888 HB THR 114 HB THR 114 -9.594 5.700 -7.637 889 HG1 THR 114 HG1 THR 114 -8.739 3.132 -6.744 890 HG21 THR 114 HG21 THR 114 -7.188 6.021 -8.291 891 HG22 THR 114 HG22 THR 114 -7.982 4.731 -9.223 892 HG23 THR 114 HG23 THR 114 -6.860 4.310 -7.910 893 H LEU 115 H LEU 115 -9.291 7.575 -4.588 894 HA LEU 115 HA LEU 115 -11.778 6.271 -3.285 895 HB2 LEU 115 HB2 LEU 115 -10.039 6.794 -1.646 896 HB3 LEU 115 HB3 LEU 115 -9.847 8.420 -2.257 897 HG LEU 115 HG LEU 115 -12.140 9.044 -1.458 898 HD11 LEU 115 HD11 LEU 115 -12.233 6.217 -0.195 899 HD12 LEU 115 HD12 LEU 115 -13.299 6.811 -1.485 900 HD13 LEU 115 HD13 LEU 115 -13.376 7.538 0.127 901 HD21 LEU 115 HD21 LEU 115 -10.118 9.432 -0.034 902 HD22 LEU 115 HD22 LEU 115 -10.293 7.818 0.693 903 HD23 LEU 115 HD23 LEU 115 -11.533 9.067 0.971 904 H GLY 116 H GLY 116 -12.683 6.719 -5.420 905 HA2 GLY 116 HA2 GLY 116 -14.331 7.942 -6.715 906 HA3 GLY 116 HA3 GLY 116 -14.394 9.166 -5.469 907 H ASP 117 H ASP 117 -12.973 10.874 -5.612 908 HA ASP 117 HA ASP 117 -11.809 11.538 -8.376 909 HB2 ASP 117 HB2 ASP 117 -12.585 13.403 -6.034 910 HB3 ASP 117 HB3 ASP 117 -11.798 13.930 -7.510 911 H ILE 118 H ILE 118 -10.846 10.933 -5.068 912 HA ILE 118 HA ILE 118 -8.163 12.295 -5.270 913 HB ILE 118 HB ILE 118 -9.205 10.385 -3.128 914 HG12 ILE 118 HG12 ILE 118 -10.728 12.309 -3.119 915 HG13 ILE 118 HG13 ILE 118 -9.845 12.083 -1.636 916 HG21 ILE 118 HG21 ILE 118 -6.827 12.379 -3.012 917 HG22 ILE 118 HG22 ILE 118 -7.423 11.395 -1.663 918 HG23 ILE 118 HG23 ILE 118 -6.695 10.609 -3.066 919 HD11 ILE 118 HD11 ILE 118 -9.115 14.246 -3.723 920 HD12 ILE 118 HD12 ILE 118 -10.069 14.506 -2.236 921 HD13 ILE 118 HD13 ILE 118 -8.369 14.027 -2.112 922 H VAL 119 H VAL 119 -6.549 11.310 -6.349 923 HA VAL 119 HA VAL 119 -6.338 8.236 -6.460 924 HB VAL 119 HB VAL 119 -5.225 10.345 -8.393 925 HG11 VAL 119 HG11 VAL 119 -3.797 8.292 -8.401 926 HG12 VAL 119 HG12 VAL 119 -5.232 7.266 -8.651 927 HG13 VAL 119 HG13 VAL 119 -4.710 8.411 -9.909 928 HG21 VAL 119 HG21 VAL 119 -7.613 8.401 -8.799 929 HG22 VAL 119 HG22 VAL 119 -7.727 10.165 -8.653 930 HG23 VAL 119 HG23 VAL 119 -6.912 9.457 -10.053 931 H PHE 120 H PHE 120 -5.261 7.915 -4.476 932 HA PHE 120 HA PHE 120 -2.694 9.405 -3.855 933 HB2 PHE 120 HB2 PHE 120 -4.042 9.014 -1.977 934 HB3 PHE 120 HB3 PHE 120 -4.312 7.335 -2.346 935 HD1 PHE 120 HD2 PHE 120 -1.053 9.337 -2.104 936 HD2 PHE 120 HD1 PHE 120 -3.403 6.093 -0.528 937 HE1 PHE 120 HE2 PHE 120 0.863 8.568 -0.807 938 HE2 PHE 120 HE1 PHE 120 -1.462 5.332 0.766 939 HZ PHE 120 HZ PHE 120 0.687 6.565 0.627 940 H LYS 121 H LYS 121 -1.237 8.950 -5.360 941 HA LYS 121 HA LYS 121 -0.555 6.044 -5.994 942 HB2 LYS 121 HB2 LYS 121 -1.310 7.666 -7.776 943 HB3 LYS 121 HB3 LYS 121 0.180 8.557 -7.558 944 HG2 LYS 121 HG2 LYS 121 1.519 6.482 -8.168 945 HG3 LYS 121 HG3 LYS 121 0.018 5.578 -8.367 946 HD2 LYS 121 HD2 LYS 121 -0.732 7.240 -10.150 947 HD3 LYS 121 HD3 LYS 121 0.774 8.133 -9.943 948 HE2 LYS 121 HE2 LYS 121 2.098 6.030 -10.618 949 HE3 LYS 121 HE3 LYS 121 0.580 5.153 -10.837 950 HZ1 LYS 121 HZ1 LYS 121 1.285 7.699 -12.313 951 HZ2 LYS 121 HZ2 LYS 121 -0.090 6.848 -12.541 952 HZ3 LYS 121 HZ3 LYS 121 1.356 6.196 -12.993 953 H ARG 122 H ARG 122 0.992 5.191 -4.829 954 HA ARG 122 HA ARG 122 3.599 6.691 -4.214 955 HB2 ARG 122 HB2 ARG 122 2.543 3.902 -3.420 956 HB3 ARG 122 HB3 ARG 122 4.243 4.259 -3.362 957 HG2 ARG 122 HG2 ARG 122 3.773 6.266 -1.835 958 HG3 ARG 122 HG3 ARG 122 2.096 5.715 -1.705 959 HD2 ARG 122 HD2 ARG 122 2.890 3.487 -0.804 960 HD3 ARG 122 HD3 ARG 122 4.560 3.934 -1.128 961 HE ARG 122 HE ARG 122 3.502 5.971 0.670 962 HH11 ARG 122 HH11 ARG 122 4.675 2.641 0.656 963 HH12 ARG 122 HH12 ARG 122 5.249 2.826 2.395 964 HH21 ARG 122 HH21 ARG 122 4.127 6.052 2.609 965 HH22 ARG 122 HH22 ARG 122 4.932 4.617 3.439 966 H ILE 123 H ILE 123 5.514 6.251 -5.221 967 HA ILE 123 HA ILE 123 5.675 4.032 -7.346 968 HB ILE 123 HB ILE 123 6.927 6.827 -7.592 969 HG12 ILE 123 HG12 ILE 123 5.428 6.730 -9.859 970 HG13 ILE 123 HG13 ILE 123 4.434 5.637 -8.930 971 HG21 ILE 123 HG21 ILE 123 6.973 4.452 -9.575 972 HG22 ILE 123 HG22 ILE 123 7.656 6.070 -9.874 973 HG23 ILE 123 HG23 ILE 123 8.358 5.039 -8.626 974 HD11 ILE 123 HD11 ILE 123 3.563 7.973 -8.816 975 HD12 ILE 123 HD12 ILE 123 4.123 7.559 -7.189 976 HD13 ILE 123 HD13 ILE 123 5.118 8.588 -8.234 977 H SER 124 H SER 124 6.893 2.531 -6.384 978 HA SER 124 HA SER 124 9.428 3.343 -4.833 979 HB2 SER 124 HB2 SER 124 7.471 0.998 -4.294 980 HB3 SER 124 HB3 SER 124 8.960 1.304 -3.402 981 HG SER 124 HG SER 124 6.524 2.358 -2.964 982 H LYS 125 H LYS 125 11.315 2.153 -5.164 983 HA LYS 125 HA LYS 125 11.318 0.420 -7.689 984 HB2 LYS 125 HB2 LYS 125 12.555 2.537 -7.815 985 HB3 LYS 125 HB3 LYS 125 13.570 2.099 -6.441 986 HG2 LYS 125 HG2 LYS 125 14.671 0.323 -7.638 987 HG3 LYS 125 HG3 LYS 125 13.429 0.205 -8.861 988 HD2 LYS 125 HD2 LYS 125 14.109 2.706 -9.513 989 HD3 LYS 125 HD3 LYS 125 15.563 2.407 -8.586 990 HE2 LYS 125 HE2 LYS 125 14.498 0.728 -10.994 991 HE3 LYS 125 HE3 LYS 125 15.719 1.983 -11.131 992 HZ1 LYS 125 HZ1 LYS 125 16.055 -0.530 -9.476 993 HZ2 LYS 125 HZ2 LYS 125 17.201 0.627 -9.616 994 HZ3 LYS 125 HZ3 LYS 125 16.781 -0.279 -10.927 995 H ARG 126 H ARG 126 12.100 -1.637 -7.675 996 HA ARG 126 HA ARG 126 12.178 -3.171 -5.264 997 HB2 ARG 126 HB2 ARG 126 11.663 -3.830 -7.716 998 HB3 ARG 126 HB3 ARG 126 13.394 -3.914 -7.989 999 HG2 ARG 126 HG2 ARG 126 13.512 -5.730 -6.143 1000 HG3 ARG 126 HG3 ARG 126 11.758 -5.587 -5.964 1001 HD2 ARG 126 HD2 ARG 126 11.630 -6.025 -8.572 1002 HD3 ARG 126 HD3 ARG 126 13.336 -6.473 -8.473 1003 HE ARG 126 HE ARG 126 11.926 -8.069 -6.468 1004 HH11 ARG 126 HH11 ARG 126 11.993 -7.759 -10.015 1005 HH12 ARG 126 HH12 ARG 126 11.244 -9.436 -10.143 1006 HH21 ARG 126 HH21 ARG 126 11.135 -9.874 -6.743 1007 HH22 ARG 126 HH22 ARG 126 10.722 -10.543 -8.412 1008 H ILE 127 H ILE 127 13.655 -3.584 -3.802 1009 HA ILE 127 HA ILE 127 16.621 -3.553 -4.357 1010 HB ILE 127 HB ILE 127 15.100 -1.702 -2.438 1011 HG12 ILE 127 HG12 ILE 127 17.511 -1.243 -4.281 1012 HG13 ILE 127 HG13 ILE 127 15.840 -0.860 -4.655 1013 HG21 ILE 127 HG21 ILE 127 18.003 -2.507 -1.903 1014 HG22 ILE 127 HG22 ILE 127 17.072 -1.222 -1.066 1015 HG23 ILE 127 HG23 ILE 127 16.587 -2.912 -0.900 1016 HD11 ILE 127 HD11 ILE 127 15.755 0.806 -2.759 1017 HD12 ILE 127 HD12 ILE 127 17.492 0.549 -2.478 1018 HD13 ILE 127 HD13 ILE 127 16.931 1.218 -4.026 1019 H21 OLA 128 H21 OLA 128 4.037 9.401 15.092 1020 H22 OLA 128 H22 OLA 128 5.009 8.204 14.269 1021 H31 OLA 128 H31 OLA 128 3.795 10.672 12.828 1022 H32 OLA 128 H32 OLA 128 2.910 9.165 13.037 1023 H41 OLA 128 H41 OLA 128 4.680 7.919 11.737 1024 H42 OLA 128 H42 OLA 128 5.591 9.416 11.554 1025 H51 OLA 128 H51 OLA 128 4.418 9.123 9.489 1026 H52 OLA 128 H52 OLA 128 3.604 10.438 10.313 1027 H61 OLA 128 H61 OLA 128 1.784 8.835 11.068 1028 H62 OLA 128 H62 OLA 128 2.635 7.495 10.303 1029 H71 OLA 128 H71 OLA 128 2.379 8.599 8.046 1030 H72 OLA 128 H72 OLA 128 1.572 9.981 8.800 1031 H81 OLA 128 H81 OLA 128 -0.259 8.422 9.660 1032 H82 OLA 128 H82 OLA 128 0.536 7.056 8.891 1033 H9 OLA 128 H9 OLA 128 -0.865 9.452 7.514 1034 H10 OLA 128 H10 OLA 128 -0.899 8.256 5.555 1035 H111 OLA 128 H111 OLA 128 0.095 5.750 6.888 1036 H112 OLA 128 H112 OLA 128 1.440 6.636 6.163 1037 H121 OLA 128 H121 OLA 128 0.257 6.623 3.938 1038 H122 OLA 128 H122 OLA 128 -1.125 5.790 4.646 1039 H131 OLA 128 H131 OLA 128 0.267 3.769 5.107 1040 H132 OLA 128 H132 OLA 128 1.729 4.603 4.564 1041 H141 OLA 128 H141 OLA 128 0.739 4.914 2.274 1042 H142 OLA 128 H142 OLA 128 -0.749 4.118 2.775 1043 H151 OLA 128 H151 OLA 128 0.543 1.973 3.193 1044 H152 OLA 128 H152 OLA 128 2.034 2.785 2.728 1045 H161 OLA 128 H161 OLA 128 0.967 3.315 0.448 1046 H162 OLA 128 H162 OLA 128 -0.437 2.367 0.898 1047 H171 OLA 128 H171 OLA 128 2.435 1.194 0.873 1048 H172 OLA 128 H172 OLA 128 1.424 1.239 -0.553 1049 H181 OLA 128 H181 OLA 128 1.287 -0.991 0.625 1050 H182 OLA 128 H182 OLA 128 0.573 -0.213 2.049 1051 H183 OLA 128 H183 OLA 128 -0.303 -0.220 0.495 1052 H21 OLA 129 H21 OLA 129 5.454 -0.746 -2.207 1053 H22 OLA 129 H22 OLA 129 4.286 -0.207 -3.399 1054 H31 OLA 129 H31 OLA 129 2.394 -0.485 -1.825 1055 H32 OLA 129 H32 OLA 129 3.483 -0.800 -0.479 1056 H41 OLA 129 H41 OLA 129 4.318 -2.879 -1.592 1057 H42 OLA 129 H42 OLA 129 3.253 -2.615 -2.967 1058 H51 OLA 129 H51 OLA 129 2.241 -2.975 -0.061 1059 H52 OLA 129 H52 OLA 129 2.479 -4.320 -1.159 1060 H61 OLA 129 H61 OLA 129 0.790 -3.448 -2.743 1061 H62 OLA 129 H62 OLA 129 0.611 -1.962 -1.813 1062 H71 OLA 129 H71 OLA 129 -0.284 -3.255 0.141 1063 H72 OLA 129 H72 OLA 129 -0.081 -4.774 -0.738 1064 H81 OLA 129 H81 OLA 129 -1.688 -4.028 -2.511 1065 H82 OLA 129 H82 OLA 129 -1.835 -2.440 -1.785 1066 H9 OLA 129 H9 OLA 129 -3.116 -5.049 -0.865 1067 H10 OLA 129 H10 OLA 129 -4.227 -3.908 0.819 1068 H111 OLA 129 H111 OLA 129 -4.101 -1.426 0.898 1069 H112 OLA 129 H112 OLA 129 -2.512 -1.392 0.154 1070 H121 OLA 129 H121 OLA 129 -1.470 -2.449 2.168 1071 H122 OLA 129 H122 OLA 129 -3.050 -2.716 2.903 1072 H131 OLA 129 H131 OLA 129 -3.421 -0.180 2.911 1073 H132 OLA 129 H132 OLA 129 -1.776 0.044 2.341 1074 H141 OLA 129 H141 OLA 129 -0.950 -1.239 4.418 1075 H142 OLA 129 H142 OLA 129 -2.612 -1.367 4.962 1076 H151 OLA 129 H151 OLA 129 -0.926 1.203 4.728 1077 H152 OLA 129 H152 OLA 129 -1.488 0.399 6.169 1078 H161 OLA 129 H161 OLA 129 -3.121 1.992 6.184 1079 H162 OLA 129 H162 OLA 129 -3.951 0.883 5.115 1080 H171 OLA 129 H171 OLA 129 -2.816 2.215 3.122 1081 H172 OLA 129 H172 OLA 129 -2.305 3.376 4.339 1082 H181 OLA 129 H181 OLA 129 -4.427 4.136 3.258 1083 H182 OLA 129 H182 OLA 129 -5.248 2.626 3.709 1084 H183 OLA 129 H183 OLA 129 -4.755 3.780 4.968 Start of MODEL 8 1 H1 SER 2 H1 SER 2 6.494 -11.245 -11.556 2 H2 SER 2 H2 SER 2 5.752 -10.243 -10.533 3 HA SER 2 HA SER 2 7.083 -11.988 -9.455 4 HB2 SER 2 HB2 SER 2 8.868 -12.004 -11.217 5 HB3 SER 2 HB3 SER 2 9.373 -10.384 -10.730 6 HG SER 2 HG SER 2 9.465 -12.784 -9.201 7 H PHE 3 H PHE 3 6.219 -11.198 -7.672 8 HA PHE 3 HA PHE 3 6.737 -8.381 -6.671 9 HB2 PHE 3 HB2 PHE 3 4.792 -10.604 -5.803 10 HB3 PHE 3 HB3 PHE 3 4.989 -9.156 -4.873 11 HD1 PHE 3 HD2 PHE 3 4.272 -6.933 -5.722 12 HD2 PHE 3 HD1 PHE 3 3.667 -10.491 -8.066 13 HE1 PHE 3 HE2 PHE 3 2.597 -5.755 -7.115 14 HE2 PHE 3 HE1 PHE 3 1.988 -9.309 -9.403 15 HZ PHE 3 HZ PHE 3 1.432 -6.946 -8.907 16 H SER 4 H SER 4 8.474 -11.190 -5.969 17 HA SER 4 HA SER 4 8.921 -10.679 -3.100 18 HB2 SER 4 HB2 SER 4 10.537 -12.362 -5.080 19 HB3 SER 4 HB3 SER 4 10.901 -12.248 -3.355 20 HG SER 4 HG SER 4 9.468 -13.994 -3.895 21 H GLY 5 H GLY 5 9.885 -8.928 -2.259 22 HA2 GLY 5 HA2 GLY 5 12.656 -8.169 -2.623 23 HA3 GLY 5 HA3 GLY 5 11.732 -7.156 -3.733 24 H LYS 6 H LYS 6 13.211 -5.972 -1.946 25 HA LYS 6 HA LYS 6 11.350 -4.826 0.243 26 HB2 LYS 6 HB2 LYS 6 14.392 -4.864 -0.058 27 HB3 LYS 6 HB3 LYS 6 13.570 -3.909 1.146 28 HG2 LYS 6 HG2 LYS 6 12.627 -5.955 2.257 29 HG3 LYS 6 HG3 LYS 6 13.350 -6.984 1.022 30 HD2 LYS 6 HD2 LYS 6 15.654 -6.117 1.651 31 HD3 LYS 6 HD3 LYS 6 14.965 -5.147 2.935 32 HE2 LYS 6 HE2 LYS 6 14.753 -8.249 2.753 33 HE3 LYS 6 HE3 LYS 6 16.024 -7.398 3.624 34 HZ1 LYS 6 HZ1 LYS 6 13.051 -7.399 4.292 35 HZ2 LYS 6 HZ2 LYS 6 14.068 -6.266 4.929 36 HZ3 LYS 6 HZ3 LYS 6 14.291 -7.871 5.259 37 H TYR 7 H TYR 7 10.243 -3.442 -1.177 38 HA TYR 7 HA TYR 7 11.734 -1.928 -3.313 39 HB2 TYR 7 HB2 TYR 7 8.713 -1.901 -2.654 40 HB3 TYR 7 HB3 TYR 7 9.448 -1.140 -4.027 41 HD1 TYR 7 HD2 TYR 7 8.858 -4.549 -2.484 42 HD2 TYR 7 HD1 TYR 7 9.610 -2.353 -6.108 43 HE1 TYR 7 HE2 TYR 7 8.517 -6.585 -3.795 44 HE2 TYR 7 HE1 TYR 7 9.209 -4.396 -7.413 45 HH TYR 7 HH TYR 7 8.875 -6.626 -7.326 46 H GLN 8 H GLN 8 12.802 -0.105 -2.680 47 HA GLN 8 HA GLN 8 11.784 1.565 -0.421 48 HB2 GLN 8 HB2 GLN 8 14.259 1.133 -0.868 49 HB3 GLN 8 HB3 GLN 8 14.155 2.287 -2.199 50 HG2 GLN 8 HG2 GLN 8 13.324 4.061 -0.532 51 HG3 GLN 8 HG3 GLN 8 13.455 2.877 0.764 52 HE21 GLN 8 HE21 GLN 8 14.652 4.910 1.420 53 HE22 GLN 8 HE22 GLN 8 16.464 4.850 1.067 54 H LEU 9 H LEU 9 10.813 3.449 -0.405 55 HA LEU 9 HA LEU 9 9.209 4.279 -2.720 56 HB2 LEU 9 HB2 LEU 9 8.384 4.305 -0.411 57 HB3 LEU 9 HB3 LEU 9 9.580 5.496 0.059 58 HG LEU 9 HG LEU 9 8.479 7.217 -1.437 59 HD11 LEU 9 HD11 LEU 9 6.152 6.738 -2.335 60 HD12 LEU 9 HD12 LEU 9 6.365 5.011 -1.933 61 HD13 LEU 9 HD13 LEU 9 7.384 5.778 -3.160 62 HD21 LEU 9 HD21 LEU 9 7.883 7.044 0.983 63 HD22 LEU 9 HD22 LEU 9 6.610 5.861 0.610 64 HD23 LEU 9 HD23 LEU 9 6.480 7.538 0.026 65 H GLN 10 H GLN 10 9.478 5.736 -4.201 66 HA GLN 10 HA GLN 10 11.784 7.752 -4.074 67 HB2 GLN 10 HB2 GLN 10 10.374 6.459 -6.480 68 HB3 GLN 10 HB3 GLN 10 11.616 7.682 -6.607 69 HG2 GLN 10 HG2 GLN 10 12.104 4.971 -5.190 70 HG3 GLN 10 HG3 GLN 10 12.236 5.213 -6.905 71 HE21 GLN 10 HE21 GLN 10 14.441 4.420 -6.338 72 HE22 GLN 10 HE22 GLN 10 15.695 5.668 -5.841 73 H SER 11 H SER 11 8.585 7.526 -5.630 74 HA SER 11 HA SER 11 8.098 10.493 -4.906 75 HB2 SER 11 HB2 SER 11 8.548 10.183 -7.344 76 HB3 SER 11 HB3 SER 11 7.215 9.042 -7.469 77 HG SER 11 HG SER 11 7.106 11.818 -6.871 78 H GLN 12 H GLN 12 6.214 11.042 -4.003 79 HA GLN 12 HA GLN 12 4.003 8.959 -3.603 80 HB2 GLN 12 HB2 GLN 12 5.647 9.215 -1.604 81 HB3 GLN 12 HB3 GLN 12 5.025 10.855 -1.399 82 HG2 GLN 12 HG2 GLN 12 2.802 10.046 -0.831 83 HG3 GLN 12 HG3 GLN 12 3.123 8.442 -1.440 84 HE21 GLN 12 HE21 GLN 12 4.994 10.436 0.948 85 HE22 GLN 12 HE22 GLN 12 4.738 9.205 2.279 86 H GLU 13 H GLU 13 2.328 9.770 -4.720 87 HA GLU 13 HA GLU 13 2.173 12.628 -5.459 88 HB2 GLU 13 HB2 GLU 13 1.858 10.574 -6.931 89 HB3 GLU 13 HB3 GLU 13 0.362 10.241 -6.083 90 HG2 GLU 13 HG2 GLU 13 -0.479 12.593 -6.970 91 HG3 GLU 13 HG3 GLU 13 0.985 12.625 -7.949 92 H ASN 14 H ASN 14 -0.991 11.394 -4.979 93 HA ASN 14 HA ASN 14 -1.694 13.699 -3.269 94 HB2 ASN 14 HB2 ASN 14 -3.379 11.380 -4.374 95 HB3 ASN 14 HB3 ASN 14 -4.055 12.629 -3.424 96 HD21 ASN 14 HD21 ASN 14 -3.207 11.836 -6.627 97 HD22 ASN 14 HD22 ASN 14 -3.582 13.520 -7.263 98 H PHE 15 H PHE 15 -0.038 12.639 -1.637 99 HA PHE 15 HA PHE 15 -1.305 11.039 0.524 100 HB2 PHE 15 HB2 PHE 15 1.192 11.284 0.007 101 HB3 PHE 15 HB3 PHE 15 1.172 12.861 0.734 102 HD1 PHE 15 HD1 PHE 15 0.747 13.064 3.249 103 HD2 PHE 15 HD2 PHE 15 1.193 9.236 1.361 104 HE1 PHE 15 HE1 PHE 15 1.334 12.040 5.407 105 HE2 PHE 15 HE2 PHE 15 1.799 8.241 3.517 106 HZ PHE 15 HZ PHE 15 1.850 9.638 5.555 107 H GLU 16 H GLU 16 -0.544 14.564 0.499 108 HA GLU 16 HA GLU 16 -2.000 15.355 2.869 109 HB2 GLU 16 HB2 GLU 16 -1.042 16.763 0.320 110 HB3 GLU 16 HB3 GLU 16 -2.183 17.630 1.285 111 HG2 GLU 16 HG2 GLU 16 0.365 16.502 2.623 112 HG3 GLU 16 HG3 GLU 16 0.355 18.039 1.755 113 H ALA 17 H ALA 17 -3.312 15.352 -0.454 114 HA ALA 17 HA ALA 17 -6.047 16.140 0.309 115 HB1 ALA 17 HB1 ALA 17 -5.058 14.647 -2.219 116 HB2 ALA 17 HB2 ALA 17 -6.602 15.510 -2.040 117 HB3 ALA 17 HB3 ALA 17 -5.085 16.416 -2.002 118 H PHE 18 H PHE 18 -4.592 12.898 0.055 119 HA PHE 18 HA PHE 18 -7.216 11.452 0.432 120 HB2 PHE 18 HB2 PHE 18 -5.272 10.543 -0.922 121 HB3 PHE 18 HB3 PHE 18 -4.317 10.401 0.519 122 HD1 PHE 18 HD2 PHE 18 -4.985 8.690 2.303 123 HD2 PHE 18 HD1 PHE 18 -6.950 8.832 -1.521 124 HE1 PHE 18 HE2 PHE 18 -5.695 6.354 2.572 125 HE2 PHE 18 HE1 PHE 18 -7.662 6.504 -1.233 126 HZ PHE 18 HZ PHE 18 -7.027 5.257 0.817 127 H MET 19 H MET 19 -4.338 11.941 2.571 128 HA MET 19 HA MET 19 -5.606 10.662 4.890 129 HB2 MET 19 HB2 MET 19 -3.201 12.548 4.704 130 HB3 MET 19 HB3 MET 19 -3.784 11.814 6.193 131 HG2 MET 19 HG2 MET 19 -1.899 10.506 5.312 132 HG3 MET 19 HG3 MET 19 -3.371 9.520 5.375 133 HE1 MET 19 HE1 MET 19 -1.207 8.156 3.260 134 HE2 MET 19 HE2 MET 19 -2.821 7.744 3.929 135 HE3 MET 19 HE3 MET 19 -2.569 7.823 2.164 136 H LYS 20 H LYS 20 -5.592 14.139 3.953 137 HA LYS 20 HA LYS 20 -7.302 14.925 6.282 138 HB2 LYS 20 HB2 LYS 20 -6.586 16.356 3.661 139 HB3 LYS 20 HB3 LYS 20 -7.893 16.943 4.667 140 HG2 LYS 20 HG2 LYS 20 -6.358 17.072 6.673 141 HG3 LYS 20 HG3 LYS 20 -4.996 16.599 5.680 142 HD2 LYS 20 HD2 LYS 20 -6.748 19.007 4.858 143 HD3 LYS 20 HD3 LYS 20 -5.652 19.212 6.183 144 HE2 LYS 20 HE2 LYS 20 -4.617 18.141 3.456 145 HE3 LYS 20 HE3 LYS 20 -4.873 19.866 3.729 146 HZ1 LYS 20 HZ1 LYS 20 -2.529 19.225 4.342 147 HZ2 LYS 20 HZ2 LYS 20 -3.044 18.152 5.409 148 HZ3 LYS 20 HZ3 LYS 20 -3.344 19.751 5.741 149 H ALA 21 H ALA 21 -8.179 13.853 2.896 150 HA ALA 21 HA ALA 21 -11.073 14.150 3.291 151 HB1 ALA 21 HB1 ALA 21 -11.232 12.638 1.294 152 HB2 ALA 21 HB2 ALA 21 -10.018 13.906 1.041 153 HB3 ALA 21 HB3 ALA 21 -9.501 12.247 1.429 154 H ILE 22 H ILE 22 -8.934 11.374 4.098 155 HA ILE 22 HA ILE 22 -11.315 9.800 5.141 156 HB ILE 22 HB ILE 22 -9.843 7.976 5.676 157 HG12 ILE 22 HG12 ILE 22 -7.442 9.438 4.459 158 HG13 ILE 22 HG13 ILE 22 -7.722 9.414 6.187 159 HG21 ILE 22 HG21 ILE 22 -9.295 7.254 3.370 160 HG22 ILE 22 HG22 ILE 22 -10.813 8.172 3.355 161 HG23 ILE 22 HG23 ILE 22 -9.305 8.936 2.800 162 HD11 ILE 22 HD11 ILE 22 -7.291 6.891 4.446 163 HD12 ILE 22 HD12 ILE 22 -6.108 7.642 5.537 164 HD13 ILE 22 HD13 ILE 22 -7.582 6.893 6.206 165 H GLY 23 H GLY 23 -9.609 12.261 6.531 166 HA2 GLY 23 HA2 GLY 23 -10.102 13.126 8.760 167 HA3 GLY 23 HA3 GLY 23 -10.718 11.575 9.258 168 H LEU 24 H LEU 24 -7.416 12.420 8.067 169 HA LEU 24 HA LEU 24 -6.335 11.639 10.809 170 HB2 LEU 24 HB2 LEU 24 -5.360 11.199 7.975 171 HB3 LEU 24 HB3 LEU 24 -4.133 11.688 9.085 172 HG LEU 24 HG LEU 24 -5.054 9.804 10.721 173 HD11 LEU 24 HD11 LEU 24 -7.166 9.289 9.440 174 HD12 LEU 24 HD12 LEU 24 -6.125 7.871 9.579 175 HD13 LEU 24 HD13 LEU 24 -6.204 8.769 8.041 176 HD21 LEU 24 HD21 LEU 24 -2.837 9.749 9.630 177 HD22 LEU 24 HD22 LEU 24 -3.553 9.075 8.141 178 HD23 LEU 24 HD23 LEU 24 -3.576 8.137 9.664 179 HA PRO 25 HA PRO 25 -4.839 15.677 11.813 180 HB2 PRO 25 HB2 PRO 25 -2.570 15.146 13.406 181 HB3 PRO 25 HB3 PRO 25 -4.229 14.945 13.882 182 HG2 PRO 25 HG2 PRO 25 -2.250 12.870 12.917 183 HG3 PRO 25 HG3 PRO 25 -3.467 12.662 14.191 184 HD2 PRO 25 HD2 PRO 25 -3.619 11.746 11.510 185 HD3 PRO 25 HD3 PRO 25 -5.048 11.937 12.546 186 H GLU 26 H GLU 26 -3.686 17.319 10.986 187 HA GLU 26 HA GLU 26 -1.856 17.059 8.796 188 HB2 GLU 26 HB2 GLU 26 -2.501 19.426 10.599 189 HB3 GLU 26 HB3 GLU 26 -1.522 19.507 9.173 190 HG2 GLU 26 HG2 GLU 26 -3.613 18.402 7.899 191 HG3 GLU 26 HG3 GLU 26 -4.529 18.891 9.312 192 H GLU 27 H GLU 27 -1.034 17.431 12.189 193 HA GLU 27 HA GLU 27 1.877 17.780 11.935 194 HB2 GLU 27 HB2 GLU 27 0.654 18.294 13.963 195 HB3 GLU 27 HB3 GLU 27 0.056 16.664 14.161 196 HG2 GLU 27 HG2 GLU 27 3.095 17.203 14.287 197 HG3 GLU 27 HG3 GLU 27 2.052 17.573 15.650 198 H LEU 28 H LEU 28 0.041 14.681 12.377 199 HA LEU 28 HA LEU 28 2.454 13.018 11.845 200 HB2 LEU 28 HB2 LEU 28 -0.435 12.055 11.608 201 HB3 LEU 28 HB3 LEU 28 1.004 11.075 11.775 202 HG LEU 28 HG LEU 28 -0.205 12.891 13.943 203 HD11 LEU 28 HD11 LEU 28 0.013 9.802 13.796 204 HD12 LEU 28 HD12 LEU 28 -1.469 10.724 13.470 205 HD13 LEU 28 HD13 LEU 28 -0.756 10.745 15.094 206 HD21 LEU 28 HD21 LEU 28 2.331 12.756 14.189 207 HD22 LEU 28 HD22 LEU 28 2.175 10.994 14.398 208 HD23 LEU 28 HD23 LEU 28 1.417 12.110 15.547 209 H ILE 29 H ILE 29 -0.051 14.298 9.726 210 HA ILE 29 HA ILE 29 0.695 12.778 7.295 211 HB ILE 29 HB ILE 29 -0.768 15.467 7.465 212 HG12 ILE 29 HG12 ILE 29 -1.979 12.671 7.020 213 HG13 ILE 29 HG13 ILE 29 -1.924 13.411 8.576 214 HG21 ILE 29 HG21 ILE 29 -0.724 13.512 5.059 215 HG22 ILE 29 HG22 ILE 29 -1.555 15.073 5.147 216 HG23 ILE 29 HG23 ILE 29 0.198 15.039 5.128 217 HD11 ILE 29 HD11 ILE 29 -3.336 15.368 7.820 218 HD12 ILE 29 HD12 ILE 29 -3.491 14.624 6.208 219 HD13 ILE 29 HD13 ILE 29 -4.166 13.814 7.629 220 H GLN 30 H GLN 30 1.579 16.070 8.432 221 HA GLN 30 HA GLN 30 3.621 16.618 6.384 222 HB2 GLN 30 HB2 GLN 30 2.948 17.760 9.131 223 HB3 GLN 30 HB3 GLN 30 4.524 18.105 8.522 224 HG2 GLN 30 HG2 GLN 30 2.678 19.850 8.027 225 HG3 GLN 30 HG3 GLN 30 3.843 19.463 6.789 226 HE21 GLN 30 HE21 GLN 30 0.567 18.346 7.712 227 HE22 GLN 30 HE22 GLN 30 0.048 18.254 5.938 228 H LYS 31 H LYS 31 3.845 14.503 9.125 229 HA LYS 31 HA LYS 31 6.874 14.268 8.986 230 HB2 LYS 31 HB2 LYS 31 4.675 12.816 10.578 231 HB3 LYS 31 HB3 LYS 31 6.318 12.226 10.551 232 HG2 LYS 31 HG2 LYS 31 7.215 14.291 11.554 233 HG3 LYS 31 HG3 LYS 31 5.644 15.102 11.441 234 HD2 LYS 31 HD2 LYS 31 4.586 13.534 12.990 235 HD3 LYS 31 HD3 LYS 31 5.991 12.465 12.999 236 HE2 LYS 31 HE2 LYS 31 7.391 14.163 14.172 237 HE3 LYS 31 HE3 LYS 31 6.086 15.376 14.061 238 HZ1 LYS 31 HZ1 LYS 31 4.639 14.054 15.399 239 HZ2 LYS 31 HZ2 LYS 31 6.068 14.003 16.251 240 HZ3 LYS 31 HZ3 LYS 31 5.639 12.665 15.342 241 H GLY 32 H GLY 32 4.114 12.031 8.246 242 HA2 GLY 32 HA2 GLY 32 5.894 10.100 6.816 243 HA3 GLY 32 HA3 GLY 32 4.159 10.006 6.881 244 H LYS 33 H LYS 33 4.434 12.965 5.515 245 HA LYS 33 HA LYS 33 3.951 11.993 2.822 246 HB2 LYS 33 HB2 LYS 33 3.771 14.285 2.118 247 HB3 LYS 33 HB3 LYS 33 2.946 14.040 3.639 248 HG2 LYS 33 HG2 LYS 33 4.758 15.148 4.914 249 HG3 LYS 33 HG3 LYS 33 5.750 15.326 3.494 250 HD2 LYS 33 HD2 LYS 33 2.964 16.591 3.716 251 HD3 LYS 33 HD3 LYS 33 4.399 17.392 4.301 252 HE2 LYS 33 HE2 LYS 33 4.125 16.456 1.354 253 HE3 LYS 33 HE3 LYS 33 3.588 18.033 1.914 254 HZ1 LYS 33 HZ1 LYS 33 6.033 17.895 1.018 255 HZ2 LYS 33 HZ2 LYS 33 6.472 17.121 2.365 256 HZ3 LYS 33 HZ3 LYS 33 5.885 18.635 2.496 257 H ASP 34 H ASP 34 7.010 13.426 3.980 258 HA ASP 34 HA ASP 34 8.261 12.961 1.225 259 HB2 ASP 34 HB2 ASP 34 9.306 14.622 3.597 260 HB3 ASP 34 HB3 ASP 34 10.004 14.556 1.991 261 H ILE 35 H ILE 35 8.259 11.122 4.015 262 HA ILE 35 HA ILE 35 11.161 10.448 4.183 263 HB ILE 35 HB ILE 35 8.729 9.075 5.436 264 HG12 ILE 35 HG12 ILE 35 10.877 10.821 6.819 265 HG13 ILE 35 HG13 ILE 35 9.367 11.476 6.231 266 HG21 ILE 35 HG21 ILE 35 11.713 8.509 6.069 267 HG22 ILE 35 HG22 ILE 35 10.322 7.840 6.953 268 HG23 ILE 35 HG23 ILE 35 10.589 7.378 5.279 269 HD11 ILE 35 HD11 ILE 35 9.551 9.338 8.454 270 HD12 ILE 35 HD12 ILE 35 9.142 11.057 8.631 271 HD13 ILE 35 HD13 ILE 35 8.039 9.981 7.766 272 H LYS 36 H LYS 36 12.166 9.395 2.583 273 HA LYS 36 HA LYS 36 10.861 7.406 0.778 274 HB2 LYS 36 HB2 LYS 36 13.825 8.189 1.093 275 HB3 LYS 36 HB3 LYS 36 13.222 7.015 -0.053 276 HG2 LYS 36 HG2 LYS 36 11.648 8.879 -0.999 277 HG3 LYS 36 HG3 LYS 36 12.603 10.029 -0.062 278 HD2 LYS 36 HD2 LYS 36 14.724 9.155 -1.241 279 HD3 LYS 36 HD3 LYS 36 13.725 7.998 -2.122 280 HE2 LYS 36 HE2 LYS 36 12.389 10.042 -3.076 281 HE3 LYS 36 HE3 LYS 36 13.615 11.087 -2.370 282 HZ1 LYS 36 HZ1 LYS 36 14.193 8.843 -4.352 283 HZ2 LYS 36 HZ2 LYS 36 15.337 9.821 -3.703 284 HZ3 LYS 36 HZ3 LYS 36 14.205 10.446 -4.724 285 H GLY 37 H GLY 37 10.085 6.142 2.676 286 HA2 GLY 37 HA2 GLY 37 11.958 4.223 4.003 287 HA3 GLY 37 HA3 GLY 37 10.213 4.231 4.152 288 H VAL 38 H VAL 38 11.281 1.924 4.191 289 HA VAL 38 HA VAL 38 11.347 0.601 1.461 290 HB VAL 38 HB VAL 38 11.878 -0.548 4.247 291 HG11 VAL 38 HG11 VAL 38 12.236 -1.941 1.510 292 HG12 VAL 38 HG12 VAL 38 12.825 -2.572 3.072 293 HG13 VAL 38 HG13 VAL 38 11.090 -2.416 2.784 294 HG21 VAL 38 HG21 VAL 38 14.286 -0.671 3.494 295 HG22 VAL 38 HG22 VAL 38 13.861 0.077 1.935 296 HG23 VAL 38 HG23 VAL 38 13.724 1.005 3.443 297 H SER 39 H SER 39 9.758 -0.553 0.592 298 HA SER 39 HA SER 39 7.332 -1.441 2.264 299 HB2 SER 39 HB2 SER 39 7.487 -0.480 -0.632 300 HB3 SER 39 HB3 SER 39 6.089 -1.305 0.031 301 HG SER 39 HG SER 39 5.792 0.922 0.169 302 H GLU 40 H GLU 40 7.997 -3.408 2.684 303 HA GLU 40 HA GLU 40 9.324 -5.237 0.699 304 HB2 GLU 40 HB2 GLU 40 9.818 -5.059 3.250 305 HB3 GLU 40 HB3 GLU 40 8.293 -5.840 3.510 306 HG2 GLU 40 HG2 GLU 40 9.046 -7.940 2.414 307 HG3 GLU 40 HG3 GLU 40 10.571 -7.197 1.942 308 H ILE 41 H ILE 41 8.518 -7.047 -0.229 309 HA ILE 41 HA ILE 41 5.833 -8.128 0.626 310 HB ILE 41 HB ILE 41 6.393 -7.730 -2.370 311 HG12 ILE 41 HG12 ILE 41 4.254 -6.160 -0.819 312 HG13 ILE 41 HG13 ILE 41 5.820 -5.510 -1.263 313 HG21 ILE 41 HG21 ILE 41 3.817 -8.732 -0.944 314 HG22 ILE 41 HG22 ILE 41 4.022 -8.538 -2.702 315 HG23 ILE 41 HG23 ILE 41 4.953 -9.759 -1.854 316 HD11 ILE 41 HD11 ILE 41 4.260 -4.781 -2.976 317 HD12 ILE 41 HD12 ILE 41 5.373 -5.940 -3.723 318 HD13 ILE 41 HD13 ILE 41 3.705 -6.424 -3.308 319 H VAL 42 H VAL 42 6.168 -10.279 0.952 320 HA VAL 42 HA VAL 42 8.241 -11.825 -0.708 321 HB VAL 42 HB VAL 42 6.920 -12.922 1.815 322 HG11 VAL 42 HG11 VAL 42 9.639 -13.585 0.508 323 HG12 VAL 42 HG12 VAL 42 8.914 -14.402 1.911 324 HG13 VAL 42 HG13 VAL 42 8.161 -14.549 0.312 325 HG21 VAL 42 HG21 VAL 42 8.018 -10.849 2.632 326 HG22 VAL 42 HG22 VAL 42 8.898 -12.276 3.189 327 HG23 VAL 42 HG23 VAL 42 9.543 -11.304 1.837 328 H GLN 43 H GLN 43 7.264 -12.682 -2.497 329 HA GLN 43 HA GLN 43 4.357 -13.394 -2.552 330 HB2 GLN 43 HB2 GLN 43 5.542 -12.255 -4.420 331 HB3 GLN 43 HB3 GLN 43 6.548 -13.667 -4.694 332 HG2 GLN 43 HG2 GLN 43 4.518 -15.031 -5.300 333 HG3 GLN 43 HG3 GLN 43 3.469 -13.678 -4.903 334 HE21 GLN 43 HE21 GLN 43 2.769 -14.292 -7.118 335 HE22 GLN 43 HE22 GLN 43 3.598 -13.443 -8.533 336 H ASN 44 H ASN 44 3.829 -15.194 -1.380 337 HA ASN 44 HA ASN 44 5.273 -17.862 -1.973 338 HB2 ASN 44 HB2 ASN 44 3.559 -17.124 0.484 339 HB3 ASN 44 HB3 ASN 44 4.372 -18.634 0.197 340 HD21 ASN 44 HD21 ASN 44 5.011 -15.239 0.871 341 HD22 ASN 44 HD22 ASN 44 6.648 -15.611 1.604 342 H GLY 45 H GLY 45 3.854 -17.505 -4.001 343 HA2 GLY 45 HA2 GLY 45 2.102 -18.480 -5.371 344 HA3 GLY 45 HA3 GLY 45 1.625 -19.487 -4.020 345 H LYS 46 H LYS 46 -0.002 -18.728 -2.662 346 HA LYS 46 HA LYS 46 -1.761 -16.430 -3.642 347 HB2 LYS 46 HB2 LYS 46 -2.278 -18.651 -1.565 348 HB3 LYS 46 HB3 LYS 46 -3.376 -17.327 -1.875 349 HG2 LYS 46 HG2 LYS 46 -3.725 -18.064 -4.257 350 HG3 LYS 46 HG3 LYS 46 -2.534 -19.325 -4.046 351 HD2 LYS 46 HD2 LYS 46 -4.253 -20.692 -3.584 352 HD3 LYS 46 HD3 LYS 46 -4.179 -20.086 -1.962 353 HE2 LYS 46 HE2 LYS 46 -6.093 -19.116 -4.221 354 HE3 LYS 46 HE3 LYS 46 -6.511 -20.240 -2.935 355 HZ1 LYS 46 HZ1 LYS 46 -7.264 -18.116 -2.122 356 HZ2 LYS 46 HZ2 LYS 46 -5.947 -17.310 -2.681 357 HZ3 LYS 46 HZ3 LYS 46 -5.827 -18.280 -1.340 358 H HIS 47 H HIS 47 0.355 -17.239 -0.881 359 HA HIS 47 HA HIS 47 -0.771 -14.958 0.798 360 HB2 HIS 47 HB2 HIS 47 1.235 -17.198 1.465 361 HB3 HIS 47 HB3 HIS 47 0.942 -15.844 2.528 362 HD1 HIS 47 HD1 HIS 47 -0.744 -19.105 1.402 363 HD2 HIS 47 HD2 HIS 47 -1.479 -15.602 3.749 364 HE1 HIS 47 HE1 HIS 47 -2.896 -19.401 2.807 365 H PHE 48 H PHE 48 -0.040 -13.043 0.318 366 HA PHE 48 HA PHE 48 2.881 -12.541 -0.485 367 HB2 PHE 48 HB2 PHE 48 0.271 -10.973 -0.796 368 HB3 PHE 48 HB3 PHE 48 1.812 -10.212 -0.977 369 HD1 PHE 48 HD1 PHE 48 0.352 -13.511 -2.362 370 HD2 PHE 48 HD2 PHE 48 2.169 -9.703 -3.195 371 HE1 PHE 48 HE1 PHE 48 0.255 -13.978 -4.763 372 HE2 PHE 48 HE2 PHE 48 2.033 -10.183 -5.591 373 HZ PHE 48 HZ PHE 48 1.104 -12.298 -6.389 374 H LYS 49 H LYS 49 4.038 -12.351 1.362 375 HA LYS 49 HA LYS 49 2.884 -11.077 3.868 376 HB2 LYS 49 HB2 LYS 49 5.648 -12.317 3.436 377 HB3 LYS 49 HB3 LYS 49 5.059 -11.693 4.959 378 HG2 LYS 49 HG2 LYS 49 3.265 -13.360 5.084 379 HG3 LYS 49 HG3 LYS 49 3.580 -13.922 3.458 380 HD2 LYS 49 HD2 LYS 49 6.041 -14.469 4.368 381 HD3 LYS 49 HD3 LYS 49 5.357 -14.270 5.969 382 HE2 LYS 49 HE2 LYS 49 4.419 -16.280 3.794 383 HE3 LYS 49 HE3 LYS 49 5.488 -16.666 5.138 384 HZ1 LYS 49 HZ1 LYS 49 3.199 -17.281 5.845 385 HZ2 LYS 49 HZ2 LYS 49 2.547 -15.843 5.386 386 HZ3 LYS 49 HZ3 LYS 49 3.489 -15.872 6.657 387 H PHE 50 H PHE 50 2.962 -8.989 4.139 388 HA PHE 50 HA PHE 50 5.210 -7.414 2.807 389 HB2 PHE 50 HB2 PHE 50 3.907 -5.528 2.452 390 HB3 PHE 50 HB3 PHE 50 3.134 -6.915 1.775 391 HD1 PHE 50 HD2 PHE 50 2.702 -5.470 5.366 392 HD2 PHE 50 HD1 PHE 50 1.049 -5.960 1.431 393 HE1 PHE 50 HE2 PHE 50 0.658 -4.385 6.089 394 HE2 PHE 50 HE1 PHE 50 -1.009 -4.885 2.170 395 HZ PHE 50 HZ PHE 50 -1.220 -4.080 4.509 396 H THR 51 H THR 51 6.338 -5.872 3.690 397 HA THR 51 HA THR 51 5.819 -5.108 6.641 398 HB THR 51 HB THR 51 8.663 -5.347 5.524 399 HG1 THR 51 HG1 THR 51 8.611 -7.377 5.841 400 HG21 THR 51 HG21 THR 51 8.468 -3.888 7.495 401 HG22 THR 51 HG22 THR 51 9.341 -5.390 7.879 402 HG23 THR 51 HG23 THR 51 7.662 -5.192 8.411 403 H ILE 52 H ILE 52 4.746 -3.219 6.128 404 HA ILE 52 HA ILE 52 5.947 -1.356 4.029 405 HB ILE 52 HB ILE 52 3.127 -1.401 5.176 406 HG12 ILE 52 HG12 ILE 52 3.392 -3.383 3.843 407 HG13 ILE 52 HG13 ILE 52 2.351 -2.278 2.988 408 HG21 ILE 52 HG21 ILE 52 2.478 0.134 3.308 409 HG22 ILE 52 HG22 ILE 52 3.639 0.904 4.387 410 HG23 ILE 52 HG23 ILE 52 4.179 0.280 2.808 411 HD11 ILE 52 HD11 ILE 52 5.324 -2.890 2.328 412 HD12 ILE 52 HD12 ILE 52 3.912 -3.415 1.409 413 HD13 ILE 52 HD13 ILE 52 4.334 -1.689 1.451 414 H THR 53 H THR 53 6.700 0.546 4.451 415 HA THR 53 HA THR 53 6.752 1.640 7.281 416 HB THR 53 HB THR 53 8.390 3.338 6.343 417 HG1 THR 53 HG1 THR 53 8.625 1.506 4.197 418 HG21 THR 53 HG21 THR 53 10.324 1.773 6.272 419 HG22 THR 53 HG22 THR 53 9.229 0.374 6.125 420 HG23 THR 53 HG23 THR 53 9.228 1.362 7.606 421 H ALA 54 H ALA 54 5.077 2.740 7.794 422 HA ALA 54 HA ALA 54 3.804 4.877 5.968 423 HB1 ALA 54 HB1 ALA 54 2.893 3.552 8.623 424 HB2 ALA 54 HB2 ALA 54 1.999 4.817 7.770 425 HB3 ALA 54 HB3 ALA 54 2.239 3.236 6.994 426 H GLY 55 H GLY 55 6.031 5.796 6.272 427 HA2 GLY 55 HA2 GLY 55 7.198 7.794 6.959 428 HA3 GLY 55 HA3 GLY 55 5.954 8.172 8.136 429 H SER 56 H SER 56 6.130 7.310 10.184 430 HA SER 56 HA SER 56 8.824 6.163 11.057 431 HB2 SER 56 HB2 SER 56 6.545 7.186 12.849 432 HB3 SER 56 HB3 SER 56 8.160 6.728 13.363 433 HG SER 56 HG SER 56 7.621 9.086 12.962 434 H LYS 57 H LYS 57 5.406 5.137 10.917 435 HA LYS 57 HA LYS 57 5.878 2.823 12.793 436 HB2 LYS 57 HB2 LYS 57 3.703 4.162 12.780 437 HB3 LYS 57 HB3 LYS 57 3.333 3.490 11.199 438 HG2 LYS 57 HG2 LYS 57 3.519 1.116 12.297 439 HG3 LYS 57 HG3 LYS 57 3.700 1.924 13.851 440 HD2 LYS 57 HD2 LYS 57 1.398 2.997 13.510 441 HD3 LYS 57 HD3 LYS 57 1.271 2.185 11.946 442 HE2 LYS 57 HE2 LYS 57 1.566 -0.095 13.167 443 HE3 LYS 57 HE3 LYS 57 1.531 0.772 14.706 444 HZ1 LYS 57 HZ1 LYS 57 -0.711 0.573 12.654 445 HZ2 LYS 57 HZ2 LYS 57 -0.794 1.655 13.915 446 HZ3 LYS 57 HZ3 LYS 57 -0.761 0.003 14.106 447 H VAL 58 H VAL 58 6.397 0.841 12.215 448 HA VAL 58 HA VAL 58 6.446 -0.057 9.312 449 HB VAL 58 HB VAL 58 7.509 -1.471 11.823 450 HG11 VAL 58 HG11 VAL 58 7.932 -2.136 8.831 451 HG12 VAL 58 HG12 VAL 58 8.750 -2.950 10.191 452 HG13 VAL 58 HG13 VAL 58 6.999 -3.115 9.985 453 HG21 VAL 58 HG21 VAL 58 8.870 0.605 11.304 454 HG22 VAL 58 HG22 VAL 58 9.802 -0.864 10.981 455 HG23 VAL 58 HG23 VAL 58 9.091 0.055 9.631 456 H ILE 59 H ILE 59 4.540 -0.755 8.584 457 HA ILE 59 HA ILE 59 2.546 -2.221 10.415 458 HB ILE 59 HB ILE 59 2.056 -0.838 7.721 459 HG12 ILE 59 HG12 ILE 59 1.103 0.023 10.533 460 HG13 ILE 59 HG13 ILE 59 2.466 0.747 9.697 461 HG21 ILE 59 HG21 ILE 59 0.004 -2.152 9.647 462 HG22 ILE 59 HG22 ILE 59 -0.393 -1.280 8.152 463 HG23 ILE 59 HG23 ILE 59 0.491 -2.800 8.057 464 HD11 ILE 59 HD11 ILE 59 -0.475 0.923 8.825 465 HD12 ILE 59 HD12 ILE 59 0.609 2.229 9.339 466 HD13 ILE 59 HD13 ILE 59 0.875 1.425 7.771 467 H GLN 60 H GLN 60 3.242 -4.303 10.369 468 HA GLN 60 HA GLN 60 3.691 -5.639 7.678 469 HB2 GLN 60 HB2 GLN 60 5.080 -7.242 8.657 470 HB3 GLN 60 HB3 GLN 60 5.641 -5.641 9.040 471 HG2 GLN 60 HG2 GLN 60 4.145 -7.463 11.021 472 HG3 GLN 60 HG3 GLN 60 5.887 -7.383 10.873 473 HE21 GLN 60 HE21 GLN 60 6.968 -5.490 11.706 474 HE22 GLN 60 HE22 GLN 60 6.033 -4.284 12.743 475 H ASN 61 H ASN 61 2.409 -7.029 6.962 476 HA ASN 61 HA ASN 61 0.528 -8.751 8.455 477 HB2 ASN 61 HB2 ASN 61 -0.751 -6.475 6.776 478 HB3 ASN 61 HB3 ASN 61 -1.596 -7.914 7.276 479 HD21 ASN 61 HD21 ASN 61 -0.251 -4.963 8.517 480 HD22 ASN 61 HD22 ASN 61 -1.194 -5.067 10.080 481 H GLU 62 H GLU 62 -0.735 -10.172 6.847 482 HA GLU 62 HA GLU 62 0.688 -10.318 4.157 483 HB2 GLU 62 HB2 GLU 62 1.041 -12.576 4.170 484 HB3 GLU 62 HB3 GLU 62 1.678 -11.942 5.679 485 HG2 GLU 62 HG2 GLU 62 -0.285 -12.969 6.934 486 HG3 GLU 62 HG3 GLU 62 -0.932 -13.590 5.413 487 H PHE 63 H PHE 63 -0.451 -10.516 2.429 488 HA PHE 63 HA PHE 63 -3.461 -10.841 2.724 489 HB2 PHE 63 HB2 PHE 63 -3.935 -9.645 0.752 490 HB3 PHE 63 HB3 PHE 63 -3.112 -8.723 1.940 491 HD1 PHE 63 HD1 PHE 63 -0.757 -7.857 1.435 492 HD2 PHE 63 HD2 PHE 63 -2.903 -10.215 -1.448 493 HE1 PHE 63 HE1 PHE 63 0.777 -7.099 -0.367 494 HE2 PHE 63 HE2 PHE 63 -1.395 -9.411 -3.220 495 HZ PHE 63 HZ PHE 63 0.443 -7.843 -2.663 496 H THR 64 H THR 64 -4.522 -12.344 1.854 497 HA THR 64 HA THR 64 -3.131 -14.498 0.237 498 HB THR 64 HB THR 64 -5.908 -14.617 1.546 499 HG1 THR 64 HG1 THR 64 -3.894 -15.995 2.753 500 HG21 THR 64 HG21 THR 64 -5.479 -16.435 -0.131 501 HG22 THR 64 HG22 THR 64 -5.500 -17.096 1.521 502 HG23 THR 64 HG23 THR 64 -3.943 -16.859 0.678 503 H VAL 65 H VAL 65 -3.265 -14.228 -1.915 504 HA VAL 65 HA VAL 65 -5.357 -12.649 -3.285 505 HB VAL 65 HB VAL 65 -3.229 -14.518 -4.390 506 HG11 VAL 65 HG11 VAL 65 -5.012 -14.285 -6.157 507 HG12 VAL 65 HG12 VAL 65 -4.822 -12.517 -6.109 508 HG13 VAL 65 HG13 VAL 65 -3.479 -13.548 -6.636 509 HG21 VAL 65 HG21 VAL 65 -3.320 -11.411 -4.298 510 HG22 VAL 65 HG22 VAL 65 -2.278 -12.437 -3.287 511 HG23 VAL 65 HG23 VAL 65 -2.019 -12.368 -5.037 512 H GLY 66 H GLY 66 -7.376 -13.291 -3.614 513 HA2 GLY 66 HA2 GLY 66 -9.152 -14.756 -4.508 514 HA3 GLY 66 HA3 GLY 66 -8.099 -16.144 -4.468 515 H GLU 67 H GLU 67 -7.878 -14.855 -1.387 516 HA GLU 67 HA GLU 67 -10.446 -15.904 -0.330 517 HB2 GLU 67 HB2 GLU 67 -7.767 -17.275 0.446 518 HB3 GLU 67 HB3 GLU 67 -9.123 -17.288 1.540 519 HG2 GLU 67 HG2 GLU 67 -9.358 -18.462 -1.304 520 HG3 GLU 67 HG3 GLU 67 -8.920 -19.394 0.126 521 H GLU 68 H GLU 68 -10.851 -15.290 1.879 522 HA GLU 68 HA GLU 68 -10.358 -12.543 2.272 523 HB2 GLU 68 HB2 GLU 68 -11.440 -12.631 4.399 524 HB3 GLU 68 HB3 GLU 68 -12.310 -13.543 3.202 525 HG2 GLU 68 HG2 GLU 68 -12.051 -15.587 4.313 526 HG3 GLU 68 HG3 GLU 68 -10.416 -15.236 4.830 527 H CYS 69 H CYS 69 -8.969 -11.237 3.167 528 HA CYS 69 HA CYS 69 -6.968 -12.203 5.251 529 HB2 CYS 69 HB2 CYS 69 -5.122 -10.928 3.988 530 HB3 CYS 69 HB3 CYS 69 -5.649 -12.509 3.403 531 HG CYS 69 HG CYS 69 -6.952 -11.736 1.356 532 H GLU 70 H GLU 70 -6.676 -10.934 6.787 533 HA GLU 70 HA GLU 70 -8.043 -8.250 6.963 534 HB2 GLU 70 HB2 GLU 70 -7.775 -8.341 9.367 535 HB3 GLU 70 HB3 GLU 70 -8.750 -9.606 8.683 536 HG2 GLU 70 HG2 GLU 70 -6.928 -11.296 8.966 537 HG3 GLU 70 HG3 GLU 70 -5.833 -10.017 9.464 538 H LEU 71 H LEU 71 -7.000 -6.494 6.462 539 HA LEU 71 HA LEU 71 -4.030 -6.142 7.232 540 HB2 LEU 71 HB2 LEU 71 -5.538 -4.814 4.904 541 HB3 LEU 71 HB3 LEU 71 -3.846 -4.596 5.296 542 HG LEU 71 HG LEU 71 -5.151 -7.175 4.232 543 HD11 LEU 71 HD11 LEU 71 -4.870 -5.279 2.583 544 HD12 LEU 71 HD12 LEU 71 -3.838 -6.650 2.163 545 HD13 LEU 71 HD13 LEU 71 -3.139 -5.212 2.939 546 HD21 LEU 71 HD21 LEU 71 -2.803 -8.099 4.031 547 HD22 LEU 71 HD22 LEU 71 -3.260 -7.841 5.709 548 HD23 LEU 71 HD23 LEU 71 -2.164 -6.689 4.898 549 H GLU 72 H GLU 72 -3.427 -4.316 8.328 550 HA GLU 72 HA GLU 72 -5.472 -2.648 9.708 551 HB2 GLU 72 HB2 GLU 72 -3.154 -3.318 10.609 552 HB3 GLU 72 HB3 GLU 72 -2.424 -2.212 9.452 553 HG2 GLU 72 HG2 GLU 72 -3.821 -0.296 10.603 554 HG3 GLU 72 HG3 GLU 72 -4.291 -1.477 11.819 555 H THR 73 H THR 73 -6.094 -0.683 9.413 556 HA THR 73 HA THR 73 -5.491 0.808 6.805 557 HB THR 73 HB THR 73 -7.697 -0.016 6.656 558 HG1 THR 73 HG1 THR 73 -8.626 2.368 7.502 559 HG21 THR 73 HG21 THR 73 -9.581 0.521 8.285 560 HG22 THR 73 HG22 THR 73 -8.363 1.186 9.410 561 HG23 THR 73 HG23 THR 73 -8.367 -0.550 8.992 562 H MET 74 H MET 74 -5.940 3.055 6.933 563 HA MET 74 HA MET 74 -4.465 4.422 9.241 564 HB2 MET 74 HB2 MET 74 -5.453 5.514 6.539 565 HB3 MET 74 HB3 MET 74 -4.946 6.580 7.832 566 HG2 MET 74 HG2 MET 74 -3.114 4.464 6.551 567 HG3 MET 74 HG3 MET 74 -3.097 6.200 6.232 568 HE1 MET 74 HE1 MET 74 -2.300 3.359 8.856 569 HE2 MET 74 HE2 MET 74 -0.993 3.804 7.719 570 HE3 MET 74 HE3 MET 74 -0.805 4.129 9.470 571 H THR 75 H THR 75 -7.643 4.943 7.637 572 HA THR 75 HA THR 75 -8.807 5.761 10.354 573 HB THR 75 HB THR 75 -10.143 5.994 7.616 574 HG1 THR 75 HG1 THR 75 -9.805 8.313 8.206 575 HG21 THR 75 HG21 THR 75 -10.947 7.257 10.327 576 HG22 THR 75 HG22 THR 75 -11.808 5.907 9.542 577 HG23 THR 75 HG23 THR 75 -11.772 7.501 8.771 578 H GLY 76 H GLY 76 -9.728 4.185 11.406 579 HA2 GLY 76 HA2 GLY 76 -11.720 2.483 11.250 580 HA3 GLY 76 HA3 GLY 76 -10.845 1.653 10.005 581 H GLU 77 H GLU 77 -9.404 0.022 10.644 582 HA GLU 77 HA GLU 77 -8.621 -0.549 13.360 583 HB2 GLU 77 HB2 GLU 77 -10.162 -2.178 14.152 584 HB3 GLU 77 HB3 GLU 77 -10.927 -0.632 13.961 585 HG2 GLU 77 HG2 GLU 77 -11.489 -3.195 12.363 586 HG3 GLU 77 HG3 GLU 77 -12.517 -2.244 13.396 587 H LYS 78 H LYS 78 -10.091 -2.711 11.052 588 HA LYS 78 HA LYS 78 -7.606 -3.556 9.755 589 HB2 LYS 78 HB2 LYS 78 -7.807 -4.772 12.260 590 HB3 LYS 78 HB3 LYS 78 -8.742 -5.933 11.345 591 HG2 LYS 78 HG2 LYS 78 -6.738 -6.105 9.704 592 HG3 LYS 78 HG3 LYS 78 -5.900 -4.924 10.721 593 HD2 LYS 78 HD2 LYS 78 -6.075 -6.546 12.702 594 HD3 LYS 78 HD3 LYS 78 -6.918 -7.692 11.659 595 HE2 LYS 78 HE2 LYS 78 -4.814 -7.685 10.104 596 HE3 LYS 78 HE3 LYS 78 -3.980 -6.712 11.311 597 HZ1 LYS 78 HZ1 LYS 78 -4.374 -8.550 12.963 598 HZ2 LYS 78 HZ2 LYS 78 -3.689 -9.229 11.615 599 HZ3 LYS 78 HZ3 LYS 78 -5.323 -9.384 11.904 600 H VAL 79 H VAL 79 -8.232 -3.942 7.779 601 HA VAL 79 HA VAL 79 -11.169 -4.563 7.247 602 HB VAL 79 HB VAL 79 -10.233 -2.407 6.482 603 HG11 VAL 79 HG11 VAL 79 -8.871 -2.172 4.434 604 HG12 VAL 79 HG12 VAL 79 -7.932 -2.966 5.704 605 HG13 VAL 79 HG13 VAL 79 -8.595 -3.926 4.366 606 HG21 VAL 79 HG21 VAL 79 -11.226 -4.136 4.143 607 HG22 VAL 79 HG22 VAL 79 -12.264 -3.410 5.401 608 HG23 VAL 79 HG23 VAL 79 -11.342 -2.368 4.308 609 H LYS 80 H LYS 80 -11.794 -6.421 6.362 610 HA LYS 80 HA LYS 80 -9.761 -8.427 5.356 611 HB2 LYS 80 HB2 LYS 80 -12.738 -8.748 5.945 612 HB3 LYS 80 HB3 LYS 80 -11.810 -9.935 5.046 613 HG2 LYS 80 HG2 LYS 80 -10.087 -10.010 6.938 614 HG3 LYS 80 HG3 LYS 80 -11.150 -8.994 7.915 615 HD2 LYS 80 HD2 LYS 80 -12.942 -10.809 7.769 616 HD3 LYS 80 HD3 LYS 80 -11.886 -11.744 6.713 617 HE2 LYS 80 HE2 LYS 80 -10.099 -11.758 8.642 618 HE3 LYS 80 HE3 LYS 80 -11.310 -11.027 9.691 619 HZ1 LYS 80 HZ1 LYS 80 -11.466 -13.503 9.858 620 HZ2 LYS 80 HZ2 LYS 80 -11.531 -13.686 8.213 621 HZ3 LYS 80 HZ3 LYS 80 -12.808 -13.043 8.980 622 H THR 81 H THR 81 -8.973 -7.533 3.634 623 HA THR 81 HA THR 81 -10.745 -6.812 1.225 624 HB THR 81 HB THR 81 -9.609 -4.917 2.279 625 HG1 THR 81 HG1 THR 81 -8.600 -5.588 -0.286 626 HG21 THR 81 HG21 THR 81 -7.428 -6.111 3.089 627 HG22 THR 81 HG22 THR 81 -7.212 -4.547 2.319 628 HG23 THR 81 HG23 THR 81 -6.858 -6.022 1.406 629 H VAL 82 H VAL 82 -10.755 -8.527 -0.120 630 HA VAL 82 HA VAL 82 -8.314 -10.298 -0.359 631 HB VAL 82 HB VAL 82 -10.462 -11.473 -0.145 632 HG11 VAL 82 HG11 VAL 82 -11.794 -12.015 -2.197 633 HG12 VAL 82 HG12 VAL 82 -12.002 -10.303 -1.741 634 HG13 VAL 82 HG13 VAL 82 -10.942 -10.749 -3.111 635 HG21 VAL 82 HG21 VAL 82 -8.894 -12.150 -2.719 636 HG22 VAL 82 HG22 VAL 82 -8.364 -12.534 -1.071 637 HG23 VAL 82 HG23 VAL 82 -9.860 -13.247 -1.705 638 H VAL 83 H VAL 83 -7.011 -10.411 -2.046 639 HA VAL 83 HA VAL 83 -7.184 -8.131 -4.069 640 HB VAL 83 HB VAL 83 -4.637 -9.624 -3.259 641 HG11 VAL 83 HG11 VAL 83 -3.509 -7.560 -4.067 642 HG12 VAL 83 HG12 VAL 83 -4.519 -8.233 -5.363 643 HG13 VAL 83 HG13 VAL 83 -5.068 -6.801 -4.467 644 HG21 VAL 83 HG21 VAL 83 -4.061 -7.633 -1.749 645 HG22 VAL 83 HG22 VAL 83 -5.739 -7.092 -1.853 646 HG23 VAL 83 HG23 VAL 83 -5.362 -8.647 -1.112 647 H GLN 84 H GLN 84 -7.333 -8.514 -6.176 648 HA GLN 84 HA GLN 84 -7.025 -11.387 -7.243 649 HB2 GLN 84 HB2 GLN 84 -8.708 -9.021 -8.200 650 HB3 GLN 84 HB3 GLN 84 -8.270 -10.284 -9.308 651 HG2 GLN 84 HG2 GLN 84 -10.496 -10.722 -8.462 652 HG3 GLN 84 HG3 GLN 84 -9.419 -12.030 -8.051 653 HE21 GLN 84 HE21 GLN 84 -9.287 -12.571 -5.877 654 HE22 GLN 84 HE22 GLN 84 -10.227 -11.654 -4.584 655 H LEU 85 H LEU 85 -5.678 -11.821 -8.908 656 HA LEU 85 HA LEU 85 -3.569 -9.714 -9.566 657 HB2 LEU 85 HB2 LEU 85 -2.818 -11.478 -8.011 658 HB3 LEU 85 HB3 LEU 85 -3.344 -12.737 -9.114 659 HG LEU 85 HG LEU 85 -1.662 -12.070 -10.782 660 HD11 LEU 85 HD11 LEU 85 -0.630 -10.019 -8.699 661 HD12 LEU 85 HD12 LEU 85 -1.360 -9.617 -10.273 662 HD13 LEU 85 HD13 LEU 85 0.184 -10.454 -10.201 663 HD21 LEU 85 HD21 LEU 85 0.368 -12.868 -9.478 664 HD22 LEU 85 HD22 LEU 85 -1.082 -13.822 -9.115 665 HD23 LEU 85 HD23 LEU 85 -0.519 -12.593 -7.960 666 H GLU 86 H GLU 86 -3.451 -9.143 -11.616 667 HA GLU 86 HA GLU 86 -4.187 -11.114 -13.864 668 HB2 GLU 86 HB2 GLU 86 -5.503 -8.920 -13.720 669 HB3 GLU 86 HB3 GLU 86 -3.996 -8.088 -14.060 670 HG2 GLU 86 HG2 GLU 86 -3.843 -9.391 -16.299 671 HG3 GLU 86 HG3 GLU 86 -5.468 -10.000 -15.969 672 H GLY 87 H GLY 87 -2.662 -11.745 -15.103 673 HA2 GLY 87 HA2 GLY 87 -0.469 -12.263 -16.059 674 HA3 GLY 87 HA3 GLY 87 -0.385 -10.524 -16.185 675 H ASP 88 H ASP 88 -0.244 -11.794 -13.103 676 HA ASP 88 HA ASP 88 1.387 -11.800 -11.401 677 HB2 ASP 88 HB2 ASP 88 2.465 -13.598 -12.852 678 HB3 ASP 88 HB3 ASP 88 3.589 -12.373 -13.421 679 H ASN 89 H ASN 89 0.728 -9.307 -12.893 680 HA ASN 89 HA ASN 89 2.675 -7.587 -11.317 681 HB2 ASN 89 HB2 ASN 89 3.393 -6.262 -12.988 682 HB3 ASN 89 HB3 ASN 89 3.440 -7.815 -13.750 683 HD21 ASN 89 HD21 ASN 89 3.147 -4.918 -14.659 684 HD22 ASN 89 HD22 ASN 89 1.795 -5.059 -15.910 685 H LYS 90 H LYS 90 -0.642 -7.670 -12.552 686 HA LYS 90 HA LYS 90 -1.173 -4.963 -11.193 687 HB2 LYS 90 HB2 LYS 90 -2.883 -6.674 -13.049 688 HB3 LYS 90 HB3 LYS 90 -3.410 -5.146 -12.389 689 HG2 LYS 90 HG2 LYS 90 -1.798 -3.867 -13.704 690 HG3 LYS 90 HG3 LYS 90 -0.899 -5.317 -14.164 691 HD2 LYS 90 HD2 LYS 90 -2.961 -6.221 -15.335 692 HD3 LYS 90 HD3 LYS 90 -3.835 -4.748 -15.003 693 HE2 LYS 90 HE2 LYS 90 -1.212 -4.953 -16.664 694 HE3 LYS 90 HE3 LYS 90 -2.838 -5.026 -17.344 695 HZ1 LYS 90 HZ1 LYS 90 -2.027 -2.686 -17.455 696 HZ2 LYS 90 HZ2 LYS 90 -1.671 -2.610 -15.850 697 HZ3 LYS 90 HZ3 LYS 90 -3.239 -2.725 -16.336 698 H LEU 91 H LEU 91 -1.614 -5.217 -9.075 699 HA LEU 91 HA LEU 91 -3.469 -7.467 -8.096 700 HB2 LEU 91 HB2 LEU 91 -1.490 -5.610 -6.711 701 HB3 LEU 91 HB3 LEU 91 -2.639 -6.499 -5.785 702 HG LEU 91 HG LEU 91 -0.571 -7.827 -7.631 703 HD11 LEU 91 HD11 LEU 91 0.500 -6.559 -5.744 704 HD12 LEU 91 HD12 LEU 91 0.660 -8.302 -5.470 705 HD13 LEU 91 HD13 LEU 91 -0.565 -7.359 -4.578 706 HD21 LEU 91 HD21 LEU 91 -2.575 -9.323 -7.131 707 HD22 LEU 91 HD22 LEU 91 -2.302 -9.103 -5.391 708 HD23 LEU 91 HD23 LEU 91 -1.088 -9.930 -6.377 709 H VAL 92 H VAL 92 -5.569 -6.898 -8.010 710 HA VAL 92 HA VAL 92 -6.337 -4.024 -7.241 711 HB VAL 92 HB VAL 92 -8.384 -4.253 -8.483 712 HG11 VAL 92 HG11 VAL 92 -6.019 -4.946 -10.326 713 HG12 VAL 92 HG12 VAL 92 -7.492 -4.049 -10.763 714 HG13 VAL 92 HG13 VAL 92 -6.317 -3.345 -9.630 715 HG21 VAL 92 HG21 VAL 92 -8.845 -6.082 -10.131 716 HG22 VAL 92 HG22 VAL 92 -7.460 -7.012 -9.513 717 HG23 VAL 92 HG23 VAL 92 -8.868 -6.699 -8.471 718 H THR 93 H THR 93 -7.368 -3.652 -5.372 719 HA THR 93 HA THR 93 -9.286 -5.761 -4.303 720 HB THR 93 HB THR 93 -7.017 -6.084 -3.269 721 HG1 THR 93 HG1 THR 93 -8.775 -6.954 -2.323 722 HG21 THR 93 HG21 THR 93 -6.218 -3.801 -2.711 723 HG22 THR 93 HG22 THR 93 -6.405 -4.752 -1.228 724 HG23 THR 93 HG23 THR 93 -7.622 -3.530 -1.636 725 H THR 94 H THR 94 -10.391 -4.993 -2.305 726 HA THR 94 HA THR 94 -11.614 -2.202 -2.753 727 HB THR 94 HB THR 94 -13.204 -4.721 -1.978 728 HG1 THR 94 HG1 THR 94 -14.180 -4.433 -3.954 729 HG21 THR 94 HG21 THR 94 -14.201 -2.605 -1.016 730 HG22 THR 94 HG22 THR 94 -15.232 -3.271 -2.294 731 HG23 THR 94 HG23 THR 94 -14.202 -1.857 -2.631 732 H PHE 95 H PHE 95 -10.640 -1.171 -1.097 733 HA PHE 95 HA PHE 95 -10.080 -2.554 1.547 734 HB2 PHE 95 HB2 PHE 95 -8.508 -1.024 -0.083 735 HB3 PHE 95 HB3 PHE 95 -9.333 0.277 0.696 736 HD1 PHE 95 HD2 PHE 95 -7.149 -2.661 1.208 737 HD2 PHE 95 HD1 PHE 95 -8.473 1.064 2.889 738 HE1 PHE 95 HE2 PHE 95 -5.442 -2.844 2.972 739 HE2 PHE 95 HE1 PHE 95 -6.738 0.899 4.608 740 HZ PHE 95 HZ PHE 95 -5.243 -1.076 4.695 741 H LYS 96 H LYS 96 -10.318 0.404 2.735 742 HA LYS 96 HA LYS 96 -13.170 0.104 3.767 743 HB2 LYS 96 HB2 LYS 96 -11.052 2.246 4.389 744 HB3 LYS 96 HB3 LYS 96 -12.605 2.146 5.162 745 HG2 LYS 96 HG2 LYS 96 -10.455 -0.058 5.361 746 HG3 LYS 96 HG3 LYS 96 -10.560 1.296 6.449 747 HD2 LYS 96 HD2 LYS 96 -12.810 -0.803 6.122 748 HD3 LYS 96 HD3 LYS 96 -11.514 -0.881 7.304 749 HE2 LYS 96 HE2 LYS 96 -12.293 1.436 8.217 750 HE3 LYS 96 HE3 LYS 96 -13.737 1.256 7.221 751 HZ1 LYS 96 HZ1 LYS 96 -12.822 -0.796 9.319 752 HZ2 LYS 96 HZ2 LYS 96 -14.193 -0.927 8.426 753 HZ3 LYS 96 HZ3 LYS 96 -13.993 0.239 9.578 754 H ASN 97 H ASN 97 -14.305 0.465 1.737 755 HA ASN 97 HA ASN 97 -15.055 1.515 -0.203 756 HB2 ASN 97 HB2 ASN 97 -15.127 3.922 1.697 757 HB3 ASN 97 HB3 ASN 97 -15.971 3.780 0.179 758 HD21 ASN 97 HD21 ASN 97 -17.903 2.569 0.085 759 HD22 ASN 97 HD22 ASN 97 -18.634 1.893 1.635 760 H ILE 98 H ILE 98 -12.257 1.356 -0.218 761 HA ILE 98 HA ILE 98 -11.519 3.592 -2.215 762 HB ILE 98 HB ILE 98 -9.684 2.163 -0.212 763 HG12 ILE 98 HG12 ILE 98 -9.974 5.180 0.014 764 HG13 ILE 98 HG13 ILE 98 -11.317 4.244 0.598 765 HG21 ILE 98 HG21 ILE 98 -8.389 2.763 -2.255 766 HG22 ILE 98 HG22 ILE 98 -8.932 4.452 -2.139 767 HG23 ILE 98 HG23 ILE 98 -7.874 3.751 -0.888 768 HD11 ILE 98 HD11 ILE 98 -9.942 2.983 2.192 769 HD12 ILE 98 HD12 ILE 98 -8.441 3.706 1.575 770 HD13 ILE 98 HD13 ILE 98 -9.645 4.720 2.412 771 H LYS 99 H LYS 99 -10.810 2.822 -4.165 772 HA LYS 99 HA LYS 99 -10.531 -0.207 -4.553 773 HB2 LYS 99 HB2 LYS 99 -12.156 1.058 -5.998 774 HB3 LYS 99 HB3 LYS 99 -10.858 1.962 -6.681 775 HG2 LYS 99 HG2 LYS 99 -10.458 0.346 -8.216 776 HG3 LYS 99 HG3 LYS 99 -10.003 -0.804 -6.998 777 HD2 LYS 99 HD2 LYS 99 -12.838 -0.292 -8.096 778 HD3 LYS 99 HD3 LYS 99 -11.824 -1.648 -8.508 779 HE2 LYS 99 HE2 LYS 99 -13.023 -1.120 -5.688 780 HE3 LYS 99 HE3 LYS 99 -13.721 -2.185 -6.895 781 HZ1 LYS 99 HZ1 LYS 99 -11.640 -3.582 -6.789 782 HZ2 LYS 99 HZ2 LYS 99 -12.331 -3.448 -5.285 783 HZ3 LYS 99 HZ3 LYS 99 -10.992 -2.592 -5.642 784 H SER 100 H SER 100 -8.547 -0.767 -3.975 785 HA SER 100 HA SER 100 -6.124 0.990 -4.497 786 HB2 SER 100 HB2 SER 100 -6.511 0.038 -2.225 787 HB3 SER 100 HB3 SER 100 -6.372 -1.594 -2.862 788 HG SER 100 HG SER 100 -4.227 -1.108 -3.499 789 H VAL 101 H VAL 101 -5.101 0.770 -6.327 790 HA VAL 101 HA VAL 101 -4.920 -1.949 -7.771 791 HB VAL 101 HB VAL 101 -4.860 0.917 -8.895 792 HG11 VAL 101 HG11 VAL 101 -3.404 -0.540 -10.295 793 HG12 VAL 101 HG12 VAL 101 -4.694 -1.752 -10.450 794 HG13 VAL 101 HG13 VAL 101 -4.877 -0.132 -11.178 795 HG21 VAL 101 HG21 VAL 101 -7.009 0.336 -10.061 796 HG22 VAL 101 HG22 VAL 101 -7.059 -1.237 -9.228 797 HG23 VAL 101 HG23 VAL 101 -7.198 0.272 -8.303 798 H THR 102 H THR 102 -2.965 -2.822 -7.236 799 HA THR 102 HA THR 102 -0.514 -1.012 -7.088 800 HB THR 102 HB THR 102 -0.439 -3.906 -6.202 801 HG1 THR 102 HG1 THR 102 -0.912 -1.770 -4.401 802 HG21 THR 102 HG21 THR 102 1.195 -1.468 -5.263 803 HG22 THR 102 HG22 THR 102 1.733 -2.651 -6.476 804 HG23 THR 102 HG23 THR 102 1.439 -3.175 -4.814 805 H GLU 103 H GLU 103 0.714 -0.892 -8.979 806 HA GLU 103 HA GLU 103 0.622 -3.320 -10.852 807 HB2 GLU 103 HB2 GLU 103 -0.508 -1.181 -11.744 808 HB3 GLU 103 HB3 GLU 103 1.107 -0.499 -11.850 809 HG2 GLU 103 HG2 GLU 103 1.857 -2.331 -13.402 810 HG3 GLU 103 HG3 GLU 103 0.322 -3.154 -13.234 811 H LEU 104 H LEU 104 2.433 -4.222 -11.324 812 HA LEU 104 HA LEU 104 5.112 -2.976 -10.533 813 HB2 LEU 104 HB2 LEU 104 4.091 -5.501 -9.958 814 HB3 LEU 104 HB3 LEU 104 5.011 -5.875 -11.387 815 HG LEU 104 HG LEU 104 6.032 -4.557 -8.792 816 HD11 LEU 104 HD11 LEU 104 5.489 -7.041 -8.712 817 HD12 LEU 104 HD12 LEU 104 7.208 -6.712 -8.467 818 HD13 LEU 104 HD13 LEU 104 6.635 -7.329 -10.031 819 HD21 LEU 104 HD21 LEU 104 7.674 -5.302 -11.307 820 HD22 LEU 104 HD22 LEU 104 8.373 -4.838 -9.735 821 HD23 LEU 104 HD23 LEU 104 7.437 -3.666 -10.666 822 H ASN 105 H ASN 105 6.195 -1.974 -12.095 823 HA ASN 105 HA ASN 105 5.874 -2.853 -15.056 824 HB2 ASN 105 HB2 ASN 105 6.387 -0.071 -13.831 825 HB3 ASN 105 HB3 ASN 105 6.732 -0.449 -15.499 826 HD21 ASN 105 HD21 ASN 105 4.031 -0.339 -13.212 827 HD22 ASN 105 HD22 ASN 105 2.768 -0.203 -14.542 828 H GLY 106 H GLY 106 7.355 -4.534 -14.641 829 HA2 GLY 106 HA2 GLY 106 9.576 -5.437 -15.167 830 HA3 GLY 106 HA3 GLY 106 10.247 -3.819 -15.226 831 H ASP 107 H ASP 107 11.084 -2.970 -13.346 832 HA ASP 107 HA ASP 107 10.855 -4.532 -10.710 833 HB2 ASP 107 HB2 ASP 107 13.475 -3.513 -11.970 834 HB3 ASP 107 HB3 ASP 107 13.329 -3.930 -10.278 835 H ILE 108 H ILE 108 9.471 -2.090 -11.695 836 HA ILE 108 HA ILE 108 9.903 -0.494 -9.143 837 HB ILE 108 HB ILE 108 9.389 1.547 -10.010 838 HG12 ILE 108 HG12 ILE 108 9.553 1.701 -12.736 839 HG13 ILE 108 HG13 ILE 108 8.687 0.195 -12.626 840 HG21 ILE 108 HG21 ILE 108 11.645 0.385 -11.721 841 HG22 ILE 108 HG22 ILE 108 11.398 2.106 -11.319 842 HG23 ILE 108 HG23 ILE 108 11.760 0.942 -10.036 843 HD11 ILE 108 HD11 ILE 108 6.909 1.365 -11.170 844 HD12 ILE 108 HD12 ILE 108 7.834 2.876 -11.309 845 HD13 ILE 108 HD13 ILE 108 7.098 2.140 -12.759 846 H ILE 109 H ILE 109 8.116 -0.233 -7.915 847 HA ILE 109 HA ILE 109 5.516 -1.415 -8.993 848 HB ILE 109 HB ILE 109 6.698 -2.778 -7.220 849 HG12 ILE 109 HG12 ILE 109 3.919 -1.840 -6.329 850 HG13 ILE 109 HG13 ILE 109 4.176 -2.855 -7.740 851 HG21 ILE 109 HG21 ILE 109 7.524 -0.908 -5.710 852 HG22 ILE 109 HG22 ILE 109 5.855 -0.578 -5.205 853 HG23 ILE 109 HG23 ILE 109 6.623 -2.131 -4.814 854 HD11 ILE 109 HD11 ILE 109 3.590 -4.252 -5.752 855 HD12 ILE 109 HD12 ILE 109 5.227 -4.661 -6.328 856 HD13 ILE 109 HD13 ILE 109 5.005 -3.659 -4.875 857 H THR 110 H THR 110 3.739 -0.237 -8.980 858 HA THR 110 HA THR 110 3.745 2.362 -7.373 859 HB THR 110 HB THR 110 3.766 2.552 -9.932 860 HG1 THR 110 HG1 THR 110 2.905 4.071 -8.070 861 HG21 THR 110 HG21 THR 110 1.683 2.645 -11.163 862 HG22 THR 110 HG22 THR 110 0.749 2.101 -9.746 863 HG23 THR 110 HG23 THR 110 1.914 0.997 -10.516 864 H ASN 111 H ASN 111 2.191 2.713 -5.944 865 HA ASN 111 HA ASN 111 -0.111 0.672 -5.736 866 HB2 ASN 111 HB2 ASN 111 1.578 0.575 -3.814 867 HB3 ASN 111 HB3 ASN 111 1.055 2.179 -3.334 868 HD21 ASN 111 HD21 ASN 111 -0.810 2.227 -2.045 869 HD22 ASN 111 HD22 ASN 111 -1.897 0.758 -1.820 870 H THR 112 H THR 112 -1.789 1.613 -6.691 871 HA THR 112 HA THR 112 -2.266 4.626 -6.373 872 HB THR 112 HB THR 112 -3.407 2.751 -8.497 873 HG1 THR 112 HG1 THR 112 -1.085 2.995 -8.454 874 HG21 THR 112 HG21 THR 112 -3.764 4.856 -9.790 875 HG22 THR 112 HG22 THR 112 -3.092 5.828 -8.460 876 HG23 THR 112 HG23 THR 112 -4.635 4.961 -8.243 877 H MET 113 H MET 113 -3.419 4.816 -4.558 878 HA MET 113 HA MET 113 -5.878 3.081 -3.994 879 HB2 MET 113 HB2 MET 113 -4.341 5.091 -2.297 880 HB3 MET 113 HB3 MET 113 -5.953 4.583 -1.860 881 HG2 MET 113 HG2 MET 113 -5.156 2.122 -1.970 882 HG3 MET 113 HG3 MET 113 -3.503 2.746 -2.087 883 HE1 MET 113 HE1 MET 113 -4.653 1.442 1.678 884 HE2 MET 113 HE2 MET 113 -5.390 0.972 0.127 885 HE3 MET 113 HE3 MET 113 -3.607 0.996 0.299 886 H THR 114 H THR 114 -7.422 3.635 -5.276 887 HA THR 114 HA THR 114 -8.066 6.527 -5.929 888 HB THR 114 HB THR 114 -9.592 5.702 -7.638 889 HG1 THR 114 HG1 THR 114 -8.739 3.134 -6.745 890 HG21 THR 114 HG21 THR 114 -7.186 6.022 -8.291 891 HG22 THR 114 HG22 THR 114 -7.981 4.733 -9.224 892 HG23 THR 114 HG23 THR 114 -6.859 4.311 -7.910 893 H LEU 115 H LEU 115 -9.289 7.577 -4.588 894 HA LEU 115 HA LEU 115 -11.777 6.273 -3.286 895 HB2 LEU 115 HB2 LEU 115 -10.038 6.796 -1.647 896 HB3 LEU 115 HB3 LEU 115 -9.846 8.422 -2.258 897 HG LEU 115 HG LEU 115 -12.138 9.046 -1.460 898 HD11 LEU 115 HD11 LEU 115 -12.233 6.220 -0.197 899 HD12 LEU 115 HD12 LEU 115 -13.298 6.814 -1.487 900 HD13 LEU 115 HD13 LEU 115 -13.376 7.540 0.125 901 HD21 LEU 115 HD21 LEU 115 -10.117 9.434 -0.034 902 HD22 LEU 115 HD22 LEU 115 -10.292 7.820 0.692 903 HD23 LEU 115 HD23 LEU 115 -11.532 9.069 0.969 904 H GLY 116 H GLY 116 -12.681 6.721 -5.421 905 HA2 GLY 116 HA2 GLY 116 -14.329 7.945 -6.717 906 HA3 GLY 116 HA3 GLY 116 -14.392 9.170 -5.471 907 H ASP 117 H ASP 117 -12.970 10.877 -5.614 908 HA ASP 117 HA ASP 117 -11.805 11.539 -8.379 909 HB2 ASP 117 HB2 ASP 117 -12.580 13.406 -6.038 910 HB3 ASP 117 HB3 ASP 117 -11.793 13.932 -7.514 911 H ILE 118 H ILE 118 -10.842 10.935 -5.070 912 HA ILE 118 HA ILE 118 -8.159 12.296 -5.272 913 HB ILE 118 HB ILE 118 -9.202 10.386 -3.130 914 HG12 ILE 118 HG12 ILE 118 -10.725 12.312 -3.121 915 HG13 ILE 118 HG13 ILE 118 -9.842 12.085 -1.638 916 HG21 ILE 118 HG21 ILE 118 -6.824 12.380 -3.012 917 HG22 ILE 118 HG22 ILE 118 -7.420 11.396 -1.665 918 HG23 ILE 118 HG23 ILE 118 -6.692 10.609 -3.067 919 HD11 ILE 118 HD11 ILE 118 -9.111 14.248 -3.725 920 HD12 ILE 118 HD12 ILE 118 -10.065 14.509 -2.238 921 HD13 ILE 118 HD13 ILE 118 -8.365 14.028 -2.114 922 H VAL 119 H VAL 119 -6.546 11.310 -6.352 923 HA VAL 119 HA VAL 119 -6.336 8.236 -6.461 924 HB VAL 119 HB VAL 119 -5.221 10.345 -8.395 925 HG11 VAL 119 HG11 VAL 119 -3.794 8.292 -8.402 926 HG12 VAL 119 HG12 VAL 119 -5.230 7.266 -8.653 927 HG13 VAL 119 HG13 VAL 119 -4.707 8.411 -9.911 928 HG21 VAL 119 HG21 VAL 119 -7.611 8.401 -8.801 929 HG22 VAL 119 HG22 VAL 119 -7.723 10.166 -8.655 930 HG23 VAL 119 HG23 VAL 119 -6.909 9.458 -10.054 931 H PHE 120 H PHE 120 -5.259 7.916 -4.478 932 HA PHE 120 HA PHE 120 -2.691 9.404 -3.856 933 HB2 PHE 120 HB2 PHE 120 -4.040 9.014 -1.978 934 HB3 PHE 120 HB3 PHE 120 -4.310 7.335 -2.347 935 HD1 PHE 120 HD2 PHE 120 -1.051 9.336 -2.105 936 HD2 PHE 120 HD1 PHE 120 -3.402 6.093 -0.528 937 HE1 PHE 120 HE2 PHE 120 0.865 8.566 -0.809 938 HE2 PHE 120 HE1 PHE 120 -1.462 5.331 0.765 939 HZ PHE 120 HZ PHE 120 0.688 6.563 0.626 940 H LYS 121 H LYS 121 -1.235 8.949 -5.362 941 HA LYS 121 HA LYS 121 -0.554 6.043 -5.995 942 HB2 LYS 121 HB2 LYS 121 -1.308 7.665 -7.777 943 HB3 LYS 121 HB3 LYS 121 0.182 8.555 -7.560 944 HG2 LYS 121 HG2 LYS 121 1.519 6.479 -8.169 945 HG3 LYS 121 HG3 LYS 121 0.018 5.575 -8.367 946 HD2 LYS 121 HD2 LYS 121 -0.732 7.238 -10.150 947 HD3 LYS 121 HD3 LYS 121 0.775 8.129 -9.945 948 HE2 LYS 121 HE2 LYS 121 2.097 6.025 -10.620 949 HE3 LYS 121 HE3 LYS 121 0.579 5.149 -10.837 950 HZ1 LYS 121 HZ1 LYS 121 1.285 7.693 -12.315 951 HZ2 LYS 121 HZ2 LYS 121 -0.091 6.843 -12.542 952 HZ3 LYS 121 HZ3 LYS 121 1.353 6.189 -12.994 953 H ARG 122 H ARG 122 0.993 5.190 -4.830 954 HA ARG 122 HA ARG 122 3.600 6.689 -4.216 955 HB2 ARG 122 HB2 ARG 122 2.544 3.900 -3.421 956 HB3 ARG 122 HB3 ARG 122 4.245 4.257 -3.363 957 HG2 ARG 122 HG2 ARG 122 3.775 6.263 -1.836 958 HG3 ARG 122 HG3 ARG 122 2.097 5.713 -1.706 959 HD2 ARG 122 HD2 ARG 122 2.891 3.485 -0.805 960 HD3 ARG 122 HD3 ARG 122 4.561 3.932 -1.129 961 HE ARG 122 HE ARG 122 3.503 5.969 0.668 962 HH11 ARG 122 HH11 ARG 122 4.677 2.640 0.656 963 HH12 ARG 122 HH12 ARG 122 5.251 2.825 2.394 964 HH21 ARG 122 HH21 ARG 122 4.129 6.051 2.607 965 HH22 ARG 122 HH22 ARG 122 4.934 4.617 3.437 966 H ILE 123 H ILE 123 5.516 6.248 -5.223 967 HA ILE 123 HA ILE 123 5.675 4.028 -7.347 968 HB ILE 123 HB ILE 123 6.929 6.823 -7.593 969 HG12 ILE 123 HG12 ILE 123 5.429 6.726 -9.861 970 HG13 ILE 123 HG13 ILE 123 4.436 5.633 -8.931 971 HG21 ILE 123 HG21 ILE 123 6.973 4.448 -9.576 972 HG22 ILE 123 HG22 ILE 123 7.657 6.066 -9.876 973 HG23 ILE 123 HG23 ILE 123 8.359 5.035 -8.627 974 HD11 ILE 123 HD11 ILE 123 3.565 7.970 -8.817 975 HD12 ILE 123 HD12 ILE 123 4.125 7.556 -7.190 976 HD13 ILE 123 HD13 ILE 123 5.120 8.585 -8.236 977 H SER 124 H SER 124 6.893 2.527 -6.384 978 HA SER 124 HA SER 124 9.429 3.339 -4.835 979 HB2 SER 124 HB2 SER 124 7.471 0.995 -4.294 980 HB3 SER 124 HB3 SER 124 8.961 1.300 -3.402 981 HG SER 124 HG SER 124 6.525 2.355 -2.965 982 H LYS 125 H LYS 125 11.316 2.149 -5.166 983 HA LYS 125 HA LYS 125 11.318 0.415 -7.691 984 HB2 LYS 125 HB2 LYS 125 12.555 2.531 -7.818 985 HB3 LYS 125 HB3 LYS 125 13.570 2.093 -6.443 986 HG2 LYS 125 HG2 LYS 125 14.671 0.317 -7.640 987 HG3 LYS 125 HG3 LYS 125 13.428 0.199 -8.863 988 HD2 LYS 125 HD2 LYS 125 14.109 2.700 -9.516 989 HD3 LYS 125 HD3 LYS 125 15.563 2.400 -8.589 990 HE2 LYS 125 HE2 LYS 125 14.496 0.721 -10.996 991 HE3 LYS 125 HE3 LYS 125 15.718 1.975 -11.134 992 HZ1 LYS 125 HZ1 LYS 125 16.053 -0.538 -9.479 993 HZ2 LYS 125 HZ2 LYS 125 17.200 0.619 -9.620 994 HZ3 LYS 125 HZ3 LYS 125 16.779 -0.288 -10.929 995 H ARG 126 H ARG 126 12.099 -1.642 -7.676 996 HA ARG 126 HA ARG 126 12.177 -3.175 -5.264 997 HB2 ARG 126 HB2 ARG 126 11.662 -3.835 -7.717 998 HB3 ARG 126 HB3 ARG 126 13.392 -3.919 -7.990 999 HG2 ARG 126 HG2 ARG 126 13.510 -5.735 -6.143 1000 HG3 ARG 126 HG3 ARG 126 11.756 -5.591 -5.964 1001 HD2 ARG 126 HD2 ARG 126 11.627 -6.031 -8.572 1002 HD3 ARG 126 HD3 ARG 126 13.333 -6.478 -8.473 1003 HE ARG 126 HE ARG 126 11.924 -8.073 -6.467 1004 HH11 ARG 126 HH11 ARG 126 11.990 -7.765 -10.014 1005 HH12 ARG 126 HH12 ARG 126 11.241 -9.441 -10.141 1006 HH21 ARG 126 HH21 ARG 126 11.132 -9.879 -6.741 1007 HH22 ARG 126 HH22 ARG 126 10.719 -10.548 -8.410 1008 H ILE 127 H ILE 127 13.655 -3.589 -3.802 1009 HA ILE 127 HA ILE 127 16.620 -3.558 -4.359 1010 HB ILE 127 HB ILE 127 15.100 -1.707 -2.439 1011 HG12 ILE 127 HG12 ILE 127 17.511 -1.249 -4.283 1012 HG13 ILE 127 HG13 ILE 127 15.840 -0.866 -4.657 1013 HG21 ILE 127 HG21 ILE 127 18.003 -2.513 -1.905 1014 HG22 ILE 127 HG22 ILE 127 17.073 -1.227 -1.068 1015 HG23 ILE 127 HG23 ILE 127 16.587 -2.917 -0.901 1016 HD11 ILE 127 HD11 ILE 127 15.755 0.801 -2.762 1017 HD12 ILE 127 HD12 ILE 127 17.493 0.544 -2.481 1018 HD13 ILE 127 HD13 ILE 127 16.932 1.212 -4.029 1019 H21 OLA 128 H21 OLA 128 4.042 9.401 15.089 1020 H22 OLA 128 H22 OLA 128 5.014 8.204 14.266 1021 H31 OLA 128 H31 OLA 128 3.799 10.671 12.825 1022 H32 OLA 128 H32 OLA 128 2.914 9.165 13.035 1023 H41 OLA 128 H41 OLA 128 4.683 7.918 11.734 1024 H42 OLA 128 H42 OLA 128 5.595 9.415 11.551 1025 H51 OLA 128 H51 OLA 128 4.421 9.121 9.487 1026 H52 OLA 128 H52 OLA 128 3.609 10.438 10.310 1027 H61 OLA 128 H61 OLA 128 1.788 8.836 11.067 1028 H62 OLA 128 H62 OLA 128 2.638 7.496 10.301 1029 H71 OLA 128 H71 OLA 128 2.381 8.599 8.044 1030 H72 OLA 128 H72 OLA 128 1.575 9.981 8.798 1031 H81 OLA 128 H81 OLA 128 -0.257 8.425 9.659 1032 H82 OLA 128 H82 OLA 128 0.537 7.057 8.891 1033 H9 OLA 128 H9 OLA 128 -0.863 9.454 7.513 1034 H10 OLA 128 H10 OLA 128 -0.898 8.257 5.554 1035 H111 OLA 128 H111 OLA 128 0.096 5.751 6.888 1036 H112 OLA 128 H112 OLA 128 1.441 6.636 6.163 1037 H121 OLA 128 H121 OLA 128 0.258 6.623 3.938 1038 H122 OLA 128 H122 OLA 128 -1.124 5.791 4.646 1039 H131 OLA 128 H131 OLA 128 0.268 3.770 5.107 1040 H132 OLA 128 H132 OLA 128 1.730 4.604 4.564 1041 H141 OLA 128 H141 OLA 128 0.739 4.914 2.274 1042 H142 OLA 128 H142 OLA 128 -0.748 4.118 2.776 1043 H151 OLA 128 H151 OLA 128 0.544 1.973 3.193 1044 H152 OLA 128 H152 OLA 128 2.035 2.785 2.728 1045 H161 OLA 128 H161 OLA 128 0.968 3.315 0.448 1046 H162 OLA 128 H162 OLA 128 -0.436 2.367 0.898 1047 H171 OLA 128 H171 OLA 128 2.435 1.194 0.873 1048 H172 OLA 128 H172 OLA 128 1.424 1.239 -0.552 1049 H181 OLA 128 H181 OLA 128 1.287 -0.991 0.627 1050 H182 OLA 128 H182 OLA 128 0.573 -0.213 2.050 1051 H183 OLA 128 H183 OLA 128 -0.303 -0.220 0.496 1052 H21 OLA 129 H21 OLA 129 5.454 -0.749 -2.206 1053 H22 OLA 129 H22 OLA 129 4.286 -0.209 -3.398 1054 H31 OLA 129 H31 OLA 129 2.394 -0.487 -1.825 1055 H32 OLA 129 H32 OLA 129 3.483 -0.801 -0.478 1056 H41 OLA 129 H41 OLA 129 4.318 -2.881 -1.590 1057 H42 OLA 129 H42 OLA 129 3.252 -2.617 -2.966 1058 H51 OLA 129 H51 OLA 129 2.241 -2.976 -0.059 1059 H52 OLA 129 H52 OLA 129 2.478 -4.321 -1.157 1060 H61 OLA 129 H61 OLA 129 0.789 -3.449 -2.741 1061 H62 OLA 129 H62 OLA 129 0.610 -1.963 -1.812 1062 H71 OLA 129 H71 OLA 129 -0.285 -3.255 0.142 1063 H72 OLA 129 H72 OLA 129 -0.082 -4.774 -0.735 1064 H81 OLA 129 H81 OLA 129 -1.689 -4.028 -2.509 1065 H82 OLA 129 H82 OLA 129 -1.836 -2.440 -1.784 1066 H9 OLA 129 H9 OLA 129 -3.118 -5.048 -0.863 1067 H10 OLA 129 H10 OLA 129 -4.228 -3.906 0.820 1068 H111 OLA 129 H111 OLA 129 -4.101 -1.424 0.899 1069 H112 OLA 129 H112 OLA 129 -2.512 -1.391 0.155 1070 H121 OLA 129 H121 OLA 129 -1.471 -2.448 2.170 1071 H122 OLA 129 H122 OLA 129 -3.051 -2.714 2.904 1072 H131 OLA 129 H131 OLA 129 -3.421 -0.178 2.912 1073 H132 OLA 129 H132 OLA 129 -1.776 0.045 2.342 1074 H141 OLA 129 H141 OLA 129 -0.950 -1.238 4.419 1075 H142 OLA 129 H142 OLA 129 -2.612 -1.365 4.964 1076 H151 OLA 129 H151 OLA 129 -0.927 1.205 4.728 1077 H152 OLA 129 H152 OLA 129 -1.488 0.401 6.169 1078 H161 OLA 129 H161 OLA 129 -3.120 1.994 6.185 1079 H162 OLA 129 H162 OLA 129 -3.951 0.885 5.116 1080 H171 OLA 129 H171 OLA 129 -2.817 2.216 3.122 1081 H172 OLA 129 H172 OLA 129 -2.305 3.378 4.340 1082 H181 OLA 129 H181 OLA 129 -4.428 4.137 3.259 1083 H182 OLA 129 H182 OLA 129 -5.249 2.627 3.709 1084 H183 OLA 129 H183 OLA 129 -4.756 3.781 4.969 Start of MODEL 9 1 H1 SER 2 H1 SER 2 6.514 -11.279 -11.535 2 H2 SER 2 H2 SER 2 5.775 -10.268 -10.518 3 HA SER 2 HA SER 2 7.107 -12.009 -9.432 4 HB2 SER 2 HB2 SER 2 8.894 -12.031 -11.192 5 HB3 SER 2 HB3 SER 2 9.395 -10.407 -10.715 6 HG SER 2 HG SER 2 9.492 -12.797 -9.171 7 H PHE 3 H PHE 3 6.245 -11.214 -7.651 8 HA PHE 3 HA PHE 3 6.753 -8.389 -6.668 9 HB2 PHE 3 HB2 PHE 3 4.815 -10.616 -5.790 10 HB3 PHE 3 HB3 PHE 3 5.009 -9.165 -4.862 11 HD1 PHE 3 HD2 PHE 3 4.291 -6.943 -5.720 12 HD2 PHE 3 HD1 PHE 3 3.688 -10.511 -8.050 13 HE1 PHE 3 HE2 PHE 3 2.618 -5.770 -7.121 14 HE2 PHE 3 HE1 PHE 3 2.011 -9.334 -9.394 15 HZ PHE 3 HZ PHE 3 1.451 -6.970 -8.906 16 H SER 4 H SER 4 8.497 -11.190 -5.942 17 HA SER 4 HA SER 4 8.941 -10.653 -3.080 18 HB2 SER 4 HB2 SER 4 10.569 -12.343 -5.044 19 HB3 SER 4 HB3 SER 4 10.929 -12.215 -3.319 20 HG SER 4 HG SER 4 9.505 -13.972 -3.853 21 H GLY 5 H GLY 5 9.913 -8.907 -2.236 22 HA2 GLY 5 HA2 GLY 5 12.673 -8.128 -2.617 23 HA3 GLY 5 HA3 GLY 5 11.741 -7.124 -3.728 24 H LYS 6 H LYS 6 13.223 -5.933 -1.939 25 HA LYS 6 HA LYS 6 11.358 -4.788 0.248 26 HB2 LYS 6 HB2 LYS 6 14.400 -4.812 -0.062 27 HB3 LYS 6 HB3 LYS 6 13.578 -3.858 1.142 28 HG2 LYS 6 HG2 LYS 6 12.651 -5.900 2.267 29 HG3 LYS 6 HG3 LYS 6 13.363 -6.933 1.028 30 HD2 LYS 6 HD2 LYS 6 15.672 -6.068 1.633 31 HD3 LYS 6 HD3 LYS 6 14.997 -5.089 2.918 32 HE2 LYS 6 HE2 LYS 6 14.772 -8.192 2.756 33 HE3 LYS 6 HE3 LYS 6 16.060 -7.341 3.605 34 HZ1 LYS 6 HZ1 LYS 6 13.095 -7.318 4.314 35 HZ2 LYS 6 HZ2 LYS 6 14.131 -6.193 4.932 36 HZ3 LYS 6 HZ3 LYS 6 14.344 -7.798 5.265 37 H TYR 7 H TYR 7 10.240 -3.415 -1.177 38 HA TYR 7 HA TYR 7 11.718 -1.895 -3.315 39 HB2 TYR 7 HB2 TYR 7 8.700 -1.877 -2.643 40 HB3 TYR 7 HB3 TYR 7 9.424 -1.106 -4.016 41 HD1 TYR 7 HD2 TYR 7 8.865 -4.528 -2.487 42 HD2 TYR 7 HD1 TYR 7 9.575 -2.304 -6.103 43 HE1 TYR 7 HE2 TYR 7 8.520 -6.557 -3.809 44 HE2 TYR 7 HE1 TYR 7 9.173 -4.341 -7.418 45 HH TYR 7 HH TYR 7 8.852 -6.572 -7.343 46 H GLN 8 H GLN 8 12.783 -0.067 -2.692 47 HA GLN 8 HA GLN 8 11.766 1.605 -0.431 48 HB2 GLN 8 HB2 GLN 8 14.243 1.169 -0.875 49 HB3 GLN 8 HB3 GLN 8 14.140 2.325 -2.205 50 HG2 GLN 8 HG2 GLN 8 13.305 4.096 -0.538 51 HG3 GLN 8 HG3 GLN 8 13.437 2.911 0.758 52 HE21 GLN 8 HE21 GLN 8 14.630 4.948 1.414 53 HE22 GLN 8 HE22 GLN 8 16.443 4.890 1.062 54 H LEU 9 H LEU 9 10.795 3.489 -0.424 55 HA LEU 9 HA LEU 9 9.196 4.315 -2.742 56 HB2 LEU 9 HB2 LEU 9 8.371 4.363 -0.437 57 HB3 LEU 9 HB3 LEU 9 9.576 5.546 0.029 58 HG LEU 9 HG LEU 9 8.491 7.271 -1.474 59 HD11 LEU 9 HD11 LEU 9 6.160 6.803 -2.373 60 HD12 LEU 9 HD12 LEU 9 6.372 5.075 -1.978 61 HD13 LEU 9 HD13 LEU 9 7.393 5.846 -3.199 62 HD21 LEU 9 HD21 LEU 9 7.887 7.108 0.945 63 HD22 LEU 9 HD22 LEU 9 6.606 5.935 0.571 64 HD23 LEU 9 HD23 LEU 9 6.492 7.611 -0.017 65 H GLN 10 H GLN 10 9.469 5.760 -4.233 66 HA GLN 10 HA GLN 10 11.781 7.772 -4.120 67 HB2 GLN 10 HB2 GLN 10 10.370 6.461 -6.516 68 HB3 GLN 10 HB3 GLN 10 11.613 7.681 -6.654 69 HG2 GLN 10 HG2 GLN 10 12.103 4.987 -5.206 70 HG3 GLN 10 HG3 GLN 10 12.228 5.202 -6.924 71 HE21 GLN 10 HE21 GLN 10 14.440 4.437 -6.399 72 HE22 GLN 10 HE22 GLN 10 15.693 5.685 -5.898 73 H SER 11 H SER 11 8.587 7.542 -5.682 74 HA SER 11 HA SER 11 8.099 10.513 -4.975 75 HB2 SER 11 HB2 SER 11 8.536 10.176 -7.413 76 HB3 SER 11 HB3 SER 11 7.200 9.036 -7.517 77 HG SER 11 HG SER 11 7.100 11.819 -6.949 78 H GLN 12 H GLN 12 6.219 11.072 -4.065 79 HA GLN 12 HA GLN 12 4.007 8.995 -3.641 80 HB2 GLN 12 HB2 GLN 12 5.653 9.256 -1.648 81 HB3 GLN 12 HB3 GLN 12 5.041 10.901 -1.451 82 HG2 GLN 12 HG2 GLN 12 2.815 10.113 -0.870 83 HG3 GLN 12 HG3 GLN 12 3.119 8.504 -1.474 84 HE21 GLN 12 HE21 GLN 12 4.996 10.501 0.912 85 HE22 GLN 12 HE22 GLN 12 4.747 9.263 2.239 86 H GLU 13 H GLU 13 2.319 9.799 -4.743 87 HA GLU 13 HA GLU 13 2.148 12.657 -5.484 88 HB2 GLU 13 HB2 GLU 13 1.827 10.599 -6.952 89 HB3 GLU 13 HB3 GLU 13 0.340 10.263 -6.091 90 HG2 GLU 13 HG2 GLU 13 -0.512 12.615 -6.970 91 HG3 GLU 13 HG3 GLU 13 0.941 12.646 -7.965 92 H ASN 14 H ASN 14 -1.005 11.415 -4.977 93 HA ASN 14 HA ASN 14 -1.699 13.717 -3.259 94 HB2 ASN 14 HB2 ASN 14 -3.389 11.399 -4.360 95 HB3 ASN 14 HB3 ASN 14 -4.061 12.646 -3.403 96 HD21 ASN 14 HD21 ASN 14 -3.228 11.860 -6.613 97 HD22 ASN 14 HD22 ASN 14 -3.611 13.545 -7.243 98 H PHE 15 H PHE 15 -0.037 12.656 -1.635 99 HA PHE 15 HA PHE 15 -1.297 11.055 0.530 100 HB2 PHE 15 HB2 PHE 15 1.200 11.310 0.014 101 HB3 PHE 15 HB3 PHE 15 1.174 12.885 0.743 102 HD1 PHE 15 HD1 PHE 15 0.733 13.079 3.261 103 HD2 PHE 15 HD2 PHE 15 1.221 9.263 1.361 104 HE1 PHE 15 HE1 PHE 15 1.320 12.053 5.418 105 HE2 PHE 15 HE2 PHE 15 1.831 8.266 3.513 106 HZ PHE 15 HZ PHE 15 1.857 9.654 5.559 107 H GLU 16 H GLU 16 -0.545 14.582 0.506 108 HA GLU 16 HA GLU 16 -1.998 15.369 2.878 109 HB2 GLU 16 HB2 GLU 16 -1.045 16.780 0.328 110 HB3 GLU 16 HB3 GLU 16 -2.187 17.644 1.293 111 HG2 GLU 16 HG2 GLU 16 0.363 16.521 2.632 112 HG3 GLU 16 HG3 GLU 16 0.351 18.057 1.763 113 H ALA 17 H ALA 17 -3.316 15.370 -0.442 114 HA ALA 17 HA ALA 17 -6.050 16.155 0.326 115 HB1 ALA 17 HB1 ALA 17 -5.066 14.665 -2.205 116 HB2 ALA 17 HB2 ALA 17 -6.608 15.530 -2.022 117 HB3 ALA 17 HB3 ALA 17 -5.091 16.434 -1.985 118 H PHE 18 H PHE 18 -4.595 12.915 0.068 119 HA PHE 18 HA PHE 18 -7.216 11.465 0.446 120 HB2 PHE 18 HB2 PHE 18 -5.274 10.559 -0.909 121 HB3 PHE 18 HB3 PHE 18 -4.313 10.424 0.529 122 HD1 PHE 18 HD2 PHE 18 -4.946 8.706 2.308 123 HD2 PHE 18 HD1 PHE 18 -6.960 8.844 -1.490 124 HE1 PHE 18 HE2 PHE 18 -5.632 6.361 2.577 125 HE2 PHE 18 HE1 PHE 18 -7.648 6.509 -1.202 126 HZ PHE 18 HZ PHE 18 -6.975 5.260 0.835 127 H MET 19 H MET 19 -4.339 11.961 2.586 128 HA MET 19 HA MET 19 -5.604 10.682 4.907 129 HB2 MET 19 HB2 MET 19 -3.206 12.578 4.718 130 HB3 MET 19 HB3 MET 19 -3.789 11.847 6.209 131 HG2 MET 19 HG2 MET 19 -1.896 10.546 5.332 132 HG3 MET 19 HG3 MET 19 -3.364 9.554 5.406 133 HE1 MET 19 HE1 MET 19 -1.183 8.200 3.328 134 HE2 MET 19 HE2 MET 19 -2.803 7.768 3.970 135 HE3 MET 19 HE3 MET 19 -2.518 7.838 2.209 136 H LYS 20 H LYS 20 -5.597 14.159 3.966 137 HA LYS 20 HA LYS 20 -7.310 14.945 6.293 138 HB2 LYS 20 HB2 LYS 20 -6.594 16.372 3.669 139 HB3 LYS 20 HB3 LYS 20 -7.902 16.960 4.673 140 HG2 LYS 20 HG2 LYS 20 -6.368 17.096 6.679 141 HG3 LYS 20 HG3 LYS 20 -5.005 16.618 5.689 142 HD2 LYS 20 HD2 LYS 20 -6.756 19.025 4.857 143 HD3 LYS 20 HD3 LYS 20 -5.661 19.234 6.183 144 HE2 LYS 20 HE2 LYS 20 -4.623 18.153 3.460 145 HE3 LYS 20 HE3 LYS 20 -4.878 19.879 3.728 146 HZ1 LYS 20 HZ1 LYS 20 -2.536 19.241 4.347 147 HZ2 LYS 20 HZ2 LYS 20 -3.052 18.170 5.416 148 HZ3 LYS 20 HZ3 LYS 20 -3.353 19.770 5.743 149 H ALA 21 H ALA 21 -8.183 13.867 2.909 150 HA ALA 21 HA ALA 21 -11.078 14.159 3.300 151 HB1 ALA 21 HB1 ALA 21 -11.232 12.643 1.306 152 HB2 ALA 21 HB2 ALA 21 -10.020 13.912 1.052 153 HB3 ALA 21 HB3 ALA 21 -9.501 12.255 1.443 154 H ILE 22 H ILE 22 -8.934 11.389 4.116 155 HA ILE 22 HA ILE 22 -11.315 9.812 5.159 156 HB ILE 22 HB ILE 22 -9.840 7.991 5.699 157 HG12 ILE 22 HG12 ILE 22 -7.442 9.468 4.494 158 HG13 ILE 22 HG13 ILE 22 -7.725 9.424 6.221 159 HG21 ILE 22 HG21 ILE 22 -9.288 7.265 3.397 160 HG22 ILE 22 HG22 ILE 22 -10.805 8.186 3.375 161 HG23 ILE 22 HG23 ILE 22 -9.294 8.946 2.823 162 HD11 ILE 22 HD11 ILE 22 -7.268 6.927 4.450 163 HD12 ILE 22 HD12 ILE 22 -6.101 7.667 5.562 164 HD13 ILE 22 HD13 ILE 22 -7.575 6.899 6.207 165 H GLY 23 H GLY 23 -9.613 12.279 6.543 166 HA2 GLY 23 HA2 GLY 23 -10.111 13.153 8.768 167 HA3 GLY 23 HA3 GLY 23 -10.727 11.603 9.270 168 H LEU 24 H LEU 24 -7.423 12.448 8.084 169 HA LEU 24 HA LEU 24 -6.349 11.678 10.832 170 HB2 LEU 24 HB2 LEU 24 -5.372 11.218 8.001 171 HB3 LEU 24 HB3 LEU 24 -4.145 11.709 9.110 172 HG LEU 24 HG LEU 24 -5.077 9.837 10.756 173 HD11 LEU 24 HD11 LEU 24 -7.187 9.320 9.472 174 HD12 LEU 24 HD12 LEU 24 -6.150 7.899 9.621 175 HD13 LEU 24 HD13 LEU 24 -6.222 8.790 8.079 176 HD21 LEU 24 HD21 LEU 24 -2.857 9.770 9.673 177 HD22 LEU 24 HD22 LEU 24 -3.570 9.087 8.186 178 HD23 LEU 24 HD23 LEU 24 -3.600 8.160 9.715 179 HA PRO 25 HA PRO 25 -4.841 15.711 11.824 180 HB2 PRO 25 HB2 PRO 25 -2.570 15.181 13.414 181 HB3 PRO 25 HB3 PRO 25 -4.228 14.985 13.894 182 HG2 PRO 25 HG2 PRO 25 -2.256 12.904 12.926 183 HG3 PRO 25 HG3 PRO 25 -3.467 12.701 14.207 184 HD2 PRO 25 HD2 PRO 25 -3.636 11.774 11.533 185 HD3 PRO 25 HD3 PRO 25 -5.062 11.981 12.571 186 H GLU 26 H GLU 26 -3.690 17.351 10.992 187 HA GLU 26 HA GLU 26 -1.862 17.087 8.802 188 HB2 GLU 26 HB2 GLU 26 -2.504 19.458 10.600 189 HB3 GLU 26 HB3 GLU 26 -1.528 19.535 9.173 190 HG2 GLU 26 HG2 GLU 26 -3.621 18.427 7.905 191 HG3 GLU 26 HG3 GLU 26 -4.535 18.920 9.317 192 H GLU 27 H GLU 27 -1.035 17.468 12.194 193 HA GLU 27 HA GLU 27 1.876 17.817 11.934 194 HB2 GLU 27 HB2 GLU 27 0.657 18.335 13.964 195 HB3 GLU 27 HB3 GLU 27 0.061 16.703 14.166 196 HG2 GLU 27 HG2 GLU 27 3.100 17.247 14.283 197 HG3 GLU 27 HG3 GLU 27 2.060 17.618 15.649 198 H LEU 28 H LEU 28 0.042 14.720 12.384 199 HA LEU 28 HA LEU 28 2.455 13.055 11.856 200 HB2 LEU 28 HB2 LEU 28 -0.435 12.093 11.616 201 HB3 LEU 28 HB3 LEU 28 1.002 11.113 11.786 202 HG LEU 28 HG LEU 28 -0.210 12.931 13.950 203 HD11 LEU 28 HD11 LEU 28 0.011 9.842 13.807 204 HD12 LEU 28 HD12 LEU 28 -1.472 10.762 13.476 205 HD13 LEU 28 HD13 LEU 28 -0.762 10.786 15.102 206 HD21 LEU 28 HD21 LEU 28 2.326 12.798 14.200 207 HD22 LEU 28 HD22 LEU 28 2.169 11.035 14.412 208 HD23 LEU 28 HD23 LEU 28 1.409 12.153 15.558 209 H ILE 29 H ILE 29 -0.052 14.329 9.734 210 HA ILE 29 HA ILE 29 0.693 12.806 7.306 211 HB ILE 29 HB ILE 29 -0.773 15.493 7.471 212 HG12 ILE 29 HG12 ILE 29 -1.983 12.695 7.035 213 HG13 ILE 29 HG13 ILE 29 -1.925 13.438 8.589 214 HG21 ILE 29 HG21 ILE 29 -0.731 13.530 5.071 215 HG22 ILE 29 HG22 ILE 29 -1.564 15.091 5.155 216 HG23 ILE 29 HG23 ILE 29 0.190 15.058 5.134 217 HD11 ILE 29 HD11 ILE 29 -3.339 15.393 7.833 218 HD12 ILE 29 HD12 ILE 29 -3.497 14.647 6.222 219 HD13 ILE 29 HD13 ILE 29 -4.169 13.839 7.646 220 H GLN 30 H GLN 30 1.575 16.099 8.437 221 HA GLN 30 HA GLN 30 3.613 16.649 6.387 222 HB2 GLN 30 HB2 GLN 30 2.943 17.789 9.136 223 HB3 GLN 30 HB3 GLN 30 4.519 18.135 8.525 224 HG2 GLN 30 HG2 GLN 30 2.670 19.880 8.034 225 HG3 GLN 30 HG3 GLN 30 3.834 19.495 6.796 226 HE21 GLN 30 HE21 GLN 30 0.562 18.371 7.718 227 HE22 GLN 30 HE22 GLN 30 0.042 18.281 5.945 228 H LYS 31 H LYS 31 3.843 14.534 9.128 229 HA LYS 31 HA LYS 31 6.872 14.302 8.980 230 HB2 LYS 31 HB2 LYS 31 4.680 12.850 10.581 231 HB3 LYS 31 HB3 LYS 31 6.324 12.262 10.550 232 HG2 LYS 31 HG2 LYS 31 7.221 14.332 11.545 233 HG3 LYS 31 HG3 LYS 31 5.648 15.139 11.436 234 HD2 LYS 31 HD2 LYS 31 4.600 13.569 12.992 235 HD3 LYS 31 HD3 LYS 31 6.013 12.510 13.004 236 HE2 LYS 31 HE2 LYS 31 7.404 14.225 14.163 237 HE3 LYS 31 HE3 LYS 31 6.090 15.429 14.047 238 HZ1 LYS 31 HZ1 LYS 31 4.656 14.103 15.397 239 HZ2 LYS 31 HZ2 LYS 31 6.086 14.072 16.247 240 HZ3 LYS 31 HZ3 LYS 31 5.669 12.723 15.349 241 H GLY 32 H GLY 32 4.112 12.064 8.245 242 HA2 GLY 32 HA2 GLY 32 5.887 10.130 6.815 243 HA3 GLY 32 HA3 GLY 32 4.151 10.042 6.875 244 H LYS 33 H LYS 33 4.421 12.999 5.514 245 HA LYS 33 HA LYS 33 3.948 12.030 2.819 246 HB2 LYS 33 HB2 LYS 33 3.759 14.323 2.121 247 HB3 LYS 33 HB3 LYS 33 2.934 14.073 3.641 248 HG2 LYS 33 HG2 LYS 33 4.741 15.184 4.918 249 HG3 LYS 33 HG3 LYS 33 5.736 15.364 3.501 250 HD2 LYS 33 HD2 LYS 33 2.949 16.627 3.716 251 HD3 LYS 33 HD3 LYS 33 4.382 17.428 4.307 252 HE2 LYS 33 HE2 LYS 33 4.119 16.495 1.358 253 HE3 LYS 33 HE3 LYS 33 3.579 18.072 1.917 254 HZ1 LYS 33 HZ1 LYS 33 6.029 17.933 1.031 255 HZ2 LYS 33 HZ2 LYS 33 6.461 17.162 2.381 256 HZ3 LYS 33 HZ3 LYS 33 5.872 18.676 2.506 257 H ASP 34 H ASP 34 7.003 13.458 3.991 258 HA ASP 34 HA ASP 34 8.257 13.015 1.233 259 HB2 ASP 34 HB2 ASP 34 9.296 14.663 3.616 260 HB3 ASP 34 HB3 ASP 34 9.999 14.605 2.013 261 H ILE 35 H ILE 35 8.253 11.159 4.011 262 HA ILE 35 HA ILE 35 11.155 10.482 4.173 263 HB ILE 35 HB ILE 35 8.722 9.109 5.427 264 HG12 ILE 35 HG12 ILE 35 10.875 10.846 6.814 265 HG13 ILE 35 HG13 ILE 35 9.367 11.508 6.228 266 HG21 ILE 35 HG21 ILE 35 11.706 8.536 6.054 267 HG22 ILE 35 HG22 ILE 35 10.315 7.867 6.938 268 HG23 ILE 35 HG23 ILE 35 10.579 7.411 5.262 269 HD11 ILE 35 HD11 ILE 35 9.542 9.361 8.443 270 HD12 ILE 35 HD12 ILE 35 9.141 11.082 8.626 271 HD13 ILE 35 HD13 ILE 35 8.033 10.013 7.756 272 H LYS 36 H LYS 36 12.155 9.429 2.568 273 HA LYS 36 HA LYS 36 10.841 7.447 0.763 274 HB2 LYS 36 HB2 LYS 36 13.807 8.218 1.074 275 HB3 LYS 36 HB3 LYS 36 13.201 7.043 -0.068 276 HG2 LYS 36 HG2 LYS 36 11.634 8.904 -1.023 277 HG3 LYS 36 HG3 LYS 36 12.587 10.058 -0.088 278 HD2 LYS 36 HD2 LYS 36 14.710 9.185 -1.259 279 HD3 LYS 36 HD3 LYS 36 13.719 8.018 -2.134 280 HE2 LYS 36 HE2 LYS 36 12.375 10.050 -3.106 281 HE3 LYS 36 HE3 LYS 36 13.598 11.104 -2.406 282 HZ1 LYS 36 HZ1 LYS 36 14.183 8.848 -4.373 283 HZ2 LYS 36 HZ2 LYS 36 15.325 9.830 -3.727 284 HZ3 LYS 36 HZ3 LYS 36 14.195 10.449 -4.753 285 H GLY 37 H GLY 37 10.060 6.182 2.654 286 HA2 GLY 37 HA2 GLY 37 11.922 4.263 3.990 287 HA3 GLY 37 HA3 GLY 37 10.177 4.271 4.129 288 H VAL 38 H VAL 38 11.260 1.967 4.177 289 HA VAL 38 HA VAL 38 11.330 0.637 1.449 290 HB VAL 38 HB VAL 38 11.873 -0.500 4.239 291 HG11 VAL 38 HG11 VAL 38 12.231 -1.902 1.506 292 HG12 VAL 38 HG12 VAL 38 12.827 -2.523 3.069 293 HG13 VAL 38 HG13 VAL 38 11.091 -2.377 2.785 294 HG21 VAL 38 HG21 VAL 38 14.279 -0.614 3.480 295 HG22 VAL 38 HG22 VAL 38 13.846 0.126 1.919 296 HG23 VAL 38 HG23 VAL 38 13.709 1.059 3.424 297 H SER 39 H SER 39 9.745 -0.525 0.588 298 HA SER 39 HA SER 39 7.324 -1.418 2.262 299 HB2 SER 39 HB2 SER 39 7.483 -0.462 -0.635 300 HB3 SER 39 HB3 SER 39 6.084 -1.286 0.026 301 HG SER 39 HG SER 39 5.794 0.951 0.160 302 H GLU 40 H GLU 40 8.008 -3.378 2.694 303 HA GLU 40 HA GLU 40 9.343 -5.211 0.721 304 HB2 GLU 40 HB2 GLU 40 9.846 -5.010 3.263 305 HB3 GLU 40 HB3 GLU 40 8.325 -5.788 3.543 306 HG2 GLU 40 HG2 GLU 40 9.077 -7.903 2.464 307 HG3 GLU 40 HG3 GLU 40 10.598 -7.160 1.979 308 H ILE 41 H ILE 41 8.557 -7.030 -0.203 309 HA ILE 41 HA ILE 41 5.885 -8.141 0.659 310 HB ILE 41 HB ILE 41 6.450 -7.732 -2.337 311 HG12 ILE 41 HG12 ILE 41 4.279 -6.214 -0.783 312 HG13 ILE 41 HG13 ILE 41 5.831 -5.529 -1.220 313 HG21 ILE 41 HG21 ILE 41 3.888 -8.791 -0.927 314 HG22 ILE 41 HG22 ILE 41 4.089 -8.573 -2.682 315 HG23 ILE 41 HG23 ILE 41 5.041 -9.787 -1.850 316 HD11 ILE 41 HD11 ILE 41 4.253 -4.817 -2.921 317 HD12 ILE 41 HD12 ILE 41 5.395 -5.938 -3.683 318 HD13 ILE 41 HD13 ILE 41 3.739 -6.468 -3.276 319 H VAL 42 H VAL 42 6.215 -10.297 0.968 320 HA VAL 42 HA VAL 42 8.293 -11.833 -0.698 321 HB VAL 42 HB VAL 42 6.990 -12.934 1.835 322 HG11 VAL 42 HG11 VAL 42 9.701 -13.595 0.507 323 HG12 VAL 42 HG12 VAL 42 8.986 -14.414 1.914 324 HG13 VAL 42 HG13 VAL 42 8.223 -14.559 0.320 325 HG21 VAL 42 HG21 VAL 42 8.093 -10.863 2.646 326 HG22 VAL 42 HG22 VAL 42 8.976 -12.291 3.195 327 HG23 VAL 42 HG23 VAL 42 9.613 -11.318 1.841 328 H GLN 43 H GLN 43 7.305 -12.694 -2.480 329 HA GLN 43 HA GLN 43 4.399 -13.414 -2.517 330 HB2 GLN 43 HB2 GLN 43 5.560 -12.269 -4.391 331 HB3 GLN 43 HB3 GLN 43 6.586 -13.668 -4.667 332 HG2 GLN 43 HG2 GLN 43 4.578 -15.059 -5.276 333 HG3 GLN 43 HG3 GLN 43 3.507 -13.725 -4.874 334 HE21 GLN 43 HE21 GLN 43 2.806 -14.319 -7.091 335 HE22 GLN 43 HE22 GLN 43 3.626 -13.449 -8.499 336 H ASN 44 H ASN 44 3.869 -15.226 -1.358 337 HA ASN 44 HA ASN 44 5.323 -17.884 -1.970 338 HB2 ASN 44 HB2 ASN 44 3.627 -17.163 0.506 339 HB3 ASN 44 HB3 ASN 44 4.438 -18.671 0.203 340 HD21 ASN 44 HD21 ASN 44 5.089 -15.276 0.882 341 HD22 ASN 44 HD22 ASN 44 6.728 -15.655 1.605 342 H GLY 45 H GLY 45 3.900 -17.541 -3.986 343 HA2 GLY 45 HA2 GLY 45 2.146 -18.521 -5.348 344 HA3 GLY 45 HA3 GLY 45 1.673 -19.523 -3.992 345 H LYS 46 H LYS 46 0.025 -18.778 -2.659 346 HA LYS 46 HA LYS 46 -1.722 -16.471 -3.638 347 HB2 LYS 46 HB2 LYS 46 -2.257 -18.702 -1.578 348 HB3 LYS 46 HB3 LYS 46 -3.350 -17.374 -1.884 349 HG2 LYS 46 HG2 LYS 46 -3.685 -18.092 -4.275 350 HG3 LYS 46 HG3 LYS 46 -2.501 -19.360 -4.063 351 HD2 LYS 46 HD2 LYS 46 -4.233 -20.720 -3.623 352 HD3 LYS 46 HD3 LYS 46 -4.166 -20.125 -1.997 353 HE2 LYS 46 HE2 LYS 46 -6.058 -19.126 -4.260 354 HE3 LYS 46 HE3 LYS 46 -6.492 -20.257 -2.986 355 HZ1 LYS 46 HZ1 LYS 46 -7.238 -18.137 -2.160 356 HZ2 LYS 46 HZ2 LYS 46 -5.916 -17.332 -2.707 357 HZ3 LYS 46 HZ3 LYS 46 -5.806 -18.311 -1.373 358 H HIS 47 H HIS 47 0.387 -17.282 -0.878 359 HA HIS 47 HA HIS 47 -0.746 -15.006 0.805 360 HB2 HIS 47 HB2 HIS 47 1.240 -17.262 1.478 361 HB3 HIS 47 HB3 HIS 47 0.963 -15.904 2.539 362 HD1 HIS 47 HD1 HIS 47 -0.749 -19.153 1.436 363 HD2 HIS 47 HD2 HIS 47 -1.473 -15.617 3.737 364 HE1 HIS 47 HE1 HIS 47 -2.912 -19.416 2.830 365 H PHE 48 H PHE 48 0.005 -13.094 0.359 366 HA PHE 48 HA PHE 48 2.932 -12.614 -0.444 367 HB2 PHE 48 HB2 PHE 48 0.334 -11.031 -0.776 368 HB3 PHE 48 HB3 PHE 48 1.885 -10.287 -0.955 369 HD1 PHE 48 HD1 PHE 48 0.361 -13.556 -2.334 370 HD2 PHE 48 HD2 PHE 48 2.278 -9.799 -3.166 371 HE1 PHE 48 HE1 PHE 48 0.247 -14.017 -4.738 372 HE2 PHE 48 HE2 PHE 48 2.118 -10.266 -5.562 373 HZ PHE 48 HZ PHE 48 1.135 -12.353 -6.362 374 H LYS 49 H LYS 49 4.100 -12.376 1.387 375 HA LYS 49 HA LYS 49 2.936 -11.104 3.892 376 HB2 LYS 49 HB2 LYS 49 5.703 -12.339 3.456 377 HB3 LYS 49 HB3 LYS 49 5.118 -11.712 4.980 378 HG2 LYS 49 HG2 LYS 49 3.332 -13.383 5.123 379 HG3 LYS 49 HG3 LYS 49 3.633 -13.947 3.495 380 HD2 LYS 49 HD2 LYS 49 6.107 -14.482 4.392 381 HD3 LYS 49 HD3 LYS 49 5.423 -14.297 5.994 382 HE2 LYS 49 HE2 LYS 49 4.497 -16.297 3.806 383 HE3 LYS 49 HE3 LYS 49 5.565 -16.686 5.148 384 HZ1 LYS 49 HZ1 LYS 49 3.278 -17.318 5.848 385 HZ2 LYS 49 HZ2 LYS 49 2.619 -15.881 5.397 386 HZ3 LYS 49 HZ3 LYS 49 3.560 -15.912 6.670 387 H PHE 50 H PHE 50 3.023 -9.013 4.174 388 HA PHE 50 HA PHE 50 5.283 -7.439 2.854 389 HB2 PHE 50 HB2 PHE 50 3.957 -5.525 2.537 390 HB3 PHE 50 HB3 PHE 50 3.250 -6.905 1.787 391 HD1 PHE 50 HD2 PHE 50 2.779 -5.318 5.315 392 HD2 PHE 50 HD1 PHE 50 1.040 -6.359 1.533 393 HE1 PHE 50 HE2 PHE 50 0.652 -4.378 6.032 394 HE2 PHE 50 HE1 PHE 50 -1.094 -5.442 2.260 395 HZ PHE 50 HZ PHE 50 -1.309 -4.429 4.519 396 H THR 51 H THR 51 6.385 -5.889 3.735 397 HA THR 51 HA THR 51 5.837 -5.103 6.675 398 HB THR 51 HB THR 51 8.689 -5.326 5.576 399 HG1 THR 51 HG1 THR 51 8.647 -7.357 5.881 400 HG21 THR 51 HG21 THR 51 8.462 -3.876 7.555 401 HG22 THR 51 HG22 THR 51 9.348 -5.371 7.939 402 HG23 THR 51 HG23 THR 51 7.661 -5.194 8.457 403 H ILE 52 H ILE 52 4.765 -3.209 6.157 404 HA ILE 52 HA ILE 52 5.972 -1.355 4.053 405 HB ILE 52 HB ILE 52 3.144 -1.405 5.183 406 HG12 ILE 52 HG12 ILE 52 3.427 -3.390 3.861 407 HG13 ILE 52 HG13 ILE 52 2.386 -2.295 2.994 408 HG21 ILE 52 HG21 ILE 52 2.501 0.116 3.297 409 HG22 ILE 52 HG22 ILE 52 3.646 0.898 4.386 410 HG23 ILE 52 HG23 ILE 52 4.207 0.271 2.816 411 HD11 ILE 52 HD11 ILE 52 5.368 -2.889 2.358 412 HD12 ILE 52 HD12 ILE 52 3.968 -3.443 1.441 413 HD13 ILE 52 HD13 ILE 52 4.367 -1.711 1.461 414 H THR 53 H THR 53 6.701 0.563 4.463 415 HA THR 53 HA THR 53 6.755 1.656 7.294 416 HB THR 53 HB THR 53 8.389 3.354 6.357 417 HG1 THR 53 HG1 THR 53 8.618 1.531 4.202 418 HG21 THR 53 HG21 THR 53 10.325 1.793 6.274 419 HG22 THR 53 HG22 THR 53 9.232 0.393 6.122 420 HG23 THR 53 HG23 THR 53 9.233 1.372 7.608 421 H ALA 54 H ALA 54 5.089 2.760 7.814 422 HA ALA 54 HA ALA 54 3.809 4.896 5.991 423 HB1 ALA 54 HB1 ALA 54 2.902 3.567 8.646 424 HB2 ALA 54 HB2 ALA 54 1.999 4.821 7.786 425 HB3 ALA 54 HB3 ALA 54 2.255 3.240 7.016 426 H GLY 55 H GLY 55 6.036 5.819 6.303 427 HA2 GLY 55 HA2 GLY 55 7.188 7.826 6.990 428 HA3 GLY 55 HA3 GLY 55 5.940 8.197 8.166 429 H SER 56 H SER 56 6.111 7.317 10.212 430 HA SER 56 HA SER 56 8.811 6.175 11.083 431 HB2 SER 56 HB2 SER 56 6.544 7.212 12.881 432 HB3 SER 56 HB3 SER 56 8.157 6.742 13.390 433 HG SER 56 HG SER 56 7.643 9.105 12.991 434 H LYS 57 H LYS 57 5.390 5.157 10.948 435 HA LYS 57 HA LYS 57 5.861 2.840 12.821 436 HB2 LYS 57 HB2 LYS 57 3.681 4.171 12.804 437 HB3 LYS 57 HB3 LYS 57 3.318 3.500 11.221 438 HG2 LYS 57 HG2 LYS 57 3.516 1.124 12.318 439 HG3 LYS 57 HG3 LYS 57 3.681 1.933 13.873 440 HD2 LYS 57 HD2 LYS 57 1.372 2.984 13.523 441 HD3 LYS 57 HD3 LYS 57 1.262 2.181 11.954 442 HE2 LYS 57 HE2 LYS 57 1.573 -0.104 13.165 443 HE3 LYS 57 HE3 LYS 57 1.512 0.755 14.707 444 HZ1 LYS 57 HZ1 LYS 57 -0.708 0.536 12.632 445 HZ2 LYS 57 HZ2 LYS 57 -0.814 1.616 13.892 446 HZ3 LYS 57 HZ3 LYS 57 -0.764 -0.035 14.086 447 H VAL 58 H VAL 58 6.386 0.861 12.243 448 HA VAL 58 HA VAL 58 6.448 -0.034 9.339 449 HB VAL 58 HB VAL 58 7.510 -1.446 11.852 450 HG11 VAL 58 HG11 VAL 58 7.946 -2.104 8.861 451 HG12 VAL 58 HG12 VAL 58 8.761 -2.917 10.223 452 HG13 VAL 58 HG13 VAL 58 7.012 -3.089 10.010 453 HG21 VAL 58 HG21 VAL 58 8.863 0.637 11.341 454 HG22 VAL 58 HG22 VAL 58 9.803 -0.827 11.016 455 HG23 VAL 58 HG23 VAL 58 9.091 0.092 9.667 456 H ILE 59 H ILE 59 4.549 -0.743 8.604 457 HA ILE 59 HA ILE 59 2.552 -2.207 10.432 458 HB ILE 59 HB ILE 59 2.062 -0.825 7.737 459 HG12 ILE 59 HG12 ILE 59 1.120 0.045 10.549 460 HG13 ILE 59 HG13 ILE 59 2.478 0.766 9.704 461 HG21 ILE 59 HG21 ILE 59 0.011 -2.129 9.671 462 HG22 ILE 59 HG22 ILE 59 -0.386 -1.263 8.172 463 HG23 ILE 59 HG23 ILE 59 0.494 -2.785 8.084 464 HD11 ILE 59 HD11 ILE 59 -0.467 0.939 8.846 465 HD12 ILE 59 HD12 ILE 59 0.615 2.248 9.353 466 HD13 ILE 59 HD13 ILE 59 0.878 1.442 7.786 467 H GLN 60 H GLN 60 3.213 -4.297 10.379 468 HA GLN 60 HA GLN 60 3.677 -5.623 7.685 469 HB2 GLN 60 HB2 GLN 60 5.065 -7.229 8.669 470 HB3 GLN 60 HB3 GLN 60 5.624 -5.628 9.053 471 HG2 GLN 60 HG2 GLN 60 4.122 -7.447 11.032 472 HG3 GLN 60 HG3 GLN 60 5.865 -7.368 10.889 473 HE21 GLN 60 HE21 GLN 60 6.944 -5.467 11.712 474 HE22 GLN 60 HE22 GLN 60 6.007 -4.261 12.746 475 H ASN 61 H ASN 61 2.409 -7.023 6.962 476 HA ASN 61 HA ASN 61 0.534 -8.755 8.457 477 HB2 ASN 61 HB2 ASN 61 -0.765 -6.521 6.734 478 HB3 ASN 61 HB3 ASN 61 -1.590 -7.962 7.251 479 HD21 ASN 61 HD21 ASN 61 -0.188 -5.024 8.524 480 HD22 ASN 61 HD22 ASN 61 -1.215 -5.080 10.035 481 H GLU 62 H GLU 62 -0.692 -10.213 6.869 482 HA GLU 62 HA GLU 62 0.731 -10.369 4.182 483 HB2 GLU 62 HB2 GLU 62 1.105 -12.618 4.204 484 HB3 GLU 62 HB3 GLU 62 1.731 -11.980 5.716 485 HG2 GLU 62 HG2 GLU 62 -0.224 -13.025 6.964 486 HG3 GLU 62 HG3 GLU 62 -0.870 -13.643 5.440 487 H PHE 63 H PHE 63 -0.406 -10.598 2.457 488 HA PHE 63 HA PHE 63 -3.421 -10.900 2.759 489 HB2 PHE 63 HB2 PHE 63 -3.885 -9.676 0.805 490 HB3 PHE 63 HB3 PHE 63 -2.994 -8.772 1.963 491 HD1 PHE 63 HD1 PHE 63 -0.581 -8.106 1.442 492 HD2 PHE 63 HD2 PHE 63 -2.960 -10.211 -1.444 493 HE1 PHE 63 HE1 PHE 63 0.954 -7.386 -0.378 494 HE2 PHE 63 HE2 PHE 63 -1.449 -9.452 -3.236 495 HZ PHE 63 HZ PHE 63 0.501 -8.018 -2.686 496 H THR 64 H THR 64 -4.516 -12.354 1.830 497 HA THR 64 HA THR 64 -3.126 -14.531 0.232 498 HB THR 64 HB THR 64 -5.913 -14.650 1.517 499 HG1 THR 64 HG1 THR 64 -3.893 -16.015 2.745 500 HG21 THR 64 HG21 THR 64 -5.453 -16.467 -0.156 501 HG22 THR 64 HG22 THR 64 -5.492 -17.129 1.496 502 HG23 THR 64 HG23 THR 64 -3.926 -16.883 0.673 503 H VAL 65 H VAL 65 -3.249 -14.254 -1.918 504 HA VAL 65 HA VAL 65 -5.336 -12.660 -3.293 505 HB VAL 65 HB VAL 65 -3.200 -14.524 -4.395 506 HG11 VAL 65 HG11 VAL 65 -4.981 -14.278 -6.167 507 HG12 VAL 65 HG12 VAL 65 -4.784 -12.511 -6.109 508 HG13 VAL 65 HG13 VAL 65 -3.443 -13.544 -6.637 509 HG21 VAL 65 HG21 VAL 65 -3.291 -11.418 -4.286 510 HG22 VAL 65 HG22 VAL 65 -2.251 -12.450 -3.279 511 HG23 VAL 65 HG23 VAL 65 -1.988 -12.370 -5.028 512 H GLY 66 H GLY 66 -7.353 -13.310 -3.625 513 HA2 GLY 66 HA2 GLY 66 -9.123 -14.782 -4.520 514 HA3 GLY 66 HA3 GLY 66 -8.065 -16.167 -4.479 515 H GLU 67 H GLU 67 -7.856 -14.854 -1.401 516 HA GLU 67 HA GLU 67 -10.419 -15.908 -0.341 517 HB2 GLU 67 HB2 GLU 67 -7.736 -17.267 0.438 518 HB3 GLU 67 HB3 GLU 67 -9.084 -17.272 1.541 519 HG2 GLU 67 HG2 GLU 67 -9.335 -18.470 -1.291 520 HG3 GLU 67 HG3 GLU 67 -8.890 -19.389 0.145 521 H GLU 68 H GLU 68 -10.812 -15.305 1.883 522 HA GLU 68 HA GLU 68 -10.338 -12.545 2.263 523 HB2 GLU 68 HB2 GLU 68 -11.417 -12.641 4.395 524 HB3 GLU 68 HB3 GLU 68 -12.288 -13.549 3.195 525 HG2 GLU 68 HG2 GLU 68 -11.988 -15.615 4.281 526 HG3 GLU 68 HG3 GLU 68 -10.381 -15.214 4.853 527 H CYS 69 H CYS 69 -8.961 -11.234 3.167 528 HA CYS 69 HA CYS 69 -6.956 -12.197 5.252 529 HB2 CYS 69 HB2 CYS 69 -5.127 -10.857 4.005 530 HB3 CYS 69 HB3 CYS 69 -5.608 -12.456 3.434 531 HG CYS 69 HG CYS 69 -6.922 -11.736 1.371 532 H GLU 70 H GLU 70 -6.771 -10.967 6.826 533 HA GLU 70 HA GLU 70 -8.144 -8.285 7.013 534 HB2 GLU 70 HB2 GLU 70 -7.902 -8.394 9.421 535 HB3 GLU 70 HB3 GLU 70 -8.873 -9.654 8.719 536 HG2 GLU 70 HG2 GLU 70 -7.063 -11.350 9.015 537 HG3 GLU 70 HG3 GLU 70 -5.962 -10.078 9.518 538 H LEU 71 H LEU 71 -7.072 -6.541 6.509 539 HA LEU 71 HA LEU 71 -4.104 -6.225 7.298 540 HB2 LEU 71 HB2 LEU 71 -5.539 -4.913 4.922 541 HB3 LEU 71 HB3 LEU 71 -3.829 -4.824 5.288 542 HG LEU 71 HG LEU 71 -5.365 -7.335 4.377 543 HD11 LEU 71 HD11 LEU 71 -4.938 -5.436 2.661 544 HD12 LEU 71 HD12 LEU 71 -4.308 -7.025 2.220 545 HD13 LEU 71 HD13 LEU 71 -3.211 -5.765 2.836 546 HD21 LEU 71 HD21 LEU 71 -3.152 -8.478 4.159 547 HD22 LEU 71 HD22 LEU 71 -3.426 -8.021 5.831 548 HD23 LEU 71 HD23 LEU 71 -2.309 -7.062 4.828 549 H GLU 72 H GLU 72 -3.453 -4.363 8.306 550 HA GLU 72 HA GLU 72 -5.469 -2.644 9.652 551 HB2 GLU 72 HB2 GLU 72 -3.156 -3.340 10.556 552 HB3 GLU 72 HB3 GLU 72 -2.416 -2.245 9.395 553 HG2 GLU 72 HG2 GLU 72 -3.784 -0.311 10.542 554 HG3 GLU 72 HG3 GLU 72 -4.283 -1.484 11.755 555 H THR 73 H THR 73 -5.982 -0.639 9.404 556 HA THR 73 HA THR 73 -5.399 0.853 6.789 557 HB THR 73 HB THR 73 -7.610 -0.002 6.630 558 HG1 THR 73 HG1 THR 73 -8.575 2.369 7.449 559 HG21 THR 73 HG21 THR 73 -9.505 0.519 8.240 560 HG22 THR 73 HG22 THR 73 -8.308 1.209 9.372 561 HG23 THR 73 HG23 THR 73 -8.284 -0.528 8.968 562 H MET 74 H MET 74 -5.935 3.099 6.967 563 HA MET 74 HA MET 74 -4.471 4.452 9.296 564 HB2 MET 74 HB2 MET 74 -5.426 5.550 6.584 565 HB3 MET 74 HB3 MET 74 -4.956 6.618 7.891 566 HG2 MET 74 HG2 MET 74 -3.088 4.524 6.634 567 HG3 MET 74 HG3 MET 74 -3.074 6.263 6.320 568 HE1 MET 74 HE1 MET 74 -0.970 3.884 7.808 569 HE2 MET 74 HE2 MET 74 -0.788 4.199 9.561 570 HE3 MET 74 HE3 MET 74 -2.273 3.415 8.939 571 H THR 75 H THR 75 -7.618 4.994 7.635 572 HA THR 75 HA THR 75 -8.847 5.750 10.340 573 HB THR 75 HB THR 75 -10.124 6.010 7.575 574 HG1 THR 75 HG1 THR 75 -9.817 8.325 8.216 575 HG21 THR 75 HG21 THR 75 -11.002 7.226 10.285 576 HG22 THR 75 HG22 THR 75 -11.833 5.882 9.459 577 HG23 THR 75 HG23 THR 75 -11.791 7.488 8.713 578 H GLY 76 H GLY 76 -9.780 4.159 11.351 579 HA2 GLY 76 HA2 GLY 76 -11.749 2.432 11.132 580 HA3 GLY 76 HA3 GLY 76 -10.827 1.624 9.904 581 H GLU 77 H GLU 77 -9.418 -0.008 10.573 582 HA GLU 77 HA GLU 77 -8.640 -0.558 13.290 583 HB2 GLU 77 HB2 GLU 77 -10.173 -2.180 14.106 584 HB3 GLU 77 HB3 GLU 77 -10.943 -0.638 13.902 585 HG2 GLU 77 HG2 GLU 77 -11.504 -3.218 12.331 586 HG3 GLU 77 HG3 GLU 77 -12.531 -2.263 13.363 587 H LYS 78 H LYS 78 -10.114 -2.742 11.007 588 HA LYS 78 HA LYS 78 -7.624 -3.613 9.725 589 HB2 LYS 78 HB2 LYS 78 -7.860 -4.796 12.249 590 HB3 LYS 78 HB3 LYS 78 -8.786 -5.964 11.334 591 HG2 LYS 78 HG2 LYS 78 -6.759 -6.160 9.724 592 HG3 LYS 78 HG3 LYS 78 -5.929 -4.977 10.744 593 HD2 LYS 78 HD2 LYS 78 -6.151 -6.581 12.736 594 HD3 LYS 78 HD3 LYS 78 -6.995 -7.725 11.691 595 HE2 LYS 78 HE2 LYS 78 -4.861 -7.760 10.171 596 HE3 LYS 78 HE3 LYS 78 -4.032 -6.801 11.391 597 HZ1 LYS 78 HZ1 LYS 78 -4.499 -8.626 13.041 598 HZ2 LYS 78 HZ2 LYS 78 -3.807 -9.329 11.708 599 HZ3 LYS 78 HZ3 LYS 78 -5.448 -9.442 11.968 600 H VAL 79 H VAL 79 -8.265 -3.979 7.750 601 HA VAL 79 HA VAL 79 -11.201 -4.607 7.225 602 HB VAL 79 HB VAL 79 -10.268 -2.454 6.458 603 HG11 VAL 79 HG11 VAL 79 -8.902 -2.218 4.414 604 HG12 VAL 79 HG12 VAL 79 -7.966 -3.010 5.685 605 HG13 VAL 79 HG13 VAL 79 -8.624 -3.972 4.347 606 HG21 VAL 79 HG21 VAL 79 -11.253 -4.182 4.115 607 HG22 VAL 79 HG22 VAL 79 -12.295 -3.450 5.366 608 HG23 VAL 79 HG23 VAL 79 -11.363 -2.413 4.274 609 H LYS 80 H LYS 80 -11.836 -6.461 6.336 610 HA LYS 80 HA LYS 80 -9.813 -8.478 5.331 611 HB2 LYS 80 HB2 LYS 80 -12.796 -8.776 5.908 612 HB3 LYS 80 HB3 LYS 80 -11.870 -9.973 5.021 613 HG2 LYS 80 HG2 LYS 80 -10.161 -10.051 6.926 614 HG3 LYS 80 HG3 LYS 80 -11.226 -9.025 7.891 615 HD2 LYS 80 HD2 LYS 80 -13.028 -10.829 7.737 616 HD3 LYS 80 HD3 LYS 80 -11.971 -11.774 6.691 617 HE2 LYS 80 HE2 LYS 80 -10.198 -11.793 8.635 618 HE3 LYS 80 HE3 LYS 80 -11.415 -11.057 9.673 619 HZ1 LYS 80 HZ1 LYS 80 -11.586 -13.529 9.844 620 HZ2 LYS 80 HZ2 LYS 80 -11.624 -13.718 8.199 621 HZ3 LYS 80 HZ3 LYS 80 -12.914 -13.069 8.944 622 H THR 81 H THR 81 -9.021 -7.539 3.622 623 HA THR 81 HA THR 81 -10.788 -6.858 1.199 624 HB THR 81 HB THR 81 -9.660 -4.953 2.256 625 HG1 THR 81 HG1 THR 81 -8.649 -5.607 -0.312 626 HG21 THR 81 HG21 THR 81 -7.270 -4.579 2.309 627 HG22 THR 81 HG22 THR 81 -6.910 -6.023 1.351 628 HG23 THR 81 HG23 THR 81 -7.464 -6.164 3.036 629 H VAL 82 H VAL 82 -10.773 -8.557 -0.167 630 HA VAL 82 HA VAL 82 -8.321 -10.318 -0.388 631 HB VAL 82 HB VAL 82 -10.453 -11.514 -0.196 632 HG11 VAL 82 HG11 VAL 82 -11.782 -12.043 -2.252 633 HG12 VAL 82 HG12 VAL 82 -12.003 -10.340 -1.776 634 HG13 VAL 82 HG13 VAL 82 -10.941 -10.760 -3.152 635 HG21 VAL 82 HG21 VAL 82 -8.881 -12.148 -2.780 636 HG22 VAL 82 HG22 VAL 82 -8.347 -12.549 -1.137 637 HG23 VAL 82 HG23 VAL 82 -9.839 -13.265 -1.779 638 H VAL 83 H VAL 83 -7.008 -10.414 -2.068 639 HA VAL 83 HA VAL 83 -7.177 -8.126 -4.081 640 HB VAL 83 HB VAL 83 -4.634 -9.622 -3.267 641 HG11 VAL 83 HG11 VAL 83 -3.499 -7.553 -4.064 642 HG12 VAL 83 HG12 VAL 83 -4.504 -8.222 -5.367 643 HG13 VAL 83 HG13 VAL 83 -5.057 -6.794 -4.468 644 HG21 VAL 83 HG21 VAL 83 -4.054 -7.669 -1.739 645 HG22 VAL 83 HG22 VAL 83 -5.711 -7.071 -1.872 646 HG23 VAL 83 HG23 VAL 83 -5.395 -8.638 -1.121 647 H GLN 84 H GLN 84 -7.331 -8.505 -6.185 648 HA GLN 84 HA GLN 84 -7.024 -11.374 -7.260 649 HB2 GLN 84 HB2 GLN 84 -8.687 -8.993 -8.216 650 HB3 GLN 84 HB3 GLN 84 -8.246 -10.250 -9.331 651 HG2 GLN 84 HG2 GLN 84 -10.483 -10.679 -8.497 652 HG3 GLN 84 HG3 GLN 84 -9.415 -11.999 -8.102 653 HE21 GLN 84 HE21 GLN 84 -9.324 -12.590 -5.945 654 HE22 GLN 84 HE22 GLN 84 -10.245 -11.676 -4.636 655 H LEU 85 H LEU 85 -5.671 -11.811 -8.917 656 HA LEU 85 HA LEU 85 -3.550 -9.713 -9.565 657 HB2 LEU 85 HB2 LEU 85 -2.814 -11.471 -7.999 658 HB3 LEU 85 HB3 LEU 85 -3.333 -12.735 -9.101 659 HG LEU 85 HG LEU 85 -1.640 -12.080 -10.758 660 HD11 LEU 85 HD11 LEU 85 -0.634 -10.004 -8.688 661 HD12 LEU 85 HD12 LEU 85 -1.344 -9.622 -10.275 662 HD13 LEU 85 HD13 LEU 85 0.200 -10.453 -10.173 663 HD21 LEU 85 HD21 LEU 85 0.384 -12.860 -9.434 664 HD22 LEU 85 HD22 LEU 85 -1.065 -13.814 -9.067 665 HD23 LEU 85 HD23 LEU 85 -0.511 -12.570 -7.924 666 H GLU 86 H GLU 86 -3.436 -9.141 -11.618 667 HA GLU 86 HA GLU 86 -4.173 -11.115 -13.862 668 HB2 GLU 86 HB2 GLU 86 -5.456 -8.889 -13.719 669 HB3 GLU 86 HB3 GLU 86 -3.933 -8.097 -14.089 670 HG2 GLU 86 HG2 GLU 86 -3.833 -9.435 -16.307 671 HG3 GLU 86 HG3 GLU 86 -5.466 -10.008 -15.951 672 H GLY 87 H GLY 87 -2.644 -11.776 -15.085 673 HA2 GLY 87 HA2 GLY 87 -0.453 -12.312 -16.033 674 HA3 GLY 87 HA3 GLY 87 -0.363 -10.575 -16.184 675 H ASP 88 H ASP 88 -0.236 -11.795 -13.085 676 HA ASP 88 HA ASP 88 1.388 -11.796 -11.379 677 HB2 ASP 88 HB2 ASP 88 2.478 -13.607 -12.802 678 HB3 ASP 88 HB3 ASP 88 3.603 -12.386 -13.379 679 H ASN 89 H ASN 89 0.706 -9.322 -12.862 680 HA ASN 89 HA ASN 89 2.660 -7.587 -11.315 681 HB2 ASN 89 HB2 ASN 89 3.364 -6.266 -12.990 682 HB3 ASN 89 HB3 ASN 89 3.402 -7.815 -13.756 683 HD21 ASN 89 HD21 ASN 89 3.081 -4.899 -14.631 684 HD22 ASN 89 HD22 ASN 89 1.720 -5.035 -15.873 685 H LYS 90 H LYS 90 -0.669 -7.668 -12.540 686 HA LYS 90 HA LYS 90 -1.177 -4.965 -11.165 687 HB2 LYS 90 HB2 LYS 90 -2.957 -6.650 -12.978 688 HB3 LYS 90 HB3 LYS 90 -3.423 -5.103 -12.319 689 HG2 LYS 90 HG2 LYS 90 -1.802 -3.883 -13.683 690 HG3 LYS 90 HG3 LYS 90 -0.967 -5.365 -14.159 691 HD2 LYS 90 HD2 LYS 90 -3.108 -6.194 -15.260 692 HD3 LYS 90 HD3 LYS 90 -3.894 -4.672 -14.930 693 HE2 LYS 90 HE2 LYS 90 -1.319 -5.038 -16.639 694 HE3 LYS 90 HE3 LYS 90 -2.956 -5.052 -17.291 695 HZ1 LYS 90 HZ1 LYS 90 -2.018 -2.752 -17.454 696 HZ2 LYS 90 HZ2 LYS 90 -1.680 -2.661 -15.845 697 HZ3 LYS 90 HZ3 LYS 90 -3.244 -2.715 -16.350 698 H LEU 91 H LEU 91 -1.582 -5.216 -9.040 699 HA LEU 91 HA LEU 91 -3.427 -7.456 -8.031 700 HB2 LEU 91 HB2 LEU 91 -1.389 -5.618 -6.698 701 HB3 LEU 91 HB3 LEU 91 -2.550 -6.466 -5.736 702 HG LEU 91 HG LEU 91 -0.530 -7.848 -7.598 703 HD11 LEU 91 HD11 LEU 91 0.570 -6.618 -5.705 704 HD12 LEU 91 HD12 LEU 91 0.686 -8.366 -5.437 705 HD13 LEU 91 HD13 LEU 91 -0.517 -7.395 -4.544 706 HD21 LEU 91 HD21 LEU 91 -2.552 -9.316 -7.117 707 HD22 LEU 91 HD22 LEU 91 -2.297 -9.100 -5.373 708 HD23 LEU 91 HD23 LEU 91 -1.084 -9.946 -6.347 709 H VAL 92 H VAL 92 -5.518 -6.873 -8.011 710 HA VAL 92 HA VAL 92 -6.292 -4.007 -7.225 711 HB VAL 92 HB VAL 92 -8.324 -4.224 -8.496 712 HG11 VAL 92 HG11 VAL 92 -5.925 -4.893 -10.305 713 HG12 VAL 92 HG12 VAL 92 -7.395 -4.001 -10.763 714 HG13 VAL 92 HG13 VAL 92 -6.246 -3.299 -9.603 715 HG21 VAL 92 HG21 VAL 92 -8.758 -6.038 -10.168 716 HG22 VAL 92 HG22 VAL 92 -7.380 -6.972 -9.540 717 HG23 VAL 92 HG23 VAL 92 -8.802 -6.671 -8.514 718 H THR 93 H THR 93 -7.372 -3.638 -5.385 719 HA THR 93 HA THR 93 -9.287 -5.764 -4.342 720 HB THR 93 HB THR 93 -7.028 -6.081 -3.281 721 HG1 THR 93 HG1 THR 93 -8.790 -6.961 -2.353 722 HG21 THR 93 HG21 THR 93 -6.247 -3.796 -2.718 723 HG22 THR 93 HG22 THR 93 -6.440 -4.750 -1.237 724 HG23 THR 93 HG23 THR 93 -7.661 -3.533 -1.652 725 H THR 94 H THR 94 -10.416 -5.013 -2.350 726 HA THR 94 HA THR 94 -11.663 -2.232 -2.801 727 HB THR 94 HB THR 94 -13.231 -4.771 -2.046 728 HG1 THR 94 HG1 THR 94 -14.189 -4.497 -4.030 729 HG21 THR 94 HG21 THR 94 -14.262 -2.670 -1.088 730 HG22 THR 94 HG22 THR 94 -15.273 -3.344 -2.377 731 HG23 THR 94 HG23 THR 94 -14.257 -1.917 -2.702 732 H PHE 95 H PHE 95 -10.699 -1.200 -1.137 733 HA PHE 95 HA PHE 95 -10.154 -2.585 1.509 734 HB2 PHE 95 HB2 PHE 95 -8.567 -1.080 -0.123 735 HB3 PHE 95 HB3 PHE 95 -9.398 0.234 0.629 736 HD1 PHE 95 HD2 PHE 95 -7.236 -2.706 1.214 737 HD2 PHE 95 HD1 PHE 95 -8.528 1.071 2.795 738 HE1 PHE 95 HE2 PHE 95 -5.555 -2.876 3.009 739 HE2 PHE 95 HE1 PHE 95 -6.812 0.924 4.537 740 HZ PHE 95 HZ PHE 95 -5.360 -1.078 4.697 741 H LYS 96 H LYS 96 -10.344 0.330 2.735 742 HA LYS 96 HA LYS 96 -13.201 0.097 3.756 743 HB2 LYS 96 HB2 LYS 96 -11.037 2.195 4.376 744 HB3 LYS 96 HB3 LYS 96 -12.586 2.121 5.160 745 HG2 LYS 96 HG2 LYS 96 -10.462 -0.109 5.342 746 HG3 LYS 96 HG3 LYS 96 -10.557 1.240 6.437 747 HD2 LYS 96 HD2 LYS 96 -12.802 -0.862 6.101 748 HD3 LYS 96 HD3 LYS 96 -11.521 -0.916 7.301 749 HE2 LYS 96 HE2 LYS 96 -12.337 1.401 8.181 750 HE3 LYS 96 HE3 LYS 96 -13.765 1.197 7.165 751 HZ1 LYS 96 HZ1 LYS 96 -12.858 -0.836 9.285 752 HZ2 LYS 96 HZ2 LYS 96 -14.223 -0.973 8.384 753 HZ3 LYS 96 HZ3 LYS 96 -14.034 0.198 9.534 754 H ASN 97 H ASN 97 -14.330 0.497 1.724 755 HA ASN 97 HA ASN 97 -15.067 1.586 -0.199 756 HB2 ASN 97 HB2 ASN 97 -15.085 3.974 1.725 757 HB3 ASN 97 HB3 ASN 97 -15.938 3.863 0.209 758 HD21 ASN 97 HD21 ASN 97 -17.890 2.682 0.110 759 HD22 ASN 97 HD22 ASN 97 -18.630 2.011 1.658 760 H ILE 98 H ILE 98 -12.250 1.397 -0.192 761 HA ILE 98 HA ILE 98 -11.496 3.623 -2.193 762 HB ILE 98 HB ILE 98 -9.667 2.188 -0.188 763 HG12 ILE 98 HG12 ILE 98 -9.946 5.208 0.025 764 HG13 ILE 98 HG13 ILE 98 -11.292 4.279 0.614 765 HG21 ILE 98 HG21 ILE 98 -8.374 2.776 -2.238 766 HG22 ILE 98 HG22 ILE 98 -8.911 4.467 -2.128 767 HG23 ILE 98 HG23 ILE 98 -7.850 3.771 -0.879 768 HD11 ILE 98 HD11 ILE 98 -9.925 3.023 2.215 769 HD12 ILE 98 HD12 ILE 98 -8.419 3.733 1.593 770 HD13 ILE 98 HD13 ILE 98 -9.618 4.759 2.424 771 H LYS 99 H LYS 99 -10.815 2.846 -4.143 772 HA LYS 99 HA LYS 99 -10.548 -0.185 -4.532 773 HB2 LYS 99 HB2 LYS 99 -12.182 1.073 -5.964 774 HB3 LYS 99 HB3 LYS 99 -10.896 1.993 -6.650 775 HG2 LYS 99 HG2 LYS 99 -10.475 0.390 -8.194 776 HG3 LYS 99 HG3 LYS 99 -10.032 -0.774 -6.985 777 HD2 LYS 99 HD2 LYS 99 -12.863 -0.241 -8.085 778 HD3 LYS 99 HD3 LYS 99 -11.849 -1.591 -8.520 779 HE2 LYS 99 HE2 LYS 99 -13.047 -1.111 -5.690 780 HE3 LYS 99 HE3 LYS 99 -13.745 -2.155 -6.915 781 HZ1 LYS 99 HZ1 LYS 99 -11.658 -3.550 -6.836 782 HZ2 LYS 99 HZ2 LYS 99 -12.355 -3.450 -5.333 783 HZ3 LYS 99 HZ3 LYS 99 -11.017 -2.582 -5.666 784 H SER 100 H SER 100 -8.557 -0.753 -3.978 785 HA SER 100 HA SER 100 -6.140 1.008 -4.512 786 HB2 SER 100 HB2 SER 100 -6.486 0.047 -2.244 787 HB3 SER 100 HB3 SER 100 -6.365 -1.584 -2.890 788 HG SER 100 HG SER 100 -4.230 -1.096 -3.572 789 H VAL 101 H VAL 101 -5.183 0.815 -6.375 790 HA VAL 101 HA VAL 101 -5.002 -1.889 -7.848 791 HB VAL 101 HB VAL 101 -4.975 1.003 -8.915 792 HG11 VAL 101 HG11 VAL 101 -3.473 -0.376 -10.339 793 HG12 VAL 101 HG12 VAL 101 -4.731 -1.615 -10.543 794 HG13 VAL 101 HG13 VAL 101 -4.947 0.021 -11.226 795 HG21 VAL 101 HG21 VAL 101 -7.103 0.415 -10.108 796 HG22 VAL 101 HG22 VAL 101 -7.117 -1.193 -9.344 797 HG23 VAL 101 HG23 VAL 101 -7.304 0.271 -8.356 798 H THR 102 H THR 102 -3.049 -2.743 -7.251 799 HA THR 102 HA THR 102 -0.612 -0.911 -7.118 800 HB THR 102 HB THR 102 -0.739 -3.738 -6.013 801 HG1 THR 102 HG1 THR 102 -0.822 -1.593 -4.258 802 HG21 THR 102 HG21 THR 102 1.149 -1.373 -5.359 803 HG22 THR 102 HG22 THR 102 1.574 -2.792 -6.340 804 HG23 THR 102 HG23 THR 102 1.188 -2.991 -4.625 805 H GLU 103 H GLU 103 0.650 -0.867 -8.976 806 HA GLU 103 HA GLU 103 0.576 -3.343 -10.783 807 HB2 GLU 103 HB2 GLU 103 -0.550 -1.231 -11.731 808 HB3 GLU 103 HB3 GLU 103 1.057 -0.532 -11.824 809 HG2 GLU 103 HG2 GLU 103 1.845 -2.368 -13.352 810 HG3 GLU 103 HG3 GLU 103 0.316 -3.206 -13.196 811 H LEU 104 H LEU 104 2.396 -4.240 -11.283 812 HA LEU 104 HA LEU 104 5.071 -2.990 -10.486 813 HB2 LEU 104 HB2 LEU 104 4.057 -5.526 -9.936 814 HB3 LEU 104 HB3 LEU 104 4.971 -5.881 -11.372 815 HG LEU 104 HG LEU 104 5.993 -4.612 -8.755 816 HD11 LEU 104 HD11 LEU 104 5.470 -7.107 -8.753 817 HD12 LEU 104 HD12 LEU 104 7.183 -6.765 -8.485 818 HD13 LEU 104 HD13 LEU 104 6.629 -7.343 -10.071 819 HD21 LEU 104 HD21 LEU 104 7.635 -5.272 -11.294 820 HD22 LEU 104 HD22 LEU 104 8.338 -4.858 -9.710 821 HD23 LEU 104 HD23 LEU 104 7.393 -3.659 -10.598 822 H ASN 105 H ASN 105 6.167 -1.988 -12.049 823 HA ASN 105 HA ASN 105 5.837 -2.856 -15.012 824 HB2 ASN 105 HB2 ASN 105 6.352 -0.078 -13.782 825 HB3 ASN 105 HB3 ASN 105 6.695 -0.452 -15.451 826 HD21 ASN 105 HD21 ASN 105 4.000 -0.336 -13.161 827 HD22 ASN 105 HD22 ASN 105 2.733 -0.216 -14.490 828 H GLY 106 H GLY 106 7.315 -4.542 -14.592 829 HA2 GLY 106 HA2 GLY 106 9.533 -5.450 -15.121 830 HA3 GLY 106 HA3 GLY 106 10.205 -3.833 -15.190 831 H ASP 107 H ASP 107 11.035 -2.966 -13.313 832 HA ASP 107 HA ASP 107 10.834 -4.526 -10.673 833 HB2 ASP 107 HB2 ASP 107 13.438 -3.487 -11.950 834 HB3 ASP 107 HB3 ASP 107 13.306 -3.906 -10.258 835 H ILE 108 H ILE 108 9.420 -2.103 -11.647 836 HA ILE 108 HA ILE 108 9.856 -0.496 -9.103 837 HB ILE 108 HB ILE 108 9.332 1.542 -9.981 838 HG12 ILE 108 HG12 ILE 108 9.503 1.672 -12.713 839 HG13 ILE 108 HG13 ILE 108 8.632 0.171 -12.585 840 HG21 ILE 108 HG21 ILE 108 11.597 0.383 -11.682 841 HG22 ILE 108 HG22 ILE 108 11.339 2.105 -11.292 842 HG23 ILE 108 HG23 ILE 108 11.705 0.952 -10.001 843 HD11 ILE 108 HD11 ILE 108 6.861 1.365 -11.138 844 HD12 ILE 108 HD12 ILE 108 7.790 2.871 -11.303 845 HD13 ILE 108 HD13 ILE 108 7.047 2.116 -12.739 846 H ILE 109 H ILE 109 8.070 -0.251 -7.868 847 HA ILE 109 HA ILE 109 5.466 -1.413 -8.958 848 HB ILE 109 HB ILE 109 6.613 -2.788 -7.182 849 HG12 ILE 109 HG12 ILE 109 3.833 -1.810 -6.318 850 HG13 ILE 109 HG13 ILE 109 4.100 -2.842 -7.714 851 HG21 ILE 109 HG21 ILE 109 7.458 -0.923 -5.670 852 HG22 ILE 109 HG22 ILE 109 5.792 -0.583 -5.164 853 HG23 ILE 109 HG23 ILE 109 6.550 -2.144 -4.778 854 HD11 ILE 109 HD11 ILE 109 3.473 -4.215 -5.724 855 HD12 ILE 109 HD12 ILE 109 5.117 -4.640 -6.269 856 HD13 ILE 109 HD13 ILE 109 4.877 -3.623 -4.829 857 H THR 110 H THR 110 3.712 -0.215 -8.983 858 HA THR 110 HA THR 110 3.729 2.407 -7.415 859 HB THR 110 HB THR 110 3.697 2.562 -9.973 860 HG1 THR 110 HG1 THR 110 2.861 4.092 -8.111 861 HG21 THR 110 HG21 THR 110 1.586 2.619 -11.162 862 HG22 THR 110 HG22 THR 110 0.690 2.070 -9.723 863 HG23 THR 110 HG23 THR 110 1.857 0.982 -10.509 864 H ASN 111 H ASN 111 2.174 2.786 -5.980 865 HA ASN 111 HA ASN 111 -0.092 0.707 -5.673 866 HB2 ASN 111 HB2 ASN 111 1.696 0.737 -3.812 867 HB3 ASN 111 HB3 ASN 111 1.118 2.332 -3.371 868 HD21 ASN 111 HD21 ASN 111 -0.895 2.439 -2.263 869 HD22 ASN 111 HD22 ASN 111 -1.777 0.899 -1.772 870 H THR 112 H THR 112 -1.776 1.635 -6.700 871 HA THR 112 HA THR 112 -2.280 4.645 -6.402 872 HB THR 112 HB THR 112 -3.406 2.748 -8.515 873 HG1 THR 112 HG1 THR 112 -1.086 3.011 -8.466 874 HG21 THR 112 HG21 THR 112 -3.772 4.841 -9.824 875 HG22 THR 112 HG22 THR 112 -3.116 5.827 -8.496 876 HG23 THR 112 HG23 THR 112 -4.652 4.947 -8.282 877 H MET 113 H MET 113 -3.424 4.835 -4.588 878 HA MET 113 HA MET 113 -5.876 3.100 -3.998 879 HB2 MET 113 HB2 MET 113 -4.243 5.066 -2.351 880 HB3 MET 113 HB3 MET 113 -5.860 4.639 -1.846 881 HG2 MET 113 HG2 MET 113 -5.299 2.219 -1.734 882 HG3 MET 113 HG3 MET 113 -3.674 2.529 -2.372 883 HE1 MET 113 HE1 MET 113 -3.340 0.964 -0.334 884 HE2 MET 113 HE2 MET 113 -2.956 1.611 1.283 885 HE3 MET 113 HE3 MET 113 -4.652 1.241 0.847 886 H THR 114 H THR 114 -7.420 3.659 -5.270 887 HA THR 114 HA THR 114 -8.079 6.548 -5.909 888 HB THR 114 HB THR 114 -9.615 5.724 -7.608 889 HG1 THR 114 HG1 THR 114 -8.765 3.154 -6.717 890 HG21 THR 114 HG21 THR 114 -7.214 6.040 -8.279 891 HG22 THR 114 HG22 THR 114 -8.016 4.750 -9.205 892 HG23 THR 114 HG23 THR 114 -6.886 4.328 -7.898 893 H LEU 115 H LEU 115 -9.294 7.598 -4.567 894 HA LEU 115 HA LEU 115 -11.777 6.299 -3.249 895 HB2 LEU 115 HB2 LEU 115 -10.030 6.827 -1.619 896 HB3 LEU 115 HB3 LEU 115 -9.838 8.449 -2.237 897 HG LEU 115 HG LEU 115 -12.129 9.078 -1.431 898 HD11 LEU 115 HD11 LEU 115 -12.214 6.259 -0.151 899 HD12 LEU 115 HD12 LEU 115 -13.286 6.844 -1.440 900 HD13 LEU 115 HD13 LEU 115 -13.357 7.581 0.168 901 HD21 LEU 115 HD21 LEU 115 -10.101 9.477 -0.020 902 HD22 LEU 115 HD22 LEU 115 -10.268 7.865 0.715 903 HD23 LEU 115 HD23 LEU 115 -11.509 9.114 0.995 904 H GLY 116 H GLY 116 -12.688 6.741 -5.383 905 HA2 GLY 116 HA2 GLY 116 -14.337 7.962 -6.680 906 HA3 GLY 116 HA3 GLY 116 -14.396 9.191 -5.437 907 H ASP 117 H ASP 117 -12.989 10.906 -5.597 908 HA ASP 117 HA ASP 117 -11.817 11.549 -8.362 909 HB2 ASP 117 HB2 ASP 117 -12.590 13.427 -6.030 910 HB3 ASP 117 HB3 ASP 117 -11.804 13.945 -7.509 911 H ILE 118 H ILE 118 -10.853 10.956 -5.054 912 HA ILE 118 HA ILE 118 -8.169 12.316 -5.257 913 HB ILE 118 HB ILE 118 -9.223 10.409 -3.116 914 HG12 ILE 118 HG12 ILE 118 -10.732 12.346 -3.111 915 HG13 ILE 118 HG13 ILE 118 -9.856 12.112 -1.626 916 HG21 ILE 118 HG21 ILE 118 -6.831 12.386 -2.988 917 HG22 ILE 118 HG22 ILE 118 -7.439 11.403 -1.645 918 HG23 ILE 118 HG23 ILE 118 -6.711 10.615 -3.047 919 HD11 ILE 118 HD11 ILE 118 -9.101 14.270 -3.709 920 HD12 ILE 118 HD12 ILE 118 -10.058 14.538 -2.226 921 HD13 ILE 118 HD13 ILE 118 -8.363 14.044 -2.096 922 H VAL 119 H VAL 119 -6.553 11.328 -6.333 923 HA VAL 119 HA VAL 119 -6.346 8.253 -6.436 924 HB VAL 119 HB VAL 119 -5.230 10.352 -8.379 925 HG11 VAL 119 HG11 VAL 119 -3.808 8.297 -8.380 926 HG12 VAL 119 HG12 VAL 119 -5.245 7.270 -8.618 927 HG13 VAL 119 HG13 VAL 119 -4.725 8.406 -9.887 928 HG21 VAL 119 HG21 VAL 119 -7.626 8.414 -8.775 929 HG22 VAL 119 HG22 VAL 119 -7.732 10.179 -8.638 930 HG23 VAL 119 HG23 VAL 119 -6.921 9.461 -10.034 931 H PHE 120 H PHE 120 -5.265 7.933 -4.457 932 HA PHE 120 HA PHE 120 -2.697 9.422 -3.840 933 HB2 PHE 120 HB2 PHE 120 -4.044 9.022 -1.960 934 HB3 PHE 120 HB3 PHE 120 -4.304 7.341 -2.333 935 HD1 PHE 120 HD2 PHE 120 -1.046 9.350 -2.101 936 HD2 PHE 120 HD1 PHE 120 -3.397 6.115 -0.512 937 HE1 PHE 120 HE2 PHE 120 0.871 8.585 -0.803 938 HE2 PHE 120 HE1 PHE 120 -1.454 5.356 0.785 939 HZ PHE 120 HZ PHE 120 0.695 6.586 0.639 940 H LYS 121 H LYS 121 -1.245 8.968 -5.350 941 HA LYS 121 HA LYS 121 -0.562 6.062 -5.984 942 HB2 LYS 121 HB2 LYS 121 -1.344 7.669 -7.764 943 HB3 LYS 121 HB3 LYS 121 0.142 8.571 -7.568 944 HG2 LYS 121 HG2 LYS 121 1.489 6.508 -8.185 945 HG3 LYS 121 HG3 LYS 121 -0.004 5.584 -8.350 946 HD2 LYS 121 HD2 LYS 121 -0.803 7.222 -10.136 947 HD3 LYS 121 HD3 LYS 121 0.699 8.130 -9.967 948 HE2 LYS 121 HE2 LYS 121 2.027 6.030 -10.643 949 HE3 LYS 121 HE3 LYS 121 0.514 5.138 -10.823 950 HZ1 LYS 121 HZ1 LYS 121 1.171 7.671 -12.343 951 HZ2 LYS 121 HZ2 LYS 121 -0.202 6.806 -12.535 952 HZ3 LYS 121 HZ3 LYS 121 1.240 6.160 -13.005 953 H ARG 122 H ARG 122 1.000 5.223 -4.825 954 HA ARG 122 HA ARG 122 3.608 6.741 -4.258 955 HB2 ARG 122 HB2 ARG 122 2.608 3.945 -3.428 956 HB3 ARG 122 HB3 ARG 122 4.296 4.346 -3.377 957 HG2 ARG 122 HG2 ARG 122 3.797 6.334 -1.851 958 HG3 ARG 122 HG3 ARG 122 2.124 5.768 -1.723 959 HD2 ARG 122 HD2 ARG 122 2.932 3.549 -0.823 960 HD3 ARG 122 HD3 ARG 122 4.600 4.002 -1.142 961 HE ARG 122 HE ARG 122 3.536 6.032 0.657 962 HH11 ARG 122 HH11 ARG 122 4.700 2.696 0.642 963 HH12 ARG 122 HH12 ARG 122 5.264 2.873 2.384 964 HH21 ARG 122 HH21 ARG 122 4.148 6.101 2.607 965 HH22 ARG 122 HH22 ARG 122 4.944 4.659 3.433 966 H ILE 123 H ILE 123 5.526 6.260 -5.253 967 HA ILE 123 HA ILE 123 5.661 4.026 -7.363 968 HB ILE 123 HB ILE 123 6.926 6.812 -7.648 969 HG12 ILE 123 HG12 ILE 123 5.421 6.685 -9.913 970 HG13 ILE 123 HG13 ILE 123 4.426 5.611 -8.963 971 HG21 ILE 123 HG21 ILE 123 6.960 4.411 -9.597 972 HG22 ILE 123 HG22 ILE 123 7.648 6.022 -9.922 973 HG23 ILE 123 HG23 ILE 123 8.349 5.006 -8.660 974 HD11 ILE 123 HD11 ILE 123 3.561 7.949 -8.880 975 HD12 ILE 123 HD12 ILE 123 4.133 7.565 -7.250 976 HD13 ILE 123 HD13 ILE 123 5.121 8.572 -8.322 977 H SER 124 H SER 124 6.865 2.529 -6.371 978 HA SER 124 HA SER 124 9.409 3.349 -4.839 979 HB2 SER 124 HB2 SER 124 7.441 1.015 -4.279 980 HB3 SER 124 HB3 SER 124 8.928 1.328 -3.385 981 HG SER 124 HG SER 124 6.492 2.399 -2.974 982 H LYS 125 H LYS 125 11.298 2.181 -5.186 983 HA LYS 125 HA LYS 125 11.291 0.421 -7.688 984 HB2 LYS 125 HB2 LYS 125 12.528 2.536 -7.835 985 HB3 LYS 125 HB3 LYS 125 13.548 2.108 -6.461 986 HG2 LYS 125 HG2 LYS 125 14.645 0.323 -7.650 987 HG3 LYS 125 HG3 LYS 125 13.397 0.196 -8.867 988 HD2 LYS 125 HD2 LYS 125 14.077 2.693 -9.539 989 HD3 LYS 125 HD3 LYS 125 15.536 2.395 -8.620 990 HE2 LYS 125 HE2 LYS 125 14.449 0.705 -11.010 991 HE3 LYS 125 HE3 LYS 125 15.674 1.953 -11.163 992 HZ1 LYS 125 HZ1 LYS 125 16.010 -0.551 -9.495 993 HZ2 LYS 125 HZ2 LYS 125 17.160 0.601 -9.650 994 HZ3 LYS 125 HZ3 LYS 125 16.728 -0.313 -10.952 995 H ARG 126 H ARG 126 12.072 -1.633 -7.665 996 HA ARG 126 HA ARG 126 12.161 -3.159 -5.250 997 HB2 ARG 126 HB2 ARG 126 11.641 -3.824 -7.702 998 HB3 ARG 126 HB3 ARG 126 13.371 -3.907 -7.975 999 HG2 ARG 126 HG2 ARG 126 13.489 -5.719 -6.122 1000 HG3 ARG 126 HG3 ARG 126 11.733 -5.578 -5.951 1001 HD2 ARG 126 HD2 ARG 126 11.613 -6.023 -8.555 1002 HD3 ARG 126 HD3 ARG 126 13.322 -6.459 -8.455 1003 HE ARG 126 HE ARG 126 11.921 -8.064 -6.451 1004 HH11 ARG 126 HH11 ARG 126 11.989 -7.753 -9.998 1005 HH12 ARG 126 HH12 ARG 126 11.253 -9.435 -10.128 1006 HH21 ARG 126 HH21 ARG 126 11.146 -9.874 -6.727 1007 HH22 ARG 126 HH22 ARG 126 10.738 -10.548 -8.396 1008 H ILE 127 H ILE 127 13.646 -3.558 -3.790 1009 HA ILE 127 HA ILE 127 16.610 -3.521 -4.358 1010 HB ILE 127 HB ILE 127 15.088 -1.662 -2.448 1011 HG12 ILE 127 HG12 ILE 127 17.494 -1.210 -4.297 1012 HG13 ILE 127 HG13 ILE 127 15.822 -0.835 -4.672 1013 HG21 ILE 127 HG21 ILE 127 17.993 -2.455 -1.910 1014 HG22 ILE 127 HG22 ILE 127 17.059 -1.166 -1.082 1015 HG23 ILE 127 HG23 ILE 127 16.579 -2.856 -0.902 1016 HD11 ILE 127 HD11 ILE 127 15.733 0.845 -2.789 1017 HD12 ILE 127 HD12 ILE 127 17.471 0.596 -2.507 1018 HD13 ILE 127 HD13 ILE 127 16.908 1.251 -4.060 1019 H21 OLA 128 H21 OLA 128 4.084 9.471 15.132 1020 H22 OLA 128 H22 OLA 128 5.041 8.262 14.307 1021 H31 OLA 128 H31 OLA 128 3.833 10.734 12.868 1022 H32 OLA 128 H32 OLA 128 2.947 9.229 13.080 1023 H41 OLA 128 H41 OLA 128 4.709 7.980 11.773 1024 H42 OLA 128 H42 OLA 128 5.622 9.476 11.585 1025 H51 OLA 128 H51 OLA 128 4.438 9.186 9.526 1026 H52 OLA 128 H52 OLA 128 3.627 10.499 10.355 1027 H61 OLA 128 H61 OLA 128 1.816 8.891 11.124 1028 H62 OLA 128 H62 OLA 128 2.661 7.555 10.345 1029 H71 OLA 128 H71 OLA 128 2.377 8.654 8.097 1030 H72 OLA 128 H72 OLA 128 1.595 10.047 8.854 1031 H81 OLA 128 H81 OLA 128 -0.247 8.525 9.739 1032 H82 OLA 128 H82 OLA 128 0.522 7.138 8.980 1033 H9 OLA 128 H9 OLA 128 -0.872 9.527 7.589 1034 H10 OLA 128 H10 OLA 128 -0.905 8.319 5.634 1035 H111 OLA 128 H111 OLA 128 0.096 5.824 6.977 1036 H112 OLA 128 H112 OLA 128 1.445 6.712 6.266 1037 H121 OLA 128 H121 OLA 128 0.281 6.700 4.032 1038 H122 OLA 128 H122 OLA 128 -1.101 5.856 4.723 1039 H131 OLA 128 H131 OLA 128 0.285 3.838 5.175 1040 H132 OLA 128 H132 OLA 128 1.758 4.682 4.676 1041 H141 OLA 128 H141 OLA 128 0.835 5.018 2.370 1042 H142 OLA 128 H142 OLA 128 -0.676 4.239 2.824 1043 H151 OLA 128 H151 OLA 128 0.577 2.069 3.251 1044 H152 OLA 128 H152 OLA 128 2.088 2.863 2.824 1045 H161 OLA 128 H161 OLA 128 1.089 3.442 0.532 1046 H162 OLA 128 H162 OLA 128 -0.349 2.527 0.928 1047 H171 OLA 128 H171 OLA 128 2.481 1.256 0.970 1048 H172 OLA 128 H172 OLA 128 1.542 1.389 -0.499 1049 H181 OLA 128 H181 OLA 128 1.244 -0.868 0.568 1050 H182 OLA 128 H182 OLA 128 0.519 -0.120 2.004 1051 H183 OLA 128 H183 OLA 128 -0.296 -0.009 0.419 1052 H21 OLA 129 H21 OLA 129 5.476 -0.665 -2.216 1053 H22 OLA 129 H22 OLA 129 4.264 -0.171 -3.381 1054 H31 OLA 129 H31 OLA 129 2.406 -0.560 -1.821 1055 H32 OLA 129 H32 OLA 129 3.497 -0.717 -0.446 1056 H41 OLA 129 H41 OLA 129 4.504 -2.785 -1.411 1057 H42 OLA 129 H42 OLA 129 3.477 -2.672 -2.832 1058 H51 OLA 129 H51 OLA 129 2.249 -2.835 0.002 1059 H52 OLA 129 H52 OLA 129 2.834 -4.281 -0.791 1060 H61 OLA 129 H61 OLA 129 1.305 -4.007 -2.687 1061 H62 OLA 129 H62 OLA 129 0.767 -2.425 -2.107 1062 H71 OLA 129 H71 OLA 129 -0.204 -3.503 -0.046 1063 H72 OLA 129 H72 OLA 129 0.359 -5.083 -0.588 1064 H81 OLA 129 H81 OLA 129 -1.066 -4.854 -2.698 1065 H82 OLA 129 H82 OLA 129 -1.648 -3.297 -2.143 1066 H9 OLA 129 H9 OLA 129 -2.413 -6.077 -1.143 1067 H10 OLA 129 H10 OLA 129 -3.952 -5.163 0.324 1068 H111 OLA 129 H111 OLA 129 -4.412 -2.716 0.333 1069 H112 OLA 129 H112 OLA 129 -2.867 -2.347 -0.414 1070 H121 OLA 129 H121 OLA 129 -1.684 -3.207 1.719 1071 H122 OLA 129 H122 OLA 129 -3.266 -3.444 2.461 1072 H131 OLA 129 H131 OLA 129 -3.748 -0.956 2.085 1073 H132 OLA 129 H132 OLA 129 -2.132 -0.776 1.430 1074 H141 OLA 129 H141 OLA 129 -1.186 -1.646 3.668 1075 H142 OLA 129 H142 OLA 129 -2.815 -1.636 4.330 1076 H151 OLA 129 H151 OLA 129 -1.378 0.833 3.151 1077 H152 OLA 129 H152 OLA 129 -1.368 0.427 4.860 1078 H161 OLA 129 H161 OLA 129 -3.786 0.778 5.081 1079 H162 OLA 129 H162 OLA 129 -4.004 0.896 3.340 1080 H171 OLA 129 H171 OLA 129 -2.495 2.980 3.333 1081 H172 OLA 129 H172 OLA 129 -2.492 2.922 5.095 1082 H181 OLA 129 H181 OLA 129 -5.001 3.219 3.274 1083 H182 OLA 129 H182 OLA 129 -5.064 3.127 5.050 1084 H183 OLA 129 H183 OLA 129 -4.264 4.505 4.257 Start of MODEL 10 1 H1 SER 2 H1 SER 2 6.574 -11.847 -11.622 2 H2 SER 2 H2 SER 2 5.850 -10.702 -10.745 3 HA SER 2 HA SER 2 7.135 -12.366 -9.461 4 HB2 SER 2 HB2 SER 2 8.998 -12.554 -11.121 5 HB3 SER 2 HB3 SER 2 9.455 -10.875 -10.827 6 HG SER 2 HG SER 2 9.544 -13.053 -8.998 7 H PHE 3 H PHE 3 6.294 -11.449 -7.727 8 HA PHE 3 HA PHE 3 6.727 -8.543 -7.032 9 HB2 PHE 3 HB2 PHE 3 4.873 -10.737 -5.952 10 HB3 PHE 3 HB3 PHE 3 5.124 -9.307 -5.010 11 HD1 PHE 3 HD2 PHE 3 4.436 -7.050 -5.811 12 HD2 PHE 3 HD1 PHE 3 3.615 -10.578 -8.139 13 HE1 PHE 3 HE2 PHE 3 2.729 -5.819 -7.114 14 HE2 PHE 3 HE1 PHE 3 1.902 -9.341 -9.380 15 HZ PHE 3 HZ PHE 3 1.438 -6.967 -8.847 16 H SER 4 H SER 4 8.282 -11.409 -5.765 17 HA SER 4 HA SER 4 8.811 -10.497 -3.120 18 HB2 SER 4 HB2 SER 4 10.538 -12.319 -4.874 19 HB3 SER 4 HB3 SER 4 10.822 -12.057 -3.151 20 HG SER 4 HG SER 4 9.449 -13.875 -3.632 21 H GLY 5 H GLY 5 9.930 -8.880 -2.220 22 HA2 GLY 5 HA2 GLY 5 12.641 -8.061 -2.708 23 HA3 GLY 5 HA3 GLY 5 11.678 -7.053 -3.789 24 H LYS 6 H LYS 6 13.233 -5.907 -1.965 25 HA LYS 6 HA LYS 6 11.384 -4.768 0.238 26 HB2 LYS 6 HB2 LYS 6 14.425 -4.821 -0.074 27 HB3 LYS 6 HB3 LYS 6 13.611 -3.880 1.147 28 HG2 LYS 6 HG2 LYS 6 12.666 -5.933 2.236 29 HG3 LYS 6 HG3 LYS 6 13.368 -6.952 0.979 30 HD2 LYS 6 HD2 LYS 6 15.685 -6.121 1.597 31 HD3 LYS 6 HD3 LYS 6 15.022 -5.154 2.897 32 HE2 LYS 6 HE2 LYS 6 14.764 -8.252 2.690 33 HE3 LYS 6 HE3 LYS 6 16.062 -7.427 3.549 34 HZ1 LYS 6 HZ1 LYS 6 13.099 -7.383 4.263 35 HZ2 LYS 6 HZ2 LYS 6 14.148 -6.277 4.896 36 HZ3 LYS 6 HZ3 LYS 6 14.344 -7.889 5.205 37 H TYR 7 H TYR 7 10.284 -3.348 -1.144 38 HA TYR 7 HA TYR 7 11.755 -1.824 -3.273 39 HB2 TYR 7 HB2 TYR 7 8.757 -1.696 -2.543 40 HB3 TYR 7 HB3 TYR 7 9.492 -0.965 -3.933 41 HD1 TYR 7 HD2 TYR 7 8.804 -4.342 -2.368 42 HD2 TYR 7 HD1 TYR 7 9.562 -2.183 -6.015 43 HE1 TYR 7 HE2 TYR 7 8.272 -6.329 -3.649 44 HE2 TYR 7 HE1 TYR 7 8.982 -4.204 -7.303 45 HH TYR 7 HH TYR 7 8.112 -7.239 -5.647 46 H GLN 8 H GLN 8 12.842 0.009 -2.703 47 HA GLN 8 HA GLN 8 11.888 1.693 -0.412 48 HB2 GLN 8 HB2 GLN 8 14.359 1.288 -0.901 49 HB3 GLN 8 HB3 GLN 8 14.216 2.435 -2.236 50 HG2 GLN 8 HG2 GLN 8 13.367 4.198 -0.565 51 HG3 GLN 8 HG3 GLN 8 13.546 3.025 0.735 52 HE21 GLN 8 HE21 GLN 8 14.699 5.067 1.385 53 HE22 GLN 8 HE22 GLN 8 16.504 5.074 0.994 54 H LEU 9 H LEU 9 10.866 3.550 -0.410 55 HA LEU 9 HA LEU 9 9.232 4.336 -2.719 56 HB2 LEU 9 HB2 LEU 9 8.421 4.385 -0.409 57 HB3 LEU 9 HB3 LEU 9 9.610 5.588 0.043 58 HG LEU 9 HG LEU 9 8.490 7.289 -1.463 59 HD11 LEU 9 HD11 LEU 9 7.401 5.833 -3.170 60 HD12 LEU 9 HD12 LEU 9 6.164 6.787 -2.347 61 HD13 LEU 9 HD13 LEU 9 6.393 5.066 -1.935 62 HD21 LEU 9 HD21 LEU 9 6.641 5.937 0.605 63 HD22 LEU 9 HD22 LEU 9 6.494 7.607 0.006 64 HD23 LEU 9 HD23 LEU 9 7.905 7.134 0.961 65 H GLN 10 H GLN 10 9.477 5.775 -4.224 66 HA GLN 10 HA GLN 10 11.775 7.804 -4.144 67 HB2 GLN 10 HB2 GLN 10 10.350 6.473 -6.520 68 HB3 GLN 10 HB3 GLN 10 11.585 7.700 -6.675 69 HG2 GLN 10 HG2 GLN 10 12.104 5.015 -5.219 70 HG3 GLN 10 HG3 GLN 10 12.210 5.223 -6.940 71 HE21 GLN 10 HE21 GLN 10 14.433 4.496 -6.490 72 HE22 GLN 10 HE22 GLN 10 15.683 5.743 -5.979 73 H SER 11 H SER 11 8.566 7.545 -5.666 74 HA SER 11 HA SER 11 8.068 10.517 -4.972 75 HB2 SER 11 HB2 SER 11 8.494 10.176 -7.411 76 HB3 SER 11 HB3 SER 11 7.164 9.029 -7.506 77 HG SER 11 HG SER 11 7.053 11.813 -6.946 78 H GLN 12 H GLN 12 6.192 11.070 -4.057 79 HA GLN 12 HA GLN 12 3.988 8.988 -3.617 80 HB2 GLN 12 HB2 GLN 12 5.643 9.255 -1.632 81 HB3 GLN 12 HB3 GLN 12 5.029 10.900 -1.435 82 HG2 GLN 12 HG2 GLN 12 2.807 10.108 -0.844 83 HG3 GLN 12 HG3 GLN 12 3.113 8.497 -1.443 84 HE21 GLN 12 HE21 GLN 12 4.995 10.510 0.926 85 HE22 GLN 12 HE22 GLN 12 4.752 9.281 2.262 86 H GLU 13 H GLU 13 2.306 9.793 -4.728 87 HA GLU 13 HA GLU 13 2.135 12.648 -5.470 88 HB2 GLU 13 HB2 GLU 13 1.812 10.590 -6.936 89 HB3 GLU 13 HB3 GLU 13 0.323 10.256 -6.076 90 HG2 GLU 13 HG2 GLU 13 -0.527 12.607 -6.958 91 HG3 GLU 13 HG3 GLU 13 0.929 12.639 -7.950 92 H ASN 14 H ASN 14 -1.021 11.407 -4.961 93 HA ASN 14 HA ASN 14 -1.714 13.714 -3.248 94 HB2 ASN 14 HB2 ASN 14 -3.402 11.394 -4.345 95 HB3 ASN 14 HB3 ASN 14 -4.075 12.639 -3.388 96 HD21 ASN 14 HD21 ASN 14 -3.240 11.855 -6.599 97 HD22 ASN 14 HD22 ASN 14 -3.625 13.538 -7.229 98 H PHE 15 H PHE 15 -0.048 12.655 -1.623 99 HA PHE 15 HA PHE 15 -1.305 11.058 0.545 100 HB2 PHE 15 HB2 PHE 15 1.191 11.312 0.024 101 HB3 PHE 15 HB3 PHE 15 1.166 12.888 0.752 102 HD1 PHE 15 HD1 PHE 15 0.733 13.085 3.269 103 HD2 PHE 15 HD2 PHE 15 1.210 9.265 1.375 104 HE1 PHE 15 HE1 PHE 15 1.323 12.061 5.427 105 HE2 PHE 15 HE2 PHE 15 1.822 8.270 3.528 106 HZ PHE 15 HZ PHE 15 1.856 9.662 5.571 107 H GLU 16 H GLU 16 -0.555 14.585 0.516 108 HA GLU 16 HA GLU 16 -2.010 15.373 2.888 109 HB2 GLU 16 HB2 GLU 16 -1.058 16.783 0.336 110 HB3 GLU 16 HB3 GLU 16 -2.197 17.648 1.306 111 HG2 GLU 16 HG2 GLU 16 0.356 16.521 2.636 112 HG3 GLU 16 HG3 GLU 16 0.343 18.057 1.768 113 H ALA 17 H ALA 17 -3.323 15.369 -0.434 114 HA ALA 17 HA ALA 17 -6.058 16.155 0.329 115 HB1 ALA 17 HB1 ALA 17 -5.070 14.661 -2.199 116 HB2 ALA 17 HB2 ALA 17 -6.613 15.525 -2.019 117 HB3 ALA 17 HB3 ALA 17 -5.096 16.429 -1.982 118 H PHE 18 H PHE 18 -4.603 12.913 0.077 119 HA PHE 18 HA PHE 18 -7.226 11.467 0.456 120 HB2 PHE 18 HB2 PHE 18 -5.285 10.557 -0.899 121 HB3 PHE 18 HB3 PHE 18 -4.325 10.422 0.539 122 HD1 PHE 18 HD2 PHE 18 -4.961 8.704 2.319 123 HD2 PHE 18 HD1 PHE 18 -6.973 8.844 -1.481 124 HE1 PHE 18 HE2 PHE 18 -5.647 6.360 2.587 125 HE2 PHE 18 HE1 PHE 18 -7.662 6.509 -1.193 126 HZ PHE 18 HZ PHE 18 -6.990 5.259 0.842 127 H MET 19 H MET 19 -4.348 11.960 2.595 128 HA MET 19 HA MET 19 -5.615 10.684 4.916 129 HB2 MET 19 HB2 MET 19 -3.214 12.576 4.727 130 HB3 MET 19 HB3 MET 19 -3.797 11.844 6.218 131 HG2 MET 19 HG2 MET 19 -1.906 10.541 5.340 132 HG3 MET 19 HG3 MET 19 -3.376 9.551 5.410 133 HE1 MET 19 HE1 MET 19 -2.809 7.768 3.973 134 HE2 MET 19 HE2 MET 19 -2.535 7.840 2.211 135 HE3 MET 19 HE3 MET 19 -1.192 8.199 3.323 136 H LYS 20 H LYS 20 -5.603 14.160 3.975 137 HA LYS 20 HA LYS 20 -7.315 14.948 6.302 138 HB2 LYS 20 HB2 LYS 20 -6.598 16.376 3.679 139 HB3 LYS 20 HB3 LYS 20 -7.904 16.965 4.684 140 HG2 LYS 20 HG2 LYS 20 -6.370 17.097 6.690 141 HG3 LYS 20 HG3 LYS 20 -5.008 16.620 5.698 142 HD2 LYS 20 HD2 LYS 20 -6.757 19.028 4.869 143 HD3 LYS 20 HD3 LYS 20 -5.662 19.235 6.194 144 HE2 LYS 20 HE2 LYS 20 -4.624 18.156 3.471 145 HE3 LYS 20 HE3 LYS 20 -4.879 19.882 3.740 146 HZ1 LYS 20 HZ1 LYS 20 -2.537 19.242 4.358 147 HZ2 LYS 20 HZ2 LYS 20 -3.054 18.172 5.427 148 HZ3 LYS 20 HZ3 LYS 20 -3.354 19.772 5.754 149 H ALA 21 H ALA 21 -8.189 13.873 2.918 150 HA ALA 21 HA ALA 21 -11.084 14.170 3.309 151 HB1 ALA 21 HB1 ALA 21 -11.241 12.655 1.314 152 HB2 ALA 21 HB2 ALA 21 -10.027 13.923 1.060 153 HB3 ALA 21 HB3 ALA 21 -9.511 12.265 1.450 154 H ILE 22 H ILE 22 -8.945 11.395 4.122 155 HA ILE 22 HA ILE 22 -11.328 9.822 5.165 156 HB ILE 22 HB ILE 22 -9.855 7.999 5.704 157 HG12 ILE 22 HG12 ILE 22 -7.455 9.473 4.500 158 HG13 ILE 22 HG13 ILE 22 -7.738 9.429 6.227 159 HG21 ILE 22 HG21 ILE 22 -9.304 7.273 3.401 160 HG22 ILE 22 HG22 ILE 22 -10.820 8.195 3.380 161 HG23 ILE 22 HG23 ILE 22 -9.309 8.954 2.828 162 HD11 ILE 22 HD11 ILE 22 -7.285 6.931 4.455 163 HD12 ILE 22 HD12 ILE 22 -6.116 7.671 5.567 164 HD13 ILE 22 HD13 ILE 22 -7.591 6.904 6.213 165 H GLY 23 H GLY 23 -9.625 12.287 6.551 166 HA2 GLY 23 HA2 GLY 23 -10.123 13.159 8.776 167 HA3 GLY 23 HA3 GLY 23 -10.739 11.609 9.277 168 H LEU 24 H LEU 24 -7.435 12.453 8.091 169 HA LEU 24 HA LEU 24 -6.360 11.681 10.838 170 HB2 LEU 24 HB2 LEU 24 -5.384 11.221 8.008 171 HB3 LEU 24 HB3 LEU 24 -4.156 11.714 9.116 172 HG LEU 24 HG LEU 24 -5.083 9.843 10.764 173 HD11 LEU 24 HD11 LEU 24 -7.196 9.324 9.487 174 HD12 LEU 24 HD12 LEU 24 -6.158 7.904 9.633 175 HD13 LEU 24 HD13 LEU 24 -6.236 8.794 8.091 176 HD21 LEU 24 HD21 LEU 24 -2.866 9.777 9.674 177 HD22 LEU 24 HD22 LEU 24 -3.582 9.092 8.189 178 HD23 LEU 24 HD23 LEU 24 -3.608 8.167 9.720 179 HA PRO 25 HA PRO 25 -4.854 15.714 11.832 180 HB2 PRO 25 HB2 PRO 25 -2.585 15.184 13.424 181 HB3 PRO 25 HB3 PRO 25 -4.243 14.986 13.902 182 HG2 PRO 25 HG2 PRO 25 -2.269 12.907 12.935 183 HG3 PRO 25 HG3 PRO 25 -3.480 12.703 14.215 184 HD2 PRO 25 HD2 PRO 25 -3.647 11.778 11.540 185 HD3 PRO 25 HD3 PRO 25 -5.074 11.983 12.578 186 H GLU 26 H GLU 26 -3.701 17.355 11.003 187 HA GLU 26 HA GLU 26 -1.871 17.090 8.813 188 HB2 GLU 26 HB2 GLU 26 -2.513 19.460 10.612 189 HB3 GLU 26 HB3 GLU 26 -1.535 19.538 9.186 190 HG2 GLU 26 HG2 GLU 26 -3.629 18.431 7.916 191 HG3 GLU 26 HG3 GLU 26 -4.543 18.927 9.328 192 H GLU 27 H GLU 27 -1.047 17.469 12.207 193 HA GLU 27 HA GLU 27 1.864 17.816 11.951 194 HB2 GLU 27 HB2 GLU 27 0.642 18.331 13.980 195 HB3 GLU 27 HB3 GLU 27 0.044 16.700 14.179 196 HG2 GLU 27 HG2 GLU 27 3.083 17.241 14.302 197 HG3 GLU 27 HG3 GLU 27 2.041 17.610 15.666 198 H LEU 28 H LEU 28 0.028 14.718 12.395 199 HA LEU 28 HA LEU 28 2.441 13.053 11.868 200 HB2 LEU 28 HB2 LEU 28 -0.450 12.093 11.625 201 HB3 LEU 28 HB3 LEU 28 0.987 11.111 11.793 202 HG LEU 28 HG LEU 28 -0.223 12.927 13.960 203 HD11 LEU 28 HD11 LEU 28 -0.008 9.838 13.812 204 HD12 LEU 28 HD12 LEU 28 -1.489 10.762 13.483 205 HD13 LEU 28 HD13 LEU 28 -0.779 10.782 15.109 206 HD21 LEU 28 HD21 LEU 28 2.154 11.027 14.417 207 HD22 LEU 28 HD22 LEU 28 1.395 12.142 15.567 208 HD23 LEU 28 HD23 LEU 28 2.313 12.790 14.211 209 H ILE 29 H ILE 29 -0.063 14.329 9.745 210 HA ILE 29 HA ILE 29 0.687 12.808 7.315 211 HB ILE 29 HB ILE 29 -0.782 15.495 7.480 212 HG12 ILE 29 HG12 ILE 29 -1.991 12.696 7.043 213 HG13 ILE 29 HG13 ILE 29 -1.935 13.438 8.598 214 HG21 ILE 29 HG21 ILE 29 -0.737 13.531 5.080 215 HG22 ILE 29 HG22 ILE 29 -1.570 15.092 5.164 216 HG23 ILE 29 HG23 ILE 29 0.184 15.060 5.144 217 HD11 ILE 29 HD11 ILE 29 -3.348 15.395 7.840 218 HD12 ILE 29 HD12 ILE 29 -3.504 14.648 6.230 219 HD13 ILE 29 HD13 ILE 29 -4.178 13.841 7.653 220 H GLN 30 H GLN 30 1.564 16.101 8.452 221 HA GLN 30 HA GLN 30 3.604 16.656 6.404 222 HB2 GLN 30 HB2 GLN 30 2.932 17.792 9.154 223 HB3 GLN 30 HB3 GLN 30 4.507 18.140 8.544 224 HG2 GLN 30 HG2 GLN 30 2.655 19.883 8.055 225 HG3 GLN 30 HG3 GLN 30 3.822 19.503 6.818 226 HE21 GLN 30 HE21 GLN 30 0.551 18.369 7.731 227 HE22 GLN 30 HE22 GLN 30 0.034 18.282 5.957 228 H LYS 31 H LYS 31 3.833 14.537 9.143 229 HA LYS 31 HA LYS 31 6.863 14.309 9.000 230 HB2 LYS 31 HB2 LYS 31 4.669 12.851 10.594 231 HB3 LYS 31 HB3 LYS 31 6.314 12.264 10.564 232 HG2 LYS 31 HG2 LYS 31 7.208 14.333 11.565 233 HG3 LYS 31 HG3 LYS 31 5.634 15.139 11.455 234 HD2 LYS 31 HD2 LYS 31 4.584 13.566 13.007 235 HD3 LYS 31 HD3 LYS 31 5.997 12.507 13.018 236 HE2 LYS 31 HE2 LYS 31 7.386 14.220 14.183 237 HE3 LYS 31 HE3 LYS 31 6.073 15.424 14.067 238 HZ1 LYS 31 HZ1 LYS 31 4.636 14.097 15.413 239 HZ2 LYS 31 HZ2 LYS 31 6.065 14.063 16.264 240 HZ3 LYS 31 HZ3 LYS 31 5.648 12.716 15.364 241 H GLY 32 H GLY 32 4.108 12.065 8.257 242 HA2 GLY 32 HA2 GLY 32 5.892 10.141 6.824 243 HA3 GLY 32 HA3 GLY 32 4.157 10.044 6.886 244 H LYS 33 H LYS 33 4.422 13.008 5.529 245 HA LYS 33 HA LYS 33 3.948 12.040 2.832 246 HB2 LYS 33 HB2 LYS 33 3.753 14.333 2.137 247 HB3 LYS 33 HB3 LYS 33 2.930 14.079 3.657 248 HG2 LYS 33 HG2 LYS 33 4.735 15.194 4.934 249 HG3 LYS 33 HG3 LYS 33 5.728 15.380 3.516 250 HD2 LYS 33 HD2 LYS 33 2.937 16.633 3.737 251 HD3 LYS 33 HD3 LYS 33 4.368 17.438 4.326 252 HE2 LYS 33 HE2 LYS 33 4.103 16.508 1.376 253 HE3 LYS 33 HE3 LYS 33 3.558 18.081 1.939 254 HZ1 LYS 33 HZ1 LYS 33 6.007 17.954 1.049 255 HZ2 LYS 33 HZ2 LYS 33 6.444 17.181 2.396 256 HZ3 LYS 33 HZ3 LYS 33 5.850 18.693 2.526 257 H ASP 34 H ASP 34 6.999 13.478 4.004 258 HA ASP 34 HA ASP 34 8.255 13.038 1.246 259 HB2 ASP 34 HB2 ASP 34 9.288 14.692 3.629 260 HB3 ASP 34 HB3 ASP 34 9.990 14.636 2.025 261 H ILE 35 H ILE 35 8.261 11.186 4.028 262 HA ILE 35 HA ILE 35 11.166 10.521 4.189 263 HB ILE 35 HB ILE 35 8.739 9.135 5.440 264 HG12 ILE 35 HG12 ILE 35 10.880 10.882 6.832 265 HG13 ILE 35 HG13 ILE 35 9.371 11.537 6.243 266 HG21 ILE 35 HG21 ILE 35 11.726 8.579 6.071 267 HG22 ILE 35 HG22 ILE 35 10.337 7.902 6.953 268 HG23 ILE 35 HG23 ILE 35 10.606 7.447 5.277 269 HD11 ILE 35 HD11 ILE 35 9.551 9.389 8.457 270 HD12 ILE 35 HD12 ILE 35 9.141 11.108 8.641 271 HD13 ILE 35 HD13 ILE 35 8.040 10.036 7.767 272 H LYS 36 H LYS 36 12.172 9.473 2.584 273 HA LYS 36 HA LYS 36 10.865 7.483 0.781 274 HB2 LYS 36 HB2 LYS 36 13.828 8.272 1.081 275 HB3 LYS 36 HB3 LYS 36 13.223 7.092 -0.058 276 HG2 LYS 36 HG2 LYS 36 11.640 8.946 -1.003 277 HG3 LYS 36 HG3 LYS 36 12.596 10.105 -0.078 278 HD2 LYS 36 HD2 LYS 36 14.713 9.251 -1.266 279 HD3 LYS 36 HD3 LYS 36 13.729 8.062 -2.121 280 HE2 LYS 36 HE2 LYS 36 12.350 10.065 -3.100 281 HE3 LYS 36 HE3 LYS 36 13.565 11.143 -2.424 282 HZ1 LYS 36 HZ1 LYS 36 14.158 8.876 -4.377 283 HZ2 LYS 36 HZ2 LYS 36 15.296 9.873 -3.747 284 HZ3 LYS 36 HZ3 LYS 36 14.151 10.474 -4.767 285 H GLY 37 H GLY 37 10.097 6.221 2.681 286 HA2 GLY 37 HA2 GLY 37 11.968 4.305 4.009 287 HA3 GLY 37 HA3 GLY 37 10.221 4.304 4.149 288 H VAL 38 H VAL 38 11.277 2.002 4.195 289 HA VAL 38 HA VAL 38 11.343 0.688 1.451 290 HB VAL 38 HB VAL 38 11.957 -0.460 4.223 291 HG11 VAL 38 HG11 VAL 38 12.287 -1.837 1.473 292 HG12 VAL 38 HG12 VAL 38 12.908 -2.464 3.024 293 HG13 VAL 38 HG13 VAL 38 11.167 -2.333 2.761 294 HG21 VAL 38 HG21 VAL 38 14.349 -0.539 3.416 295 HG22 VAL 38 HG22 VAL 38 13.876 0.209 1.870 296 HG23 VAL 38 HG23 VAL 38 13.757 1.127 3.386 297 H SER 39 H SER 39 9.756 -0.472 0.620 298 HA SER 39 HA SER 39 7.366 -1.398 2.324 299 HB2 SER 39 HB2 SER 39 7.498 -0.427 -0.573 300 HB3 SER 39 HB3 SER 39 6.109 -1.268 0.086 301 HG SER 39 HG SER 39 5.800 0.963 0.224 302 H GLU 40 H GLU 40 7.986 -3.393 2.713 303 HA GLU 40 HA GLU 40 9.350 -5.176 0.709 304 HB2 GLU 40 HB2 GLU 40 9.846 -5.020 3.247 305 HB3 GLU 40 HB3 GLU 40 8.325 -5.805 3.517 306 HG2 GLU 40 HG2 GLU 40 9.080 -7.904 2.415 307 HG3 GLU 40 HG3 GLU 40 10.600 -7.154 1.938 308 H ILE 41 H ILE 41 8.595 -7.005 -0.228 309 HA ILE 41 HA ILE 41 5.905 -8.124 0.585 310 HB ILE 41 HB ILE 41 6.577 -7.744 -2.412 311 HG12 ILE 41 HG12 ILE 41 4.341 -6.287 -0.868 312 HG13 ILE 41 HG13 ILE 41 5.868 -5.556 -1.316 313 HG21 ILE 41 HG21 ILE 41 5.203 -9.832 -1.980 314 HG22 ILE 41 HG22 ILE 41 3.991 -8.868 -1.102 315 HG23 ILE 41 HG23 ILE 41 4.255 -8.642 -2.847 316 HD11 ILE 41 HD11 ILE 41 5.405 -5.939 -3.775 317 HD12 ILE 41 HD12 ILE 41 3.777 -6.541 -3.353 318 HD13 ILE 41 HD13 ILE 41 4.228 -4.879 -2.974 319 H VAL 42 H VAL 42 6.200 -10.287 0.914 320 HA VAL 42 HA VAL 42 8.297 -11.852 -0.705 321 HB VAL 42 HB VAL 42 7.006 -12.915 1.850 322 HG11 VAL 42 HG11 VAL 42 9.717 -13.580 0.523 323 HG12 VAL 42 HG12 VAL 42 9.008 -14.385 1.942 324 HG13 VAL 42 HG13 VAL 42 8.241 -14.553 0.352 325 HG21 VAL 42 HG21 VAL 42 8.100 -10.830 2.632 326 HG22 VAL 42 HG22 VAL 42 8.991 -12.247 3.198 327 HG23 VAL 42 HG23 VAL 42 9.621 -11.287 1.830 328 H GLN 43 H GLN 43 7.299 -12.733 -2.465 329 HA GLN 43 HA GLN 43 4.383 -13.441 -2.480 330 HB2 GLN 43 HB2 GLN 43 5.520 -12.317 -4.378 331 HB3 GLN 43 HB3 GLN 43 6.564 -13.707 -4.634 332 HG2 GLN 43 HG2 GLN 43 4.564 -15.132 -5.216 333 HG3 GLN 43 HG3 GLN 43 3.487 -13.792 -4.852 334 HE21 GLN 43 HE21 GLN 43 2.755 -14.319 -7.040 335 HE22 GLN 43 HE22 GLN 43 3.613 -13.523 -8.467 336 H ASN 44 H ASN 44 3.848 -15.249 -1.327 337 HA ASN 44 HA ASN 44 5.312 -17.907 -1.913 338 HB2 ASN 44 HB2 ASN 44 3.620 -17.159 0.559 339 HB3 ASN 44 HB3 ASN 44 4.415 -18.678 0.267 340 HD21 ASN 44 HD21 ASN 44 5.110 -15.279 0.903 341 HD22 ASN 44 HD22 ASN 44 6.744 -15.672 1.632 342 H GLY 45 H GLY 45 3.897 -17.579 -3.932 343 HA2 GLY 45 HA2 GLY 45 2.142 -18.557 -5.294 344 HA3 GLY 45 HA3 GLY 45 1.659 -19.549 -3.933 345 H LYS 46 H LYS 46 0.000 -18.797 -2.624 346 HA LYS 46 HA LYS 46 -1.728 -16.486 -3.621 347 HB2 LYS 46 HB2 LYS 46 -2.280 -18.701 -1.548 348 HB3 LYS 46 HB3 LYS 46 -3.367 -17.370 -1.866 349 HG2 LYS 46 HG2 LYS 46 -3.700 -18.101 -4.252 350 HG3 LYS 46 HG3 LYS 46 -2.518 -19.370 -4.032 351 HD2 LYS 46 HD2 LYS 46 -4.253 -20.725 -3.590 352 HD3 LYS 46 HD3 LYS 46 -4.186 -20.125 -1.966 353 HE2 LYS 46 HE2 LYS 46 -6.076 -19.131 -4.234 354 HE3 LYS 46 HE3 LYS 46 -6.512 -20.256 -2.955 355 HZ1 LYS 46 HZ1 LYS 46 -7.254 -18.132 -2.138 356 HZ2 LYS 46 HZ2 LYS 46 -5.930 -17.331 -2.688 357 HZ3 LYS 46 HZ3 LYS 46 -5.822 -18.305 -1.349 358 H HIS 47 H HIS 47 0.365 -17.285 -0.846 359 HA HIS 47 HA HIS 47 -0.765 -14.990 0.816 360 HB2 HIS 47 HB2 HIS 47 1.213 -17.245 1.515 361 HB3 HIS 47 HB3 HIS 47 0.931 -15.880 2.565 362 HD1 HIS 47 HD1 HIS 47 -0.780 -19.135 1.473 363 HD2 HIS 47 HD2 HIS 47 -1.505 -15.586 3.755 364 HE1 HIS 47 HE1 HIS 47 -2.946 -19.389 2.864 365 H PHE 48 H PHE 48 -0.002 -13.085 0.357 366 HA PHE 48 HA PHE 48 2.931 -12.627 -0.440 367 HB2 PHE 48 HB2 PHE 48 0.344 -11.027 -0.787 368 HB3 PHE 48 HB3 PHE 48 1.901 -10.293 -0.965 369 HD1 PHE 48 HD1 PHE 48 0.335 -13.546 -2.333 370 HD2 PHE 48 HD2 PHE 48 2.326 -9.830 -3.174 371 HE1 PHE 48 HE1 PHE 48 0.218 -14.015 -4.735 372 HE2 PHE 48 HE2 PHE 48 2.161 -10.301 -5.569 373 HZ PHE 48 HZ PHE 48 1.134 -12.374 -6.365 374 H LYS 49 H LYS 49 4.099 -12.373 1.387 375 HA LYS 49 HA LYS 49 2.937 -11.077 3.881 376 HB2 LYS 49 HB2 LYS 49 5.709 -12.304 3.453 377 HB3 LYS 49 HB3 LYS 49 5.123 -11.665 4.971 378 HG2 LYS 49 HG2 LYS 49 3.345 -13.347 5.131 379 HG3 LYS 49 HG3 LYS 49 3.650 -13.923 3.507 380 HD2 LYS 49 HD2 LYS 49 6.125 -14.438 4.409 381 HD3 LYS 49 HD3 LYS 49 5.443 -14.237 6.010 382 HE2 LYS 49 HE2 LYS 49 4.525 -16.268 3.847 383 HE3 LYS 49 HE3 LYS 49 5.594 -16.635 5.195 384 HZ1 LYS 49 HZ1 LYS 49 3.311 -17.270 5.901 385 HZ2 LYS 49 HZ2 LYS 49 2.644 -15.844 5.429 386 HZ3 LYS 49 HZ3 LYS 49 3.582 -15.851 6.704 387 H PHE 50 H PHE 50 3.031 -8.987 4.160 388 HA PHE 50 HA PHE 50 5.283 -7.414 2.821 389 HB2 PHE 50 HB2 PHE 50 3.958 -5.500 2.508 390 HB3 PHE 50 HB3 PHE 50 3.255 -6.880 1.753 391 HD1 PHE 50 HD2 PHE 50 2.770 -5.300 5.282 392 HD2 PHE 50 HD1 PHE 50 1.043 -6.344 1.495 393 HE1 PHE 50 HE2 PHE 50 0.637 -4.371 5.996 394 HE2 PHE 50 HE1 PHE 50 -1.097 -5.441 2.220 395 HZ PHE 50 HZ PHE 50 -1.322 -4.432 4.480 396 H THR 51 H THR 51 6.389 -5.880 3.706 397 HA THR 51 HA THR 51 5.847 -5.097 6.652 398 HB THR 51 HB THR 51 8.696 -5.317 5.545 399 HG1 THR 51 HG1 THR 51 8.653 -7.352 5.840 400 HG21 THR 51 HG21 THR 51 8.471 -3.882 7.540 401 HG22 THR 51 HG22 THR 51 9.361 -5.380 7.906 402 HG23 THR 51 HG23 THR 51 7.676 -5.212 8.431 403 H ILE 52 H ILE 52 4.779 -3.193 6.158 404 HA ILE 52 HA ILE 52 5.983 -1.327 4.065 405 HB ILE 52 HB ILE 52 3.162 -1.376 5.209 406 HG12 ILE 52 HG12 ILE 52 3.431 -3.360 3.884 407 HG13 ILE 52 HG13 ILE 52 2.393 -2.261 3.018 408 HG21 ILE 52 HG21 ILE 52 2.512 0.148 3.327 409 HG22 ILE 52 HG22 ILE 52 3.664 0.927 4.412 410 HG23 ILE 52 HG23 ILE 52 4.216 0.300 2.838 411 HD11 ILE 52 HD11 ILE 52 5.375 -2.859 2.381 412 HD12 ILE 52 HD12 ILE 52 3.975 -3.416 1.466 413 HD13 ILE 52 HD13 ILE 52 4.373 -1.684 1.485 414 H THR 53 H THR 53 6.721 0.588 4.477 415 HA THR 53 HA THR 53 6.773 1.678 7.311 416 HB THR 53 HB THR 53 8.409 3.380 6.379 417 HG1 THR 53 HG1 THR 53 8.659 1.547 4.236 418 HG21 THR 53 HG21 THR 53 10.348 1.818 6.315 419 HG22 THR 53 HG22 THR 53 9.255 0.417 6.170 420 HG23 THR 53 HG23 THR 53 9.249 1.410 7.647 421 H ALA 54 H ALA 54 5.104 2.781 7.824 422 HA ALA 54 HA ALA 54 3.831 4.917 5.996 423 HB1 ALA 54 HB1 ALA 54 2.915 3.589 8.648 424 HB2 ALA 54 HB2 ALA 54 2.016 4.844 7.786 425 HB3 ALA 54 HB3 ALA 54 2.272 3.262 7.016 426 H GLY 55 H GLY 55 6.060 5.837 6.315 427 HA2 GLY 55 HA2 GLY 55 7.210 7.844 7.006 428 HA3 GLY 55 HA3 GLY 55 5.960 8.215 8.179 429 H SER 56 H SER 56 6.112 7.310 10.219 430 HA SER 56 HA SER 56 8.817 6.184 11.102 431 HB2 SER 56 HB2 SER 56 6.538 7.213 12.890 432 HB3 SER 56 HB3 SER 56 8.149 6.746 13.407 433 HG SER 56 HG SER 56 7.631 9.108 13.007 434 H LYS 57 H LYS 57 5.396 5.158 10.963 435 HA LYS 57 HA LYS 57 5.875 2.837 12.828 436 HB2 LYS 57 HB2 LYS 57 3.693 4.165 12.818 437 HB3 LYS 57 HB3 LYS 57 3.329 3.500 11.233 438 HG2 LYS 57 HG2 LYS 57 3.528 1.120 12.319 439 HG3 LYS 57 HG3 LYS 57 3.694 1.922 13.878 440 HD2 LYS 57 HD2 LYS 57 1.385 2.974 13.536 441 HD3 LYS 57 HD3 LYS 57 1.274 2.182 11.962 442 HE2 LYS 57 HE2 LYS 57 1.583 -0.112 13.157 443 HE3 LYS 57 HE3 LYS 57 1.525 0.737 14.705 444 HZ1 LYS 57 HZ1 LYS 57 -0.697 0.534 12.630 445 HZ2 LYS 57 HZ2 LYS 57 -0.802 1.605 13.898 446 HZ3 LYS 57 HZ3 LYS 57 -0.753 -0.047 14.079 447 H VAL 58 H VAL 58 6.395 0.857 12.245 448 HA VAL 58 HA VAL 58 6.454 -0.031 9.340 449 HB VAL 58 HB VAL 58 7.510 -1.458 11.846 450 HG11 VAL 58 HG11 VAL 58 7.942 -2.106 8.851 451 HG12 VAL 58 HG12 VAL 58 8.754 -2.928 10.209 452 HG13 VAL 58 HG13 VAL 58 7.004 -3.091 9.997 453 HG21 VAL 58 HG21 VAL 58 8.873 0.621 11.342 454 HG22 VAL 58 HG22 VAL 58 9.805 -0.847 11.012 455 HG23 VAL 58 HG23 VAL 58 9.098 0.080 9.666 456 H ILE 59 H ILE 59 4.555 -0.729 8.603 457 HA ILE 59 HA ILE 59 2.550 -2.195 10.423 458 HB ILE 59 HB ILE 59 2.068 -0.801 7.733 459 HG12 ILE 59 HG12 ILE 59 1.123 0.060 10.546 460 HG13 ILE 59 HG13 ILE 59 2.486 0.781 9.707 461 HG21 ILE 59 HG21 ILE 59 0.012 -2.108 9.658 462 HG22 ILE 59 HG22 ILE 59 -0.381 -1.234 8.163 463 HG23 ILE 59 HG23 ILE 59 0.495 -2.758 8.068 464 HD11 ILE 59 HD11 ILE 59 -0.457 0.966 8.843 465 HD12 ILE 59 HD12 ILE 59 0.629 2.270 9.357 466 HD13 ILE 59 HD13 ILE 59 0.892 1.468 7.787 467 H GLN 60 H GLN 60 3.221 -4.284 10.363 468 HA GLN 60 HA GLN 60 3.680 -5.601 7.664 469 HB2 GLN 60 HB2 GLN 60 5.073 -7.206 8.640 470 HB3 GLN 60 HB3 GLN 60 5.629 -5.605 9.032 471 HG2 GLN 60 HG2 GLN 60 4.131 -7.439 11.002 472 HG3 GLN 60 HG3 GLN 60 5.873 -7.356 10.858 473 HE21 GLN 60 HE21 GLN 60 6.950 -5.465 11.700 474 HE22 GLN 60 HE22 GLN 60 6.012 -4.263 12.739 475 H ASN 61 H ASN 61 2.410 -7.000 6.939 476 HA ASN 61 HA ASN 61 0.540 -8.735 8.436 477 HB2 ASN 61 HB2 ASN 61 -0.764 -6.504 6.713 478 HB3 ASN 61 HB3 ASN 61 -1.587 -7.943 7.233 479 HD21 ASN 61 HD21 ASN 61 -0.187 -5.001 8.495 480 HD22 ASN 61 HD22 ASN 61 -1.207 -5.056 10.012 481 H GLU 62 H GLU 62 -0.692 -10.189 6.850 482 HA GLU 62 HA GLU 62 0.733 -10.352 4.164 483 HB2 GLU 62 HB2 GLU 62 1.108 -12.602 4.194 484 HB3 GLU 62 HB3 GLU 62 1.734 -11.955 5.702 485 HG2 GLU 62 HG2 GLU 62 -0.224 -12.994 6.955 486 HG3 GLU 62 HG3 GLU 62 -0.861 -13.628 5.434 487 H PHE 63 H PHE 63 -0.405 -10.579 2.440 488 HA PHE 63 HA PHE 63 -3.419 -10.874 2.743 489 HB2 PHE 63 HB2 PHE 63 -3.880 -9.656 0.784 490 HB3 PHE 63 HB3 PHE 63 -2.985 -8.751 1.939 491 HD1 PHE 63 HD1 PHE 63 -0.568 -8.101 1.414 492 HD2 PHE 63 HD2 PHE 63 -2.957 -10.204 -1.462 493 HE1 PHE 63 HE1 PHE 63 0.973 -7.399 -0.407 494 HE2 PHE 63 HE2 PHE 63 -1.441 -9.464 -3.257 495 HZ PHE 63 HZ PHE 63 0.516 -8.038 -2.714 496 H THR 64 H THR 64 -4.519 -12.328 1.821 497 HA THR 64 HA THR 64 -3.136 -14.516 0.232 498 HB THR 64 HB THR 64 -5.927 -14.618 1.515 499 HG1 THR 64 HG1 THR 64 -3.920 -15.984 2.758 500 HG21 THR 64 HG21 THR 64 -5.469 -16.447 -0.146 501 HG22 THR 64 HG22 THR 64 -5.514 -17.098 1.510 502 HG23 THR 64 HG23 THR 64 -3.945 -16.863 0.690 503 H VAL 65 H VAL 65 -3.260 -14.256 -1.919 504 HA VAL 65 HA VAL 65 -5.345 -12.664 -3.301 505 HB VAL 65 HB VAL 65 -3.210 -14.534 -4.395 506 HG11 VAL 65 HG11 VAL 65 -4.993 -14.291 -6.167 507 HG12 VAL 65 HG12 VAL 65 -4.791 -12.524 -6.118 508 HG13 VAL 65 HG13 VAL 65 -3.453 -13.565 -6.640 509 HG21 VAL 65 HG21 VAL 65 -3.300 -11.426 -4.299 510 HG22 VAL 65 HG22 VAL 65 -2.260 -12.454 -3.288 511 HG23 VAL 65 HG23 VAL 65 -1.997 -12.381 -5.037 512 H GLY 66 H GLY 66 -7.362 -13.314 -3.636 513 HA2 GLY 66 HA2 GLY 66 -9.133 -14.788 -4.520 514 HA3 GLY 66 HA3 GLY 66 -8.075 -16.173 -4.478 515 H GLU 67 H GLU 67 -7.865 -14.847 -1.405 516 HA GLU 67 HA GLU 67 -10.427 -15.894 -0.338 517 HB2 GLU 67 HB2 GLU 67 -7.745 -17.256 0.440 518 HB3 GLU 67 HB3 GLU 67 -9.087 -17.250 1.550 519 HG2 GLU 67 HG2 GLU 67 -9.359 -18.463 -1.274 520 HG3 GLU 67 HG3 GLU 67 -8.906 -19.375 0.163 521 H GLU 68 H GLU 68 -10.805 -15.297 1.897 522 HA GLU 68 HA GLU 68 -10.338 -12.532 2.268 523 HB2 GLU 68 HB2 GLU 68 -11.405 -12.629 4.407 524 HB3 GLU 68 HB3 GLU 68 -12.282 -13.538 3.212 525 HG2 GLU 68 HG2 GLU 68 -11.966 -15.607 4.293 526 HG3 GLU 68 HG3 GLU 68 -10.362 -15.197 4.863 527 H CYS 69 H CYS 69 -8.958 -11.219 3.166 528 HA CYS 69 HA CYS 69 -6.943 -12.179 5.243 529 HB2 CYS 69 HB2 CYS 69 -5.121 -10.833 3.989 530 HB3 CYS 69 HB3 CYS 69 -5.598 -12.436 3.425 531 HG CYS 69 HG CYS 69 -6.923 -11.725 1.364 532 H GLU 70 H GLU 70 -6.763 -10.951 6.817 533 HA GLU 70 HA GLU 70 -8.136 -8.270 7.008 534 HB2 GLU 70 HB2 GLU 70 -7.889 -8.379 9.415 535 HB3 GLU 70 HB3 GLU 70 -8.859 -9.640 8.715 536 HG2 GLU 70 HG2 GLU 70 -7.045 -11.334 9.006 537 HG3 GLU 70 HG3 GLU 70 -5.945 -10.059 9.508 538 H LEU 71 H LEU 71 -7.066 -6.528 6.492 539 HA LEU 71 HA LEU 71 -4.098 -6.206 7.275 540 HB2 LEU 71 HB2 LEU 71 -5.541 -4.896 4.903 541 HB3 LEU 71 HB3 LEU 71 -3.830 -4.805 5.264 542 HG LEU 71 HG LEU 71 -5.367 -7.316 4.357 543 HD11 LEU 71 HD11 LEU 71 -4.941 -5.418 2.639 544 HD12 LEU 71 HD12 LEU 71 -4.310 -7.007 2.198 545 HD13 LEU 71 HD13 LEU 71 -3.214 -5.747 2.814 546 HD21 LEU 71 HD21 LEU 71 -3.155 -8.460 4.136 547 HD22 LEU 71 HD22 LEU 71 -3.428 -8.004 5.809 548 HD23 LEU 71 HD23 LEU 71 -2.310 -7.046 4.805 549 H GLU 72 H GLU 72 -3.450 -4.349 8.291 550 HA GLU 72 HA GLU 72 -5.465 -2.633 9.640 551 HB2 GLU 72 HB2 GLU 72 -3.153 -3.331 10.543 552 HB3 GLU 72 HB3 GLU 72 -2.412 -2.235 9.383 553 HG2 GLU 72 HG2 GLU 72 -3.776 -0.301 10.534 554 HG3 GLU 72 HG3 GLU 72 -4.277 -1.475 11.745 555 H THR 73 H THR 73 -5.979 -0.627 9.397 556 HA THR 73 HA THR 73 -5.395 0.871 6.786 557 HB THR 73 HB THR 73 -7.605 0.012 6.623 558 HG1 THR 73 HG1 THR 73 -8.573 2.381 7.442 559 HG21 THR 73 HG21 THR 73 -9.503 0.531 8.230 560 HG22 THR 73 HG22 THR 73 -8.308 1.221 9.366 561 HG23 THR 73 HG23 THR 73 -8.282 -0.516 8.959 562 H MET 74 H MET 74 -5.936 3.116 6.969 563 HA MET 74 HA MET 74 -4.476 4.467 9.301 564 HB2 MET 74 HB2 MET 74 -5.431 5.569 6.591 565 HB3 MET 74 HB3 MET 74 -4.960 6.633 7.900 566 HG2 MET 74 HG2 MET 74 -3.094 4.543 6.633 567 HG3 MET 74 HG3 MET 74 -3.079 6.283 6.328 568 HE1 MET 74 HE1 MET 74 -2.288 3.422 8.935 569 HE2 MET 74 HE2 MET 74 -0.979 3.889 7.810 570 HE3 MET 74 HE3 MET 74 -0.802 4.198 9.565 571 H THR 75 H THR 75 -7.622 5.008 7.638 572 HA THR 75 HA THR 75 -8.855 5.756 10.342 573 HB THR 75 HB THR 75 -10.128 6.020 7.577 574 HG1 THR 75 HG1 THR 75 -9.827 8.334 8.223 575 HG21 THR 75 HG21 THR 75 -11.012 7.228 10.288 576 HG22 THR 75 HG22 THR 75 -11.840 5.885 9.457 577 HG23 THR 75 HG23 THR 75 -11.799 7.493 8.716 578 H GLY 76 H GLY 76 -9.788 4.161 11.349 579 HA2 GLY 76 HA2 GLY 76 -11.754 2.432 11.124 580 HA3 GLY 76 HA3 GLY 76 -10.830 1.629 9.894 581 H GLU 77 H GLU 77 -9.419 -0.003 10.562 582 HA GLU 77 HA GLU 77 -8.641 -0.557 13.278 583 HB2 GLU 77 HB2 GLU 77 -10.172 -2.183 14.091 584 HB3 GLU 77 HB3 GLU 77 -10.945 -0.643 13.889 585 HG2 GLU 77 HG2 GLU 77 -11.499 -3.221 12.313 586 HG3 GLU 77 HG3 GLU 77 -12.529 -2.269 13.345 587 H LYS 78 H LYS 78 -10.109 -2.739 10.990 588 HA LYS 78 HA LYS 78 -7.618 -3.606 9.708 589 HB2 LYS 78 HB2 LYS 78 -7.855 -4.791 12.234 590 HB3 LYS 78 HB3 LYS 78 -8.772 -5.961 11.314 591 HG2 LYS 78 HG2 LYS 78 -6.739 -6.146 9.711 592 HG3 LYS 78 HG3 LYS 78 -5.917 -4.960 10.735 593 HD2 LYS 78 HD2 LYS 78 -6.137 -6.567 12.724 594 HD3 LYS 78 HD3 LYS 78 -6.977 -7.712 11.678 595 HE2 LYS 78 HE2 LYS 78 -4.841 -7.743 10.161 596 HE3 LYS 78 HE3 LYS 78 -4.016 -6.782 11.383 597 HZ1 LYS 78 HZ1 LYS 78 -4.481 -8.608 13.031 598 HZ2 LYS 78 HZ2 LYS 78 -3.787 -9.310 11.699 599 HZ3 LYS 78 HZ3 LYS 78 -5.427 -9.425 11.958 600 H VAL 79 H VAL 79 -8.260 -3.969 7.733 601 HA VAL 79 HA VAL 79 -11.195 -4.601 7.210 602 HB VAL 79 HB VAL 79 -10.260 -2.449 6.438 603 HG11 VAL 79 HG11 VAL 79 -8.900 -2.219 4.390 604 HG12 VAL 79 HG12 VAL 79 -7.961 -3.010 5.660 605 HG13 VAL 79 HG13 VAL 79 -8.624 -3.974 4.325 606 HG21 VAL 79 HG21 VAL 79 -11.253 -4.181 4.101 607 HG22 VAL 79 HG22 VAL 79 -12.291 -3.447 5.355 608 HG23 VAL 79 HG23 VAL 79 -11.363 -2.412 4.258 609 H LYS 80 H LYS 80 -11.829 -6.458 6.328 610 HA LYS 80 HA LYS 80 -9.807 -8.476 5.323 611 HB2 LYS 80 HB2 LYS 80 -12.788 -8.775 5.907 612 HB3 LYS 80 HB3 LYS 80 -11.862 -9.974 5.021 613 HG2 LYS 80 HG2 LYS 80 -10.150 -10.044 6.924 614 HG3 LYS 80 HG3 LYS 80 -11.214 -9.015 7.887 615 HD2 LYS 80 HD2 LYS 80 -13.015 -10.820 7.745 616 HD3 LYS 80 HD3 LYS 80 -11.961 -11.768 6.699 617 HE2 LYS 80 HE2 LYS 80 -10.182 -11.779 8.639 618 HE3 LYS 80 HE3 LYS 80 -11.398 -11.042 9.677 619 HZ1 LYS 80 HZ1 LYS 80 -11.564 -13.514 9.855 620 HZ2 LYS 80 HZ2 LYS 80 -11.606 -13.707 8.210 621 HZ3 LYS 80 HZ3 LYS 80 -12.895 -13.059 8.956 622 H THR 81 H THR 81 -9.020 -7.537 3.609 623 HA THR 81 HA THR 81 -10.793 -6.866 1.189 624 HB THR 81 HB THR 81 -9.665 -4.955 2.238 625 HG1 THR 81 HG1 THR 81 -8.650 -5.615 -0.328 626 HG21 THR 81 HG21 THR 81 -7.468 -6.157 3.021 627 HG22 THR 81 HG22 THR 81 -7.275 -4.577 2.283 628 HG23 THR 81 HG23 THR 81 -6.915 -6.028 1.335 629 H VAL 82 H VAL 82 -10.772 -8.556 -0.188 630 HA VAL 82 HA VAL 82 -8.322 -10.323 -0.402 631 HB VAL 82 HB VAL 82 -10.447 -11.522 -0.217 632 HG11 VAL 82 HG11 VAL 82 -11.786 -12.036 -2.272 633 HG12 VAL 82 HG12 VAL 82 -12.006 -10.337 -1.780 634 HG13 VAL 82 HG13 VAL 82 -10.949 -10.744 -3.164 635 HG21 VAL 82 HG21 VAL 82 -8.888 -12.135 -2.814 636 HG22 VAL 82 HG22 VAL 82 -8.348 -12.552 -1.176 637 HG23 VAL 82 HG23 VAL 82 -9.842 -13.260 -1.819 638 H VAL 83 H VAL 83 -7.002 -10.410 -2.076 639 HA VAL 83 HA VAL 83 -7.172 -8.122 -4.090 640 HB VAL 83 HB VAL 83 -4.629 -9.620 -3.280 641 HG11 VAL 83 HG11 VAL 83 -3.495 -7.555 -4.090 642 HG12 VAL 83 HG12 VAL 83 -4.502 -8.232 -5.387 643 HG13 VAL 83 HG13 VAL 83 -5.053 -6.799 -4.496 644 HG21 VAL 83 HG21 VAL 83 -4.044 -7.660 -1.762 645 HG22 VAL 83 HG22 VAL 83 -5.700 -7.061 -1.895 646 HG23 VAL 83 HG23 VAL 83 -5.385 -8.625 -1.137 647 H GLN 84 H GLN 84 -7.350 -8.507 -6.190 648 HA GLN 84 HA GLN 84 -7.060 -11.377 -7.262 649 HB2 GLN 84 HB2 GLN 84 -8.701 -8.981 -8.217 650 HB3 GLN 84 HB3 GLN 84 -8.269 -10.238 -9.336 651 HG2 GLN 84 HG2 GLN 84 -10.512 -10.646 -8.498 652 HG3 GLN 84 HG3 GLN 84 -9.454 -11.979 -8.120 653 HE21 GLN 84 HE21 GLN 84 -9.438 -12.631 -5.991 654 HE22 GLN 84 HE22 GLN 84 -10.311 -11.702 -4.659 655 H LEU 85 H LEU 85 -5.714 -11.829 -8.920 656 HA LEU 85 HA LEU 85 -3.570 -9.755 -9.570 657 HB2 LEU 85 HB2 LEU 85 -2.853 -11.504 -7.993 658 HB3 LEU 85 HB3 LEU 85 -3.382 -12.774 -9.085 659 HG LEU 85 HG LEU 85 -1.679 -12.152 -10.743 660 HD11 LEU 85 HD11 LEU 85 -0.661 -10.061 -8.693 661 HD12 LEU 85 HD12 LEU 85 -1.364 -9.692 -10.287 662 HD13 LEU 85 HD13 LEU 85 0.173 -10.535 -10.172 663 HD21 LEU 85 HD21 LEU 85 0.336 -12.934 -9.409 664 HD22 LEU 85 HD22 LEU 85 -1.121 -13.871 -9.030 665 HD23 LEU 85 HD23 LEU 85 -0.556 -12.618 -7.901 666 H GLU 86 H GLU 86 -3.442 -9.192 -11.622 667 HA GLU 86 HA GLU 86 -4.171 -11.177 -13.861 668 HB2 GLU 86 HB2 GLU 86 -5.508 -8.999 -13.740 669 HB3 GLU 86 HB3 GLU 86 -4.010 -8.149 -14.070 670 HG2 GLU 86 HG2 GLU 86 -3.823 -9.461 -16.304 671 HG3 GLU 86 HG3 GLU 86 -5.444 -10.085 -15.984 672 H GLY 87 H GLY 87 -2.646 -11.793 -15.112 673 HA2 GLY 87 HA2 GLY 87 -0.450 -12.299 -16.065 674 HA3 GLY 87 HA3 GLY 87 -0.354 -10.558 -16.161 675 H ASP 88 H ASP 88 -0.255 -11.872 -13.097 676 HA ASP 88 HA ASP 88 1.348 -11.880 -11.374 677 HB2 ASP 88 HB2 ASP 88 2.408 -13.700 -12.821 678 HB3 ASP 88 HB3 ASP 88 3.577 -12.500 -13.345 679 H ASN 89 H ASN 89 0.752 -9.388 -12.860 680 HA ASN 89 HA ASN 89 2.700 -7.691 -11.262 681 HB2 ASN 89 HB2 ASN 89 3.437 -6.351 -12.917 682 HB3 ASN 89 HB3 ASN 89 3.497 -7.902 -13.677 683 HD21 ASN 89 HD21 ASN 89 3.188 -4.989 -14.567 684 HD22 ASN 89 HD22 ASN 89 1.849 -5.125 -15.832 685 H LYS 90 H LYS 90 -0.605 -7.753 -12.526 686 HA LYS 90 HA LYS 90 -1.141 -5.033 -11.206 687 HB2 LYS 90 HB2 LYS 90 -2.836 -6.799 -13.029 688 HB3 LYS 90 HB3 LYS 90 -3.382 -5.263 -12.402 689 HG2 LYS 90 HG2 LYS 90 -1.765 -3.998 -13.728 690 HG3 LYS 90 HG3 LYS 90 -0.866 -5.454 -14.170 691 HD2 LYS 90 HD2 LYS 90 -2.932 -6.370 -15.329 692 HD3 LYS 90 HD3 LYS 90 -3.802 -4.891 -15.014 693 HE2 LYS 90 HE2 LYS 90 -1.185 -5.134 -16.679 694 HE3 LYS 90 HE3 LYS 90 -2.816 -5.188 -17.352 695 HZ1 LYS 90 HZ1 LYS 90 -1.956 -2.858 -17.474 696 HZ2 LYS 90 HZ2 LYS 90 -1.616 -2.785 -15.864 697 HZ3 LYS 90 HZ3 LYS 90 -3.181 -2.875 -16.367 698 H LEU 91 H LEU 91 -1.571 -5.248 -9.074 699 HA LEU 91 HA LEU 91 -3.422 -7.479 -8.052 700 HB2 LEU 91 HB2 LEU 91 -1.373 -5.639 -6.732 701 HB3 LEU 91 HB3 LEU 91 -2.538 -6.476 -5.764 702 HG LEU 91 HG LEU 91 -0.532 -7.883 -7.621 703 HD11 LEU 91 HD11 LEU 91 0.591 -6.644 -5.751 704 HD12 LEU 91 HD12 LEU 91 0.693 -8.389 -5.459 705 HD13 LEU 91 HD13 LEU 91 -0.496 -7.394 -4.572 706 HD21 LEU 91 HD21 LEU 91 -2.555 -9.337 -7.119 707 HD22 LEU 91 HD22 LEU 91 -2.293 -9.107 -5.379 708 HD23 LEU 91 HD23 LEU 91 -1.087 -9.966 -6.348 709 H VAL 92 H VAL 92 -5.513 -6.890 -8.018 710 HA VAL 92 HA VAL 92 -6.270 -4.016 -7.240 711 HB VAL 92 HB VAL 92 -8.305 -4.223 -8.514 712 HG11 VAL 92 HG11 VAL 92 -5.900 -4.882 -10.318 713 HG12 VAL 92 HG12 VAL 92 -7.371 -3.992 -10.778 714 HG13 VAL 92 HG13 VAL 92 -6.229 -3.291 -9.612 715 HG21 VAL 92 HG21 VAL 92 -8.738 -6.028 -10.195 716 HG22 VAL 92 HG22 VAL 92 -7.362 -6.967 -9.568 717 HG23 VAL 92 HG23 VAL 92 -8.786 -6.668 -8.544 718 H THR 93 H THR 93 -7.366 -3.637 -5.413 719 HA THR 93 HA THR 93 -9.283 -5.759 -4.367 720 HB THR 93 HB THR 93 -7.025 -6.079 -3.302 721 HG1 THR 93 HG1 THR 93 -8.788 -6.959 -2.376 722 HG21 THR 93 HG21 THR 93 -6.244 -3.793 -2.738 723 HG22 THR 93 HG22 THR 93 -6.438 -4.749 -1.259 724 HG23 THR 93 HG23 THR 93 -7.659 -3.532 -1.674 725 H THR 94 H THR 94 -10.406 -5.003 -2.371 726 HA THR 94 HA THR 94 -11.648 -2.220 -2.822 727 HB THR 94 HB THR 94 -13.225 -4.754 -2.068 728 HG1 THR 94 HG1 THR 94 -14.180 -4.482 -4.052 729 HG21 THR 94 HG21 THR 94 -14.249 -2.648 -1.114 730 HG22 THR 94 HG22 THR 94 -15.262 -3.321 -2.402 731 HG23 THR 94 HG23 THR 94 -14.241 -1.898 -2.728 732 H PHE 95 H PHE 95 -10.683 -1.194 -1.154 733 HA PHE 95 HA PHE 95 -10.139 -2.587 1.487 734 HB2 PHE 95 HB2 PHE 95 -8.553 -1.072 -0.138 735 HB3 PHE 95 HB3 PHE 95 -9.384 0.237 0.624 736 HD1 PHE 95 HD2 PHE 95 -7.216 -2.703 1.184 737 HD2 PHE 95 HD1 PHE 95 -8.517 1.057 2.798 738 HE1 PHE 95 HE2 PHE 95 -5.534 -2.885 2.977 739 HE2 PHE 95 HE1 PHE 95 -6.800 0.899 4.539 740 HZ PHE 95 HZ PHE 95 -5.344 -1.102 4.681 741 H LYS 96 H LYS 96 -10.337 0.333 2.716 742 HA LYS 96 HA LYS 96 -13.191 0.085 3.743 743 HB2 LYS 96 HB2 LYS 96 -11.036 2.194 4.358 744 HB3 LYS 96 HB3 LYS 96 -12.584 2.115 5.142 745 HG2 LYS 96 HG2 LYS 96 -10.453 -0.108 5.327 746 HG3 LYS 96 HG3 LYS 96 -10.551 1.243 6.420 747 HD2 LYS 96 HD2 LYS 96 -12.790 -0.866 6.088 748 HD3 LYS 96 HD3 LYS 96 -11.509 -0.913 7.289 749 HE2 LYS 96 HE2 LYS 96 -12.334 1.401 8.165 750 HE3 LYS 96 HE3 LYS 96 -13.759 1.194 7.147 751 HZ1 LYS 96 HZ1 LYS 96 -12.853 -0.837 9.269 752 HZ2 LYS 96 HZ2 LYS 96 -14.217 -0.975 8.367 753 HZ3 LYS 96 HZ3 LYS 96 -14.030 0.196 9.516 754 H ASN 97 H ASN 97 -14.322 0.475 1.709 755 HA ASN 97 HA ASN 97 -15.066 1.558 -0.214 756 HB2 ASN 97 HB2 ASN 97 -15.101 3.948 1.708 757 HB3 ASN 97 HB3 ASN 97 -15.953 3.829 0.192 758 HD21 ASN 97 HD21 ASN 97 -17.897 2.635 0.093 759 HD22 ASN 97 HD22 ASN 97 -18.633 1.960 1.641 760 H ILE 98 H ILE 98 -12.253 1.383 -0.212 761 HA ILE 98 HA ILE 98 -11.508 3.617 -2.208 762 HB ILE 98 HB ILE 98 -9.673 2.179 -0.211 763 HG12 ILE 98 HG12 ILE 98 -9.959 5.197 0.018 764 HG13 ILE 98 HG13 ILE 98 -11.303 4.263 0.603 765 HG21 ILE 98 HG21 ILE 98 -8.383 2.780 -2.258 766 HG22 ILE 98 HG22 ILE 98 -8.925 4.469 -2.141 767 HG23 ILE 98 HG23 ILE 98 -7.861 3.771 -0.895 768 HD11 ILE 98 HD11 ILE 98 -9.932 3.000 2.196 769 HD12 ILE 98 HD12 ILE 98 -8.428 3.717 1.577 770 HD13 ILE 98 HD13 ILE 98 -9.628 4.736 2.414 771 H LYS 99 H LYS 99 -10.828 2.847 -4.161 772 HA LYS 99 HA LYS 99 -10.558 -0.182 -4.561 773 HB2 LYS 99 HB2 LYS 99 -12.193 1.084 -5.989 774 HB3 LYS 99 HB3 LYS 99 -10.906 2.005 -6.670 775 HG2 LYS 99 HG2 LYS 99 -10.497 0.411 -8.225 776 HG3 LYS 99 HG3 LYS 99 -10.038 -0.755 -7.023 777 HD2 LYS 99 HD2 LYS 99 -12.879 -0.235 -8.103 778 HD3 LYS 99 HD3 LYS 99 -11.860 -1.579 -8.545 779 HE2 LYS 99 HE2 LYS 99 -13.045 -1.108 -5.708 780 HE3 LYS 99 HE3 LYS 99 -13.746 -2.153 -6.930 781 HZ1 LYS 99 HZ1 LYS 99 -11.654 -3.540 -6.866 782 HZ2 LYS 99 HZ2 LYS 99 -12.343 -3.444 -5.358 783 HZ3 LYS 99 HZ3 LYS 99 -11.010 -2.572 -5.697 784 H SER 100 H SER 100 -8.564 -0.754 -4.013 785 HA SER 100 HA SER 100 -6.151 1.013 -4.545 786 HB2 SER 100 HB2 SER 100 -6.488 0.051 -2.278 787 HB3 SER 100 HB3 SER 100 -6.369 -1.580 -2.925 788 HG SER 100 HG SER 100 -4.236 -1.089 -3.616 789 H VAL 101 H VAL 101 -5.200 0.825 -6.411 790 HA VAL 101 HA VAL 101 -5.021 -1.874 -7.892 791 HB VAL 101 HB VAL 101 -4.980 1.023 -8.945 792 HG11 VAL 101 HG11 VAL 101 -3.470 -0.348 -10.368 793 HG12 VAL 101 HG12 VAL 101 -4.728 -1.584 -10.588 794 HG13 VAL 101 HG13 VAL 101 -4.938 0.057 -11.262 795 HG21 VAL 101 HG21 VAL 101 -7.102 0.445 -10.153 796 HG22 VAL 101 HG22 VAL 101 -7.119 -1.171 -9.406 797 HG23 VAL 101 HG23 VAL 101 -7.314 0.283 -8.404 798 H THR 102 H THR 102 -3.073 -2.740 -7.308 799 HA THR 102 HA THR 102 -0.631 -0.918 -7.146 800 HB THR 102 HB THR 102 -0.840 -3.723 -5.991 801 HG1 THR 102 HG1 THR 102 -0.836 -1.586 -4.252 802 HG21 THR 102 HG21 THR 102 1.124 -1.406 -5.375 803 HG22 THR 102 HG22 THR 102 1.513 -2.865 -6.312 804 HG23 THR 102 HG23 THR 102 1.098 -3.004 -4.598 805 H GLU 103 H GLU 103 0.671 -0.909 -8.974 806 HA GLU 103 HA GLU 103 0.623 -3.412 -10.746 807 HB2 GLU 103 HB2 GLU 103 -0.513 -1.311 -11.724 808 HB3 GLU 103 HB3 GLU 103 1.094 -0.612 -11.825 809 HG2 GLU 103 HG2 GLU 103 1.879 -2.473 -13.329 810 HG3 GLU 103 HG3 GLU 103 0.346 -3.304 -13.161 811 H LEU 104 H LEU 104 2.457 -4.305 -11.235 812 HA LEU 104 HA LEU 104 5.118 -3.031 -10.419 813 HB2 LEU 104 HB2 LEU 104 4.137 -5.569 -9.853 814 HB3 LEU 104 HB3 LEU 104 5.021 -5.924 -11.306 815 HG LEU 104 HG LEU 104 6.074 -4.727 -8.672 816 HD11 LEU 104 HD11 LEU 104 5.646 -7.220 -8.773 817 HD12 LEU 104 HD12 LEU 104 7.374 -6.859 -8.595 818 HD13 LEU 104 HD13 LEU 104 6.729 -7.361 -10.168 819 HD21 LEU 104 HD21 LEU 104 7.712 -5.186 -11.253 820 HD22 LEU 104 HD22 LEU 104 8.410 -4.862 -9.646 821 HD23 LEU 104 HD23 LEU 104 7.435 -3.627 -10.449 822 H ASN 105 H ASN 105 6.178 -1.997 -12.005 823 HA ASN 105 HA ASN 105 5.840 -2.883 -14.960 824 HB2 ASN 105 HB2 ASN 105 6.345 -0.102 -13.734 825 HB3 ASN 105 HB3 ASN 105 6.688 -0.472 -15.404 826 HD21 ASN 105 HD21 ASN 105 3.994 -0.399 -13.109 827 HD22 ASN 105 HD22 ASN 105 2.726 -0.280 -14.437 828 H GLY 106 H GLY 106 7.334 -4.560 -14.542 829 HA2 GLY 106 HA2 GLY 106 9.555 -5.452 -15.091 830 HA3 GLY 106 HA3 GLY 106 10.216 -3.830 -15.167 831 H ASP 107 H ASP 107 11.020 -2.937 -13.284 832 HA ASP 107 HA ASP 107 10.850 -4.496 -10.645 833 HB2 ASP 107 HB2 ASP 107 13.446 -3.457 -11.941 834 HB3 ASP 107 HB3 ASP 107 13.325 -3.867 -10.246 835 H ILE 108 H ILE 108 9.411 -2.098 -11.603 836 HA ILE 108 HA ILE 108 9.858 -0.474 -9.074 837 HB ILE 108 HB ILE 108 9.317 1.562 -9.964 838 HG12 ILE 108 HG12 ILE 108 9.506 1.667 -12.701 839 HG13 ILE 108 HG13 ILE 108 8.636 0.168 -12.559 840 HG21 ILE 108 HG21 ILE 108 11.602 0.407 -11.641 841 HG22 ILE 108 HG22 ILE 108 11.326 2.131 -11.275 842 HG23 ILE 108 HG23 ILE 108 11.695 0.999 -9.967 843 HD11 ILE 108 HD11 ILE 108 6.859 1.374 -11.131 844 HD12 ILE 108 HD12 ILE 108 7.784 2.880 -11.311 845 HD13 ILE 108 HD13 ILE 108 7.048 2.106 -12.741 846 H ILE 109 H ILE 109 8.071 -0.251 -7.828 847 HA ILE 109 HA ILE 109 5.469 -1.400 -8.935 848 HB ILE 109 HB ILE 109 6.596 -2.756 -7.133 849 HG12 ILE 109 HG12 ILE 109 3.793 -1.793 -6.332 850 HG13 ILE 109 HG13 ILE 109 4.097 -2.831 -7.715 851 HG21 ILE 109 HG21 ILE 109 7.401 -0.873 -5.621 852 HG22 ILE 109 HG22 ILE 109 5.726 -0.532 -5.156 853 HG23 ILE 109 HG23 ILE 109 6.477 -2.087 -4.733 854 HD11 ILE 109 HD11 ILE 109 3.441 -4.195 -5.725 855 HD12 ILE 109 HD12 ILE 109 5.096 -4.614 -6.242 856 HD13 ILE 109 HD13 ILE 109 4.828 -3.589 -4.812 857 H THR 110 H THR 110 3.708 -0.221 -8.965 858 HA THR 110 HA THR 110 3.704 2.411 -7.417 859 HB THR 110 HB THR 110 3.667 2.557 -9.976 860 HG1 THR 110 HG1 THR 110 2.836 4.086 -8.117 861 HG21 THR 110 HG21 THR 110 1.548 2.599 -11.157 862 HG22 THR 110 HG22 THR 110 0.663 2.043 -9.714 863 HG23 THR 110 HG23 THR 110 1.833 0.962 -10.507 864 H ASN 111 H ASN 111 2.147 2.785 -5.984 865 HA ASN 111 HA ASN 111 -0.108 0.694 -5.671 866 HB2 ASN 111 HB2 ASN 111 1.696 0.727 -3.820 867 HB3 ASN 111 HB3 ASN 111 1.110 2.317 -3.371 868 HD21 ASN 111 HD21 ASN 111 -0.925 2.414 -2.285 869 HD22 ASN 111 HD22 ASN 111 -1.776 0.864 -1.769 870 H THR 112 H THR 112 -1.791 1.631 -6.702 871 HA THR 112 HA THR 112 -2.288 4.640 -6.391 872 HB THR 112 HB THR 112 -3.418 2.756 -8.512 873 HG1 THR 112 HG1 THR 112 -1.096 3.009 -8.459 874 HG21 THR 112 HG21 THR 112 -3.774 4.855 -9.814 875 HG22 THR 112 HG22 THR 112 -3.116 5.834 -8.482 876 HG23 THR 112 HG23 THR 112 -4.655 4.959 -8.273 877 H MET 113 H MET 113 -3.435 4.829 -4.579 878 HA MET 113 HA MET 113 -5.891 3.099 -3.994 879 HB2 MET 113 HB2 MET 113 -4.262 5.072 -2.349 880 HB3 MET 113 HB3 MET 113 -5.877 4.639 -1.844 881 HG2 MET 113 HG2 MET 113 -5.305 2.220 -1.730 882 HG3 MET 113 HG3 MET 113 -3.679 2.540 -2.362 883 HE1 MET 113 HE1 MET 113 -3.334 0.983 -0.324 884 HE2 MET 113 HE2 MET 113 -2.962 1.634 1.293 885 HE3 MET 113 HE3 MET 113 -4.653 1.246 0.853 886 H THR 114 H THR 114 -7.428 3.662 -5.279 887 HA THR 114 HA THR 114 -8.086 6.553 -5.910 888 HB THR 114 HB THR 114 -9.617 5.736 -7.616 889 HG1 THR 114 HG1 THR 114 -8.774 3.162 -6.731 890 HG21 THR 114 HG21 THR 114 -7.212 6.050 -8.278 891 HG22 THR 114 HG22 THR 114 -8.014 4.766 -9.211 892 HG23 THR 114 HG23 THR 114 -6.890 4.336 -7.903 893 H LEU 115 H LEU 115 -9.304 7.598 -4.565 894 HA LEU 115 HA LEU 115 -11.789 6.295 -3.256 895 HB2 LEU 115 HB2 LEU 115 -10.043 6.819 -1.623 896 HB3 LEU 115 HB3 LEU 115 -9.854 8.444 -2.235 897 HG LEU 115 HG LEU 115 -12.147 9.066 -1.431 898 HD11 LEU 115 HD11 LEU 115 -12.229 6.242 -0.161 899 HD12 LEU 115 HD12 LEU 115 -13.300 6.830 -1.449 900 HD13 LEU 115 HD13 LEU 115 -13.374 7.560 0.162 901 HD21 LEU 115 HD21 LEU 115 -10.121 9.462 -0.014 902 HD22 LEU 115 HD22 LEU 115 -10.289 7.849 0.715 903 HD23 LEU 115 HD23 LEU 115 -11.531 9.095 0.996 904 H GLY 116 H GLY 116 -12.695 6.742 -5.392 905 HA2 GLY 116 HA2 GLY 116 -14.343 7.966 -6.687 906 HA3 GLY 116 HA3 GLY 116 -14.404 9.193 -5.443 907 H ASP 117 H ASP 117 -12.997 10.908 -5.598 908 HA ASP 117 HA ASP 117 -11.819 11.555 -8.359 909 HB2 ASP 117 HB2 ASP 117 -12.594 13.430 -6.025 910 HB3 ASP 117 HB3 ASP 117 -11.806 13.950 -7.503 911 H ILE 118 H ILE 118 -10.860 10.957 -5.051 912 HA ILE 118 HA ILE 118 -8.176 12.316 -5.246 913 HB ILE 118 HB ILE 118 -9.236 10.408 -3.111 914 HG12 ILE 118 HG12 ILE 118 -10.742 12.346 -3.106 915 HG13 ILE 118 HG13 ILE 118 -9.869 12.111 -1.619 916 HG21 ILE 118 HG21 ILE 118 -6.843 12.381 -2.971 917 HG22 ILE 118 HG22 ILE 118 -7.456 11.393 -1.633 918 HG23 ILE 118 HG23 ILE 118 -6.724 10.611 -3.036 919 HD11 ILE 118 HD11 ILE 118 -9.108 14.268 -3.701 920 HD12 ILE 118 HD12 ILE 118 -10.068 14.537 -2.220 921 HD13 ILE 118 HD13 ILE 118 -8.373 14.041 -2.086 922 H VAL 119 H VAL 119 -6.558 11.329 -6.321 923 HA VAL 119 HA VAL 119 -6.352 8.255 -6.431 924 HB VAL 119 HB VAL 119 -5.232 10.360 -8.365 925 HG11 VAL 119 HG11 VAL 119 -3.808 8.307 -8.371 926 HG12 VAL 119 HG12 VAL 119 -5.243 7.280 -8.616 927 HG13 VAL 119 HG13 VAL 119 -4.722 8.420 -9.879 928 HG21 VAL 119 HG21 VAL 119 -7.625 8.421 -8.772 929 HG22 VAL 119 HG22 VAL 119 -7.734 10.186 -8.629 930 HG23 VAL 119 HG23 VAL 119 -6.920 9.473 -10.026 931 H PHE 120 H PHE 120 -5.276 7.932 -4.447 932 HA PHE 120 HA PHE 120 -2.706 9.417 -3.827 933 HB2 PHE 120 HB2 PHE 120 -4.054 9.023 -1.948 934 HB3 PHE 120 HB3 PHE 120 -4.317 7.342 -2.317 935 HD1 PHE 120 HD2 PHE 120 -1.062 9.356 -2.084 936 HD2 PHE 120 HD1 PHE 120 -3.403 6.109 -0.504 937 HE1 PHE 120 HE2 PHE 120 0.859 8.592 -0.789 938 HE2 PHE 120 HE1 PHE 120 -1.457 5.352 0.790 939 HZ PHE 120 HZ PHE 120 0.689 6.588 0.646 940 H LYS 121 H LYS 121 -1.257 8.960 -5.336 941 HA LYS 121 HA LYS 121 -0.574 6.053 -5.966 942 HB2 LYS 121 HB2 LYS 121 -1.356 7.660 -7.747 943 HB3 LYS 121 HB3 LYS 121 0.129 8.564 -7.550 944 HG2 LYS 121 HG2 LYS 121 1.479 6.503 -8.169 945 HG3 LYS 121 HG3 LYS 121 -0.013 5.578 -8.336 946 HD2 LYS 121 HD2 LYS 121 -0.814 7.218 -10.119 947 HD3 LYS 121 HD3 LYS 121 0.686 8.128 -9.947 948 HE2 LYS 121 HE2 LYS 121 2.018 6.032 -10.629 949 HE3 LYS 121 HE3 LYS 121 0.505 5.138 -10.812 950 HZ1 LYS 121 HZ1 LYS 121 1.158 7.678 -12.322 951 HZ2 LYS 121 HZ2 LYS 121 -0.212 6.812 -12.519 952 HZ3 LYS 121 HZ3 LYS 121 1.231 6.170 -12.991 953 H ARG 122 H ARG 122 0.988 5.212 -4.809 954 HA ARG 122 HA ARG 122 3.595 6.732 -4.243 955 HB2 ARG 122 HB2 ARG 122 2.593 3.940 -3.404 956 HB3 ARG 122 HB3 ARG 122 4.284 4.333 -3.363 957 HG2 ARG 122 HG2 ARG 122 3.797 6.331 -1.843 958 HG3 ARG 122 HG3 ARG 122 2.125 5.768 -1.703 959 HD2 ARG 122 HD2 ARG 122 2.938 3.551 -0.798 960 HD3 ARG 122 HD3 ARG 122 4.603 4.006 -1.124 961 HE ARG 122 HE ARG 122 3.539 6.043 0.670 962 HH11 ARG 122 HH11 ARG 122 4.709 2.708 0.671 963 HH12 ARG 122 HH12 ARG 122 5.276 2.899 2.411 964 HH21 ARG 122 HH21 ARG 122 4.158 6.126 2.614 965 HH22 ARG 122 HH22 ARG 122 4.958 4.691 3.448 966 H ILE 123 H ILE 123 5.515 6.246 -5.229 967 HA ILE 123 HA ILE 123 5.657 4.014 -7.339 968 HB ILE 123 HB ILE 123 6.907 6.806 -7.636 969 HG12 ILE 123 HG12 ILE 123 5.400 6.660 -9.901 970 HG13 ILE 123 HG13 ILE 123 4.411 5.589 -8.942 971 HG21 ILE 123 HG21 ILE 123 6.953 4.397 -9.576 972 HG22 ILE 123 HG22 ILE 123 7.631 6.010 -9.908 973 HG23 ILE 123 HG23 ILE 123 8.339 5.004 -8.642 974 HD11 ILE 123 HD11 ILE 123 3.537 7.923 -8.870 975 HD12 ILE 123 HD12 ILE 123 4.120 7.554 -7.239 976 HD13 ILE 123 HD13 ILE 123 5.097 8.557 -8.326 977 H SER 124 H SER 124 6.873 2.531 -6.342 978 HA SER 124 HA SER 124 9.416 3.376 -4.819 979 HB2 SER 124 HB2 SER 124 7.472 1.034 -4.218 980 HB3 SER 124 HB3 SER 124 8.957 1.382 -3.333 981 HG SER 124 HG SER 124 6.508 2.423 -2.931 982 H LYS 125 H LYS 125 11.313 2.234 -5.192 983 HA LYS 125 HA LYS 125 11.286 0.458 -7.676 984 HB2 LYS 125 HB2 LYS 125 12.554 2.552 -7.826 985 HB3 LYS 125 HB3 LYS 125 13.569 2.110 -6.452 986 HG2 LYS 125 HG2 LYS 125 14.632 0.301 -7.636 987 HG3 LYS 125 HG3 LYS 125 13.380 0.192 -8.850 988 HD2 LYS 125 HD2 LYS 125 14.111 2.675 -9.531 989 HD3 LYS 125 HD3 LYS 125 15.567 2.342 -8.619 990 HE2 LYS 125 HE2 LYS 125 14.421 0.680 -11.002 991 HE3 LYS 125 HE3 LYS 125 15.686 1.887 -11.160 992 HZ1 LYS 125 HZ1 LYS 125 15.943 -0.627 -9.493 993 HZ2 LYS 125 HZ2 LYS 125 17.131 0.485 -9.650 994 HZ3 LYS 125 HZ3 LYS 125 16.664 -0.413 -10.951 995 H ARG 126 H ARG 126 12.018 -1.606 -7.649 996 HA ARG 126 HA ARG 126 12.103 -3.125 -5.212 997 HB2 ARG 126 HB2 ARG 126 11.489 -3.781 -7.655 998 HB3 ARG 126 HB3 ARG 126 13.208 -3.903 -7.976 999 HG2 ARG 126 HG2 ARG 126 13.309 -5.719 -6.101 1000 HG3 ARG 126 HG3 ARG 126 11.548 -5.564 -5.965 1001 HD2 ARG 126 HD2 ARG 126 11.456 -5.994 -8.559 1002 HD3 ARG 126 HD3 ARG 126 13.174 -6.406 -8.460 1003 HE ARG 126 HE ARG 126 11.788 -8.068 -6.491 1004 HH11 ARG 126 HH11 ARG 126 11.889 -7.703 -10.029 1005 HH12 ARG 126 HH12 ARG 126 11.113 -9.364 -10.194 1006 HH21 ARG 126 HH21 ARG 126 11.029 -9.874 -6.800 1007 HH22 ARG 126 HH22 ARG 126 10.647 -10.540 -8.474 1008 H ILE 127 H ILE 127 13.632 -3.589 -3.810 1009 HA ILE 127 HA ILE 127 16.577 -3.539 -4.455 1010 HB ILE 127 HB ILE 127 15.117 -1.666 -2.511 1011 HG12 ILE 127 HG12 ILE 127 17.504 -1.197 -4.386 1012 HG13 ILE 127 HG13 ILE 127 15.827 -0.881 -4.792 1013 HG21 ILE 127 HG21 ILE 127 18.041 -2.456 -2.064 1014 HG22 ILE 127 HG22 ILE 127 17.139 -1.159 -1.215 1015 HG23 ILE 127 HG23 ILE 127 16.663 -2.847 -1.005 1016 HD11 ILE 127 HD11 ILE 127 15.640 0.833 -2.968 1017 HD12 ILE 127 HD12 ILE 127 17.373 0.638 -2.608 1018 HD13 ILE 127 HD13 ILE 127 16.857 1.246 -4.195 1019 H21 OLA 128 H21 OLA 128 4.062 9.460 15.134 1020 H22 OLA 128 H22 OLA 128 5.025 8.256 14.310 1021 H31 OLA 128 H31 OLA 128 3.817 10.727 12.871 1022 H32 OLA 128 H32 OLA 128 2.931 9.221 13.080 1023 H41 OLA 128 H41 OLA 128 4.698 7.975 11.775 1024 H42 OLA 128 H42 OLA 128 5.610 9.471 11.591 1025 H51 OLA 128 H51 OLA 128 4.430 9.178 9.529 1026 H52 OLA 128 H52 OLA 128 3.621 10.494 10.355 1027 H61 OLA 128 H61 OLA 128 1.804 8.891 11.121 1028 H62 OLA 128 H62 OLA 128 2.649 7.552 10.346 1029 H71 OLA 128 H71 OLA 128 2.374 8.650 8.095 1030 H72 OLA 128 H72 OLA 128 1.588 10.043 8.850 1031 H81 OLA 128 H81 OLA 128 -0.254 8.518 9.730 1032 H82 OLA 128 H82 OLA 128 0.519 7.132 8.972 1033 H9 OLA 128 H9 OLA 128 -0.875 9.521 7.580 1034 H10 OLA 128 H10 OLA 128 -0.904 8.314 5.624 1035 H111 OLA 128 H111 OLA 128 0.098 5.819 6.970 1036 H112 OLA 128 H112 OLA 128 1.445 6.709 6.253 1037 H121 OLA 128 H121 OLA 128 0.273 6.691 4.022 1038 H122 OLA 128 H122 OLA 128 -1.104 5.843 4.719 1039 H131 OLA 128 H131 OLA 128 0.294 3.832 5.173 1040 H132 OLA 128 H132 OLA 128 1.761 4.681 4.666 1041 H141 OLA 128 H141 OLA 128 0.827 5.005 2.361 1042 H142 OLA 128 H142 OLA 128 -0.676 4.217 2.823 1043 H151 OLA 128 H151 OLA 128 0.596 2.058 3.256 1044 H152 OLA 128 H152 OLA 128 2.098 2.863 2.818 1045 H161 OLA 128 H161 OLA 128 1.081 3.423 0.527 1046 H162 OLA 128 H162 OLA 128 -0.343 2.491 0.935 1047 H171 OLA 128 H171 OLA 128 2.501 1.254 0.974 1048 H172 OLA 128 H172 OLA 128 1.560 1.371 -0.495 1049 H181 OLA 128 H181 OLA 128 1.296 -0.887 0.594 1050 H182 OLA 128 H182 OLA 128 0.542 -0.134 2.014 1051 H183 OLA 128 H183 OLA 128 -0.255 -0.052 0.418 1052 H21 OLA 129 H21 OLA 129 5.523 -0.660 -2.172 1053 H22 OLA 129 H22 OLA 129 4.314 -0.171 -3.344 1054 H31 OLA 129 H31 OLA 129 2.449 -0.588 -1.810 1055 H32 OLA 129 H32 OLA 129 3.523 -0.734 -0.423 1056 H41 OLA 129 H41 OLA 129 4.564 -2.794 -1.375 1057 H42 OLA 129 H42 OLA 129 3.556 -2.689 -2.809 1058 H51 OLA 129 H51 OLA 129 2.293 -2.864 0.008 1059 H52 OLA 129 H52 OLA 129 2.894 -4.307 -0.781 1060 H61 OLA 129 H61 OLA 129 1.380 -4.042 -2.687 1061 H62 OLA 129 H62 OLA 129 0.842 -2.453 -2.124 1062 H71 OLA 129 H71 OLA 129 -0.151 -3.514 -0.061 1063 H72 OLA 129 H72 OLA 129 0.398 -5.099 -0.599 1064 H81 OLA 129 H81 OLA 129 -1.013 -4.852 -2.718 1065 H82 OLA 129 H82 OLA 129 -1.583 -3.291 -2.161 1066 H9 OLA 129 H9 OLA 129 -2.374 -6.068 -1.168 1067 H10 OLA 129 H10 OLA 129 -3.915 -5.145 0.290 1068 H111 OLA 129 H111 OLA 129 -4.367 -2.698 0.293 1069 H112 OLA 129 H112 OLA 129 -2.816 -2.333 -0.445 1070 H121 OLA 129 H121 OLA 129 -1.645 -3.184 1.691 1071 H122 OLA 129 H122 OLA 129 -3.229 -3.438 2.426 1072 H131 OLA 129 H131 OLA 129 -3.732 -0.955 2.069 1073 H132 OLA 129 H132 OLA 129 -2.120 -0.752 1.413 1074 H141 OLA 129 H141 OLA 129 -1.161 -1.631 3.644 1075 H142 OLA 129 H142 OLA 129 -2.790 -1.641 4.308 1076 H151 OLA 129 H151 OLA 129 -1.376 0.850 3.146 1077 H152 OLA 129 H152 OLA 129 -1.361 0.430 4.851 1078 H161 OLA 129 H161 OLA 129 -3.785 0.752 5.074 1079 H162 OLA 129 H162 OLA 129 -4.000 0.891 3.334 1080 H171 OLA 129 H171 OLA 129 -2.504 2.989 3.365 1081 H172 OLA 129 H172 OLA 129 -2.519 2.907 5.126 1082 H181 OLA 129 H181 OLA 129 -5.094 3.086 5.054 1083 H182 OLA 129 H182 OLA 129 -4.298 4.484 4.293 1084 H183 OLA 129 H183 OLA 129 -5.010 3.207 3.281
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