NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
593656 | 2mx8 | 25397 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA2 GLY 1 HA2 GLY 1 -0.419 -4.594 -14.937 2 HA3 GLY 1 HA3 GLY 1 -1.536 -3.236 -14.982 3 H SER 2 H SER 2 1.258 -4.504 -13.586 4 HA SER 2 HA SER 2 1.445 -2.196 -11.804 5 HB2 SER 2 HB2 SER 2 0.660 -4.188 -10.474 6 HB3 SER 2 HB3 SER 2 2.158 -5.004 -10.911 7 HG SER 2 HG SER 2 2.839 -4.074 -9.144 8 H GLY 3 H GLY 3 3.692 -1.717 -11.220 9 HA2 GLY 3 HA2 GLY 3 6.055 -2.431 -11.620 10 HA3 GLY 3 HA3 GLY 3 5.545 -2.779 -13.264 11 H ASN 4 H ASN 4 5.285 -0.078 -10.984 12 HA ASN 4 HA ASN 4 6.443 1.686 -13.035 13 HB2 ASN 4 HB2 ASN 4 3.963 2.024 -12.813 14 HB3 ASN 4 HB3 ASN 4 4.210 2.434 -11.121 15 HD21 ASN 4 HD22 ASN 4 3.077 4.009 -13.306 16 HD22 ASN 4 HD21 ASN 4 4.025 5.452 -13.391 17 H SER 5 H SER 5 8.068 2.974 -12.288 18 HA SER 5 HA SER 5 9.092 2.421 -9.667 19 HB2 SER 5 HB2 SER 5 10.089 4.445 -11.680 20 HB3 SER 5 HB3 SER 5 10.990 3.764 -10.324 21 HG SER 5 HG SER 5 10.326 2.633 -12.787 22 H GLN 6 H GLN 6 7.257 3.230 -8.473 23 HA GLN 6 HA GLN 6 7.270 6.137 -8.184 24 HB2 GLN 6 HB2 GLN 6 5.199 4.098 -7.371 25 HB3 GLN 6 HB3 GLN 6 5.114 5.800 -6.949 26 HG2 GLN 6 HG2 GLN 6 5.120 4.691 -9.747 27 HG3 GLN 6 HG3 GLN 6 3.699 5.243 -8.862 28 HE21 GLN 6 HE22 GLN 6 6.525 6.172 -10.612 29 HE22 GLN 6 HE21 GLN 6 6.158 7.862 -10.718 30 HA PRO 7 HA PRO 7 9.335 4.937 -4.335 31 HB2 PRO 7 HB2 PRO 7 10.800 7.355 -4.361 32 HB3 PRO 7 HB3 PRO 7 11.381 5.757 -4.823 33 HG2 PRO 7 HG2 PRO 7 11.004 7.958 -6.532 34 HG3 PRO 7 HG3 PRO 7 11.311 6.286 -7.020 35 HD2 PRO 7 HD2 PRO 7 8.759 7.799 -6.953 36 HD3 PRO 7 HD3 PRO 7 9.251 6.444 -7.994 37 H ILE 8 H ILE 8 9.366 8.449 -4.458 38 HA ILE 8 HA ILE 8 7.216 8.515 -2.463 39 HB ILE 8 HB ILE 8 9.314 8.764 -1.260 40 HG12 ILE 8 HG12 ILE 8 7.958 11.460 -1.467 41 HG13 ILE 8 HG13 ILE 8 7.269 10.085 -0.609 42 HG21 ILE 8 HG21 ILE 8 10.827 10.627 -1.670 43 HG22 ILE 8 HG22 ILE 8 9.839 11.144 -3.035 44 HG23 ILE 8 HG23 ILE 8 10.691 9.602 -3.098 45 HD11 ILE 8 HD11 ILE 8 9.119 10.087 0.939 46 HD12 ILE 8 HD12 ILE 8 8.377 11.688 0.873 47 HD13 ILE 8 HD13 ILE 8 9.902 11.387 0.039 48 H TRP 9 H TRP 9 8.857 10.060 -5.132 49 HA TRP 9 HA TRP 9 7.123 12.330 -5.223 50 HB2 TRP 9 HB2 TRP 9 8.678 11.131 -7.526 51 HB3 TRP 9 HB3 TRP 9 8.027 12.759 -7.425 52 HD1 TRP 9 HD1 TRP 9 10.998 10.650 -6.360 53 HE1 TRP 9 HE1 TRP 9 12.815 12.193 -5.386 54 HE3 TRP 9 HE3 TRP 9 8.324 15.007 -6.111 55 HZ2 TRP 9 HZ2 TRP 9 13.074 14.891 -4.611 56 HZ3 TRP 9 HZ3 TRP 9 9.438 17.022 -5.243 57 HH2 TRP 9 HH2 TRP 9 11.763 16.963 -4.507 58 H THR 10 H THR 10 5.211 10.956 -4.812 59 HA THR 10 HA THR 10 3.981 10.180 -7.363 60 HB THR 10 HB THR 10 3.471 8.831 -4.700 61 HG1 THR 10 HG1 THR 10 5.243 8.170 -6.830 62 HG21 THR 10 HG21 THR 10 1.664 8.655 -6.338 63 HG22 THR 10 HG22 THR 10 2.445 7.095 -6.075 64 HG23 THR 10 HG23 THR 10 2.804 8.030 -7.527 65 H ASN 11 H ASN 11 3.986 12.195 -4.740 66 HA ASN 11 HA ASN 11 1.354 13.219 -5.262 67 HB2 ASN 11 HB2 ASN 11 0.911 11.420 -3.595 68 HB3 ASN 11 HB3 ASN 11 2.049 12.181 -2.495 69 HD21 ASN 11 HD22 ASN 11 -0.809 11.586 -2.235 70 HD22 ASN 11 HD21 ASN 11 -1.563 13.089 -1.831 71 HA PRO 12 HA PRO 12 3.914 16.831 -4.803 72 HB2 PRO 12 HB2 PRO 12 1.209 18.002 -4.318 73 HB3 PRO 12 HB3 PRO 12 2.504 18.569 -5.380 74 HG2 PRO 12 HG2 PRO 12 0.392 17.301 -6.382 75 HG3 PRO 12 HG3 PRO 12 2.019 17.008 -7.024 76 HD2 PRO 12 HD2 PRO 12 0.336 15.293 -5.269 77 HD3 PRO 12 HD3 PRO 12 1.520 14.829 -6.507 78 H ASN 13 H ASN 13 1.162 16.365 -2.597 79 HA ASN 13 HA ASN 13 2.119 18.076 -0.568 80 HB2 ASN 13 HB2 ASN 13 -0.251 17.116 -0.911 81 HB3 ASN 13 HB3 ASN 13 0.344 15.686 -0.084 82 HD21 ASN 13 HD22 ASN 13 2.056 17.288 1.742 83 HD22 ASN 13 HD21 ASN 13 0.960 17.999 2.875 84 H ALA 14 H ALA 14 2.512 14.641 -1.193 85 HA ALA 14 HA ALA 14 3.762 13.980 1.266 86 HB1 ALA 14 HB1 ALA 14 2.701 12.307 -0.143 87 HB2 ALA 14 HB2 ALA 14 4.394 11.900 0.142 88 HB3 ALA 14 HB3 ALA 14 3.899 12.591 -1.404 89 H ALA 15 H ALA 15 5.064 14.587 -1.975 90 HA ALA 15 HA ALA 15 7.772 14.235 -1.311 91 HB1 ALA 15 HB1 ALA 15 6.892 14.162 -3.602 92 HB2 ALA 15 HB2 ALA 15 8.251 15.272 -3.445 93 HB3 ALA 15 HB3 ALA 15 6.606 15.901 -3.535 94 H MET 16 H MET 16 5.742 17.142 -1.388 95 HA MET 16 HA MET 16 7.834 18.928 -0.765 96 HB2 MET 16 HB2 MET 16 5.023 19.038 -1.231 97 HB3 MET 16 HB3 MET 16 5.387 19.948 0.235 98 HG2 MET 16 HG2 MET 16 6.663 20.345 -2.461 99 HG3 MET 16 HG3 MET 16 5.382 21.331 -1.774 100 HE1 MET 16 HE1 MET 16 8.889 21.296 -2.617 101 HE2 MET 16 HE2 MET 16 9.165 20.169 -1.292 102 HE3 MET 16 HE3 MET 16 9.824 21.803 -1.213 103 H THR 17 H THR 17 5.886 16.801 1.180 104 HA THR 17 HA THR 17 6.255 17.995 3.697 105 HB THR 17 HB THR 17 5.875 15.084 2.970 106 HG1 THR 17 HG1 THR 17 4.103 16.463 2.493 107 HG21 THR 17 HG21 THR 17 5.207 14.778 5.339 108 HG22 THR 17 HG22 THR 17 5.755 16.419 5.680 109 HG23 THR 17 HG23 THR 17 6.913 15.192 5.164 110 H MET 18 H MET 18 8.137 15.392 2.105 111 HA MET 18 HA MET 18 10.021 15.141 4.180 112 HB2 MET 18 HB2 MET 18 11.399 13.903 2.636 113 HB3 MET 18 HB3 MET 18 9.719 13.454 2.380 114 HG2 MET 18 HG2 MET 18 9.595 14.745 0.393 115 HG3 MET 18 HG3 MET 18 11.158 15.490 0.711 116 HE1 MET 18 HE1 MET 18 11.915 14.994 -1.700 117 HE2 MET 18 HE2 MET 18 10.398 14.182 -2.101 118 HE3 MET 18 HE3 MET 18 11.939 13.393 -2.443 119 H THR 19 H THR 19 9.916 17.233 1.350 120 HA THR 19 HA THR 19 12.555 18.190 1.477 121 HB THR 19 HB THR 19 10.182 19.779 0.501 122 HG1 THR 19 HG1 THR 19 10.023 17.778 -0.517 123 HG21 THR 19 HG21 THR 19 12.371 20.925 0.580 124 HG22 THR 19 HG22 THR 19 11.795 20.699 -1.073 125 HG23 THR 19 HG23 THR 19 13.052 19.644 -0.427 126 H ASN 20 H ASN 20 9.539 19.382 2.936 127 HA ASN 20 HA ASN 20 10.725 21.644 4.174 128 HB2 ASN 20 HB2 ASN 20 8.119 20.199 4.506 129 HB3 ASN 20 HB3 ASN 20 8.596 21.422 5.678 130 HD21 ASN 20 HD22 ASN 20 7.578 20.810 2.426 131 HD22 ASN 20 HD21 ASN 20 7.308 22.462 1.988 132 H ASN 21 H ASN 21 10.058 18.340 5.242 133 HA ASN 21 HA ASN 21 10.780 18.655 7.936 134 HB2 ASN 21 HB2 ASN 21 10.822 16.268 6.094 135 HB3 ASN 21 HB3 ASN 21 11.303 16.152 7.777 136 HD21 ASN 21 HD22 ASN 21 9.120 14.866 6.381 137 HD22 ASN 21 HD21 ASN 21 7.675 15.324 7.213 138 H LEU 22 H LEU 22 12.697 18.032 5.053 139 HA LEU 22 HA LEU 22 15.157 17.472 6.283 140 HB2 LEU 22 HB2 LEU 22 14.793 17.113 3.905 141 HB3 LEU 22 HB3 LEU 22 14.549 18.830 3.651 142 HG LEU 22 HG LEU 22 16.921 19.215 4.335 143 HD11 LEU 22 HD11 LEU 22 17.081 16.208 4.203 144 HD12 LEU 22 HD12 LEU 22 17.257 17.199 5.653 145 HD13 LEU 22 HD13 LEU 22 18.448 17.313 4.355 146 HD21 LEU 22 HD21 LEU 22 17.882 18.370 2.230 147 HD22 LEU 22 HD22 LEU 22 16.316 19.148 1.998 148 HD23 LEU 22 HD23 LEU 22 16.437 17.388 1.984 149 H VAL 23 H VAL 23 13.767 20.528 5.153 150 HA VAL 23 HA VAL 23 15.920 22.165 5.938 151 HB VAL 23 HB VAL 23 13.016 22.949 5.634 152 HG11 VAL 23 HG11 VAL 23 15.527 24.618 5.543 153 HG12 VAL 23 HG12 VAL 23 14.301 24.642 6.810 154 HG13 VAL 23 HG13 VAL 23 13.899 25.196 5.185 155 HG21 VAL 23 HG21 VAL 23 13.629 23.596 3.350 156 HG22 VAL 23 HG22 VAL 23 13.852 21.868 3.622 157 HG23 VAL 23 HG23 VAL 23 15.247 22.946 3.606 158 H GLN 24 H GLN 24 12.887 21.296 7.594 159 HA GLN 24 HA GLN 24 13.339 23.027 9.794 160 HB2 GLN 24 HB2 GLN 24 11.450 22.025 10.820 161 HB3 GLN 24 HB3 GLN 24 11.116 22.050 9.099 162 HG2 GLN 24 HG2 GLN 24 10.392 19.964 9.633 163 HG3 GLN 24 HG3 GLN 24 12.062 19.613 9.193 164 HE21 GLN 24 HE22 GLN 24 12.108 17.756 10.440 165 HE22 GLN 24 HE21 GLN 24 12.163 17.800 12.166 166 H CYS 25 H CYS 25 14.290 19.729 9.114 167 HA CYS 25 HA CYS 25 15.154 19.064 11.734 168 HB2 CYS 25 HB2 CYS 25 14.704 17.360 10.018 169 HB3 CYS 25 HB3 CYS 25 16.043 17.967 9.054 170 H ALA 26 H ALA 26 16.852 20.250 8.851 171 HA ALA 26 HA ALA 26 19.405 20.286 10.111 172 HB1 ALA 26 HB1 ALA 26 19.038 20.071 7.663 173 HB2 ALA 26 HB2 ALA 26 20.205 21.314 8.108 174 HB3 ALA 26 HB3 ALA 26 18.571 21.771 7.628 175 H SER 27 H SER 27 16.810 22.601 9.823 176 HA SER 27 HA SER 27 18.294 24.907 10.544 177 HB2 SER 27 HB2 SER 27 16.019 24.934 9.491 178 HB3 SER 27 HB3 SER 27 15.354 24.379 11.027 179 HG SER 27 HG SER 27 16.942 26.515 11.430 180 H ARG 28 H ARG 28 17.070 22.237 12.348 181 HA ARG 28 HA ARG 28 17.473 23.695 14.871 182 HB2 ARG 28 HB2 ARG 28 15.897 21.187 14.277 183 HB3 ARG 28 HB3 ARG 28 16.120 21.859 15.887 184 HG2 ARG 28 HG2 ARG 28 14.779 23.260 13.586 185 HG3 ARG 28 HG3 ARG 28 13.944 22.434 14.904 186 HD2 ARG 28 HD2 ARG 28 15.015 23.975 16.506 187 HD3 ARG 28 HD3 ARG 28 15.777 24.820 15.158 188 HE ARG 28 HE ARG 28 13.065 24.813 14.632 189 HH11 ARG 28 HH11 ARG 28 15.211 26.094 17.083 190 HH12 ARG 28 HH12 ARG 28 14.160 27.411 17.497 191 HH21 ARG 28 HH21 ARG 28 11.679 26.554 15.166 192 HH22 ARG 28 HH22 ARG 28 12.145 27.662 16.416 193 H SER 29 H SER 29 19.420 22.309 13.006 194 HA SER 29 HA SER 29 20.398 20.070 14.517 195 HB2 SER 29 HB2 SER 29 22.245 20.044 12.901 196 HB3 SER 29 HB3 SER 29 20.695 20.176 12.070 197 HG SER 29 HG SER 29 21.192 22.135 11.408 198 H GLY 30 H GLY 30 21.212 23.473 14.162 199 HA2 GLY 30 HA2 GLY 30 22.450 24.821 15.601 200 HA3 GLY 30 HA3 GLY 30 22.893 23.390 16.525 201 H VAL 31 H VAL 31 23.336 22.700 13.349 202 HA VAL 31 HA VAL 31 26.226 23.052 13.599 203 HB VAL 31 HB VAL 31 24.623 21.416 11.622 204 HG11 VAL 31 HG11 VAL 31 27.594 21.527 12.137 205 HG12 VAL 31 HG12 VAL 31 26.761 22.061 10.676 206 HG13 VAL 31 HG13 VAL 31 26.789 20.348 11.102 207 HG21 VAL 31 HG21 VAL 31 26.150 20.583 14.087 208 HG22 VAL 31 HG22 VAL 31 25.443 19.478 12.910 209 HG23 VAL 31 HG23 VAL 31 24.400 20.530 13.868 210 H LEU 32 H LEU 32 23.548 23.769 11.397 211 HA LEU 32 HA LEU 32 25.236 24.896 9.383 212 HB2 LEU 32 HB2 LEU 32 22.253 25.130 9.740 213 HB3 LEU 32 HB3 LEU 32 23.148 25.583 8.302 214 HG LEU 32 HG LEU 32 22.834 22.804 9.406 215 HD11 LEU 32 HD11 LEU 32 21.754 24.154 6.947 216 HD12 LEU 32 HD12 LEU 32 20.830 23.573 8.333 217 HD13 LEU 32 HD13 LEU 32 21.648 22.426 7.271 218 HD21 LEU 32 HD21 LEU 32 24.295 23.738 6.949 219 HD22 LEU 32 HD22 LEU 32 24.015 22.060 7.415 220 HD23 LEU 32 HD23 LEU 32 25.037 23.093 8.413 221 H THR 33 H THR 33 24.905 27.078 8.560 222 HA THR 33 HA THR 33 25.111 29.004 10.735 223 HB THR 33 HB THR 33 26.023 30.520 9.099 224 HG1 THR 33 HG1 THR 33 26.134 29.737 6.844 225 HG21 THR 33 HG21 THR 33 27.044 27.738 8.532 226 HG22 THR 33 HG22 THR 33 27.547 28.760 9.882 227 HG23 THR 33 HG23 THR 33 27.911 29.242 8.224 228 H ALA 34 H ALA 34 24.122 31.236 10.235 229 HA ALA 34 HA ALA 34 21.318 30.992 10.026 230 HB1 ALA 34 HB1 ALA 34 23.002 33.481 9.740 231 HB2 ALA 34 HB2 ALA 34 22.435 32.805 11.265 232 HB3 ALA 34 HB3 ALA 34 21.275 33.423 10.089 233 H ASP 35 H ASP 35 23.866 31.660 7.758 234 HA ASP 35 HA ASP 35 22.207 32.542 5.610 235 HB2 ASP 35 HB2 ASP 35 24.950 31.278 5.417 236 HB3 ASP 35 HB3 ASP 35 24.169 32.305 4.221 237 H GLN 36 H GLN 36 23.754 29.468 6.455 238 HA GLN 36 HA GLN 36 22.941 28.045 4.180 239 HB2 GLN 36 HB2 GLN 36 23.909 27.273 6.901 240 HB3 GLN 36 HB3 GLN 36 23.287 26.029 5.821 241 HG2 GLN 36 HG2 GLN 36 24.938 26.586 4.160 242 HG3 GLN 36 HG3 GLN 36 25.500 27.947 5.131 243 HE21 GLN 36 HE22 GLN 36 26.863 25.516 4.131 244 HE22 GLN 36 HE21 GLN 36 27.573 24.788 5.533 245 H MET 37 H MET 37 21.353 28.437 7.329 246 HA MET 37 HA MET 37 19.310 26.531 6.818 247 HB2 MET 37 HB2 MET 37 19.407 28.866 8.726 248 HB3 MET 37 HB3 MET 37 18.098 27.693 8.683 249 HG2 MET 37 HG2 MET 37 19.723 25.907 9.168 250 HG3 MET 37 HG3 MET 37 20.988 27.128 9.298 251 HE1 MET 37 HE1 MET 37 19.468 29.524 10.729 252 HE2 MET 37 HE2 MET 37 21.076 28.979 11.209 253 HE3 MET 37 HE3 MET 37 19.812 29.182 12.424 254 H ASP 38 H ASP 38 19.733 29.845 5.877 255 HA ASP 38 HA ASP 38 16.958 30.101 5.041 256 HB2 ASP 38 HB2 ASP 38 18.180 32.063 5.969 257 HB3 ASP 38 HB3 ASP 38 19.269 32.001 4.586 258 H ASP 39 H ASP 39 20.133 29.546 3.710 259 HA ASP 39 HA ASP 39 19.570 29.748 0.977 260 HB2 ASP 39 HB2 ASP 39 21.838 29.436 2.135 261 HB3 ASP 39 HB3 ASP 39 21.455 27.720 2.183 262 H MET 40 H MET 40 19.155 27.093 3.263 263 HA MET 40 HA MET 40 18.294 25.156 1.395 264 HB2 MET 40 HB2 MET 40 17.684 25.437 4.340 265 HB3 MET 40 HB3 MET 40 17.281 24.026 3.375 266 HG2 MET 40 HG2 MET 40 19.675 23.707 2.895 267 HG3 MET 40 HG3 MET 40 20.039 25.080 3.939 268 HE1 MET 40 HE1 MET 40 17.297 22.290 4.440 269 HE2 MET 40 HE2 MET 40 18.187 21.122 5.413 270 HE3 MET 40 HE3 MET 40 18.667 21.425 3.743 271 H GLY 41 H GLY 41 16.711 27.854 2.871 272 HA2 GLY 41 HA2 GLY 41 14.022 27.035 2.526 273 HA3 GLY 41 HA3 GLY 41 14.582 28.693 2.701 274 H MET 42 H MET 42 16.139 29.097 0.547 275 HA MET 42 HA MET 42 14.246 29.369 -1.557 276 HB2 MET 42 HB2 MET 42 16.039 30.392 -2.823 277 HB3 MET 42 HB3 MET 42 16.058 30.999 -1.174 278 HG2 MET 42 HG2 MET 42 17.858 29.363 -0.668 279 HG3 MET 42 HG3 MET 42 17.894 28.953 -2.380 280 HE1 MET 42 HE1 MET 42 19.050 33.067 -0.630 281 HE2 MET 42 HE2 MET 42 18.589 31.662 0.334 282 HE3 MET 42 HE3 MET 42 17.387 32.480 -0.660 283 H MET 43 H MET 43 16.635 26.995 -0.743 284 HA MET 43 HA MET 43 16.769 25.662 -3.239 285 HB2 MET 43 HB2 MET 43 18.394 25.250 -1.470 286 HB3 MET 43 HB3 MET 43 17.128 24.640 -0.416 287 HG2 MET 43 HG2 MET 43 16.741 22.863 -2.201 288 HG3 MET 43 HG3 MET 43 18.293 23.377 -2.865 289 HE1 MET 43 HE1 MET 43 17.701 21.569 1.334 290 HE2 MET 43 HE2 MET 43 16.423 21.711 0.127 291 HE3 MET 43 HE3 MET 43 17.083 23.162 0.889 292 H ALA 44 H ALA 44 14.798 25.133 -0.327 293 HA ALA 44 HA ALA 44 13.267 22.992 -1.330 294 HB1 ALA 44 HB1 ALA 44 11.738 23.451 0.515 295 HB2 ALA 44 HB2 ALA 44 12.506 25.017 0.778 296 HB3 ALA 44 HB3 ALA 44 13.415 23.531 1.056 297 H ASP 45 H ASP 45 12.843 26.480 -1.463 298 HA ASP 45 HA ASP 45 10.281 26.597 -2.569 299 HB2 ASP 45 HB2 ASP 45 11.393 28.592 -1.756 300 HB3 ASP 45 HB3 ASP 45 12.650 28.428 -2.976 301 H SER 46 H SER 46 13.431 26.239 -4.081 302 HA SER 46 HA SER 46 12.595 26.290 -6.759 303 HB2 SER 46 HB2 SER 46 14.930 26.571 -6.072 304 HB3 SER 46 HB3 SER 46 14.966 24.920 -5.462 305 HG SER 46 HG SER 46 15.814 24.699 -7.417 306 H VAL 47 H VAL 47 12.831 23.686 -4.387 307 HA VAL 47 HA VAL 47 12.512 21.513 -6.123 308 HB VAL 47 HB VAL 47 11.638 21.696 -3.234 309 HG11 VAL 47 HG11 VAL 47 11.854 19.245 -3.255 310 HG12 VAL 47 HG12 VAL 47 12.168 19.297 -4.990 311 HG13 VAL 47 HG13 VAL 47 10.602 19.811 -4.360 312 HG21 VAL 47 HG21 VAL 47 13.805 20.606 -2.770 313 HG22 VAL 47 HG22 VAL 47 13.991 22.214 -3.470 314 HG23 VAL 47 HG23 VAL 47 14.235 20.783 -4.472 315 H ASN 48 H ASN 48 9.972 23.242 -4.227 316 HA ASN 48 HA ASN 48 7.931 21.578 -5.274 317 HB2 ASN 48 HB2 ASN 48 6.343 23.257 -4.367 318 HB3 ASN 48 HB3 ASN 48 7.489 22.658 -3.188 319 HD21 ASN 48 HD22 ASN 48 8.708 24.064 -2.111 320 HD22 ASN 48 HD21 ASN 48 8.720 25.768 -2.389 321 H SER 49 H SER 49 9.467 24.445 -6.450 322 HA SER 49 HA SER 49 7.496 25.202 -8.326 323 HB2 SER 49 HB2 SER 49 9.422 26.643 -7.653 324 HB3 SER 49 HB3 SER 49 10.499 25.565 -8.538 325 HG SER 49 HG SER 49 9.213 27.627 -9.495 326 H GLN 50 H GLN 50 10.403 23.159 -8.642 327 HA GLN 50 HA GLN 50 9.748 22.429 -11.330 328 HB2 GLN 50 HB2 GLN 50 11.674 20.816 -11.054 329 HB3 GLN 50 HB3 GLN 50 12.045 22.527 -10.887 330 HG2 GLN 50 HG2 GLN 50 11.964 22.303 -8.472 331 HG3 GLN 50 HG3 GLN 50 11.615 20.591 -8.642 332 HE21 GLN 50 HE22 GLN 50 13.849 21.989 -7.348 333 HE22 GLN 50 HE21 GLN 50 15.290 21.368 -8.076 334 H MET 51 H MET 51 9.031 21.146 -8.219 335 HA MET 51 HA MET 51 8.432 18.488 -8.970 336 HB2 MET 51 HB2 MET 51 8.769 19.154 -6.630 337 HB3 MET 51 HB3 MET 51 7.322 20.148 -6.693 338 HG2 MET 51 HG2 MET 51 6.966 17.304 -7.386 339 HG3 MET 51 HG3 MET 51 7.394 17.648 -5.713 340 HE1 MET 51 HE1 MET 51 6.163 20.227 -4.922 341 HE2 MET 51 HE2 MET 51 5.681 18.843 -3.935 342 HE3 MET 51 HE3 MET 51 4.463 19.958 -4.550 343 H GLN 52 H GLN 52 6.597 21.479 -9.017 344 HA GLN 52 HA GLN 52 4.123 20.233 -9.732 345 HB2 GLN 52 HB2 GLN 52 5.055 23.097 -9.982 346 HB3 GLN 52 HB3 GLN 52 3.416 22.556 -10.321 347 HG2 GLN 52 HG2 GLN 52 3.149 21.840 -8.023 348 HG3 GLN 52 HG3 GLN 52 4.814 22.300 -7.671 349 HE21 GLN 52 HE22 GLN 52 5.350 24.460 -7.512 350 HE22 GLN 52 HE21 GLN 52 4.162 25.705 -7.335 351 H LYS 53 H LYS 53 6.975 21.020 -11.408 352 HA LYS 53 HA LYS 53 5.685 20.998 -14.021 353 HB2 LYS 53 HB2 LYS 53 8.616 21.208 -13.323 354 HB3 LYS 53 HB3 LYS 53 7.901 21.478 -14.901 355 HG2 LYS 53 HG2 LYS 53 7.056 23.145 -12.573 356 HG3 LYS 53 HG3 LYS 53 8.562 23.496 -13.416 357 HD2 LYS 53 HD2 LYS 53 6.946 24.881 -14.423 358 HD3 LYS 53 HD3 LYS 53 7.176 23.550 -15.551 359 HE2 LYS 53 HE2 LYS 53 5.138 22.532 -14.892 360 HE3 LYS 53 HE3 LYS 53 4.957 23.619 -13.517 361 HZ1 LYS 53 HZ1 LYS 53 3.523 24.244 -15.360 362 HZ2 LYS 53 HZ2 LYS 53 4.862 24.413 -16.376 363 HZ3 LYS 53 HZ3 LYS 53 4.665 25.453 -15.060 364 H MET 54 H MET 54 6.452 18.750 -11.855 365 HA MET 54 HA MET 54 7.885 16.846 -13.426 366 HB2 MET 54 HB2 MET 54 7.874 16.847 -10.957 367 HB3 MET 54 HB3 MET 54 6.170 16.426 -10.974 368 HG2 MET 54 HG2 MET 54 6.661 14.304 -11.999 369 HG3 MET 54 HG3 MET 54 8.369 14.729 -12.124 370 HE1 MET 54 HE1 MET 54 9.481 14.800 -8.375 371 HE2 MET 54 HE2 MET 54 8.868 16.191 -9.269 372 HE3 MET 54 HE3 MET 54 9.964 15.049 -10.052 373 H GLY 55 H GLY 55 4.473 17.432 -12.726 374 HA2 GLY 55 HA2 GLY 55 2.875 17.090 -14.506 375 HA3 GLY 55 HA3 GLY 55 3.824 15.706 -15.025 376 HA PRO 56 HA PRO 56 0.298 14.557 -11.929 377 HB2 PRO 56 HB2 PRO 56 -1.559 13.724 -13.756 378 HB3 PRO 56 HB3 PRO 56 -1.557 15.334 -13.030 379 HG2 PRO 56 HG2 PRO 56 -0.522 14.451 -15.692 380 HG3 PRO 56 HG3 PRO 56 -1.439 15.911 -15.276 381 HD2 PRO 56 HD2 PRO 56 1.229 15.962 -15.658 382 HD3 PRO 56 HD3 PRO 56 0.433 17.003 -14.459 383 H ASN 57 H ASN 57 0.413 12.514 -11.247 384 HA ASN 57 HA ASN 57 1.280 10.430 -11.038 385 HB2 ASN 57 HB2 ASN 57 0.399 10.236 -13.926 386 HB3 ASN 57 HB3 ASN 57 1.005 8.868 -12.994 387 HD21 ASN 57 HD22 ASN 57 -1.638 10.968 -13.596 388 HD22 ASN 57 HD21 ASN 57 -2.787 10.179 -12.575 389 HA PRO 58 HA PRO 58 5.192 12.376 -12.421 390 HB2 PRO 58 HB2 PRO 58 6.071 10.646 -10.155 391 HB3 PRO 58 HB3 PRO 58 6.506 12.318 -10.532 392 HG2 PRO 58 HG2 PRO 58 4.765 11.830 -8.611 393 HG3 PRO 58 HG3 PRO 58 4.475 13.155 -9.755 394 HD2 PRO 58 HD2 PRO 58 3.228 10.436 -9.650 395 HD3 PRO 58 HD3 PRO 58 2.485 12.006 -10.025 396 HA PRO 59 HA PRO 59 6.400 8.706 -14.747 397 HB2 PRO 59 HB2 PRO 59 7.749 10.076 -16.655 398 HB3 PRO 59 HB3 PRO 59 5.991 9.914 -16.661 399 HG2 PRO 59 HG2 PRO 59 7.680 12.214 -15.793 400 HG3 PRO 59 HG3 PRO 59 6.147 12.220 -16.681 401 HD2 PRO 59 HD2 PRO 59 6.360 12.726 -14.001 402 HD3 PRO 59 HD3 PRO 59 4.901 12.071 -14.769 403 H GLN 60 H GLN 60 8.274 7.540 -14.668 404 HA GLN 60 HA GLN 60 10.124 8.311 -12.700 405 HB2 GLN 60 HB2 GLN 60 11.365 6.229 -13.406 406 HB3 GLN 60 HB3 GLN 60 9.703 6.016 -12.881 407 HG2 GLN 60 HG2 GLN 60 8.989 5.885 -15.220 408 HG3 GLN 60 HG3 GLN 60 10.667 6.074 -15.731 409 HE21 GLN 60 HE22 GLN 60 12.085 4.369 -15.501 410 HE22 GLN 60 HE21 GLN 60 11.564 2.763 -15.119 411 H HIS 61 H HIS 61 10.165 8.822 -16.131 412 HA HIS 61 HA HIS 61 12.983 9.125 -16.361 413 HB2 HIS 61 HB2 HIS 61 12.619 10.007 -18.532 414 HB3 HIS 61 HB3 HIS 61 11.386 8.781 -18.296 415 HD1 HIS 61 HD1 HIS 61 8.994 9.496 -18.631 416 HD2 HIS 61 HD2 HIS 61 11.617 12.712 -18.410 417 HE1 HIS 61 HE1 HIS 61 7.641 11.517 -19.266 418 H ARG 62 H ARG 62 10.527 11.080 -15.016 419 HA ARG 62 HA ARG 62 12.162 13.492 -15.005 420 HB2 ARG 62 HB2 ARG 62 9.452 12.794 -13.879 421 HB3 ARG 62 HB3 ARG 62 10.266 14.293 -13.457 422 HG2 ARG 62 HG2 ARG 62 10.000 13.684 -16.337 423 HG3 ARG 62 HG3 ARG 62 8.525 14.092 -15.460 424 HD2 ARG 62 HD2 ARG 62 9.558 16.073 -16.458 425 HD3 ARG 62 HD3 ARG 62 9.522 16.171 -14.701 426 HE ARG 62 HE ARG 62 11.967 15.260 -16.044 427 HH11 ARG 62 HH11 ARG 62 10.289 17.698 -14.172 428 HH12 ARG 62 HH12 ARG 62 11.741 18.514 -13.693 429 HH21 ARG 62 HH21 ARG 62 13.881 16.341 -15.427 430 HH22 ARG 62 HH22 ARG 62 13.787 17.755 -14.423 431 H LEU 63 H LEU 63 11.245 10.841 -12.947 432 HA LEU 63 HA LEU 63 12.074 11.955 -10.481 433 HB2 LEU 63 HB2 LEU 63 11.853 9.035 -11.205 434 HB3 LEU 63 HB3 LEU 63 11.806 9.726 -9.594 435 HG LEU 63 HG LEU 63 9.715 10.034 -11.747 436 HD11 LEU 63 HD11 LEU 63 9.639 8.698 -9.048 437 HD12 LEU 63 HD12 LEU 63 9.659 7.887 -10.614 438 HD13 LEU 63 HD13 LEU 63 8.274 8.876 -10.152 439 HD21 LEU 63 HD21 LEU 63 8.443 11.261 -10.003 440 HD22 LEU 63 HD22 LEU 63 9.864 12.118 -10.595 441 HD23 LEU 63 HD23 LEU 63 9.913 11.308 -9.031 442 H ARG 64 H ARG 64 13.681 10.038 -12.935 443 HA ARG 64 HA ARG 64 16.017 9.460 -11.423 444 HB2 ARG 64 HB2 ARG 64 15.195 9.208 -14.264 445 HB3 ARG 64 HB3 ARG 64 16.920 9.223 -13.934 446 HG2 ARG 64 HG2 ARG 64 15.929 6.951 -14.059 447 HG3 ARG 64 HG3 ARG 64 16.746 7.294 -12.536 448 HD2 ARG 64 HD2 ARG 64 14.613 7.706 -11.457 449 HD3 ARG 64 HD3 ARG 64 13.768 7.468 -12.984 450 HE ARG 64 HE ARG 64 14.685 5.124 -12.877 451 HH11 ARG 64 HH11 ARG 64 14.186 6.992 -9.948 452 HH12 ARG 64 HH12 ARG 64 13.853 5.600 -8.971 453 HH21 ARG 64 HH21 ARG 64 14.230 3.291 -11.566 454 HH22 ARG 64 HH22 ARG 64 13.860 3.516 -9.885 455 H ALA 65 H ALA 65 14.937 12.275 -13.030 456 HA ALA 65 HA ALA 65 17.633 13.410 -13.100 457 HB1 ALA 65 HB1 ALA 65 16.616 15.292 -14.263 458 HB2 ALA 65 HB2 ALA 65 15.015 14.591 -14.026 459 HB3 ALA 65 HB3 ALA 65 16.194 13.772 -15.051 460 H MET 66 H MET 66 14.577 13.637 -11.397 461 HA MET 66 HA MET 66 14.958 16.108 -10.157 462 HB2 MET 66 HB2 MET 66 12.782 15.286 -10.245 463 HB3 MET 66 HB3 MET 66 13.248 13.707 -9.630 464 HG2 MET 66 HG2 MET 66 11.989 14.932 -8.007 465 HG3 MET 66 HG3 MET 66 13.629 14.654 -7.441 466 HE1 MET 66 HE1 MET 66 11.922 18.726 -8.792 467 HE2 MET 66 HE2 MET 66 10.994 17.232 -8.671 468 HE3 MET 66 HE3 MET 66 12.194 17.424 -9.950 469 H ASN 67 H ASN 67 15.797 12.816 -9.050 470 HA ASN 67 HA ASN 67 16.636 13.512 -6.479 471 HB2 ASN 67 HB2 ASN 67 17.986 11.472 -6.487 472 HB3 ASN 67 HB3 ASN 67 16.399 11.173 -7.178 473 HD21 ASN 67 HD22 ASN 67 16.235 10.472 -9.231 474 HD22 ASN 67 HD21 ASN 67 17.591 10.118 -10.243 475 H THR 68 H THR 68 18.303 13.753 -9.561 476 HA THR 68 HA THR 68 20.818 14.502 -8.412 477 HB THR 68 HB THR 68 19.871 14.925 -11.254 478 HG1 THR 68 HG1 THR 68 20.352 12.633 -9.894 479 HG21 THR 68 HG21 THR 68 22.640 14.661 -10.067 480 HG22 THR 68 HG22 THR 68 21.911 16.149 -10.672 481 HG23 THR 68 HG23 THR 68 22.270 14.827 -11.783 482 H ALA 69 H ALA 69 18.034 16.174 -9.775 483 HA ALA 69 HA ALA 69 19.050 18.774 -9.816 484 HB1 ALA 69 HB1 ALA 69 16.722 19.510 -9.752 485 HB2 ALA 69 HB2 ALA 69 16.216 17.887 -9.284 486 HB3 ALA 69 HB3 ALA 69 16.935 18.164 -10.873 487 H MET 70 H MET 70 17.294 17.055 -7.232 488 HA MET 70 HA MET 70 17.348 19.112 -5.323 489 HB2 MET 70 HB2 MET 70 15.970 17.124 -4.993 490 HB3 MET 70 HB3 MET 70 17.403 16.109 -4.914 491 HG2 MET 70 HG2 MET 70 18.072 17.631 -2.929 492 HG3 MET 70 HG3 MET 70 16.368 18.072 -2.911 493 HE1 MET 70 HE1 MET 70 14.414 16.458 -2.288 494 HE2 MET 70 HE2 MET 70 14.602 14.723 -2.036 495 HE3 MET 70 HE3 MET 70 14.840 15.413 -3.645 496 H ALA 71 H ALA 71 19.515 16.363 -5.807 497 HA ALA 71 HA ALA 71 21.312 16.813 -3.765 498 HB1 ALA 71 HB1 ALA 71 21.229 14.786 -5.122 499 HB2 ALA 71 HB2 ALA 71 22.863 15.445 -5.042 500 HB3 ALA 71 HB3 ALA 71 21.885 15.678 -6.492 501 H ALA 72 H ALA 72 21.326 18.160 -7.040 502 HA ALA 72 HA ALA 72 23.864 19.391 -6.860 503 HB1 ALA 72 HB1 ALA 72 21.530 20.131 -8.622 504 HB2 ALA 72 HB2 ALA 72 22.771 18.934 -8.998 505 HB3 ALA 72 HB3 ALA 72 23.204 20.638 -8.847 506 H GLU 73 H GLU 73 20.635 20.462 -5.984 507 HA GLU 73 HA GLU 73 21.528 23.170 -5.526 508 HB2 GLU 73 HB2 GLU 73 18.852 21.871 -4.982 509 HB3 GLU 73 HB3 GLU 73 19.192 23.597 -4.875 510 HG2 GLU 73 HG2 GLU 73 19.809 23.590 -7.265 511 HG3 GLU 73 HG3 GLU 73 19.364 21.890 -7.348 512 H VAL 74 H VAL 74 20.787 20.309 -3.598 513 HA VAL 74 HA VAL 74 21.103 21.530 -1.055 514 HB VAL 74 HB VAL 74 21.684 18.664 -1.855 515 HG11 VAL 74 HG11 VAL 74 22.738 19.253 0.259 516 HG12 VAL 74 HG12 VAL 74 21.386 18.150 0.520 517 HG13 VAL 74 HG13 VAL 74 21.202 19.871 0.867 518 HG21 VAL 74 HG21 VAL 74 19.384 19.286 -2.346 519 HG22 VAL 74 HG22 VAL 74 19.184 19.896 -0.701 520 HG23 VAL 74 HG23 VAL 74 19.450 18.172 -0.978 521 H ALA 75 H ALA 75 23.335 20.186 -3.405 522 HA ALA 75 HA ALA 75 25.667 20.070 -1.886 523 HB1 ALA 75 HB1 ALA 75 25.406 20.721 -4.817 524 HB2 ALA 75 HB2 ALA 75 25.461 19.102 -4.121 525 HB3 ALA 75 HB3 ALA 75 26.866 20.162 -4.003 526 H GLU 76 H GLU 76 24.084 22.801 -3.393 527 HA GLU 76 HA GLU 76 26.161 24.673 -3.312 528 HB2 GLU 76 HB2 GLU 76 23.189 25.107 -2.953 529 HB3 GLU 76 HB3 GLU 76 24.359 26.374 -3.281 530 HG2 GLU 76 HG2 GLU 76 23.748 24.059 -5.098 531 HG3 GLU 76 HG3 GLU 76 23.129 25.701 -5.282 532 H VAL 77 H VAL 77 23.732 23.803 -0.896 533 HA VAL 77 HA VAL 77 24.441 25.684 1.070 534 HB VAL 77 HB VAL 77 23.290 22.920 1.518 535 HG11 VAL 77 HG11 VAL 77 22.310 23.903 3.536 536 HG12 VAL 77 HG12 VAL 77 23.135 25.423 3.192 537 HG13 VAL 77 HG13 VAL 77 24.072 23.976 3.565 538 HG21 VAL 77 HG21 VAL 77 21.094 23.968 1.373 539 HG22 VAL 77 HG22 VAL 77 21.985 24.161 -0.137 540 HG23 VAL 77 HG23 VAL 77 21.848 25.514 0.986 541 H VAL 78 H VAL 78 25.539 22.387 0.441 542 HA VAL 78 HA VAL 78 27.192 22.243 2.767 543 HB VAL 78 HB VAL 78 27.367 20.503 0.304 544 HG11 VAL 78 HG11 VAL 78 29.240 20.255 1.825 545 HG12 VAL 78 HG12 VAL 78 28.212 18.825 1.881 546 HG13 VAL 78 HG13 VAL 78 28.135 20.014 3.179 547 HG21 VAL 78 HG21 VAL 78 25.068 20.539 1.076 548 HG22 VAL 78 HG22 VAL 78 25.593 20.195 2.725 549 HG23 VAL 78 HG23 VAL 78 25.815 18.986 1.460 550 H ALA 79 H ALA 79 27.702 23.132 -0.600 551 HA ALA 79 HA ALA 79 30.532 23.155 -0.556 552 HB1 ALA 79 HB1 ALA 79 28.686 24.795 -2.289 553 HB2 ALA 79 HB2 ALA 79 29.195 23.141 -2.623 554 HB3 ALA 79 HB3 ALA 79 30.384 24.441 -2.604 555 H THR 80 H THR 80 28.261 25.188 0.900 556 HA THR 80 HA THR 80 29.946 27.540 0.986 557 HB THR 80 HB THR 80 27.407 26.963 2.538 558 HG1 THR 80 HG1 THR 80 27.046 26.834 0.262 559 HG21 THR 80 HG21 THR 80 27.196 29.402 2.647 560 HG22 THR 80 HG22 THR 80 28.727 29.577 1.790 561 HG23 THR 80 HG23 THR 80 28.697 28.863 3.403 562 H SER 81 H SER 81 29.988 24.606 2.501 563 HA SER 81 HA SER 81 30.672 25.567 5.162 564 HB2 SER 81 HB2 SER 81 30.668 22.729 4.117 565 HB3 SER 81 HB3 SER 81 30.672 23.245 5.806 566 HG SER 81 HG SER 81 28.595 23.031 4.033 567 HA PRO 82 HA PRO 82 35.098 25.221 4.352 568 HB2 PRO 82 HB2 PRO 82 35.378 25.259 7.267 569 HB3 PRO 82 HB3 PRO 82 35.950 26.435 6.082 570 HG2 PRO 82 HG2 PRO 82 33.932 26.966 7.806 571 HG3 PRO 82 HG3 PRO 82 34.023 27.676 6.185 572 HD2 PRO 82 HD2 PRO 82 32.356 25.389 7.163 573 HD3 PRO 82 HD3 PRO 82 31.934 26.700 6.038 574 HA PRO 83 HA PRO 83 35.919 20.910 4.917 575 HB2 PRO 83 HB2 PRO 83 38.572 21.671 6.034 576 HB3 PRO 83 HB3 PRO 83 38.183 20.581 4.698 577 HG2 PRO 83 HG2 PRO 83 39.155 23.006 4.213 578 HG3 PRO 83 HG3 PRO 83 37.876 22.320 3.193 579 HD2 PRO 83 HD2 PRO 83 37.682 24.393 5.340 580 HD3 PRO 83 HD3 PRO 83 36.825 24.291 3.789 581 H GLN 84 H GLN 84 36.565 23.069 7.599 582 HA GLN 84 HA GLN 84 36.887 21.101 9.609 583 HB2 GLN 84 HB2 GLN 84 35.792 23.893 9.977 584 HB3 GLN 84 HB3 GLN 84 36.554 22.887 11.198 585 HG2 GLN 84 HG2 GLN 84 37.860 24.180 8.821 586 HG3 GLN 84 HG3 GLN 84 38.092 24.576 10.521 587 HE21 GLN 84 HE22 GLN 84 40.062 23.870 8.553 588 HE22 GLN 84 HE21 GLN 84 40.863 22.445 9.133 589 H SER 85 H SER 85 34.065 22.850 8.389 590 HA SER 85 HA SER 85 32.363 21.514 10.354 591 HB2 SER 85 HB2 SER 85 31.588 23.689 8.408 592 HB3 SER 85 HB3 SER 85 30.738 23.199 9.874 593 HG SER 85 HG SER 85 31.925 25.044 10.326 594 H TYR 86 H TYR 86 33.325 21.162 7.159 595 HA TYR 86 HA TYR 86 31.060 20.622 5.696 596 HB2 TYR 86 HB2 TYR 86 33.377 20.727 4.792 597 HB3 TYR 86 HB3 TYR 86 33.691 19.140 5.481 598 HD1 TYR 86 HD2 TYR 86 32.385 17.159 4.610 599 HD2 TYR 86 HD1 TYR 86 32.295 20.961 2.702 600 HE1 TYR 86 HE2 TYR 86 31.523 16.104 2.562 601 HE2 TYR 86 HE1 TYR 86 31.437 19.917 0.651 602 HH TYR 86 HH TYR 86 31.410 17.721 -0.429 603 H SER 87 H SER 87 32.934 18.290 7.635 604 HA SER 87 HA SER 87 31.431 16.038 6.929 605 HB2 SER 87 HB2 SER 87 32.926 16.477 9.519 606 HB3 SER 87 HB3 SER 87 32.533 14.929 8.771 607 HG SER 87 HG SER 87 33.896 15.482 7.038 608 H ALA 88 H ALA 88 30.973 18.399 9.498 609 HA ALA 88 HA ALA 88 28.930 16.897 10.837 610 HB1 ALA 88 HB1 ALA 88 30.321 18.553 12.008 611 HB2 ALA 88 HB2 ALA 88 28.601 18.906 12.167 612 HB3 ALA 88 HB3 ALA 88 29.591 19.837 11.044 613 H VAL 89 H VAL 89 29.041 19.392 8.383 614 HA VAL 89 HA VAL 89 26.251 19.945 8.311 615 HB VAL 89 HB VAL 89 28.393 20.324 6.205 616 HG11 VAL 89 HG11 VAL 89 25.577 21.405 6.258 617 HG12 VAL 89 HG12 VAL 89 26.203 20.192 5.143 618 HG13 VAL 89 HG13 VAL 89 26.823 21.842 5.091 619 HG21 VAL 89 HG21 VAL 89 27.123 22.250 8.151 620 HG22 VAL 89 HG22 VAL 89 28.270 22.689 6.886 621 HG23 VAL 89 HG23 VAL 89 28.774 21.637 8.207 622 H LEU 90 H LEU 90 28.381 17.883 6.372 623 HA LEU 90 HA LEU 90 26.459 16.804 4.662 624 HB2 LEU 90 HB2 LEU 90 29.099 16.672 4.787 625 HB3 LEU 90 HB3 LEU 90 28.770 15.183 5.645 626 HG LEU 90 HG LEU 90 29.248 14.876 3.245 627 HD11 LEU 90 HD11 LEU 90 27.987 13.178 4.407 628 HD12 LEU 90 HD12 LEU 90 27.358 13.370 2.769 629 HD13 LEU 90 HD13 LEU 90 26.489 14.069 4.136 630 HD21 LEU 90 HD21 LEU 90 26.639 16.325 2.843 631 HD22 LEU 90 HD22 LEU 90 27.559 15.499 1.590 632 HD23 LEU 90 HD23 LEU 90 28.241 16.911 2.394 633 H ASN 91 H ASN 91 27.609 15.766 7.835 634 HA ASN 91 HA ASN 91 26.212 13.359 8.059 635 HB2 ASN 91 HB2 ASN 91 27.788 15.020 9.737 636 HB3 ASN 91 HB3 ASN 91 26.301 14.659 10.609 637 HD21 ASN 91 HD22 ASN 91 29.089 13.778 11.009 638 HD22 ASN 91 HD21 ASN 91 29.027 12.054 11.022 639 H THR 92 H THR 92 25.230 16.654 8.887 640 HA THR 92 HA THR 92 22.741 16.040 10.020 641 HB THR 92 HB THR 92 23.511 18.532 8.482 642 HG1 THR 92 HG1 THR 92 24.931 18.089 10.245 643 HG21 THR 92 HG21 THR 92 21.393 18.092 10.592 644 HG22 THR 92 HG22 THR 92 21.095 18.335 8.870 645 HG23 THR 92 HG23 THR 92 21.799 19.633 9.836 646 H ILE 93 H ILE 93 23.598 16.971 6.699 647 HA ILE 93 HA ILE 93 21.040 16.822 5.578 648 HB ILE 93 HB ILE 93 23.689 16.262 4.238 649 HG12 ILE 93 HG12 ILE 93 23.670 18.459 5.275 650 HG13 ILE 93 HG13 ILE 93 23.568 18.626 3.528 651 HG21 ILE 93 HG21 ILE 93 22.548 16.868 2.150 652 HG22 ILE 93 HG22 ILE 93 21.028 17.009 3.034 653 HG23 ILE 93 HG23 ILE 93 21.828 15.443 2.903 654 HD11 ILE 93 HD11 ILE 93 21.286 18.889 5.471 655 HD12 ILE 93 HD12 ILE 93 21.151 19.004 3.717 656 HD13 ILE 93 HD13 ILE 93 22.094 20.199 4.610 657 H GLY 94 H GLY 94 23.592 14.358 5.774 658 HA2 GLY 94 HA2 GLY 94 22.259 12.362 4.321 659 HA3 GLY 94 HA3 GLY 94 23.553 12.086 5.469 660 H ALA 95 H ALA 95 21.980 13.282 7.658 661 HA ALA 95 HA ALA 95 20.567 10.865 8.389 662 HB1 ALA 95 HB1 ALA 95 20.417 11.846 10.607 663 HB2 ALA 95 HB2 ALA 95 21.025 13.382 9.989 664 HB3 ALA 95 HB3 ALA 95 22.069 11.961 9.997 665 H CYS 96 H CYS 96 19.794 14.343 8.243 666 HA CYS 96 HA CYS 96 17.096 14.071 8.922 667 HB2 CYS 96 HB2 CYS 96 18.470 16.241 7.334 668 HB3 CYS 96 HB3 CYS 96 16.825 16.350 7.950 669 H LEU 97 H LEU 97 18.683 13.926 5.762 670 HA LEU 97 HA LEU 97 16.375 14.097 4.161 671 HB2 LEU 97 HB2 LEU 97 18.874 14.173 3.500 672 HB3 LEU 97 HB3 LEU 97 18.783 12.427 3.461 673 HG LEU 97 HG LEU 97 18.579 13.595 1.235 674 HD11 LEU 97 HD11 LEU 97 16.755 12.175 0.413 675 HD12 LEU 97 HD12 LEU 97 16.302 11.817 2.082 676 HD13 LEU 97 HD13 LEU 97 17.873 11.303 1.464 677 HD21 LEU 97 HD21 LEU 97 16.452 14.584 0.631 678 HD22 LEU 97 HD22 LEU 97 17.177 15.460 1.982 679 HD23 LEU 97 HD23 LEU 97 15.847 14.336 2.270 680 H ARG 98 H ARG 98 17.971 11.350 5.702 681 HA ARG 98 HA ARG 98 16.295 9.341 4.614 682 HB2 ARG 98 HB2 ARG 98 18.069 9.492 7.032 683 HB3 ARG 98 HB3 ARG 98 17.065 8.077 6.737 684 HG2 ARG 98 HG2 ARG 98 18.172 7.638 4.671 685 HG3 ARG 98 HG3 ARG 98 19.053 9.165 4.760 686 HD2 ARG 98 HD2 ARG 98 20.346 8.418 6.584 687 HD3 ARG 98 HD3 ARG 98 19.298 7.024 6.847 688 HE ARG 98 HE ARG 98 20.350 5.905 5.118 689 HH11 ARG 98 HH11 ARG 98 21.481 9.230 5.229 690 HH12 ARG 98 HH12 ARG 98 22.774 8.952 4.105 691 HH21 ARG 98 HH21 ARG 98 22.035 5.554 3.636 692 HH22 ARG 98 HH22 ARG 98 23.085 6.862 3.189 693 H GLU 99 H GLU 99 16.276 11.014 7.717 694 HA GLU 99 HA GLU 99 13.980 9.958 8.852 695 HB2 GLU 99 HB2 GLU 99 14.998 12.797 9.019 696 HB3 GLU 99 HB3 GLU 99 13.836 12.071 10.119 697 HG2 GLU 99 HG2 GLU 99 16.629 11.054 9.712 698 HG3 GLU 99 HG3 GLU 99 16.155 12.192 10.971 699 H SER 100 H SER 100 14.236 12.936 6.935 700 HA SER 100 HA SER 100 11.538 13.612 6.973 701 HB2 SER 100 HB2 SER 100 12.069 14.999 4.969 702 HB3 SER 100 HB3 SER 100 13.210 15.207 6.297 703 HG SER 100 HG SER 100 13.552 13.899 3.835 704 H MET 101 H MET 101 13.285 11.481 4.779 705 HA MET 101 HA MET 101 11.389 11.129 2.782 706 HB2 MET 101 HB2 MET 101 13.534 9.401 3.933 707 HB3 MET 101 HB3 MET 101 12.392 8.683 2.810 708 HG2 MET 101 HG2 MET 101 13.945 11.167 2.165 709 HG3 MET 101 HG3 MET 101 14.562 9.547 1.847 710 HE1 MET 101 HE1 MET 101 11.893 7.973 1.003 711 HE2 MET 101 HE2 MET 101 13.454 7.836 0.197 712 HE3 MET 101 HE3 MET 101 12.000 8.159 -0.746 713 H MET 102 H MET 102 11.734 9.283 5.817 714 HA MET 102 HA MET 102 9.417 7.703 5.182 715 HB2 MET 102 HB2 MET 102 9.785 6.568 7.257 716 HB3 MET 102 HB3 MET 102 11.323 6.771 6.437 717 HG2 MET 102 HG2 MET 102 11.905 8.594 7.911 718 HG3 MET 102 HG3 MET 102 10.329 8.489 8.699 719 HE1 MET 102 HE1 MET 102 10.560 4.821 10.177 720 HE2 MET 102 HE2 MET 102 10.161 5.158 8.491 721 HE3 MET 102 HE3 MET 102 9.484 6.162 9.775 722 H GLN 103 H GLN 103 10.067 10.565 7.005 723 HA GLN 103 HA GLN 103 7.617 10.531 8.486 724 HB2 GLN 103 HB2 GLN 103 9.832 12.470 8.075 725 HB3 GLN 103 HB3 GLN 103 8.290 13.095 8.642 726 HG2 GLN 103 HG2 GLN 103 8.340 11.722 10.568 727 HG3 GLN 103 HG3 GLN 103 9.715 10.806 9.960 728 HE21 GLN 103 HE22 GLN 103 11.758 11.653 10.127 729 HE22 GLN 103 HE21 GLN 103 12.123 13.036 11.104 730 H ALA 104 H ALA 104 8.239 11.010 5.274 731 HA ALA 104 HA ALA 104 6.110 12.910 4.805 732 HB1 ALA 104 HB1 ALA 104 8.032 12.864 3.304 733 HB2 ALA 104 HB2 ALA 104 6.542 12.502 2.433 734 HB3 ALA 104 HB3 ALA 104 7.654 11.201 2.858 735 H THR 105 H THR 105 6.609 9.564 3.641 736 HA THR 105 HA THR 105 4.218 8.496 4.575 737 HB THR 105 HB THR 105 3.112 10.159 3.136 738 HG1 THR 105 HG1 THR 105 2.666 7.543 3.159 739 HG21 THR 105 HG21 THR 105 4.482 8.730 0.855 740 HG22 THR 105 HG22 THR 105 4.833 10.368 1.410 741 HG23 THR 105 HG23 THR 105 3.260 9.995 0.701 742 H GLY 106 H GLY 106 6.769 8.492 2.192 743 HA2 GLY 106 HA2 GLY 106 6.036 5.798 1.319 744 HA3 GLY 106 HA3 GLY 106 7.178 6.866 0.523 745 H SER 107 H SER 107 7.506 6.530 3.950 746 HA SER 107 HA SER 107 9.176 5.726 5.231 747 HB2 SER 107 HB2 SER 107 9.144 3.541 3.144 748 HB3 SER 107 HB3 SER 107 10.027 3.448 4.667 749 HG SER 107 HG SER 107 7.232 3.560 4.243 750 H VAL 108 H VAL 108 11.612 4.718 4.907 751 HA VAL 108 HA VAL 108 12.859 6.584 3.024 752 HB VAL 108 HB VAL 108 13.444 7.283 5.187 753 HG11 VAL 108 HG11 VAL 108 14.142 4.433 5.842 754 HG12 VAL 108 HG12 VAL 108 12.765 5.351 6.451 755 HG13 VAL 108 HG13 VAL 108 14.405 5.819 6.900 756 HG21 VAL 108 HG21 VAL 108 15.718 5.614 4.129 757 HG22 VAL 108 HG22 VAL 108 15.869 6.940 5.283 758 HG23 VAL 108 HG23 VAL 108 15.309 7.258 3.641 759 H ASP 109 H ASP 109 13.279 5.490 1.274 760 HA ASP 109 HA ASP 109 14.381 2.811 1.361 761 HB2 ASP 109 HB2 ASP 109 13.140 4.523 -0.669 762 HB3 ASP 109 HB3 ASP 109 14.509 3.593 -1.271 763 H ASN 110 H ASN 110 16.425 2.233 0.791 764 HA ASN 110 HA ASN 110 18.408 4.127 1.486 765 HB2 ASN 110 HB2 ASN 110 20.020 2.358 1.186 766 HB3 ASN 110 HB3 ASN 110 18.598 1.695 1.978 767 HD21 ASN 110 HD22 ASN 110 17.310 0.223 0.883 768 HD22 ASN 110 HD21 ASN 110 17.818 -0.536 -0.585 769 H ALA 111 H ALA 111 17.271 2.894 -1.603 770 HA ALA 111 HA ALA 111 19.494 3.578 -3.170 771 HB1 ALA 111 HB1 ALA 111 16.599 3.450 -4.006 772 HB2 ALA 111 HB2 ALA 111 17.722 2.091 -3.946 773 HB3 ALA 111 HB3 ALA 111 17.995 3.411 -5.083 774 H PHE 112 H PHE 112 16.545 5.452 -2.490 775 HA PHE 112 HA PHE 112 17.266 7.647 -4.131 776 HB2 PHE 112 HB2 PHE 112 14.938 7.210 -3.397 777 HB3 PHE 112 HB3 PHE 112 15.399 7.603 -1.745 778 HD1 PHE 112 HD2 PHE 112 15.072 8.991 -5.152 779 HD2 PHE 112 HD1 PHE 112 15.445 9.835 -0.999 780 HE1 PHE 112 HE2 PHE 112 14.568 11.357 -5.593 781 HE2 PHE 112 HE1 PHE 112 14.937 12.203 -1.430 782 HZ PHE 112 HZ PHE 112 14.500 12.967 -3.730 783 H THR 113 H THR 113 17.591 7.045 -0.649 784 HA THR 113 HA THR 113 18.800 9.534 -0.065 785 HB THR 113 HB THR 113 19.523 8.446 2.056 786 HG1 THR 113 HG1 THR 113 19.529 6.259 0.752 787 HG21 THR 113 HG21 THR 113 17.255 7.974 2.888 788 HG22 THR 113 HG22 THR 113 16.670 7.902 1.227 789 HG23 THR 113 HG23 THR 113 17.292 9.417 1.879 790 H ASN 114 H ASN 114 19.963 6.586 -1.399 791 HA ASN 114 HA ASN 114 22.748 6.965 -0.928 792 HB2 ASN 114 HB2 ASN 114 21.805 4.760 -1.427 793 HB3 ASN 114 HB3 ASN 114 21.276 5.327 -3.005 794 HD21 ASN 114 HD22 ASN 114 22.416 3.856 -4.148 795 HD22 ASN 114 HD21 ASN 114 24.140 3.865 -4.259 796 H GLU 115 H GLU 115 20.664 7.435 -3.787 797 HA GLU 115 HA GLU 115 22.558 8.486 -5.505 798 HB2 GLU 115 HB2 GLU 115 19.594 9.029 -5.293 799 HB3 GLU 115 HB3 GLU 115 20.594 9.441 -6.664 800 HG2 GLU 115 HG2 GLU 115 21.103 7.088 -7.022 801 HG3 GLU 115 HG3 GLU 115 20.088 6.673 -5.642 802 H VAL 116 H VAL 116 20.263 10.166 -3.368 803 HA VAL 116 HA VAL 116 21.058 12.777 -3.942 804 HB VAL 116 HB VAL 116 19.975 11.687 -1.337 805 HG11 VAL 116 HG11 VAL 116 21.034 13.852 -0.987 806 HG12 VAL 116 HG12 VAL 116 19.279 13.998 -0.876 807 HG13 VAL 116 HG13 VAL 116 20.119 14.531 -2.332 808 HG21 VAL 116 HG21 VAL 116 17.819 12.490 -2.162 809 HG22 VAL 116 HG22 VAL 116 18.512 11.291 -3.255 810 HG23 VAL 116 HG23 VAL 116 18.582 13.005 -3.666 811 H MET 117 H MET 117 22.195 10.660 -1.275 812 HA MET 117 HA MET 117 23.950 12.461 -0.106 813 HB2 MET 117 HB2 MET 117 23.130 10.339 0.867 814 HB3 MET 117 HB3 MET 117 24.146 9.455 -0.263 815 HG2 MET 117 HG2 MET 117 25.527 9.443 1.473 816 HG3 MET 117 HG3 MET 117 25.987 11.009 0.820 817 HE1 MET 117 HE1 MET 117 23.401 12.819 1.697 818 HE2 MET 117 HE2 MET 117 25.088 13.327 1.775 819 HE3 MET 117 HE3 MET 117 24.055 13.480 3.196 820 H GLN 118 H GLN 118 24.570 9.952 -2.537 821 HA GLN 118 HA GLN 118 27.329 10.321 -2.768 822 HB2 GLN 118 HB2 GLN 118 26.112 8.394 -3.693 823 HB3 GLN 118 HB3 GLN 118 25.355 9.443 -4.883 824 HG2 GLN 118 HG2 GLN 118 27.573 9.939 -5.821 825 HG3 GLN 118 HG3 GLN 118 28.288 8.817 -4.663 826 HE21 GLN 118 HE22 GLN 118 29.078 7.456 -6.241 827 HE22 GLN 118 HE21 GLN 118 28.054 6.455 -7.207 828 H LEU 119 H LEU 119 24.681 11.744 -4.659 829 HA LEU 119 HA LEU 119 26.400 13.191 -6.383 830 HB2 LEU 119 HB2 LEU 119 23.459 13.321 -5.813 831 HB3 LEU 119 HB3 LEU 119 24.228 14.449 -6.915 832 HG LEU 119 HG LEU 119 24.594 11.502 -7.322 833 HD11 LEU 119 HD11 LEU 119 22.173 11.849 -7.088 834 HD12 LEU 119 HD12 LEU 119 22.622 11.465 -8.751 835 HD13 LEU 119 HD13 LEU 119 22.247 13.128 -8.301 836 HD21 LEU 119 HD21 LEU 119 24.824 12.190 -9.645 837 HD22 LEU 119 HD22 LEU 119 25.942 13.083 -8.615 838 HD23 LEU 119 HD23 LEU 119 24.470 13.858 -9.199 839 H VAL 120 H VAL 120 24.566 14.155 -3.474 840 HA VAL 120 HA VAL 120 25.112 16.888 -3.553 841 HB VAL 120 HB VAL 120 24.789 15.071 -1.159 842 HG11 VAL 120 HG11 VAL 120 24.887 18.089 -1.193 843 HG12 VAL 120 HG12 VAL 120 26.107 17.026 -0.494 844 HG13 VAL 120 HG13 VAL 120 24.488 17.084 0.200 845 HG21 VAL 120 HG21 VAL 120 22.943 17.066 -2.463 846 HG22 VAL 120 HG22 VAL 120 22.578 16.131 -1.013 847 HG23 VAL 120 HG23 VAL 120 22.812 15.310 -2.558 848 H LYS 121 H LYS 121 27.005 14.304 -2.032 849 HA LYS 121 HA LYS 121 29.053 15.949 -1.026 850 HB2 LYS 121 HB2 LYS 121 29.133 13.031 -1.816 851 HB3 LYS 121 HB3 LYS 121 30.343 13.848 -0.833 852 HG2 LYS 121 HG2 LYS 121 28.831 14.168 0.941 853 HG3 LYS 121 HG3 LYS 121 27.447 13.720 -0.057 854 HD2 LYS 121 HD2 LYS 121 27.943 11.885 1.388 855 HD3 LYS 121 HD3 LYS 121 28.424 11.435 -0.247 856 HE2 LYS 121 HE2 LYS 121 30.749 11.961 0.272 857 HE3 LYS 121 HE3 LYS 121 30.283 12.471 1.894 858 HZ1 LYS 121 HZ1 LYS 121 30.043 9.728 0.787 859 HZ2 LYS 121 HZ2 LYS 121 29.530 10.200 2.325 860 HZ3 LYS 121 HZ3 LYS 121 31.171 10.247 1.935 861 H MET 122 H MET 122 28.759 14.149 -4.054 862 HA MET 122 HA MET 122 31.372 14.706 -4.985 863 HB2 MET 122 HB2 MET 122 30.111 12.818 -5.832 864 HB3 MET 122 HB3 MET 122 28.862 13.885 -6.452 865 HG2 MET 122 HG2 MET 122 30.394 14.788 -8.084 866 HG3 MET 122 HG3 MET 122 31.706 13.814 -7.422 867 HE1 MET 122 HE1 MET 122 28.206 13.732 -9.178 868 HE2 MET 122 HE2 MET 122 27.949 12.577 -7.868 869 HE3 MET 122 HE3 MET 122 28.009 12.018 -9.538 870 H LEU 123 H LEU 123 28.288 16.340 -5.387 871 HA LEU 123 HA LEU 123 29.401 18.227 -7.286 872 HB2 LEU 123 HB2 LEU 123 26.684 18.160 -5.962 873 HB3 LEU 123 HB3 LEU 123 27.153 19.213 -7.283 874 HG LEU 123 HG LEU 123 27.066 16.200 -7.467 875 HD11 LEU 123 HD11 LEU 123 25.028 16.526 -8.778 876 HD12 LEU 123 HD12 LEU 123 25.082 18.254 -8.431 877 HD13 LEU 123 HD13 LEU 123 24.833 17.099 -7.122 878 HD21 LEU 123 HD21 LEU 123 27.383 18.337 -9.571 879 HD22 LEU 123 HD22 LEU 123 27.197 16.612 -9.885 880 HD23 LEU 123 HD23 LEU 123 28.625 17.205 -9.034 881 H SER 124 H SER 124 29.772 17.912 -4.079 882 HA SER 124 HA SER 124 29.672 20.821 -3.602 883 HB2 SER 124 HB2 SER 124 28.141 19.630 -2.124 884 HB3 SER 124 HB3 SER 124 29.449 18.576 -1.584 885 HG SER 124 HG SER 124 30.343 20.975 -1.184 886 H ALA 125 H ALA 125 31.651 17.965 -3.464 887 HA ALA 125 HA ALA 125 33.754 19.307 -2.012 888 HB1 ALA 125 HB1 ALA 125 34.956 17.224 -2.155 889 HB2 ALA 125 HB2 ALA 125 33.753 16.573 -3.268 890 HB3 ALA 125 HB3 ALA 125 33.309 16.937 -1.600 891 H ASP 126 H ASP 126 34.430 20.902 -3.262 892 HA ASP 126 HA ASP 126 36.072 20.181 -5.536 893 HB2 ASP 126 HB2 ASP 126 33.877 20.939 -6.430 894 HB3 ASP 126 HB3 ASP 126 34.119 22.485 -5.627 895 H SER 127 H SER 127 37.905 20.640 -4.616 896 HA SER 127 HA SER 127 39.730 21.818 -4.037 897 HB2 SER 127 HB2 SER 127 37.898 24.080 -4.714 898 HB3 SER 127 HB3 SER 127 39.571 24.336 -4.228 899 HG SER 127 HG SER 127 38.943 22.536 -6.300 900 H ALA 128 H ALA 128 37.089 21.540 -2.196 901 HA ALA 128 HA ALA 128 37.927 23.283 -0.045 902 HB1 ALA 128 HB1 ALA 128 35.529 22.860 -0.418 903 HB2 ALA 128 HB2 ALA 128 36.045 22.373 1.198 904 HB3 ALA 128 HB3 ALA 128 35.786 21.155 -0.051 905 H ASN 129 H ASN 129 40.092 22.311 -0.043 906 HA ASN 129 HA ASN 129 40.202 19.978 1.717 907 HB2 ASN 129 HB2 ASN 129 40.464 19.388 -0.790 908 HB3 ASN 129 HB3 ASN 129 42.032 20.170 -0.664 909 HD21 ASN 129 HD22 ASN 129 43.681 19.158 0.431 910 HD22 ASN 129 HD21 ASN 129 43.565 17.521 0.983 911 H GLU 130 H GLU 130 42.087 22.435 0.026 912 HA GLU 130 HA GLU 130 43.566 22.944 2.521 913 HB2 GLU 130 HB2 GLU 130 44.311 23.352 -0.365 914 HB3 GLU 130 HB3 GLU 130 45.078 24.299 0.894 915 HG2 GLU 130 HG2 GLU 130 46.483 22.456 0.342 916 HG3 GLU 130 HG3 GLU 130 45.832 22.209 1.960 917 H VAL 131 H VAL 131 43.139 24.817 3.537 918 HA VAL 131 HA VAL 131 42.586 27.248 2.212 919 HB VAL 131 HB VAL 131 40.404 26.043 1.872 920 HG11 VAL 131 HG11 VAL 131 40.302 24.824 3.953 921 HG12 VAL 131 HG12 VAL 131 38.872 25.840 3.767 922 HG13 VAL 131 HG13 VAL 131 40.169 26.331 4.856 923 HG21 VAL 131 HG21 VAL 131 40.310 28.571 3.509 924 HG22 VAL 131 HG22 VAL 131 38.986 27.940 2.530 925 HG23 VAL 131 HG23 VAL 131 40.486 28.456 1.758 926 H SER 132 H SER 132 42.146 29.012 3.773 927 HA SER 132 HA SER 132 43.748 28.730 6.088 928 HB2 SER 132 HB2 SER 132 42.649 31.112 6.497 929 HB3 SER 132 HB3 SER 132 43.859 30.863 5.238 930 HG SER 132 HG SER 132 41.136 31.365 5.021 931 H THR 133 H THR 133 40.441 28.099 5.562 932 HA THR 133 HA THR 133 39.883 28.234 8.434 933 HB THR 133 HB THR 133 37.857 27.780 6.298 934 HG1 THR 133 HG1 THR 133 38.644 30.271 7.432 935 HG21 THR 133 HG21 THR 133 37.177 27.249 8.593 936 HG22 THR 133 HG22 THR 133 36.298 28.644 7.971 937 HG23 THR 133 HG23 THR 133 37.635 28.877 9.096 Start of MODEL 2 1 HA2 GLY 1 HA2 GLY 1 3.045 -1.068 -0.572 2 HA3 GLY 1 HA3 GLY 1 2.944 -1.842 1.004 3 H SER 2 H SER 2 5.252 -2.242 0.559 4 HA SER 2 HA SER 2 6.995 -3.574 0.039 5 HB2 SER 2 HB2 SER 2 4.841 -5.660 -0.381 6 HB3 SER 2 HB3 SER 2 6.565 -5.989 -0.196 7 HG SER 2 HG SER 2 4.676 -5.449 1.697 8 H GLY 3 H GLY 3 7.393 -2.236 -1.802 9 HA2 GLY 3 HA2 GLY 3 7.397 -3.781 -4.263 10 HA3 GLY 3 HA3 GLY 3 6.480 -2.283 -4.313 11 H ASN 4 H ASN 4 8.228 -2.041 -6.082 12 HA ASN 4 HA ASN 4 10.467 -0.571 -4.884 13 HB2 ASN 4 HB2 ASN 4 12.032 -1.507 -6.535 14 HB3 ASN 4 HB3 ASN 4 11.358 -2.763 -5.507 15 HD21 ASN 4 HD22 ASN 4 11.769 -4.394 -6.968 16 HD22 ASN 4 HD21 ASN 4 10.895 -4.565 -8.453 17 H SER 5 H SER 5 7.832 -0.333 -6.695 18 HA SER 5 HA SER 5 9.033 1.501 -8.666 19 HB2 SER 5 HB2 SER 5 6.377 0.058 -8.872 20 HB3 SER 5 HB3 SER 5 7.164 1.015 -10.127 21 HG SER 5 HG SER 5 8.740 -1.003 -9.120 22 H GLN 6 H GLN 6 7.973 3.444 -9.096 23 HA GLN 6 HA GLN 6 6.834 5.353 -8.666 24 HB2 GLN 6 HB2 GLN 6 5.106 3.580 -6.938 25 HB3 GLN 6 HB3 GLN 6 4.785 5.282 -7.226 26 HG2 GLN 6 HG2 GLN 6 4.913 3.157 -9.353 27 HG3 GLN 6 HG3 GLN 6 3.435 3.800 -8.641 28 HE21 GLN 6 HE22 GLN 6 6.074 4.393 -10.800 29 HE22 GLN 6 HE21 GLN 6 5.437 5.832 -11.516 30 HA PRO 7 HA PRO 7 9.390 6.085 -4.977 31 HB2 PRO 7 HB2 PRO 7 9.892 8.664 -6.240 32 HB3 PRO 7 HB3 PRO 7 11.038 7.394 -5.806 33 HG2 PRO 7 HG2 PRO 7 10.403 8.010 -8.369 34 HG3 PRO 7 HG3 PRO 7 10.889 6.385 -7.854 35 HD2 PRO 7 HD2 PRO 7 8.157 7.454 -8.442 36 HD3 PRO 7 HD3 PRO 7 8.843 5.851 -8.793 37 H ILE 8 H ILE 8 9.634 8.415 -3.849 38 HA ILE 8 HA ILE 8 7.064 8.899 -2.705 39 HB ILE 8 HB ILE 8 9.131 8.872 -1.375 40 HG12 ILE 8 HG12 ILE 8 7.932 11.641 -1.261 41 HG13 ILE 8 HG13 ILE 8 7.094 10.208 -0.667 42 HG21 ILE 8 HG21 ILE 8 9.819 11.379 -2.901 43 HG22 ILE 8 HG22 ILE 8 10.682 9.839 -2.931 44 HG23 ILE 8 HG23 ILE 8 10.665 10.813 -1.459 45 HD11 ILE 8 HD11 ILE 8 8.310 11.577 1.048 46 HD12 ILE 8 HD12 ILE 8 9.811 11.028 0.301 47 HD13 ILE 8 HD13 ILE 8 8.703 9.858 1.016 48 H TRP 9 H TRP 9 8.496 10.090 -5.451 49 HA TRP 9 HA TRP 9 7.586 12.830 -5.240 50 HB2 TRP 9 HB2 TRP 9 8.781 11.308 -7.563 51 HB3 TRP 9 HB3 TRP 9 8.438 13.029 -7.552 52 HD1 TRP 9 HD1 TRP 9 10.974 10.477 -6.399 53 HE1 TRP 9 HE1 TRP 9 13.026 11.692 -5.440 54 HE3 TRP 9 HE3 TRP 9 9.104 15.232 -6.255 55 HZ2 TRP 9 HZ2 TRP 9 13.755 14.327 -4.710 56 HZ3 TRP 9 HZ3 TRP 9 10.539 17.042 -5.409 57 HH2 TRP 9 HH2 TRP 9 12.817 16.599 -4.648 58 H THR 10 H THR 10 5.820 10.241 -5.440 59 HA THR 10 HA THR 10 4.353 10.690 -7.881 60 HB THR 10 HB THR 10 2.827 8.892 -6.827 61 HG1 THR 10 HG1 THR 10 4.980 8.069 -5.289 62 HG21 THR 10 HG21 THR 10 5.716 8.245 -7.431 63 HG22 THR 10 HG22 THR 10 4.454 8.493 -8.636 64 HG23 THR 10 HG23 THR 10 4.356 7.129 -7.525 65 H ASN 11 H ASN 11 4.215 11.897 -4.705 66 HA ASN 11 HA ASN 11 1.657 13.169 -5.334 67 HB2 ASN 11 HB2 ASN 11 1.111 11.376 -3.772 68 HB3 ASN 11 HB3 ASN 11 2.360 11.926 -2.661 69 HD21 ASN 11 HD22 ASN 11 0.804 12.165 -1.012 70 HD22 ASN 11 HD21 ASN 11 -0.310 13.489 -1.005 71 HA PRO 12 HA PRO 12 4.158 16.805 -4.804 72 HB2 PRO 12 HB2 PRO 12 1.402 17.822 -4.222 73 HB3 PRO 12 HB3 PRO 12 2.668 18.530 -5.234 74 HG2 PRO 12 HG2 PRO 12 0.635 17.215 -6.337 75 HG3 PRO 12 HG3 PRO 12 2.278 17.061 -6.983 76 HD2 PRO 12 HD2 PRO 12 0.676 15.119 -5.406 77 HD3 PRO 12 HD3 PRO 12 1.944 14.827 -6.611 78 H ASN 13 H ASN 13 1.466 16.207 -2.539 79 HA ASN 13 HA ASN 13 2.557 17.837 -0.491 80 HB2 ASN 13 HB2 ASN 13 0.131 17.151 -0.713 81 HB3 ASN 13 HB3 ASN 13 0.602 15.567 -0.101 82 HD21 ASN 13 HD22 ASN 13 1.072 15.321 2.066 83 HD22 ASN 13 HD21 ASN 13 0.785 16.565 3.230 84 H ALA 14 H ALA 14 2.854 14.447 -1.292 85 HA ALA 14 HA ALA 14 4.066 13.621 1.151 86 HB1 ALA 14 HB1 ALA 14 4.201 12.362 -1.587 87 HB2 ALA 14 HB2 ALA 14 2.973 12.042 -0.362 88 HB3 ALA 14 HB3 ALA 14 4.652 11.589 -0.068 89 H ALA 15 H ALA 15 5.335 14.442 -2.056 90 HA ALA 15 HA ALA 15 8.055 14.030 -1.435 91 HB1 ALA 15 HB1 ALA 15 7.148 14.112 -3.729 92 HB2 ALA 15 HB2 ALA 15 8.534 15.181 -3.504 93 HB3 ALA 15 HB3 ALA 15 6.900 15.850 -3.546 94 H MET 16 H MET 16 6.046 16.958 -1.440 95 HA MET 16 HA MET 16 8.098 18.758 -0.787 96 HB2 MET 16 HB2 MET 16 5.238 18.804 -1.058 97 HB3 MET 16 HB3 MET 16 5.711 19.724 0.365 98 HG2 MET 16 HG2 MET 16 6.799 20.144 -2.409 99 HG3 MET 16 HG3 MET 16 5.482 21.064 -1.695 100 HE1 MET 16 HE1 MET 16 9.936 21.733 -1.167 101 HE2 MET 16 HE2 MET 16 9.062 21.032 -2.528 102 HE3 MET 16 HE3 MET 16 9.338 20.080 -1.074 103 H THR 17 H THR 17 6.093 16.686 1.205 104 HA THR 17 HA THR 17 6.589 17.832 3.696 105 HB THR 17 HB THR 17 5.983 14.980 2.922 106 HG1 THR 17 HG1 THR 17 4.227 16.286 2.616 107 HG21 THR 17 HG21 THR 17 6.055 16.161 5.708 108 HG22 THR 17 HG22 THR 17 7.192 14.974 5.069 109 HG23 THR 17 HG23 THR 17 5.494 14.545 5.279 110 H MET 18 H MET 18 8.410 15.257 1.998 111 HA MET 18 HA MET 18 10.253 14.966 4.152 112 HB2 MET 18 HB2 MET 18 11.577 13.573 2.595 113 HB3 MET 18 HB3 MET 18 9.895 13.088 2.700 114 HG2 MET 18 HG2 MET 18 10.330 12.921 0.453 115 HG3 MET 18 HG3 MET 18 9.583 14.512 0.574 116 HE1 MET 18 HE1 MET 18 12.259 14.776 -2.319 117 HE2 MET 18 HE2 MET 18 10.564 15.030 -1.907 118 HE3 MET 18 HE3 MET 18 11.240 13.401 -1.883 119 H THR 19 H THR 19 10.138 16.958 1.305 120 HA THR 19 HA THR 19 12.815 17.863 1.347 121 HB THR 19 HB THR 19 10.339 19.311 0.397 122 HG1 THR 19 HG1 THR 19 11.642 17.115 -0.552 123 HG21 THR 19 HG21 THR 19 12.265 20.785 0.598 124 HG22 THR 19 HG22 THR 19 11.877 20.498 -1.098 125 HG23 THR 19 HG23 THR 19 13.241 19.660 -0.352 126 H ASN 20 H ASN 20 9.818 19.205 2.716 127 HA ASN 20 HA ASN 20 11.057 21.487 3.852 128 HB2 ASN 20 HB2 ASN 20 8.392 20.160 4.312 129 HB3 ASN 20 HB3 ASN 20 8.870 21.642 5.130 130 HD21 ASN 20 HD22 ASN 20 6.794 20.930 3.077 131 HD22 ASN 20 HD21 ASN 20 6.987 22.117 1.838 132 H ASN 21 H ASN 21 10.295 18.269 5.108 133 HA ASN 21 HA ASN 21 10.871 18.868 7.811 134 HB2 ASN 21 HB2 ASN 21 10.761 16.296 6.260 135 HB3 ASN 21 HB3 ASN 21 11.274 16.319 7.939 136 HD21 ASN 21 HD22 ASN 21 8.978 15.018 6.827 137 HD22 ASN 21 HD21 ASN 21 7.586 15.699 7.591 138 H LEU 22 H LEU 22 12.877 18.122 5.073 139 HA LEU 22 HA LEU 22 15.273 17.624 6.523 140 HB2 LEU 22 HB2 LEU 22 15.115 16.956 4.208 141 HB3 LEU 22 HB3 LEU 22 14.784 18.605 3.707 142 HG LEU 22 HG LEU 22 17.073 19.251 4.386 143 HD11 LEU 22 HD11 LEU 22 18.720 17.528 4.892 144 HD12 LEU 22 HD12 LEU 22 17.454 16.300 4.869 145 HD13 LEU 22 HD13 LEU 22 17.438 17.560 6.104 146 HD21 LEU 22 HD21 LEU 22 18.221 18.176 2.536 147 HD22 LEU 22 HD22 LEU 22 16.574 18.608 2.075 148 HD23 LEU 22 HD23 LEU 22 16.972 16.935 2.463 149 H VAL 23 H VAL 23 13.840 20.487 5.037 150 HA VAL 23 HA VAL 23 15.908 22.293 5.655 151 HB VAL 23 HB VAL 23 12.965 22.881 5.281 152 HG11 VAL 23 HG11 VAL 23 13.680 25.138 4.700 153 HG12 VAL 23 HG12 VAL 23 15.358 24.705 5.028 154 HG13 VAL 23 HG13 VAL 23 14.180 24.731 6.341 155 HG21 VAL 23 HG21 VAL 23 15.227 22.871 3.289 156 HG22 VAL 23 HG22 VAL 23 13.565 23.366 2.962 157 HG23 VAL 23 HG23 VAL 23 13.920 21.689 3.381 158 H GLN 24 H GLN 24 12.872 21.538 7.376 159 HA GLN 24 HA GLN 24 13.200 23.434 9.417 160 HB2 GLN 24 HB2 GLN 24 11.496 22.221 10.639 161 HB3 GLN 24 HB3 GLN 24 11.062 22.287 8.941 162 HG2 GLN 24 HG2 GLN 24 10.548 20.128 9.405 163 HG3 GLN 24 HG3 GLN 24 12.218 19.938 8.878 164 HE21 GLN 24 HE22 GLN 24 12.553 18.062 10.012 165 HE22 GLN 24 HE21 GLN 24 12.647 18.003 11.739 166 H CYS 25 H CYS 25 14.546 20.261 8.989 167 HA CYS 25 HA CYS 25 15.479 19.971 11.683 168 HB2 CYS 25 HB2 CYS 25 15.010 18.038 10.185 169 HB3 CYS 25 HB3 CYS 25 16.366 18.524 9.174 170 H ALA 26 H ALA 26 17.010 20.782 8.569 171 HA ALA 26 HA ALA 26 19.604 21.132 9.629 172 HB1 ALA 26 HB1 ALA 26 19.165 20.707 7.259 173 HB2 ALA 26 HB2 ALA 26 20.143 22.155 7.493 174 HB3 ALA 26 HB3 ALA 26 18.426 22.302 7.114 175 H SER 27 H SER 27 16.863 23.287 9.314 176 HA SER 27 HA SER 27 18.301 25.703 9.777 177 HB2 SER 27 HB2 SER 27 16.041 25.570 8.688 178 HB3 SER 27 HB3 SER 27 15.364 25.160 10.264 179 HG SER 27 HG SER 27 16.912 27.379 10.418 180 H ARG 28 H ARG 28 17.368 23.142 11.794 181 HA ARG 28 HA ARG 28 17.580 24.849 14.180 182 HB2 ARG 28 HB2 ARG 28 16.172 22.226 13.797 183 HB3 ARG 28 HB3 ARG 28 16.382 23.014 15.357 184 HG2 ARG 28 HG2 ARG 28 15.188 25.003 14.366 185 HG3 ARG 28 HG3 ARG 28 14.786 23.958 12.997 186 HD2 ARG 28 HD2 ARG 28 13.960 22.337 14.814 187 HD3 ARG 28 HD3 ARG 28 13.929 23.753 15.853 188 HE ARG 28 HE ARG 28 12.197 23.223 13.559 189 HH11 ARG 28 HH11 ARG 28 13.204 25.448 16.063 190 HH12 ARG 28 HH12 ARG 28 11.770 26.414 15.955 191 HH21 ARG 28 HH21 ARG 28 10.310 24.493 13.412 192 HH22 ARG 28 HH22 ARG 28 10.122 25.871 14.449 193 H SER 29 H SER 29 19.549 23.199 12.386 194 HA SER 29 HA SER 29 20.541 21.119 14.041 195 HB2 SER 29 HB2 SER 29 22.435 21.056 12.450 196 HB3 SER 29 HB3 SER 29 20.878 21.080 11.621 197 HG SER 29 HG SER 29 21.257 23.074 10.904 198 H GLY 30 H GLY 30 21.728 24.394 13.326 199 HA2 GLY 30 HA2 GLY 30 22.963 25.782 14.757 200 HA3 GLY 30 HA3 GLY 30 23.155 24.430 15.867 201 H VAL 31 H VAL 31 23.765 23.323 12.848 202 HA VAL 31 HA VAL 31 26.662 23.500 13.239 203 HB VAL 31 HB VAL 31 25.112 21.762 11.308 204 HG11 VAL 31 HG11 VAL 31 27.406 22.098 10.634 205 HG12 VAL 31 HG12 VAL 31 27.203 20.453 11.238 206 HG13 VAL 31 HG13 VAL 31 27.976 21.675 12.248 207 HG21 VAL 31 HG21 VAL 31 24.506 21.217 13.612 208 HG22 VAL 31 HG22 VAL 31 26.214 21.047 14.026 209 HG23 VAL 31 HG23 VAL 31 25.467 19.929 12.883 210 H LEU 32 H LEU 32 24.108 24.153 10.929 211 HA LEU 32 HA LEU 32 25.920 25.305 8.989 212 HB2 LEU 32 HB2 LEU 32 22.912 25.084 9.107 213 HB3 LEU 32 HB3 LEU 32 23.750 25.918 7.819 214 HG LEU 32 HG LEU 32 24.911 23.735 7.292 215 HD11 LEU 32 HD11 LEU 32 22.808 22.618 9.141 216 HD12 LEU 32 HD12 LEU 32 24.548 22.609 9.428 217 HD13 LEU 32 HD13 LEU 32 23.869 21.679 8.091 218 HD21 LEU 32 HD21 LEU 32 21.905 23.780 7.083 219 HD22 LEU 32 HD22 LEU 32 23.006 22.842 6.077 220 HD23 LEU 32 HD23 LEU 32 23.023 24.601 5.996 221 H THR 33 H THR 33 25.586 27.567 8.241 222 HA THR 33 HA THR 33 25.545 29.311 10.531 223 HB THR 33 HB THR 33 26.110 31.097 8.940 224 HG1 THR 33 HG1 THR 33 26.590 29.920 6.700 225 HG21 THR 33 HG21 THR 33 28.256 30.197 8.148 226 HG22 THR 33 HG22 THR 33 27.693 28.564 8.511 227 HG23 THR 33 HG23 THR 33 27.919 29.729 9.817 228 H ALA 34 H ALA 34 24.301 31.402 10.417 229 HA ALA 34 HA ALA 34 21.543 30.889 10.266 230 HB1 ALA 34 HB1 ALA 34 22.556 32.633 11.695 231 HB2 ALA 34 HB2 ALA 34 21.224 33.233 10.709 232 HB3 ALA 34 HB3 ALA 34 22.887 33.586 10.249 233 H ASP 35 H ASP 35 23.830 32.058 7.927 234 HA ASP 35 HA ASP 35 21.835 32.924 6.031 235 HB2 ASP 35 HB2 ASP 35 24.800 32.388 5.768 236 HB3 ASP 35 HB3 ASP 35 23.798 32.910 4.421 237 H GLN 36 H GLN 36 24.029 30.172 6.361 238 HA GLN 36 HA GLN 36 23.352 28.832 4.008 239 HB2 GLN 36 HB2 GLN 36 25.319 28.456 5.587 240 HB3 GLN 36 HB3 GLN 36 24.218 27.502 6.567 241 HG2 GLN 36 HG2 GLN 36 23.879 25.959 4.728 242 HG3 GLN 36 HG3 GLN 36 24.924 26.940 3.700 243 HE21 GLN 36 HE22 GLN 36 25.242 24.163 4.487 244 HE22 GLN 36 HE21 GLN 36 26.782 24.061 5.272 245 H MET 37 H MET 37 21.897 28.708 7.217 246 HA MET 37 HA MET 37 20.192 26.496 6.672 247 HB2 MET 37 HB2 MET 37 20.026 28.683 8.749 248 HB3 MET 37 HB3 MET 37 18.920 27.317 8.684 249 HG2 MET 37 HG2 MET 37 20.838 25.791 8.956 250 HG3 MET 37 HG3 MET 37 21.898 27.190 9.097 251 HE1 MET 37 HE1 MET 37 21.786 28.934 11.102 252 HE2 MET 37 HE2 MET 37 20.635 28.823 12.435 253 HE3 MET 37 HE3 MET 37 20.069 29.200 10.809 254 H ASP 38 H ASP 38 19.975 29.909 6.024 255 HA ASP 38 HA ASP 38 17.137 29.824 5.472 256 HB2 ASP 38 HB2 ASP 38 18.241 31.870 6.359 257 HB3 ASP 38 HB3 ASP 38 19.134 32.011 4.848 258 H ASP 39 H ASP 39 20.167 29.737 3.700 259 HA ASP 39 HA ASP 39 19.170 29.872 1.088 260 HB2 ASP 39 HB2 ASP 39 21.536 28.351 2.196 261 HB3 ASP 39 HB3 ASP 39 21.189 28.482 0.476 262 H MET 40 H MET 40 19.311 27.238 3.383 263 HA MET 40 HA MET 40 18.635 25.067 1.805 264 HB2 MET 40 HB2 MET 40 17.795 25.738 4.629 265 HB3 MET 40 HB3 MET 40 17.527 24.173 3.881 266 HG2 MET 40 HG2 MET 40 20.247 25.407 4.187 267 HG3 MET 40 HG3 MET 40 19.521 24.340 5.387 268 HE1 MET 40 HE1 MET 40 19.261 20.952 3.517 269 HE2 MET 40 HE2 MET 40 17.991 22.169 3.619 270 HE3 MET 40 HE3 MET 40 18.999 21.827 5.024 271 H GLY 41 H GLY 41 16.514 27.489 3.285 272 HA2 GLY 41 HA2 GLY 41 14.095 26.230 2.462 273 HA3 GLY 41 HA3 GLY 41 14.255 27.873 3.058 274 H MET 42 H MET 42 16.266 28.478 0.936 275 HA MET 42 HA MET 42 14.409 29.477 -0.963 276 HB2 MET 42 HB2 MET 42 17.424 29.432 -0.978 277 HB3 MET 42 HB3 MET 42 16.459 30.213 -2.223 278 HG2 MET 42 HG2 MET 42 15.382 31.499 -0.275 279 HG3 MET 42 HG3 MET 42 16.778 30.958 0.655 280 HE1 MET 42 HE1 MET 42 18.978 30.955 -1.793 281 HE2 MET 42 HE2 MET 42 19.317 31.462 -0.140 282 HE3 MET 42 HE3 MET 42 19.720 32.525 -1.485 283 H MET 43 H MET 43 16.672 26.737 -0.990 284 HA MET 43 HA MET 43 16.107 26.208 -3.756 285 HB2 MET 43 HB2 MET 43 17.488 24.229 -3.486 286 HB3 MET 43 HB3 MET 43 18.298 25.645 -2.856 287 HG2 MET 43 HG2 MET 43 18.779 23.990 -1.324 288 HG3 MET 43 HG3 MET 43 17.453 24.874 -0.572 289 HE1 MET 43 HE1 MET 43 16.831 23.046 1.097 290 HE2 MET 43 HE2 MET 43 18.226 22.111 0.558 291 HE3 MET 43 HE3 MET 43 16.648 21.333 0.704 292 H ALA 44 H ALA 44 14.925 25.146 -0.659 293 HA ALA 44 HA ALA 44 13.390 22.951 -1.468 294 HB1 ALA 44 HB1 ALA 44 12.772 24.953 0.703 295 HB2 ALA 44 HB2 ALA 44 13.776 23.513 0.880 296 HB3 ALA 44 HB3 ALA 44 12.053 23.351 0.536 297 H ASP 45 H ASP 45 12.755 26.405 -1.562 298 HA ASP 45 HA ASP 45 10.088 26.359 -2.423 299 HB2 ASP 45 HB2 ASP 45 11.175 28.422 -1.697 300 HB3 ASP 45 HB3 ASP 45 12.289 28.339 -3.056 301 H SER 46 H SER 46 13.132 26.151 -4.183 302 HA SER 46 HA SER 46 11.963 26.176 -6.771 303 HB2 SER 46 HB2 SER 46 14.334 26.798 -6.272 304 HB3 SER 46 HB3 SER 46 14.672 25.098 -5.953 305 HG SER 46 HG SER 46 15.140 25.172 -8.021 306 H VAL 47 H VAL 47 12.680 23.682 -4.433 307 HA VAL 47 HA VAL 47 12.632 21.432 -6.085 308 HB VAL 47 HB VAL 47 11.730 21.650 -3.204 309 HG11 VAL 47 HG11 VAL 47 12.458 19.207 -4.819 310 HG12 VAL 47 HG12 VAL 47 10.838 19.638 -4.272 311 HG13 VAL 47 HG13 VAL 47 12.089 19.232 -3.095 312 HG21 VAL 47 HG21 VAL 47 14.057 22.322 -3.562 313 HG22 VAL 47 HG22 VAL 47 14.370 20.796 -4.391 314 HG23 VAL 47 HG23 VAL 47 13.956 20.799 -2.675 315 H ASN 48 H ASN 48 9.911 22.959 -4.312 316 HA ASN 48 HA ASN 48 8.056 21.029 -5.235 317 HB2 ASN 48 HB2 ASN 48 6.310 22.586 -4.396 318 HB3 ASN 48 HB3 ASN 48 7.531 22.180 -3.206 319 HD21 ASN 48 HD22 ASN 48 8.780 23.762 -2.358 320 HD22 ASN 48 HD21 ASN 48 8.573 25.436 -2.715 321 H SER 49 H SER 49 9.044 24.184 -6.476 322 HA SER 49 HA SER 49 7.063 24.513 -8.390 323 HB2 SER 49 HB2 SER 49 9.972 25.310 -8.588 324 HB3 SER 49 HB3 SER 49 8.608 26.055 -9.399 325 HG SER 49 HG SER 49 7.896 26.199 -6.969 326 H GLN 50 H GLN 50 10.207 22.880 -8.566 327 HA GLN 50 HA GLN 50 9.905 22.038 -11.267 328 HB2 GLN 50 HB2 GLN 50 11.687 21.037 -9.042 329 HB3 GLN 50 HB3 GLN 50 11.807 20.506 -10.713 330 HG2 GLN 50 HG2 GLN 50 12.469 22.665 -11.440 331 HG3 GLN 50 HG3 GLN 50 12.086 23.377 -9.871 332 HE21 GLN 50 HE22 GLN 50 13.474 23.089 -8.160 333 HE22 GLN 50 HE21 GLN 50 15.092 22.497 -8.345 334 H MET 51 H MET 51 9.088 20.659 -8.161 335 HA MET 51 HA MET 51 8.626 18.020 -9.078 336 HB2 MET 51 HB2 MET 51 9.104 18.428 -6.755 337 HB3 MET 51 HB3 MET 51 7.702 19.475 -6.604 338 HG2 MET 51 HG2 MET 51 7.025 16.807 -7.536 339 HG3 MET 51 HG3 MET 51 7.813 16.814 -5.960 340 HE1 MET 51 HE1 MET 51 6.715 19.691 -4.715 341 HE2 MET 51 HE2 MET 51 7.057 18.138 -3.959 342 HE3 MET 51 HE3 MET 51 5.477 18.894 -3.739 343 H GLN 52 H GLN 52 6.502 20.824 -8.642 344 HA GLN 52 HA GLN 52 4.128 19.352 -9.199 345 HB2 GLN 52 HB2 GLN 52 4.650 22.324 -9.310 346 HB3 GLN 52 HB3 GLN 52 3.063 21.583 -9.454 347 HG2 GLN 52 HG2 GLN 52 3.404 20.588 -7.196 348 HG3 GLN 52 HG3 GLN 52 4.884 21.537 -7.062 349 HE21 GLN 52 HE22 GLN 52 4.733 23.799 -6.925 350 HE22 GLN 52 HE21 GLN 52 3.263 24.572 -6.447 351 H LYS 53 H LYS 53 6.468 21.072 -11.155 352 HA LYS 53 HA LYS 53 4.837 20.720 -13.534 353 HB2 LYS 53 HB2 LYS 53 6.537 21.979 -14.701 354 HB3 LYS 53 HB3 LYS 53 6.040 22.826 -13.250 355 HG2 LYS 53 HG2 LYS 53 8.061 22.131 -12.120 356 HG3 LYS 53 HG3 LYS 53 8.560 21.214 -13.547 357 HD2 LYS 53 HD2 LYS 53 8.711 23.208 -14.857 358 HD3 LYS 53 HD3 LYS 53 7.992 24.169 -13.566 359 HE2 LYS 53 HE2 LYS 53 9.940 23.758 -12.160 360 HE3 LYS 53 HE3 LYS 53 10.655 22.757 -13.424 361 HZ1 LYS 53 HZ1 LYS 53 10.024 25.646 -13.672 362 HZ2 LYS 53 HZ2 LYS 53 10.760 24.687 -14.853 363 HZ3 LYS 53 HZ3 LYS 53 11.564 25.005 -13.404 364 H MET 54 H MET 54 6.368 18.582 -11.853 365 HA MET 54 HA MET 54 8.164 17.350 -13.681 366 HB2 MET 54 HB2 MET 54 8.051 16.899 -11.216 367 HB3 MET 54 HB3 MET 54 6.553 16.027 -11.492 368 HG2 MET 54 HG2 MET 54 7.837 14.528 -13.045 369 HG3 MET 54 HG3 MET 54 9.304 15.312 -12.460 370 HE1 MET 54 HE1 MET 54 8.849 14.501 -8.551 371 HE2 MET 54 HE2 MET 54 8.376 15.911 -9.490 372 HE3 MET 54 HE3 MET 54 9.981 15.213 -9.688 373 H GLY 55 H GLY 55 4.736 16.897 -12.924 374 HA2 GLY 55 HA2 GLY 55 3.344 16.590 -14.999 375 HA3 GLY 55 HA3 GLY 55 4.451 15.278 -15.376 376 HA PRO 56 HA PRO 56 0.918 13.953 -12.339 377 HB2 PRO 56 HB2 PRO 56 -1.100 13.363 -14.068 378 HB3 PRO 56 HB3 PRO 56 -0.964 14.920 -13.246 379 HG2 PRO 56 HG2 PRO 56 -0.159 14.171 -16.027 380 HG3 PRO 56 HG3 PRO 56 -0.997 15.627 -15.460 381 HD2 PRO 56 HD2 PRO 56 1.643 15.615 -16.019 382 HD3 PRO 56 HD3 PRO 56 0.958 16.617 -14.722 383 H ASN 57 H ASN 57 1.213 11.858 -11.865 384 HA ASN 57 HA ASN 57 2.233 9.822 -12.005 385 HB2 ASN 57 HB2 ASN 57 0.470 9.780 -14.454 386 HB3 ASN 57 HB3 ASN 57 1.444 8.392 -13.983 387 HD21 ASN 57 HD22 ASN 57 -1.294 10.368 -13.215 388 HD22 ASN 57 HD21 ASN 57 -1.960 9.327 -12.009 389 HA PRO 58 HA PRO 58 5.272 11.789 -14.870 390 HB2 PRO 58 HB2 PRO 58 7.391 11.763 -13.181 391 HB3 PRO 58 HB3 PRO 58 6.156 13.027 -13.163 392 HG2 PRO 58 HG2 PRO 58 6.447 10.637 -11.385 393 HG3 PRO 58 HG3 PRO 58 6.018 12.304 -10.958 394 HD2 PRO 58 HD2 PRO 58 4.182 10.324 -11.210 395 HD3 PRO 58 HD3 PRO 58 3.820 12.024 -11.573 396 HA PRO 59 HA PRO 59 7.125 7.924 -16.193 397 HB2 PRO 59 HB2 PRO 59 8.626 9.025 -18.184 398 HB3 PRO 59 HB3 PRO 59 6.902 8.682 -18.354 399 HG2 PRO 59 HG2 PRO 59 8.266 11.266 -17.736 400 HG3 PRO 59 HG3 PRO 59 6.907 10.952 -18.826 401 HD2 PRO 59 HD2 PRO 59 6.564 11.981 -16.356 402 HD3 PRO 59 HD3 PRO 59 5.369 10.898 -17.104 403 H GLN 60 H GLN 60 9.232 7.000 -16.114 404 HA GLN 60 HA GLN 60 10.660 7.886 -13.887 405 HB2 GLN 60 HB2 GLN 60 12.277 6.103 -14.427 406 HB3 GLN 60 HB3 GLN 60 10.606 5.561 -14.466 407 HG2 GLN 60 HG2 GLN 60 10.645 5.786 -16.934 408 HG3 GLN 60 HG3 GLN 60 12.363 6.172 -16.827 409 HE21 GLN 60 HE22 GLN 60 9.954 3.690 -16.494 410 HE22 GLN 60 HE21 GLN 60 11.049 2.352 -16.437 411 H HIS 61 H HIS 61 11.078 8.777 -17.215 412 HA HIS 61 HA HIS 61 13.794 9.636 -16.866 413 HB2 HIS 61 HB2 HIS 61 13.711 10.528 -19.078 414 HB3 HIS 61 HB3 HIS 61 12.852 8.998 -19.104 415 HD1 HIS 61 HD1 HIS 61 10.580 9.035 -20.130 416 HD2 HIS 61 HD2 HIS 61 11.913 12.839 -19.116 417 HE1 HIS 61 HE1 HIS 61 8.894 10.627 -21.103 418 H ARG 62 H ARG 62 10.793 10.932 -15.968 419 HA ARG 62 HA ARG 62 11.774 13.677 -15.893 420 HB2 ARG 62 HB2 ARG 62 9.163 12.431 -15.021 421 HB3 ARG 62 HB3 ARG 62 9.548 14.130 -14.788 422 HG2 ARG 62 HG2 ARG 62 9.507 12.776 -17.471 423 HG3 ARG 62 HG3 ARG 62 8.134 13.639 -16.779 424 HD2 ARG 62 HD2 ARG 62 10.849 14.846 -17.284 425 HD3 ARG 62 HD3 ARG 62 9.471 14.996 -18.369 426 HE ARG 62 HE ARG 62 8.407 15.983 -16.172 427 HH11 ARG 62 HH11 ARG 62 11.621 16.516 -17.478 428 HH12 ARG 62 HH12 ARG 62 11.745 18.127 -16.842 429 HH21 ARG 62 HH21 ARG 62 8.588 18.123 -15.341 430 HH22 ARG 62 HH22 ARG 62 10.034 19.033 -15.639 431 H LEU 63 H LEU 63 11.255 10.939 -13.811 432 HA LEU 63 HA LEU 63 11.574 12.223 -11.324 433 HB2 LEU 63 HB2 LEU 63 11.959 9.394 -12.256 434 HB3 LEU 63 HB3 LEU 63 12.404 9.856 -10.628 435 HG LEU 63 HG LEU 63 10.224 8.826 -10.620 436 HD11 LEU 63 HD11 LEU 63 10.627 10.634 -9.039 437 HD12 LEU 63 HD12 LEU 63 8.932 10.559 -9.523 438 HD13 LEU 63 HD13 LEU 63 9.990 11.797 -10.201 439 HD21 LEU 63 HD21 LEU 63 9.368 10.997 -12.524 440 HD22 LEU 63 HD22 LEU 63 8.325 9.775 -11.796 441 HD23 LEU 63 HD23 LEU 63 9.588 9.295 -12.930 442 H ARG 64 H ARG 64 13.872 10.641 -13.498 443 HA ARG 64 HA ARG 64 16.100 10.552 -11.887 444 HB2 ARG 64 HB2 ARG 64 15.534 10.230 -14.662 445 HB3 ARG 64 HB3 ARG 64 16.998 11.190 -14.504 446 HG2 ARG 64 HG2 ARG 64 17.535 8.840 -14.668 447 HG3 ARG 64 HG3 ARG 64 17.973 9.459 -13.072 448 HD2 ARG 64 HD2 ARG 64 15.856 8.552 -12.180 449 HD3 ARG 64 HD3 ARG 64 15.498 7.881 -13.769 450 HE ARG 64 HE ARG 64 18.031 7.045 -12.687 451 HH11 ARG 64 HH11 ARG 64 14.602 6.372 -12.840 452 HH12 ARG 64 HH12 ARG 64 14.782 4.698 -12.434 453 HH21 ARG 64 HH21 ARG 64 18.273 4.847 -12.150 454 HH22 ARG 64 HH22 ARG 64 16.872 3.831 -12.027 455 H ALA 65 H ALA 65 15.034 13.273 -13.901 456 HA ALA 65 HA ALA 65 17.374 14.790 -13.118 457 HB1 ALA 65 HB1 ALA 65 15.027 15.580 -14.844 458 HB2 ALA 65 HB2 ALA 65 16.574 14.956 -15.417 459 HB3 ALA 65 HB3 ALA 65 16.499 16.524 -14.612 460 H MET 66 H MET 66 14.944 13.987 -11.354 461 HA MET 66 HA MET 66 14.556 16.665 -10.203 462 HB2 MET 66 HB2 MET 66 12.757 14.265 -10.274 463 HB3 MET 66 HB3 MET 66 12.554 15.508 -9.046 464 HG2 MET 66 HG2 MET 66 12.500 15.967 -12.021 465 HG3 MET 66 HG3 MET 66 11.086 15.854 -10.981 466 HE1 MET 66 HE1 MET 66 12.456 17.398 -8.367 467 HE2 MET 66 HE2 MET 66 10.766 17.509 -8.856 468 HE3 MET 66 HE3 MET 66 11.710 18.977 -8.617 469 H ASN 67 H ASN 67 15.065 13.233 -9.361 470 HA ASN 67 HA ASN 67 15.669 13.693 -6.648 471 HB2 ASN 67 HB2 ASN 67 17.144 11.549 -6.975 472 HB3 ASN 67 HB3 ASN 67 15.392 11.431 -7.078 473 HD21 ASN 67 HD22 ASN 67 18.362 11.578 -8.951 474 HD22 ASN 67 HD21 ASN 67 17.698 10.874 -10.390 475 H THR 68 H THR 68 17.718 13.616 -9.518 476 HA THR 68 HA THR 68 20.135 14.229 -8.187 477 HB THR 68 HB THR 68 19.320 14.601 -11.078 478 HG1 THR 68 HG1 THR 68 20.161 12.451 -9.527 479 HG21 THR 68 HG21 THR 68 21.298 15.979 -10.464 480 HG22 THR 68 HG22 THR 68 21.681 14.700 -11.615 481 HG23 THR 68 HG23 THR 68 22.110 14.514 -9.916 482 H ALA 69 H ALA 69 17.520 16.165 -9.457 483 HA ALA 69 HA ALA 69 18.844 18.637 -9.661 484 HB1 ALA 69 HB1 ALA 69 15.927 18.093 -9.126 485 HB2 ALA 69 HB2 ALA 69 16.687 18.214 -10.714 486 HB3 ALA 69 HB3 ALA 69 16.609 19.626 -9.663 487 H MET 70 H MET 70 16.819 17.321 -7.019 488 HA MET 70 HA MET 70 17.069 19.589 -5.361 489 HB2 MET 70 HB2 MET 70 15.345 17.775 -5.098 490 HB3 MET 70 HB3 MET 70 16.608 16.749 -4.430 491 HG2 MET 70 HG2 MET 70 16.959 18.366 -2.626 492 HG3 MET 70 HG3 MET 70 15.682 19.379 -3.292 493 HE1 MET 70 HE1 MET 70 16.577 16.225 -1.216 494 HE2 MET 70 HE2 MET 70 16.030 15.470 -2.712 495 HE3 MET 70 HE3 MET 70 15.078 15.300 -1.235 496 H ALA 71 H ALA 71 18.859 16.562 -5.518 497 HA ALA 71 HA ALA 71 20.585 16.946 -3.367 498 HB1 ALA 71 HB1 ALA 71 20.362 14.820 -4.524 499 HB2 ALA 71 HB2 ALA 71 22.049 15.333 -4.498 500 HB3 ALA 71 HB3 ALA 71 21.094 15.514 -5.971 501 H ALA 72 H ALA 72 20.818 18.048 -6.714 502 HA ALA 72 HA ALA 72 23.446 19.054 -6.589 503 HB1 ALA 72 HB1 ALA 72 22.304 18.626 -8.694 504 HB2 ALA 72 HB2 ALA 72 22.861 20.298 -8.608 505 HB3 ALA 72 HB3 ALA 72 21.158 19.919 -8.346 506 H GLU 73 H GLU 73 20.320 20.493 -5.805 507 HA GLU 73 HA GLU 73 21.437 23.124 -5.491 508 HB2 GLU 73 HB2 GLU 73 18.702 22.063 -4.771 509 HB3 GLU 73 HB3 GLU 73 19.171 23.762 -4.767 510 HG2 GLU 73 HG2 GLU 73 19.755 23.496 -7.196 511 HG3 GLU 73 HG3 GLU 73 18.994 21.910 -7.127 512 H VAL 74 H VAL 74 20.712 20.408 -3.401 513 HA VAL 74 HA VAL 74 21.116 21.795 -0.943 514 HB VAL 74 HB VAL 74 21.536 18.857 -1.560 515 HG11 VAL 74 HG11 VAL 74 21.237 20.263 1.094 516 HG12 VAL 74 HG12 VAL 74 22.723 19.550 0.466 517 HG13 VAL 74 HG13 VAL 74 21.347 18.518 0.857 518 HG21 VAL 74 HG21 VAL 74 19.179 20.317 -0.375 519 HG22 VAL 74 HG22 VAL 74 19.322 18.565 -0.539 520 HG23 VAL 74 HG23 VAL 74 19.248 19.584 -1.977 521 H ALA 75 H ALA 75 23.198 20.234 -3.273 522 HA ALA 75 HA ALA 75 25.603 20.202 -1.841 523 HB1 ALA 75 HB1 ALA 75 25.307 19.002 -3.925 524 HB2 ALA 75 HB2 ALA 75 26.673 20.106 -4.054 525 HB3 ALA 75 HB3 ALA 75 25.132 20.522 -4.800 526 H GLU 76 H GLU 76 23.906 22.804 -3.399 527 HA GLU 76 HA GLU 76 26.008 24.614 -3.769 528 HB2 GLU 76 HB2 GLU 76 23.082 25.092 -3.210 529 HB3 GLU 76 HB3 GLU 76 24.211 26.365 -3.659 530 HG2 GLU 76 HG2 GLU 76 23.556 23.946 -5.328 531 HG3 GLU 76 HG3 GLU 76 22.897 25.566 -5.560 532 H VAL 77 H VAL 77 23.878 24.122 -0.958 533 HA VAL 77 HA VAL 77 25.145 26.234 0.516 534 HB VAL 77 HB VAL 77 23.773 25.621 2.390 535 HG11 VAL 77 HG11 VAL 77 22.683 26.844 0.587 536 HG12 VAL 77 HG12 VAL 77 21.548 25.771 1.405 537 HG13 VAL 77 HG13 VAL 77 22.209 25.322 -0.167 538 HG21 VAL 77 HG21 VAL 77 24.045 23.184 2.264 539 HG22 VAL 77 HG22 VAL 77 22.974 23.147 0.865 540 HG23 VAL 77 HG23 VAL 77 22.355 23.653 2.434 541 H VAL 78 H VAL 78 25.580 22.806 0.168 542 HA VAL 78 HA VAL 78 27.181 22.392 2.473 543 HB VAL 78 HB VAL 78 27.114 20.825 -0.115 544 HG11 VAL 78 HG11 VAL 78 28.136 20.029 2.607 545 HG12 VAL 78 HG12 VAL 78 29.130 20.381 1.192 546 HG13 VAL 78 HG13 VAL 78 28.048 18.987 1.186 547 HG21 VAL 78 HG21 VAL 78 25.608 19.314 1.104 548 HG22 VAL 78 HG22 VAL 78 24.928 20.931 0.937 549 HG23 VAL 78 HG23 VAL 78 25.620 20.421 2.476 550 H ALA 79 H ALA 79 27.791 23.614 -0.721 551 HA ALA 79 HA ALA 79 30.600 23.306 -0.759 552 HB1 ALA 79 HB1 ALA 79 29.304 23.754 -2.786 553 HB2 ALA 79 HB2 ALA 79 30.578 24.953 -2.560 554 HB3 ALA 79 HB3 ALA 79 28.905 25.362 -2.177 555 H THR 80 H THR 80 28.542 25.395 0.969 556 HA THR 80 HA THR 80 30.557 27.444 1.410 557 HB THR 80 HB THR 80 27.875 27.241 2.780 558 HG1 THR 80 HG1 THR 80 28.448 28.367 0.217 559 HG21 THR 80 HG21 THR 80 29.616 29.580 1.980 560 HG22 THR 80 HG22 THR 80 29.392 28.962 3.617 561 HG23 THR 80 HG23 THR 80 28.039 29.703 2.761 562 H SER 81 H SER 81 30.005 24.416 2.576 563 HA SER 81 HA SER 81 30.595 25.024 5.368 564 HB2 SER 81 HB2 SER 81 30.068 22.346 4.059 565 HB3 SER 81 HB3 SER 81 30.111 22.686 5.790 566 HG SER 81 HG SER 81 28.381 24.236 4.276 567 HA PRO 82 HA PRO 82 34.931 24.345 4.476 568 HB2 PRO 82 HB2 PRO 82 35.799 24.478 7.057 569 HB3 PRO 82 HB3 PRO 82 35.416 25.906 6.088 570 HG2 PRO 82 HG2 PRO 82 33.753 24.509 8.146 571 HG3 PRO 82 HG3 PRO 82 33.979 26.247 7.882 572 HD2 PRO 82 HD2 PRO 82 31.783 24.921 7.030 573 HD3 PRO 82 HD3 PRO 82 32.457 26.310 6.153 574 HA PRO 83 HA PRO 83 35.471 19.985 4.893 575 HB2 PRO 83 HB2 PRO 83 38.284 20.641 5.629 576 HB3 PRO 83 HB3 PRO 83 37.672 19.537 4.392 577 HG2 PRO 83 HG2 PRO 83 38.659 21.902 3.705 578 HG3 PRO 83 HG3 PRO 83 37.220 21.253 2.897 579 HD2 PRO 83 HD2 PRO 83 37.433 23.390 4.975 580 HD3 PRO 83 HD3 PRO 83 36.338 23.273 3.583 581 H GLN 84 H GLN 84 36.578 22.094 7.453 582 HA GLN 84 HA GLN 84 37.168 20.229 9.447 583 HB2 GLN 84 HB2 GLN 84 35.934 22.968 9.793 584 HB3 GLN 84 HB3 GLN 84 36.779 22.050 11.030 585 HG2 GLN 84 HG2 GLN 84 38.846 22.220 9.777 586 HG3 GLN 84 HG3 GLN 84 38.008 23.080 8.486 587 HE21 GLN 84 HE22 GLN 84 39.318 24.876 8.694 588 HE22 GLN 84 HE21 GLN 84 39.191 25.968 10.028 589 H SER 85 H SER 85 34.137 22.071 9.047 590 HA SER 85 HA SER 85 32.815 20.200 10.851 591 HB2 SER 85 HB2 SER 85 30.961 21.941 10.733 592 HB3 SER 85 HB3 SER 85 32.476 22.477 11.460 593 HG SER 85 HG SER 85 31.405 23.862 9.782 594 H TYR 86 H TYR 86 33.438 20.182 7.728 595 HA TYR 86 HA TYR 86 31.053 19.983 6.331 596 HB2 TYR 86 HB2 TYR 86 33.226 20.013 5.234 597 HB3 TYR 86 HB3 TYR 86 33.626 18.444 5.922 598 HD1 TYR 86 HD2 TYR 86 32.645 16.407 5.026 599 HD2 TYR 86 HD1 TYR 86 31.689 20.209 3.349 600 HE1 TYR 86 HE2 TYR 86 31.726 15.294 3.037 601 HE2 TYR 86 HE1 TYR 86 30.776 19.092 1.355 602 HH TYR 86 HH TYR 86 31.022 16.960 0.174 603 H SER 87 H SER 87 32.771 17.509 8.187 604 HA SER 87 HA SER 87 30.932 15.431 7.496 605 HB2 SER 87 HB2 SER 87 33.026 15.530 9.678 606 HB3 SER 87 HB3 SER 87 32.150 14.085 9.170 607 HG SER 87 HG SER 87 34.376 15.018 8.161 608 H ALA 88 H ALA 88 30.431 18.043 9.336 609 HA ALA 88 HA ALA 88 28.561 16.614 11.104 610 HB1 ALA 88 HB1 ALA 88 30.124 18.120 12.262 611 HB2 ALA 88 HB2 ALA 88 28.454 18.652 12.436 612 HB3 ALA 88 HB3 ALA 88 29.528 19.471 11.303 613 H VAL 89 H VAL 89 28.921 19.112 8.666 614 HA VAL 89 HA VAL 89 26.167 19.873 8.593 615 HB VAL 89 HB VAL 89 28.307 20.201 6.476 616 HG11 VAL 89 HG11 VAL 89 26.847 21.960 5.567 617 HG12 VAL 89 HG12 VAL 89 25.615 21.532 6.755 618 HG13 VAL 89 HG13 VAL 89 26.084 20.370 5.515 619 HG21 VAL 89 HG21 VAL 89 28.519 22.486 7.305 620 HG22 VAL 89 HG22 VAL 89 28.876 21.319 8.579 621 HG23 VAL 89 HG23 VAL 89 27.321 22.153 8.556 622 H LEU 90 H LEU 90 28.208 17.924 6.423 623 HA LEU 90 HA LEU 90 26.192 16.994 4.728 624 HB2 LEU 90 HB2 LEU 90 28.846 16.847 4.730 625 HB3 LEU 90 HB3 LEU 90 28.527 15.283 5.449 626 HG LEU 90 HG LEU 90 28.918 15.179 3.033 627 HD11 LEU 90 HD11 LEU 90 26.989 13.792 2.452 628 HD12 LEU 90 HD12 LEU 90 26.129 14.415 3.862 629 HD13 LEU 90 HD13 LEU 90 27.588 13.446 4.075 630 HD21 LEU 90 HD21 LEU 90 27.992 17.328 2.405 631 HD22 LEU 90 HD22 LEU 90 26.371 16.762 2.814 632 HD23 LEU 90 HD23 LEU 90 27.250 16.026 1.476 633 H ASN 91 H ASN 91 27.445 15.815 7.774 634 HA ASN 91 HA ASN 91 26.136 13.352 7.950 635 HB2 ASN 91 HB2 ASN 91 27.929 14.635 9.470 636 HB3 ASN 91 HB3 ASN 91 26.486 15.002 10.406 637 HD21 ASN 91 HD22 ASN 91 28.857 13.343 10.936 638 HD22 ASN 91 HD21 ASN 91 28.238 11.796 11.386 639 H THR 92 H THR 92 25.170 16.579 9.056 640 HA THR 92 HA THR 92 22.674 15.889 10.138 641 HB THR 92 HB THR 92 23.543 18.515 8.902 642 HG1 THR 92 HG1 THR 92 24.878 17.956 10.626 643 HG21 THR 92 HG21 THR 92 21.115 18.422 9.145 644 HG22 THR 92 HG22 THR 92 21.811 19.526 10.332 645 HG23 THR 92 HG23 THR 92 21.289 17.915 10.824 646 H ILE 93 H ILE 93 23.636 16.812 6.863 647 HA ILE 93 HA ILE 93 21.123 17.079 5.696 648 HB ILE 93 HB ILE 93 23.651 16.024 4.424 649 HG12 ILE 93 HG12 ILE 93 23.948 18.259 5.353 650 HG13 ILE 93 HG13 ILE 93 23.913 18.338 3.597 651 HG21 ILE 93 HG21 ILE 93 22.644 16.681 2.291 652 HG22 ILE 93 HG22 ILE 93 21.154 17.112 3.129 653 HG23 ILE 93 HG23 ILE 93 21.697 15.433 3.101 654 HD11 ILE 93 HD11 ILE 93 21.664 19.056 5.462 655 HD12 ILE 93 HD12 ILE 93 21.571 19.080 3.703 656 HD13 ILE 93 HD13 ILE 93 22.672 20.174 4.542 657 H GLY 94 H GLY 94 23.199 14.183 5.802 658 HA2 GLY 94 HA2 GLY 94 21.295 12.479 4.591 659 HA3 GLY 94 HA3 GLY 94 22.689 11.957 5.520 660 H ALA 95 H ALA 95 22.008 13.215 7.939 661 HA ALA 95 HA ALA 95 20.457 11.210 9.136 662 HB1 ALA 95 HB1 ALA 95 20.618 12.530 11.167 663 HB2 ALA 95 HB2 ALA 95 21.137 13.932 10.232 664 HB3 ALA 95 HB3 ALA 95 22.165 12.504 10.322 665 H CYS 96 H CYS 96 19.635 14.599 8.406 666 HA CYS 96 HA CYS 96 17.000 14.360 9.466 667 HB2 CYS 96 HB2 CYS 96 18.124 16.449 7.603 668 HB3 CYS 96 HB3 CYS 96 16.625 16.584 8.514 669 H LEU 97 H LEU 97 18.358 14.166 6.206 670 HA LEU 97 HA LEU 97 15.902 14.174 4.814 671 HB2 LEU 97 HB2 LEU 97 18.196 14.566 3.850 672 HB3 LEU 97 HB3 LEU 97 18.481 12.845 3.973 673 HG LEU 97 HG LEU 97 17.827 13.821 1.685 674 HD11 LEU 97 HD11 LEU 97 17.942 11.444 2.066 675 HD12 LEU 97 HD12 LEU 97 16.518 11.824 1.097 676 HD13 LEU 97 HD13 LEU 97 16.345 11.454 2.815 677 HD21 LEU 97 HD21 LEU 97 15.090 13.702 2.941 678 HD22 LEU 97 HD22 LEU 97 15.451 14.009 1.242 679 HD23 LEU 97 HD23 LEU 97 15.943 15.173 2.473 680 H ARG 98 H ARG 98 17.823 11.613 6.260 681 HA ARG 98 HA ARG 98 16.660 9.367 5.136 682 HB2 ARG 98 HB2 ARG 98 18.689 9.500 6.595 683 HB3 ARG 98 HB3 ARG 98 17.621 9.664 7.980 684 HG2 ARG 98 HG2 ARG 98 16.711 7.467 7.584 685 HG3 ARG 98 HG3 ARG 98 17.680 7.306 6.114 686 HD2 ARG 98 HD2 ARG 98 19.708 7.678 7.566 687 HD3 ARG 98 HD3 ARG 98 18.641 7.494 8.957 688 HE ARG 98 HE ARG 98 18.139 5.256 7.545 689 HH11 ARG 98 HH11 ARG 98 21.092 6.754 8.661 690 HH12 ARG 98 HH12 ARG 98 21.990 5.271 8.696 691 HH21 ARG 98 HH21 ARG 98 19.303 3.291 7.597 692 HH22 ARG 98 HH22 ARG 98 20.962 3.292 8.108 693 H GLU 99 H GLU 99 15.730 11.006 8.179 694 HA GLU 99 HA GLU 99 13.564 9.225 8.664 695 HB2 GLU 99 HB2 GLU 99 12.976 10.634 10.491 696 HB3 GLU 99 HB3 GLU 99 14.723 10.524 10.451 697 HG2 GLU 99 HG2 GLU 99 14.980 12.723 9.965 698 HG3 GLU 99 HG3 GLU 99 13.477 12.804 9.046 699 H SER 100 H SER 100 13.874 12.358 7.165 700 HA SER 100 HA SER 100 11.229 13.167 7.171 701 HB2 SER 100 HB2 SER 100 13.371 13.719 5.102 702 HB3 SER 100 HB3 SER 100 11.860 14.616 5.257 703 HG SER 100 HG SER 100 14.041 14.492 7.054 704 H MET 101 H MET 101 12.902 10.972 5.021 705 HA MET 101 HA MET 101 11.005 10.781 2.972 706 HB2 MET 101 HB2 MET 101 13.036 8.837 4.051 707 HB3 MET 101 HB3 MET 101 12.005 8.439 2.685 708 HG2 MET 101 HG2 MET 101 13.789 10.851 2.752 709 HG3 MET 101 HG3 MET 101 14.299 9.287 2.125 710 HE1 MET 101 HE1 MET 101 13.356 8.146 0.008 711 HE2 MET 101 HE2 MET 101 12.037 8.779 -0.975 712 HE3 MET 101 HE3 MET 101 11.712 8.179 0.650 713 H MET 102 H MET 102 11.325 8.903 5.975 714 HA MET 102 HA MET 102 9.026 7.300 5.307 715 HB2 MET 102 HB2 MET 102 9.443 6.078 7.303 716 HB3 MET 102 HB3 MET 102 10.994 6.393 6.541 717 HG2 MET 102 HG2 MET 102 11.378 8.226 8.122 718 HG3 MET 102 HG3 MET 102 9.841 7.854 8.903 719 HE1 MET 102 HE1 MET 102 10.632 4.075 9.976 720 HE2 MET 102 HE2 MET 102 10.242 4.502 8.308 721 HE3 MET 102 HE3 MET 102 9.342 5.230 9.640 722 H GLN 103 H GLN 103 9.671 10.142 7.212 723 HA GLN 103 HA GLN 103 7.176 10.075 8.619 724 HB2 GLN 103 HB2 GLN 103 9.429 11.963 8.373 725 HB3 GLN 103 HB3 GLN 103 7.862 12.708 8.655 726 HG2 GLN 103 HG2 GLN 103 8.975 12.331 10.754 727 HG3 GLN 103 HG3 GLN 103 7.551 11.301 10.635 728 HE21 GLN 103 HE22 GLN 103 10.996 11.422 10.824 729 HE22 GLN 103 HE21 GLN 103 11.240 9.715 11.009 730 H ALA 104 H ALA 104 8.024 10.719 5.442 731 HA ALA 104 HA ALA 104 5.741 12.438 4.913 732 HB1 ALA 104 HB1 ALA 104 7.822 12.838 3.697 733 HB2 ALA 104 HB2 ALA 104 6.512 12.413 2.598 734 HB3 ALA 104 HB3 ALA 104 7.737 11.215 3.012 735 H THR 105 H THR 105 6.891 9.281 3.665 736 HA THR 105 HA THR 105 4.585 7.839 4.137 737 HB THR 105 HB THR 105 3.417 9.433 2.679 738 HG1 THR 105 HG1 THR 105 2.580 7.373 2.636 739 HG21 THR 105 HG21 THR 105 3.883 9.471 0.263 740 HG22 THR 105 HG22 THR 105 5.306 8.461 0.537 741 HG23 THR 105 HG23 THR 105 5.233 10.090 1.214 742 H GLY 106 H GLY 106 7.410 8.374 2.163 743 HA2 GLY 106 HA2 GLY 106 7.114 5.798 0.833 744 HA3 GLY 106 HA3 GLY 106 8.299 7.032 0.451 745 H SER 107 H SER 107 7.821 5.920 3.730 746 HA SER 107 HA SER 107 9.286 5.053 5.236 747 HB2 SER 107 HB2 SER 107 10.149 2.811 4.649 748 HB3 SER 107 HB3 SER 107 8.458 3.001 4.202 749 HG SER 107 HG SER 107 9.926 3.768 2.129 750 H VAL 108 H VAL 108 11.768 3.656 4.828 751 HA VAL 108 HA VAL 108 13.416 5.846 3.760 752 HB VAL 108 HB VAL 108 14.295 3.738 5.743 753 HG11 VAL 108 HG11 VAL 108 16.245 5.178 6.038 754 HG12 VAL 108 HG12 VAL 108 15.611 6.294 4.830 755 HG13 VAL 108 HG13 VAL 108 16.089 4.666 4.358 756 HG21 VAL 108 HG21 VAL 108 14.220 5.533 7.422 757 HG22 VAL 108 HG22 VAL 108 12.622 5.181 6.766 758 HG23 VAL 108 HG23 VAL 108 13.502 6.611 6.225 759 H ASP 109 H ASP 109 13.841 5.331 1.735 760 HA ASP 109 HA ASP 109 14.343 2.601 0.898 761 HB2 ASP 109 HB2 ASP 109 14.153 3.376 -1.276 762 HB3 ASP 109 HB3 ASP 109 13.138 4.530 -0.419 763 H ASN 110 H ASN 110 16.291 2.742 -0.929 764 HA ASN 110 HA ASN 110 18.668 3.668 0.511 765 HB2 ASN 110 HB2 ASN 110 19.708 1.394 0.020 766 HB3 ASN 110 HB3 ASN 110 18.497 1.436 1.295 767 HD21 ASN 110 HD22 ASN 110 19.148 0.505 -1.999 768 HD22 ASN 110 HD21 ASN 110 17.826 -0.596 -2.153 769 H ALA 111 H ALA 111 17.162 4.292 -2.052 770 HA ALA 111 HA ALA 111 19.484 4.030 -3.864 771 HB1 ALA 111 HB1 ALA 111 17.576 2.694 -4.640 772 HB2 ALA 111 HB2 ALA 111 17.930 4.021 -5.743 773 HB3 ALA 111 HB3 ALA 111 16.565 4.138 -4.634 774 H PHE 112 H PHE 112 16.596 5.962 -3.135 775 HA PHE 112 HA PHE 112 17.509 8.320 -4.451 776 HB2 PHE 112 HB2 PHE 112 15.143 8.001 -4.058 777 HB3 PHE 112 HB3 PHE 112 15.403 7.869 -2.322 778 HD1 PHE 112 HD1 PHE 112 15.675 10.222 -5.175 779 HD2 PHE 112 HD2 PHE 112 15.305 9.754 -0.963 780 HE1 PHE 112 HE1 PHE 112 15.298 12.642 -4.941 781 HE2 PHE 112 HE2 PHE 112 14.926 12.171 -0.723 782 HZ PHE 112 HZ PHE 112 14.921 13.617 -2.714 783 H THR 113 H THR 113 17.299 7.391 -1.022 784 HA THR 113 HA THR 113 18.663 9.530 0.105 785 HB THR 113 HB THR 113 19.370 7.806 1.866 786 HG1 THR 113 HG1 THR 113 17.719 5.873 1.275 787 HG21 THR 113 HG21 THR 113 17.089 7.525 2.710 788 HG22 THR 113 HG22 THR 113 16.444 7.967 1.130 789 HG23 THR 113 HG23 THR 113 17.334 9.155 2.082 790 H ASN 114 H ASN 114 19.878 6.572 -1.351 791 HA ASN 114 HA ASN 114 22.612 6.894 -0.738 792 HB2 ASN 114 HB2 ASN 114 21.621 4.755 -1.430 793 HB3 ASN 114 HB3 ASN 114 21.286 5.411 -3.027 794 HD21 ASN 114 HD22 ASN 114 22.513 3.957 -4.136 795 HD22 ASN 114 HD21 ASN 114 24.237 3.905 -4.041 796 H GLU 115 H GLU 115 20.782 7.697 -3.724 797 HA GLU 115 HA GLU 115 22.907 8.729 -5.159 798 HB2 GLU 115 HB2 GLU 115 20.551 8.187 -5.963 799 HB3 GLU 115 HB3 GLU 115 20.068 9.745 -5.293 800 HG2 GLU 115 HG2 GLU 115 21.814 10.788 -6.674 801 HG3 GLU 115 HG3 GLU 115 22.084 9.233 -7.437 802 H VAL 116 H VAL 116 20.560 10.349 -3.039 803 HA VAL 116 HA VAL 116 21.534 12.949 -3.223 804 HB VAL 116 HB VAL 116 20.261 11.544 -0.862 805 HG11 VAL 116 HG11 VAL 116 21.487 13.486 -0.060 806 HG12 VAL 116 HG12 VAL 116 19.751 13.784 0.005 807 HG13 VAL 116 HG13 VAL 116 20.719 14.496 -1.285 808 HG21 VAL 116 HG21 VAL 116 18.848 11.648 -2.838 809 HG22 VAL 116 HG22 VAL 116 19.127 13.383 -2.969 810 HG23 VAL 116 HG23 VAL 116 18.240 12.736 -1.590 811 H MET 117 H MET 117 22.533 10.332 -1.054 812 HA MET 117 HA MET 117 24.425 11.900 0.380 813 HB2 MET 117 HB2 MET 117 23.838 8.971 0.180 814 HB3 MET 117 HB3 MET 117 25.244 9.525 1.061 815 HG2 MET 117 HG2 MET 117 22.468 10.504 1.646 816 HG3 MET 117 HG3 MET 117 23.152 9.071 2.404 817 HE1 MET 117 HE1 MET 117 23.007 12.792 2.044 818 HE2 MET 117 HE2 MET 117 24.760 12.944 1.878 819 HE3 MET 117 HE3 MET 117 23.968 13.443 3.369 820 H GLN 118 H GLN 118 24.568 10.564 -2.713 821 HA GLN 118 HA GLN 118 27.500 10.617 -2.671 822 HB2 GLN 118 HB2 GLN 118 26.396 8.752 -3.878 823 HB3 GLN 118 HB3 GLN 118 25.617 9.919 -4.939 824 HG2 GLN 118 HG2 GLN 118 27.936 10.694 -5.574 825 HG3 GLN 118 HG3 GLN 118 28.542 9.272 -4.729 826 HE21 GLN 118 HE22 GLN 118 28.116 7.216 -5.580 827 HE22 GLN 118 HE21 GLN 118 27.610 7.003 -7.220 828 H LEU 119 H LEU 119 24.785 11.984 -4.480 829 HA LEU 119 HA LEU 119 26.249 13.783 -6.017 830 HB2 LEU 119 HB2 LEU 119 23.386 13.492 -5.262 831 HB3 LEU 119 HB3 LEU 119 23.903 14.941 -6.101 832 HG LEU 119 HG LEU 119 24.692 13.623 -7.974 833 HD11 LEU 119 HD11 LEU 119 24.178 11.203 -8.096 834 HD12 LEU 119 HD12 LEU 119 23.819 11.243 -6.370 835 HD13 LEU 119 HD13 LEU 119 25.444 11.613 -6.940 836 HD21 LEU 119 HD21 LEU 119 22.540 12.802 -8.769 837 HD22 LEU 119 HD22 LEU 119 22.379 14.356 -7.948 838 HD23 LEU 119 HD23 LEU 119 21.911 12.870 -7.124 839 H VAL 120 H VAL 120 24.644 14.282 -2.859 840 HA VAL 120 HA VAL 120 24.923 17.098 -2.888 841 HB VAL 120 HB VAL 120 24.667 15.181 -0.564 842 HG11 VAL 120 HG11 VAL 120 24.468 18.192 -0.525 843 HG12 VAL 120 HG12 VAL 120 25.772 17.241 0.185 844 HG13 VAL 120 HG13 VAL 120 24.135 17.112 0.828 845 HG21 VAL 120 HG21 VAL 120 22.736 15.262 -2.024 846 HG22 VAL 120 HG22 VAL 120 22.705 17.020 -1.924 847 HG23 VAL 120 HG23 VAL 120 22.365 16.051 -0.492 848 H LYS 121 H LYS 121 27.128 14.536 -2.184 849 HA LYS 121 HA LYS 121 29.099 16.307 -1.000 850 HB2 LYS 121 HB2 LYS 121 29.414 13.405 -1.787 851 HB3 LYS 121 HB3 LYS 121 30.439 14.329 -0.697 852 HG2 LYS 121 HG2 LYS 121 28.534 14.540 0.858 853 HG3 LYS 121 HG3 LYS 121 27.577 13.524 -0.219 854 HD2 LYS 121 HD2 LYS 121 28.394 12.097 1.474 855 HD3 LYS 121 HD3 LYS 121 29.383 11.771 0.048 856 HE2 LYS 121 HE2 LYS 121 31.095 13.340 0.949 857 HE3 LYS 121 HE3 LYS 121 30.127 13.487 2.413 858 HZ1 LYS 121 HZ1 LYS 121 31.912 11.883 2.678 859 HZ2 LYS 121 HZ2 LYS 121 31.322 10.975 1.381 860 HZ3 LYS 121 HZ3 LYS 121 30.408 11.119 2.795 861 H MET 122 H MET 122 28.718 14.304 -3.892 862 HA MET 122 HA MET 122 31.240 14.973 -4.997 863 HB2 MET 122 HB2 MET 122 30.237 12.876 -5.561 864 HB3 MET 122 HB3 MET 122 28.788 13.661 -6.163 865 HG2 MET 122 HG2 MET 122 31.368 14.305 -7.479 866 HG3 MET 122 HG3 MET 122 30.659 12.721 -7.770 867 HE1 MET 122 HE1 MET 122 27.590 13.181 -7.733 868 HE2 MET 122 HE2 MET 122 28.383 12.310 -9.047 869 HE3 MET 122 HE3 MET 122 27.235 13.599 -9.408 870 H LEU 123 H LEU 123 28.008 16.312 -5.459 871 HA LEU 123 HA LEU 123 28.871 17.958 -7.679 872 HB2 LEU 123 HB2 LEU 123 26.301 17.889 -6.102 873 HB3 LEU 123 HB3 LEU 123 26.580 18.966 -7.455 874 HG LEU 123 HG LEU 123 26.628 15.951 -7.643 875 HD11 LEU 123 HD11 LEU 123 24.478 17.899 -8.461 876 HD12 LEU 123 HD12 LEU 123 24.398 16.805 -7.081 877 HD13 LEU 123 HD13 LEU 123 24.460 16.155 -8.719 878 HD21 LEU 123 HD21 LEU 123 26.521 16.370 -10.057 879 HD22 LEU 123 HD22 LEU 123 27.982 17.047 -9.341 880 HD23 LEU 123 HD23 LEU 123 26.634 18.104 -9.756 881 H SER 124 H SER 124 29.442 18.107 -4.474 882 HA SER 124 HA SER 124 29.379 21.036 -4.402 883 HB2 SER 124 HB2 SER 124 28.038 19.724 -2.668 884 HB3 SER 124 HB3 SER 124 29.586 19.175 -2.031 885 HG SER 124 HG SER 124 28.528 21.773 -2.132 886 H ALA 125 H ALA 125 31.114 18.442 -2.761 887 HA ALA 125 HA ALA 125 33.645 18.739 -3.797 888 HB1 ALA 125 HB1 ALA 125 33.567 21.055 -2.983 889 HB2 ALA 125 HB2 ALA 125 34.800 20.108 -2.147 890 HB3 ALA 125 HB3 ALA 125 33.268 20.462 -1.350 891 H ASP 126 H ASP 126 34.210 16.709 -3.306 892 HA ASP 126 HA ASP 126 33.866 15.832 -0.520 893 HB2 ASP 126 HB2 ASP 126 32.791 14.408 -2.286 894 HB3 ASP 126 HB3 ASP 126 34.394 14.085 -2.936 895 H SER 127 H SER 127 35.744 17.411 -0.369 896 HA SER 127 HA SER 127 38.274 15.956 -0.789 897 HB2 SER 127 HB2 SER 127 37.887 18.958 -0.656 898 HB3 SER 127 HB3 SER 127 39.385 18.104 -1.022 899 HG SER 127 HG SER 127 37.714 17.165 -2.745 900 H ALA 128 H ALA 128 36.110 16.485 1.451 901 HA ALA 128 HA ALA 128 37.641 17.660 3.559 902 HB1 ALA 128 HB1 ALA 128 35.061 16.109 3.713 903 HB2 ALA 128 HB2 ALA 128 35.206 17.855 3.501 904 HB3 ALA 128 HB3 ALA 128 35.762 17.099 4.995 905 H ASN 129 H ASN 129 39.395 15.980 2.895 906 HA ASN 129 HA ASN 129 39.157 13.594 4.573 907 HB2 ASN 129 HB2 ASN 129 40.107 13.228 2.356 908 HB3 ASN 129 HB3 ASN 129 41.328 14.465 2.644 909 HD21 ASN 129 HD22 ASN 129 43.162 13.934 3.721 910 HD22 ASN 129 HD21 ASN 129 43.509 12.347 4.315 911 H GLU 130 H GLU 130 40.648 16.691 4.360 912 HA GLU 130 HA GLU 130 42.182 16.194 6.796 913 HB2 GLU 130 HB2 GLU 130 43.434 17.206 4.954 914 HB3 GLU 130 HB3 GLU 130 42.275 18.528 4.874 915 HG2 GLU 130 HG2 GLU 130 44.263 19.252 6.018 916 HG3 GLU 130 HG3 GLU 130 42.914 19.201 7.149 917 H VAL 131 H VAL 131 40.883 16.417 8.500 918 HA VAL 131 HA VAL 131 39.085 18.701 8.689 919 HB VAL 131 HB VAL 131 39.610 16.539 10.740 920 HG11 VAL 131 HG11 VAL 131 37.328 18.496 10.496 921 HG12 VAL 131 HG12 VAL 131 38.654 18.606 11.653 922 HG13 VAL 131 HG13 VAL 131 37.517 17.262 11.741 923 HG21 VAL 131 HG21 VAL 131 37.431 16.723 8.660 924 HG22 VAL 131 HG22 VAL 131 37.500 15.537 9.962 925 HG23 VAL 131 HG23 VAL 131 38.737 15.540 8.708 926 H SER 132 H SER 132 40.507 20.411 8.778 927 HA SER 132 HA SER 132 42.740 20.409 10.575 928 HB2 SER 132 HB2 SER 132 41.551 22.681 8.965 929 HB3 SER 132 HB3 SER 132 43.127 22.686 9.756 930 HG SER 132 HG SER 132 42.957 22.108 7.395 931 H THR 133 H THR 133 41.568 20.009 12.552 932 HA THR 133 HA THR 133 40.316 22.439 13.625 933 HB THR 133 HB THR 133 40.115 19.685 14.757 934 HG1 THR 133 HG1 THR 133 38.779 20.902 12.682 935 HG21 THR 133 HG21 THR 133 38.521 22.190 15.273 936 HG22 THR 133 HG22 THR 133 39.707 21.478 16.366 937 HG23 THR 133 HG23 THR 133 38.215 20.615 16.003 Start of MODEL 3 1 HA2 GLY 1 HA2 GLY 1 8.728 -0.601 -2.670 2 HA3 GLY 1 HA3 GLY 1 9.187 -1.832 -1.501 3 H SER 2 H SER 2 10.992 -0.134 -2.857 4 HA SER 2 HA SER 2 13.056 -0.236 -3.766 5 HB2 SER 2 HB2 SER 2 13.271 -2.405 -2.567 6 HB3 SER 2 HB3 SER 2 12.640 -3.227 -3.991 7 HG SER 2 HG SER 2 14.761 -1.529 -4.483 8 H GLY 3 H GLY 3 11.116 -2.673 -5.539 9 HA2 GLY 3 HA2 GLY 3 12.146 -1.664 -8.060 10 HA3 GLY 3 HA3 GLY 3 11.065 -3.032 -7.843 11 H ASN 4 H ASN 4 10.626 0.259 -6.644 12 HA ASN 4 HA ASN 4 8.092 0.391 -8.110 13 HB2 ASN 4 HB2 ASN 4 9.173 2.242 -5.969 14 HB3 ASN 4 HB3 ASN 4 7.568 2.314 -6.678 15 HD21 ASN 4 HD22 ASN 4 8.175 2.107 -3.940 16 HD22 ASN 4 HD21 ASN 4 7.496 0.626 -3.367 17 H SER 5 H SER 5 7.587 2.239 -9.407 18 HA SER 5 HA SER 5 9.908 3.451 -10.627 19 HB2 SER 5 HB2 SER 5 6.972 3.835 -11.233 20 HB3 SER 5 HB3 SER 5 8.309 4.437 -12.212 21 HG SER 5 HG SER 5 8.413 1.740 -11.647 22 H GLN 6 H GLN 6 7.602 4.191 -8.261 23 HA GLN 6 HA GLN 6 8.654 6.913 -8.068 24 HB2 GLN 6 HB2 GLN 6 5.920 6.020 -7.137 25 HB3 GLN 6 HB3 GLN 6 6.557 7.655 -7.093 26 HG2 GLN 6 HG2 GLN 6 5.156 7.715 -8.912 27 HG3 GLN 6 HG3 GLN 6 6.721 7.406 -9.660 28 HE21 GLN 6 HE22 GLN 6 5.786 6.477 -11.480 29 HE22 GLN 6 HE21 GLN 6 5.047 4.911 -11.437 30 HA PRO 7 HA PRO 7 10.057 4.876 -4.274 31 HB2 PRO 7 HB2 PRO 7 12.123 6.532 -3.786 32 HB3 PRO 7 HB3 PRO 7 12.201 5.272 -5.023 33 HG2 PRO 7 HG2 PRO 7 11.674 8.203 -5.342 34 HG3 PRO 7 HG3 PRO 7 12.708 7.143 -6.315 35 HD2 PRO 7 HD2 PRO 7 10.191 7.878 -7.060 36 HD3 PRO 7 HD3 PRO 7 10.942 6.343 -7.546 37 H ILE 8 H ILE 8 8.769 7.978 -4.793 38 HA ILE 8 HA ILE 8 7.677 8.272 -2.243 39 HB ILE 8 HB ILE 8 9.890 8.741 -1.399 40 HG12 ILE 8 HG12 ILE 8 9.579 11.196 -0.713 41 HG13 ILE 8 HG13 ILE 8 8.127 11.165 -1.697 42 HG21 ILE 8 HG21 ILE 8 11.012 9.336 -3.453 43 HG22 ILE 8 HG22 ILE 8 11.251 10.602 -2.248 44 HG23 ILE 8 HG23 ILE 8 10.088 10.835 -3.553 45 HD11 ILE 8 HD11 ILE 8 7.632 10.814 0.641 46 HD12 ILE 8 HD12 ILE 8 8.689 9.403 0.663 47 HD13 ILE 8 HD13 ILE 8 7.222 9.392 -0.317 48 H TRP 9 H TRP 9 8.772 9.717 -5.219 49 HA TRP 9 HA TRP 9 7.168 12.068 -5.031 50 HB2 TRP 9 HB2 TRP 9 8.325 10.861 -7.547 51 HB3 TRP 9 HB3 TRP 9 7.859 12.535 -7.283 52 HD1 TRP 9 HD1 TRP 9 10.697 10.080 -6.672 53 HE1 TRP 9 HE1 TRP 9 12.782 11.381 -5.907 54 HE3 TRP 9 HE3 TRP 9 8.584 14.698 -5.995 55 HZ2 TRP 9 HZ2 TRP 9 13.442 14.005 -5.123 56 HZ3 TRP 9 HZ3 TRP 9 10.020 16.546 -5.243 57 HH2 TRP 9 HH2 TRP 9 12.399 16.204 -4.814 58 H THR 10 H THR 10 5.265 10.576 -4.410 59 HA THR 10 HA THR 10 3.781 9.790 -6.822 60 HB THR 10 HB THR 10 2.162 8.786 -5.143 61 HG1 THR 10 HG1 THR 10 3.486 8.356 -3.066 62 HG21 THR 10 HG21 THR 10 4.996 7.736 -5.123 63 HG22 THR 10 HG22 THR 10 3.785 7.417 -6.366 64 HG23 THR 10 HG23 THR 10 3.546 6.813 -4.726 65 H ASN 11 H ASN 11 3.843 11.959 -4.127 66 HA ASN 11 HA ASN 11 1.656 13.503 -5.297 67 HB2 ASN 11 HB2 ASN 11 0.698 12.138 -3.454 68 HB3 ASN 11 HB3 ASN 11 1.884 12.814 -2.350 69 HD21 ASN 11 HD22 ASN 11 -1.028 12.860 -2.276 70 HD22 ASN 11 HD21 ASN 11 -1.478 14.526 -2.192 71 HA PRO 12 HA PRO 12 4.746 16.698 -5.072 72 HB2 PRO 12 HB2 PRO 12 2.245 18.311 -4.810 73 HB3 PRO 12 HB3 PRO 12 3.645 18.573 -5.854 74 HG2 PRO 12 HG2 PRO 12 1.379 17.541 -6.821 75 HG3 PRO 12 HG3 PRO 12 2.965 16.995 -7.396 76 HD2 PRO 12 HD2 PRO 12 1.017 15.610 -5.639 77 HD3 PRO 12 HD3 PRO 12 2.235 14.933 -6.736 78 H ASN 13 H ASN 13 1.901 16.847 -2.923 79 HA ASN 13 HA ASN 13 3.160 18.519 -1.000 80 HB2 ASN 13 HB2 ASN 13 0.690 18.282 -1.248 81 HB3 ASN 13 HB3 ASN 13 0.813 16.651 -0.594 82 HD21 ASN 13 HD22 ASN 13 1.123 16.363 1.590 83 HD22 ASN 13 HD21 ASN 13 1.034 17.656 2.730 84 H ALA 14 H ALA 14 2.863 15.045 -1.396 85 HA ALA 14 HA ALA 14 3.867 14.307 1.163 86 HB1 ALA 14 HB1 ALA 14 2.586 12.733 -0.156 87 HB2 ALA 14 HB2 ALA 14 4.205 12.084 0.134 88 HB3 ALA 14 HB3 ALA 14 3.801 12.778 -1.435 89 H ALA 15 H ALA 15 5.339 14.629 -2.039 90 HA ALA 15 HA ALA 15 7.962 13.914 -1.268 91 HB1 ALA 15 HB1 ALA 15 7.063 15.664 -3.557 92 HB2 ALA 15 HB2 ALA 15 7.210 13.906 -3.597 93 HB3 ALA 15 HB3 ALA 15 8.648 14.907 -3.389 94 H MET 16 H MET 16 6.271 17.019 -1.485 95 HA MET 16 HA MET 16 8.501 18.565 -0.710 96 HB2 MET 16 HB2 MET 16 5.736 19.011 -1.352 97 HB3 MET 16 HB3 MET 16 6.193 19.951 0.072 98 HG2 MET 16 HG2 MET 16 7.581 19.939 -2.593 99 HG3 MET 16 HG3 MET 16 6.548 21.214 -1.953 100 HE1 MET 16 HE1 MET 16 9.489 21.591 -3.096 101 HE2 MET 16 HE2 MET 16 10.067 20.052 -2.454 102 HE3 MET 16 HE3 MET 16 10.795 21.564 -1.912 103 H THR 17 H THR 17 6.276 16.631 1.078 104 HA THR 17 HA THR 17 6.556 17.791 3.614 105 HB THR 17 HB THR 17 6.209 14.863 2.918 106 HG1 THR 17 HG1 THR 17 4.565 16.589 2.296 107 HG21 THR 17 HG21 THR 17 6.988 15.075 5.204 108 HG22 THR 17 HG22 THR 17 5.267 14.690 5.216 109 HG23 THR 17 HG23 THR 17 5.801 16.341 5.522 110 H MET 18 H MET 18 8.431 15.153 2.091 111 HA MET 18 HA MET 18 10.289 14.941 4.213 112 HB2 MET 18 HB2 MET 18 11.619 13.568 2.750 113 HB3 MET 18 HB3 MET 18 9.928 13.172 2.491 114 HG2 MET 18 HG2 MET 18 9.889 14.442 0.459 115 HG3 MET 18 HG3 MET 18 11.531 15.013 0.743 116 HE1 MET 18 HE1 MET 18 12.001 12.720 -2.337 117 HE2 MET 18 HE2 MET 18 12.108 14.353 -1.671 118 HE3 MET 18 HE3 MET 18 10.530 13.633 -2.000 119 H THR 19 H THR 19 10.203 16.896 1.293 120 HA THR 19 HA THR 19 12.861 17.823 1.406 121 HB THR 19 HB THR 19 10.549 19.398 0.266 122 HG1 THR 19 HG1 THR 19 10.292 17.366 -0.619 123 HG21 THR 19 HG21 THR 19 13.413 19.065 -0.635 124 HG22 THR 19 HG22 THR 19 12.795 20.444 0.277 125 HG23 THR 19 HG23 THR 19 12.205 20.131 -1.357 126 H ASN 20 H ASN 20 9.812 19.186 2.666 127 HA ASN 20 HA ASN 20 11.004 21.472 3.845 128 HB2 ASN 20 HB2 ASN 20 8.364 20.093 4.152 129 HB3 ASN 20 HB3 ASN 20 8.830 21.327 5.314 130 HD21 ASN 20 HD22 ASN 20 7.870 20.681 2.055 131 HD22 ASN 20 HD21 ASN 20 7.646 22.330 1.576 132 H ASN 21 H ASN 21 10.276 18.227 5.061 133 HA ASN 21 HA ASN 21 10.958 18.695 7.739 134 HB2 ASN 21 HB2 ASN 21 11.010 16.187 6.074 135 HB3 ASN 21 HB3 ASN 21 11.428 16.192 7.778 136 HD21 ASN 21 HD22 ASN 21 9.302 14.757 6.538 137 HD22 ASN 21 HD21 ASN 21 7.824 15.333 7.233 138 H LEU 22 H LEU 22 12.901 17.960 4.922 139 HA LEU 22 HA LEU 22 15.342 17.463 6.247 140 HB2 LEU 22 HB2 LEU 22 15.005 16.900 3.899 141 HB3 LEU 22 HB3 LEU 22 14.793 18.593 3.499 142 HG LEU 22 HG LEU 22 17.153 19.001 4.191 143 HD11 LEU 22 HD11 LEU 22 17.282 15.993 4.327 144 HD12 LEU 22 HD12 LEU 22 17.411 17.098 5.696 145 HD13 LEU 22 HD13 LEU 22 18.652 17.099 4.443 146 HD21 LEU 22 HD21 LEU 22 16.566 18.700 1.851 147 HD22 LEU 22 HD22 LEU 22 16.737 16.954 2.018 148 HD23 LEU 22 HD23 LEU 22 18.146 18.000 2.194 149 H VAL 23 H VAL 23 13.864 20.390 4.947 150 HA VAL 23 HA VAL 23 15.937 22.175 5.560 151 HB VAL 23 HB VAL 23 12.971 22.741 5.400 152 HG11 VAL 23 HG11 VAL 23 13.639 25.049 4.912 153 HG12 VAL 23 HG12 VAL 23 15.326 24.616 5.186 154 HG13 VAL 23 HG13 VAL 23 14.171 24.545 6.515 155 HG21 VAL 23 HG21 VAL 23 13.462 23.435 3.087 156 HG22 VAL 23 HG22 VAL 23 13.793 21.723 3.358 157 HG23 VAL 23 HG23 VAL 23 15.124 22.880 3.290 158 H GLN 24 H GLN 24 13.045 21.245 7.428 159 HA GLN 24 HA GLN 24 13.580 23.047 9.565 160 HB2 GLN 24 HB2 GLN 24 11.766 22.038 10.704 161 HB3 GLN 24 HB3 GLN 24 11.343 21.987 8.999 162 HG2 GLN 24 HG2 GLN 24 12.094 19.641 8.922 163 HG3 GLN 24 HG3 GLN 24 12.398 19.712 10.655 164 HE21 GLN 24 HE22 GLN 24 10.901 18.125 11.128 165 HE22 GLN 24 HE21 GLN 24 9.199 18.392 11.014 166 H CYS 25 H CYS 25 14.697 19.848 8.808 167 HA CYS 25 HA CYS 25 15.676 19.252 11.429 168 HB2 CYS 25 HB2 CYS 25 15.170 17.503 9.724 169 HB3 CYS 25 HB3 CYS 25 16.540 18.073 8.778 170 H ALA 26 H ALA 26 17.205 20.335 8.405 171 HA ALA 26 HA ALA 26 19.798 20.620 9.498 172 HB1 ALA 26 HB1 ALA 26 18.587 21.954 7.077 173 HB2 ALA 26 HB2 ALA 26 19.380 20.379 7.101 174 HB3 ALA 26 HB3 ALA 26 20.309 21.839 7.444 175 H SER 27 H SER 27 17.019 22.731 9.368 176 HA SER 27 HA SER 27 18.394 25.140 10.006 177 HB2 SER 27 HB2 SER 27 16.119 24.989 8.936 178 HB3 SER 27 HB3 SER 27 15.482 24.505 10.509 179 HG SER 27 HG SER 27 16.758 26.616 11.105 180 H ARG 28 H ARG 28 17.653 22.407 11.845 181 HA ARG 28 HA ARG 28 17.985 23.946 14.334 182 HB2 ARG 28 HB2 ARG 28 16.297 21.473 13.892 183 HB3 ARG 28 HB3 ARG 28 16.588 22.223 15.457 184 HG2 ARG 28 HG2 ARG 28 15.249 23.567 13.123 185 HG3 ARG 28 HG3 ARG 28 14.407 22.820 14.482 186 HD2 ARG 28 HD2 ARG 28 15.216 24.426 16.000 187 HD3 ARG 28 HD3 ARG 28 16.456 24.983 14.880 188 HE ARG 28 HE ARG 28 14.024 25.452 13.652 189 HH11 ARG 28 HH11 ARG 28 15.596 26.459 16.607 190 HH12 ARG 28 HH12 ARG 28 14.918 28.053 16.581 191 HH21 ARG 28 HH21 ARG 28 13.127 27.551 13.606 192 HH22 ARG 28 HH22 ARG 28 13.498 28.670 14.878 193 H SER 29 H SER 29 19.797 22.424 12.434 194 HA SER 29 HA SER 29 20.768 20.176 13.900 195 HB2 SER 29 HB2 SER 29 22.657 20.264 12.288 196 HB3 SER 29 HB3 SER 29 21.088 20.317 11.486 197 HG SER 29 HG SER 29 21.416 22.356 10.906 198 H GLY 30 H GLY 30 21.668 23.566 13.619 199 HA2 GLY 30 HA2 GLY 30 22.764 24.836 15.277 200 HA3 GLY 30 HA3 GLY 30 23.295 23.336 16.036 201 H VAL 31 H VAL 31 23.962 22.489 13.158 202 HA VAL 31 HA VAL 31 26.731 23.290 13.290 203 HB VAL 31 HB VAL 31 25.283 21.504 11.328 204 HG11 VAL 31 HG11 VAL 31 27.489 20.729 10.650 205 HG12 VAL 31 HG12 VAL 31 28.249 21.866 11.762 206 HG13 VAL 31 HG13 VAL 31 27.332 22.462 10.379 207 HG21 VAL 31 HG21 VAL 31 26.991 20.816 13.718 208 HG22 VAL 31 HG22 VAL 31 26.325 19.658 12.564 209 HG23 VAL 31 HG23 VAL 31 25.245 20.609 13.586 210 H LEU 32 H LEU 32 24.070 23.539 10.965 211 HA LEU 32 HA LEU 32 25.541 25.175 9.149 212 HB2 LEU 32 HB2 LEU 32 22.623 24.464 9.381 213 HB3 LEU 32 HB3 LEU 32 23.210 25.586 8.171 214 HG LEU 32 HG LEU 32 24.714 23.729 7.333 215 HD11 LEU 32 HD11 LEU 32 24.078 21.437 7.892 216 HD12 LEU 32 HD12 LEU 32 22.954 22.045 9.107 217 HD13 LEU 32 HD13 LEU 32 24.688 22.303 9.302 218 HD21 LEU 32 HD21 LEU 32 21.733 23.309 7.227 219 HD22 LEU 32 HD22 LEU 32 22.909 22.631 6.100 220 HD23 LEU 32 HD23 LEU 32 22.672 24.378 6.186 221 H THR 33 H THR 33 25.109 27.390 8.646 222 HA THR 33 HA THR 33 24.496 28.923 11.058 223 HB THR 33 HB THR 33 26.528 29.602 9.958 224 HG1 THR 33 HG1 THR 33 25.564 31.836 9.111 225 HG21 THR 33 HG21 THR 33 25.992 28.748 7.703 226 HG22 THR 33 HG22 THR 33 26.633 30.391 7.674 227 HG23 THR 33 HG23 THR 33 24.905 30.117 7.468 228 H ALA 34 H ALA 34 23.177 30.953 10.755 229 HA ALA 34 HA ALA 34 20.583 30.301 9.956 230 HB1 ALA 34 HB1 ALA 34 21.787 33.051 10.290 231 HB2 ALA 34 HB2 ALA 34 21.066 32.072 11.568 232 HB3 ALA 34 HB3 ALA 34 20.063 32.677 10.249 233 H ASP 35 H ASP 35 23.221 31.773 8.227 234 HA ASP 35 HA ASP 35 21.833 32.731 5.971 235 HB2 ASP 35 HB2 ASP 35 24.644 31.620 5.947 236 HB3 ASP 35 HB3 ASP 35 23.971 32.871 4.909 237 H GLN 36 H GLN 36 23.409 29.646 6.642 238 HA GLN 36 HA GLN 36 22.870 28.457 4.144 239 HB2 GLN 36 HB2 GLN 36 23.671 27.402 6.828 240 HB3 GLN 36 HB3 GLN 36 23.259 26.297 5.523 241 HG2 GLN 36 HG2 GLN 36 25.045 27.074 4.179 242 HG3 GLN 36 HG3 GLN 36 25.338 28.448 5.242 243 HE21 GLN 36 HE22 GLN 36 27.072 26.196 4.328 244 HE22 GLN 36 HE21 GLN 36 27.694 25.501 5.784 245 H MET 37 H MET 37 21.142 28.588 7.191 246 HA MET 37 HA MET 37 19.139 26.684 6.603 247 HB2 MET 37 HB2 MET 37 18.912 29.144 8.353 248 HB3 MET 37 HB3 MET 37 17.853 27.746 8.393 249 HG2 MET 37 HG2 MET 37 19.706 26.370 9.144 250 HG3 MET 37 HG3 MET 37 20.766 27.780 9.093 251 HE1 MET 37 HE1 MET 37 20.507 27.503 12.881 252 HE2 MET 37 HE2 MET 37 21.535 27.832 11.485 253 HE3 MET 37 HE3 MET 37 20.773 26.252 11.665 254 H ASP 38 H ASP 38 19.532 30.056 5.766 255 HA ASP 38 HA ASP 38 16.810 30.458 4.978 256 HB2 ASP 38 HB2 ASP 38 18.469 32.257 5.715 257 HB3 ASP 38 HB3 ASP 38 19.157 32.128 4.098 258 H ASP 39 H ASP 39 19.859 29.842 3.269 259 HA ASP 39 HA ASP 39 18.819 29.806 0.666 260 HB2 ASP 39 HB2 ASP 39 21.241 28.704 1.978 261 HB3 ASP 39 HB3 ASP 39 20.782 27.980 0.442 262 H MET 40 H MET 40 18.897 27.363 3.181 263 HA MET 40 HA MET 40 17.958 25.177 1.688 264 HB2 MET 40 HB2 MET 40 17.588 25.879 4.603 265 HB3 MET 40 HB3 MET 40 17.099 24.342 3.906 266 HG2 MET 40 HG2 MET 40 19.914 25.391 3.821 267 HG3 MET 40 HG3 MET 40 19.294 24.332 5.088 268 HE1 MET 40 HE1 MET 40 17.421 22.309 3.581 269 HE2 MET 40 HE2 MET 40 18.638 21.863 4.777 270 HE3 MET 40 HE3 MET 40 18.574 21.023 3.228 271 H GLY 41 H GLY 41 16.313 27.905 3.134 272 HA2 GLY 41 HA2 GLY 41 13.667 26.902 2.925 273 HA3 GLY 41 HA3 GLY 41 14.120 28.594 3.089 274 H MET 42 H MET 42 15.610 28.970 0.779 275 HA MET 42 HA MET 42 13.505 29.113 -1.172 276 HB2 MET 42 HB2 MET 42 15.048 30.355 -2.539 277 HB3 MET 42 HB3 MET 42 15.148 30.944 -0.887 278 HG2 MET 42 HG2 MET 42 17.177 29.631 -0.550 279 HG3 MET 42 HG3 MET 42 17.083 29.065 -2.216 280 HE1 MET 42 HE1 MET 42 17.730 32.089 0.165 281 HE2 MET 42 HE2 MET 42 16.333 32.670 -0.744 282 HE3 MET 42 HE3 MET 42 17.906 33.433 -0.967 283 H MET 43 H MET 43 16.120 26.985 -0.481 284 HA MET 43 HA MET 43 16.437 25.715 -2.953 285 HB2 MET 43 HB2 MET 43 17.926 25.291 -1.078 286 HB3 MET 43 HB3 MET 43 16.609 24.613 -0.139 287 HG2 MET 43 HG2 MET 43 17.451 23.388 -2.735 288 HG3 MET 43 HG3 MET 43 18.304 23.032 -1.236 289 HE1 MET 43 HE1 MET 43 15.868 23.096 0.870 290 HE2 MET 43 HE2 MET 43 17.155 21.888 0.871 291 HE3 MET 43 HE3 MET 43 15.467 21.377 0.913 292 H ALA 44 H ALA 44 14.178 25.082 -0.292 293 HA ALA 44 HA ALA 44 12.789 22.953 -1.457 294 HB1 ALA 44 HB1 ALA 44 11.706 25.051 0.421 295 HB2 ALA 44 HB2 ALA 44 12.582 23.600 0.907 296 HB3 ALA 44 HB3 ALA 44 11.010 23.457 0.120 297 H ASP 45 H ASP 45 12.384 26.434 -1.761 298 HA ASP 45 HA ASP 45 9.983 26.439 -3.225 299 HB2 ASP 45 HB2 ASP 45 10.814 28.477 -2.216 300 HB3 ASP 45 HB3 ASP 45 12.274 28.413 -3.198 301 H SER 46 H SER 46 13.365 26.312 -4.258 302 HA SER 46 HA SER 46 12.953 26.350 -7.020 303 HB2 SER 46 HB2 SER 46 15.168 26.610 -5.980 304 HB3 SER 46 HB3 SER 46 15.114 24.937 -5.431 305 HG SER 46 HG SER 46 16.324 25.266 -7.391 306 H VAL 47 H VAL 47 13.225 23.593 -4.775 307 HA VAL 47 HA VAL 47 12.825 21.559 -6.659 308 HB VAL 47 HB VAL 47 12.008 21.514 -3.748 309 HG11 VAL 47 HG11 VAL 47 11.044 19.675 -5.021 310 HG12 VAL 47 HG12 VAL 47 12.299 19.086 -3.930 311 HG13 VAL 47 HG13 VAL 47 12.638 19.259 -5.654 312 HG21 VAL 47 HG21 VAL 47 14.627 20.747 -5.035 313 HG22 VAL 47 HG22 VAL 47 14.207 20.524 -3.335 314 HG23 VAL 47 HG23 VAL 47 14.345 22.152 -4.003 315 H ASN 48 H ASN 48 10.472 23.298 -4.627 316 HA ASN 48 HA ASN 48 8.115 22.085 -5.341 317 HB2 ASN 48 HB2 ASN 48 8.833 24.890 -4.642 318 HB3 ASN 48 HB3 ASN 48 7.246 24.616 -5.342 319 HD21 ASN 48 HD22 ASN 48 9.247 24.264 -2.584 320 HD22 ASN 48 HD21 ASN 48 8.044 23.611 -1.524 321 H SER 49 H SER 49 9.721 24.725 -7.091 322 HA SER 49 HA SER 49 7.783 24.995 -9.098 323 HB2 SER 49 HB2 SER 49 9.539 26.680 -8.492 324 HB3 SER 49 HB3 SER 49 10.726 25.667 -9.312 325 HG SER 49 HG SER 49 8.660 26.044 -10.952 326 H GLN 50 H GLN 50 10.733 23.043 -8.951 327 HA GLN 50 HA GLN 50 10.564 22.218 -11.690 328 HB2 GLN 50 HB2 GLN 50 12.122 20.860 -9.492 329 HB3 GLN 50 HB3 GLN 50 12.449 20.824 -11.219 330 HG2 GLN 50 HG2 GLN 50 12.953 23.238 -11.138 331 HG3 GLN 50 HG3 GLN 50 12.709 23.203 -9.393 332 HE21 GLN 50 HE22 GLN 50 14.757 23.736 -8.803 333 HE22 GLN 50 HE21 GLN 50 16.130 22.725 -9.102 334 H MET 51 H MET 51 9.489 20.924 -8.620 335 HA MET 51 HA MET 51 8.831 18.322 -9.493 336 HB2 MET 51 HB2 MET 51 9.112 18.889 -7.134 337 HB3 MET 51 HB3 MET 51 7.726 19.965 -7.206 338 HG2 MET 51 HG2 MET 51 6.267 18.073 -7.635 339 HG3 MET 51 HG3 MET 51 7.650 16.984 -7.607 340 HE1 MET 51 HE1 MET 51 6.172 19.342 -3.909 341 HE2 MET 51 HE2 MET 51 5.586 19.595 -5.562 342 HE3 MET 51 HE3 MET 51 7.221 20.083 -5.121 343 H GLN 52 H GLN 52 7.208 21.392 -9.708 344 HA GLN 52 HA GLN 52 4.618 20.382 -10.334 345 HB2 GLN 52 HB2 GLN 52 5.915 23.048 -10.929 346 HB3 GLN 52 HB3 GLN 52 4.216 22.690 -11.212 347 HG2 GLN 52 HG2 GLN 52 3.818 22.387 -8.877 348 HG3 GLN 52 HG3 GLN 52 5.541 22.486 -8.518 349 HE21 GLN 52 HE22 GLN 52 5.251 24.176 -7.098 350 HE22 GLN 52 HE21 GLN 52 4.891 25.785 -7.623 351 H LYS 53 H LYS 53 7.545 20.631 -12.077 352 HA LYS 53 HA LYS 53 6.281 20.513 -14.699 353 HB2 LYS 53 HB2 LYS 53 9.215 20.307 -14.016 354 HB3 LYS 53 HB3 LYS 53 8.518 20.666 -15.584 355 HG2 LYS 53 HG2 LYS 53 8.036 22.487 -13.265 356 HG3 LYS 53 HG3 LYS 53 9.546 22.572 -14.167 357 HD2 LYS 53 HD2 LYS 53 8.181 24.176 -15.174 358 HD3 LYS 53 HD3 LYS 53 8.076 22.788 -16.252 359 HE2 LYS 53 HE2 LYS 53 5.922 22.190 -15.329 360 HE3 LYS 53 HE3 LYS 53 6.045 23.473 -14.127 361 HZ1 LYS 53 HZ1 LYS 53 5.903 23.859 -17.067 362 HZ2 LYS 53 HZ2 LYS 53 6.022 25.095 -15.919 363 HZ3 LYS 53 HZ3 LYS 53 4.640 24.124 -15.975 364 H MET 54 H MET 54 7.005 18.412 -12.265 365 HA MET 54 HA MET 54 8.147 16.212 -13.617 366 HB2 MET 54 HB2 MET 54 8.228 16.417 -11.215 367 HB3 MET 54 HB3 MET 54 6.475 16.368 -11.115 368 HG2 MET 54 HG2 MET 54 6.552 14.051 -12.020 369 HG3 MET 54 HG3 MET 54 8.314 14.122 -11.906 370 HE1 MET 54 HE1 MET 54 8.628 15.919 -9.307 371 HE2 MET 54 HE2 MET 54 9.609 14.470 -9.532 372 HE3 MET 54 HE3 MET 54 8.743 14.723 -8.017 373 H GLY 55 H GLY 55 4.816 16.436 -12.357 374 HA2 GLY 55 HA2 GLY 55 2.901 16.045 -13.804 375 HA3 GLY 55 HA3 GLY 55 3.909 14.952 -14.743 376 HA PRO 56 HA PRO 56 1.570 12.809 -11.094 377 HB2 PRO 56 HB2 PRO 56 -0.682 11.981 -12.371 378 HB3 PRO 56 HB3 PRO 56 -0.585 13.504 -11.478 379 HG2 PRO 56 HG2 PRO 56 -0.347 13.013 -14.424 380 HG3 PRO 56 HG3 PRO 56 -1.237 14.289 -13.571 381 HD2 PRO 56 HD2 PRO 56 1.175 14.727 -14.697 382 HD3 PRO 56 HD3 PRO 56 0.666 15.547 -13.209 383 H ASN 57 H ASN 57 1.731 10.680 -10.798 384 HA ASN 57 HA ASN 57 2.725 8.668 -11.120 385 HB2 ASN 57 HB2 ASN 57 1.337 7.165 -12.534 386 HB3 ASN 57 HB3 ASN 57 0.430 8.124 -11.376 387 HD21 ASN 57 HD22 ASN 57 -0.956 9.712 -12.095 388 HD22 ASN 57 HD21 ASN 57 -1.462 9.817 -13.747 389 HA PRO 58 HA PRO 58 5.240 9.434 -14.845 390 HB2 PRO 58 HB2 PRO 58 7.452 10.411 -13.610 391 HB3 PRO 58 HB3 PRO 58 6.079 11.415 -14.074 392 HG2 PRO 58 HG2 PRO 58 6.980 10.658 -11.414 393 HG3 PRO 58 HG3 PRO 58 5.781 11.873 -11.879 394 HD2 PRO 58 HD2 PRO 58 5.374 9.131 -10.948 395 HD3 PRO 58 HD3 PRO 58 4.195 10.450 -11.102 396 HA PRO 59 HA PRO 59 7.517 5.597 -14.517 397 HB2 PRO 59 HB2 PRO 59 9.336 6.671 -16.549 398 HB3 PRO 59 HB3 PRO 59 8.272 5.268 -16.631 399 HG2 PRO 59 HG2 PRO 59 7.809 7.566 -17.990 400 HG3 PRO 59 HG3 PRO 59 6.517 6.484 -17.446 401 HD2 PRO 59 HD2 PRO 59 7.392 9.095 -16.346 402 HD3 PRO 59 HD3 PRO 59 5.779 8.361 -16.372 403 H GLN 60 H GLN 60 9.657 4.815 -14.047 404 HA GLN 60 HA GLN 60 10.815 6.052 -11.894 405 HB2 GLN 60 HB2 GLN 60 12.561 4.411 -12.001 406 HB3 GLN 60 HB3 GLN 60 11.055 3.655 -12.494 407 HG2 GLN 60 HG2 GLN 60 13.217 4.611 -14.364 408 HG3 GLN 60 HG3 GLN 60 12.986 2.946 -13.843 409 HE21 GLN 60 HE22 GLN 60 11.221 1.781 -14.628 410 HE22 GLN 60 HE21 GLN 60 10.356 2.281 -16.041 411 H HIS 61 H HIS 61 11.819 6.344 -15.282 412 HA HIS 61 HA HIS 61 14.277 7.630 -14.659 413 HB2 HIS 61 HB2 HIS 61 14.426 8.147 -17.067 414 HB3 HIS 61 HB3 HIS 61 14.070 6.456 -16.761 415 HD1 HIS 61 HD1 HIS 61 12.044 5.499 -17.869 416 HD2 HIS 61 HD2 HIS 61 12.153 9.649 -18.053 417 HE1 HIS 61 HE1 HIS 61 10.184 6.157 -19.427 418 H ARG 62 H ARG 62 11.045 8.798 -14.842 419 HA ARG 62 HA ARG 62 11.728 11.536 -15.368 420 HB2 ARG 62 HB2 ARG 62 9.272 10.203 -14.235 421 HB3 ARG 62 HB3 ARG 62 9.405 11.951 -14.382 422 HG2 ARG 62 HG2 ARG 62 9.712 10.060 -16.702 423 HG3 ARG 62 HG3 ARG 62 8.181 10.801 -16.237 424 HD2 ARG 62 HD2 ARG 62 10.675 12.342 -16.932 425 HD3 ARG 62 HD3 ARG 62 9.375 11.990 -18.068 426 HE ARG 62 HE ARG 62 8.038 13.199 -16.097 427 HH11 ARG 62 HH11 ARG 62 11.005 14.057 -17.740 428 HH12 ARG 62 HH12 ARG 62 10.770 15.765 -17.545 429 HH21 ARG 62 HH21 ARG 62 7.711 15.456 -15.852 430 HH22 ARG 62 HH22 ARG 62 8.914 16.556 -16.458 431 H LEU 63 H LEU 63 11.320 9.538 -12.501 432 HA LEU 63 HA LEU 63 11.593 11.757 -10.690 433 HB2 LEU 63 HB2 LEU 63 11.698 8.781 -10.183 434 HB3 LEU 63 HB3 LEU 63 11.720 10.007 -8.932 435 HG LEU 63 HG LEU 63 9.511 9.334 -8.924 436 HD11 LEU 63 HD11 LEU 63 8.188 11.124 -9.844 437 HD12 LEU 63 HD12 LEU 63 9.500 11.580 -10.927 438 HD13 LEU 63 HD13 LEU 63 9.690 11.769 -9.183 439 HD21 LEU 63 HD21 LEU 63 8.173 8.852 -10.890 440 HD22 LEU 63 HD22 LEU 63 9.642 7.876 -10.881 441 HD23 LEU 63 HD23 LEU 63 9.525 9.285 -11.935 442 H ARG 64 H ARG 64 13.682 9.507 -12.270 443 HA ARG 64 HA ARG 64 15.931 9.957 -10.547 444 HB2 ARG 64 HB2 ARG 64 15.309 8.239 -12.772 445 HB3 ARG 64 HB3 ARG 64 16.874 9.003 -13.023 446 HG2 ARG 64 HG2 ARG 64 17.147 6.888 -11.886 447 HG3 ARG 64 HG3 ARG 64 17.602 8.216 -10.818 448 HD2 ARG 64 HD2 ARG 64 15.242 8.085 -9.891 449 HD3 ARG 64 HD3 ARG 64 15.090 6.562 -10.763 450 HE ARG 64 HE ARG 64 17.217 7.002 -8.755 451 HH11 ARG 64 HH11 ARG 64 14.588 5.071 -10.057 452 HH12 ARG 64 HH12 ARG 64 14.777 3.802 -8.895 453 HH21 ARG 64 HH21 ARG 64 17.487 5.350 -7.249 454 HH22 ARG 64 HH22 ARG 64 16.431 3.965 -7.277 455 H ALA 65 H ALA 65 14.440 12.083 -12.379 456 HA ALA 65 HA ALA 65 16.943 13.430 -13.148 457 HB1 ALA 65 HB1 ALA 65 14.131 13.985 -14.094 458 HB2 ALA 65 HB2 ALA 65 15.364 13.103 -14.996 459 HB3 ALA 65 HB3 ALA 65 15.592 14.814 -14.632 460 H MET 66 H MET 66 14.820 13.222 -10.685 461 HA MET 66 HA MET 66 14.827 16.111 -10.103 462 HB2 MET 66 HB2 MET 66 13.031 13.886 -9.166 463 HB3 MET 66 HB3 MET 66 13.097 15.433 -8.337 464 HG2 MET 66 HG2 MET 66 12.381 15.033 -11.232 465 HG3 MET 66 HG3 MET 66 11.241 15.308 -9.920 466 HE1 MET 66 HE1 MET 66 12.193 18.973 -8.815 467 HE2 MET 66 HE2 MET 66 12.820 17.465 -8.153 468 HE3 MET 66 HE3 MET 66 11.103 17.614 -8.530 469 H ASN 67 H ASN 67 15.928 13.024 -9.052 470 HA ASN 67 HA ASN 67 16.751 13.478 -6.458 471 HB2 ASN 67 HB2 ASN 67 18.752 11.959 -7.146 472 HB3 ASN 67 HB3 ASN 67 17.123 11.301 -7.222 473 HD21 ASN 67 HD22 ASN 67 17.917 9.738 -8.709 474 HD22 ASN 67 HD21 ASN 67 18.166 10.169 -10.371 475 H THR 68 H THR 68 18.690 14.062 -9.391 476 HA THR 68 HA THR 68 20.789 15.405 -8.098 477 HB THR 68 HB THR 68 19.921 15.784 -10.966 478 HG1 THR 68 HG1 THR 68 21.651 14.004 -11.131 479 HG21 THR 68 HG21 THR 68 21.672 17.314 -10.185 480 HG22 THR 68 HG22 THR 68 22.307 16.164 -11.360 481 HG23 THR 68 HG23 THR 68 22.632 15.938 -9.643 482 H ALA 69 H ALA 69 17.737 16.504 -9.417 483 HA ALA 69 HA ALA 69 18.219 19.230 -9.629 484 HB1 ALA 69 HB1 ALA 69 16.199 18.042 -10.453 485 HB2 ALA 69 HB2 ALA 69 15.843 19.526 -9.571 486 HB3 ALA 69 HB3 ALA 69 15.618 17.962 -8.790 487 H MET 70 H MET 70 16.875 17.437 -6.854 488 HA MET 70 HA MET 70 16.907 19.729 -5.143 489 HB2 MET 70 HB2 MET 70 15.390 17.769 -4.823 490 HB3 MET 70 HB3 MET 70 16.787 16.809 -4.365 491 HG2 MET 70 HG2 MET 70 17.175 18.176 -2.435 492 HG3 MET 70 HG3 MET 70 15.910 19.300 -2.927 493 HE1 MET 70 HE1 MET 70 16.747 15.758 -1.505 494 HE2 MET 70 HE2 MET 70 15.884 15.320 -2.981 495 HE3 MET 70 HE3 MET 70 15.156 15.002 -1.405 496 H ALA 71 H ALA 71 18.975 16.908 -5.585 497 HA ALA 71 HA ALA 71 20.782 17.201 -3.539 498 HB1 ALA 71 HB1 ALA 71 22.378 15.991 -4.910 499 HB2 ALA 71 HB2 ALA 71 21.430 16.349 -6.353 500 HB3 ALA 71 HB3 ALA 71 20.762 15.310 -5.097 501 H ALA 72 H ALA 72 20.919 18.732 -6.741 502 HA ALA 72 HA ALA 72 23.435 19.953 -6.402 503 HB1 ALA 72 HB1 ALA 72 21.169 20.774 -8.209 504 HB2 ALA 72 HB2 ALA 72 22.404 19.569 -8.581 505 HB3 ALA 72 HB3 ALA 72 22.857 21.260 -8.366 506 H GLU 73 H GLU 73 20.203 20.988 -5.521 507 HA GLU 73 HA GLU 73 20.953 23.732 -5.122 508 HB2 GLU 73 HB2 GLU 73 18.488 22.222 -4.238 509 HB3 GLU 73 HB3 GLU 73 18.700 23.964 -4.138 510 HG2 GLU 73 HG2 GLU 73 18.778 22.395 -6.699 511 HG3 GLU 73 HG3 GLU 73 17.348 23.213 -6.073 512 H VAL 74 H VAL 74 20.489 20.897 -3.078 513 HA VAL 74 HA VAL 74 20.989 22.260 -0.618 514 HB VAL 74 HB VAL 74 21.308 19.307 -1.217 515 HG11 VAL 74 HG11 VAL 74 22.363 19.985 0.876 516 HG12 VAL 74 HG12 VAL 74 20.935 18.993 1.179 517 HG13 VAL 74 HG13 VAL 74 20.857 20.742 1.399 518 HG21 VAL 74 HG21 VAL 74 19.018 19.062 -0.360 519 HG22 VAL 74 HG22 VAL 74 19.073 20.052 -1.819 520 HG23 VAL 74 HG23 VAL 74 18.883 20.817 -0.242 521 H ALA 75 H ALA 75 22.935 20.989 -3.143 522 HA ALA 75 HA ALA 75 25.348 20.548 -1.760 523 HB1 ALA 75 HB1 ALA 75 24.907 19.677 -4.004 524 HB2 ALA 75 HB2 ALA 75 26.397 20.621 -3.961 525 HB3 ALA 75 HB3 ALA 75 24.930 21.319 -4.646 526 H GLU 76 H GLU 76 23.820 23.440 -2.944 527 HA GLU 76 HA GLU 76 26.072 25.066 -3.269 528 HB2 GLU 76 HB2 GLU 76 23.232 25.790 -2.565 529 HB3 GLU 76 HB3 GLU 76 24.469 26.963 -2.999 530 HG2 GLU 76 HG2 GLU 76 23.419 24.744 -4.739 531 HG3 GLU 76 HG3 GLU 76 23.070 26.464 -4.905 532 H VAL 77 H VAL 77 24.039 24.541 -0.399 533 HA VAL 77 HA VAL 77 25.419 26.483 1.168 534 HB VAL 77 HB VAL 77 24.228 25.574 3.095 535 HG11 VAL 77 HG11 VAL 77 22.490 25.814 0.644 536 HG12 VAL 77 HG12 VAL 77 23.061 27.142 1.656 537 HG13 VAL 77 HG13 VAL 77 21.935 25.952 2.312 538 HG21 VAL 77 HG21 VAL 77 22.674 23.686 2.844 539 HG22 VAL 77 HG22 VAL 77 24.351 23.201 2.593 540 HG23 VAL 77 HG23 VAL 77 23.281 23.419 1.209 541 H VAL 78 H VAL 78 25.985 23.171 0.394 542 HA VAL 78 HA VAL 78 27.709 22.643 2.639 543 HB VAL 78 HB VAL 78 27.419 21.060 0.077 544 HG11 VAL 78 HG11 VAL 78 29.448 20.532 1.315 545 HG12 VAL 78 HG12 VAL 78 28.298 19.196 1.394 546 HG13 VAL 78 HG13 VAL 78 28.498 20.271 2.778 547 HG21 VAL 78 HG21 VAL 78 25.987 20.716 2.710 548 HG22 VAL 78 HG22 VAL 78 25.862 19.641 1.320 549 HG23 VAL 78 HG23 VAL 78 25.268 21.299 1.209 550 H ALA 79 H ALA 79 28.047 23.824 -0.619 551 HA ALA 79 HA ALA 79 30.824 23.406 -0.937 552 HB1 ALA 79 HB1 ALA 79 30.670 25.050 -2.741 553 HB2 ALA 79 HB2 ALA 79 29.058 25.513 -2.185 554 HB3 ALA 79 HB3 ALA 79 29.343 23.889 -2.815 555 H THR 80 H THR 80 28.999 25.730 0.840 556 HA THR 80 HA THR 80 31.269 27.524 1.160 557 HB THR 80 HB THR 80 28.626 27.804 2.576 558 HG1 THR 80 HG1 THR 80 27.956 28.981 0.654 559 HG21 THR 80 HG21 THR 80 30.615 29.796 1.469 560 HG22 THR 80 HG22 THR 80 30.396 29.381 3.169 561 HG23 THR 80 HG23 THR 80 29.110 30.206 2.289 562 H SER 81 H SER 81 30.727 24.651 2.383 563 HA SER 81 HA SER 81 31.073 25.298 5.210 564 HB2 SER 81 HB2 SER 81 30.755 22.610 3.846 565 HB3 SER 81 HB3 SER 81 30.755 22.895 5.588 566 HG SER 81 HG SER 81 28.911 24.106 3.806 567 HA PRO 82 HA PRO 82 35.548 24.955 4.849 568 HB2 PRO 82 HB2 PRO 82 35.247 24.475 7.770 569 HB3 PRO 82 HB3 PRO 82 36.277 25.634 6.922 570 HG2 PRO 82 HG2 PRO 82 34.078 26.444 8.193 571 HG3 PRO 82 HG3 PRO 82 34.553 27.163 6.642 572 HD2 PRO 82 HD2 PRO 82 32.416 25.157 7.229 573 HD3 PRO 82 HD3 PRO 82 32.415 26.507 6.074 574 HA PRO 83 HA PRO 83 36.241 20.633 4.391 575 HB2 PRO 83 HB2 PRO 83 38.800 21.181 5.834 576 HB3 PRO 83 HB3 PRO 83 38.526 20.308 4.321 577 HG2 PRO 83 HG2 PRO 83 39.459 22.798 4.293 578 HG3 PRO 83 HG3 PRO 83 38.276 22.256 3.089 579 HD2 PRO 83 HD2 PRO 83 37.904 24.033 5.443 580 HD3 PRO 83 HD3 PRO 83 37.071 24.037 3.879 581 H GLN 84 H GLN 84 37.184 21.921 7.587 582 HA GLN 84 HA GLN 84 37.014 19.377 8.862 583 HB2 GLN 84 HB2 GLN 84 38.466 21.261 9.614 584 HB3 GLN 84 HB3 GLN 84 37.021 22.125 10.115 585 HG2 GLN 84 HG2 GLN 84 38.092 21.077 11.998 586 HG3 GLN 84 HG3 GLN 84 36.511 20.358 11.710 587 HE21 GLN 84 HE22 GLN 84 39.319 19.635 9.753 588 HE22 GLN 84 HE21 GLN 84 39.504 18.002 10.286 589 H SER 85 H SER 85 34.838 22.126 8.501 590 HA SER 85 HA SER 85 32.885 21.087 10.338 591 HB2 SER 85 HB2 SER 85 32.475 23.247 8.261 592 HB3 SER 85 HB3 SER 85 31.580 23.009 9.761 593 HG SER 85 HG SER 85 32.978 24.476 10.418 594 H TYR 86 H TYR 86 33.708 20.571 7.101 595 HA TYR 86 HA TYR 86 31.312 20.206 5.773 596 HB2 TYR 86 HB2 TYR 86 33.544 20.213 4.701 597 HB3 TYR 86 HB3 TYR 86 33.866 18.627 5.390 598 HD1 TYR 86 HD1 TYR 86 32.374 16.687 4.685 599 HD2 TYR 86 HD2 TYR 86 32.418 20.430 2.662 600 HE1 TYR 86 HE1 TYR 86 31.342 15.620 2.725 601 HE2 TYR 86 HE2 TYR 86 31.394 19.384 0.693 602 HH TYR 86 HH TYR 86 31.289 17.030 -0.296 603 H SER 87 H SER 87 33.153 17.868 7.698 604 HA SER 87 HA SER 87 31.738 15.568 7.119 605 HB2 SER 87 HB2 SER 87 32.935 16.316 9.799 606 HB3 SER 87 HB3 SER 87 32.621 14.682 9.207 607 HG SER 87 HG SER 87 34.291 14.807 7.861 608 H ALA 88 H ALA 88 30.967 18.136 9.408 609 HA ALA 88 HA ALA 88 28.799 16.683 10.616 610 HB1 ALA 88 HB1 ALA 88 30.020 18.341 11.904 611 HB2 ALA 88 HB2 ALA 88 28.321 18.795 11.773 612 HB3 ALA 88 HB3 ALA 88 29.531 19.606 10.778 613 H VAL 89 H VAL 89 29.217 18.945 8.009 614 HA VAL 89 HA VAL 89 26.406 19.480 7.655 615 HB VAL 89 HB VAL 89 28.715 20.022 5.775 616 HG11 VAL 89 HG11 VAL 89 26.521 20.125 4.684 617 HG12 VAL 89 HG12 VAL 89 27.260 21.722 4.794 618 HG13 VAL 89 HG13 VAL 89 25.968 21.270 5.905 619 HG21 VAL 89 HG21 VAL 89 28.716 22.288 6.710 620 HG22 VAL 89 HG22 VAL 89 29.092 21.075 7.934 621 HG23 VAL 89 HG23 VAL 89 27.485 21.803 7.876 622 H LEU 90 H LEU 90 28.503 16.964 6.855 623 HA LEU 90 HA LEU 90 26.846 16.001 4.654 624 HB2 LEU 90 HB2 LEU 90 29.238 15.776 4.417 625 HB3 LEU 90 HB3 LEU 90 29.374 14.991 5.962 626 HG LEU 90 HG LEU 90 28.823 12.953 5.142 627 HD11 LEU 90 HD11 LEU 90 27.396 12.495 3.213 628 HD12 LEU 90 HD12 LEU 90 27.227 14.224 2.932 629 HD13 LEU 90 HD13 LEU 90 26.570 13.505 4.397 630 HD21 LEU 90 HD21 LEU 90 30.777 13.808 3.890 631 HD22 LEU 90 HD22 LEU 90 29.688 14.241 2.571 632 HD23 LEU 90 HD23 LEU 90 29.878 12.553 3.037 633 H ASN 91 H ASN 91 28.049 14.807 7.769 634 HA ASN 91 HA ASN 91 26.464 12.551 8.007 635 HB2 ASN 91 HB2 ASN 91 27.572 14.361 10.150 636 HB3 ASN 91 HB3 ASN 91 26.777 12.831 10.504 637 HD21 ASN 91 HD22 ASN 91 29.512 13.633 11.040 638 HD22 ASN 91 HD21 ASN 91 30.522 12.500 10.212 639 H THR 92 H THR 92 25.688 15.834 9.172 640 HA THR 92 HA THR 92 23.296 15.173 10.471 641 HB THR 92 HB THR 92 23.996 17.800 9.145 642 HG1 THR 92 HG1 THR 92 25.535 17.609 10.636 643 HG21 THR 92 HG21 THR 92 22.441 18.786 10.754 644 HG22 THR 92 HG22 THR 92 22.057 17.181 11.379 645 HG23 THR 92 HG23 THR 92 21.616 17.613 9.726 646 H ILE 93 H ILE 93 23.803 16.416 7.174 647 HA ILE 93 HA ILE 93 21.118 16.589 6.426 648 HB ILE 93 HB ILE 93 23.538 16.076 4.693 649 HG12 ILE 93 HG12 ILE 93 23.674 18.141 6.007 650 HG13 ILE 93 HG13 ILE 93 23.488 18.484 4.294 651 HG21 ILE 93 HG21 ILE 93 20.801 17.054 3.893 652 HG22 ILE 93 HG22 ILE 93 21.486 15.472 3.522 653 HG23 ILE 93 HG23 ILE 93 22.208 16.928 2.838 654 HD11 ILE 93 HD11 ILE 93 22.141 19.994 5.602 655 HD12 ILE 93 HD12 ILE 93 21.340 18.637 6.393 656 HD13 ILE 93 HD13 ILE 93 21.097 18.920 4.669 657 H GLY 94 H GLY 94 23.442 13.945 6.071 658 HA2 GLY 94 HA2 GLY 94 21.860 12.167 4.610 659 HA3 GLY 94 HA3 GLY 94 23.149 11.693 5.699 660 H ALA 95 H ALA 95 22.109 12.585 8.089 661 HA ALA 95 HA ALA 95 20.340 10.470 8.758 662 HB1 ALA 95 HB1 ALA 95 20.320 11.444 10.994 663 HB2 ALA 95 HB2 ALA 95 21.092 12.903 10.373 664 HB3 ALA 95 HB3 ALA 95 21.963 11.369 10.355 665 H CYS 96 H CYS 96 19.925 13.969 8.390 666 HA CYS 96 HA CYS 96 17.237 14.127 9.134 667 HB2 CYS 96 HB2 CYS 96 18.829 15.822 7.204 668 HB3 CYS 96 HB3 CYS 96 17.206 16.226 7.751 669 H LEU 97 H LEU 97 18.716 13.497 5.972 670 HA LEU 97 HA LEU 97 16.328 13.576 4.474 671 HB2 LEU 97 HB2 LEU 97 18.840 13.587 3.748 672 HB3 LEU 97 HB3 LEU 97 18.668 11.847 3.733 673 HG LEU 97 HG LEU 97 18.432 12.943 1.496 674 HD11 LEU 97 HD11 LEU 97 16.465 11.666 0.793 675 HD12 LEU 97 HD12 LEU 97 16.021 11.432 2.483 676 HD13 LEU 97 HD13 LEU 97 17.514 10.735 1.859 677 HD21 LEU 97 HD21 LEU 97 16.399 14.127 0.952 678 HD22 LEU 97 HD22 LEU 97 17.245 14.953 2.260 679 HD23 LEU 97 HD23 LEU 97 15.828 13.965 2.612 680 H ARG 98 H ARG 98 18.060 10.917 6.049 681 HA ARG 98 HA ARG 98 16.428 8.806 5.213 682 HB2 ARG 98 HB2 ARG 98 18.496 8.283 6.249 683 HB3 ARG 98 HB3 ARG 98 18.115 9.239 7.672 684 HG2 ARG 98 HG2 ARG 98 16.326 6.956 7.107 685 HG3 ARG 98 HG3 ARG 98 17.975 6.575 7.609 686 HD2 ARG 98 HD2 ARG 98 17.708 7.936 9.600 687 HD3 ARG 98 HD3 ARG 98 16.092 8.407 9.086 688 HE ARG 98 HE ARG 98 15.671 5.860 9.233 689 HH11 ARG 98 HH11 ARG 98 17.759 7.694 11.356 690 HH12 ARG 98 HH12 ARG 98 17.482 6.672 12.724 691 HH21 ARG 98 HH21 ARG 98 15.299 4.513 11.037 692 HH22 ARG 98 HH22 ARG 98 16.082 4.862 12.546 693 H GLU 99 H GLU 99 16.107 11.022 7.929 694 HA GLU 99 HA GLU 99 13.791 9.785 9.041 695 HB2 GLU 99 HB2 GLU 99 14.926 12.568 9.339 696 HB3 GLU 99 HB3 GLU 99 13.580 11.948 10.282 697 HG2 GLU 99 HG2 GLU 99 16.310 10.703 10.237 698 HG3 GLU 99 HG3 GLU 99 15.782 11.900 11.418 699 H SER 100 H SER 100 14.271 12.798 7.263 700 HA SER 100 HA SER 100 11.658 13.664 7.202 701 HB2 SER 100 HB2 SER 100 12.348 14.993 5.197 702 HB3 SER 100 HB3 SER 100 13.458 15.120 6.560 703 HG SER 100 HG SER 100 13.772 13.735 4.131 704 H MET 101 H MET 101 13.258 11.425 4.993 705 HA MET 101 HA MET 101 11.306 11.383 2.989 706 HB2 MET 101 HB2 MET 101 13.599 10.440 2.789 707 HB3 MET 101 HB3 MET 101 13.087 9.094 3.804 708 HG2 MET 101 HG2 MET 101 11.402 8.509 2.207 709 HG3 MET 101 HG3 MET 101 11.852 9.881 1.203 710 HE1 MET 101 HE1 MET 101 12.200 8.742 -0.853 711 HE2 MET 101 HE2 MET 101 11.582 7.259 -0.129 712 HE3 MET 101 HE3 MET 101 13.056 7.217 -1.103 713 H MET 102 H MET 102 11.704 9.240 5.838 714 HA MET 102 HA MET 102 9.372 7.750 5.034 715 HB2 MET 102 HB2 MET 102 9.750 6.326 6.884 716 HB3 MET 102 HB3 MET 102 11.319 6.691 6.192 717 HG2 MET 102 HG2 MET 102 11.809 8.223 7.969 718 HG3 MET 102 HG3 MET 102 10.174 8.058 8.613 719 HE1 MET 102 HE1 MET 102 9.922 4.777 7.980 720 HE2 MET 102 HE2 MET 102 9.194 5.640 9.335 721 HE3 MET 102 HE3 MET 102 10.208 4.227 9.634 722 H GLN 103 H GLN 103 10.058 10.395 7.169 723 HA GLN 103 HA GLN 103 7.600 10.299 8.609 724 HB2 GLN 103 HB2 GLN 103 9.759 12.286 8.257 725 HB3 GLN 103 HB3 GLN 103 8.178 12.944 8.645 726 HG2 GLN 103 HG2 GLN 103 9.316 12.654 10.691 727 HG3 GLN 103 HG3 GLN 103 8.092 11.392 10.602 728 HE21 GLN 103 HE22 GLN 103 11.454 12.121 10.675 729 HE22 GLN 103 HE21 GLN 103 12.033 10.498 10.832 730 H ALA 104 H ALA 104 8.272 11.006 5.380 731 HA ALA 104 HA ALA 104 6.124 12.857 4.945 732 HB1 ALA 104 HB1 ALA 104 8.043 12.835 3.445 733 HB2 ALA 104 HB2 ALA 104 6.558 12.481 2.558 734 HB3 ALA 104 HB3 ALA 104 7.670 11.177 2.972 735 H THR 105 H THR 105 6.572 9.592 3.597 736 HA THR 105 HA THR 105 4.310 8.379 4.620 737 HB THR 105 HB THR 105 2.924 10.010 3.487 738 HG1 THR 105 HG1 THR 105 1.611 8.428 3.017 739 HG21 THR 105 HG21 THR 105 4.495 10.688 1.728 740 HG22 THR 105 HG22 THR 105 2.921 10.264 1.056 741 HG23 THR 105 HG23 THR 105 4.269 9.134 0.927 742 H GLY 106 H GLY 106 6.426 8.761 1.839 743 HA2 GLY 106 HA2 GLY 106 5.912 6.098 0.845 744 HA3 GLY 106 HA3 GLY 106 7.041 7.270 0.179 745 H SER 107 H SER 107 7.072 6.279 3.550 746 HA SER 107 HA SER 107 8.734 5.510 4.850 747 HB2 SER 107 HB2 SER 107 9.705 3.319 4.182 748 HB3 SER 107 HB3 SER 107 7.952 3.362 4.043 749 HG SER 107 HG SER 107 8.962 4.131 1.713 750 H VAL 108 H VAL 108 11.216 4.387 4.354 751 HA VAL 108 HA VAL 108 12.573 6.541 2.913 752 HB VAL 108 HB VAL 108 13.059 6.870 5.186 753 HG11 VAL 108 HG11 VAL 108 13.757 3.958 5.464 754 HG12 VAL 108 HG12 VAL 108 12.246 4.703 5.995 755 HG13 VAL 108 HG13 VAL 108 13.774 5.180 6.738 756 HG21 VAL 108 HG21 VAL 108 15.351 5.325 3.989 757 HG22 VAL 108 HG22 VAL 108 15.466 6.408 5.375 758 HG23 VAL 108 HG23 VAL 108 15.023 7.047 3.793 759 H ASP 109 H ASP 109 13.249 5.796 1.074 760 HA ASP 109 HA ASP 109 13.664 3.022 0.543 761 HB2 ASP 109 HB2 ASP 109 12.779 4.568 -1.161 762 HB3 ASP 109 HB3 ASP 109 14.307 5.439 -1.161 763 H ASN 110 H ASN 110 15.599 2.002 -0.103 764 HA ASN 110 HA ASN 110 17.767 2.755 1.628 765 HB2 ASN 110 HB2 ASN 110 17.503 0.419 -0.277 766 HB3 ASN 110 HB3 ASN 110 18.776 0.614 0.924 767 HD21 ASN 110 HD22 ASN 110 15.512 -0.293 0.344 768 HD22 ASN 110 HD21 ASN 110 15.138 -0.805 1.955 769 H ALA 111 H ALA 111 17.063 3.066 -1.738 770 HA ALA 111 HA ALA 111 19.904 3.524 -2.371 771 HB1 ALA 111 HB1 ALA 111 18.701 1.927 -3.794 772 HB2 ALA 111 HB2 ALA 111 19.249 3.333 -4.707 773 HB3 ALA 111 HB3 ALA 111 17.556 3.191 -4.240 774 H PHE 112 H PHE 112 16.694 5.030 -2.662 775 HA PHE 112 HA PHE 112 17.460 7.313 -4.066 776 HB2 PHE 112 HB2 PHE 112 15.124 6.732 -3.763 777 HB3 PHE 112 HB3 PHE 112 15.254 6.999 -2.029 778 HD1 PHE 112 HD2 PHE 112 15.401 8.694 -5.317 779 HD2 PHE 112 HD1 PHE 112 14.965 9.143 -1.105 780 HE1 PHE 112 HE2 PHE 112 14.791 11.057 -5.631 781 HE2 PHE 112 HE1 PHE 112 14.355 11.503 -1.416 782 HZ PHE 112 HZ PHE 112 14.270 12.462 -3.676 783 H THR 113 H THR 113 17.363 6.794 -0.561 784 HA THR 113 HA THR 113 18.095 9.331 0.308 785 HB THR 113 HB THR 113 19.224 8.004 2.228 786 HG1 THR 113 HG1 THR 113 17.789 5.765 1.547 787 HG21 THR 113 HG21 THR 113 16.983 8.947 2.434 788 HG22 THR 113 HG22 THR 113 17.045 7.350 3.177 789 HG23 THR 113 HG23 THR 113 16.302 7.555 1.590 790 H ASN 114 H ASN 114 20.183 6.545 -0.274 791 HA ASN 114 HA ASN 114 22.663 7.788 -0.021 792 HB2 ASN 114 HB2 ASN 114 22.670 5.453 0.020 793 HB3 ASN 114 HB3 ASN 114 21.639 5.327 -1.395 794 HD21 ASN 114 HD22 ASN 114 22.534 5.251 -3.388 795 HD22 ASN 114 HD21 ASN 114 24.233 5.155 -3.671 796 H GLU 115 H GLU 115 20.588 7.388 -2.845 797 HA GLU 115 HA GLU 115 22.272 8.127 -4.877 798 HB2 GLU 115 HB2 GLU 115 19.851 7.160 -4.764 799 HB3 GLU 115 HB3 GLU 115 19.362 8.847 -4.815 800 HG2 GLU 115 HG2 GLU 115 20.394 9.146 -6.912 801 HG3 GLU 115 HG3 GLU 115 21.137 7.554 -6.846 802 H VAL 116 H VAL 116 19.873 10.189 -3.217 803 HA VAL 116 HA VAL 116 20.731 12.556 -4.538 804 HB VAL 116 HB VAL 116 18.449 12.240 -3.634 805 HG11 VAL 116 HG11 VAL 116 18.970 11.179 -1.520 806 HG12 VAL 116 HG12 VAL 116 17.990 12.627 -1.276 807 HG13 VAL 116 HG13 VAL 116 19.723 12.669 -0.947 808 HG21 VAL 116 HG21 VAL 116 18.201 14.536 -2.718 809 HG22 VAL 116 HG22 VAL 116 19.136 14.454 -4.210 810 HG23 VAL 116 HG23 VAL 116 19.961 14.651 -2.664 811 H MET 117 H MET 117 21.456 11.147 -1.390 812 HA MET 117 HA MET 117 22.739 13.316 -0.215 813 HB2 MET 117 HB2 MET 117 22.937 10.357 0.169 814 HB3 MET 117 HB3 MET 117 24.027 11.428 1.037 815 HG2 MET 117 HG2 MET 117 21.025 11.374 1.176 816 HG3 MET 117 HG3 MET 117 22.169 10.941 2.444 817 HE1 MET 117 HE1 MET 117 24.304 13.397 1.700 818 HE2 MET 117 HE2 MET 117 24.009 12.797 3.333 819 HE3 MET 117 HE3 MET 117 23.865 14.520 2.987 820 H GLN 118 H GLN 118 24.216 10.635 -2.054 821 HA GLN 118 HA GLN 118 26.851 11.605 -1.810 822 HB2 GLN 118 HB2 GLN 118 26.297 9.279 -2.443 823 HB3 GLN 118 HB3 GLN 118 25.670 9.852 -3.980 824 HG2 GLN 118 HG2 GLN 118 27.877 8.923 -4.267 825 HG3 GLN 118 HG3 GLN 118 27.900 10.655 -4.588 826 HE21 GLN 118 HE22 GLN 118 30.110 10.769 -4.223 827 HE22 GLN 118 HE21 GLN 118 30.786 10.680 -2.634 828 H LEU 119 H LEU 119 24.343 12.127 -4.234 829 HA LEU 119 HA LEU 119 25.858 13.599 -6.076 830 HB2 LEU 119 HB2 LEU 119 22.933 13.538 -5.399 831 HB3 LEU 119 HB3 LEU 119 23.560 14.631 -6.617 832 HG LEU 119 HG LEU 119 24.117 11.687 -6.797 833 HD11 LEU 119 HD11 LEU 119 21.717 11.814 -6.587 834 HD12 LEU 119 HD12 LEU 119 22.127 11.530 -8.279 835 HD13 LEU 119 HD13 LEU 119 21.648 13.140 -7.746 836 HD21 LEU 119 HD21 LEU 119 24.235 12.217 -9.193 837 HD22 LEU 119 HD22 LEU 119 25.382 13.164 -8.248 838 HD23 LEU 119 HD23 LEU 119 23.891 13.906 -8.826 839 H VAL 120 H VAL 120 23.984 14.654 -3.232 840 HA VAL 120 HA VAL 120 24.326 17.399 -3.438 841 HB VAL 120 HB VAL 120 24.314 15.690 -0.939 842 HG11 VAL 120 HG11 VAL 120 23.768 17.728 0.292 843 HG12 VAL 120 HG12 VAL 120 23.950 18.676 -1.182 844 HG13 VAL 120 HG13 VAL 120 25.347 17.863 -0.480 845 HG21 VAL 120 HG21 VAL 120 22.279 15.563 -2.299 846 HG22 VAL 120 HG22 VAL 120 22.132 17.319 -2.221 847 HG23 VAL 120 HG23 VAL 120 21.989 16.358 -0.750 848 H LYS 121 H LYS 121 26.540 14.981 -2.072 849 HA LYS 121 HA LYS 121 28.381 16.937 -1.111 850 HB2 LYS 121 HB2 LYS 121 29.063 14.059 -1.638 851 HB3 LYS 121 HB3 LYS 121 29.721 15.126 -0.416 852 HG2 LYS 121 HG2 LYS 121 27.169 13.595 -0.433 853 HG3 LYS 121 HG3 LYS 121 28.377 13.754 0.839 854 HD2 LYS 121 HD2 LYS 121 26.435 15.894 -0.025 855 HD3 LYS 121 HD3 LYS 121 26.258 14.873 1.396 856 HE2 LYS 121 HE2 LYS 121 28.363 15.818 2.293 857 HE3 LYS 121 HE3 LYS 121 28.464 16.872 0.887 858 HZ1 LYS 121 HZ1 LYS 121 26.289 16.875 2.907 859 HZ2 LYS 121 HZ2 LYS 121 26.359 17.872 1.546 860 HZ3 LYS 121 HZ3 LYS 121 27.517 18.027 2.769 861 H MET 122 H MET 122 28.325 14.727 -3.837 862 HA MET 122 HA MET 122 30.825 15.393 -4.920 863 HB2 MET 122 HB2 MET 122 29.616 13.358 -5.502 864 HB3 MET 122 HB3 MET 122 28.340 14.305 -6.247 865 HG2 MET 122 HG2 MET 122 29.859 15.057 -7.969 866 HG3 MET 122 HG3 MET 122 31.194 14.203 -7.196 867 HE1 MET 122 HE1 MET 122 27.656 13.782 -8.833 868 HE2 MET 122 HE2 MET 122 27.516 12.772 -7.394 869 HE3 MET 122 HE3 MET 122 27.536 12.031 -8.994 870 H LEU 123 H LEU 123 27.733 16.974 -5.147 871 HA LEU 123 HA LEU 123 28.644 18.654 -7.352 872 HB2 LEU 123 HB2 LEU 123 25.990 18.507 -5.928 873 HB3 LEU 123 HB3 LEU 123 26.341 19.590 -7.262 874 HG LEU 123 HG LEU 123 26.468 16.580 -7.453 875 HD11 LEU 123 HD11 LEU 123 24.360 16.730 -8.662 876 HD12 LEU 123 HD12 LEU 123 24.295 18.465 -8.351 877 HD13 LEU 123 HD13 LEU 123 24.186 17.324 -7.010 878 HD21 LEU 123 HD21 LEU 123 27.884 17.704 -9.067 879 HD22 LEU 123 HD22 LEU 123 26.550 18.755 -9.541 880 HD23 LEU 123 HD23 LEU 123 26.471 17.025 -9.874 881 H SER 124 H SER 124 29.393 18.714 -4.272 882 HA SER 124 HA SER 124 29.226 21.652 -4.141 883 HB2 SER 124 HB2 SER 124 29.291 21.310 -1.590 884 HB3 SER 124 HB3 SER 124 27.772 20.980 -2.419 885 HG SER 124 HG SER 124 28.115 18.824 -2.219 886 H ALA 125 H ALA 125 30.961 18.951 -2.602 887 HA ALA 125 HA ALA 125 33.484 20.036 -3.491 888 HB1 ALA 125 HB1 ALA 125 33.060 21.314 -1.436 889 HB2 ALA 125 HB2 ALA 125 34.462 20.254 -1.286 890 HB3 ALA 125 HB3 ALA 125 32.930 19.802 -0.539 891 H ASP 126 H ASP 126 34.257 18.267 -4.374 892 HA ASP 126 HA ASP 126 34.051 15.726 -2.915 893 HB2 ASP 126 HB2 ASP 126 33.065 15.768 -5.216 894 HB3 ASP 126 HB3 ASP 126 34.662 16.143 -5.855 895 H SER 127 H SER 127 35.789 16.651 -1.598 896 HA SER 127 HA SER 127 38.352 15.742 -2.564 897 HB2 SER 127 HB2 SER 127 38.041 18.589 -1.589 898 HB3 SER 127 HB3 SER 127 39.549 17.814 -2.079 899 HG SER 127 HG SER 127 37.928 17.481 -4.094 900 H ALA 128 H ALA 128 36.338 16.946 -0.023 901 HA ALA 128 HA ALA 128 38.228 16.341 2.065 902 HB1 ALA 128 HB1 ALA 128 35.315 17.099 2.267 903 HB2 ALA 128 HB2 ALA 128 36.675 18.220 2.302 904 HB3 ALA 128 HB3 ALA 128 36.471 17.041 3.597 905 H ASN 129 H ASN 129 38.653 14.163 1.965 906 HA ASN 129 HA ASN 129 36.406 12.310 2.262 907 HB2 ASN 129 HB2 ASN 129 38.237 11.780 0.637 908 HB3 ASN 129 HB3 ASN 129 39.358 11.679 1.991 909 HD21 ASN 129 HD22 ASN 129 36.751 10.158 0.313 910 HD22 ASN 129 HD21 ASN 129 36.818 8.644 1.147 911 H GLU 130 H GLU 130 36.087 11.097 4.095 912 HA GLU 130 HA GLU 130 36.816 12.242 6.547 913 HB2 GLU 130 HB2 GLU 130 35.611 9.565 5.857 914 HB3 GLU 130 HB3 GLU 130 35.835 10.114 7.514 915 HG2 GLU 130 HG2 GLU 130 34.244 11.610 5.444 916 HG3 GLU 130 HG3 GLU 130 33.549 10.472 6.598 917 H VAL 131 H VAL 131 38.928 12.358 7.027 918 HA VAL 131 HA VAL 131 40.785 10.256 6.647 919 HB VAL 131 HB VAL 131 41.631 12.487 6.744 920 HG11 VAL 131 HG11 VAL 131 39.921 13.522 8.129 921 HG12 VAL 131 HG12 VAL 131 41.534 13.887 8.747 922 HG13 VAL 131 HG13 VAL 131 40.536 12.672 9.547 923 HG21 VAL 131 HG21 VAL 131 43.367 12.300 8.477 924 HG22 VAL 131 HG22 VAL 131 43.142 10.798 7.583 925 HG23 VAL 131 HG23 VAL 131 42.474 10.967 9.205 926 H SER 132 H SER 132 40.283 8.381 7.557 927 HA SER 132 HA SER 132 39.743 8.359 10.439 928 HB2 SER 132 HB2 SER 132 39.143 6.186 8.423 929 HB3 SER 132 HB3 SER 132 38.647 6.221 10.115 930 HG SER 132 HG SER 132 37.828 8.003 8.055 931 H THR 133 H THR 133 41.959 8.548 10.929 932 HA THR 133 HA THR 133 43.204 5.980 11.204 933 HB THR 133 HB THR 133 44.074 6.641 8.988 934 HG1 THR 133 HG1 THR 133 45.751 6.425 11.239 935 HG21 THR 133 HG21 THR 133 43.965 9.074 9.248 936 HG22 THR 133 HG22 THR 133 45.580 8.554 8.767 937 HG23 THR 133 HG23 THR 133 45.262 9.008 10.441 Start of MODEL 4 1 HA2 GLY 1 HA2 GLY 1 4.845 -2.192 0.460 2 HA3 GLY 1 HA3 GLY 1 3.120 -2.367 0.745 3 H SER 2 H SER 2 5.498 -0.663 -1.240 4 HA SER 2 HA SER 2 3.458 -0.314 -3.320 5 HB2 SER 2 HB2 SER 2 6.206 0.943 -3.128 6 HB3 SER 2 HB3 SER 2 4.934 1.363 -4.275 7 HG SER 2 HG SER 2 4.905 2.830 -2.575 8 H GLY 3 H GLY 3 3.651 -1.304 -5.288 9 HA2 GLY 3 HA2 GLY 3 6.013 -3.052 -5.624 10 HA3 GLY 3 HA3 GLY 3 4.386 -3.548 -6.067 11 H ASN 4 H ASN 4 4.523 -0.387 -6.858 12 HA ASN 4 HA ASN 4 5.315 -1.022 -9.620 13 HB2 ASN 4 HB2 ASN 4 2.925 -0.366 -9.238 14 HB3 ASN 4 HB3 ASN 4 3.492 1.201 -8.675 15 HD21 ASN 4 HD22 ASN 4 2.441 2.321 -10.289 16 HD22 ASN 4 HD21 ASN 4 2.957 2.280 -11.941 17 H SER 5 H SER 5 6.188 0.890 -10.846 18 HA SER 5 HA SER 5 8.436 1.921 -9.422 19 HB2 SER 5 HB2 SER 5 8.931 3.028 -11.648 20 HB3 SER 5 HB3 SER 5 8.779 1.272 -11.695 21 HG SER 5 HG SER 5 6.838 3.200 -12.460 22 H GLN 6 H GLN 6 7.087 3.094 -7.832 23 HA GLN 6 HA GLN 6 6.812 5.870 -8.683 24 HB2 GLN 6 HB2 GLN 6 4.793 4.294 -7.094 25 HB3 GLN 6 HB3 GLN 6 4.844 6.050 -7.075 26 HG2 GLN 6 HG2 GLN 6 4.512 4.412 -9.575 27 HG3 GLN 6 HG3 GLN 6 3.170 5.055 -8.631 28 HE21 GLN 6 HE22 GLN 6 5.818 5.827 -10.748 29 HE22 GLN 6 HE21 GLN 6 5.326 7.455 -11.090 30 HA PRO 7 HA PRO 7 9.470 5.771 -4.991 31 HB2 PRO 7 HB2 PRO 7 10.583 8.248 -6.030 32 HB3 PRO 7 HB3 PRO 7 11.375 6.688 -5.808 33 HG2 PRO 7 HG2 PRO 7 10.842 7.748 -8.254 34 HG3 PRO 7 HG3 PRO 7 10.918 6.005 -7.948 35 HD2 PRO 7 HD2 PRO 7 8.515 7.782 -8.192 36 HD3 PRO 7 HD3 PRO 7 8.779 6.145 -8.837 37 H ILE 8 H ILE 8 10.273 8.125 -3.873 38 HA ILE 8 HA ILE 8 8.091 8.836 -2.298 39 HB ILE 8 HB ILE 8 10.377 9.031 -1.527 40 HG12 ILE 8 HG12 ILE 8 10.296 11.319 -0.526 41 HG13 ILE 8 HG13 ILE 8 8.924 11.680 -1.563 42 HG21 ILE 8 HG21 ILE 8 11.446 9.713 -3.585 43 HG22 ILE 8 HG22 ILE 8 11.850 10.836 -2.286 44 HG23 ILE 8 HG23 ILE 8 10.653 11.287 -3.501 45 HD11 ILE 8 HD11 ILE 8 7.640 9.924 -0.478 46 HD12 ILE 8 HD12 ILE 8 8.227 11.111 0.687 47 HD13 ILE 8 HD13 ILE 8 9.024 9.543 0.547 48 H TRP 9 H TRP 9 8.989 10.052 -5.378 49 HA TRP 9 HA TRP 9 7.666 12.606 -5.082 50 HB2 TRP 9 HB2 TRP 9 8.689 11.272 -7.596 51 HB3 TRP 9 HB3 TRP 9 8.251 12.964 -7.416 52 HD1 TRP 9 HD1 TRP 9 11.067 10.509 -6.723 53 HE1 TRP 9 HE1 TRP 9 13.168 11.818 -6.024 54 HE3 TRP 9 HE3 TRP 9 9.008 15.166 -6.241 55 HZ2 TRP 9 HZ2 TRP 9 13.865 14.471 -5.358 56 HZ3 TRP 9 HZ3 TRP 9 10.461 17.036 -5.571 57 HH2 TRP 9 HH2 TRP 9 12.839 16.694 -5.137 58 H THR 10 H THR 10 6.031 10.281 -4.579 59 HA THR 10 HA THR 10 4.492 9.483 -6.784 60 HB THR 10 HB THR 10 3.305 9.666 -4.033 61 HG1 THR 10 HG1 THR 10 5.553 8.184 -4.845 62 HG21 THR 10 HG21 THR 10 1.948 8.736 -5.846 63 HG22 THR 10 HG22 THR 10 2.356 7.492 -4.665 64 HG23 THR 10 HG23 THR 10 3.217 7.563 -6.201 65 H ASN 11 H ASN 11 3.915 12.012 -4.346 66 HA ASN 11 HA ASN 11 2.322 13.463 -6.266 67 HB2 ASN 11 HB2 ASN 11 0.365 13.545 -5.023 68 HB3 ASN 11 HB3 ASN 11 0.877 11.890 -4.777 69 HD21 ASN 11 HD22 ASN 11 -0.892 13.456 -3.184 70 HD22 ASN 11 HD21 ASN 11 -0.211 13.542 -1.600 71 HA PRO 12 HA PRO 12 4.189 17.148 -4.863 72 HB2 PRO 12 HB2 PRO 12 1.509 18.094 -3.957 73 HB3 PRO 12 HB3 PRO 12 2.699 18.907 -4.978 74 HG2 PRO 12 HG2 PRO 12 0.531 17.768 -6.037 75 HG3 PRO 12 HG3 PRO 12 2.096 17.716 -6.864 76 HD2 PRO 12 HD2 PRO 12 0.650 15.554 -5.425 77 HD3 PRO 12 HD3 PRO 12 1.777 15.451 -6.791 78 H ASN 13 H ASN 13 1.638 16.189 -2.569 79 HA ASN 13 HA ASN 13 2.741 17.545 -0.365 80 HB2 ASN 13 HB2 ASN 13 0.400 16.775 -0.443 81 HB3 ASN 13 HB3 ASN 13 0.952 15.105 -0.352 82 HD21 ASN 13 HD22 ASN 13 1.635 14.276 1.598 83 HD22 ASN 13 HD21 ASN 13 1.452 15.122 3.093 84 H ALA 14 H ALA 14 3.180 14.261 -1.552 85 HA ALA 14 HA ALA 14 4.473 13.257 0.766 86 HB1 ALA 14 HB1 ALA 14 4.946 11.315 -0.538 87 HB2 ALA 14 HB2 ALA 14 4.739 12.209 -2.044 88 HB3 ALA 14 HB3 ALA 14 3.344 11.892 -1.014 89 H ALA 15 H ALA 15 5.640 14.579 -2.270 90 HA ALA 15 HA ALA 15 8.396 14.065 -1.721 91 HB1 ALA 15 HB1 ALA 15 7.191 15.916 -3.768 92 HB2 ALA 15 HB2 ALA 15 7.475 14.194 -4.004 93 HB3 ALA 15 HB3 ALA 15 8.837 15.285 -3.754 94 H MET 16 H MET 16 6.317 16.935 -1.604 95 HA MET 16 HA MET 16 8.394 18.736 -0.990 96 HB2 MET 16 HB2 MET 16 5.529 18.813 -1.281 97 HB3 MET 16 HB3 MET 16 6.032 19.776 0.105 98 HG2 MET 16 HG2 MET 16 7.062 20.057 -2.708 99 HG3 MET 16 HG3 MET 16 5.855 21.082 -1.950 100 HE1 MET 16 HE1 MET 16 10.359 21.479 -1.705 101 HE2 MET 16 HE2 MET 16 9.351 20.863 -3.014 102 HE3 MET 16 HE3 MET 16 9.669 19.864 -1.600 103 H THR 17 H THR 17 6.388 16.670 0.982 104 HA THR 17 HA THR 17 6.827 17.863 3.463 105 HB THR 17 HB THR 17 6.348 14.960 2.772 106 HG1 THR 17 HG1 THR 17 4.541 16.113 2.325 107 HG21 THR 17 HG21 THR 17 5.677 14.723 5.167 108 HG22 THR 17 HG22 THR 17 6.360 16.319 5.477 109 HG23 THR 17 HG23 THR 17 7.405 15.000 4.946 110 H MET 18 H MET 18 8.733 15.266 1.877 111 HA MET 18 HA MET 18 10.559 15.139 4.054 112 HB2 MET 18 HB2 MET 18 11.976 13.760 2.543 113 HB3 MET 18 HB3 MET 18 10.331 13.182 2.717 114 HG2 MET 18 HG2 MET 18 10.764 12.912 0.473 115 HG3 MET 18 HG3 MET 18 9.874 14.429 0.525 116 HE1 MET 18 HE1 MET 18 12.483 14.753 -2.434 117 HE2 MET 18 HE2 MET 18 10.771 14.788 -2.015 118 HE3 MET 18 HE3 MET 18 11.678 13.282 -1.882 119 H THR 19 H THR 19 10.498 16.950 1.062 120 HA THR 19 HA THR 19 13.143 17.936 1.155 121 HB THR 19 HB THR 19 10.674 19.252 0.005 122 HG1 THR 19 HG1 THR 19 11.868 16.980 -0.680 123 HG21 THR 19 HG21 THR 19 13.602 19.633 -0.611 124 HG22 THR 19 HG22 THR 19 12.531 20.800 0.170 125 HG23 THR 19 HG23 THR 19 12.269 20.351 -1.515 126 H ASN 20 H ASN 20 10.070 19.227 2.411 127 HA ASN 20 HA ASN 20 11.228 21.609 3.457 128 HB2 ASN 20 HB2 ASN 20 8.559 20.266 3.751 129 HB3 ASN 20 HB3 ASN 20 8.968 21.682 4.712 130 HD21 ASN 20 HD22 ASN 20 7.054 21.114 2.441 131 HD22 ASN 20 HD21 ASN 20 7.344 22.397 1.318 132 H ASN 21 H ASN 21 10.520 18.425 4.814 133 HA ASN 21 HA ASN 21 11.006 19.088 7.513 134 HB2 ASN 21 HB2 ASN 21 11.252 16.491 6.007 135 HB3 ASN 21 HB3 ASN 21 11.588 16.615 7.723 136 HD21 ASN 21 HD22 ASN 21 9.611 15.022 6.445 137 HD22 ASN 21 HD21 ASN 21 8.073 15.540 7.040 138 H LEU 22 H LEU 22 13.106 18.272 4.843 139 HA LEU 22 HA LEU 22 15.494 17.858 6.272 140 HB2 LEU 22 HB2 LEU 22 15.277 17.263 3.923 141 HB3 LEU 22 HB3 LEU 22 15.025 18.944 3.491 142 HG LEU 22 HG LEU 22 17.342 19.443 4.221 143 HD11 LEU 22 HD11 LEU 22 18.895 17.575 4.575 144 HD12 LEU 22 HD12 LEU 22 17.531 16.458 4.550 145 HD13 LEU 22 HD13 LEU 22 17.657 17.667 5.827 146 HD21 LEU 22 HD21 LEU 22 17.091 17.279 2.139 147 HD22 LEU 22 HD22 LEU 22 18.450 18.390 2.314 148 HD23 LEU 22 HD23 LEU 22 16.855 19.007 1.876 149 H VAL 23 H VAL 23 13.951 20.729 4.971 150 HA VAL 23 HA VAL 23 15.957 22.593 5.611 151 HB VAL 23 HB VAL 23 12.974 23.039 5.403 152 HG11 VAL 23 HG11 VAL 23 15.254 25.001 5.156 153 HG12 VAL 23 HG12 VAL 23 14.121 24.894 6.501 154 HG13 VAL 23 HG13 VAL 23 13.546 25.357 4.901 155 HG21 VAL 23 HG21 VAL 23 13.426 23.679 3.087 156 HG22 VAL 23 HG22 VAL 23 13.877 22.003 3.393 157 HG23 VAL 23 HG23 VAL 23 15.122 23.246 3.296 158 H GLN 24 H GLN 24 13.020 21.593 7.390 159 HA GLN 24 HA GLN 24 13.442 23.445 9.508 160 HB2 GLN 24 HB2 GLN 24 11.608 22.414 10.614 161 HB3 GLN 24 HB3 GLN 24 11.242 22.379 8.897 162 HG2 GLN 24 HG2 GLN 24 11.932 20.044 8.795 163 HG3 GLN 24 HG3 GLN 24 12.289 20.073 10.517 164 HE21 GLN 24 HE22 GLN 24 9.566 21.740 9.105 165 HE22 GLN 24 HE21 GLN 24 8.349 20.726 9.787 166 H CYS 25 H CYS 25 14.484 20.168 8.940 167 HA CYS 25 HA CYS 25 15.329 19.602 11.592 168 HB2 CYS 25 HB2 CYS 25 14.875 17.841 9.934 169 HB3 CYS 25 HB3 CYS 25 16.223 18.408 8.959 170 H ALA 26 H ALA 26 16.953 20.874 8.715 171 HA ALA 26 HA ALA 26 19.528 20.945 9.983 172 HB1 ALA 26 HB1 ALA 26 19.309 20.621 7.573 173 HB2 ALA 26 HB2 ALA 26 20.276 22.048 7.946 174 HB3 ALA 26 HB3 ALA 26 18.603 22.228 7.421 175 H SER 27 H SER 27 16.873 23.167 9.564 176 HA SER 27 HA SER 27 18.283 25.568 10.064 177 HB2 SER 27 HB2 SER 27 16.018 25.380 8.988 178 HB3 SER 27 HB3 SER 27 15.350 25.021 10.576 179 HG SER 27 HG SER 27 15.901 27.398 9.488 180 H ARG 28 H ARG 28 17.198 23.054 12.152 181 HA ARG 28 HA ARG 28 17.859 24.734 14.483 182 HB2 ARG 28 HB2 ARG 28 15.784 22.539 14.306 183 HB3 ARG 28 HB3 ARG 28 16.258 23.356 15.791 184 HG2 ARG 28 HG2 ARG 28 14.996 24.645 13.387 185 HG3 ARG 28 HG3 ARG 28 14.191 24.275 14.915 186 HD2 ARG 28 HD2 ARG 28 15.757 25.785 16.072 187 HD3 ARG 28 HD3 ARG 28 16.501 26.176 14.525 188 HE ARG 28 HE ARG 28 13.766 26.898 15.340 189 HH11 ARG 28 HH11 ARG 28 16.538 27.339 13.231 190 HH12 ARG 28 HH12 ARG 28 15.947 28.828 12.569 191 HH21 ARG 28 HH21 ARG 28 13.004 28.859 14.474 192 HH22 ARG 28 HH22 ARG 28 13.929 29.681 13.260 193 H SER 29 H SER 29 19.512 23.011 12.825 194 HA SER 29 HA SER 29 20.131 20.641 14.297 195 HB2 SER 29 HB2 SER 29 22.151 20.588 12.833 196 HB3 SER 29 HB3 SER 29 20.648 20.774 11.929 197 HG SER 29 HG SER 29 21.203 22.753 11.362 198 H GLY 30 H GLY 30 21.334 23.937 14.240 199 HA2 GLY 30 HA2 GLY 30 22.562 25.020 15.916 200 HA3 GLY 30 HA3 GLY 30 22.876 23.459 16.662 201 H VAL 31 H VAL 31 23.359 23.291 13.382 202 HA VAL 31 HA VAL 31 26.264 23.618 13.708 203 HB VAL 31 HB VAL 31 24.780 21.898 11.711 204 HG11 VAL 31 HG11 VAL 31 27.724 22.101 12.335 205 HG12 VAL 31 HG12 VAL 31 26.926 22.681 10.873 206 HG13 VAL 31 HG13 VAL 31 26.987 20.952 11.218 207 HG21 VAL 31 HG21 VAL 31 26.273 21.113 14.212 208 HG22 VAL 31 HG22 VAL 31 25.613 19.995 13.019 209 HG23 VAL 31 HG23 VAL 31 24.530 21.019 13.961 210 H LEU 32 H LEU 32 23.607 23.980 11.381 211 HA LEU 32 HA LEU 32 25.163 25.412 9.475 212 HB2 LEU 32 HB2 LEU 32 22.211 24.942 9.794 213 HB3 LEU 32 HB3 LEU 32 22.834 25.998 8.544 214 HG LEU 32 HG LEU 32 24.184 24.040 7.701 215 HD11 LEU 32 HD11 LEU 32 24.141 22.675 9.715 216 HD12 LEU 32 HD12 LEU 32 23.463 21.805 8.340 217 HD13 LEU 32 HD13 LEU 32 22.394 22.490 9.563 218 HD21 LEU 32 HD21 LEU 32 22.204 24.744 6.556 219 HD22 LEU 32 HD22 LEU 32 21.179 23.887 7.707 220 HD23 LEU 32 HD23 LEU 32 22.226 22.980 6.612 221 H THR 33 H THR 33 25.189 27.584 8.987 222 HA THR 33 HA THR 33 24.722 29.373 11.195 223 HB THR 33 HB THR 33 25.678 31.101 9.755 224 HG1 THR 33 HG1 THR 33 26.421 30.369 7.610 225 HG21 THR 33 HG21 THR 33 27.194 28.502 9.571 226 HG22 THR 33 HG22 THR 33 27.225 29.630 10.928 227 HG23 THR 33 HG23 THR 33 27.885 30.112 9.363 228 H ALA 34 H ALA 34 23.668 31.581 10.616 229 HA ALA 34 HA ALA 34 20.941 31.091 10.030 230 HB1 ALA 34 HB1 ALA 34 22.399 33.727 10.195 231 HB2 ALA 34 HB2 ALA 34 21.652 32.874 11.546 232 HB3 ALA 34 HB3 ALA 34 20.651 33.504 10.237 233 H ASP 35 H ASP 35 23.674 32.038 8.120 234 HA ASP 35 HA ASP 35 22.121 32.863 5.829 235 HB2 ASP 35 HB2 ASP 35 25.061 32.206 6.150 236 HB3 ASP 35 HB3 ASP 35 24.343 32.753 4.641 237 H GLN 36 H GLN 36 24.091 30.075 6.719 238 HA GLN 36 HA GLN 36 23.797 28.612 4.359 239 HB2 GLN 36 HB2 GLN 36 25.508 28.217 6.097 240 HB3 GLN 36 HB3 GLN 36 24.259 27.606 7.169 241 HG2 GLN 36 HG2 GLN 36 23.841 25.756 5.656 242 HG3 GLN 36 HG3 GLN 36 25.050 26.388 4.537 243 HE21 GLN 36 HE22 GLN 36 26.301 24.548 4.666 244 HE22 GLN 36 HE21 GLN 36 27.245 24.165 6.067 245 H MET 37 H MET 37 21.820 28.698 7.289 246 HA MET 37 HA MET 37 20.176 26.488 6.507 247 HB2 MET 37 HB2 MET 37 18.796 27.029 8.400 248 HB3 MET 37 HB3 MET 37 20.482 27.189 8.872 249 HG2 MET 37 HG2 MET 37 20.342 29.595 8.680 250 HG3 MET 37 HG3 MET 37 18.683 29.476 8.102 251 HE1 MET 37 HE1 MET 37 21.104 28.871 11.142 252 HE2 MET 37 HE2 MET 37 20.316 27.302 10.971 253 HE3 MET 37 HE3 MET 37 19.980 28.309 12.380 254 H ASP 38 H ASP 38 20.264 29.778 5.606 255 HA ASP 38 HA ASP 38 17.438 30.014 5.078 256 HB2 ASP 38 HB2 ASP 38 18.877 31.980 5.672 257 HB3 ASP 38 HB3 ASP 38 19.667 31.815 4.105 258 H ASP 39 H ASP 39 20.354 29.260 3.282 259 HA ASP 39 HA ASP 39 19.275 29.302 0.690 260 HB2 ASP 39 HB2 ASP 39 21.508 27.692 1.903 261 HB3 ASP 39 HB3 ASP 39 21.045 27.502 0.217 262 H MET 40 H MET 40 19.103 26.964 3.253 263 HA MET 40 HA MET 40 18.161 24.712 1.929 264 HB2 MET 40 HB2 MET 40 17.378 25.736 4.667 265 HB3 MET 40 HB3 MET 40 17.109 24.102 4.084 266 HG2 MET 40 HG2 MET 40 19.826 25.356 4.358 267 HG3 MET 40 HG3 MET 40 19.060 24.380 5.609 268 HE1 MET 40 HE1 MET 40 17.588 22.099 3.944 269 HE2 MET 40 HE2 MET 40 18.554 21.811 5.389 270 HE3 MET 40 HE3 MET 40 18.849 20.867 3.933 271 H GLY 41 H GLY 41 16.392 27.510 3.181 272 HA2 GLY 41 HA2 GLY 41 13.811 26.463 2.585 273 HA3 GLY 41 HA3 GLY 41 14.186 28.130 2.996 274 H MET 42 H MET 42 15.937 28.773 0.913 275 HA MET 42 HA MET 42 14.022 29.446 -1.056 276 HB2 MET 42 HB2 MET 42 15.787 30.586 -2.209 277 HB3 MET 42 HB3 MET 42 15.977 30.859 -0.484 278 HG2 MET 42 HG2 MET 42 17.712 29.154 -0.404 279 HG3 MET 42 HG3 MET 42 17.529 28.881 -2.132 280 HE1 MET 42 HE1 MET 42 19.133 32.786 -0.269 281 HE2 MET 42 HE2 MET 42 18.660 31.366 0.666 282 HE3 MET 42 HE3 MET 42 17.438 32.318 -0.177 283 H MET 43 H MET 43 16.414 26.860 -0.864 284 HA MET 43 HA MET 43 16.219 26.224 -3.651 285 HB2 MET 43 HB2 MET 43 17.817 24.643 -3.250 286 HB3 MET 43 HB3 MET 43 18.070 25.627 -1.817 287 HG2 MET 43 HG2 MET 43 16.286 24.039 -0.778 288 HG3 MET 43 HG3 MET 43 16.771 22.973 -2.093 289 HE1 MET 43 HE1 MET 43 17.111 21.524 0.368 290 HE2 MET 43 HE2 MET 43 16.862 23.060 1.201 291 HE3 MET 43 HE3 MET 43 18.289 22.077 1.565 292 H ALA 44 H ALA 44 14.625 25.239 -0.685 293 HA ALA 44 HA ALA 44 13.264 22.981 -1.611 294 HB1 ALA 44 HB1 ALA 44 13.377 23.605 0.750 295 HB2 ALA 44 HB2 ALA 44 11.709 23.358 0.229 296 HB3 ALA 44 HB3 ALA 44 12.336 24.994 0.435 297 H ASP 45 H ASP 45 12.386 26.417 -1.733 298 HA ASP 45 HA ASP 45 9.852 26.132 -2.893 299 HB2 ASP 45 HB2 ASP 45 10.593 28.270 -1.998 300 HB3 ASP 45 HB3 ASP 45 11.855 28.370 -3.223 301 H SER 46 H SER 46 13.038 26.482 -4.357 302 HA SER 46 HA SER 46 12.276 26.446 -7.043 303 HB2 SER 46 HB2 SER 46 14.540 27.031 -6.190 304 HB3 SER 46 HB3 SER 46 14.811 25.333 -5.811 305 HG SER 46 HG SER 46 15.547 25.226 -7.766 306 H VAL 47 H VAL 47 12.925 23.828 -4.769 307 HA VAL 47 HA VAL 47 12.884 21.691 -6.575 308 HB VAL 47 HB VAL 47 12.097 21.709 -3.654 309 HG11 VAL 47 HG11 VAL 47 11.151 19.758 -4.777 310 HG12 VAL 47 HG12 VAL 47 12.484 19.285 -3.722 311 HG13 VAL 47 HG13 VAL 47 12.729 19.375 -5.467 312 HG21 VAL 47 HG21 VAL 47 14.398 22.415 -4.080 313 HG22 VAL 47 HG22 VAL 47 14.676 20.950 -5.022 314 HG23 VAL 47 HG23 VAL 47 14.350 20.838 -3.292 315 H ASN 48 H ASN 48 10.152 22.969 -4.582 316 HA ASN 48 HA ASN 48 8.363 21.087 -5.719 317 HB2 ASN 48 HB2 ASN 48 6.548 22.420 -4.706 318 HB3 ASN 48 HB3 ASN 48 7.788 21.953 -3.565 319 HD21 ASN 48 HD22 ASN 48 8.671 23.461 -2.353 320 HD22 ASN 48 HD21 ASN 48 8.426 25.157 -2.539 321 H SER 49 H SER 49 9.353 24.297 -6.662 322 HA SER 49 HA SER 49 7.317 24.816 -8.524 323 HB2 SER 49 HB2 SER 49 9.039 26.472 -7.806 324 HB3 SER 49 HB3 SER 49 10.240 25.587 -8.746 325 HG SER 49 HG SER 49 9.565 27.098 -10.134 326 H GLN 50 H GLN 50 10.267 22.916 -8.727 327 HA GLN 50 HA GLN 50 9.890 22.268 -11.517 328 HB2 GLN 50 HB2 GLN 50 11.813 21.176 -9.454 329 HB3 GLN 50 HB3 GLN 50 11.860 20.806 -11.172 330 HG2 GLN 50 HG2 GLN 50 12.454 23.019 -11.732 331 HG3 GLN 50 HG3 GLN 50 12.085 23.606 -10.110 332 HE21 GLN 50 HE22 GLN 50 13.511 23.172 -8.436 333 HE22 GLN 50 HE21 GLN 50 15.152 22.675 -8.709 334 H MET 51 H MET 51 8.979 20.950 -8.457 335 HA MET 51 HA MET 51 8.511 18.288 -9.445 336 HB2 MET 51 HB2 MET 51 9.164 18.616 -7.130 337 HB3 MET 51 HB3 MET 51 7.752 19.619 -6.845 338 HG2 MET 51 HG2 MET 51 7.139 16.944 -7.860 339 HG3 MET 51 HG3 MET 51 7.926 16.968 -6.285 340 HE1 MET 51 HE1 MET 51 7.043 18.088 -4.201 341 HE2 MET 51 HE2 MET 51 5.488 18.900 -4.029 342 HE3 MET 51 HE3 MET 51 6.796 19.677 -4.925 343 H GLN 52 H GLN 52 6.636 21.204 -9.014 344 HA GLN 52 HA GLN 52 4.100 19.918 -9.306 345 HB2 GLN 52 HB2 GLN 52 4.919 22.814 -9.489 346 HB3 GLN 52 HB3 GLN 52 3.256 22.265 -9.646 347 HG2 GLN 52 HG2 GLN 52 3.344 21.315 -7.406 348 HG3 GLN 52 HG3 GLN 52 5.020 21.840 -7.249 349 HE21 GLN 52 HE22 GLN 52 5.472 24.021 -7.013 350 HE22 GLN 52 HE21 GLN 52 4.263 25.170 -6.557 351 H LYS 53 H LYS 53 6.505 21.032 -11.529 352 HA LYS 53 HA LYS 53 4.665 20.900 -13.757 353 HB2 LYS 53 HB2 LYS 53 6.556 21.469 -15.161 354 HB3 LYS 53 HB3 LYS 53 6.383 22.599 -13.832 355 HG2 LYS 53 HG2 LYS 53 8.604 22.292 -13.810 356 HG3 LYS 53 HG3 LYS 53 8.138 21.014 -12.699 357 HD2 LYS 53 HD2 LYS 53 8.268 19.380 -14.493 358 HD3 LYS 53 HD3 LYS 53 8.671 20.651 -15.649 359 HE2 LYS 53 HE2 LYS 53 10.331 19.913 -13.237 360 HE3 LYS 53 HE3 LYS 53 10.641 19.357 -14.881 361 HZ1 LYS 53 HZ1 LYS 53 12.030 21.245 -14.317 362 HZ2 LYS 53 HZ2 LYS 53 10.671 22.190 -13.980 363 HZ3 LYS 53 HZ3 LYS 53 10.961 21.662 -15.557 364 H MET 54 H MET 54 6.424 18.783 -11.907 365 HA MET 54 HA MET 54 7.078 16.806 -13.858 366 HB2 MET 54 HB2 MET 54 8.146 16.897 -11.621 367 HB3 MET 54 HB3 MET 54 6.597 16.521 -10.879 368 HG2 MET 54 HG2 MET 54 6.676 14.401 -12.346 369 HG3 MET 54 HG3 MET 54 8.391 14.767 -12.499 370 HE1 MET 54 HE1 MET 54 9.444 14.741 -8.662 371 HE2 MET 54 HE2 MET 54 9.024 16.082 -9.732 372 HE3 MET 54 HE3 MET 54 10.097 14.801 -10.298 373 H GLY 55 H GLY 55 4.468 17.188 -11.485 374 HA2 GLY 55 HA2 GLY 55 2.173 16.854 -12.091 375 HA3 GLY 55 HA3 GLY 55 2.698 15.685 -13.291 376 HA PRO 56 HA PRO 56 1.896 13.800 -8.809 377 HB2 PRO 56 HB2 PRO 56 -0.966 13.829 -9.612 378 HB3 PRO 56 HB3 PRO 56 -0.243 14.050 -8.013 379 HG2 PRO 56 HG2 PRO 56 -1.233 16.127 -9.344 380 HG3 PRO 56 HG3 PRO 56 0.265 16.278 -8.406 381 HD2 PRO 56 HD2 PRO 56 -0.099 16.019 -11.367 382 HD3 PRO 56 HD3 PRO 56 1.047 17.024 -10.453 383 H ASN 57 H ASN 57 2.088 11.665 -8.852 384 HA ASN 57 HA ASN 57 2.328 9.565 -9.685 385 HB2 ASN 57 HB2 ASN 57 -0.179 10.228 -11.249 386 HB3 ASN 57 HB3 ASN 57 0.489 8.614 -11.028 387 HD21 ASN 57 HD22 ASN 57 -1.318 11.181 -9.633 388 HD22 ASN 57 HD21 ASN 57 -1.799 10.356 -8.193 389 HA PRO 58 HA PRO 58 4.084 11.569 -13.450 390 HB2 PRO 58 HB2 PRO 58 6.661 11.614 -12.776 391 HB3 PRO 58 HB3 PRO 58 5.511 12.755 -12.069 392 HG2 PRO 58 HG2 PRO 58 6.668 10.262 -10.899 393 HG3 PRO 58 HG3 PRO 58 6.368 11.828 -10.124 394 HD2 PRO 58 HD2 PRO 58 4.708 9.612 -9.946 395 HD3 PRO 58 HD3 PRO 58 4.208 11.287 -9.638 396 HA PRO 59 HA PRO 59 5.530 7.942 -15.609 397 HB2 PRO 59 HB2 PRO 59 6.920 9.159 -17.607 398 HB3 PRO 59 HB3 PRO 59 5.155 9.075 -17.571 399 HG2 PRO 59 HG2 PRO 59 6.965 11.328 -16.797 400 HG3 PRO 59 HG3 PRO 59 5.436 11.377 -17.695 401 HD2 PRO 59 HD2 PRO 59 5.617 11.999 -15.062 402 HD3 PRO 59 HD3 PRO 59 4.166 11.272 -15.779 403 H GLN 60 H GLN 60 7.347 6.703 -15.783 404 HA GLN 60 HA GLN 60 9.137 6.778 -13.752 405 HB2 GLN 60 HB2 GLN 60 9.804 5.560 -16.431 406 HB3 GLN 60 HB3 GLN 60 10.390 5.059 -14.853 407 HG2 GLN 60 HG2 GLN 60 8.807 3.465 -15.250 408 HG3 GLN 60 HG3 GLN 60 7.855 4.656 -14.365 409 HE21 GLN 60 HE22 GLN 60 8.494 3.236 -17.477 410 HE22 GLN 60 HE21 GLN 60 7.075 3.834 -18.261 411 H HIS 61 H HIS 61 9.728 8.077 -17.002 412 HA HIS 61 HA HIS 61 12.497 8.472 -16.639 413 HB2 HIS 61 HB2 HIS 61 12.429 9.792 -18.688 414 HB3 HIS 61 HB3 HIS 61 11.491 8.316 -18.861 415 HD1 HIS 61 HD1 HIS 61 9.031 8.556 -19.430 416 HD2 HIS 61 HD2 HIS 61 10.871 12.185 -18.574 417 HE1 HIS 61 HE1 HIS 61 7.367 10.326 -20.068 418 H ARG 62 H ARG 62 9.852 10.318 -15.466 419 HA ARG 62 HA ARG 62 11.281 12.823 -15.423 420 HB2 ARG 62 HB2 ARG 62 8.640 11.922 -14.318 421 HB3 ARG 62 HB3 ARG 62 9.318 13.482 -13.881 422 HG2 ARG 62 HG2 ARG 62 8.740 12.576 -16.694 423 HG3 ARG 62 HG3 ARG 62 7.702 13.626 -15.726 424 HD2 ARG 62 HD2 ARG 62 9.574 15.245 -15.562 425 HD3 ARG 62 HD3 ARG 62 10.523 14.213 -16.629 426 HE ARG 62 HE ARG 62 8.033 14.870 -17.819 427 HH11 ARG 62 HH11 ARG 62 11.198 16.214 -17.117 428 HH12 ARG 62 HH12 ARG 62 11.124 17.373 -18.402 429 HH21 ARG 62 HH21 ARG 62 7.937 16.416 -19.496 430 HH22 ARG 62 HH22 ARG 62 9.278 17.486 -19.754 431 H LEU 63 H LEU 63 10.935 10.097 -13.319 432 HA LEU 63 HA LEU 63 11.585 11.453 -10.899 433 HB2 LEU 63 HB2 LEU 63 11.725 8.532 -11.641 434 HB3 LEU 63 HB3 LEU 63 12.061 9.141 -10.034 435 HG LEU 63 HG LEU 63 9.866 8.337 -9.928 436 HD11 LEU 63 HD11 LEU 63 10.131 10.551 -8.933 437 HD12 LEU 63 HD12 LEU 63 8.493 10.283 -9.524 438 HD13 LEU 63 HD13 LEU 63 9.606 11.290 -10.446 439 HD21 LEU 63 HD21 LEU 63 9.248 9.809 -12.482 440 HD22 LEU 63 HD22 LEU 63 8.112 8.855 -11.526 441 HD23 LEU 63 HD23 LEU 63 9.478 8.069 -12.316 442 H ARG 64 H ARG 64 13.431 9.812 -13.374 443 HA ARG 64 HA ARG 64 15.886 9.527 -12.100 444 HB2 ARG 64 HB2 ARG 64 15.048 9.847 -14.947 445 HB3 ARG 64 HB3 ARG 64 16.756 9.948 -14.562 446 HG2 ARG 64 HG2 ARG 64 16.202 7.724 -15.272 447 HG3 ARG 64 HG3 ARG 64 16.652 7.708 -13.570 448 HD2 ARG 64 HD2 ARG 64 13.773 7.986 -14.218 449 HD3 ARG 64 HD3 ARG 64 14.523 6.420 -14.517 450 HE ARG 64 HE ARG 64 14.999 7.558 -11.892 451 HH11 ARG 64 HH11 ARG 64 13.022 5.448 -13.865 452 HH12 ARG 64 HH12 ARG 64 12.478 4.492 -12.523 453 HH21 ARG 64 HH21 ARG 64 14.295 6.306 -10.126 454 HH22 ARG 64 HH22 ARG 64 13.211 4.974 -10.390 455 H ALA 65 H ALA 65 14.919 12.170 -14.277 456 HA ALA 65 HA ALA 65 17.335 13.603 -13.881 457 HB1 ALA 65 HB1 ALA 65 16.006 13.715 -15.947 458 HB2 ALA 65 HB2 ALA 65 16.343 15.310 -15.274 459 HB3 ALA 65 HB3 ALA 65 14.748 14.588 -15.069 460 H MET 66 H MET 66 14.371 13.540 -12.127 461 HA MET 66 HA MET 66 14.660 16.259 -11.156 462 HB2 MET 66 HB2 MET 66 12.590 14.132 -10.834 463 HB3 MET 66 HB3 MET 66 12.643 15.461 -9.684 464 HG2 MET 66 HG2 MET 66 12.372 15.733 -12.671 465 HG3 MET 66 HG3 MET 66 11.065 15.880 -11.503 466 HE1 MET 66 HE1 MET 66 12.730 17.425 -9.128 467 HE2 MET 66 HE2 MET 66 11.057 17.764 -9.566 468 HE3 MET 66 HE3 MET 66 12.231 19.078 -9.485 469 H ASN 67 H ASN 67 15.201 12.994 -10.025 470 HA ASN 67 HA ASN 67 15.642 13.680 -7.314 471 HB2 ASN 67 HB2 ASN 67 15.815 11.458 -7.068 472 HB3 ASN 67 HB3 ASN 67 15.521 11.326 -8.795 473 HD21 ASN 67 HD22 ASN 67 17.287 11.028 -10.199 474 HD22 ASN 67 HD21 ASN 67 18.791 10.388 -9.599 475 H THR 68 H THR 68 17.702 13.567 -10.156 476 HA THR 68 HA THR 68 20.133 14.151 -8.772 477 HB THR 68 HB THR 68 19.449 14.491 -11.704 478 HG1 THR 68 HG1 THR 68 19.840 12.299 -10.178 479 HG21 THR 68 HG21 THR 68 21.846 14.456 -12.095 480 HG22 THR 68 HG22 THR 68 22.154 14.273 -10.369 481 HG23 THR 68 HG23 THR 68 21.450 15.768 -10.985 482 H ALA 69 H ALA 69 17.611 16.031 -10.335 483 HA ALA 69 HA ALA 69 18.940 18.505 -10.445 484 HB1 ALA 69 HB1 ALA 69 15.982 17.955 -10.220 485 HB2 ALA 69 HB2 ALA 69 16.909 18.039 -11.718 486 HB3 ALA 69 HB3 ALA 69 16.712 19.480 -10.720 487 H MET 70 H MET 70 16.795 17.104 -7.978 488 HA MET 70 HA MET 70 16.759 19.384 -6.305 489 HB2 MET 70 HB2 MET 70 15.117 17.484 -6.250 490 HB3 MET 70 HB3 MET 70 16.352 16.502 -5.483 491 HG2 MET 70 HG2 MET 70 15.601 19.106 -4.252 492 HG3 MET 70 HG3 MET 70 14.529 17.724 -4.064 493 HE1 MET 70 HE1 MET 70 16.555 15.226 -1.979 494 HE2 MET 70 HE2 MET 70 16.075 15.237 -3.677 495 HE3 MET 70 HE3 MET 70 14.938 15.763 -2.435 496 H ALA 71 H ALA 71 18.726 16.459 -6.338 497 HA ALA 71 HA ALA 71 20.216 16.861 -4.023 498 HB1 ALA 71 HB1 ALA 71 20.196 14.785 -5.364 499 HB2 ALA 71 HB2 ALA 71 21.827 15.330 -4.970 500 HB3 ALA 71 HB3 ALA 71 21.173 15.597 -6.586 501 H ALA 72 H ALA 72 20.594 18.241 -7.223 502 HA ALA 72 HA ALA 72 23.237 19.214 -6.864 503 HB1 ALA 72 HB1 ALA 72 22.233 18.829 -9.072 504 HB2 ALA 72 HB2 ALA 72 22.853 20.471 -8.901 505 HB3 ALA 72 HB3 ALA 72 21.120 20.167 -8.786 506 H GLU 73 H GLU 73 20.084 20.466 -6.060 507 HA GLU 73 HA GLU 73 21.101 23.153 -5.663 508 HB2 GLU 73 HB2 GLU 73 18.347 21.988 -5.200 509 HB3 GLU 73 HB3 GLU 73 18.764 23.692 -5.040 510 HG2 GLU 73 HG2 GLU 73 19.444 23.728 -7.405 511 HG3 GLU 73 HG3 GLU 73 18.954 22.043 -7.552 512 H VAL 74 H VAL 74 20.354 20.333 -3.754 513 HA VAL 74 HA VAL 74 20.470 21.660 -1.226 514 HB VAL 74 HB VAL 74 20.970 18.744 -1.870 515 HG11 VAL 74 HG11 VAL 74 20.358 20.104 0.754 516 HG12 VAL 74 HG12 VAL 74 21.866 19.306 0.306 517 HG13 VAL 74 HG13 VAL 74 20.392 18.359 0.498 518 HG21 VAL 74 HG21 VAL 74 18.769 19.452 -2.592 519 HG22 VAL 74 HG22 VAL 74 18.456 20.162 -1.007 520 HG23 VAL 74 HG23 VAL 74 18.640 18.414 -1.170 521 H ALA 75 H ALA 75 22.796 20.405 -3.461 522 HA ALA 75 HA ALA 75 25.026 20.105 -1.788 523 HB1 ALA 75 HB1 ALA 75 24.931 19.240 -4.072 524 HB2 ALA 75 HB2 ALA 75 26.343 20.270 -3.837 525 HB3 ALA 75 HB3 ALA 75 24.937 20.890 -4.698 526 H GLU 76 H GLU 76 23.480 22.930 -3.037 527 HA GLU 76 HA GLU 76 25.647 24.726 -3.019 528 HB2 GLU 76 HB2 GLU 76 22.670 25.167 -2.794 529 HB3 GLU 76 HB3 GLU 76 23.833 26.482 -2.903 530 HG2 GLU 76 HG2 GLU 76 23.559 24.300 -4.951 531 HG3 GLU 76 HG3 GLU 76 22.762 25.870 -5.060 532 H VAL 77 H VAL 77 23.542 23.586 -0.463 533 HA VAL 77 HA VAL 77 24.317 25.708 1.346 534 HB VAL 77 HB VAL 77 22.912 24.723 2.982 535 HG11 VAL 77 HG11 VAL 77 20.787 24.436 1.805 536 HG12 VAL 77 HG12 VAL 77 21.661 24.268 0.283 537 HG13 VAL 77 HG13 VAL 77 21.713 25.793 1.164 538 HG21 VAL 77 HG21 VAL 77 23.682 22.423 2.834 539 HG22 VAL 77 HG22 VAL 77 22.854 22.231 1.289 540 HG23 VAL 77 HG23 VAL 77 21.919 22.491 2.763 541 H VAL 78 H VAL 78 25.494 22.632 0.428 542 HA VAL 78 HA VAL 78 26.877 22.167 2.948 543 HB VAL 78 HB VAL 78 27.038 20.512 0.425 544 HG11 VAL 78 HG11 VAL 78 27.571 19.828 3.315 545 HG12 VAL 78 HG12 VAL 78 28.787 20.059 2.058 546 HG13 VAL 78 HG13 VAL 78 27.660 18.706 1.956 547 HG21 VAL 78 HG21 VAL 78 25.294 19.092 1.393 548 HG22 VAL 78 HG22 VAL 78 24.702 20.726 1.091 549 HG23 VAL 78 HG23 VAL 78 25.114 20.226 2.731 550 H ALA 79 H ALA 79 27.531 23.222 -0.311 551 HA ALA 79 HA ALA 79 30.322 22.823 -0.365 552 HB1 ALA 79 HB1 ALA 79 28.999 23.163 -2.378 553 HB2 ALA 79 HB2 ALA 79 30.298 24.352 -2.274 554 HB3 ALA 79 HB3 ALA 79 28.643 24.817 -1.880 555 H THR 80 H THR 80 28.441 25.164 1.268 556 HA THR 80 HA THR 80 30.549 27.156 1.347 557 HB THR 80 HB THR 80 27.979 27.262 2.913 558 HG1 THR 80 HG1 THR 80 27.082 28.232 0.979 559 HG21 THR 80 HG21 THR 80 29.675 29.390 1.586 560 HG22 THR 80 HG22 THR 80 29.633 29.036 3.313 561 HG23 THR 80 HG23 THR 80 28.200 29.677 2.509 562 H SER 81 H SER 81 30.356 24.333 2.792 563 HA SER 81 HA SER 81 30.950 25.222 5.521 564 HB2 SER 81 HB2 SER 81 30.718 22.386 4.489 565 HB3 SER 81 HB3 SER 81 30.685 22.920 6.170 566 HG SER 81 HG SER 81 28.717 23.125 4.187 567 HA PRO 82 HA PRO 82 35.324 24.738 4.655 568 HB2 PRO 82 HB2 PRO 82 36.192 24.867 7.237 569 HB3 PRO 82 HB3 PRO 82 35.743 26.293 6.296 570 HG2 PRO 82 HG2 PRO 82 34.160 24.796 8.344 571 HG3 PRO 82 HG3 PRO 82 34.295 26.545 8.091 572 HD2 PRO 82 HD2 PRO 82 32.165 25.099 7.238 573 HD3 PRO 82 HD3 PRO 82 32.744 26.546 6.388 574 HA PRO 83 HA PRO 83 35.756 20.320 4.762 575 HB2 PRO 83 HB2 PRO 83 38.607 21.112 5.229 576 HB3 PRO 83 HB3 PRO 83 37.947 19.893 4.131 577 HG2 PRO 83 HG2 PRO 83 38.677 22.273 3.205 578 HG3 PRO 83 HG3 PRO 83 37.211 21.480 2.599 579 HD2 PRO 83 HD2 PRO 83 37.485 23.811 4.418 580 HD3 PRO 83 HD3 PRO 83 36.184 23.408 3.282 581 H GLN 84 H GLN 84 37.573 22.165 7.228 582 HA GLN 84 HA GLN 84 38.064 19.979 8.925 583 HB2 GLN 84 HB2 GLN 84 38.600 21.636 10.645 584 HB3 GLN 84 HB3 GLN 84 39.322 22.057 9.100 585 HG2 GLN 84 HG2 GLN 84 37.601 23.717 8.714 586 HG3 GLN 84 HG3 GLN 84 36.797 23.258 10.216 587 HE21 GLN 84 HE22 GLN 84 36.986 25.329 11.048 588 HE22 GLN 84 HE21 GLN 84 38.497 25.955 11.615 589 H SER 85 H SER 85 35.201 21.857 8.464 590 HA SER 85 HA SER 85 33.995 20.544 10.811 591 HB2 SER 85 HB2 SER 85 33.157 23.184 9.579 592 HB3 SER 85 HB3 SER 85 32.513 22.453 11.051 593 HG SER 85 HG SER 85 34.074 23.390 12.084 594 H TYR 86 H TYR 86 34.202 20.292 7.621 595 HA TYR 86 HA TYR 86 31.614 20.396 6.576 596 HB2 TYR 86 HB2 TYR 86 33.666 20.253 5.221 597 HB3 TYR 86 HB3 TYR 86 33.911 18.599 5.764 598 HD1 TYR 86 HD1 TYR 86 32.185 16.847 5.095 599 HD2 TYR 86 HD2 TYR 86 32.326 20.731 3.359 600 HE1 TYR 86 HE1 TYR 86 30.871 16.034 3.185 601 HE2 TYR 86 HE2 TYR 86 31.013 19.923 1.443 602 HH TYR 86 HH TYR 86 30.520 17.776 0.310 603 H SER 87 H SER 87 33.363 17.724 8.089 604 HA SER 87 HA SER 87 31.605 15.651 7.557 605 HB2 SER 87 HB2 SER 87 33.138 15.914 10.139 606 HB3 SER 87 HB3 SER 87 32.773 14.448 9.225 607 HG SER 87 HG SER 87 34.350 14.889 7.831 608 H ALA 88 H ALA 88 31.496 18.105 10.078 609 HA ALA 88 HA ALA 88 29.522 16.810 11.683 610 HB1 ALA 88 HB1 ALA 88 29.402 18.927 12.892 611 HB2 ALA 88 HB2 ALA 88 30.363 19.708 11.636 612 HB3 ALA 88 HB3 ALA 88 31.077 18.441 12.632 613 H VAL 89 H VAL 89 29.499 19.072 9.042 614 HA VAL 89 HA VAL 89 26.724 19.764 9.249 615 HB VAL 89 HB VAL 89 28.656 20.086 6.944 616 HG11 VAL 89 HG11 VAL 89 25.991 21.415 7.446 617 HG12 VAL 89 HG12 VAL 89 26.332 20.209 6.205 618 HG13 VAL 89 HG13 VAL 89 27.099 21.795 6.128 619 HG21 VAL 89 HG21 VAL 89 29.400 21.241 8.965 620 HG22 VAL 89 HG22 VAL 89 27.842 22.063 9.069 621 HG23 VAL 89 HG23 VAL 89 28.918 22.382 7.710 622 H LEU 90 H LEU 90 28.665 17.540 7.285 623 HA LEU 90 HA LEU 90 26.652 16.736 5.520 624 HB2 LEU 90 HB2 LEU 90 29.201 16.346 5.456 625 HB3 LEU 90 HB3 LEU 90 28.863 14.933 6.432 626 HG LEU 90 HG LEU 90 27.251 14.220 4.645 627 HD11 LEU 90 HD11 LEU 90 27.000 16.411 3.581 628 HD12 LEU 90 HD12 LEU 90 27.481 15.163 2.436 629 HD13 LEU 90 HD13 LEU 90 28.673 16.319 3.030 630 HD21 LEU 90 HD21 LEU 90 30.169 14.428 3.957 631 HD22 LEU 90 HD22 LEU 90 29.020 13.357 3.159 632 HD23 LEU 90 HD23 LEU 90 29.388 13.139 4.869 633 H ASN 91 H ASN 91 27.682 15.468 8.635 634 HA ASN 91 HA ASN 91 26.088 13.186 8.750 635 HB2 ASN 91 HB2 ASN 91 26.994 15.034 10.959 636 HB3 ASN 91 HB3 ASN 91 26.139 13.525 11.261 637 HD21 ASN 91 HD22 ASN 91 28.796 14.263 12.097 638 HD22 ASN 91 HD21 ASN 91 29.876 13.107 11.400 639 H THR 92 H THR 92 25.301 16.531 9.570 640 HA THR 92 HA THR 92 22.707 16.100 10.553 641 HB THR 92 HB THR 92 23.707 18.537 9.064 642 HG1 THR 92 HG1 THR 92 23.774 18.096 11.874 643 HG21 THR 92 HG21 THR 92 22.065 19.738 10.429 644 HG22 THR 92 HG22 THR 92 21.558 18.218 11.165 645 HG23 THR 92 HG23 THR 92 21.284 18.499 9.447 646 H ILE 93 H ILE 93 23.819 17.049 7.311 647 HA ILE 93 HA ILE 93 21.326 17.232 6.078 648 HB ILE 93 HB ILE 93 23.934 16.418 4.788 649 HG12 ILE 93 HG12 ILE 93 24.156 18.528 6.006 650 HG13 ILE 93 HG13 ILE 93 24.199 18.811 4.271 651 HG21 ILE 93 HG21 ILE 93 21.453 17.628 3.574 652 HG22 ILE 93 HG22 ILE 93 22.015 15.970 3.360 653 HG23 ILE 93 HG23 ILE 93 22.968 17.313 2.727 654 HD11 ILE 93 HD11 ILE 93 22.888 20.505 5.416 655 HD12 ILE 93 HD12 ILE 93 21.825 19.257 6.069 656 HD13 ILE 93 HD13 ILE 93 21.878 19.551 4.331 657 H GLY 94 H GLY 94 23.552 14.466 6.229 658 HA2 GLY 94 HA2 GLY 94 22.000 12.733 4.642 659 HA3 GLY 94 HA3 GLY 94 23.239 12.236 5.778 660 H ALA 95 H ALA 95 22.086 13.248 8.114 661 HA ALA 95 HA ALA 95 20.389 11.093 8.804 662 HB1 ALA 95 HB1 ALA 95 21.847 12.138 10.443 663 HB2 ALA 95 HB2 ALA 95 20.166 12.226 10.973 664 HB3 ALA 95 HB3 ALA 95 20.955 13.654 10.298 665 H CYS 96 H CYS 96 19.763 14.570 8.428 666 HA CYS 96 HA CYS 96 17.049 14.481 9.079 667 HB2 CYS 96 HB2 CYS 96 18.527 16.423 7.296 668 HB3 CYS 96 HB3 CYS 96 16.903 16.673 7.928 669 H LEU 97 H LEU 97 18.678 14.014 5.966 670 HA LEU 97 HA LEU 97 16.309 13.995 4.406 671 HB2 LEU 97 HB2 LEU 97 19.113 13.555 3.973 672 HB3 LEU 97 HB3 LEU 97 18.164 12.345 3.128 673 HG LEU 97 HG LEU 97 17.928 15.341 2.821 674 HD11 LEU 97 HD11 LEU 97 18.806 13.192 0.909 675 HD12 LEU 97 HD12 LEU 97 19.870 14.329 1.740 676 HD13 LEU 97 HD13 LEU 97 18.695 14.918 0.564 677 HD21 LEU 97 HD21 LEU 97 16.322 13.110 1.577 678 HD22 LEU 97 HD22 LEU 97 16.323 14.778 1.005 679 HD23 LEU 97 HD23 LEU 97 15.723 14.401 2.619 680 H ARG 98 H ARG 98 18.137 11.449 6.034 681 HA ARG 98 HA ARG 98 16.742 9.270 4.922 682 HB2 ARG 98 HB2 ARG 98 18.852 8.899 5.940 683 HB3 ARG 98 HB3 ARG 98 18.343 9.657 7.440 684 HG2 ARG 98 HG2 ARG 98 16.558 7.592 7.162 685 HG3 ARG 98 HG3 ARG 98 18.073 6.910 6.554 686 HD2 ARG 98 HD2 ARG 98 17.741 8.361 9.164 687 HD3 ARG 98 HD3 ARG 98 17.784 6.604 8.990 688 HE ARG 98 HE ARG 98 20.099 7.177 7.915 689 HH11 ARG 98 HH11 ARG 98 18.615 8.752 10.678 690 HH12 ARG 98 HH12 ARG 98 20.140 9.105 11.442 691 HH21 ARG 98 HH21 ARG 98 22.088 7.659 8.907 692 HH22 ARG 98 HH22 ARG 98 22.114 8.467 10.442 693 H GLU 99 H GLU 99 16.289 11.117 7.919 694 HA GLU 99 HA GLU 99 14.122 9.594 8.909 695 HB2 GLU 99 HB2 GLU 99 14.587 12.532 9.426 696 HB3 GLU 99 HB3 GLU 99 13.759 11.382 10.463 697 HG2 GLU 99 HG2 GLU 99 16.696 11.306 9.817 698 HG3 GLU 99 HG3 GLU 99 15.997 12.028 11.260 699 H SER 100 H SER 100 14.208 12.728 7.233 700 HA SER 100 HA SER 100 11.497 13.269 7.247 701 HB2 SER 100 HB2 SER 100 11.994 14.757 5.286 702 HB3 SER 100 HB3 SER 100 13.046 14.994 6.679 703 HG SER 100 HG SER 100 14.688 14.129 5.617 704 H MET 101 H MET 101 13.315 11.262 5.020 705 HA MET 101 HA MET 101 11.476 10.968 2.968 706 HB2 MET 101 HB2 MET 101 13.553 9.138 4.117 707 HB3 MET 101 HB3 MET 101 12.490 8.578 2.835 708 HG2 MET 101 HG2 MET 101 14.185 11.050 2.627 709 HG3 MET 101 HG3 MET 101 14.705 9.455 2.084 710 HE1 MET 101 HE1 MET 101 13.629 8.125 0.136 711 HE2 MET 101 HE2 MET 101 12.262 8.678 -0.830 712 HE3 MET 101 HE3 MET 101 12.020 8.212 0.852 713 H MET 102 H MET 102 11.736 9.018 5.959 714 HA MET 102 HA MET 102 9.296 7.634 5.207 715 HB2 MET 102 HB2 MET 102 9.671 6.158 7.007 716 HB3 MET 102 HB3 MET 102 11.228 6.437 6.252 717 HG2 MET 102 HG2 MET 102 11.837 7.974 8.030 718 HG3 MET 102 HG3 MET 102 10.257 7.740 8.781 719 HE1 MET 102 HE1 MET 102 10.458 3.823 9.523 720 HE2 MET 102 HE2 MET 102 9.974 4.547 7.986 721 HE3 MET 102 HE3 MET 102 9.395 5.230 9.504 722 H GLN 103 H GLN 103 10.259 10.286 7.143 723 HA GLN 103 HA GLN 103 7.972 10.447 8.807 724 HB2 GLN 103 HB2 GLN 103 10.154 12.236 8.026 725 HB3 GLN 103 HB3 GLN 103 8.647 13.073 8.345 726 HG2 GLN 103 HG2 GLN 103 9.997 13.009 10.337 727 HG3 GLN 103 HG3 GLN 103 8.548 12.035 10.561 728 HE21 GLN 103 HE22 GLN 103 8.738 9.809 10.741 729 HE22 GLN 103 HE21 GLN 103 10.256 9.028 11.023 730 H ALA 104 H ALA 104 8.526 11.161 5.459 731 HA ALA 104 HA ALA 104 6.237 12.822 5.090 732 HB1 ALA 104 HB1 ALA 104 8.144 12.908 3.561 733 HB2 ALA 104 HB2 ALA 104 6.648 12.532 2.702 734 HB3 ALA 104 HB3 ALA 104 7.812 11.252 3.051 735 H THR 105 H THR 105 6.866 9.578 3.765 736 HA THR 105 HA THR 105 4.697 8.184 4.627 737 HB THR 105 HB THR 105 3.265 9.994 3.724 738 HG1 THR 105 HG1 THR 105 2.303 7.993 3.776 739 HG21 THR 105 HG21 THR 105 4.674 10.658 1.834 740 HG22 THR 105 HG22 THR 105 3.033 10.279 1.308 741 HG23 THR 105 HG23 THR 105 4.334 9.120 1.040 742 H GLY 106 H GLY 106 6.989 8.889 2.168 743 HA2 GLY 106 HA2 GLY 106 6.434 6.486 0.643 744 HA3 GLY 106 HA3 GLY 106 7.659 7.695 0.287 745 H SER 107 H SER 107 7.790 6.756 3.535 746 HA SER 107 HA SER 107 9.332 5.660 4.751 747 HB2 SER 107 HB2 SER 107 9.401 3.799 2.374 748 HB3 SER 107 HB3 SER 107 10.021 3.438 3.982 749 HG SER 107 HG SER 107 7.329 3.920 3.226 750 H VAL 108 H VAL 108 11.703 4.792 4.638 751 HA VAL 108 HA VAL 108 13.180 6.719 3.025 752 HB VAL 108 HB VAL 108 13.780 7.062 5.247 753 HG11 VAL 108 HG11 VAL 108 14.425 5.295 6.814 754 HG12 VAL 108 HG12 VAL 108 14.027 4.085 5.592 755 HG13 VAL 108 HG13 VAL 108 12.761 5.132 6.245 756 HG21 VAL 108 HG21 VAL 108 16.121 6.373 5.416 757 HG22 VAL 108 HG22 VAL 108 15.718 6.941 3.796 758 HG23 VAL 108 HG23 VAL 108 15.872 5.211 4.111 759 H ASP 109 H ASP 109 13.681 5.980 1.208 760 HA ASP 109 HA ASP 109 13.850 3.249 0.505 761 HB2 ASP 109 HB2 ASP 109 13.035 4.965 -1.036 762 HB3 ASP 109 HB3 ASP 109 14.620 5.733 -1.041 763 H ASN 110 H ASN 110 15.728 2.412 -0.837 764 HA ASN 110 HA ASN 110 18.196 2.840 0.702 765 HB2 ASN 110 HB2 ASN 110 17.299 0.520 -1.019 766 HB3 ASN 110 HB3 ASN 110 18.886 0.632 -0.268 767 HD21 ASN 110 HD22 ASN 110 15.494 0.137 0.256 768 HD22 ASN 110 HD21 ASN 110 15.626 -0.439 1.878 769 H ALA 111 H ALA 111 16.808 3.374 -2.388 770 HA ALA 111 HA ALA 111 19.459 3.519 -3.653 771 HB1 ALA 111 HB1 ALA 111 17.745 2.156 -4.789 772 HB2 ALA 111 HB2 ALA 111 18.299 3.505 -5.780 773 HB3 ALA 111 HB3 ALA 111 16.739 3.594 -4.963 774 H PHE 112 H PHE 112 16.424 5.401 -3.442 775 HA PHE 112 HA PHE 112 17.392 7.729 -4.669 776 HB2 PHE 112 HB2 PHE 112 15.022 7.428 -4.331 777 HB3 PHE 112 HB3 PHE 112 15.230 7.356 -2.586 778 HD1 PHE 112 HD2 PHE 112 15.198 9.563 -5.521 779 HD2 PHE 112 HD1 PHE 112 15.481 9.355 -1.278 780 HE1 PHE 112 HE2 PHE 112 14.825 11.993 -5.374 781 HE2 PHE 112 HE1 PHE 112 15.113 11.783 -1.126 782 HZ PHE 112 HZ PHE 112 14.780 13.103 -3.179 783 H THR 113 H THR 113 17.108 6.978 -1.214 784 HA THR 113 HA THR 113 18.257 9.350 -0.263 785 HB THR 113 HB THR 113 18.634 6.931 1.384 786 HG1 THR 113 HG1 THR 113 16.647 6.186 1.185 787 HG21 THR 113 HG21 THR 113 17.452 8.285 3.037 788 HG22 THR 113 HG22 THR 113 17.062 9.478 1.800 789 HG23 THR 113 HG23 THR 113 18.739 9.230 2.285 790 H ASN 114 H ASN 114 19.642 6.607 -1.704 791 HA ASN 114 HA ASN 114 22.275 6.954 -0.526 792 HB2 ASN 114 HB2 ASN 114 21.445 4.692 -0.894 793 HB3 ASN 114 HB3 ASN 114 21.206 5.029 -2.602 794 HD21 ASN 114 HD22 ASN 114 22.494 3.353 -3.231 795 HD22 ASN 114 HD21 ASN 114 24.211 3.377 -3.066 796 H GLU 115 H GLU 115 20.740 7.197 -3.741 797 HA GLU 115 HA GLU 115 23.006 8.023 -5.131 798 HB2 GLU 115 HB2 GLU 115 20.898 7.068 -6.088 799 HB3 GLU 115 HB3 GLU 115 20.101 8.597 -5.738 800 HG2 GLU 115 HG2 GLU 115 21.623 9.743 -7.186 801 HG3 GLU 115 HG3 GLU 115 22.479 8.244 -7.508 802 H VAL 116 H VAL 116 20.238 9.867 -3.858 803 HA VAL 116 HA VAL 116 21.054 12.404 -4.639 804 HB VAL 116 HB VAL 116 19.419 11.581 -2.234 805 HG11 VAL 116 HG11 VAL 116 20.350 13.809 -1.861 806 HG12 VAL 116 HG12 VAL 116 18.613 13.888 -2.153 807 HG13 VAL 116 HG13 VAL 116 19.741 14.333 -3.431 808 HG21 VAL 116 HG21 VAL 116 17.520 12.250 -3.632 809 HG22 VAL 116 HG22 VAL 116 18.453 10.952 -4.378 810 HG23 VAL 116 HG23 VAL 116 18.627 12.610 -4.956 811 H MET 117 H MET 117 21.774 10.679 -1.607 812 HA MET 117 HA MET 117 23.117 12.735 -0.308 813 HB2 MET 117 HB2 MET 117 22.340 10.745 0.828 814 HB3 MET 117 HB3 MET 117 23.404 9.740 -0.142 815 HG2 MET 117 HG2 MET 117 24.592 9.869 1.758 816 HG3 MET 117 HG3 MET 117 25.255 11.240 0.885 817 HE1 MET 117 HE1 MET 117 24.729 13.719 1.391 818 HE2 MET 117 HE2 MET 117 23.770 14.307 2.751 819 HE3 MET 117 HE3 MET 117 22.968 13.593 1.355 820 H GLN 118 H GLN 118 24.313 10.184 -2.459 821 HA GLN 118 HA GLN 118 27.043 10.755 -2.244 822 HB2 GLN 118 HB2 GLN 118 26.057 8.737 -3.338 823 HB3 GLN 118 HB3 GLN 118 25.604 9.747 -4.705 824 HG2 GLN 118 HG2 GLN 118 27.628 8.594 -5.242 825 HG3 GLN 118 HG3 GLN 118 27.997 10.306 -5.023 826 HE21 GLN 118 HE22 GLN 118 28.373 7.110 -3.765 827 HE22 GLN 118 HE21 GLN 118 29.589 7.484 -2.594 828 H LEU 119 H LEU 119 24.629 11.944 -4.560 829 HA LEU 119 HA LEU 119 26.407 13.601 -5.974 830 HB2 LEU 119 HB2 LEU 119 23.445 13.388 -5.784 831 HB3 LEU 119 HB3 LEU 119 24.141 14.802 -6.553 832 HG LEU 119 HG LEU 119 25.437 13.177 -8.025 833 HD11 LEU 119 HD11 LEU 119 24.404 10.977 -8.343 834 HD12 LEU 119 HD12 LEU 119 23.394 11.266 -6.926 835 HD13 LEU 119 HD13 LEU 119 25.145 11.154 -6.753 836 HD21 LEU 119 HD21 LEU 119 22.440 13.282 -8.233 837 HD22 LEU 119 HD22 LEU 119 23.553 12.893 -9.544 838 HD23 LEU 119 HD23 LEU 119 23.569 14.501 -8.821 839 H VAL 120 H VAL 120 24.226 14.317 -3.237 840 HA VAL 120 HA VAL 120 24.607 17.070 -3.130 841 HB VAL 120 HB VAL 120 24.262 15.135 -0.830 842 HG11 VAL 120 HG11 VAL 120 24.043 18.146 -0.825 843 HG12 VAL 120 HG12 VAL 120 25.286 17.194 -0.011 844 HG13 VAL 120 HG13 VAL 120 23.604 17.082 0.513 845 HG21 VAL 120 HG21 VAL 120 22.314 16.941 -2.259 846 HG22 VAL 120 HG22 VAL 120 21.940 15.926 -0.868 847 HG23 VAL 120 HG23 VAL 120 22.400 15.185 -2.400 848 H LYS 121 H LYS 121 26.597 14.504 -1.736 849 HA LYS 121 HA LYS 121 28.576 16.137 -0.584 850 HB2 LYS 121 HB2 LYS 121 28.669 13.306 -1.636 851 HB3 LYS 121 HB3 LYS 121 29.948 14.044 -0.682 852 HG2 LYS 121 HG2 LYS 121 28.784 13.903 1.246 853 HG3 LYS 121 HG3 LYS 121 27.225 14.138 0.457 854 HD2 LYS 121 HD2 LYS 121 27.485 11.878 1.421 855 HD3 LYS 121 HD3 LYS 121 27.224 11.853 -0.321 856 HE2 LYS 121 HE2 LYS 121 29.635 11.547 -0.667 857 HE3 LYS 121 HE3 LYS 121 29.888 11.585 1.077 858 HZ1 LYS 121 HZ1 LYS 121 28.518 9.598 1.276 859 HZ2 LYS 121 HZ2 LYS 121 29.833 9.321 0.248 860 HZ3 LYS 121 HZ3 LYS 121 28.294 9.558 -0.399 861 H MET 122 H MET 122 28.429 14.521 -3.745 862 HA MET 122 HA MET 122 31.083 15.342 -4.446 863 HB2 MET 122 HB2 MET 122 30.245 13.193 -5.169 864 HB3 MET 122 HB3 MET 122 28.917 13.956 -6.023 865 HG2 MET 122 HG2 MET 122 31.682 14.699 -6.806 866 HG3 MET 122 HG3 MET 122 31.089 13.103 -7.261 867 HE1 MET 122 HE1 MET 122 28.002 13.943 -9.486 868 HE2 MET 122 HE2 MET 122 28.000 13.588 -7.758 869 HE3 MET 122 HE3 MET 122 29.041 12.671 -8.847 870 H LEU 123 H LEU 123 27.925 16.670 -4.950 871 HA LEU 123 HA LEU 123 28.828 18.354 -7.148 872 HB2 LEU 123 HB2 LEU 123 26.167 18.244 -5.721 873 HB3 LEU 123 HB3 LEU 123 26.515 19.240 -7.118 874 HG LEU 123 HG LEU 123 26.596 16.221 -7.118 875 HD11 LEU 123 HD11 LEU 123 24.332 17.042 -6.740 876 HD12 LEU 123 HD12 LEU 123 24.498 16.348 -8.353 877 HD13 LEU 123 HD13 LEU 123 24.473 18.099 -8.145 878 HD21 LEU 123 HD21 LEU 123 28.029 17.140 -8.821 879 HD22 LEU 123 HD22 LEU 123 26.762 18.253 -9.338 880 HD23 LEU 123 HD23 LEU 123 26.562 16.516 -9.577 881 H SER 124 H SER 124 29.312 18.474 -3.933 882 HA SER 124 HA SER 124 29.089 21.407 -3.871 883 HB2 SER 124 HB2 SER 124 28.985 21.164 -1.369 884 HB3 SER 124 HB3 SER 124 27.595 20.492 -2.219 885 HG SER 124 HG SER 124 28.152 18.534 -1.628 886 H ALA 125 H ALA 125 30.852 18.860 -2.122 887 HA ALA 125 HA ALA 125 33.397 19.991 -2.874 888 HB1 ALA 125 HB1 ALA 125 34.125 20.531 -0.636 889 HB2 ALA 125 HB2 ALA 125 32.552 20.066 0.011 890 HB3 ALA 125 HB3 ALA 125 32.690 21.469 -1.047 891 H ASP 126 H ASP 126 34.361 18.192 -3.446 892 HA ASP 126 HA ASP 126 34.077 15.774 -1.837 893 HB2 ASP 126 HB2 ASP 126 33.883 15.559 -4.276 894 HB3 ASP 126 HB3 ASP 126 35.489 16.244 -4.477 895 H SER 127 H SER 127 35.749 18.423 -1.540 896 HA SER 127 HA SER 127 38.405 17.356 -1.051 897 HB2 SER 127 HB2 SER 127 37.322 20.111 -0.456 898 HB3 SER 127 HB3 SER 127 39.016 19.640 -0.604 899 HG SER 127 HG SER 127 38.345 18.984 -2.844 900 H ALA 128 H ALA 128 36.137 16.371 0.501 901 HA ALA 128 HA ALA 128 36.336 17.599 3.111 902 HB1 ALA 128 HB1 ALA 128 34.773 15.186 2.197 903 HB2 ALA 128 HB2 ALA 128 34.164 16.839 2.312 904 HB3 ALA 128 HB3 ALA 128 34.634 15.968 3.772 905 H ASN 129 H ASN 129 38.456 15.821 1.621 906 HA ASN 129 HA ASN 129 38.920 13.563 3.245 907 HB2 ASN 129 HB2 ASN 129 39.957 13.906 1.009 908 HB3 ASN 129 HB3 ASN 129 40.939 15.198 1.683 909 HD21 ASN 129 HD22 ASN 129 42.621 14.675 3.107 910 HD22 ASN 129 HD21 ASN 129 43.249 13.068 3.224 911 H GLU 130 H GLU 130 39.925 13.310 5.128 912 HA GLU 130 HA GLU 130 40.159 15.205 7.054 913 HB2 GLU 130 HB2 GLU 130 41.992 12.818 6.756 914 HB3 GLU 130 HB3 GLU 130 41.691 13.702 8.243 915 HG2 GLU 130 HG2 GLU 130 40.387 11.788 8.434 916 HG3 GLU 130 HG3 GLU 130 39.246 13.037 7.938 917 H VAL 131 H VAL 131 41.166 17.096 6.918 918 HA VAL 131 HA VAL 131 43.790 17.269 5.674 919 HB VAL 131 HB VAL 131 42.169 18.963 5.020 920 HG11 VAL 131 HG11 VAL 131 41.359 20.661 6.568 921 HG12 VAL 131 HG12 VAL 131 42.145 19.824 7.906 922 HG13 VAL 131 HG13 VAL 131 40.818 19.050 7.040 923 HG21 VAL 131 HG21 VAL 131 43.525 20.986 5.494 924 HG22 VAL 131 HG22 VAL 131 44.475 19.607 4.945 925 HG23 VAL 131 HG23 VAL 131 44.459 20.040 6.651 926 H SER 132 H SER 132 45.509 16.924 6.861 927 HA SER 132 HA SER 132 45.379 16.995 9.732 928 HB2 SER 132 HB2 SER 132 47.733 16.407 7.924 929 HB3 SER 132 HB3 SER 132 47.637 16.068 9.649 930 HG SER 132 HG SER 132 45.671 14.787 8.970 931 H THR 133 H THR 133 44.936 19.325 9.805 932 HA THR 133 HA THR 133 47.456 20.696 10.273 933 HB THR 133 HB THR 133 46.791 21.462 8.030 934 HG1 THR 133 HG1 THR 133 47.587 22.904 9.940 935 HG21 THR 133 HG21 THR 133 44.311 22.564 9.358 936 HG22 THR 133 HG22 THR 133 44.346 21.177 8.272 937 HG23 THR 133 HG23 THR 133 44.783 22.777 7.671 Start of MODEL 5 1 HA2 GLY 1 HA2 GLY 1 10.717 1.522 -1.884 2 HA3 GLY 1 HA3 GLY 1 12.367 1.124 -1.421 3 H SER 2 H SER 2 10.289 1.368 -3.975 4 HA SER 2 HA SER 2 11.211 -0.836 -5.552 5 HB2 SER 2 HB2 SER 2 10.095 0.749 -7.386 6 HB3 SER 2 HB3 SER 2 9.119 -0.203 -6.267 7 HG SER 2 HG SER 2 9.608 2.557 -6.326 8 H GLY 3 H GLY 3 13.158 -0.945 -6.411 9 HA2 GLY 3 HA2 GLY 3 14.980 1.213 -6.405 10 HA3 GLY 3 HA3 GLY 3 15.230 -0.343 -7.181 11 H ASN 4 H ASN 4 15.194 2.829 -7.741 12 HA ASN 4 HA ASN 4 15.502 4.017 -9.639 13 HB2 ASN 4 HB2 ASN 4 16.585 2.069 -10.616 14 HB3 ASN 4 HB3 ASN 4 15.023 1.387 -11.058 15 HD21 ASN 4 HD22 ASN 4 15.568 1.311 -13.232 16 HD22 ASN 4 HD21 ASN 4 15.658 2.730 -14.213 17 H SER 5 H SER 5 12.920 1.711 -10.550 18 HA SER 5 HA SER 5 11.493 3.869 -11.814 19 HB2 SER 5 HB2 SER 5 10.765 0.951 -11.490 20 HB3 SER 5 HB3 SER 5 9.918 2.112 -12.516 21 HG SER 5 HG SER 5 11.438 0.904 -13.713 22 H GLN 6 H GLN 6 9.961 5.043 -10.995 23 HA GLN 6 HA GLN 6 8.294 5.864 -9.733 24 HB2 GLN 6 HB2 GLN 6 7.190 3.698 -10.190 25 HB3 GLN 6 HB3 GLN 6 7.911 3.048 -8.723 26 HG2 GLN 6 HG2 GLN 6 6.701 4.654 -7.380 27 HG3 GLN 6 HG3 GLN 6 6.031 5.389 -8.834 28 HE21 GLN 6 HE22 GLN 6 4.458 4.306 -9.991 29 HE22 GLN 6 HE21 GLN 6 3.556 2.993 -9.316 30 HA PRO 7 HA PRO 7 10.682 6.208 -5.885 31 HB2 PRO 7 HB2 PRO 7 11.242 8.920 -6.437 32 HB3 PRO 7 HB3 PRO 7 12.353 7.561 -6.610 33 HG2 PRO 7 HG2 PRO 7 11.351 9.122 -8.702 34 HG3 PRO 7 HG3 PRO 7 12.128 7.541 -8.870 35 HD2 PRO 7 HD2 PRO 7 9.216 8.230 -8.814 36 HD3 PRO 7 HD3 PRO 7 10.074 7.012 -9.787 37 H ILE 8 H ILE 8 10.579 8.714 -4.669 38 HA ILE 8 HA ILE 8 7.921 8.615 -3.595 39 HB ILE 8 HB ILE 8 9.869 8.877 -2.142 40 HG12 ILE 8 HG12 ILE 8 8.238 11.415 -2.013 41 HG13 ILE 8 HG13 ILE 8 7.613 9.848 -1.507 42 HG21 ILE 8 HG21 ILE 8 10.227 11.555 -3.474 43 HG22 ILE 8 HG22 ILE 8 11.302 10.163 -3.614 44 HG23 ILE 8 HG23 ILE 8 11.119 10.985 -2.064 45 HD11 ILE 8 HD11 ILE 8 10.021 11.223 -0.339 46 HD12 ILE 8 HD12 ILE 8 9.315 9.702 0.209 47 HD13 ILE 8 HD13 ILE 8 8.406 11.205 0.368 48 H TRP 9 H TRP 9 9.180 10.228 -6.217 49 HA TRP 9 HA TRP 9 7.893 12.775 -5.864 50 HB2 TRP 9 HB2 TRP 9 9.020 11.557 -8.392 51 HB3 TRP 9 HB3 TRP 9 8.624 13.251 -8.137 52 HD1 TRP 9 HD1 TRP 9 11.374 10.761 -7.708 53 HE1 TRP 9 HE1 TRP 9 13.446 11.888 -6.682 54 HE3 TRP 9 HE3 TRP 9 9.267 15.214 -6.364 55 HZ2 TRP 9 HZ2 TRP 9 14.095 14.355 -5.469 56 HZ3 TRP 9 HZ3 TRP 9 10.683 16.910 -5.278 57 HH2 TRP 9 HH2 TRP 9 13.046 16.486 -4.840 58 H THR 10 H THR 10 6.345 10.103 -5.968 59 HA THR 10 HA THR 10 4.708 10.363 -8.318 60 HB THR 10 HB THR 10 3.334 8.614 -6.829 61 HG1 THR 10 HG1 THR 10 5.850 7.815 -5.988 62 HG21 THR 10 HG21 THR 10 5.902 8.022 -8.301 63 HG22 THR 10 HG22 THR 10 4.300 8.170 -9.024 64 HG23 THR 10 HG23 THR 10 4.648 6.845 -7.914 65 H ASN 11 H ASN 11 4.630 11.535 -5.074 66 HA ASN 11 HA ASN 11 2.032 12.770 -5.636 67 HB2 ASN 11 HB2 ASN 11 1.561 10.959 -4.088 68 HB3 ASN 11 HB3 ASN 11 2.848 11.499 -3.015 69 HD21 ASN 11 HD22 ASN 11 1.328 11.624 -1.333 70 HD22 ASN 11 HD21 ASN 11 0.223 12.956 -1.218 71 HA PRO 12 HA PRO 12 4.528 16.412 -5.136 72 HB2 PRO 12 HB2 PRO 12 1.771 17.481 -4.720 73 HB3 PRO 12 HB3 PRO 12 3.079 18.110 -5.728 74 HG2 PRO 12 HG2 PRO 12 1.049 16.772 -6.816 75 HG3 PRO 12 HG3 PRO 12 2.705 16.570 -7.415 76 HD2 PRO 12 HD2 PRO 12 1.050 14.723 -5.779 77 HD3 PRO 12 HD3 PRO 12 2.331 14.360 -6.953 78 H ASN 13 H ASN 13 1.768 15.811 -2.958 79 HA ASN 13 HA ASN 13 2.678 17.546 -0.923 80 HB2 ASN 13 HB2 ASN 13 0.340 16.748 -1.073 81 HB3 ASN 13 HB3 ASN 13 0.880 15.129 -0.644 82 HD21 ASN 13 HD22 ASN 13 0.242 18.332 0.499 83 HD22 ASN 13 HD21 ASN 13 0.418 17.991 2.189 84 H ALA 14 H ALA 14 3.177 14.123 -1.548 85 HA ALA 14 HA ALA 14 4.392 13.496 0.943 86 HB1 ALA 14 HB1 ALA 14 5.070 11.418 -0.138 87 HB2 ALA 14 HB2 ALA 14 4.620 12.080 -1.709 88 HB3 ALA 14 HB3 ALA 14 3.383 11.791 -0.486 89 H ALA 15 H ALA 15 5.662 14.258 -2.260 90 HA ALA 15 HA ALA 15 8.393 13.999 -1.633 91 HB1 ALA 15 HB1 ALA 15 7.553 14.032 -3.932 92 HB2 ALA 15 HB2 ALA 15 8.794 15.260 -3.685 93 HB3 ALA 15 HB3 ALA 15 7.093 15.725 -3.740 94 H MET 16 H MET 16 6.248 16.835 -1.696 95 HA MET 16 HA MET 16 8.181 18.715 -0.941 96 HB2 MET 16 HB2 MET 16 5.336 18.641 -1.335 97 HB3 MET 16 HB3 MET 16 5.718 19.572 0.109 98 HG2 MET 16 HG2 MET 16 6.831 20.039 -2.645 99 HG3 MET 16 HG3 MET 16 5.553 20.966 -1.874 100 HE1 MET 16 HE1 MET 16 9.063 20.994 -2.865 101 HE2 MET 16 HE2 MET 16 9.414 19.925 -1.511 102 HE3 MET 16 HE3 MET 16 10.020 21.578 -1.506 103 H THR 17 H THR 17 6.326 16.437 0.921 104 HA THR 17 HA THR 17 6.606 17.590 3.460 105 HB THR 17 HB THR 17 6.460 14.652 2.732 106 HG1 THR 17 HG1 THR 17 4.632 16.056 2.154 107 HG21 THR 17 HG21 THR 17 6.067 16.044 5.389 108 HG22 THR 17 HG22 THR 17 7.356 14.914 4.977 109 HG23 THR 17 HG23 THR 17 5.688 14.353 5.070 110 H MET 18 H MET 18 8.707 15.243 1.760 111 HA MET 18 HA MET 18 10.523 15.135 3.963 112 HB2 MET 18 HB2 MET 18 11.996 13.832 2.427 113 HB3 MET 18 HB3 MET 18 10.385 13.173 2.624 114 HG2 MET 18 HG2 MET 18 10.782 12.926 0.372 115 HG3 MET 18 HG3 MET 18 9.845 14.415 0.441 116 HE1 MET 18 HE1 MET 18 11.761 13.268 -1.968 117 HE2 MET 18 HE2 MET 18 12.432 14.790 -2.551 118 HE3 MET 18 HE3 MET 18 10.722 14.685 -2.131 119 H THR 19 H THR 19 10.332 17.055 1.050 120 HA THR 19 HA THR 19 12.951 18.104 1.138 121 HB THR 19 HB THR 19 10.530 19.620 0.167 122 HG1 THR 19 HG1 THR 19 11.783 17.323 -0.886 123 HG21 THR 19 HG21 THR 19 12.087 20.541 -1.452 124 HG22 THR 19 HG22 THR 19 13.375 19.506 -0.833 125 HG23 THR 19 HG23 THR 19 12.706 20.784 0.182 126 H ASN 20 H ASN 20 9.884 19.197 2.573 127 HA ASN 20 HA ASN 20 10.950 21.567 3.720 128 HB2 ASN 20 HB2 ASN 20 8.407 20.030 4.059 129 HB3 ASN 20 HB3 ASN 20 8.813 21.287 5.219 130 HD21 ASN 20 HD22 ASN 20 7.873 20.569 1.984 131 HD22 ASN 20 HD21 ASN 20 7.540 22.196 1.498 132 H ASN 21 H ASN 21 10.361 18.305 4.986 133 HA ASN 21 HA ASN 21 11.002 18.862 7.655 134 HB2 ASN 21 HB2 ASN 21 11.164 16.308 6.056 135 HB3 ASN 21 HB3 ASN 21 11.529 16.379 7.773 136 HD21 ASN 21 HD22 ASN 21 9.462 14.873 6.480 137 HD22 ASN 21 HD21 ASN 21 7.960 15.428 7.126 138 H LEU 22 H LEU 22 13.009 18.101 4.886 139 HA LEU 22 HA LEU 22 15.438 17.691 6.247 140 HB2 LEU 22 HB2 LEU 22 15.148 17.099 3.903 141 HB3 LEU 22 HB3 LEU 22 14.909 18.785 3.484 142 HG LEU 22 HG LEU 22 17.254 19.231 4.241 143 HD11 LEU 22 HD11 LEU 22 17.552 17.333 5.712 144 HD12 LEU 22 HD12 LEU 22 18.772 17.316 4.438 145 HD13 LEU 22 HD13 LEU 22 17.389 16.224 4.350 146 HD21 LEU 22 HD21 LEU 22 16.852 17.254 2.002 147 HD22 LEU 22 HD22 LEU 22 18.298 18.238 2.237 148 HD23 LEU 22 HD23 LEU 22 16.750 19.011 1.893 149 H VAL 23 H VAL 23 13.980 20.591 4.836 150 HA VAL 23 HA VAL 23 16.088 22.352 5.473 151 HB VAL 23 HB VAL 23 13.160 22.987 5.057 152 HG11 VAL 23 HG11 VAL 23 15.571 24.796 4.879 153 HG12 VAL 23 HG12 VAL 23 14.374 24.807 6.171 154 HG13 VAL 23 HG13 VAL 23 13.904 25.247 4.531 155 HG21 VAL 23 HG21 VAL 23 13.800 23.487 2.758 156 HG22 VAL 23 HG22 VAL 23 14.160 21.809 3.162 157 HG23 VAL 23 HG23 VAL 23 15.459 23.000 3.105 158 H GLN 24 H GLN 24 13.072 21.540 7.188 159 HA GLN 24 HA GLN 24 13.455 23.467 9.235 160 HB2 GLN 24 HB2 GLN 24 11.605 22.499 10.341 161 HB3 GLN 24 HB3 GLN 24 11.278 22.312 8.625 162 HG2 GLN 24 HG2 GLN 24 12.068 19.982 8.766 163 HG3 GLN 24 HG3 GLN 24 12.274 20.187 10.503 164 HE21 GLN 24 HE22 GLN 24 9.651 21.625 8.693 165 HE22 GLN 24 HE21 GLN 24 8.398 20.653 9.377 166 H CYS 25 H CYS 25 14.450 20.120 8.862 167 HA CYS 25 HA CYS 25 15.409 19.746 11.504 168 HB2 CYS 25 HB2 CYS 25 14.936 17.896 9.909 169 HB3 CYS 25 HB3 CYS 25 16.317 18.405 8.945 170 H ALA 26 H ALA 26 16.898 20.868 8.497 171 HA ALA 26 HA ALA 26 19.520 21.129 9.566 172 HB1 ALA 26 HB1 ALA 26 20.047 22.304 7.537 173 HB2 ALA 26 HB2 ALA 26 18.339 22.552 7.187 174 HB3 ALA 26 HB3 ALA 26 19.022 20.924 7.144 175 H SER 27 H SER 27 16.709 23.184 9.550 176 HA SER 27 HA SER 27 18.108 25.578 10.262 177 HB2 SER 27 HB2 SER 27 15.174 24.902 10.577 178 HB3 SER 27 HB3 SER 27 15.883 26.514 10.658 179 HG SER 27 HG SER 27 15.915 24.787 8.399 180 H ARG 28 H ARG 28 16.709 22.900 11.989 181 HA ARG 28 HA ARG 28 17.052 24.265 14.561 182 HB2 ARG 28 HB2 ARG 28 15.706 21.663 13.801 183 HB3 ARG 28 HB3 ARG 28 15.868 22.229 15.456 184 HG2 ARG 28 HG2 ARG 28 14.611 24.055 13.486 185 HG3 ARG 28 HG3 ARG 28 13.690 22.654 14.025 186 HD2 ARG 28 HD2 ARG 28 13.193 24.616 15.386 187 HD3 ARG 28 HD3 ARG 28 13.958 23.352 16.343 188 HE ARG 28 HE ARG 28 15.886 24.670 16.527 189 HH11 ARG 28 HH11 ARG 28 13.417 26.241 14.605 190 HH12 ARG 28 HH12 ARG 28 14.098 27.825 14.780 191 HH21 ARG 28 HH21 ARG 28 16.761 26.767 16.811 192 HH22 ARG 28 HH22 ARG 28 15.992 28.127 16.057 193 H SER 29 H SER 29 19.133 23.029 12.660 194 HA SER 29 HA SER 29 20.191 20.773 14.032 195 HB2 SER 29 HB2 SER 29 22.103 21.004 12.507 196 HB3 SER 29 HB3 SER 29 20.579 21.134 11.631 197 HG SER 29 HG SER 29 20.999 23.157 11.158 198 H GLY 30 H GLY 30 21.155 24.179 13.794 199 HA2 GLY 30 HA2 GLY 30 22.177 25.465 15.478 200 HA3 GLY 30 HA3 GLY 30 22.518 23.984 16.368 201 H VAL 31 H VAL 31 23.297 23.274 13.325 202 HA VAL 31 HA VAL 31 26.142 23.797 13.792 203 HB VAL 31 HB VAL 31 24.829 21.905 11.829 204 HG11 VAL 31 HG11 VAL 31 27.716 22.155 12.674 205 HG12 VAL 31 HG12 VAL 31 27.049 22.634 11.113 206 HG13 VAL 31 HG13 VAL 31 27.062 20.934 11.582 207 HG21 VAL 31 HG21 VAL 31 24.395 21.219 14.117 208 HG22 VAL 31 HG22 VAL 31 26.111 21.343 14.501 209 HG23 VAL 31 HG23 VAL 31 25.550 20.123 13.358 210 H LEU 32 H LEU 32 23.570 24.202 11.434 211 HA LEU 32 HA LEU 32 25.260 25.364 9.432 212 HB2 LEU 32 HB2 LEU 32 22.288 25.044 9.734 213 HB3 LEU 32 HB3 LEU 32 22.956 26.026 8.449 214 HG LEU 32 HG LEU 32 24.226 23.998 7.671 215 HD11 LEU 32 HD11 LEU 32 24.162 22.729 9.759 216 HD12 LEU 32 HD12 LEU 32 23.487 21.813 8.414 217 HD13 LEU 32 HD13 LEU 32 22.414 22.556 9.599 218 HD21 LEU 32 HD21 LEU 32 21.219 23.922 7.723 219 HD22 LEU 32 HD22 LEU 32 22.224 22.939 6.660 220 HD23 LEU 32 HD23 LEU 32 22.249 24.696 6.522 221 H THR 33 H THR 33 24.893 27.549 8.569 222 HA THR 33 HA THR 33 24.589 29.502 10.719 223 HB THR 33 HB THR 33 25.491 31.125 9.112 224 HG1 THR 33 HG1 THR 33 26.338 29.699 7.112 225 HG21 THR 33 HG21 THR 33 27.091 28.569 9.147 226 HG22 THR 33 HG22 THR 33 27.076 29.792 10.419 227 HG23 THR 33 HG23 THR 33 27.726 30.184 8.827 228 H ALA 34 H ALA 34 23.360 31.528 10.167 229 HA ALA 34 HA ALA 34 20.728 30.984 9.393 230 HB1 ALA 34 HB1 ALA 34 20.386 33.395 9.428 231 HB2 ALA 34 HB2 ALA 34 22.130 33.657 9.404 232 HB3 ALA 34 HB3 ALA 34 21.374 32.897 10.805 233 H ASP 35 H ASP 35 23.530 32.086 7.606 234 HA ASP 35 HA ASP 35 22.219 32.774 5.183 235 HB2 ASP 35 HB2 ASP 35 25.051 31.760 5.582 236 HB3 ASP 35 HB3 ASP 35 24.444 32.595 4.157 237 H GLN 36 H GLN 36 23.828 29.872 6.350 238 HA GLN 36 HA GLN 36 23.539 28.316 4.028 239 HB2 GLN 36 HB2 GLN 36 25.065 28.024 6.096 240 HB3 GLN 36 HB3 GLN 36 23.686 27.215 6.822 241 HG2 GLN 36 HG2 GLN 36 23.741 25.486 5.196 242 HG3 GLN 36 HG3 GLN 36 24.926 26.362 4.223 243 HE21 GLN 36 HE22 GLN 36 26.428 24.712 4.301 244 HE22 GLN 36 HE21 GLN 36 27.301 24.314 5.742 245 H MET 37 H MET 37 21.499 28.735 6.887 246 HA MET 37 HA MET 37 19.613 26.707 6.223 247 HB2 MET 37 HB2 MET 37 19.262 29.181 7.927 248 HB3 MET 37 HB3 MET 37 18.120 27.852 7.837 249 HG2 MET 37 HG2 MET 37 19.807 26.352 8.758 250 HG3 MET 37 HG3 MET 37 20.939 27.703 8.860 251 HE1 MET 37 HE1 MET 37 21.402 28.563 11.094 252 HE2 MET 37 HE2 MET 37 21.148 26.852 11.441 253 HE3 MET 37 HE3 MET 37 20.464 28.080 12.508 254 H ASP 38 H ASP 38 19.868 30.139 5.470 255 HA ASP 38 HA ASP 38 17.237 30.449 4.476 256 HB2 ASP 38 HB2 ASP 38 18.790 32.314 5.168 257 HB3 ASP 38 HB3 ASP 38 19.655 32.062 3.656 258 H ASP 39 H ASP 39 20.317 29.674 2.911 259 HA ASP 39 HA ASP 39 19.273 29.655 0.270 260 HB2 ASP 39 HB2 ASP 39 21.716 29.817 0.899 261 HB3 ASP 39 HB3 ASP 39 21.666 28.096 1.259 262 H MET 40 H MET 40 19.519 27.242 2.812 263 HA MET 40 HA MET 40 18.656 24.976 1.412 264 HB2 MET 40 HB2 MET 40 18.278 25.861 4.268 265 HB3 MET 40 HB3 MET 40 17.593 24.355 3.685 266 HG2 MET 40 HG2 MET 40 20.513 25.013 3.478 267 HG3 MET 40 HG3 MET 40 19.805 24.193 4.866 268 HE1 MET 40 HE1 MET 40 18.567 20.834 3.382 269 HE2 MET 40 HE2 MET 40 17.604 22.301 3.563 270 HE3 MET 40 HE3 MET 40 18.746 21.835 4.825 271 H GLY 41 H GLY 41 16.834 27.606 2.907 272 HA2 GLY 41 HA2 GLY 41 14.257 26.592 2.342 273 HA3 GLY 41 HA3 GLY 41 14.653 28.277 2.660 274 H MET 42 H MET 42 16.399 28.777 0.541 275 HA MET 42 HA MET 42 14.585 29.268 -1.577 276 HB2 MET 42 HB2 MET 42 17.604 29.413 -1.532 277 HB3 MET 42 HB3 MET 42 16.599 30.020 -2.839 278 HG2 MET 42 HG2 MET 42 15.479 31.494 -1.128 279 HG3 MET 42 HG3 MET 42 16.751 31.019 -0.010 280 HE1 MET 42 HE1 MET 42 19.329 30.852 -1.791 281 HE2 MET 42 HE2 MET 42 19.275 31.695 -0.243 282 HE3 MET 42 HE3 MET 42 19.949 32.497 -1.659 283 H MET 43 H MET 43 16.943 26.760 -0.967 284 HA MET 43 HA MET 43 16.916 25.471 -3.452 285 HB2 MET 43 HB2 MET 43 18.514 24.912 -1.702 286 HB3 MET 43 HB3 MET 43 17.224 24.353 -0.655 287 HG2 MET 43 HG2 MET 43 17.716 23.065 -3.309 288 HG3 MET 43 HG3 MET 43 18.677 22.633 -1.899 289 HE1 MET 43 HE1 MET 43 15.932 21.223 0.534 290 HE2 MET 43 HE2 MET 43 16.427 22.913 0.439 291 HE3 MET 43 HE3 MET 43 17.636 21.633 0.336 292 H ALA 44 H ALA 44 14.980 24.772 -0.543 293 HA ALA 44 HA ALA 44 13.324 22.835 -1.721 294 HB1 ALA 44 HB1 ALA 44 12.744 24.647 0.620 295 HB2 ALA 44 HB2 ALA 44 13.541 23.073 0.690 296 HB3 ALA 44 HB3 ALA 44 11.849 23.185 0.202 297 H ASP 45 H ASP 45 13.078 26.322 -1.521 298 HA ASP 45 HA ASP 45 10.481 26.822 -2.295 299 HB2 ASP 45 HB2 ASP 45 12.052 28.577 -1.646 300 HB3 ASP 45 HB3 ASP 45 13.005 28.290 -3.095 301 H SER 46 H SER 46 13.288 26.256 -4.386 302 HA SER 46 HA SER 46 11.803 26.517 -6.803 303 HB2 SER 46 HB2 SER 46 14.217 26.989 -6.669 304 HB3 SER 46 HB3 SER 46 14.530 25.290 -6.321 305 HG SER 46 HG SER 46 14.776 25.307 -8.437 306 H VAL 47 H VAL 47 12.696 23.841 -4.719 307 HA VAL 47 HA VAL 47 12.375 21.712 -6.486 308 HB VAL 47 HB VAL 47 11.811 21.748 -3.511 309 HG11 VAL 47 HG11 VAL 47 10.743 19.828 -4.571 310 HG12 VAL 47 HG12 VAL 47 12.134 19.315 -3.613 311 HG13 VAL 47 HG13 VAL 47 12.259 19.410 -5.370 312 HG21 VAL 47 HG21 VAL 47 14.064 20.788 -3.330 313 HG22 VAL 47 HG22 VAL 47 14.091 22.393 -4.058 314 HG23 VAL 47 HG23 VAL 47 14.270 20.963 -5.072 315 H ASN 48 H ASN 48 9.914 23.175 -4.323 316 HA ASN 48 HA ASN 48 7.901 21.357 -5.115 317 HB2 ASN 48 HB2 ASN 48 6.309 22.949 -4.060 318 HB3 ASN 48 HB3 ASN 48 7.632 22.475 -3.011 319 HD21 ASN 48 HD22 ASN 48 9.071 23.987 -2.321 320 HD22 ASN 48 HD21 ASN 48 8.874 25.676 -2.599 321 H SER 49 H SER 49 8.957 24.434 -6.410 322 HA SER 49 HA SER 49 6.728 24.977 -8.018 323 HB2 SER 49 HB2 SER 49 8.550 26.601 -7.584 324 HB3 SER 49 HB3 SER 49 9.633 25.634 -8.582 325 HG SER 49 HG SER 49 7.272 26.988 -9.407 326 H GLN 50 H GLN 50 9.765 23.290 -8.855 327 HA GLN 50 HA GLN 50 8.828 22.606 -11.450 328 HB2 GLN 50 HB2 GLN 50 10.894 21.096 -11.442 329 HB3 GLN 50 HB3 GLN 50 11.129 22.838 -11.360 330 HG2 GLN 50 HG2 GLN 50 11.457 22.709 -8.983 331 HG3 GLN 50 HG3 GLN 50 11.147 20.980 -9.008 332 HE21 GLN 50 HE22 GLN 50 13.503 22.486 -8.139 333 HE22 GLN 50 HE21 GLN 50 14.831 21.872 -9.062 334 H MET 51 H MET 51 8.853 20.943 -8.375 335 HA MET 51 HA MET 51 8.275 18.377 -9.435 336 HB2 MET 51 HB2 MET 51 9.349 18.608 -7.282 337 HB3 MET 51 HB3 MET 51 7.980 19.510 -6.655 338 HG2 MET 51 HG2 MET 51 7.529 16.750 -7.667 339 HG3 MET 51 HG3 MET 51 8.313 16.971 -6.105 340 HE1 MET 51 HE1 MET 51 5.656 18.758 -3.970 341 HE2 MET 51 HE2 MET 51 6.807 19.642 -4.974 342 HE3 MET 51 HE3 MET 51 7.319 18.189 -4.119 343 H GLN 52 H GLN 52 6.247 20.991 -8.124 344 HA GLN 52 HA GLN 52 3.830 19.474 -8.317 345 HB2 GLN 52 HB2 GLN 52 4.317 22.443 -8.078 346 HB3 GLN 52 HB3 GLN 52 2.712 21.727 -8.103 347 HG2 GLN 52 HG2 GLN 52 3.237 20.465 -6.080 348 HG3 GLN 52 HG3 GLN 52 4.857 21.160 -6.066 349 HE21 GLN 52 HE22 GLN 52 3.889 23.765 -6.970 350 HE22 GLN 52 HE21 GLN 52 3.111 24.496 -5.614 351 H LYS 53 H LYS 53 5.540 21.702 -10.434 352 HA LYS 53 HA LYS 53 3.463 21.679 -12.426 353 HB2 LYS 53 HB2 LYS 53 6.266 22.779 -12.405 354 HB3 LYS 53 HB3 LYS 53 5.180 22.917 -13.781 355 HG2 LYS 53 HG2 LYS 53 3.643 24.245 -12.524 356 HG3 LYS 53 HG3 LYS 53 4.541 23.956 -11.031 357 HD2 LYS 53 HD2 LYS 53 4.988 26.182 -11.989 358 HD3 LYS 53 HD3 LYS 53 6.437 25.180 -11.895 359 HE2 LYS 53 HE2 LYS 53 6.197 24.619 -14.263 360 HE3 LYS 53 HE3 LYS 53 4.757 25.630 -14.356 361 HZ1 LYS 53 HZ1 LYS 53 7.521 26.543 -13.772 362 HZ2 LYS 53 HZ2 LYS 53 6.157 27.538 -13.726 363 HZ3 LYS 53 HZ3 LYS 53 6.640 26.836 -15.185 364 H MET 54 H MET 54 5.280 19.272 -11.483 365 HA MET 54 HA MET 54 6.378 18.340 -13.959 366 HB2 MET 54 HB2 MET 54 7.360 17.653 -11.836 367 HB3 MET 54 HB3 MET 54 5.845 16.910 -11.346 368 HG2 MET 54 HG2 MET 54 6.133 15.100 -12.701 369 HG3 MET 54 HG3 MET 54 7.133 15.982 -13.851 370 HE1 MET 54 HE1 MET 54 6.980 14.634 -10.196 371 HE2 MET 54 HE2 MET 54 7.911 16.109 -9.892 372 HE3 MET 54 HE3 MET 54 8.682 14.521 -9.745 373 H GLY 55 H GLY 55 3.308 18.225 -12.383 374 HA2 GLY 55 HA2 GLY 55 1.381 18.053 -13.805 375 HA3 GLY 55 HA3 GLY 55 2.263 16.908 -14.799 376 HA PRO 56 HA PRO 56 -0.374 14.694 -11.461 377 HB2 PRO 56 HB2 PRO 56 -2.700 14.378 -12.835 378 HB3 PRO 56 HB3 PRO 56 -2.427 15.709 -11.706 379 HG2 PRO 56 HG2 PRO 56 -2.223 15.683 -14.693 380 HG3 PRO 56 HG3 PRO 56 -2.944 16.909 -13.633 381 HD2 PRO 56 HD2 PRO 56 -0.480 17.195 -14.708 382 HD3 PRO 56 HD3 PRO 56 -0.895 17.837 -13.105 383 H ASN 57 H ASN 57 -0.100 12.544 -11.576 384 HA ASN 57 HA ASN 57 0.705 10.568 -12.357 385 HB2 ASN 57 HB2 ASN 57 -0.959 11.344 -14.764 386 HB3 ASN 57 HB3 ASN 57 -0.144 9.791 -14.610 387 HD21 ASN 57 HD22 ASN 57 -2.757 11.781 -13.517 388 HD22 ASN 57 HD21 ASN 57 -3.599 10.550 -12.641 389 HA PRO 58 HA PRO 58 3.944 13.133 -14.377 390 HB2 PRO 58 HB2 PRO 58 6.018 12.243 -12.870 391 HB3 PRO 58 HB3 PRO 58 4.914 13.517 -12.337 392 HG2 PRO 58 HG2 PRO 58 4.918 10.605 -11.649 393 HG3 PRO 58 HG3 PRO 58 4.675 12.004 -10.585 394 HD2 PRO 58 HD2 PRO 58 2.621 10.518 -11.521 395 HD3 PRO 58 HD3 PRO 58 2.473 12.260 -11.217 396 HA PRO 59 HA PRO 59 5.386 9.944 -17.137 397 HB2 PRO 59 HB2 PRO 59 7.255 11.476 -18.424 398 HB3 PRO 59 HB3 PRO 59 5.529 11.523 -18.796 399 HG2 PRO 59 HG2 PRO 59 7.171 13.399 -17.160 400 HG3 PRO 59 HG3 PRO 59 5.835 13.750 -18.273 401 HD2 PRO 59 HD2 PRO 59 5.561 13.715 -15.568 402 HD3 PRO 59 HD3 PRO 59 4.238 13.316 -16.683 403 H GLN 60 H GLN 60 7.065 8.487 -17.055 404 HA GLN 60 HA GLN 60 8.408 8.455 -14.613 405 HB2 GLN 60 HB2 GLN 60 9.580 6.441 -15.454 406 HB3 GLN 60 HB3 GLN 60 7.836 6.389 -15.650 407 HG2 GLN 60 HG2 GLN 60 8.057 6.918 -18.000 408 HG3 GLN 60 HG3 GLN 60 9.805 7.055 -17.818 409 HE21 GLN 60 HE22 GLN 60 8.196 5.282 -19.495 410 HE22 GLN 60 HE21 GLN 60 8.680 3.674 -19.083 411 H HIS 61 H HIS 61 9.577 9.574 -17.752 412 HA HIS 61 HA HIS 61 12.313 9.597 -17.093 413 HB2 HIS 61 HB2 HIS 61 12.654 11.133 -18.920 414 HB3 HIS 61 HB3 HIS 61 11.491 9.918 -19.408 415 HD1 HIS 61 HD1 HIS 61 9.276 10.745 -20.286 416 HD2 HIS 61 HD2 HIS 61 11.479 13.737 -18.410 417 HE1 HIS 61 HE1 HIS 61 8.072 12.895 -20.788 418 H ARG 62 H ARG 62 9.729 11.761 -16.225 419 HA ARG 62 HA ARG 62 11.365 13.934 -15.372 420 HB2 ARG 62 HB2 ARG 62 8.526 13.100 -14.900 421 HB3 ARG 62 HB3 ARG 62 9.221 14.414 -13.964 422 HG2 ARG 62 HG2 ARG 62 9.195 14.367 -16.968 423 HG3 ARG 62 HG3 ARG 62 7.910 15.084 -15.994 424 HD2 ARG 62 HD2 ARG 62 9.831 16.402 -14.866 425 HD3 ARG 62 HD3 ARG 62 10.762 15.948 -16.294 426 HE ARG 62 HE ARG 62 8.571 16.970 -17.411 427 HH11 ARG 62 HH11 ARG 62 10.655 18.179 -14.878 428 HH12 ARG 62 HH12 ARG 62 10.230 19.836 -15.146 429 HH21 ARG 62 HH21 ARG 62 7.992 19.134 -17.761 430 HH22 ARG 62 HH22 ARG 62 8.692 20.388 -16.785 431 H LEU 63 H LEU 63 10.258 10.965 -13.952 432 HA LEU 63 HA LEU 63 10.747 11.664 -11.231 433 HB2 LEU 63 HB2 LEU 63 10.581 8.918 -12.485 434 HB3 LEU 63 HB3 LEU 63 10.421 9.290 -10.782 435 HG LEU 63 HG LEU 63 8.499 10.176 -12.939 436 HD11 LEU 63 HD11 LEU 63 8.219 8.032 -10.837 437 HD12 LEU 63 HD12 LEU 63 8.427 7.761 -12.566 438 HD13 LEU 63 HD13 LEU 63 6.966 8.547 -11.966 439 HD21 LEU 63 HD21 LEU 63 8.629 11.727 -11.037 440 HD22 LEU 63 HD22 LEU 63 8.299 10.387 -9.938 441 HD23 LEU 63 HD23 LEU 63 7.078 10.890 -11.107 442 H ARG 64 H ARG 64 12.862 11.242 -13.720 443 HA ARG 64 HA ARG 64 14.963 9.979 -12.120 444 HB2 ARG 64 HB2 ARG 64 14.705 10.674 -15.029 445 HB3 ARG 64 HB3 ARG 64 16.291 10.404 -14.329 446 HG2 ARG 64 HG2 ARG 64 15.500 8.396 -15.394 447 HG3 ARG 64 HG3 ARG 64 15.591 8.149 -13.649 448 HD2 ARG 64 HD2 ARG 64 13.189 8.519 -13.469 449 HD3 ARG 64 HD3 ARG 64 13.094 8.802 -15.205 450 HE ARG 64 HE ARG 64 13.408 6.522 -15.590 451 HH11 ARG 64 HH11 ARG 64 13.521 7.295 -12.187 452 HH12 ARG 64 HH12 ARG 64 13.263 5.663 -11.659 453 HH21 ARG 64 HH21 ARG 64 13.031 4.360 -14.925 454 HH22 ARG 64 HH22 ARG 64 12.987 3.981 -13.233 455 H ALA 65 H ALA 65 14.428 12.952 -13.991 456 HA ALA 65 HA ALA 65 16.930 14.081 -13.310 457 HB1 ALA 65 HB1 ALA 65 14.466 15.439 -14.387 458 HB2 ALA 65 HB2 ALA 65 15.740 14.690 -15.348 459 HB3 ALA 65 HB3 ALA 65 16.096 16.113 -14.369 460 H MET 66 H MET 66 13.818 14.154 -11.761 461 HA MET 66 HA MET 66 14.093 16.539 -10.313 462 HB2 MET 66 HB2 MET 66 12.523 14.041 -9.698 463 HB3 MET 66 HB3 MET 66 12.405 15.517 -8.750 464 HG2 MET 66 HG2 MET 66 11.725 15.184 -11.660 465 HG3 MET 66 HG3 MET 66 10.594 15.403 -10.326 466 HE1 MET 66 HE1 MET 66 10.407 17.622 -8.905 467 HE2 MET 66 HE2 MET 66 11.350 19.077 -9.212 468 HE3 MET 66 HE3 MET 66 12.138 17.631 -8.581 469 H ASN 67 H ASN 67 15.298 13.309 -9.664 470 HA ASN 67 HA ASN 67 15.996 13.751 -6.951 471 HB2 ASN 67 HB2 ASN 67 17.423 11.861 -8.830 472 HB3 ASN 67 HB3 ASN 67 17.266 11.731 -7.081 473 HD21 ASN 67 HD22 ASN 67 15.818 11.148 -10.132 474 HD22 ASN 67 HD21 ASN 67 14.417 10.306 -9.553 475 H THR 68 H THR 68 17.850 13.879 -9.964 476 HA THR 68 HA THR 68 20.288 14.742 -8.894 477 HB THR 68 HB THR 68 19.237 15.493 -11.625 478 HG1 THR 68 HG1 THR 68 20.709 13.145 -11.312 479 HG21 THR 68 HG21 THR 68 21.589 15.320 -12.274 480 HG22 THR 68 HG22 THR 68 22.020 14.869 -10.624 481 HG23 THR 68 HG23 THR 68 21.387 16.482 -10.960 482 H ALA 69 H ALA 69 17.462 16.509 -10.060 483 HA ALA 69 HA ALA 69 18.490 19.086 -10.088 484 HB1 ALA 69 HB1 ALA 69 15.667 18.237 -9.440 485 HB2 ALA 69 HB2 ALA 69 16.328 18.491 -11.055 486 HB3 ALA 69 HB3 ALA 69 16.172 19.850 -9.944 487 H MET 70 H MET 70 16.761 17.442 -7.428 488 HA MET 70 HA MET 70 16.995 19.640 -5.644 489 HB2 MET 70 HB2 MET 70 15.314 17.773 -5.440 490 HB3 MET 70 HB3 MET 70 16.618 16.736 -4.887 491 HG2 MET 70 HG2 MET 70 16.985 18.149 -2.966 492 HG3 MET 70 HG3 MET 70 15.764 19.285 -3.534 493 HE1 MET 70 HE1 MET 70 15.822 15.297 -3.326 494 HE2 MET 70 HE2 MET 70 14.941 15.084 -1.811 495 HE3 MET 70 HE3 MET 70 16.509 15.890 -1.815 496 H ALA 71 H ALA 71 18.841 16.674 -6.102 497 HA ALA 71 HA ALA 71 20.569 16.879 -3.922 498 HB1 ALA 71 HB1 ALA 71 20.341 14.862 -5.276 499 HB2 ALA 71 HB2 ALA 71 22.030 15.359 -5.149 500 HB3 ALA 71 HB3 ALA 71 21.125 15.676 -6.631 501 H ALA 72 H ALA 72 20.891 18.193 -7.201 502 HA ALA 72 HA ALA 72 23.520 19.169 -6.895 503 HB1 ALA 72 HB1 ALA 72 21.349 20.137 -8.746 504 HB2 ALA 72 HB2 ALA 72 22.482 18.828 -9.076 505 HB3 ALA 72 HB3 ALA 72 23.070 20.480 -8.898 506 H GLU 73 H GLU 73 20.408 20.491 -6.027 507 HA GLU 73 HA GLU 73 21.410 23.165 -5.634 508 HB2 GLU 73 HB2 GLU 73 18.779 21.906 -4.847 509 HB3 GLU 73 HB3 GLU 73 19.155 23.619 -4.726 510 HG2 GLU 73 HG2 GLU 73 19.060 22.008 -7.265 511 HG3 GLU 73 HG3 GLU 73 17.829 23.137 -6.700 512 H VAL 74 H VAL 74 20.594 20.390 -3.588 513 HA VAL 74 HA VAL 74 21.066 21.702 -1.117 514 HB VAL 74 HB VAL 74 21.400 18.758 -1.736 515 HG11 VAL 74 HG11 VAL 74 22.422 19.408 0.384 516 HG12 VAL 74 HG12 VAL 74 20.986 18.416 0.649 517 HG13 VAL 74 HG13 VAL 74 20.907 20.163 0.890 518 HG21 VAL 74 HG21 VAL 74 19.102 18.503 -0.943 519 HG22 VAL 74 HG22 VAL 74 19.183 19.540 -2.368 520 HG23 VAL 74 HG23 VAL 74 18.967 20.254 -0.769 521 H ALA 75 H ALA 75 23.127 20.305 -3.525 522 HA ALA 75 HA ALA 75 25.484 19.948 -2.051 523 HB1 ALA 75 HB1 ALA 75 25.190 20.697 -4.956 524 HB2 ALA 75 HB2 ALA 75 25.148 19.058 -4.307 525 HB3 ALA 75 HB3 ALA 75 26.627 20.011 -4.200 526 H GLU 76 H GLU 76 23.935 22.832 -3.180 527 HA GLU 76 HA GLU 76 26.168 24.531 -3.378 528 HB2 GLU 76 HB2 GLU 76 23.277 25.140 -2.762 529 HB3 GLU 76 HB3 GLU 76 24.493 26.372 -3.064 530 HG2 GLU 76 HG2 GLU 76 23.579 24.246 -4.989 531 HG3 GLU 76 HG3 GLU 76 23.194 25.965 -5.058 532 H VAL 77 H VAL 77 23.957 23.902 -0.658 533 HA VAL 77 HA VAL 77 25.172 25.841 1.031 534 HB VAL 77 HB VAL 77 23.835 24.932 2.843 535 HG11 VAL 77 HG11 VAL 77 22.750 26.429 1.290 536 HG12 VAL 77 HG12 VAL 77 21.608 25.203 1.838 537 HG13 VAL 77 HG13 VAL 77 22.335 25.078 0.237 538 HG21 VAL 77 HG21 VAL 77 24.086 22.555 2.392 539 HG22 VAL 77 HG22 VAL 77 23.117 22.717 0.927 540 HG23 VAL 77 HG23 VAL 77 22.379 22.986 2.506 541 H VAL 78 H VAL 78 25.824 22.514 0.345 542 HA VAL 78 HA VAL 78 27.306 21.940 2.706 543 HB VAL 78 HB VAL 78 27.474 20.615 -0.008 544 HG11 VAL 78 HG11 VAL 78 28.325 19.615 2.708 545 HG12 VAL 78 HG12 VAL 78 29.399 20.102 1.395 546 HG13 VAL 78 HG13 VAL 78 28.360 18.690 1.205 547 HG21 VAL 78 HG21 VAL 78 25.930 18.963 0.920 548 HG22 VAL 78 HG22 VAL 78 25.207 20.571 0.884 549 HG23 VAL 78 HG23 VAL 78 25.809 19.907 2.404 550 H ALA 79 H ALA 79 28.058 23.445 -0.340 551 HA ALA 79 HA ALA 79 30.875 23.100 -0.255 552 HB1 ALA 79 HB1 ALA 79 30.932 24.731 -2.062 553 HB2 ALA 79 HB2 ALA 79 29.248 25.149 -1.750 554 HB3 ALA 79 HB3 ALA 79 29.663 23.537 -2.331 555 H THR 80 H THR 80 28.770 25.166 1.445 556 HA THR 80 HA THR 80 30.711 27.276 1.863 557 HB THR 80 HB THR 80 28.165 26.950 3.430 558 HG1 THR 80 HG1 THR 80 28.490 27.741 0.714 559 HG21 THR 80 HG21 THR 80 29.644 29.365 2.369 560 HG22 THR 80 HG22 THR 80 29.665 28.793 4.036 561 HG23 THR 80 HG23 THR 80 28.167 29.407 3.334 562 H SER 81 H SER 81 30.638 24.238 2.940 563 HA SER 81 HA SER 81 31.221 24.853 5.742 564 HB2 SER 81 HB2 SER 81 31.030 22.117 4.476 565 HB3 SER 81 HB3 SER 81 30.896 22.532 6.185 566 HG SER 81 HG SER 81 29.048 22.954 4.100 567 HA PRO 82 HA PRO 82 35.588 24.411 4.788 568 HB2 PRO 82 HB2 PRO 82 36.496 24.564 7.341 569 HB3 PRO 82 HB3 PRO 82 35.975 25.985 6.429 570 HG2 PRO 82 HG2 PRO 82 34.494 24.408 8.494 571 HG3 PRO 82 HG3 PRO 82 34.572 26.166 8.269 572 HD2 PRO 82 HD2 PRO 82 32.471 24.646 7.432 573 HD3 PRO 82 HD3 PRO 82 32.962 26.150 6.628 574 HA PRO 83 HA PRO 83 36.387 20.131 5.347 575 HB2 PRO 83 HB2 PRO 83 39.217 20.624 5.957 576 HB3 PRO 83 HB3 PRO 83 38.490 19.842 4.550 577 HG2 PRO 83 HG2 PRO 83 39.631 22.271 4.392 578 HG3 PRO 83 HG3 PRO 83 38.212 21.834 3.422 579 HD2 PRO 83 HD2 PRO 83 38.362 23.457 5.939 580 HD3 PRO 83 HD3 PRO 83 37.406 23.742 4.469 581 H GLN 84 H GLN 84 36.301 22.006 7.961 582 HA GLN 84 HA GLN 84 37.302 19.938 9.792 583 HB2 GLN 84 HB2 GLN 84 36.541 22.814 10.327 584 HB3 GLN 84 HB3 GLN 84 37.041 21.670 11.563 585 HG2 GLN 84 HG2 GLN 84 39.215 21.440 10.368 586 HG3 GLN 84 HG3 GLN 84 38.699 22.746 9.297 587 HE21 GLN 84 HE22 GLN 84 40.357 24.130 9.991 588 HE22 GLN 84 HE21 GLN 84 40.343 24.857 11.560 589 H SER 85 H SER 85 34.562 22.217 9.573 590 HA SER 85 HA SER 85 32.990 20.543 11.320 591 HB2 SER 85 HB2 SER 85 31.271 22.416 10.887 592 HB3 SER 85 HB3 SER 85 32.746 22.840 11.759 593 HG SER 85 HG SER 85 32.551 24.371 10.214 594 H TYR 86 H TYR 86 33.660 20.392 8.136 595 HA TYR 86 HA TYR 86 31.276 20.050 6.785 596 HB2 TYR 86 HB2 TYR 86 33.388 20.012 5.619 597 HB3 TYR 86 HB3 TYR 86 33.896 18.569 6.486 598 HD1 TYR 86 HD2 TYR 86 31.555 19.849 3.910 599 HD2 TYR 86 HD1 TYR 86 33.273 16.408 5.742 600 HE1 TYR 86 HE2 TYR 86 30.641 18.431 2.113 601 HE2 TYR 86 HE1 TYR 86 32.369 14.990 3.950 602 HH TYR 86 HH TYR 86 31.129 16.240 1.061 603 H SER 87 H SER 87 33.021 17.737 8.813 604 HA SER 87 HA SER 87 31.312 15.545 8.297 605 HB2 SER 87 HB2 SER 87 33.069 15.979 10.719 606 HB3 SER 87 HB3 SER 87 32.478 14.435 10.102 607 HG SER 87 HG SER 87 34.701 15.042 9.515 608 H ALA 88 H ALA 88 30.718 18.341 10.042 609 HA ALA 88 HA ALA 88 28.737 16.997 11.751 610 HB1 ALA 88 HB1 ALA 88 29.708 19.856 11.838 611 HB2 ALA 88 HB2 ALA 88 30.266 18.547 12.883 612 HB3 ALA 88 HB3 ALA 88 28.593 19.098 12.977 613 H VAL 89 H VAL 89 29.134 19.274 9.125 614 HA VAL 89 HA VAL 89 26.394 20.152 9.118 615 HB VAL 89 HB VAL 89 28.492 20.406 6.949 616 HG11 VAL 89 HG11 VAL 89 25.861 21.838 7.318 617 HG12 VAL 89 HG12 VAL 89 26.241 20.656 6.064 618 HG13 VAL 89 HG13 VAL 89 27.069 22.212 6.088 619 HG21 VAL 89 HG21 VAL 89 29.145 21.497 9.057 620 HG22 VAL 89 HG22 VAL 89 27.634 22.410 9.033 621 HG23 VAL 89 HG23 VAL 89 28.838 22.663 7.770 622 H LEU 90 H LEU 90 28.346 18.133 6.931 623 HA LEU 90 HA LEU 90 26.255 17.283 5.277 624 HB2 LEU 90 HB2 LEU 90 28.853 17.130 5.085 625 HB3 LEU 90 HB3 LEU 90 28.658 15.606 5.915 626 HG LEU 90 HG LEU 90 28.863 15.429 3.449 627 HD11 LEU 90 HD11 LEU 90 27.854 13.629 4.718 628 HD12 LEU 90 HD12 LEU 90 27.038 13.817 3.167 629 HD13 LEU 90 HD13 LEU 90 26.285 14.430 4.639 630 HD21 LEU 90 HD21 LEU 90 26.987 16.022 2.038 631 HD22 LEU 90 HD22 LEU 90 27.602 17.450 2.872 632 HD23 LEU 90 HD23 LEU 90 26.121 16.671 3.429 633 H ASN 91 H ASN 91 27.628 15.979 8.219 634 HA ASN 91 HA ASN 91 26.359 13.537 8.460 635 HB2 ASN 91 HB2 ASN 91 28.042 14.932 10.005 636 HB3 ASN 91 HB3 ASN 91 26.553 15.267 10.878 637 HD21 ASN 91 HD22 ASN 91 28.923 13.773 11.624 638 HD22 ASN 91 HD21 ASN 91 28.380 12.194 12.067 639 H THR 92 H THR 92 25.245 16.721 9.525 640 HA THR 92 HA THR 92 22.756 15.932 10.552 641 HB THR 92 HB THR 92 23.496 18.615 9.356 642 HG1 THR 92 HG1 THR 92 24.959 18.278 10.968 643 HG21 THR 92 HG21 THR 92 21.793 19.500 10.878 644 HG22 THR 92 HG22 THR 92 21.419 17.864 11.417 645 HG23 THR 92 HG23 THR 92 21.091 18.338 9.751 646 H ILE 93 H ILE 93 23.714 17.111 7.342 647 HA ILE 93 HA ILE 93 21.192 17.305 6.175 648 HB ILE 93 HB ILE 93 23.791 16.547 4.839 649 HG12 ILE 93 HG12 ILE 93 23.935 18.685 6.017 650 HG13 ILE 93 HG13 ILE 93 23.948 18.939 4.276 651 HG21 ILE 93 HG21 ILE 93 21.249 17.630 3.632 652 HG22 ILE 93 HG22 ILE 93 21.876 15.993 3.442 653 HG23 ILE 93 HG23 ILE 93 22.767 17.359 2.773 654 HD11 ILE 93 HD11 ILE 93 22.576 20.596 5.390 655 HD12 ILE 93 HD12 ILE 93 21.585 19.324 6.102 656 HD13 ILE 93 HD13 ILE 93 21.588 19.565 4.355 657 H GLY 94 H GLY 94 23.438 14.541 6.148 658 HA2 GLY 94 HA2 GLY 94 21.791 12.834 4.632 659 HA3 GLY 94 HA3 GLY 94 23.095 12.316 5.683 660 H ALA 95 H ALA 95 22.141 13.209 8.107 661 HA ALA 95 HA ALA 95 20.479 11.080 8.880 662 HB1 ALA 95 HB1 ALA 95 22.038 12.127 10.424 663 HB2 ALA 95 HB2 ALA 95 20.397 12.185 11.071 664 HB3 ALA 95 HB3 ALA 95 21.117 13.630 10.359 665 H CYS 96 H CYS 96 19.796 14.541 8.458 666 HA CYS 96 HA CYS 96 17.081 14.397 9.194 667 HB2 CYS 96 HB2 CYS 96 18.464 16.380 7.384 668 HB3 CYS 96 HB3 CYS 96 16.861 16.585 8.080 669 H LEU 97 H LEU 97 18.707 14.011 6.089 670 HA LEU 97 HA LEU 97 16.440 14.035 4.441 671 HB2 LEU 97 HB2 LEU 97 18.975 14.057 3.872 672 HB3 LEU 97 HB3 LEU 97 18.847 12.315 3.908 673 HG LEU 97 HG LEU 97 18.741 13.315 1.624 674 HD11 LEU 97 HD11 LEU 97 16.837 11.993 0.833 675 HD12 LEU 97 HD12 LEU 97 16.294 11.795 2.501 676 HD13 LEU 97 HD13 LEU 97 17.835 11.105 1.986 677 HD21 LEU 97 HD21 LEU 97 16.715 14.433 0.902 678 HD22 LEU 97 HD22 LEU 97 17.483 15.333 2.209 679 HD23 LEU 97 HD23 LEU 97 16.059 14.345 2.537 680 H ARG 98 H ARG 98 18.088 11.365 6.101 681 HA ARG 98 HA ARG 98 16.533 9.257 5.098 682 HB2 ARG 98 HB2 ARG 98 17.855 9.514 7.801 683 HB3 ARG 98 HB3 ARG 98 17.271 8.011 7.102 684 HG2 ARG 98 HG2 ARG 98 18.896 8.144 5.338 685 HG3 ARG 98 HG3 ARG 98 19.404 9.744 5.881 686 HD2 ARG 98 HD2 ARG 98 20.152 8.781 7.999 687 HD3 ARG 98 HD3 ARG 98 19.654 7.182 7.451 688 HE ARG 98 HE ARG 98 21.407 8.178 5.541 689 HH11 ARG 98 HH11 ARG 98 21.492 7.312 8.928 690 HH12 ARG 98 HH12 ARG 98 23.174 6.890 8.913 691 HH21 ARG 98 HH21 ARG 98 23.625 7.587 5.506 692 HH22 ARG 98 HH22 ARG 98 24.382 7.020 6.960 693 H GLU 99 H GLU 99 16.151 11.104 8.108 694 HA GLU 99 HA GLU 99 13.798 9.948 9.057 695 HB2 GLU 99 HB2 GLU 99 14.774 12.799 9.283 696 HB3 GLU 99 HB3 GLU 99 13.439 12.137 10.214 697 HG2 GLU 99 HG2 GLU 99 16.208 10.999 10.282 698 HG3 GLU 99 HG3 GLU 99 15.646 12.260 11.376 699 H SER 100 H SER 100 14.197 12.890 7.154 700 HA SER 100 HA SER 100 11.580 13.633 6.806 701 HB2 SER 100 HB2 SER 100 13.813 13.861 4.777 702 HB3 SER 100 HB3 SER 100 12.331 14.818 4.789 703 HG SER 100 HG SER 100 14.522 14.890 6.548 704 H MET 101 H MET 101 13.391 11.254 4.914 705 HA MET 101 HA MET 101 11.507 10.858 2.881 706 HB2 MET 101 HB2 MET 101 13.755 9.257 4.003 707 HB3 MET 101 HB3 MET 101 12.623 8.455 2.922 708 HG2 MET 101 HG2 MET 101 14.156 10.962 2.269 709 HG3 MET 101 HG3 MET 101 14.611 9.332 1.772 710 HE1 MET 101 HE1 MET 101 13.233 7.857 0.062 711 HE2 MET 101 HE2 MET 101 11.681 8.344 -0.623 712 HE3 MET 101 HE3 MET 101 11.816 8.000 1.101 713 H MET 102 H MET 102 11.942 9.036 5.924 714 HA MET 102 HA MET 102 9.668 7.384 5.333 715 HB2 MET 102 HB2 MET 102 10.102 6.257 7.373 716 HB3 MET 102 HB3 MET 102 11.658 6.610 6.641 717 HG2 MET 102 HG2 MET 102 11.998 8.449 8.173 718 HG3 MET 102 HG3 MET 102 10.396 8.196 8.865 719 HE1 MET 102 HE1 MET 102 10.598 4.819 8.579 720 HE2 MET 102 HE2 MET 102 9.699 5.732 9.790 721 HE3 MET 102 HE3 MET 102 10.875 4.519 10.298 722 H GLN 103 H GLN 103 10.202 10.343 7.063 723 HA GLN 103 HA GLN 103 7.682 10.277 8.438 724 HB2 GLN 103 HB2 GLN 103 9.919 12.170 8.182 725 HB3 GLN 103 HB3 GLN 103 8.343 12.922 8.382 726 HG2 GLN 103 HG2 GLN 103 9.515 12.576 10.513 727 HG3 GLN 103 HG3 GLN 103 7.973 11.730 10.436 728 HE21 GLN 103 HE22 GLN 103 11.417 11.405 10.585 729 HE22 GLN 103 HE21 GLN 103 11.450 9.705 10.884 730 H ALA 104 H ALA 104 8.728 11.099 5.277 731 HA ALA 104 HA ALA 104 6.411 12.616 4.555 732 HB1 ALA 104 HB1 ALA 104 8.460 12.843 3.273 733 HB2 ALA 104 HB2 ALA 104 7.164 12.244 2.238 734 HB3 ALA 104 HB3 ALA 104 8.401 11.135 2.835 735 H THR 105 H THR 105 7.487 9.359 3.585 736 HA THR 105 HA THR 105 5.337 7.879 4.373 737 HB THR 105 HB THR 105 3.875 9.305 3.013 738 HG1 THR 105 HG1 THR 105 2.911 7.561 1.796 739 HG21 THR 105 HG21 THR 105 5.504 8.321 0.666 740 HG22 THR 105 HG22 THR 105 5.458 9.974 1.281 741 HG23 THR 105 HG23 THR 105 4.016 9.261 0.558 742 H GLY 106 H GLY 106 7.882 8.438 2.104 743 HA2 GLY 106 HA2 GLY 106 7.638 5.851 0.834 744 HA3 GLY 106 HA3 GLY 106 8.843 7.076 0.484 745 H SER 107 H SER 107 8.418 6.141 3.780 746 HA SER 107 HA SER 107 9.849 5.264 5.296 747 HB2 SER 107 HB2 SER 107 10.606 2.980 4.868 748 HB3 SER 107 HB3 SER 107 8.952 3.189 4.304 749 HG SER 107 HG SER 107 10.441 3.782 2.249 750 H VAL 108 H VAL 108 12.268 3.941 5.172 751 HA VAL 108 HA VAL 108 14.011 5.959 3.980 752 HB VAL 108 HB VAL 108 14.830 3.665 5.775 753 HG11 VAL 108 HG11 VAL 108 16.841 5.033 6.138 754 HG12 VAL 108 HG12 VAL 108 16.232 6.215 4.981 755 HG13 VAL 108 HG13 VAL 108 16.642 4.586 4.445 756 HG21 VAL 108 HG21 VAL 108 14.192 6.519 6.523 757 HG22 VAL 108 HG22 VAL 108 14.887 5.306 7.600 758 HG23 VAL 108 HG23 VAL 108 13.257 5.091 6.965 759 H ASP 109 H ASP 109 14.130 5.498 1.874 760 HA ASP 109 HA ASP 109 14.156 2.850 0.829 761 HB2 ASP 109 HB2 ASP 109 13.223 4.732 -0.444 762 HB3 ASP 109 HB3 ASP 109 14.823 5.465 -0.536 763 H ASN 110 H ASN 110 15.872 2.055 -0.646 764 HA ASN 110 HA ASN 110 18.394 2.181 0.811 765 HB2 ASN 110 HB2 ASN 110 17.467 0.306 -1.376 766 HB3 ASN 110 HB3 ASN 110 18.995 0.174 -0.512 767 HD21 ASN 110 HD22 ASN 110 15.586 -0.341 -0.393 768 HD22 ASN 110 HD21 ASN 110 15.556 -1.181 1.115 769 H ALA 111 H ALA 111 17.037 3.133 -2.247 770 HA ALA 111 HA ALA 111 19.727 3.517 -3.369 771 HB1 ALA 111 HB1 ALA 111 17.042 3.588 -4.755 772 HB2 ALA 111 HB2 ALA 111 18.151 2.216 -4.727 773 HB3 ALA 111 HB3 ALA 111 18.621 3.714 -5.534 774 H PHE 112 H PHE 112 16.617 5.239 -3.022 775 HA PHE 112 HA PHE 112 17.478 7.687 -4.080 776 HB2 PHE 112 HB2 PHE 112 15.109 7.118 -3.694 777 HB3 PHE 112 HB3 PHE 112 15.374 7.198 -1.957 778 HD1 PHE 112 HD1 PHE 112 15.004 9.133 -5.036 779 HD2 PHE 112 HD2 PHE 112 15.616 9.336 -0.830 780 HE1 PHE 112 HE1 PHE 112 14.466 11.531 -5.075 781 HE2 PHE 112 HE2 PHE 112 15.077 11.735 -0.864 782 HZ PHE 112 HZ PHE 112 14.501 12.835 -2.989 783 H THR 113 H THR 113 17.184 6.726 -0.672 784 HA THR 113 HA THR 113 18.236 9.060 0.440 785 HB THR 113 HB THR 113 18.688 6.516 1.886 786 HG1 THR 113 HG1 THR 113 16.738 5.777 1.524 787 HG21 THR 113 HG21 THR 113 18.850 8.742 2.956 788 HG22 THR 113 HG22 THR 113 17.595 7.736 3.684 789 HG23 THR 113 HG23 THR 113 17.151 9.027 2.566 790 H ASN 114 H ASN 114 19.798 6.486 -1.158 791 HA ASN 114 HA ASN 114 22.373 6.999 0.104 792 HB2 ASN 114 HB2 ASN 114 21.991 4.693 -0.131 793 HB3 ASN 114 HB3 ASN 114 21.339 4.872 -1.752 794 HD21 ASN 114 HD22 ASN 114 22.688 4.821 -3.469 795 HD22 ASN 114 HD21 ASN 114 24.382 4.521 -3.358 796 H GLU 115 H GLU 115 20.908 7.059 -3.141 797 HA GLU 115 HA GLU 115 23.194 7.875 -4.502 798 HB2 GLU 115 HB2 GLU 115 21.253 6.752 -5.507 799 HB3 GLU 115 HB3 GLU 115 20.270 8.179 -5.195 800 HG2 GLU 115 HG2 GLU 115 21.597 9.471 -6.671 801 HG3 GLU 115 HG3 GLU 115 22.712 8.133 -6.901 802 H VAL 116 H VAL 116 20.443 9.677 -3.160 803 HA VAL 116 HA VAL 116 21.122 12.205 -4.155 804 HB VAL 116 HB VAL 116 19.655 11.485 -1.609 805 HG11 VAL 116 HG11 VAL 116 20.550 13.751 -1.440 806 HG12 VAL 116 HG12 VAL 116 18.797 13.781 -1.632 807 HG13 VAL 116 HG13 VAL 116 19.841 14.158 -3.003 808 HG21 VAL 116 HG21 VAL 116 18.582 10.704 -3.663 809 HG22 VAL 116 HG22 VAL 116 18.652 12.336 -4.327 810 HG23 VAL 116 HG23 VAL 116 17.652 12.001 -2.914 811 H MET 117 H MET 117 22.092 10.595 -1.132 812 HA MET 117 HA MET 117 23.525 12.702 -0.001 813 HB2 MET 117 HB2 MET 117 22.882 10.737 1.253 814 HB3 MET 117 HB3 MET 117 23.853 9.710 0.207 815 HG2 MET 117 HG2 MET 117 25.328 9.895 1.850 816 HG3 MET 117 HG3 MET 117 25.727 11.400 1.035 817 HE1 MET 117 HE1 MET 117 23.820 14.044 3.264 818 HE2 MET 117 HE2 MET 117 23.100 13.213 1.885 819 HE3 MET 117 HE3 MET 117 24.771 13.778 1.800 820 H GLN 118 H GLN 118 24.552 10.074 -2.153 821 HA GLN 118 HA GLN 118 27.273 10.764 -2.252 822 HB2 GLN 118 HB2 GLN 118 26.354 8.599 -3.021 823 HB3 GLN 118 HB3 GLN 118 25.597 9.419 -4.379 824 HG2 GLN 118 HG2 GLN 118 27.596 8.336 -5.129 825 HG3 GLN 118 HG3 GLN 118 27.832 10.081 -5.184 826 HE21 GLN 118 HE22 GLN 118 29.754 7.869 -5.039 827 HE22 GLN 118 HE21 GLN 118 30.726 8.179 -3.645 828 H LEU 119 H LEU 119 24.547 11.686 -4.320 829 HA LEU 119 HA LEU 119 26.029 13.234 -6.147 830 HB2 LEU 119 HB2 LEU 119 23.135 13.137 -5.383 831 HB3 LEU 119 HB3 LEU 119 23.719 14.352 -6.506 832 HG LEU 119 HG LEU 119 24.273 11.443 -6.990 833 HD11 LEU 119 HD11 LEU 119 21.847 11.662 -6.658 834 HD12 LEU 119 HD12 LEU 119 22.246 11.335 -8.344 835 HD13 LEU 119 HD13 LEU 119 21.809 12.968 -7.842 836 HD21 LEU 119 HD21 LEU 119 23.956 13.818 -8.815 837 HD22 LEU 119 HD22 LEU 119 24.375 12.178 -9.306 838 HD23 LEU 119 HD23 LEU 119 25.486 13.109 -8.304 839 H VAL 120 H VAL 120 24.185 14.203 -3.247 840 HA VAL 120 HA VAL 120 24.600 16.953 -3.441 841 HB VAL 120 HB VAL 120 24.288 15.235 -0.975 842 HG11 VAL 120 HG11 VAL 120 23.726 17.308 0.222 843 HG12 VAL 120 HG12 VAL 120 24.182 18.241 -1.203 844 HG13 VAL 120 HG13 VAL 120 25.399 17.301 -0.339 845 HG21 VAL 120 HG21 VAL 120 22.370 15.213 -2.463 846 HG22 VAL 120 HG22 VAL 120 22.353 16.977 -2.496 847 HG23 VAL 120 HG23 VAL 120 21.993 16.120 -0.996 848 H LYS 121 H LYS 121 26.672 14.460 -2.051 849 HA LYS 121 HA LYS 121 28.578 16.315 -0.989 850 HB2 LYS 121 HB2 LYS 121 28.745 13.341 -1.506 851 HB3 LYS 121 HB3 LYS 121 29.959 14.269 -0.635 852 HG2 LYS 121 HG2 LYS 121 28.520 14.683 1.164 853 HG3 LYS 121 HG3 LYS 121 27.091 14.226 0.234 854 HD2 LYS 121 HD2 LYS 121 27.623 12.471 1.804 855 HD3 LYS 121 HD3 LYS 121 27.915 11.903 0.164 856 HE2 LYS 121 HE2 LYS 121 29.726 11.190 1.603 857 HE3 LYS 121 HE3 LYS 121 30.322 12.382 0.451 858 HZ1 LYS 121 HZ1 LYS 121 30.217 14.070 2.168 859 HZ2 LYS 121 HZ2 LYS 121 31.162 12.769 2.697 860 HZ3 LYS 121 HZ3 LYS 121 29.585 12.948 3.271 861 H MET 122 H MET 122 28.494 14.182 -3.821 862 HA MET 122 HA MET 122 31.107 14.851 -4.702 863 HB2 MET 122 HB2 MET 122 30.248 12.738 -5.340 864 HB3 MET 122 HB3 MET 122 28.779 13.444 -5.988 865 HG2 MET 122 HG2 MET 122 31.317 14.264 -7.256 866 HG3 MET 122 HG3 MET 122 30.801 12.600 -7.509 867 HE1 MET 122 HE1 MET 122 28.579 11.885 -8.622 868 HE2 MET 122 HE2 MET 122 27.378 12.984 -9.289 869 HE3 MET 122 HE3 MET 122 27.575 12.854 -7.543 870 H LEU 123 H LEU 123 27.920 16.119 -5.437 871 HA LEU 123 HA LEU 123 28.896 17.789 -7.580 872 HB2 LEU 123 HB2 LEU 123 26.244 17.689 -6.144 873 HB3 LEU 123 HB3 LEU 123 26.591 18.786 -7.465 874 HG LEU 123 HG LEU 123 26.659 15.774 -7.679 875 HD11 LEU 123 HD11 LEU 123 24.559 17.750 -8.563 876 HD12 LEU 123 HD12 LEU 123 24.395 16.559 -7.273 877 HD13 LEU 123 HD13 LEU 123 24.574 16.029 -8.945 878 HD21 LEU 123 HD21 LEU 123 28.133 16.851 -9.275 879 HD22 LEU 123 HD22 LEU 123 26.841 17.947 -9.765 880 HD23 LEU 123 HD23 LEU 123 26.707 16.220 -10.098 881 H SER 124 H SER 124 29.199 17.950 -4.300 882 HA SER 124 HA SER 124 29.027 20.868 -4.207 883 HB2 SER 124 HB2 SER 124 27.835 19.518 -2.456 884 HB3 SER 124 HB3 SER 124 29.404 18.907 -1.931 885 HG SER 124 HG SER 124 28.401 21.536 -1.835 886 H ALA 125 H ALA 125 31.072 18.305 -2.859 887 HA ALA 125 HA ALA 125 33.499 19.362 -3.859 888 HB1 ALA 125 HB1 ALA 125 33.057 21.105 -2.222 889 HB2 ALA 125 HB2 ALA 125 34.464 20.144 -1.763 890 HB3 ALA 125 HB3 ALA 125 32.915 19.889 -0.954 891 H ASP 126 H ASP 126 34.276 17.429 -4.299 892 HA ASP 126 HA ASP 126 34.093 15.286 -2.336 893 HB2 ASP 126 HB2 ASP 126 33.480 14.735 -4.632 894 HB3 ASP 126 HB3 ASP 126 35.044 15.294 -5.206 895 H SER 127 H SER 127 36.093 17.727 -3.177 896 HA SER 127 HA SER 127 38.561 16.400 -2.382 897 HB2 SER 127 HB2 SER 127 38.085 19.269 -3.232 898 HB3 SER 127 HB3 SER 127 39.656 18.499 -3.003 899 HG SER 127 HG SER 127 38.713 16.909 -4.628 900 H ALA 128 H ALA 128 35.984 17.989 -0.979 901 HA ALA 128 HA ALA 128 37.449 19.230 1.177 902 HB1 ALA 128 HB1 ALA 128 34.488 18.771 0.840 903 HB2 ALA 128 HB2 ALA 128 35.365 20.254 0.458 904 HB3 ALA 128 HB3 ALA 128 35.238 19.708 2.131 905 H ASN 129 H ASN 129 38.594 17.265 1.705 906 HA ASN 129 HA ASN 129 37.044 15.260 3.156 907 HB2 ASN 129 HB2 ASN 129 38.769 14.404 1.670 908 HB3 ASN 129 HB3 ASN 129 39.982 15.418 2.438 909 HD21 ASN 129 HD22 ASN 129 40.941 14.747 4.298 910 HD22 ASN 129 HD21 ASN 129 40.651 13.205 5.022 911 H GLU 130 H GLU 130 37.154 15.001 5.337 912 HA GLU 130 HA GLU 130 37.611 17.061 7.077 913 HB2 GLU 130 HB2 GLU 130 36.462 14.971 7.684 914 HB3 GLU 130 HB3 GLU 130 37.996 14.116 7.637 915 HG2 GLU 130 HG2 GLU 130 38.812 15.515 9.474 916 HG3 GLU 130 HG3 GLU 130 37.245 16.320 9.536 917 H VAL 131 H VAL 131 39.388 18.218 7.315 918 HA VAL 131 HA VAL 131 41.933 17.188 6.522 919 HB VAL 131 HB VAL 131 41.264 19.496 5.992 920 HG11 VAL 131 HG11 VAL 131 40.038 20.034 8.028 921 HG12 VAL 131 HG12 VAL 131 41.283 21.237 7.693 922 HG13 VAL 131 HG13 VAL 131 41.543 20.021 8.945 923 HG21 VAL 131 HG21 VAL 131 43.386 20.579 6.618 924 HG22 VAL 131 HG22 VAL 131 43.605 18.944 5.995 925 HG23 VAL 131 HG23 VAL 131 43.711 19.250 7.728 926 H SER 132 H SER 132 43.432 16.342 7.711 927 HA SER 132 HA SER 132 43.200 16.543 10.627 928 HB2 SER 132 HB2 SER 132 44.737 14.501 10.578 929 HB3 SER 132 HB3 SER 132 43.089 14.258 10.002 930 HG SER 132 HG SER 132 43.845 14.358 7.883 931 H THR 133 H THR 133 44.168 18.671 10.440 932 HA THR 133 HA THR 133 47.101 18.461 10.438 933 HB THR 133 HB THR 133 47.115 20.902 9.699 934 HG1 THR 133 HG1 THR 133 44.622 20.847 10.000 935 HG21 THR 133 HG21 THR 133 46.882 20.326 7.305 936 HG22 THR 133 HG22 THR 133 46.151 18.790 7.772 937 HG23 THR 133 HG23 THR 133 47.824 19.138 8.204 Start of MODEL 6 1 HA2 GLY 1 HA2 GLY 1 10.323 -5.898 -2.954 2 HA3 GLY 1 HA3 GLY 1 9.730 -6.871 -4.292 3 H SER 2 H SER 2 9.056 -4.130 -3.002 4 HA SER 2 HA SER 2 6.185 -4.427 -3.413 5 HB2 SER 2 HB2 SER 2 6.496 -4.661 -0.970 6 HB3 SER 2 HB3 SER 2 7.346 -3.118 -0.936 7 HG SER 2 HG SER 2 5.486 -2.175 -0.846 8 H GLY 3 H GLY 3 5.471 -2.831 -4.697 9 HA2 GLY 3 HA2 GLY 3 5.807 -0.165 -4.565 10 HA3 GLY 3 HA3 GLY 3 7.275 -0.677 -5.387 11 H ASN 4 H ASN 4 5.086 0.972 -6.376 12 HA ASN 4 HA ASN 4 4.133 -0.738 -8.581 13 HB2 ASN 4 HB2 ASN 4 2.386 0.311 -7.053 14 HB3 ASN 4 HB3 ASN 4 2.896 1.875 -7.681 15 HD21 ASN 4 HD22 ASN 4 0.930 2.332 -8.622 16 HD22 ASN 4 HD21 ASN 4 0.348 1.505 -10.024 17 H SER 5 H SER 5 6.716 0.441 -8.484 18 HA SER 5 HA SER 5 8.176 1.448 -9.892 19 HB2 SER 5 HB2 SER 5 6.856 0.472 -11.700 20 HB3 SER 5 HB3 SER 5 5.738 1.833 -11.644 21 HG SER 5 HG SER 5 7.977 2.998 -11.976 22 H GLN 6 H GLN 6 6.278 2.983 -7.969 23 HA GLN 6 HA GLN 6 6.885 5.650 -9.004 24 HB2 GLN 6 HB2 GLN 6 4.401 4.606 -7.700 25 HB3 GLN 6 HB3 GLN 6 4.806 6.314 -7.597 26 HG2 GLN 6 HG2 GLN 6 4.483 4.768 -10.161 27 HG3 GLN 6 HG3 GLN 6 3.253 5.804 -9.434 28 HE21 GLN 6 HE22 GLN 6 4.583 6.024 -12.029 29 HE22 GLN 6 HE21 GLN 6 5.331 7.584 -12.055 30 HA PRO 7 HA PRO 7 8.887 5.688 -4.956 31 HB2 PRO 7 HB2 PRO 7 11.143 6.902 -5.736 32 HB3 PRO 7 HB3 PRO 7 10.835 5.198 -6.086 33 HG2 PRO 7 HG2 PRO 7 10.773 7.535 -7.898 34 HG3 PRO 7 HG3 PRO 7 11.091 5.834 -8.270 35 HD2 PRO 7 HD2 PRO 7 8.641 7.278 -8.589 36 HD3 PRO 7 HD3 PRO 7 8.938 5.560 -8.912 37 H ILE 8 H ILE 8 7.173 7.207 -4.367 38 HA ILE 8 HA ILE 8 6.571 8.923 -3.108 39 HB ILE 8 HB ILE 8 8.745 8.519 -2.009 40 HG12 ILE 8 HG12 ILE 8 8.025 11.451 -1.971 41 HG13 ILE 8 HG13 ILE 8 7.001 10.208 -1.251 42 HG21 ILE 8 HG21 ILE 8 10.283 9.190 -3.754 43 HG22 ILE 8 HG22 ILE 8 10.560 10.136 -2.293 44 HG23 ILE 8 HG23 ILE 8 9.702 10.852 -3.656 45 HD11 ILE 8 HD11 ILE 8 8.788 9.601 0.270 46 HD12 ILE 8 HD12 ILE 8 8.411 11.320 0.398 47 HD13 ILE 8 HD13 ILE 8 9.850 10.793 -0.480 48 H TRP 9 H TRP 9 8.433 9.980 -5.915 49 HA TRP 9 HA TRP 9 7.407 12.680 -5.742 50 HB2 TRP 9 HB2 TRP 9 8.793 11.246 -8.014 51 HB3 TRP 9 HB3 TRP 9 8.415 12.967 -7.987 52 HD1 TRP 9 HD1 TRP 9 10.811 10.400 -6.551 53 HE1 TRP 9 HE1 TRP 9 12.782 11.625 -5.429 54 HE3 TRP 9 HE3 TRP 9 9.028 15.177 -6.787 55 HZ2 TRP 9 HZ2 TRP 9 13.480 14.271 -4.737 56 HZ3 TRP 9 HZ3 TRP 9 10.405 17.002 -5.869 57 HH2 TRP 9 HH2 TRP 9 12.584 16.556 -4.860 58 H THR 10 H THR 10 5.710 10.145 -6.021 59 HA THR 10 HA THR 10 4.332 10.306 -8.492 60 HB THR 10 HB THR 10 3.282 9.153 -5.912 61 HG1 THR 10 HG1 THR 10 5.140 8.051 -7.783 62 HG21 THR 10 HG21 THR 10 1.736 9.194 -7.833 63 HG22 THR 10 HG22 THR 10 2.192 7.550 -7.389 64 HG23 THR 10 HG23 THR 10 2.928 8.317 -8.796 65 H ASN 11 H ASN 11 3.942 11.816 -5.362 66 HA ASN 11 HA ASN 11 1.795 13.453 -6.434 67 HB2 ASN 11 HB2 ASN 11 0.430 13.167 -4.440 68 HB3 ASN 11 HB3 ASN 11 0.704 11.612 -5.206 69 HD21 ASN 11 HD22 ASN 11 1.024 13.474 -2.387 70 HD22 ASN 11 HD21 ASN 11 1.800 12.280 -1.407 71 HA PRO 12 HA PRO 12 4.166 16.776 -5.110 72 HB2 PRO 12 HB2 PRO 12 2.143 18.444 -4.149 73 HB3 PRO 12 HB3 PRO 12 2.695 18.336 -5.821 74 HG2 PRO 12 HG2 PRO 12 0.341 17.065 -4.511 75 HG3 PRO 12 HG3 PRO 12 0.510 17.691 -6.162 76 HD2 PRO 12 HD2 PRO 12 0.545 15.061 -5.645 77 HD3 PRO 12 HD3 PRO 12 1.569 15.765 -6.913 78 H ASN 13 H ASN 13 1.623 16.014 -2.710 79 HA ASN 13 HA ASN 13 2.874 17.419 -0.611 80 HB2 ASN 13 HB2 ASN 13 0.502 16.817 -0.518 81 HB3 ASN 13 HB3 ASN 13 0.926 15.110 -0.438 82 HD21 ASN 13 HD22 ASN 13 1.552 14.230 1.484 83 HD22 ASN 13 HD21 ASN 13 1.539 15.097 2.980 84 H ALA 14 H ALA 14 3.184 14.107 -1.727 85 HA ALA 14 HA ALA 14 4.459 12.978 0.494 86 HB1 ALA 14 HB1 ALA 14 5.236 11.260 -1.029 87 HB2 ALA 14 HB2 ALA 14 4.881 12.297 -2.413 88 HB3 ALA 14 HB3 ALA 14 3.568 11.694 -1.404 89 H ALA 15 H ALA 15 5.861 14.379 -2.430 90 HA ALA 15 HA ALA 15 8.550 14.012 -1.607 91 HB1 ALA 15 HB1 ALA 15 7.423 15.816 -3.740 92 HB2 ALA 15 HB2 ALA 15 7.904 14.134 -3.956 93 HB3 ALA 15 HB3 ALA 15 9.116 15.354 -3.565 94 H MET 16 H MET 16 6.363 16.805 -1.651 95 HA MET 16 HA MET 16 8.257 18.706 -0.842 96 HB2 MET 16 HB2 MET 16 5.427 18.602 -1.300 97 HB3 MET 16 HB3 MET 16 5.755 19.515 0.169 98 HG2 MET 16 HG2 MET 16 7.028 20.053 -2.504 99 HG3 MET 16 HG3 MET 16 5.598 20.879 -1.898 100 HE1 MET 16 HE1 MET 16 9.951 21.765 -0.891 101 HE2 MET 16 HE2 MET 16 9.275 21.103 -2.378 102 HE3 MET 16 HE3 MET 16 9.420 20.090 -0.947 103 H THR 17 H THR 17 6.236 16.507 0.986 104 HA THR 17 HA THR 17 6.589 17.579 3.537 105 HB THR 17 HB THR 17 6.207 14.706 2.671 106 HG1 THR 17 HG1 THR 17 4.381 15.810 2.210 107 HG21 THR 17 HG21 THR 17 6.018 15.917 5.445 108 HG22 THR 17 HG22 THR 17 7.184 14.704 4.907 109 HG23 THR 17 HG23 THR 17 5.470 14.299 5.009 110 H MET 18 H MET 18 8.512 15.024 1.914 111 HA MET 18 HA MET 18 10.323 14.817 4.091 112 HB2 MET 18 HB2 MET 18 11.718 13.455 2.557 113 HB3 MET 18 HB3 MET 18 10.054 12.914 2.664 114 HG2 MET 18 HG2 MET 18 10.524 12.724 0.422 115 HG3 MET 18 HG3 MET 18 9.694 14.275 0.516 116 HE1 MET 18 HE1 MET 18 11.506 13.188 -1.906 117 HE2 MET 18 HE2 MET 18 12.400 14.644 -2.351 118 HE3 MET 18 HE3 MET 18 10.680 14.745 -1.975 119 H THR 19 H THR 19 10.212 16.817 1.257 120 HA THR 19 HA THR 19 12.905 17.699 1.307 121 HB THR 19 HB THR 19 10.432 19.067 0.244 122 HG1 THR 19 HG1 THR 19 11.670 16.867 -0.560 123 HG21 THR 19 HG21 THR 19 11.967 20.308 -1.199 124 HG22 THR 19 HG22 THR 19 13.341 19.538 -0.403 125 HG23 THR 19 HG23 THR 19 12.290 20.628 0.507 126 H ASN 20 H ASN 20 9.894 19.018 2.657 127 HA ASN 20 HA ASN 20 11.142 21.336 3.743 128 HB2 ASN 20 HB2 ASN 20 8.438 20.074 4.088 129 HB3 ASN 20 HB3 ASN 20 8.921 21.486 5.018 130 HD21 ASN 20 HD22 ASN 20 6.865 21.079 2.930 131 HD22 ASN 20 HD21 ASN 20 7.180 22.292 1.743 132 H ASN 21 H ASN 21 10.402 18.132 4.991 133 HA ASN 21 HA ASN 21 10.839 18.741 7.713 134 HB2 ASN 21 HB2 ASN 21 11.036 16.144 6.190 135 HB3 ASN 21 HB3 ASN 21 11.271 16.255 7.927 136 HD21 ASN 21 HD22 ASN 21 9.280 14.760 6.533 137 HD22 ASN 21 HD21 ASN 21 7.744 15.366 7.038 138 H LEU 22 H LEU 22 12.958 17.928 5.060 139 HA LEU 22 HA LEU 22 15.325 17.477 6.509 140 HB2 LEU 22 HB2 LEU 22 15.164 16.933 4.146 141 HB3 LEU 22 HB3 LEU 22 14.898 18.620 3.744 142 HG LEU 22 HG LEU 22 17.208 19.090 4.653 143 HD11 LEU 22 HD11 LEU 22 17.487 17.107 6.009 144 HD12 LEU 22 HD12 LEU 22 18.754 17.191 4.784 145 HD13 LEU 22 HD13 LEU 22 17.396 16.085 4.575 146 HD21 LEU 22 HD21 LEU 22 16.860 17.299 2.258 147 HD22 LEU 22 HD22 LEU 22 18.344 18.172 2.629 148 HD23 LEU 22 HD23 LEU 22 16.860 19.061 2.294 149 H VAL 23 H VAL 23 13.904 20.391 5.121 150 HA VAL 23 HA VAL 23 15.934 22.185 5.840 151 HB VAL 23 HB VAL 23 12.982 22.748 5.481 152 HG11 VAL 23 HG11 VAL 23 13.679 25.061 5.040 153 HG12 VAL 23 HG12 VAL 23 15.341 24.630 5.440 154 HG13 VAL 23 HG13 VAL 23 14.091 24.557 6.679 155 HG21 VAL 23 HG21 VAL 23 15.286 22.881 3.539 156 HG22 VAL 23 HG22 VAL 23 13.647 23.447 3.212 157 HG23 VAL 23 HG23 VAL 23 13.947 21.732 3.507 158 H GLN 24 H GLN 24 12.936 21.265 7.552 159 HA GLN 24 HA GLN 24 13.331 23.111 9.670 160 HB2 GLN 24 HB2 GLN 24 11.539 22.008 10.809 161 HB3 GLN 24 HB3 GLN 24 11.140 22.032 9.098 162 HG2 GLN 24 HG2 GLN 24 11.834 19.720 8.886 163 HG3 GLN 24 HG3 GLN 24 12.281 19.685 10.587 164 HE21 GLN 24 HE22 GLN 24 10.849 17.986 10.967 165 HE22 GLN 24 HE21 GLN 24 9.142 18.243 11.057 166 H CYS 25 H CYS 25 14.447 19.851 9.105 167 HA CYS 25 HA CYS 25 15.305 19.389 11.793 168 HB2 CYS 25 HB2 CYS 25 14.726 17.546 10.264 169 HB3 CYS 25 HB3 CYS 25 16.079 17.980 9.227 170 H ALA 26 H ALA 26 16.937 20.317 8.776 171 HA ALA 26 HA ALA 26 19.522 20.345 10.030 172 HB1 ALA 26 HB1 ALA 26 18.706 21.380 7.321 173 HB2 ALA 26 HB2 ALA 26 19.209 19.727 7.676 174 HB3 ALA 26 HB3 ALA 26 20.350 21.056 7.871 175 H SER 27 H SER 27 17.123 22.786 9.167 176 HA SER 27 HA SER 27 18.854 25.014 9.610 177 HB2 SER 27 HB2 SER 27 16.778 25.136 8.229 178 HB3 SER 27 HB3 SER 27 15.827 24.940 9.703 179 HG SER 27 HG SER 27 17.436 26.893 10.249 180 H ARG 28 H ARG 28 17.194 22.872 11.651 181 HA ARG 28 HA ARG 28 17.462 24.719 13.913 182 HB2 ARG 28 HB2 ARG 28 15.622 22.384 13.541 183 HB3 ARG 28 HB3 ARG 28 15.791 23.291 15.041 184 HG2 ARG 28 HG2 ARG 28 15.115 25.335 13.842 185 HG3 ARG 28 HG3 ARG 28 14.861 24.363 12.389 186 HD2 ARG 28 HD2 ARG 28 13.334 22.952 13.804 187 HD3 ARG 28 HD3 ARG 28 13.401 24.239 14.997 188 HE ARG 28 HE ARG 28 12.270 24.483 12.287 189 HH11 ARG 28 HH11 ARG 28 12.632 25.665 15.552 190 HH12 ARG 28 HH12 ARG 28 11.362 26.834 15.410 191 HH21 ARG 28 HH21 ARG 28 10.568 26.022 12.095 192 HH22 ARG 28 HH22 ARG 28 10.186 27.031 13.457 193 H SER 29 H SER 29 19.458 22.903 12.619 194 HA SER 29 HA SER 29 19.939 20.815 14.535 195 HB2 SER 29 HB2 SER 29 21.987 20.404 13.212 196 HB3 SER 29 HB3 SER 29 20.555 20.501 12.185 197 HG SER 29 HG SER 29 21.312 22.247 11.275 198 H GLY 30 H GLY 30 21.062 24.056 13.916 199 HA2 GLY 30 HA2 GLY 30 22.154 25.475 15.432 200 HA3 GLY 30 HA3 GLY 30 22.544 24.075 16.426 201 H VAL 31 H VAL 31 23.190 23.222 13.333 202 HA VAL 31 HA VAL 31 26.054 23.639 13.751 203 HB VAL 31 HB VAL 31 24.640 21.840 11.776 204 HG11 VAL 31 HG11 VAL 31 26.820 20.773 11.493 205 HG12 VAL 31 HG12 VAL 31 27.543 21.956 12.583 206 HG13 VAL 31 HG13 VAL 31 26.873 22.476 11.037 207 HG21 VAL 31 HG21 VAL 31 25.253 20.007 13.262 208 HG22 VAL 31 HG22 VAL 31 24.219 21.171 14.089 209 HG23 VAL 31 HG23 VAL 31 25.954 21.155 14.402 210 H LEU 32 H LEU 32 23.513 24.198 11.351 211 HA LEU 32 HA LEU 32 25.299 25.137 9.336 212 HB2 LEU 32 HB2 LEU 32 22.318 25.520 9.574 213 HB3 LEU 32 HB3 LEU 32 23.275 25.837 8.141 214 HG LEU 32 HG LEU 32 22.817 23.147 9.411 215 HD11 LEU 32 HD11 LEU 32 21.594 22.666 7.332 216 HD12 LEU 32 HD12 LEU 32 21.814 24.342 6.836 217 HD13 LEU 32 HD13 LEU 32 20.850 23.964 8.263 218 HD21 LEU 32 HD21 LEU 32 24.348 23.866 6.920 219 HD22 LEU 32 HD22 LEU 32 23.979 22.230 7.470 220 HD23 LEU 32 HD23 LEU 32 25.038 23.265 8.430 221 H THR 33 H THR 33 25.085 27.287 8.356 222 HA THR 33 HA THR 33 25.354 29.316 10.429 223 HB THR 33 HB THR 33 26.430 30.684 8.806 224 HG1 THR 33 HG1 THR 33 26.028 30.566 6.716 225 HG21 THR 33 HG21 THR 33 27.772 28.772 9.564 226 HG22 THR 33 HG22 THR 33 28.192 29.254 7.920 227 HG23 THR 33 HG23 THR 33 27.187 27.830 8.192 228 H ALA 34 H ALA 34 24.481 31.538 9.886 229 HA ALA 34 HA ALA 34 21.691 31.483 9.662 230 HB1 ALA 34 HB1 ALA 34 23.512 33.839 9.188 231 HB2 ALA 34 HB2 ALA 34 22.967 33.280 10.770 232 HB3 ALA 34 HB3 ALA 34 21.799 33.896 9.602 233 H ASP 35 H ASP 35 24.216 31.854 7.289 234 HA ASP 35 HA ASP 35 22.550 32.692 5.122 235 HB2 ASP 35 HB2 ASP 35 25.033 31.104 4.618 236 HB3 ASP 35 HB3 ASP 35 24.451 32.549 3.802 237 H GLN 36 H GLN 36 24.086 29.621 5.981 238 HA GLN 36 HA GLN 36 23.044 28.060 3.942 239 HB2 GLN 36 HB2 GLN 36 24.014 27.404 6.712 240 HB3 GLN 36 HB3 GLN 36 23.446 26.148 5.618 241 HG2 GLN 36 HG2 GLN 36 25.160 26.715 4.019 242 HG3 GLN 36 HG3 GLN 36 25.677 28.075 5.014 243 HE21 GLN 36 HE22 GLN 36 27.103 25.646 4.088 244 HE22 GLN 36 HE21 GLN 36 27.721 24.907 5.526 245 H MET 37 H MET 37 21.690 28.743 7.145 246 HA MET 37 HA MET 37 19.597 26.857 7.014 247 HB2 MET 37 HB2 MET 37 19.815 29.441 8.570 248 HB3 MET 37 HB3 MET 37 18.517 28.274 8.788 249 HG2 MET 37 HG2 MET 37 20.230 26.573 9.381 250 HG3 MET 37 HG3 MET 37 21.450 27.842 9.306 251 HE1 MET 37 HE1 MET 37 20.356 30.190 12.239 252 HE2 MET 37 HE2 MET 37 19.937 30.342 10.534 253 HE3 MET 37 HE3 MET 37 21.574 29.883 11.004 254 H ASP 38 H ASP 38 19.746 30.257 5.996 255 HA ASP 38 HA ASP 38 16.936 30.295 5.356 256 HB2 ASP 38 HB2 ASP 38 18.092 32.333 6.124 257 HB3 ASP 38 HB3 ASP 38 19.093 32.301 4.676 258 H ASP 39 H ASP 39 19.972 29.961 3.607 259 HA ASP 39 HA ASP 39 18.840 29.994 1.009 260 HB2 ASP 39 HB2 ASP 39 21.438 28.998 2.137 261 HB3 ASP 39 HB3 ASP 39 21.006 28.640 0.468 262 H MET 40 H MET 40 19.112 27.527 3.456 263 HA MET 40 HA MET 40 18.452 25.273 1.911 264 HB2 MET 40 HB2 MET 40 17.981 25.999 4.792 265 HB3 MET 40 HB3 MET 40 17.380 24.487 4.130 266 HG2 MET 40 HG2 MET 40 20.265 25.287 3.938 267 HG3 MET 40 HG3 MET 40 19.610 24.435 5.336 268 HE1 MET 40 HE1 MET 40 18.732 22.034 5.339 269 HE2 MET 40 HE2 MET 40 18.521 21.031 3.906 270 HE3 MET 40 HE3 MET 40 17.509 22.455 4.144 271 H GLY 41 H GLY 41 16.523 27.870 3.242 272 HA2 GLY 41 HA2 GLY 41 13.968 26.732 2.860 273 HA3 GLY 41 HA3 GLY 41 14.321 28.451 2.974 274 H MET 42 H MET 42 15.905 28.885 0.787 275 HA MET 42 HA MET 42 13.964 28.930 -1.294 276 HB2 MET 42 HB2 MET 42 15.602 30.086 -2.618 277 HB3 MET 42 HB3 MET 42 15.678 30.706 -0.976 278 HG2 MET 42 HG2 MET 42 17.623 29.276 -0.549 279 HG3 MET 42 HG3 MET 42 17.561 28.723 -2.219 280 HE1 MET 42 HE1 MET 42 18.169 31.768 0.166 281 HE2 MET 42 HE2 MET 42 16.891 32.388 -0.877 282 HE3 MET 42 HE3 MET 42 18.514 33.065 -0.975 283 H MET 43 H MET 43 16.482 26.751 -0.408 284 HA MET 43 HA MET 43 16.781 25.397 -2.867 285 HB2 MET 43 HB2 MET 43 18.352 25.095 -1.026 286 HB3 MET 43 HB3 MET 43 17.085 24.420 -0.019 287 HG2 MET 43 HG2 MET 43 17.841 23.120 -2.603 288 HG3 MET 43 HG3 MET 43 18.784 22.843 -1.143 289 HE1 MET 43 HE1 MET 43 17.810 21.764 1.056 290 HE2 MET 43 HE2 MET 43 16.155 21.181 1.233 291 HE3 MET 43 HE3 MET 43 16.471 22.914 1.110 292 H ALA 44 H ALA 44 14.752 24.689 -0.029 293 HA ALA 44 HA ALA 44 13.284 22.583 -1.183 294 HB1 ALA 44 HB1 ALA 44 12.489 24.508 1.004 295 HB2 ALA 44 HB2 ALA 44 13.307 22.961 1.216 296 HB3 ALA 44 HB3 ALA 44 11.651 23.006 0.616 297 H ASP 45 H ASP 45 12.909 26.051 -1.220 298 HA ASP 45 HA ASP 45 10.364 26.287 -2.333 299 HB2 ASP 45 HB2 ASP 45 11.726 28.164 -1.417 300 HB3 ASP 45 HB3 ASP 45 12.752 28.073 -2.846 301 H SER 46 H SER 46 13.521 25.901 -3.861 302 HA SER 46 HA SER 46 12.630 26.031 -6.536 303 HB2 SER 46 HB2 SER 46 14.989 26.347 -5.827 304 HB3 SER 46 HB3 SER 46 15.072 24.639 -5.403 305 HG SER 46 HG SER 46 15.934 25.125 -7.494 306 H VAL 47 H VAL 47 13.046 23.355 -4.261 307 HA VAL 47 HA VAL 47 12.788 21.225 -6.039 308 HB VAL 47 HB VAL 47 11.862 21.311 -3.158 309 HG11 VAL 47 HG11 VAL 47 12.124 18.876 -3.214 310 HG12 VAL 47 HG12 VAL 47 12.517 18.955 -4.931 311 HG13 VAL 47 HG13 VAL 47 10.907 19.416 -4.373 312 HG21 VAL 47 HG21 VAL 47 14.494 20.425 -4.351 313 HG22 VAL 47 HG22 VAL 47 14.045 20.340 -2.648 314 HG23 VAL 47 HG23 VAL 47 14.226 21.908 -3.434 315 H ASN 48 H ASN 48 10.180 22.835 -4.155 316 HA ASN 48 HA ASN 48 8.180 21.180 -5.311 317 HB2 ASN 48 HB2 ASN 48 6.551 22.641 -4.259 318 HB3 ASN 48 HB3 ASN 48 7.818 22.223 -3.127 319 HD21 ASN 48 HD22 ASN 48 9.076 23.797 -2.279 320 HD22 ASN 48 HD21 ASN 48 8.802 25.477 -2.545 321 H SER 49 H SER 49 9.650 24.186 -6.245 322 HA SER 49 HA SER 49 7.758 25.055 -8.118 323 HB2 SER 49 HB2 SER 49 9.670 26.433 -7.449 324 HB3 SER 49 HB3 SER 49 10.779 25.286 -8.194 325 HG SER 49 HG SER 49 9.208 27.247 -9.342 326 H GLN 50 H GLN 50 10.559 22.918 -8.477 327 HA GLN 50 HA GLN 50 10.102 22.367 -11.231 328 HB2 GLN 50 HB2 GLN 50 11.699 20.732 -9.258 329 HB3 GLN 50 HB3 GLN 50 11.886 20.768 -11.006 330 HG2 GLN 50 HG2 GLN 50 12.690 23.030 -10.925 331 HG3 GLN 50 HG3 GLN 50 12.370 23.120 -9.193 332 HE21 GLN 50 HE22 GLN 50 14.480 23.551 -8.620 333 HE22 GLN 50 HE21 GLN 50 15.742 22.379 -8.772 334 H MET 51 H MET 51 9.477 20.576 -8.240 335 HA MET 51 HA MET 51 8.587 18.200 -9.410 336 HB2 MET 51 HB2 MET 51 9.254 18.237 -7.117 337 HB3 MET 51 HB3 MET 51 8.023 19.425 -6.715 338 HG2 MET 51 HG2 MET 51 7.002 16.924 -7.864 339 HG3 MET 51 HG3 MET 51 7.792 16.765 -6.297 340 HE1 MET 51 HE1 MET 51 5.673 18.950 -3.944 341 HE2 MET 51 HE2 MET 51 7.129 19.480 -4.788 342 HE3 MET 51 HE3 MET 51 7.037 17.847 -4.130 343 H GLN 52 H GLN 52 6.724 21.078 -8.443 344 HA GLN 52 HA GLN 52 4.213 19.804 -8.948 345 HB2 GLN 52 HB2 GLN 52 4.899 22.726 -8.626 346 HB3 GLN 52 HB3 GLN 52 3.263 22.090 -8.728 347 HG2 GLN 52 HG2 GLN 52 3.671 20.760 -6.703 348 HG3 GLN 52 HG3 GLN 52 5.287 21.458 -6.591 349 HE21 GLN 52 HE22 GLN 52 5.501 23.662 -6.097 350 HE22 GLN 52 HE21 GLN 52 4.225 24.534 -5.320 351 H LYS 53 H LYS 53 6.541 21.297 -10.961 352 HA LYS 53 HA LYS 53 4.635 21.759 -13.106 353 HB2 LYS 53 HB2 LYS 53 7.645 22.027 -13.037 354 HB3 LYS 53 HB3 LYS 53 6.627 22.469 -14.398 355 HG2 LYS 53 HG2 LYS 53 5.533 24.170 -13.059 356 HG3 LYS 53 HG3 LYS 53 6.488 23.700 -11.654 357 HD2 LYS 53 HD2 LYS 53 8.544 24.252 -13.009 358 HD3 LYS 53 HD3 LYS 53 7.464 24.955 -14.214 359 HE2 LYS 53 HE2 LYS 53 7.713 25.800 -11.329 360 HE3 LYS 53 HE3 LYS 53 8.342 26.673 -12.724 361 HZ1 LYS 53 HZ1 LYS 53 6.079 26.978 -13.504 362 HZ2 LYS 53 HZ2 LYS 53 6.261 27.613 -11.951 363 HZ3 LYS 53 HZ3 LYS 53 5.477 26.133 -12.170 364 H MET 54 H MET 54 6.705 19.308 -11.935 365 HA MET 54 HA MET 54 7.204 17.890 -14.322 366 HB2 MET 54 HB2 MET 54 8.511 17.510 -12.297 367 HB3 MET 54 HB3 MET 54 7.082 16.923 -11.458 368 HG2 MET 54 HG2 MET 54 7.014 14.952 -12.722 369 HG3 MET 54 HG3 MET 54 8.122 15.591 -13.934 370 HE1 MET 54 HE1 MET 54 7.739 14.449 -10.214 371 HE2 MET 54 HE2 MET 54 8.688 15.917 -9.961 372 HE3 MET 54 HE3 MET 54 9.413 14.331 -9.664 373 H GLY 55 H GLY 55 4.681 17.494 -11.834 374 HA2 GLY 55 HA2 GLY 55 2.401 17.279 -12.721 375 HA3 GLY 55 HA3 GLY 55 3.061 16.189 -13.929 376 HA PRO 56 HA PRO 56 1.657 13.703 -10.195 377 HB2 PRO 56 HB2 PRO 56 -0.825 13.001 -10.893 378 HB3 PRO 56 HB3 PRO 56 -0.500 14.548 -10.102 379 HG2 PRO 56 HG2 PRO 56 -0.977 13.966 -12.998 380 HG3 PRO 56 HG3 PRO 56 -1.592 15.301 -12.009 381 HD2 PRO 56 HD2 PRO 56 0.574 15.492 -13.700 382 HD3 PRO 56 HD3 PRO 56 0.305 16.541 -12.296 383 H ASN 57 H ASN 57 2.186 11.613 -10.223 384 HA ASN 57 HA ASN 57 2.915 9.598 -10.982 385 HB2 ASN 57 HB2 ASN 57 0.445 9.924 -12.684 386 HB3 ASN 57 HB3 ASN 57 1.410 8.451 -12.676 387 HD21 ASN 57 HD22 ASN 57 -0.816 10.433 -10.924 388 HD22 ASN 57 HD21 ASN 57 -1.150 9.298 -9.664 389 HA PRO 58 HA PRO 58 4.910 11.247 -14.831 390 HB2 PRO 58 HB2 PRO 58 7.295 11.913 -13.390 391 HB3 PRO 58 HB3 PRO 58 6.149 13.015 -14.152 392 HG2 PRO 58 HG2 PRO 58 6.547 12.846 -11.434 393 HG3 PRO 58 HG3 PRO 58 5.060 13.437 -12.192 394 HD2 PRO 58 HD2 PRO 58 5.664 10.709 -11.091 395 HD3 PRO 58 HD3 PRO 58 4.196 11.699 -10.907 396 HA PRO 59 HA PRO 59 7.403 7.658 -15.576 397 HB2 PRO 59 HB2 PRO 59 9.624 9.271 -16.643 398 HB3 PRO 59 HB3 PRO 59 8.621 8.067 -17.453 399 HG2 PRO 59 HG2 PRO 59 8.396 10.700 -17.962 400 HG3 PRO 59 HG3 PRO 59 7.008 9.599 -18.026 401 HD2 PRO 59 HD2 PRO 59 7.779 11.566 -15.917 402 HD3 PRO 59 HD3 PRO 59 6.166 11.107 -16.499 403 H GLN 60 H GLN 60 8.876 6.417 -14.527 404 HA GLN 60 HA GLN 60 9.851 7.307 -12.065 405 HB2 GLN 60 HB2 GLN 60 9.345 4.946 -12.561 406 HB3 GLN 60 HB3 GLN 60 10.741 4.879 -13.629 407 HG2 GLN 60 HG2 GLN 60 12.198 5.390 -11.713 408 HG3 GLN 60 HG3 GLN 60 10.787 5.368 -10.659 409 HE21 GLN 60 HE22 GLN 60 9.783 3.412 -10.202 410 HE22 GLN 60 HE21 GLN 60 10.570 1.896 -10.472 411 H HIS 61 H HIS 61 11.481 7.043 -15.194 412 HA HIS 61 HA HIS 61 14.095 7.364 -14.166 413 HB2 HIS 61 HB2 HIS 61 14.835 7.673 -16.432 414 HB3 HIS 61 HB3 HIS 61 13.590 6.436 -16.428 415 HD1 HIS 61 HD1 HIS 61 11.589 6.813 -17.923 416 HD2 HIS 61 HD2 HIS 61 14.001 10.182 -17.566 417 HE1 HIS 61 HE1 HIS 61 10.751 8.435 -19.648 418 H ARG 62 H ARG 62 11.559 9.630 -14.721 419 HA ARG 62 HA ARG 62 13.334 11.925 -14.668 420 HB2 ARG 62 HB2 ARG 62 10.340 11.599 -14.664 421 HB3 ARG 62 HB3 ARG 62 11.089 13.158 -14.358 422 HG2 ARG 62 HG2 ARG 62 11.662 11.545 -16.827 423 HG3 ARG 62 HG3 ARG 62 10.341 12.707 -16.727 424 HD2 ARG 62 HD2 ARG 62 11.950 14.476 -16.175 425 HD3 ARG 62 HD3 ARG 62 13.267 13.310 -16.303 426 HE ARG 62 HE ARG 62 12.358 13.045 -18.702 427 HH11 ARG 62 HH11 ARG 62 12.426 16.048 -16.892 428 HH12 ARG 62 HH12 ARG 62 12.527 17.045 -18.305 429 HH21 ARG 62 HH21 ARG 62 12.516 14.357 -20.557 430 HH22 ARG 62 HH22 ARG 62 12.574 16.082 -20.392 431 H LEU 63 H LEU 63 11.193 10.177 -12.508 432 HA LEU 63 HA LEU 63 11.419 11.911 -10.274 433 HB2 LEU 63 HB2 LEU 63 10.947 8.941 -10.116 434 HB3 LEU 63 HB3 LEU 63 10.342 10.194 -9.049 435 HG LEU 63 HG LEU 63 9.454 9.682 -11.885 436 HD11 LEU 63 HD11 LEU 63 7.289 9.176 -10.800 437 HD12 LEU 63 HD12 LEU 63 8.095 9.272 -9.233 438 HD13 LEU 63 HD13 LEU 63 8.570 8.034 -10.397 439 HD21 LEU 63 HD21 LEU 63 7.804 11.417 -11.503 440 HD22 LEU 63 HD22 LEU 63 9.438 12.063 -11.379 441 HD23 LEU 63 HD23 LEU 63 8.498 11.751 -9.920 442 H ARG 64 H ARG 64 13.149 9.087 -11.375 443 HA ARG 64 HA ARG 64 14.940 8.954 -9.136 444 HB2 ARG 64 HB2 ARG 64 14.214 6.987 -10.448 445 HB3 ARG 64 HB3 ARG 64 15.034 7.633 -11.855 446 HG2 ARG 64 HG2 ARG 64 17.093 7.022 -11.105 447 HG3 ARG 64 HG3 ARG 64 16.640 7.165 -9.401 448 HD2 ARG 64 HD2 ARG 64 15.740 5.083 -9.321 449 HD3 ARG 64 HD3 ARG 64 15.225 5.131 -11.002 450 HE ARG 64 HE ARG 64 17.272 4.278 -11.650 451 HH11 ARG 64 HH11 ARG 64 17.449 5.093 -8.243 452 HH12 ARG 64 HH12 ARG 64 18.749 3.991 -7.933 453 HH21 ARG 64 HH21 ARG 64 18.955 2.822 -11.231 454 HH22 ARG 64 HH22 ARG 64 19.610 2.700 -9.625 455 H ALA 65 H ALA 65 14.654 11.149 -11.502 456 HA ALA 65 HA ALA 65 17.548 11.706 -11.548 457 HB1 ALA 65 HB1 ALA 65 15.436 12.696 -13.465 458 HB2 ALA 65 HB2 ALA 65 16.574 11.386 -13.780 459 HB3 ALA 65 HB3 ALA 65 17.166 13.032 -13.553 460 H MET 66 H MET 66 14.639 12.600 -10.145 461 HA MET 66 HA MET 66 15.020 15.449 -10.067 462 HB2 MET 66 HB2 MET 66 13.173 13.550 -8.647 463 HB3 MET 66 HB3 MET 66 13.293 15.227 -8.136 464 HG2 MET 66 HG2 MET 66 12.538 14.289 -10.894 465 HG3 MET 66 HG3 MET 66 11.419 14.852 -9.654 466 HE1 MET 66 HE1 MET 66 13.062 17.277 -8.350 467 HE2 MET 66 HE2 MET 66 11.346 17.362 -8.749 468 HE3 MET 66 HE3 MET 66 12.445 18.628 -9.297 469 H ASN 67 H ASN 67 16.068 12.739 -8.273 470 HA ASN 67 HA ASN 67 16.878 13.937 -5.881 471 HB2 ASN 67 HB2 ASN 67 18.614 12.053 -5.881 472 HB3 ASN 67 HB3 ASN 67 16.922 11.580 -5.948 473 HD21 ASN 67 HD22 ASN 67 17.087 9.683 -6.979 474 HD22 ASN 67 HD21 ASN 67 17.713 9.483 -8.578 475 H THR 68 H THR 68 18.231 13.997 -9.082 476 HA THR 68 HA THR 68 20.803 15.000 -8.323 477 HB THR 68 HB THR 68 19.444 15.149 -11.020 478 HG1 THR 68 HG1 THR 68 19.961 12.989 -9.728 479 HG21 THR 68 HG21 THR 68 22.361 15.211 -10.236 480 HG22 THR 68 HG22 THR 68 21.421 16.568 -10.854 481 HG23 THR 68 HG23 THR 68 21.749 15.178 -11.888 482 H ALA 69 H ALA 69 17.780 16.391 -9.485 483 HA ALA 69 HA ALA 69 18.672 19.026 -9.831 484 HB1 ALA 69 HB1 ALA 69 15.904 18.074 -9.110 485 HB2 ALA 69 HB2 ALA 69 16.563 18.171 -10.743 486 HB3 ALA 69 HB3 ALA 69 16.322 19.641 -9.801 487 H MET 70 H MET 70 17.080 17.477 -7.045 488 HA MET 70 HA MET 70 17.159 19.810 -5.438 489 HB2 MET 70 HB2 MET 70 16.501 18.342 -3.611 490 HB3 MET 70 HB3 MET 70 15.559 18.016 -5.049 491 HG2 MET 70 HG2 MET 70 16.969 16.074 -5.520 492 HG3 MET 70 HG3 MET 70 17.859 16.382 -4.032 493 HE1 MET 70 HE1 MET 70 15.614 17.258 -1.996 494 HE2 MET 70 HE2 MET 70 16.858 16.074 -1.602 495 HE3 MET 70 HE3 MET 70 15.162 15.709 -1.287 496 H ALA 71 H ALA 71 19.203 16.920 -5.609 497 HA ALA 71 HA ALA 71 21.019 17.421 -3.616 498 HB1 ALA 71 HB1 ALA 71 21.065 15.403 -4.976 499 HB2 ALA 71 HB2 ALA 71 22.653 16.168 -4.925 500 HB3 ALA 71 HB3 ALA 71 21.637 16.338 -6.357 501 H ALA 72 H ALA 72 20.997 18.787 -6.890 502 HA ALA 72 HA ALA 72 23.494 20.089 -6.720 503 HB1 ALA 72 HB1 ALA 72 21.113 20.859 -8.401 504 HB2 ALA 72 HB2 ALA 72 22.315 19.643 -8.835 505 HB3 ALA 72 HB3 ALA 72 22.789 21.335 -8.671 506 H GLU 73 H GLU 73 20.204 21.171 -6.004 507 HA GLU 73 HA GLU 73 20.878 23.855 -5.418 508 HB2 GLU 73 HB2 GLU 73 18.533 22.232 -4.411 509 HB3 GLU 73 HB3 GLU 73 18.658 23.985 -4.392 510 HG2 GLU 73 HG2 GLU 73 18.681 22.314 -6.896 511 HG3 GLU 73 HG3 GLU 73 17.242 23.061 -6.214 512 H VAL 74 H VAL 74 20.728 20.923 -3.470 513 HA VAL 74 HA VAL 74 21.168 22.241 -0.968 514 HB VAL 74 HB VAL 74 21.609 19.337 -1.698 515 HG11 VAL 74 HG11 VAL 74 21.445 18.924 0.720 516 HG12 VAL 74 HG12 VAL 74 21.374 20.664 1.001 517 HG13 VAL 74 HG13 VAL 74 22.828 19.942 0.314 518 HG21 VAL 74 HG21 VAL 74 19.421 18.962 -0.657 519 HG22 VAL 74 HG22 VAL 74 19.302 20.029 -2.057 520 HG23 VAL 74 HG23 VAL 74 19.237 20.701 -0.427 521 H ALA 75 H ALA 75 23.235 20.730 -3.392 522 HA ALA 75 HA ALA 75 25.596 20.526 -1.926 523 HB1 ALA 75 HB1 ALA 75 25.241 19.502 -4.131 524 HB2 ALA 75 HB2 ALA 75 26.754 20.406 -4.044 525 HB3 ALA 75 HB3 ALA 75 25.357 21.097 -4.875 526 H GLU 76 H GLU 76 24.142 23.290 -3.474 527 HA GLU 76 HA GLU 76 26.248 25.075 -3.617 528 HB2 GLU 76 HB2 GLU 76 23.370 25.596 -2.860 529 HB3 GLU 76 HB3 GLU 76 24.527 26.844 -3.298 530 HG2 GLU 76 HG2 GLU 76 23.932 24.577 -5.152 531 HG3 GLU 76 HG3 GLU 76 22.890 25.998 -5.080 532 H VAL 77 H VAL 77 23.996 24.674 -0.867 533 HA VAL 77 HA VAL 77 25.444 26.500 0.771 534 HB VAL 77 HB VAL 77 23.980 25.819 2.600 535 HG11 VAL 77 HG11 VAL 77 21.839 26.428 1.587 536 HG12 VAL 77 HG12 VAL 77 22.515 26.128 -0.014 537 HG13 VAL 77 HG13 VAL 77 23.157 27.434 0.983 538 HG21 VAL 77 HG21 VAL 77 22.282 24.106 2.330 539 HG22 VAL 77 HG22 VAL 77 23.888 23.407 2.122 540 HG23 VAL 77 HG23 VAL 77 22.880 23.740 0.713 541 H VAL 78 H VAL 78 25.533 23.046 0.293 542 HA VAL 78 HA VAL 78 27.032 22.425 2.630 543 HB VAL 78 HB VAL 78 26.806 20.865 0.044 544 HG11 VAL 78 HG11 VAL 78 27.438 18.928 1.399 545 HG12 VAL 78 HG12 VAL 78 27.673 19.981 2.793 546 HG13 VAL 78 HG13 VAL 78 28.710 20.148 1.377 547 HG21 VAL 78 HG21 VAL 78 25.230 20.620 2.606 548 HG22 VAL 78 HG22 VAL 78 25.071 19.590 1.184 549 HG23 VAL 78 HG23 VAL 78 24.632 21.296 1.091 550 H ALA 79 H ALA 79 27.877 23.243 -0.691 551 HA ALA 79 HA ALA 79 30.660 22.712 -0.477 552 HB1 ALA 79 HB1 ALA 79 30.848 23.998 -2.560 553 HB2 ALA 79 HB2 ALA 79 29.172 24.524 -2.377 554 HB3 ALA 79 HB3 ALA 79 29.538 22.819 -2.629 555 H THR 80 H THR 80 28.803 25.065 0.964 556 HA THR 80 HA THR 80 30.890 27.107 0.945 557 HB THR 80 HB THR 80 28.196 27.229 2.323 558 HG1 THR 80 HG1 THR 80 27.942 26.862 0.051 559 HG21 THR 80 HG21 THR 80 30.069 29.400 1.356 560 HG22 THR 80 HG22 THR 80 29.818 28.926 3.036 561 HG23 THR 80 HG23 THR 80 28.499 29.656 2.121 562 H SER 81 H SER 81 30.551 24.342 2.503 563 HA SER 81 HA SER 81 31.046 25.335 5.209 564 HB2 SER 81 HB2 SER 81 30.806 22.464 4.291 565 HB3 SER 81 HB3 SER 81 30.696 23.073 5.943 566 HG SER 81 HG SER 81 28.810 23.051 3.926 567 HA PRO 82 HA PRO 82 35.501 24.878 4.643 568 HB2 PRO 82 HB2 PRO 82 35.355 24.811 7.613 569 HB3 PRO 82 HB3 PRO 82 36.356 25.816 6.560 570 HG2 PRO 82 HG2 PRO 82 34.250 26.847 7.823 571 HG3 PRO 82 HG3 PRO 82 34.648 27.336 6.165 572 HD2 PRO 82 HD2 PRO 82 32.510 25.482 7.132 573 HD3 PRO 82 HD3 PRO 82 32.469 26.665 5.808 574 HA PRO 83 HA PRO 83 36.174 20.554 4.669 575 HB2 PRO 83 HB2 PRO 83 38.646 21.173 6.238 576 HB3 PRO 83 HB3 PRO 83 38.447 20.143 4.815 577 HG2 PRO 83 HG2 PRO 83 39.454 22.595 4.583 578 HG3 PRO 83 HG3 PRO 83 38.348 21.943 3.359 579 HD2 PRO 83 HD2 PRO 83 37.868 24.009 5.435 580 HD3 PRO 83 HD3 PRO 83 37.107 23.803 3.846 581 H GLN 84 H GLN 84 37.159 21.958 7.803 582 HA GLN 84 HA GLN 84 36.756 19.566 9.258 583 HB2 GLN 84 HB2 GLN 84 36.905 22.432 10.205 584 HB3 GLN 84 HB3 GLN 84 36.956 21.025 11.259 585 HG2 GLN 84 HG2 GLN 84 39.010 20.278 10.176 586 HG3 GLN 84 HG3 GLN 84 38.958 21.678 9.105 587 HE21 GLN 84 HE22 GLN 84 40.943 22.426 9.821 588 HE22 GLN 84 HE21 GLN 84 41.154 23.137 11.383 589 H SER 85 H SER 85 34.710 22.397 8.708 590 HA SER 85 HA SER 85 32.667 21.508 10.524 591 HB2 SER 85 HB2 SER 85 32.518 23.677 8.419 592 HB3 SER 85 HB3 SER 85 31.478 23.498 9.831 593 HG SER 85 HG SER 85 33.188 24.007 11.150 594 H TYR 86 H TYR 86 33.442 21.005 7.227 595 HA TYR 86 HA TYR 86 30.986 20.675 5.996 596 HB2 TYR 86 HB2 TYR 86 33.173 20.697 4.830 597 HB3 TYR 86 HB3 TYR 86 33.521 19.100 5.480 598 HD1 TYR 86 HD1 TYR 86 32.131 17.155 4.751 599 HD2 TYR 86 HD2 TYR 86 31.839 20.967 2.889 600 HE1 TYR 86 HE1 TYR 86 31.038 16.116 2.806 601 HE2 TYR 86 HE2 TYR 86 30.743 19.942 0.939 602 HH TYR 86 HH TYR 86 30.444 17.854 -0.132 603 H SER 87 H SER 87 32.903 18.288 7.781 604 HA SER 87 HA SER 87 31.353 16.040 7.257 605 HB2 SER 87 HB2 SER 87 32.862 16.631 9.813 606 HB3 SER 87 HB3 SER 87 32.432 15.040 9.188 607 HG SER 87 HG SER 87 34.595 16.498 8.652 608 H ALA 88 H ALA 88 31.002 18.515 9.735 609 HA ALA 88 HA ALA 88 28.967 17.166 11.206 610 HB1 ALA 88 HB1 ALA 88 28.661 19.298 12.358 611 HB2 ALA 88 HB2 ALA 88 29.660 20.103 11.148 612 HB3 ALA 88 HB3 ALA 88 30.373 18.897 12.218 613 H VAL 89 H VAL 89 29.023 19.467 8.581 614 HA VAL 89 HA VAL 89 26.243 20.060 8.554 615 HB VAL 89 HB VAL 89 28.346 20.291 6.391 616 HG11 VAL 89 HG11 VAL 89 26.105 20.157 5.408 617 HG12 VAL 89 HG12 VAL 89 26.791 21.770 5.226 618 HG13 VAL 89 HG13 VAL 89 25.568 21.467 6.458 619 HG21 VAL 89 HG21 VAL 89 28.328 22.672 6.962 620 HG22 VAL 89 HG22 VAL 89 28.772 21.678 8.350 621 HG23 VAL 89 HG23 VAL 89 27.149 22.358 8.236 622 H LEU 90 H LEU 90 28.292 17.872 6.653 623 HA LEU 90 HA LEU 90 26.281 16.922 4.958 624 HB2 LEU 90 HB2 LEU 90 28.940 16.728 5.015 625 HB3 LEU 90 HB3 LEU 90 28.554 15.162 5.699 626 HG LEU 90 HG LEU 90 28.957 15.117 3.261 627 HD11 LEU 90 HD11 LEU 90 26.148 14.391 4.066 628 HD12 LEU 90 HD12 LEU 90 27.585 13.397 4.308 629 HD13 LEU 90 HD13 LEU 90 27.025 13.753 2.674 630 HD21 LEU 90 HD21 LEU 90 27.339 16.049 1.725 631 HD22 LEU 90 HD22 LEU 90 27.998 17.327 2.747 632 HD23 LEU 90 HD23 LEU 90 26.390 16.682 3.069 633 H ASN 91 H ASN 91 27.558 15.613 8.016 634 HA ASN 91 HA ASN 91 26.038 13.261 8.070 635 HB2 ASN 91 HB2 ASN 91 27.144 14.953 10.314 636 HB3 ASN 91 HB3 ASN 91 26.295 13.439 10.603 637 HD21 ASN 91 HD22 ASN 91 29.028 14.125 11.228 638 HD22 ASN 91 HD21 ASN 91 30.021 12.988 10.389 639 H THR 92 H THR 92 25.283 16.516 9.203 640 HA THR 92 HA THR 92 22.818 15.938 10.411 641 HB THR 92 HB THR 92 23.696 18.503 9.065 642 HG1 THR 92 HG1 THR 92 25.122 18.136 10.699 643 HG21 THR 92 HG21 THR 92 22.059 19.588 10.542 644 HG22 THR 92 HG22 THR 92 21.544 18.006 11.129 645 HG23 THR 92 HG23 THR 92 21.281 18.448 9.441 646 H ILE 93 H ILE 93 23.572 17.090 7.124 647 HA ILE 93 HA ILE 93 20.983 17.150 6.099 648 HB ILE 93 HB ILE 93 23.520 16.453 4.617 649 HG12 ILE 93 HG12 ILE 93 23.689 18.608 5.763 650 HG13 ILE 93 HG13 ILE 93 23.575 18.843 4.020 651 HG21 ILE 93 HG21 ILE 93 22.329 17.251 2.618 652 HG22 ILE 93 HG22 ILE 93 20.864 17.437 3.584 653 HG23 ILE 93 HG23 ILE 93 21.558 15.835 3.335 654 HD11 ILE 93 HD11 ILE 93 21.188 19.379 4.285 655 HD12 ILE 93 HD12 ILE 93 22.239 20.481 5.174 656 HD13 ILE 93 HD13 ILE 93 21.365 19.210 6.031 657 H GLY 94 H GLY 94 23.338 14.484 6.058 658 HA2 GLY 94 HA2 GLY 94 21.737 12.689 4.594 659 HA3 GLY 94 HA3 GLY 94 23.092 12.246 5.613 660 H ALA 95 H ALA 95 22.086 13.149 8.059 661 HA ALA 95 HA ALA 95 20.591 10.876 8.828 662 HB1 ALA 95 HB1 ALA 95 21.074 13.399 10.409 663 HB2 ALA 95 HB2 ALA 95 22.172 12.023 10.329 664 HB3 ALA 95 HB3 ALA 95 20.576 11.835 11.053 665 H CYS 96 H CYS 96 19.727 14.310 8.509 666 HA CYS 96 HA CYS 96 17.039 13.968 9.328 667 HB2 CYS 96 HB2 CYS 96 18.274 16.142 7.632 668 HB3 CYS 96 HB3 CYS 96 16.675 16.212 8.361 669 H LEU 97 H LEU 97 18.618 13.954 6.161 670 HA LEU 97 HA LEU 97 16.347 13.988 4.544 671 HB2 LEU 97 HB2 LEU 97 18.871 14.116 3.945 672 HB3 LEU 97 HB3 LEU 97 18.795 12.369 3.880 673 HG LEU 97 HG LEU 97 18.630 13.543 1.665 674 HD11 LEU 97 HD11 LEU 97 17.881 11.252 1.903 675 HD12 LEU 97 HD12 LEU 97 16.840 12.138 0.786 676 HD13 LEU 97 HD13 LEU 97 16.293 11.809 2.432 677 HD21 LEU 97 HD21 LEU 97 17.235 15.415 2.435 678 HD22 LEU 97 HD22 LEU 97 15.880 14.304 2.629 679 HD23 LEU 97 HD23 LEU 97 16.561 14.595 1.028 680 H ARG 98 H ARG 98 17.973 11.292 6.153 681 HA ARG 98 HA ARG 98 16.520 9.194 4.970 682 HB2 ARG 98 HB2 ARG 98 17.747 9.393 7.722 683 HB3 ARG 98 HB3 ARG 98 17.105 7.910 7.036 684 HG2 ARG 98 HG2 ARG 98 18.762 8.065 5.218 685 HG3 ARG 98 HG3 ARG 98 19.434 9.505 5.993 686 HD2 ARG 98 HD2 ARG 98 19.913 8.210 7.997 687 HD3 ARG 98 HD3 ARG 98 19.227 6.774 7.244 688 HE ARG 98 HE ARG 98 21.754 8.080 6.500 689 HH11 ARG 98 HH11 ARG 98 19.522 5.400 6.176 690 HH12 ARG 98 HH12 ARG 98 20.706 4.336 5.484 691 HH21 ARG 98 HH21 ARG 98 23.329 6.667 5.597 692 HH22 ARG 98 HH22 ARG 98 22.857 5.048 5.161 693 H GLU 99 H GLU 99 15.988 10.750 8.134 694 HA GLU 99 HA GLU 99 13.613 9.324 8.657 695 HB2 GLU 99 HB2 GLU 99 13.257 10.986 10.468 696 HB3 GLU 99 HB3 GLU 99 14.833 10.214 10.502 697 HG2 GLU 99 HG2 GLU 99 15.618 12.280 10.777 698 HG3 GLU 99 HG3 GLU 99 15.332 12.465 9.046 699 H SER 100 H SER 100 14.203 12.498 7.264 700 HA SER 100 HA SER 100 11.589 13.427 7.170 701 HB2 SER 100 HB2 SER 100 13.855 13.869 5.216 702 HB3 SER 100 HB3 SER 100 12.361 14.806 5.234 703 HG SER 100 HG SER 100 13.698 14.603 7.663 704 H MET 101 H MET 101 13.332 11.353 4.899 705 HA MET 101 HA MET 101 11.401 11.247 2.872 706 HB2 MET 101 HB2 MET 101 13.722 9.576 3.674 707 HB3 MET 101 HB3 MET 101 12.554 8.853 2.579 708 HG2 MET 101 HG2 MET 101 13.884 11.501 2.078 709 HG3 MET 101 HG3 MET 101 14.508 9.963 1.483 710 HE1 MET 101 HE1 MET 101 11.803 8.388 0.755 711 HE2 MET 101 HE2 MET 101 13.256 8.425 -0.244 712 HE3 MET 101 HE3 MET 101 11.687 8.800 -0.956 713 H MET 102 H MET 102 11.818 9.246 5.759 714 HA MET 102 HA MET 102 9.709 7.478 4.897 715 HB2 MET 102 HB2 MET 102 10.206 6.166 6.853 716 HB3 MET 102 HB3 MET 102 11.699 6.606 6.061 717 HG2 MET 102 HG2 MET 102 12.181 6.876 8.301 718 HG3 MET 102 HG3 MET 102 11.815 8.516 7.771 719 HE1 MET 102 HE1 MET 102 8.935 5.903 8.167 720 HE2 MET 102 HE2 MET 102 8.693 5.901 9.913 721 HE3 MET 102 HE3 MET 102 10.201 5.286 9.227 722 H GLN 103 H GLN 103 10.034 10.219 6.956 723 HA GLN 103 HA GLN 103 7.514 9.843 8.291 724 HB2 GLN 103 HB2 GLN 103 9.624 11.906 8.231 725 HB3 GLN 103 HB3 GLN 103 8.001 12.483 8.585 726 HG2 GLN 103 HG2 GLN 103 7.835 11.247 10.532 727 HG3 GLN 103 HG3 GLN 103 9.109 10.130 10.051 728 HE21 GLN 103 HE22 GLN 103 10.982 12.079 9.237 729 HE22 GLN 103 HE21 GLN 103 11.564 12.887 10.654 730 H ALA 104 H ALA 104 8.287 10.603 5.178 731 HA ALA 104 HA ALA 104 6.164 12.468 4.666 732 HB1 ALA 104 HB1 ALA 104 7.764 10.805 2.724 733 HB2 ALA 104 HB2 ALA 104 8.199 12.422 3.280 734 HB3 ALA 104 HB3 ALA 104 6.737 12.183 2.324 735 H THR 105 H THR 105 6.674 9.423 2.999 736 HA THR 105 HA THR 105 4.541 7.896 3.627 737 HB THR 105 HB THR 105 3.006 9.731 3.229 738 HG1 THR 105 HG1 THR 105 1.671 8.702 1.695 739 HG21 THR 105 HG21 THR 105 2.811 10.620 0.858 740 HG22 THR 105 HG22 THR 105 4.400 9.884 0.581 741 HG23 THR 105 HG23 THR 105 4.213 11.147 1.795 742 H GLY 106 H GLY 106 5.924 6.385 2.940 743 HA2 GLY 106 HA2 GLY 106 5.965 5.059 0.685 744 HA3 GLY 106 HA3 GLY 106 6.917 6.459 0.183 745 H SER 107 H SER 107 7.690 6.553 3.114 746 HA SER 107 HA SER 107 9.146 5.736 4.625 747 HB2 SER 107 HB2 SER 107 9.785 3.468 4.750 748 HB3 SER 107 HB3 SER 107 8.170 3.448 4.054 749 HG SER 107 HG SER 107 9.370 3.410 1.957 750 H VAL 108 H VAL 108 11.488 5.160 4.833 751 HA VAL 108 HA VAL 108 12.903 6.866 3.028 752 HB VAL 108 HB VAL 108 13.496 7.077 5.307 753 HG11 VAL 108 HG11 VAL 108 14.060 4.120 5.302 754 HG12 VAL 108 HG12 VAL 108 12.790 4.967 6.192 755 HG13 VAL 108 HG13 VAL 108 14.486 5.220 6.614 756 HG21 VAL 108 HG21 VAL 108 15.915 6.611 5.287 757 HG22 VAL 108 HG22 VAL 108 15.343 7.367 3.800 758 HG23 VAL 108 HG23 VAL 108 15.691 5.639 3.834 759 H ASP 109 H ASP 109 12.939 5.943 1.086 760 HA ASP 109 HA ASP 109 13.696 3.325 0.448 761 HB2 ASP 109 HB2 ASP 109 12.547 4.700 -1.175 762 HB3 ASP 109 HB3 ASP 109 13.873 5.859 -1.196 763 H ASN 110 H ASN 110 15.631 2.488 -0.418 764 HA ASN 110 HA ASN 110 17.923 3.523 1.042 765 HB2 ASN 110 HB2 ASN 110 18.953 1.338 0.547 766 HB3 ASN 110 HB3 ASN 110 17.373 1.164 1.302 767 HD21 ASN 110 HD22 ASN 110 15.655 0.358 0.094 768 HD22 ASN 110 HD21 ASN 110 15.885 -0.437 -1.424 769 H ALA 111 H ALA 111 16.758 3.555 -2.168 770 HA ALA 111 HA ALA 111 19.445 3.790 -3.317 771 HB1 ALA 111 HB1 ALA 111 17.797 2.370 -4.467 772 HB2 ALA 111 HB2 ALA 111 18.346 3.707 -5.479 773 HB3 ALA 111 HB3 ALA 111 16.762 3.780 -4.703 774 H PHE 112 H PHE 112 16.398 5.622 -3.173 775 HA PHE 112 HA PHE 112 17.254 7.920 -4.502 776 HB2 PHE 112 HB2 PHE 112 14.913 7.539 -4.012 777 HB3 PHE 112 HB3 PHE 112 15.224 7.606 -2.280 778 HD1 PHE 112 HD2 PHE 112 15.156 9.610 -5.380 779 HD2 PHE 112 HD1 PHE 112 15.286 9.668 -1.126 780 HE1 PHE 112 HE2 PHE 112 14.723 12.031 -5.399 781 HE2 PHE 112 HE1 PHE 112 14.856 12.088 -1.143 782 HZ PHE 112 HZ PHE 112 14.576 13.270 -3.280 783 H THR 113 H THR 113 17.323 7.201 -1.023 784 HA THR 113 HA THR 113 18.437 9.623 -0.164 785 HB THR 113 HB THR 113 19.261 8.247 1.805 786 HG1 THR 113 HG1 THR 113 17.705 6.094 1.081 787 HG21 THR 113 HG21 THR 113 17.058 9.354 1.780 788 HG22 THR 113 HG22 THR 113 17.026 7.838 2.676 789 HG23 THR 113 HG23 THR 113 16.357 7.913 1.046 790 H ASN 114 H ASN 114 19.968 6.545 -0.981 791 HA ASN 114 HA ASN 114 22.639 7.241 -0.635 792 HB2 ASN 114 HB2 ASN 114 22.123 4.957 -0.940 793 HB3 ASN 114 HB3 ASN 114 21.222 5.271 -2.417 794 HD21 ASN 114 HD22 ASN 114 22.253 5.326 -4.326 795 HD22 ASN 114 HD21 ASN 114 23.925 4.957 -4.531 796 H GLU 115 H GLU 115 20.581 7.552 -3.519 797 HA GLU 115 HA GLU 115 22.569 8.438 -5.259 798 HB2 GLU 115 HB2 GLU 115 19.583 8.674 -5.202 799 HB3 GLU 115 HB3 GLU 115 20.528 9.389 -6.484 800 HG2 GLU 115 HG2 GLU 115 21.517 7.097 -6.860 801 HG3 GLU 115 HG3 GLU 115 20.258 6.496 -5.782 802 H VAL 116 H VAL 116 20.145 10.325 -3.413 803 HA VAL 116 HA VAL 116 21.108 12.805 -4.381 804 HB VAL 116 HB VAL 116 18.827 12.366 -3.329 805 HG11 VAL 116 HG11 VAL 116 20.391 12.795 -0.799 806 HG12 VAL 116 HG12 VAL 116 19.479 11.352 -1.251 807 HG13 VAL 116 HG13 VAL 116 18.635 12.869 -0.928 808 HG21 VAL 116 HG21 VAL 116 18.640 14.665 -2.476 809 HG22 VAL 116 HG22 VAL 116 19.507 14.571 -4.007 810 HG23 VAL 116 HG23 VAL 116 20.398 14.797 -2.500 811 H MET 117 H MET 117 21.888 10.891 -1.518 812 HA MET 117 HA MET 117 23.598 12.726 -0.258 813 HB2 MET 117 HB2 MET 117 23.406 9.743 -0.286 814 HB3 MET 117 HB3 MET 117 24.788 10.502 0.481 815 HG2 MET 117 HG2 MET 117 22.004 11.312 1.208 816 HG3 MET 117 HG3 MET 117 22.733 9.867 1.900 817 HE1 MET 117 HE1 MET 117 23.798 14.236 2.831 818 HE2 MET 117 HE2 MET 117 22.558 13.653 1.717 819 HE3 MET 117 HE3 MET 117 24.256 13.651 1.233 820 H GLN 118 H GLN 118 24.366 10.143 -2.567 821 HA GLN 118 HA GLN 118 27.079 10.653 -2.886 822 HB2 GLN 118 HB2 GLN 118 26.046 8.673 -3.809 823 HB3 GLN 118 HB3 GLN 118 25.034 9.641 -4.869 824 HG2 GLN 118 HG2 GLN 118 27.065 10.403 -6.050 825 HG3 GLN 118 HG3 GLN 118 28.022 9.330 -5.030 826 HE21 GLN 118 HE22 GLN 118 28.737 8.138 -6.783 827 HE22 GLN 118 HE21 GLN 118 27.706 7.044 -7.638 828 H LEU 119 H LEU 119 24.322 12.003 -4.646 829 HA LEU 119 HA LEU 119 25.862 13.528 -6.448 830 HB2 LEU 119 HB2 LEU 119 22.988 13.597 -5.611 831 HB3 LEU 119 HB3 LEU 119 23.634 14.754 -6.762 832 HG LEU 119 HG LEU 119 24.066 11.839 -7.265 833 HD11 LEU 119 HD11 LEU 119 21.934 11.739 -8.482 834 HD12 LEU 119 HD12 LEU 119 21.513 13.332 -7.861 835 HD13 LEU 119 HD13 LEU 119 21.690 11.975 -6.753 836 HD21 LEU 119 HD21 LEU 119 23.903 12.614 -9.599 837 HD22 LEU 119 HD22 LEU 119 25.168 13.441 -8.694 838 HD23 LEU 119 HD23 LEU 119 23.640 14.256 -9.014 839 H VAL 120 H VAL 120 24.183 14.495 -3.432 840 HA VAL 120 HA VAL 120 24.798 17.218 -3.536 841 HB VAL 120 HB VAL 120 24.474 15.413 -1.130 842 HG11 VAL 120 HG11 VAL 120 24.258 17.432 0.227 843 HG12 VAL 120 HG12 VAL 120 24.643 18.427 -1.176 844 HG13 VAL 120 HG13 VAL 120 25.857 17.337 -0.508 845 HG21 VAL 120 HG21 VAL 120 22.478 15.731 -2.523 846 HG22 VAL 120 HG22 VAL 120 22.641 17.478 -2.341 847 HG23 VAL 120 HG23 VAL 120 22.294 16.474 -0.934 848 H LYS 121 H LYS 121 26.672 14.524 -2.238 849 HA LYS 121 HA LYS 121 28.777 16.145 -1.209 850 HB2 LYS 121 HB2 LYS 121 28.742 13.194 -1.874 851 HB3 LYS 121 HB3 LYS 121 29.945 14.010 -0.884 852 HG2 LYS 121 HG2 LYS 121 28.337 14.493 0.808 853 HG3 LYS 121 HG3 LYS 121 27.014 13.933 -0.214 854 HD2 LYS 121 HD2 LYS 121 27.438 12.196 1.334 855 HD3 LYS 121 HD3 LYS 121 28.128 11.669 -0.200 856 HE2 LYS 121 HE2 LYS 121 30.345 12.387 0.544 857 HE3 LYS 121 HE3 LYS 121 29.660 12.919 2.079 858 HZ1 LYS 121 HZ1 LYS 121 28.990 10.615 2.498 859 HZ2 LYS 121 HZ2 LYS 121 30.667 10.761 2.319 860 HZ3 LYS 121 HZ3 LYS 121 29.731 10.133 1.057 861 H MET 122 H MET 122 28.388 14.208 -4.147 862 HA MET 122 HA MET 122 31.014 14.685 -5.100 863 HB2 MET 122 HB2 MET 122 29.895 12.732 -5.862 864 HB3 MET 122 HB3 MET 122 28.503 13.654 -6.404 865 HG2 MET 122 HG2 MET 122 31.078 14.308 -7.681 866 HG3 MET 122 HG3 MET 122 30.403 12.721 -8.039 867 HE1 MET 122 HE1 MET 122 27.280 13.171 -7.978 868 HE2 MET 122 HE2 MET 122 28.137 12.299 -9.250 869 HE3 MET 122 HE3 MET 122 26.982 13.562 -9.672 870 H LEU 123 H LEU 123 28.004 16.422 -5.437 871 HA LEU 123 HA LEU 123 29.042 18.103 -7.554 872 HB2 LEU 123 HB2 LEU 123 26.469 18.174 -5.986 873 HB3 LEU 123 HB3 LEU 123 26.875 19.343 -7.226 874 HG LEU 123 HG LEU 123 26.648 16.376 -7.730 875 HD11 LEU 123 HD11 LEU 123 24.641 18.564 -8.262 876 HD12 LEU 123 HD12 LEU 123 24.496 17.310 -7.032 877 HD13 LEU 123 HD13 LEU 123 24.488 16.874 -8.740 878 HD21 LEU 123 HD21 LEU 123 26.791 18.743 -9.596 879 HD22 LEU 123 HD22 LEU 123 26.550 17.065 -10.081 880 HD23 LEU 123 HD23 LEU 123 28.065 17.555 -9.324 881 H SER 124 H SER 124 29.679 18.023 -4.333 882 HA SER 124 HA SER 124 29.796 20.963 -4.165 883 HB2 SER 124 HB2 SER 124 29.863 20.610 -1.659 884 HB3 SER 124 HB3 SER 124 28.340 20.197 -2.445 885 HG SER 124 HG SER 124 28.668 18.124 -2.057 886 H ALA 125 H ALA 125 31.532 18.020 -3.129 887 HA ALA 125 HA ALA 125 34.073 19.108 -3.781 888 HB1 ALA 125 HB1 ALA 125 34.984 19.317 -1.531 889 HB2 ALA 125 HB2 ALA 125 33.401 18.956 -0.844 890 HB3 ALA 125 HB3 ALA 125 33.644 20.439 -1.767 891 H ASP 126 H ASP 126 35.422 17.475 -4.114 892 HA ASP 126 HA ASP 126 34.639 14.789 -3.636 893 HB2 ASP 126 HB2 ASP 126 36.041 15.474 -5.568 894 HB3 ASP 126 HB3 ASP 126 37.359 15.820 -4.455 895 H SER 127 H SER 127 35.955 17.055 -1.657 896 HA SER 127 HA SER 127 37.621 15.448 0.002 897 HB2 SER 127 HB2 SER 127 36.118 17.986 0.696 898 HB3 SER 127 HB3 SER 127 37.445 17.284 1.619 899 HG SER 127 HG SER 127 37.796 17.904 -1.101 900 H ALA 128 H ALA 128 34.376 15.337 -0.605 901 HA ALA 128 HA ALA 128 33.455 14.644 2.041 902 HB1 ALA 128 HB1 ALA 128 31.322 14.212 0.939 903 HB2 ALA 128 HB2 ALA 128 32.091 14.397 -0.639 904 HB3 ALA 128 HB3 ALA 128 31.975 15.778 0.455 905 H ASN 129 H ASN 129 35.646 13.087 1.021 906 HA ASN 129 HA ASN 129 34.889 10.574 0.020 907 HB2 ASN 129 HB2 ASN 129 37.220 11.386 0.045 908 HB3 ASN 129 HB3 ASN 129 37.235 11.283 1.801 909 HD21 ASN 129 HD22 ASN 129 37.333 9.521 -1.173 910 HD22 ASN 129 HD21 ASN 129 37.776 7.992 -0.494 911 H GLU 130 H GLU 130 34.739 11.963 3.153 912 HA GLU 130 HA GLU 130 34.687 9.686 4.775 913 HB2 GLU 130 HB2 GLU 130 34.936 11.998 5.615 914 HB3 GLU 130 HB3 GLU 130 33.257 12.318 5.197 915 HG2 GLU 130 HG2 GLU 130 33.487 11.873 7.567 916 HG3 GLU 130 HG3 GLU 130 32.536 10.606 6.786 917 H VAL 131 H VAL 131 33.176 8.224 5.242 918 HA VAL 131 HA VAL 131 30.430 8.751 4.367 919 HB VAL 131 HB VAL 131 31.300 7.210 2.745 920 HG11 VAL 131 HG11 VAL 131 32.188 5.006 3.342 921 HG12 VAL 131 HG12 VAL 131 32.101 5.440 5.049 922 HG13 VAL 131 HG13 VAL 131 33.190 6.314 3.971 923 HG21 VAL 131 HG21 VAL 131 29.757 5.336 3.016 924 HG22 VAL 131 HG22 VAL 131 28.999 6.864 3.471 925 HG23 VAL 131 HG23 VAL 131 29.551 5.747 4.719 926 H SER 132 H SER 132 29.999 9.432 6.429 927 HA SER 132 HA SER 132 29.728 7.285 8.423 928 HB2 SER 132 HB2 SER 132 31.525 8.906 9.037 929 HB3 SER 132 HB3 SER 132 30.345 10.210 8.964 930 HG SER 132 HG SER 132 29.167 8.985 10.609 931 H THR 133 H THR 133 27.977 8.354 6.315 932 HA THR 133 HA THR 133 25.959 9.889 7.743 933 HB THR 133 HB THR 133 24.879 10.014 5.473 934 HG1 THR 133 HG1 THR 133 25.881 8.101 4.625 935 HG21 THR 133 HG21 THR 133 27.750 10.930 5.658 936 HG22 THR 133 HG22 THR 133 26.341 11.803 6.265 937 HG23 THR 133 HG23 THR 133 26.547 11.553 4.530 Start of MODEL 7 1 HA2 GLY 1 HA2 GLY 1 15.033 -1.234 1.916 2 HA3 GLY 1 HA3 GLY 1 14.779 0.487 1.658 3 H SER 2 H SER 2 12.859 1.014 2.494 4 HA SER 2 HA SER 2 10.663 -0.861 2.444 5 HB2 SER 2 HB2 SER 2 9.508 1.271 3.491 6 HB3 SER 2 HB3 SER 2 10.643 0.312 4.439 7 HG SER 2 HG SER 2 11.872 1.998 4.556 8 H GLY 3 H GLY 3 8.696 -0.545 1.364 9 HA2 GLY 3 HA2 GLY 3 7.349 0.861 -0.146 10 HA3 GLY 3 HA3 GLY 3 8.861 1.335 -0.909 11 H ASN 4 H ASN 4 8.726 0.527 -2.927 12 HA ASN 4 HA ASN 4 9.110 -2.227 -3.350 13 HB2 ASN 4 HB2 ASN 4 6.693 -2.372 -2.869 14 HB3 ASN 4 HB3 ASN 4 6.368 -1.235 -4.172 15 HD21 ASN 4 HD22 ASN 4 7.405 -4.461 -3.378 16 HD22 ASN 4 HD21 ASN 4 7.184 -5.133 -4.956 17 H SER 5 H SER 5 7.123 -0.256 -5.494 18 HA SER 5 HA SER 5 9.490 0.331 -7.135 19 HB2 SER 5 HB2 SER 5 6.836 -0.645 -8.228 20 HB3 SER 5 HB3 SER 5 8.296 -0.300 -9.155 21 HG SER 5 HG SER 5 7.779 -2.425 -7.364 22 H GLN 6 H GLN 6 7.414 1.692 -5.286 23 HA GLN 6 HA GLN 6 6.881 3.940 -7.067 24 HB2 GLN 6 HB2 GLN 6 5.047 2.742 -4.993 25 HB3 GLN 6 HB3 GLN 6 4.802 4.345 -5.669 26 HG2 GLN 6 HG2 GLN 6 4.920 1.819 -7.298 27 HG3 GLN 6 HG3 GLN 6 3.431 2.566 -6.726 28 HE21 GLN 6 HE22 GLN 6 6.137 2.856 -8.910 29 HE22 GLN 6 HE21 GLN 6 5.439 4.084 -9.911 30 HA PRO 7 HA PRO 7 9.370 5.605 -3.702 31 HB2 PRO 7 HB2 PRO 7 10.408 7.657 -5.073 32 HB3 PRO 7 HB3 PRO 7 10.948 5.995 -5.346 33 HG2 PRO 7 HG2 PRO 7 9.015 7.640 -6.933 34 HG3 PRO 7 HG3 PRO 7 10.324 6.596 -7.510 35 HD2 PRO 7 HD2 PRO 7 7.700 5.831 -7.429 36 HD3 PRO 7 HD3 PRO 7 9.055 4.688 -7.308 37 H ILE 8 H ILE 8 9.788 8.175 -3.286 38 HA ILE 8 HA ILE 8 7.437 8.985 -1.976 39 HB ILE 8 HB ILE 8 9.654 9.486 -1.112 40 HG12 ILE 8 HG12 ILE 8 9.363 11.963 -0.673 41 HG13 ILE 8 HG13 ILE 8 7.972 11.907 -1.751 42 HG21 ILE 8 HG21 ILE 8 11.058 11.218 -2.115 43 HG22 ILE 8 HG22 ILE 8 9.936 11.335 -3.470 44 HG23 ILE 8 HG23 ILE 8 10.832 9.841 -3.192 45 HD11 ILE 8 HD11 ILE 8 6.892 10.298 -0.279 46 HD12 ILE 8 HD12 ILE 8 7.315 11.773 0.589 47 HD13 ILE 8 HD13 ILE 8 8.296 10.320 0.786 48 H TRP 9 H TRP 9 8.630 9.715 -5.149 49 HA TRP 9 HA TRP 9 7.287 12.248 -5.370 50 HB2 TRP 9 HB2 TRP 9 8.547 10.571 -7.545 51 HB3 TRP 9 HB3 TRP 9 8.084 12.264 -7.670 52 HD1 TRP 9 HD1 TRP 9 10.900 10.034 -6.611 53 HE1 TRP 9 HE1 TRP 9 12.867 11.451 -5.758 54 HE3 TRP 9 HE3 TRP 9 8.565 14.576 -6.305 55 HZ2 TRP 9 HZ2 TRP 9 13.368 14.136 -5.047 56 HZ3 TRP 9 HZ3 TRP 9 9.861 16.515 -5.523 57 HH2 TRP 9 HH2 TRP 9 12.213 16.301 -4.902 58 H THR 10 H THR 10 5.790 9.573 -4.962 59 HA THR 10 HA THR 10 4.043 9.601 -7.285 60 HB THR 10 HB THR 10 2.774 7.844 -5.921 61 HG1 THR 10 HG1 THR 10 5.145 7.476 -4.458 62 HG21 THR 10 HG21 THR 10 4.378 6.090 -6.495 63 HG22 THR 10 HG22 THR 10 5.647 7.300 -6.681 64 HG23 THR 10 HG23 THR 10 4.266 7.289 -7.782 65 H ASN 11 H ASN 11 4.383 11.359 -4.524 66 HA ASN 11 HA ASN 11 1.667 12.372 -4.768 67 HB2 ASN 11 HB2 ASN 11 1.625 10.765 -2.869 68 HB3 ASN 11 HB3 ASN 11 2.895 11.695 -2.086 69 HD21 ASN 11 HD22 ASN 11 -0.452 11.522 -2.859 70 HD22 ASN 11 HD21 ASN 11 -0.954 12.902 -1.946 71 HA PRO 12 HA PRO 12 4.182 16.022 -5.174 72 HB2 PRO 12 HB2 PRO 12 1.515 17.250 -4.666 73 HB3 PRO 12 HB3 PRO 12 2.683 17.595 -5.946 74 HG2 PRO 12 HG2 PRO 12 0.486 16.166 -6.441 75 HG3 PRO 12 HG3 PRO 12 2.032 15.770 -7.214 76 HD2 PRO 12 HD2 PRO 12 0.618 14.389 -4.990 77 HD3 PRO 12 HD3 PRO 12 1.650 13.719 -6.266 78 H ASN 13 H ASN 13 1.572 16.089 -2.747 79 HA ASN 13 HA ASN 13 2.765 18.081 -1.157 80 HB2 ASN 13 HB2 ASN 13 0.356 17.484 -1.061 81 HB3 ASN 13 HB3 ASN 13 0.787 15.962 -0.289 82 HD21 ASN 13 HD22 ASN 13 -0.298 16.369 1.587 83 HD22 ASN 13 HD21 ASN 13 0.186 17.579 2.723 84 H ALA 14 H ALA 14 2.931 14.571 -1.090 85 HA ALA 14 HA ALA 14 4.273 14.335 1.402 86 HB1 ALA 14 HB1 ALA 14 3.090 12.468 0.332 87 HB2 ALA 14 HB2 ALA 14 4.761 12.058 0.730 88 HB3 ALA 14 HB3 ALA 14 4.318 12.435 -0.936 89 H ALA 15 H ALA 15 5.393 14.501 -1.944 90 HA ALA 15 HA ALA 15 8.134 14.192 -1.464 91 HB1 ALA 15 HB1 ALA 15 7.127 14.099 -3.699 92 HB2 ALA 15 HB2 ALA 15 8.465 15.245 -3.633 93 HB3 ALA 15 HB3 ALA 15 6.801 15.830 -3.619 94 H MET 16 H MET 16 6.132 17.119 -1.642 95 HA MET 16 HA MET 16 8.196 18.939 -1.096 96 HB2 MET 16 HB2 MET 16 5.364 18.994 -1.469 97 HB3 MET 16 HB3 MET 16 5.776 19.970 -0.062 98 HG2 MET 16 HG2 MET 16 6.952 20.268 -2.814 99 HG3 MET 16 HG3 MET 16 5.672 21.261 -2.133 100 HE1 MET 16 HE1 MET 16 9.214 21.104 -2.982 101 HE2 MET 16 HE2 MET 16 9.490 20.149 -1.528 102 HE3 MET 16 HE3 MET 16 10.136 21.784 -1.644 103 H THR 17 H THR 17 6.199 16.979 0.992 104 HA THR 17 HA THR 17 6.624 18.272 3.431 105 HB THR 17 HB THR 17 6.297 15.308 2.919 106 HG1 THR 17 HG1 THR 17 4.589 16.912 2.260 107 HG21 THR 17 HG21 THR 17 6.011 16.912 5.465 108 HG22 THR 17 HG22 THR 17 7.178 15.624 5.147 109 HG23 THR 17 HG23 THR 17 5.457 15.251 5.268 110 H MET 18 H MET 18 8.502 15.606 1.945 111 HA MET 18 HA MET 18 10.340 15.541 4.109 112 HB2 MET 18 HB2 MET 18 11.700 14.042 2.674 113 HB3 MET 18 HB3 MET 18 10.037 13.528 2.872 114 HG2 MET 18 HG2 MET 18 10.484 13.121 0.651 115 HG3 MET 18 HG3 MET 18 9.617 14.652 0.617 116 HE1 MET 18 HE1 MET 18 11.440 13.329 -1.698 117 HE2 MET 18 HE2 MET 18 12.265 14.753 -2.335 118 HE3 MET 18 HE3 MET 18 10.547 14.830 -1.939 119 H THR 19 H THR 19 10.289 17.259 1.051 120 HA THR 19 HA THR 19 12.948 18.176 1.086 121 HB THR 19 HB THR 19 10.600 19.766 0.063 122 HG1 THR 19 HG1 THR 19 11.685 17.351 -0.834 123 HG21 THR 19 HG21 THR 19 13.443 19.512 -0.924 124 HG22 THR 19 HG22 THR 19 12.812 20.856 0.029 125 HG23 THR 19 HG23 THR 19 12.191 20.559 -1.595 126 H ASN 20 H ASN 20 9.952 19.568 2.425 127 HA ASN 20 HA ASN 20 11.207 21.852 3.549 128 HB2 ASN 20 HB2 ASN 20 8.542 20.534 3.930 129 HB3 ASN 20 HB3 ASN 20 9.056 21.804 5.035 130 HD21 ASN 20 HD22 ASN 20 8.049 21.043 1.818 131 HD22 ASN 20 HD21 ASN 20 7.858 22.675 1.275 132 H ASN 21 H ASN 21 10.527 18.616 4.742 133 HA ASN 21 HA ASN 21 11.219 19.039 7.431 134 HB2 ASN 21 HB2 ASN 21 11.231 16.623 5.660 135 HB3 ASN 21 HB3 ASN 21 11.879 16.531 7.288 136 HD21 ASN 21 HD22 ASN 21 9.636 15.154 6.148 137 HD22 ASN 21 HD21 ASN 21 8.251 15.592 7.090 138 H LEU 22 H LEU 22 13.161 18.334 4.581 139 HA LEU 22 HA LEU 22 15.615 17.891 5.873 140 HB2 LEU 22 HB2 LEU 22 15.289 17.399 3.503 141 HB3 LEU 22 HB3 LEU 22 15.053 19.103 3.162 142 HG LEU 22 HG LEU 22 17.405 19.526 3.873 143 HD11 LEU 22 HD11 LEU 22 17.701 17.594 5.333 144 HD12 LEU 22 HD12 LEU 22 18.930 17.619 4.067 145 HD13 LEU 22 HD13 LEU 22 17.561 16.513 3.947 146 HD21 LEU 22 HD21 LEU 22 16.832 19.272 1.521 147 HD22 LEU 22 HD22 LEU 22 17.027 17.525 1.648 148 HD23 LEU 22 HD23 LEU 22 18.421 18.584 1.853 149 H VAL 23 H VAL 23 14.052 20.818 4.690 150 HA VAL 23 HA VAL 23 16.075 22.641 5.385 151 HB VAL 23 HB VAL 23 13.094 23.131 5.254 152 HG11 VAL 23 HG11 VAL 23 13.703 25.459 4.809 153 HG12 VAL 23 HG12 VAL 23 15.405 25.057 5.037 154 HG13 VAL 23 HG13 VAL 23 14.279 24.929 6.389 155 HG21 VAL 23 HG21 VAL 23 13.503 23.851 2.950 156 HG22 VAL 23 HG22 VAL 23 13.937 22.157 3.186 157 HG23 VAL 23 HG23 VAL 23 15.198 23.387 3.106 158 H GLN 24 H GLN 24 13.150 21.612 7.155 159 HA GLN 24 HA GLN 24 13.645 23.330 9.361 160 HB2 GLN 24 HB2 GLN 24 11.857 22.111 10.510 161 HB3 GLN 24 HB3 GLN 24 11.394 22.526 8.869 162 HG2 GLN 24 HG2 GLN 24 10.709 20.430 8.742 163 HG3 GLN 24 HG3 GLN 24 12.415 20.045 8.528 164 HE21 GLN 24 HE22 GLN 24 10.243 18.449 9.632 165 HE22 GLN 24 HE21 GLN 24 10.741 18.011 11.230 166 H CYS 25 H CYS 25 14.461 19.962 8.718 167 HA CYS 25 HA CYS 25 15.466 19.380 11.296 168 HB2 CYS 25 HB2 CYS 25 14.920 17.598 9.725 169 HB3 CYS 25 HB3 CYS 25 16.154 18.171 8.609 170 H ALA 26 H ALA 26 17.004 20.589 8.329 171 HA ALA 26 HA ALA 26 19.623 20.652 9.433 172 HB1 ALA 26 HB1 ALA 26 20.247 21.884 7.458 173 HB2 ALA 26 HB2 ALA 26 18.556 22.242 7.102 174 HB3 ALA 26 HB3 ALA 26 19.146 20.583 7.007 175 H SER 27 H SER 27 16.922 22.851 9.493 176 HA SER 27 HA SER 27 18.436 25.122 10.362 177 HB2 SER 27 HB2 SER 27 16.158 25.183 9.215 178 HB3 SER 27 HB3 SER 27 15.473 24.682 10.763 179 HG SER 27 HG SER 27 17.204 26.806 10.959 180 H ARG 28 H ARG 28 16.959 22.383 11.876 181 HA ARG 28 HA ARG 28 17.302 23.570 14.536 182 HB2 ARG 28 HB2 ARG 28 15.861 21.069 13.658 183 HB3 ARG 28 HB3 ARG 28 15.969 21.625 15.319 184 HG2 ARG 28 HG2 ARG 28 14.720 23.244 13.117 185 HG3 ARG 28 HG3 ARG 28 13.816 22.109 14.114 186 HD2 ARG 28 HD2 ARG 28 13.461 24.146 15.159 187 HD3 ARG 28 HD3 ARG 28 14.755 23.428 16.108 188 HE ARG 28 HE ARG 28 16.296 24.901 14.863 189 HH11 ARG 28 HH11 ARG 28 12.892 25.733 15.040 190 HH12 ARG 28 HH12 ARG 28 13.162 27.419 14.731 191 HH21 ARG 28 HH21 ARG 28 16.644 27.134 14.503 192 HH22 ARG 28 HH22 ARG 28 15.287 28.215 14.451 193 H SER 29 H SER 29 19.291 22.206 12.551 194 HA SER 29 HA SER 29 20.131 19.826 13.842 195 HB2 SER 29 HB2 SER 29 22.104 19.994 12.359 196 HB3 SER 29 HB3 SER 29 20.592 20.210 11.479 197 HG SER 29 HG SER 29 21.121 22.209 11.031 198 H GLY 30 H GLY 30 21.766 22.964 13.542 199 HA2 GLY 30 HA2 GLY 30 22.648 24.122 15.478 200 HA3 GLY 30 HA3 GLY 30 22.913 22.550 16.226 201 H VAL 31 H VAL 31 23.684 22.017 13.150 202 HA VAL 31 HA VAL 31 26.526 22.475 13.670 203 HB VAL 31 HB VAL 31 25.643 20.184 13.039 204 HG11 VAL 31 HG11 VAL 31 25.422 21.447 10.322 205 HG12 VAL 31 HG12 VAL 31 24.110 20.765 11.287 206 HG13 VAL 31 HG13 VAL 31 25.375 19.713 10.648 207 HG21 VAL 31 HG21 VAL 31 27.577 19.680 11.601 208 HG22 VAL 31 HG22 VAL 31 27.994 20.687 12.989 209 HG23 VAL 31 HG23 VAL 31 27.836 21.411 11.388 210 H LEU 32 H LEU 32 23.952 23.328 11.484 211 HA LEU 32 HA LEU 32 25.706 24.730 9.657 212 HB2 LEU 32 HB2 LEU 32 22.695 24.879 9.837 213 HB3 LEU 32 HB3 LEU 32 23.695 25.394 8.495 214 HG LEU 32 HG LEU 32 23.239 22.559 9.392 215 HD11 LEU 32 HD11 LEU 32 22.136 22.351 7.201 216 HD12 LEU 32 HD12 LEU 32 22.343 24.087 6.958 217 HD13 LEU 32 HD13 LEU 32 21.322 23.496 8.271 218 HD21 LEU 32 HD21 LEU 32 24.490 21.919 7.396 219 HD22 LEU 32 HD22 LEU 32 25.500 22.821 8.530 220 HD23 LEU 32 HD23 LEU 32 24.866 23.613 7.086 221 H THR 33 H THR 33 24.870 27.062 9.119 222 HA THR 33 HA THR 33 24.500 28.479 11.678 223 HB THR 33 HB THR 33 26.625 29.085 10.657 224 HG1 THR 33 HG1 THR 33 26.330 31.127 11.122 225 HG21 THR 33 HG21 THR 33 25.026 29.970 8.265 226 HG22 THR 33 HG22 THR 33 26.086 28.563 8.324 227 HG23 THR 33 HG23 THR 33 26.759 30.185 8.491 228 H ALA 34 H ALA 34 23.273 30.562 11.434 229 HA ALA 34 HA ALA 34 20.705 30.012 10.464 230 HB1 ALA 34 HB1 ALA 34 21.099 31.624 12.245 231 HB2 ALA 34 HB2 ALA 34 20.209 32.370 10.919 232 HB3 ALA 34 HB3 ALA 34 21.930 32.691 11.114 233 H ASP 35 H ASP 35 23.450 31.573 9.015 234 HA ASP 35 HA ASP 35 22.211 32.790 6.803 235 HB2 ASP 35 HB2 ASP 35 24.518 33.274 7.502 236 HB3 ASP 35 HB3 ASP 35 25.002 31.640 7.066 237 H GLN 36 H GLN 36 23.621 29.584 7.229 238 HA GLN 36 HA GLN 36 23.252 28.718 4.565 239 HB2 GLN 36 HB2 GLN 36 23.775 27.255 7.141 240 HB3 GLN 36 HB3 GLN 36 23.617 26.423 5.599 241 HG2 GLN 36 HG2 GLN 36 25.532 27.534 4.720 242 HG3 GLN 36 HG3 GLN 36 25.614 28.609 6.117 243 HE21 GLN 36 HE22 GLN 36 27.572 26.728 4.992 244 HE22 GLN 36 HE21 GLN 36 27.989 25.651 6.276 245 H MET 37 H MET 37 21.265 28.715 7.400 246 HA MET 37 HA MET 37 19.399 26.749 6.552 247 HB2 MET 37 HB2 MET 37 19.085 29.010 8.537 248 HB3 MET 37 HB3 MET 37 17.971 27.664 8.354 249 HG2 MET 37 HG2 MET 37 19.674 26.120 9.045 250 HG3 MET 37 HG3 MET 37 20.860 27.423 9.122 251 HE1 MET 37 HE1 MET 37 21.650 27.257 11.415 252 HE2 MET 37 HE2 MET 37 20.782 25.732 11.594 253 HE3 MET 37 HE3 MET 37 20.662 26.968 12.847 254 H ASP 38 H ASP 38 19.812 30.137 5.869 255 HA ASP 38 HA ASP 38 17.171 30.610 4.937 256 HB2 ASP 38 HB2 ASP 38 19.781 32.060 4.772 257 HB3 ASP 38 HB3 ASP 38 18.455 32.554 3.736 258 H ASP 39 H ASP 39 20.210 29.648 3.393 259 HA ASP 39 HA ASP 39 19.276 29.808 0.727 260 HB2 ASP 39 HB2 ASP 39 21.486 28.157 1.954 261 HB3 ASP 39 HB3 ASP 39 21.152 28.190 0.226 262 H MET 40 H MET 40 18.958 27.398 3.203 263 HA MET 40 HA MET 40 18.198 25.190 1.664 264 HB2 MET 40 HB2 MET 40 17.283 25.993 4.430 265 HB3 MET 40 HB3 MET 40 17.044 24.404 3.716 266 HG2 MET 40 HG2 MET 40 19.725 25.673 4.213 267 HG3 MET 40 HG3 MET 40 18.946 24.516 5.289 268 HE1 MET 40 HE1 MET 40 17.624 22.438 3.342 269 HE2 MET 40 HE2 MET 40 18.589 21.992 4.751 270 HE3 MET 40 HE3 MET 40 18.920 21.252 3.186 271 H GLY 41 H GLY 41 16.448 28.043 2.633 272 HA2 GLY 41 HA2 GLY 41 13.828 27.116 2.099 273 HA3 GLY 41 HA3 GLY 41 14.332 28.797 2.180 274 H MET 42 H MET 42 16.081 29.035 0.102 275 HA MET 42 HA MET 42 14.324 29.173 -2.112 276 HB2 MET 42 HB2 MET 42 16.166 30.080 -3.361 277 HB3 MET 42 HB3 MET 42 16.196 30.763 -1.744 278 HG2 MET 42 HG2 MET 42 17.940 29.146 -1.125 279 HG3 MET 42 HG3 MET 42 17.940 28.550 -2.782 280 HE1 MET 42 HE1 MET 42 18.808 31.483 -0.375 281 HE2 MET 42 HE2 MET 42 17.648 32.283 -1.435 282 HE3 MET 42 HE3 MET 42 19.349 32.748 -1.477 283 H MET 43 H MET 43 16.638 26.819 -1.040 284 HA MET 43 HA MET 43 16.899 25.354 -3.439 285 HB2 MET 43 HB2 MET 43 18.392 25.040 -1.513 286 HB3 MET 43 HB3 MET 43 17.054 24.425 -0.559 287 HG2 MET 43 HG2 MET 43 17.894 23.074 -3.094 288 HG3 MET 43 HG3 MET 43 18.728 22.764 -1.577 289 HE1 MET 43 HE1 MET 43 16.242 22.992 0.494 290 HE2 MET 43 HE2 MET 43 17.520 21.779 0.584 291 HE3 MET 43 HE3 MET 43 15.828 21.282 0.624 292 H ALA 44 H ALA 44 14.757 24.920 -0.632 293 HA ALA 44 HA ALA 44 13.240 22.801 -1.670 294 HB1 ALA 44 HB1 ALA 44 11.602 23.356 0.046 295 HB2 ALA 44 HB2 ALA 44 12.383 24.915 0.307 296 HB3 ALA 44 HB3 ALA 44 13.238 23.424 0.701 297 H ASP 45 H ASP 45 12.915 26.277 -1.982 298 HA ASP 45 HA ASP 45 10.398 26.523 -3.108 299 HB2 ASP 45 HB2 ASP 45 11.732 28.456 -2.470 300 HB3 ASP 45 HB3 ASP 45 12.919 28.084 -3.714 301 H SER 46 H SER 46 13.486 25.924 -4.718 302 HA SER 46 HA SER 46 12.409 25.840 -7.340 303 HB2 SER 46 HB2 SER 46 14.741 26.364 -6.988 304 HB3 SER 46 HB3 SER 46 15.014 24.809 -6.207 305 HG SER 46 HG SER 46 15.632 24.323 -8.170 306 H VAL 47 H VAL 47 12.884 23.436 -4.840 307 HA VAL 47 HA VAL 47 12.752 21.136 -6.448 308 HB VAL 47 HB VAL 47 11.949 21.458 -3.555 309 HG11 VAL 47 HG11 VAL 47 12.484 18.969 -5.175 310 HG12 VAL 47 HG12 VAL 47 10.945 19.450 -4.459 311 HG13 VAL 47 HG13 VAL 47 12.301 19.008 -3.422 312 HG21 VAL 47 HG21 VAL 47 14.170 20.537 -3.086 313 HG22 VAL 47 HG22 VAL 47 14.277 22.048 -3.987 314 HG23 VAL 47 HG23 VAL 47 14.521 20.510 -4.813 315 H ASN 48 H ASN 48 10.134 22.826 -4.657 316 HA ASN 48 HA ASN 48 8.170 20.959 -5.437 317 HB2 ASN 48 HB2 ASN 48 6.509 22.725 -4.805 318 HB3 ASN 48 HB3 ASN 48 7.648 22.298 -3.545 319 HD21 ASN 48 HD22 ASN 48 8.988 23.817 -2.746 320 HD22 ASN 48 HD21 ASN 48 8.951 25.474 -3.219 321 H SER 49 H SER 49 9.279 23.970 -6.887 322 HA SER 49 HA SER 49 7.314 24.263 -8.838 323 HB2 SER 49 HB2 SER 49 9.052 25.952 -8.314 324 HB3 SER 49 HB3 SER 49 10.262 24.918 -9.071 325 HG SER 49 HG SER 49 8.709 26.710 -10.224 326 H GLN 50 H GLN 50 10.311 22.381 -8.877 327 HA GLN 50 HA GLN 50 9.961 21.439 -11.547 328 HB2 GLN 50 HB2 GLN 50 11.727 20.517 -9.287 329 HB3 GLN 50 HB3 GLN 50 11.788 19.840 -10.907 330 HG2 GLN 50 HG2 GLN 50 12.426 21.974 -11.824 331 HG3 GLN 50 HG3 GLN 50 12.248 22.737 -10.244 332 HE21 GLN 50 HE22 GLN 50 13.829 22.456 -8.705 333 HE22 GLN 50 HE21 GLN 50 15.370 21.752 -9.062 334 H MET 51 H MET 51 8.875 20.414 -8.438 335 HA MET 51 HA MET 51 8.241 17.726 -9.207 336 HB2 MET 51 HB2 MET 51 8.761 18.123 -6.911 337 HB3 MET 51 HB3 MET 51 7.568 19.406 -6.795 338 HG2 MET 51 HG2 MET 51 6.600 16.691 -7.488 339 HG3 MET 51 HG3 MET 51 7.145 16.975 -5.836 340 HE1 MET 51 HE1 MET 51 5.899 18.589 -4.094 341 HE2 MET 51 HE2 MET 51 4.768 19.831 -4.635 342 HE3 MET 51 HE3 MET 51 6.440 19.868 -5.183 343 H GLN 52 H GLN 52 6.443 20.768 -8.891 344 HA GLN 52 HA GLN 52 3.890 19.697 -9.429 345 HB2 GLN 52 HB2 GLN 52 4.956 22.464 -10.009 346 HB3 GLN 52 HB3 GLN 52 3.257 22.010 -9.907 347 HG2 GLN 52 HG2 GLN 52 3.361 21.652 -7.615 348 HG3 GLN 52 HG3 GLN 52 5.119 21.542 -7.620 349 HE21 GLN 52 HE22 GLN 52 3.478 23.145 -5.973 350 HE22 GLN 52 HE21 GLN 52 3.909 24.792 -6.257 351 H LYS 53 H LYS 53 6.488 20.832 -11.514 352 HA LYS 53 HA LYS 53 4.874 20.381 -13.881 353 HB2 LYS 53 HB2 LYS 53 6.684 21.332 -15.125 354 HB3 LYS 53 HB3 LYS 53 6.353 22.345 -13.733 355 HG2 LYS 53 HG2 LYS 53 8.291 21.518 -12.596 356 HG3 LYS 53 HG3 LYS 53 8.590 20.346 -13.887 357 HD2 LYS 53 HD2 LYS 53 8.991 22.103 -15.469 358 HD3 LYS 53 HD3 LYS 53 8.522 23.328 -14.295 359 HE2 LYS 53 HE2 LYS 53 10.449 22.737 -12.910 360 HE3 LYS 53 HE3 LYS 53 10.912 21.501 -14.078 361 HZ1 LYS 53 HZ1 LYS 53 11.268 23.209 -15.723 362 HZ2 LYS 53 HZ2 LYS 53 12.174 23.570 -14.339 363 HZ3 LYS 53 HZ3 LYS 53 10.744 24.409 -14.653 364 H MET 54 H MET 54 5.972 18.257 -11.950 365 HA MET 54 HA MET 54 7.533 16.574 -13.687 366 HB2 MET 54 HB2 MET 54 7.642 16.412 -11.206 367 HB3 MET 54 HB3 MET 54 5.980 15.841 -11.195 368 HG2 MET 54 HG2 MET 54 6.706 13.922 -12.596 369 HG3 MET 54 HG3 MET 54 8.364 14.468 -12.394 370 HE1 MET 54 HE1 MET 54 9.001 14.009 -8.604 371 HE2 MET 54 HE2 MET 54 8.489 15.483 -9.424 372 HE3 MET 54 HE3 MET 54 9.690 14.428 -10.173 373 H GLY 55 H GLY 55 4.146 16.879 -12.744 374 HA2 GLY 55 HA2 GLY 55 2.441 16.558 -14.416 375 HA3 GLY 55 HA3 GLY 55 3.445 15.310 -15.135 376 HA PRO 56 HA PRO 56 0.337 13.556 -11.874 377 HB2 PRO 56 HB2 PRO 56 -1.803 13.048 -13.475 378 HB3 PRO 56 HB3 PRO 56 -1.649 14.524 -12.514 379 HG2 PRO 56 HG2 PRO 56 -1.058 14.084 -15.419 380 HG3 PRO 56 HG3 PRO 56 -1.900 15.439 -14.643 381 HD2 PRO 56 HD2 PRO 56 0.679 15.608 -15.409 382 HD3 PRO 56 HD3 PRO 56 0.072 16.434 -13.960 383 H ASN 57 H ASN 57 0.612 11.422 -11.627 384 HA ASN 57 HA ASN 57 1.528 9.374 -12.020 385 HB2 ASN 57 HB2 ASN 57 -0.115 9.654 -14.549 386 HB3 ASN 57 HB3 ASN 57 0.644 8.154 -14.024 387 HD21 ASN 57 HD22 ASN 57 -1.952 10.361 -13.573 388 HD22 ASN 57 HD21 ASN 57 -2.837 9.416 -12.423 389 HA PRO 58 HA PRO 58 4.550 11.727 -14.579 390 HB2 PRO 58 HB2 PRO 58 6.646 11.585 -12.906 391 HB3 PRO 58 HB3 PRO 58 5.306 12.709 -12.658 392 HG2 PRO 58 HG2 PRO 58 5.775 10.037 -11.377 393 HG3 PRO 58 HG3 PRO 58 5.309 11.572 -10.616 394 HD2 PRO 58 HD2 PRO 58 3.519 9.646 -11.209 395 HD3 PRO 58 HD3 PRO 58 3.113 11.373 -11.273 396 HA PRO 59 HA PRO 59 6.756 8.369 -16.500 397 HB2 PRO 59 HB2 PRO 59 8.616 10.354 -17.560 398 HB3 PRO 59 HB3 PRO 59 7.447 9.353 -18.420 399 HG2 PRO 59 HG2 PRO 59 7.160 12.031 -18.134 400 HG3 PRO 59 HG3 PRO 59 5.786 10.919 -18.261 401 HD2 PRO 59 HD2 PRO 59 6.944 12.235 -15.841 402 HD3 PRO 59 HD3 PRO 59 5.248 11.918 -16.257 403 H GLN 60 H GLN 60 8.722 7.294 -16.394 404 HA GLN 60 HA GLN 60 9.955 7.153 -13.962 405 HB2 GLN 60 HB2 GLN 60 10.038 5.389 -15.632 406 HB3 GLN 60 HB3 GLN 60 11.056 6.380 -16.663 407 HG2 GLN 60 HG2 GLN 60 12.787 6.337 -14.870 408 HG3 GLN 60 HG3 GLN 60 11.776 5.179 -14.004 409 HE21 GLN 60 HE22 GLN 60 14.458 4.840 -15.097 410 HE22 GLN 60 HE21 GLN 60 14.364 3.522 -16.211 411 H HIS 61 H HIS 61 11.411 8.653 -16.866 412 HA HIS 61 HA HIS 61 13.810 9.363 -15.631 413 HB2 HIS 61 HB2 HIS 61 14.215 10.831 -17.546 414 HB3 HIS 61 HB3 HIS 61 13.592 9.270 -18.052 415 HD1 HIS 61 HD1 HIS 61 11.400 9.243 -19.348 416 HD2 HIS 61 HD2 HIS 61 12.400 13.010 -17.900 417 HE1 HIS 61 HE1 HIS 61 9.823 10.844 -20.474 418 H ARG 62 H ARG 62 10.735 10.923 -15.418 419 HA ARG 62 HA ARG 62 11.747 13.525 -14.814 420 HB2 ARG 62 HB2 ARG 62 9.045 12.257 -14.397 421 HB3 ARG 62 HB3 ARG 62 9.403 13.920 -13.956 422 HG2 ARG 62 HG2 ARG 62 9.668 12.784 -16.731 423 HG3 ARG 62 HG3 ARG 62 8.296 13.726 -16.146 424 HD2 ARG 62 HD2 ARG 62 11.150 14.688 -16.266 425 HD3 ARG 62 HD3 ARG 62 9.890 15.094 -17.426 426 HE ARG 62 HE ARG 62 8.711 16.187 -15.557 427 HH11 ARG 62 HH11 ARG 62 12.179 15.681 -15.332 428 HH12 ARG 62 HH12 ARG 62 12.414 16.962 -14.188 429 HH21 ARG 62 HH21 ARG 62 9.046 17.889 -14.061 430 HH22 ARG 62 HH22 ARG 62 10.642 18.202 -13.458 431 H LEU 63 H LEU 63 10.984 10.679 -12.933 432 HA LEU 63 HA LEU 63 11.318 12.050 -10.400 433 HB2 LEU 63 HB2 LEU 63 10.990 9.134 -11.115 434 HB3 LEU 63 HB3 LEU 63 11.232 9.693 -9.473 435 HG LEU 63 HG LEU 63 9.120 11.018 -9.676 436 HD11 LEU 63 HD11 LEU 63 8.781 9.462 -12.231 437 HD12 LEU 63 HD12 LEU 63 9.066 11.199 -12.114 438 HD13 LEU 63 HD13 LEU 63 7.583 10.504 -11.471 439 HD21 LEU 63 HD21 LEU 63 9.203 8.799 -8.617 440 HD22 LEU 63 HD22 LEU 63 8.829 8.060 -10.173 441 HD23 LEU 63 HD23 LEU 63 7.654 9.118 -9.395 442 H ARG 64 H ARG 64 13.120 9.950 -12.528 443 HA ARG 64 HA ARG 64 15.227 9.350 -10.739 444 HB2 ARG 64 HB2 ARG 64 14.582 8.027 -12.761 445 HB3 ARG 64 HB3 ARG 64 15.272 9.299 -13.759 446 HG2 ARG 64 HG2 ARG 64 17.464 8.860 -12.934 447 HG3 ARG 64 HG3 ARG 64 16.837 7.760 -11.702 448 HD2 ARG 64 HD2 ARG 64 16.036 6.252 -13.450 449 HD3 ARG 64 HD3 ARG 64 16.650 7.350 -14.682 450 HE ARG 64 HE ARG 64 18.838 6.718 -14.140 451 HH11 ARG 64 HH11 ARG 64 16.464 5.025 -12.195 452 HH12 ARG 64 HH12 ARG 64 17.576 3.803 -11.673 453 HH21 ARG 64 HH21 ARG 64 20.298 5.093 -13.468 454 HH22 ARG 64 HH22 ARG 64 19.759 3.849 -12.388 455 H ALA 65 H ALA 65 14.520 12.143 -12.587 456 HA ALA 65 HA ALA 65 17.293 13.059 -12.551 457 HB1 ALA 65 HB1 ALA 65 15.976 13.386 -14.598 458 HB2 ALA 65 HB2 ALA 65 16.513 14.916 -13.908 459 HB3 ALA 65 HB3 ALA 65 14.842 14.393 -13.696 460 H MET 66 H MET 66 14.633 13.149 -10.513 461 HA MET 66 HA MET 66 14.899 15.907 -9.685 462 HB2 MET 66 HB2 MET 66 13.175 13.634 -8.746 463 HB3 MET 66 HB3 MET 66 13.260 15.147 -7.855 464 HG2 MET 66 HG2 MET 66 12.406 14.823 -10.720 465 HG3 MET 66 HG3 MET 66 11.345 15.104 -9.341 466 HE1 MET 66 HE1 MET 66 12.264 18.732 -8.270 467 HE2 MET 66 HE2 MET 66 12.985 17.257 -7.635 468 HE3 MET 66 HE3 MET 66 11.254 17.320 -7.962 469 H ASN 67 H ASN 67 16.147 12.851 -8.730 470 HA ASN 67 HA ASN 67 16.918 13.543 -6.094 471 HB2 ASN 67 HB2 ASN 67 18.464 11.589 -6.289 472 HB3 ASN 67 HB3 ASN 67 16.795 11.217 -6.700 473 HD21 ASN 67 HD22 ASN 67 16.860 9.698 -8.187 474 HD22 ASN 67 HD21 ASN 67 17.809 9.732 -9.630 475 H THR 68 H THR 68 18.216 14.203 -9.210 476 HA THR 68 HA THR 68 20.767 15.102 -8.161 477 HB THR 68 HB THR 68 19.693 15.348 -10.980 478 HG1 THR 68 HG1 THR 68 20.093 13.125 -9.797 479 HG21 THR 68 HG21 THR 68 21.597 16.806 -10.501 480 HG22 THR 68 HG22 THR 68 22.069 15.504 -11.592 481 HG23 THR 68 HG23 THR 68 22.510 15.429 -9.887 482 H ALA 69 H ALA 69 17.766 16.407 -9.448 483 HA ALA 69 HA ALA 69 18.446 19.080 -9.727 484 HB1 ALA 69 HB1 ALA 69 16.332 18.073 -10.498 485 HB2 ALA 69 HB2 ALA 69 16.077 19.550 -9.571 486 HB3 ALA 69 HB3 ALA 69 15.788 17.982 -8.824 487 H MET 70 H MET 70 17.006 17.490 -6.875 488 HA MET 70 HA MET 70 17.066 19.822 -5.258 489 HB2 MET 70 HB2 MET 70 15.581 17.869 -4.851 490 HB3 MET 70 HB3 MET 70 16.985 16.928 -4.381 491 HG2 MET 70 HG2 MET 70 17.378 18.330 -2.486 492 HG3 MET 70 HG3 MET 70 16.121 19.455 -2.998 493 HE1 MET 70 HE1 MET 70 15.317 15.186 -1.435 494 HE2 MET 70 HE2 MET 70 16.922 15.913 -1.542 495 HE3 MET 70 HE3 MET 70 16.044 15.489 -3.011 496 H ALA 71 H ALA 71 19.201 17.049 -5.598 497 HA ALA 71 HA ALA 71 20.942 17.602 -3.476 498 HB1 ALA 71 HB1 ALA 71 20.833 15.446 -4.626 499 HB2 ALA 71 HB2 ALA 71 22.483 16.072 -4.568 500 HB3 ALA 71 HB3 ALA 71 21.549 16.179 -6.062 501 H ALA 72 H ALA 72 20.925 18.739 -6.808 502 HA ALA 72 HA ALA 72 23.526 19.824 -6.833 503 HB1 ALA 72 HB1 ALA 72 22.210 19.367 -8.862 504 HB2 ALA 72 HB2 ALA 72 22.830 21.019 -8.821 505 HB3 ALA 72 HB3 ALA 72 21.135 20.702 -8.444 506 H GLU 73 H GLU 73 20.437 21.132 -5.790 507 HA GLU 73 HA GLU 73 21.584 23.787 -5.511 508 HB2 GLU 73 HB2 GLU 73 18.782 22.778 -5.031 509 HB3 GLU 73 HB3 GLU 73 19.282 24.459 -4.894 510 HG2 GLU 73 HG2 GLU 73 19.976 24.401 -7.266 511 HG3 GLU 73 HG3 GLU 73 19.345 22.760 -7.375 512 H VAL 74 H VAL 74 20.757 21.063 -3.498 513 HA VAL 74 HA VAL 74 20.892 22.550 -1.040 514 HB VAL 74 HB VAL 74 19.779 20.224 -1.441 515 HG11 VAL 74 HG11 VAL 74 22.560 19.343 -0.767 516 HG12 VAL 74 HG12 VAL 74 21.751 19.122 -2.318 517 HG13 VAL 74 HG13 VAL 74 21.131 18.316 -0.876 518 HG21 VAL 74 HG21 VAL 74 21.409 20.800 1.027 519 HG22 VAL 74 HG22 VAL 74 20.097 19.624 0.928 520 HG23 VAL 74 HG23 VAL 74 19.761 21.342 0.703 521 H ALA 75 H ALA 75 23.110 21.236 -3.250 522 HA ALA 75 HA ALA 75 25.321 20.694 -1.609 523 HB1 ALA 75 HB1 ALA 75 25.158 19.890 -3.895 524 HB2 ALA 75 HB2 ALA 75 26.624 20.846 -3.687 525 HB3 ALA 75 HB3 ALA 75 25.227 21.544 -4.500 526 H GLU 76 H GLU 76 23.914 23.659 -2.598 527 HA GLU 76 HA GLU 76 26.131 25.341 -2.728 528 HB2 GLU 76 HB2 GLU 76 23.310 25.946 -1.844 529 HB3 GLU 76 HB3 GLU 76 24.526 27.171 -2.177 530 HG2 GLU 76 HG2 GLU 76 23.390 25.192 -4.138 531 HG3 GLU 76 HG3 GLU 76 23.057 26.922 -4.071 532 H VAL 77 H VAL 77 24.063 24.588 0.084 533 HA VAL 77 HA VAL 77 25.528 26.250 1.855 534 HB VAL 77 HB VAL 77 24.325 25.128 3.675 535 HG11 VAL 77 HG11 VAL 77 22.068 25.753 3.010 536 HG12 VAL 77 HG12 VAL 77 22.558 25.751 1.316 537 HG13 VAL 77 HG13 VAL 77 23.244 26.933 2.430 538 HG21 VAL 77 HG21 VAL 77 24.347 22.839 2.793 539 HG22 VAL 77 HG22 VAL 77 23.211 23.316 1.532 540 HG23 VAL 77 HG23 VAL 77 22.716 23.349 3.223 541 H VAL 78 H VAL 78 25.865 22.953 0.815 542 HA VAL 78 HA VAL 78 27.632 22.146 2.918 543 HB VAL 78 HB VAL 78 27.267 20.866 0.201 544 HG11 VAL 78 HG11 VAL 78 29.227 20.047 1.353 545 HG12 VAL 78 HG12 VAL 78 27.971 18.809 1.362 546 HG13 VAL 78 HG13 VAL 78 28.283 19.760 2.814 547 HG21 VAL 78 HG21 VAL 78 25.602 19.431 1.255 548 HG22 VAL 78 HG22 VAL 78 25.113 21.126 1.329 549 HG23 VAL 78 HG23 VAL 78 25.768 20.331 2.764 550 H ALA 79 H ALA 79 28.026 23.269 -0.415 551 HA ALA 79 HA ALA 79 30.844 22.950 -0.511 552 HB1 ALA 79 HB1 ALA 79 30.739 24.314 -2.522 553 HB2 ALA 79 HB2 ALA 79 29.087 24.792 -2.133 554 HB3 ALA 79 HB3 ALA 79 29.451 23.112 -2.523 555 H THR 80 H THR 80 28.813 25.308 0.932 556 HA THR 80 HA THR 80 30.997 27.253 1.109 557 HB THR 80 HB THR 80 28.169 27.657 2.092 558 HG1 THR 80 HG1 THR 80 27.806 27.276 -0.033 559 HG21 THR 80 HG21 THR 80 28.666 30.013 1.746 560 HG22 THR 80 HG22 THR 80 30.254 29.609 1.096 561 HG23 THR 80 HG23 THR 80 29.890 29.297 2.793 562 H SER 81 H SER 81 30.296 24.600 2.699 563 HA SER 81 HA SER 81 30.433 25.664 5.411 564 HB2 SER 81 HB2 SER 81 30.238 22.831 4.361 565 HB3 SER 81 HB3 SER 81 30.340 23.244 6.072 566 HG SER 81 HG SER 81 28.315 24.114 4.272 567 HA PRO 82 HA PRO 82 34.898 25.545 5.582 568 HB2 PRO 82 HB2 PRO 82 34.360 24.885 8.440 569 HB3 PRO 82 HB3 PRO 82 35.391 26.144 7.751 570 HG2 PRO 82 HG2 PRO 82 33.040 26.765 8.822 571 HG3 PRO 82 HG3 PRO 82 33.607 27.573 7.349 572 HD2 PRO 82 HD2 PRO 82 31.562 25.418 7.663 573 HD3 PRO 82 HD3 PRO 82 31.581 26.808 6.557 574 HA PRO 83 HA PRO 83 35.625 21.232 4.805 575 HB2 PRO 83 HB2 PRO 83 38.315 22.051 5.840 576 HB3 PRO 83 HB3 PRO 83 37.908 21.073 4.423 577 HG2 PRO 83 HG2 PRO 83 38.558 23.619 4.120 578 HG3 PRO 83 HG3 PRO 83 37.223 22.922 3.184 579 HD2 PRO 83 HD2 PRO 83 37.137 24.770 5.519 580 HD3 PRO 83 HD3 PRO 83 36.032 24.641 4.135 581 H GLN 84 H GLN 84 36.754 22.655 7.856 582 HA GLN 84 HA GLN 84 37.210 20.202 9.184 583 HB2 GLN 84 HB2 GLN 84 36.560 22.918 10.335 584 HB3 GLN 84 HB3 GLN 84 37.187 21.552 11.248 585 HG2 GLN 84 HG2 GLN 84 39.221 21.588 9.885 586 HG3 GLN 84 HG3 GLN 84 38.595 22.981 9.006 587 HE21 GLN 84 HE22 GLN 84 41.001 22.698 10.630 588 HE22 GLN 84 HE21 GLN 84 40.886 23.906 11.866 589 H SER 85 H SER 85 34.351 22.193 8.794 590 HA SER 85 HA SER 85 32.841 20.502 10.652 591 HB2 SER 85 HB2 SER 85 31.920 23.023 9.258 592 HB3 SER 85 HB3 SER 85 31.185 22.244 10.660 593 HG SER 85 HG SER 85 33.067 22.766 11.847 594 H TYR 86 H TYR 86 33.597 20.616 7.461 595 HA TYR 86 HA TYR 86 31.246 20.392 6.019 596 HB2 TYR 86 HB2 TYR 86 33.496 20.655 5.044 597 HB3 TYR 86 HB3 TYR 86 33.888 19.007 5.511 598 HD1 TYR 86 HD2 TYR 86 32.694 17.113 4.413 599 HD2 TYR 86 HD1 TYR 86 32.314 21.121 3.045 600 HE1 TYR 86 HE2 TYR 86 31.862 16.289 2.255 601 HE2 TYR 86 HE1 TYR 86 31.480 20.309 0.877 602 HH TYR 86 HH TYR 86 31.603 18.239 -0.490 603 H SER 87 H SER 87 33.176 17.787 7.489 604 HA SER 87 HA SER 87 31.613 15.644 6.617 605 HB2 SER 87 HB2 SER 87 33.191 15.795 9.193 606 HB3 SER 87 HB3 SER 87 32.779 14.342 8.277 607 HG SER 87 HG SER 87 34.822 14.843 7.668 608 H ALA 88 H ALA 88 31.325 17.695 9.463 609 HA ALA 88 HA ALA 88 29.319 16.162 10.768 610 HB1 ALA 88 HB1 ALA 88 30.725 17.781 11.956 611 HB2 ALA 88 HB2 ALA 88 29.009 18.118 12.182 612 HB3 ALA 88 HB3 ALA 88 29.959 19.094 11.063 613 H VAL 89 H VAL 89 29.293 18.784 8.457 614 HA VAL 89 HA VAL 89 26.516 19.270 8.461 615 HB VAL 89 HB VAL 89 28.605 19.707 6.321 616 HG11 VAL 89 HG11 VAL 89 25.761 20.715 6.405 617 HG12 VAL 89 HG12 VAL 89 26.402 19.521 5.278 618 HG13 VAL 89 HG13 VAL 89 26.985 21.185 5.226 619 HG21 VAL 89 HG21 VAL 89 28.991 21.024 8.292 620 HG22 VAL 89 HG22 VAL 89 27.304 21.531 8.341 621 HG23 VAL 89 HG23 VAL 89 28.353 22.080 7.032 622 H LEU 90 H LEU 90 28.553 17.152 6.446 623 HA LEU 90 HA LEU 90 26.548 16.185 4.777 624 HB2 LEU 90 HB2 LEU 90 29.256 15.350 5.585 625 HB3 LEU 90 HB3 LEU 90 28.237 14.099 4.930 626 HG LEU 90 HG LEU 90 29.080 16.641 3.559 627 HD11 LEU 90 HD11 LEU 90 29.638 13.739 2.963 628 HD12 LEU 90 HD12 LEU 90 30.778 14.893 3.652 629 HD13 LEU 90 HD13 LEU 90 30.184 15.117 2.009 630 HD21 LEU 90 HD21 LEU 90 26.828 16.229 2.882 631 HD22 LEU 90 HD22 LEU 90 27.145 14.508 2.673 632 HD23 LEU 90 HD23 LEU 90 27.885 15.682 1.584 633 H ASN 91 H ASN 91 27.746 14.931 7.877 634 HA ASN 91 HA ASN 91 26.133 12.642 7.999 635 HB2 ASN 91 HB2 ASN 91 27.456 14.347 10.081 636 HB3 ASN 91 HB3 ASN 91 26.340 13.078 10.577 637 HD21 ASN 91 HD22 ASN 91 29.436 13.789 9.174 638 HD22 ASN 91 HD21 ASN 91 30.050 12.172 9.235 639 H THR 92 H THR 92 25.520 15.959 8.995 640 HA THR 92 HA THR 92 23.004 15.497 10.188 641 HB THR 92 HB THR 92 24.053 18.035 8.922 642 HG1 THR 92 HG1 THR 92 25.434 17.286 10.575 643 HG21 THR 92 HG21 THR 92 21.640 18.104 9.318 644 HG22 THR 92 HG22 THR 92 22.493 19.166 10.438 645 HG23 THR 92 HG23 THR 92 21.895 17.602 10.988 646 H ILE 93 H ILE 93 23.864 16.754 6.951 647 HA ILE 93 HA ILE 93 21.331 16.949 5.853 648 HB ILE 93 HB ILE 93 23.850 16.052 4.443 649 HG12 ILE 93 HG12 ILE 93 24.115 18.223 5.545 650 HG13 ILE 93 HG13 ILE 93 24.079 18.410 3.796 651 HG21 ILE 93 HG21 ILE 93 21.300 17.190 3.302 652 HG22 ILE 93 HG22 ILE 93 21.869 15.528 3.133 653 HG23 ILE 93 HG23 ILE 93 22.773 16.849 2.394 654 HD11 ILE 93 HD11 ILE 93 22.811 20.169 4.809 655 HD12 ILE 93 HD12 ILE 93 21.851 19.009 5.724 656 HD13 ILE 93 HD13 ILE 93 21.703 19.083 3.969 657 H GLY 94 H GLY 94 23.471 14.123 5.930 658 HA2 GLY 94 HA2 GLY 94 21.837 12.352 4.510 659 HA3 GLY 94 HA3 GLY 94 23.056 11.880 5.678 660 H ALA 95 H ALA 95 22.048 12.906 7.981 661 HA ALA 95 HA ALA 95 20.186 10.952 8.757 662 HB1 ALA 95 HB1 ALA 95 21.783 12.084 10.282 663 HB2 ALA 95 HB2 ALA 95 20.127 12.060 10.887 664 HB3 ALA 95 HB3 ALA 95 20.787 13.536 10.186 665 H CYS 96 H CYS 96 19.798 14.414 8.112 666 HA CYS 96 HA CYS 96 17.060 14.570 8.716 667 HB2 CYS 96 HB2 CYS 96 18.760 16.259 6.876 668 HB3 CYS 96 HB3 CYS 96 17.118 16.668 7.363 669 H LEU 97 H LEU 97 18.729 13.986 5.629 670 HA LEU 97 HA LEU 97 16.418 13.979 4.010 671 HB2 LEU 97 HB2 LEU 97 19.049 13.899 3.507 672 HB3 LEU 97 HB3 LEU 97 18.700 12.193 3.328 673 HG LEU 97 HG LEU 97 18.705 13.356 1.175 674 HD11 LEU 97 HD11 LEU 97 15.980 12.386 2.000 675 HD12 LEU 97 HD12 LEU 97 17.305 11.411 1.366 676 HD13 LEU 97 HD13 LEU 97 16.525 12.611 0.338 677 HD21 LEU 97 HD21 LEU 97 17.980 15.553 1.966 678 HD22 LEU 97 HD22 LEU 97 16.360 14.911 2.248 679 HD23 LEU 97 HD23 LEU 97 17.007 14.984 0.609 680 H ARG 98 H ARG 98 18.093 11.425 5.775 681 HA ARG 98 HA ARG 98 16.609 9.241 4.852 682 HB2 ARG 98 HB2 ARG 98 18.511 8.584 5.952 683 HB3 ARG 98 HB3 ARG 98 18.342 9.807 7.200 684 HG2 ARG 98 HG2 ARG 98 16.260 7.750 7.258 685 HG3 ARG 98 HG3 ARG 98 17.893 7.143 7.541 686 HD2 ARG 98 HD2 ARG 98 18.213 8.621 9.371 687 HD3 ARG 98 HD3 ARG 98 16.760 9.531 8.974 688 HE ARG 98 HE ARG 98 16.063 6.861 9.506 689 HH11 ARG 98 HH11 ARG 98 17.270 9.698 11.152 690 HH12 ARG 98 HH12 ARG 98 16.486 9.323 12.648 691 HH21 ARG 98 HH21 ARG 98 15.008 6.362 11.465 692 HH22 ARG 98 HH22 ARG 98 15.177 7.426 12.828 693 H GLU 99 H GLU 99 16.037 11.273 7.752 694 HA GLU 99 HA GLU 99 13.794 9.638 8.472 695 HB2 GLU 99 HB2 GLU 99 13.430 11.311 10.259 696 HB3 GLU 99 HB3 GLU 99 15.031 10.595 10.257 697 HG2 GLU 99 HG2 GLU 99 15.931 12.603 9.221 698 HG3 GLU 99 HG3 GLU 99 14.316 13.316 9.192 699 H SER 100 H SER 100 14.194 12.800 6.986 700 HA SER 100 HA SER 100 11.571 13.705 7.118 701 HB2 SER 100 HB2 SER 100 12.151 15.018 5.046 702 HB3 SER 100 HB3 SER 100 13.292 15.195 6.380 703 HG SER 100 HG SER 100 14.743 14.023 5.319 704 H MET 101 H MET 101 13.089 11.567 4.767 705 HA MET 101 HA MET 101 11.117 11.360 2.851 706 HB2 MET 101 HB2 MET 101 13.184 9.463 3.893 707 HB3 MET 101 HB3 MET 101 12.003 8.891 2.723 708 HG2 MET 101 HG2 MET 101 13.687 11.328 2.243 709 HG3 MET 101 HG3 MET 101 14.228 9.700 1.825 710 HE1 MET 101 HE1 MET 101 11.576 8.270 0.842 711 HE2 MET 101 HE2 MET 101 13.131 8.187 0.013 712 HE3 MET 101 HE3 MET 101 11.673 8.601 -0.889 713 H MET 102 H MET 102 11.462 9.385 5.802 714 HA MET 102 HA MET 102 9.006 8.004 5.226 715 HB2 MET 102 HB2 MET 102 9.410 6.708 7.178 716 HB3 MET 102 HB3 MET 102 10.940 6.905 6.344 717 HG2 MET 102 HG2 MET 102 11.574 8.651 7.937 718 HG3 MET 102 HG3 MET 102 10.041 8.424 8.780 719 HE1 MET 102 HE1 MET 102 9.994 5.116 8.134 720 HE2 MET 102 HE2 MET 102 9.300 5.893 9.559 721 HE3 MET 102 HE3 MET 102 10.451 4.571 9.751 722 H GLN 103 H GLN 103 9.988 10.726 7.137 723 HA GLN 103 HA GLN 103 7.706 10.931 8.786 724 HB2 GLN 103 HB2 GLN 103 9.947 12.647 8.059 725 HB3 GLN 103 HB3 GLN 103 8.459 13.548 8.295 726 HG2 GLN 103 HG2 GLN 103 9.825 13.362 10.340 727 HG3 GLN 103 HG3 GLN 103 8.201 12.699 10.510 728 HE21 GLN 103 HE22 GLN 103 11.578 12.021 10.478 729 HE22 GLN 103 HE21 GLN 103 11.467 10.369 10.976 730 H ALA 104 H ALA 104 8.202 11.594 5.440 731 HA ALA 104 HA ALA 104 5.890 13.229 5.087 732 HB1 ALA 104 HB1 ALA 104 7.716 13.282 3.473 733 HB2 ALA 104 HB2 ALA 104 6.216 12.787 2.692 734 HB3 ALA 104 HB3 ALA 104 7.441 11.584 3.087 735 H THR 105 H THR 105 6.569 9.926 3.979 736 HA THR 105 HA THR 105 4.602 8.441 5.026 737 HB THR 105 HB THR 105 2.919 10.099 4.256 738 HG1 THR 105 HG1 THR 105 2.867 7.464 3.204 739 HG21 THR 105 HG21 THR 105 3.769 9.231 1.493 740 HG22 THR 105 HG22 THR 105 4.021 10.826 2.204 741 HG23 THR 105 HG23 THR 105 2.383 10.258 1.868 742 H GLY 106 H GLY 106 6.650 9.190 2.421 743 HA2 GLY 106 HA2 GLY 106 6.046 6.803 0.891 744 HA3 GLY 106 HA3 GLY 106 7.236 8.032 0.488 745 H SER 107 H SER 107 7.434 6.940 3.708 746 HA SER 107 HA SER 107 8.969 5.765 4.865 747 HB2 SER 107 HB2 SER 107 8.978 4.111 2.341 748 HB3 SER 107 HB3 SER 107 9.762 3.628 3.843 749 HG SER 107 HG SER 107 7.229 3.311 3.141 750 H VAL 108 H VAL 108 11.354 4.862 4.667 751 HA VAL 108 HA VAL 108 12.845 6.862 3.154 752 HB VAL 108 HB VAL 108 13.300 7.291 5.393 753 HG11 VAL 108 HG11 VAL 108 12.319 5.365 6.422 754 HG12 VAL 108 HG12 VAL 108 13.960 5.580 7.038 755 HG13 VAL 108 HG13 VAL 108 13.625 4.335 5.833 756 HG21 VAL 108 HG21 VAL 108 15.326 7.230 4.071 757 HG22 VAL 108 HG22 VAL 108 15.514 5.506 4.388 758 HG23 VAL 108 HG23 VAL 108 15.668 6.667 5.706 759 H ASP 109 H ASP 109 13.538 6.076 1.402 760 HA ASP 109 HA ASP 109 14.111 3.318 0.932 761 HB2 ASP 109 HB2 ASP 109 13.169 4.795 -0.798 762 HB3 ASP 109 HB3 ASP 109 14.632 5.773 -0.761 763 H ASN 110 H ASN 110 16.295 2.819 -0.256 764 HA ASN 110 HA ASN 110 18.493 4.153 1.186 765 HB2 ASN 110 HB2 ASN 110 18.116 1.207 0.666 766 HB3 ASN 110 HB3 ASN 110 19.683 1.900 1.068 767 HD21 ASN 110 HD22 ASN 110 18.598 3.874 2.896 768 HD22 ASN 110 HD21 ASN 110 18.118 3.012 4.311 769 H ALA 111 H ALA 111 17.151 3.902 -1.712 770 HA ALA 111 HA ALA 111 19.735 3.858 -3.135 771 HB1 ALA 111 HB1 ALA 111 18.449 3.494 -5.178 772 HB2 ALA 111 HB2 ALA 111 16.944 3.569 -4.261 773 HB3 ALA 111 HB3 ALA 111 18.083 2.251 -3.980 774 H PHE 112 H PHE 112 16.571 5.549 -3.293 775 HA PHE 112 HA PHE 112 17.499 7.833 -4.649 776 HB2 PHE 112 HB2 PHE 112 15.139 7.487 -4.490 777 HB3 PHE 112 HB3 PHE 112 15.198 7.422 -2.733 778 HD1 PHE 112 HD2 PHE 112 15.394 9.650 -5.660 779 HD2 PHE 112 HD1 PHE 112 15.137 9.414 -1.413 780 HE1 PHE 112 HE2 PHE 112 14.877 12.053 -5.557 781 HE2 PHE 112 HE1 PHE 112 14.618 11.819 -1.308 782 HZ PHE 112 HZ PHE 112 14.488 13.140 -3.382 783 H THR 113 H THR 113 17.075 7.271 -1.190 784 HA THR 113 HA THR 113 18.062 9.693 -0.234 785 HB THR 113 HB THR 113 18.613 7.210 1.303 786 HG1 THR 113 HG1 THR 113 16.500 6.632 1.412 787 HG21 THR 113 HG21 THR 113 18.702 9.535 2.255 788 HG22 THR 113 HG22 THR 113 17.598 8.441 3.092 789 HG23 THR 113 HG23 THR 113 16.963 9.642 1.968 790 H ASN 114 H ASN 114 19.652 6.846 -1.398 791 HA ASN 114 HA ASN 114 22.295 7.485 -0.456 792 HB2 ASN 114 HB2 ASN 114 21.720 5.175 -0.821 793 HB3 ASN 114 HB3 ASN 114 21.174 5.519 -2.459 794 HD21 ASN 114 HD22 ASN 114 22.631 5.680 -4.095 795 HD22 ASN 114 HD21 ASN 114 24.286 5.228 -3.923 796 H GLU 115 H GLU 115 20.581 7.647 -3.564 797 HA GLU 115 HA GLU 115 22.522 8.661 -5.207 798 HB2 GLU 115 HB2 GLU 115 19.593 9.359 -5.030 799 HB3 GLU 115 HB3 GLU 115 20.621 9.711 -6.395 800 HG2 GLU 115 HG2 GLU 115 19.913 6.983 -5.384 801 HG3 GLU 115 HG3 GLU 115 19.226 7.777 -6.799 802 H VAL 116 H VAL 116 20.180 10.458 -3.231 803 HA VAL 116 HA VAL 116 21.184 13.025 -3.659 804 HB VAL 116 HB VAL 116 19.873 11.950 -1.153 805 HG11 VAL 116 HG11 VAL 116 20.958 14.056 -0.688 806 HG12 VAL 116 HG12 VAL 116 19.212 14.300 -0.767 807 HG13 VAL 116 HG13 VAL 116 20.231 14.781 -2.123 808 HG21 VAL 116 HG21 VAL 116 17.806 12.858 -2.113 809 HG22 VAL 116 HG22 VAL 116 18.505 11.597 -3.130 810 HG23 VAL 116 HG23 VAL 116 18.688 13.294 -3.578 811 H MET 117 H MET 117 22.010 10.696 -1.094 812 HA MET 117 HA MET 117 23.940 12.447 0.090 813 HB2 MET 117 HB2 MET 117 23.232 9.563 0.571 814 HB3 MET 117 HB3 MET 117 24.499 10.386 1.462 815 HG2 MET 117 HG2 MET 117 21.551 10.823 1.525 816 HG3 MET 117 HG3 MET 117 22.674 10.586 2.861 817 HE1 MET 117 HE1 MET 117 24.506 14.106 2.916 818 HE2 MET 117 HE2 MET 117 25.010 12.723 1.941 819 HE3 MET 117 HE3 MET 117 24.471 12.481 3.605 820 H GLN 118 H GLN 118 24.176 11.076 -2.764 821 HA GLN 118 HA GLN 118 27.100 10.900 -2.448 822 HB2 GLN 118 HB2 GLN 118 26.022 8.816 -3.331 823 HB3 GLN 118 HB3 GLN 118 25.462 9.747 -4.714 824 HG2 GLN 118 HG2 GLN 118 27.468 8.475 -5.243 825 HG3 GLN 118 HG3 GLN 118 27.753 10.211 -5.361 826 HE21 GLN 118 HE22 GLN 118 28.412 7.314 -3.570 827 HE22 GLN 118 HE21 GLN 118 29.725 7.947 -2.640 828 H LEU 119 H LEU 119 24.439 12.042 -4.453 829 HA LEU 119 HA LEU 119 25.965 13.582 -6.235 830 HB2 LEU 119 HB2 LEU 119 23.087 13.701 -5.381 831 HB3 LEU 119 HB3 LEU 119 23.748 14.785 -6.593 832 HG LEU 119 HG LEU 119 24.063 11.826 -6.936 833 HD11 LEU 119 HD11 LEU 119 21.947 11.750 -8.147 834 HD12 LEU 119 HD12 LEU 119 21.622 13.423 -7.705 835 HD13 LEU 119 HD13 LEU 119 21.681 12.179 -6.459 836 HD21 LEU 119 HD21 LEU 119 23.757 14.133 -8.850 837 HD22 LEU 119 HD22 LEU 119 24.031 12.450 -9.295 838 HD23 LEU 119 HD23 LEU 119 25.270 13.342 -8.414 839 H VAL 120 H VAL 120 24.411 14.442 -3.142 840 HA VAL 120 HA VAL 120 24.880 17.200 -3.241 841 HB VAL 120 HB VAL 120 24.811 15.379 -0.823 842 HG11 VAL 120 HG11 VAL 120 24.337 17.417 0.476 843 HG12 VAL 120 HG12 VAL 120 24.636 18.392 -0.964 844 HG13 VAL 120 HG13 VAL 120 25.944 17.449 -0.248 845 HG21 VAL 120 HG21 VAL 120 22.679 17.155 -2.017 846 HG22 VAL 120 HG22 VAL 120 22.514 16.137 -0.586 847 HG23 VAL 120 HG23 VAL 120 22.755 15.400 -2.168 848 H LYS 121 H LYS 121 26.989 14.550 -2.346 849 HA LYS 121 HA LYS 121 29.134 16.152 -1.353 850 HB2 LYS 121 HB2 LYS 121 29.099 13.307 -2.385 851 HB3 LYS 121 HB3 LYS 121 30.442 14.055 -1.529 852 HG2 LYS 121 HG2 LYS 121 29.332 14.067 0.484 853 HG3 LYS 121 HG3 LYS 121 27.743 13.988 -0.270 854 HD2 LYS 121 HD2 LYS 121 28.181 11.884 0.775 855 HD3 LYS 121 HD3 LYS 121 28.255 11.658 -0.967 856 HE2 LYS 121 HE2 LYS 121 30.752 12.174 0.617 857 HE3 LYS 121 HE3 LYS 121 30.062 10.557 0.532 858 HZ1 LYS 121 HZ1 LYS 121 31.600 10.609 -1.181 859 HZ2 LYS 121 HZ2 LYS 121 31.224 12.190 -1.644 860 HZ3 LYS 121 HZ3 LYS 121 30.145 10.920 -1.991 861 H MET 122 H MET 122 28.460 14.515 -4.407 862 HA MET 122 HA MET 122 30.924 15.234 -5.628 863 HB2 MET 122 HB2 MET 122 29.811 13.236 -6.331 864 HB3 MET 122 HB3 MET 122 28.338 14.119 -6.705 865 HG2 MET 122 HG2 MET 122 29.398 15.193 -8.573 866 HG3 MET 122 HG3 MET 122 30.948 14.463 -8.156 867 HE1 MET 122 HE1 MET 122 27.317 11.923 -9.482 868 HE2 MET 122 HE2 MET 122 27.220 13.652 -9.153 869 HE3 MET 122 HE3 MET 122 27.519 12.519 -7.835 870 H LEU 123 H LEU 123 27.785 16.748 -5.494 871 HA LEU 123 HA LEU 123 28.433 18.513 -7.717 872 HB2 LEU 123 HB2 LEU 123 25.940 18.315 -6.028 873 HB3 LEU 123 HB3 LEU 123 26.134 19.360 -7.422 874 HG LEU 123 HG LEU 123 26.222 16.343 -7.487 875 HD11 LEU 123 HD11 LEU 123 24.085 18.259 -8.401 876 HD12 LEU 123 HD12 LEU 123 23.991 17.180 -7.009 877 HD13 LEU 123 HD13 LEU 123 24.079 16.511 -8.638 878 HD21 LEU 123 HD21 LEU 123 26.143 16.634 -9.928 879 HD22 LEU 123 HD22 LEU 123 27.611 17.308 -9.222 880 HD23 LEU 123 HD23 LEU 123 26.298 18.378 -9.713 881 H SER 124 H SER 124 29.458 18.512 -4.727 882 HA SER 124 HA SER 124 29.284 21.444 -4.507 883 HB2 SER 124 HB2 SER 124 29.709 21.091 -2.034 884 HB3 SER 124 HB3 SER 124 28.133 20.537 -2.592 885 HG SER 124 HG SER 124 28.669 18.538 -2.160 886 H ALA 125 H ALA 125 31.209 18.821 -3.143 887 HA ALA 125 HA ALA 125 33.550 19.199 -4.615 888 HB1 ALA 125 HB1 ALA 125 33.696 21.356 -3.496 889 HB2 ALA 125 HB2 ALA 125 34.998 20.284 -2.977 890 HB3 ALA 125 HB3 ALA 125 33.606 20.560 -1.928 891 H ASP 126 H ASP 126 33.722 17.033 -4.562 892 HA ASP 126 HA ASP 126 33.562 15.626 -2.028 893 HB2 ASP 126 HB2 ASP 126 32.491 14.762 -4.179 894 HB3 ASP 126 HB3 ASP 126 34.126 14.386 -4.722 895 H SER 127 H SER 127 35.497 17.038 -1.525 896 HA SER 127 HA SER 127 37.938 15.492 -2.103 897 HB2 SER 127 HB2 SER 127 37.764 18.435 -1.430 898 HB3 SER 127 HB3 SER 127 39.227 17.535 -1.834 899 HG SER 127 HG SER 127 37.418 17.143 -3.757 900 H ALA 128 H ALA 128 35.662 16.168 0.142 901 HA ALA 128 HA ALA 128 37.531 15.876 2.384 902 HB1 ALA 128 HB1 ALA 128 34.660 16.811 2.420 903 HB2 ALA 128 HB2 ALA 128 36.084 17.846 2.527 904 HB3 ALA 128 HB3 ALA 128 35.729 16.697 3.816 905 H ASN 129 H ASN 129 35.918 14.025 0.360 906 HA ASN 129 HA ASN 129 34.442 12.255 2.021 907 HB2 ASN 129 HB2 ASN 129 34.159 12.359 -0.446 908 HB3 ASN 129 HB3 ASN 129 35.781 11.705 -0.643 909 HD21 ASN 129 HD22 ASN 129 35.062 9.919 -1.750 910 HD22 ASN 129 HD21 ASN 129 34.209 8.625 -0.979 911 H GLU 130 H GLU 130 37.716 12.378 0.819 912 HA GLU 130 HA GLU 130 38.539 10.380 2.803 913 HB2 GLU 130 HB2 GLU 130 39.401 10.078 0.509 914 HB3 GLU 130 HB3 GLU 130 40.113 11.684 0.566 915 HG2 GLU 130 HG2 GLU 130 41.809 10.019 0.943 916 HG3 GLU 130 HG3 GLU 130 41.559 10.964 2.412 917 H VAL 131 H VAL 131 38.611 11.429 4.718 918 HA VAL 131 HA VAL 131 39.511 14.154 4.903 919 HB VAL 131 HB VAL 131 37.728 13.521 6.366 920 HG11 VAL 131 HG11 VAL 131 39.565 11.415 7.498 921 HG12 VAL 131 HG12 VAL 131 38.125 11.133 6.520 922 HG13 VAL 131 HG13 VAL 131 37.973 11.835 8.131 923 HG21 VAL 131 HG21 VAL 131 38.662 14.125 8.569 924 HG22 VAL 131 HG22 VAL 131 39.236 15.167 7.268 925 HG23 VAL 131 HG23 VAL 131 40.286 13.905 7.915 926 H SER 132 H SER 132 41.592 14.402 4.445 927 HA SER 132 HA SER 132 43.481 13.180 6.303 928 HB2 SER 132 HB2 SER 132 43.549 11.835 4.211 929 HB3 SER 132 HB3 SER 132 43.967 13.295 3.315 930 HG SER 132 HG SER 132 45.908 12.497 3.766 931 H THR 133 H THR 133 43.481 15.187 7.314 932 HA THR 133 HA THR 133 44.320 17.567 6.012 933 HB THR 133 HB THR 133 44.809 18.332 8.382 934 HG1 THR 133 HG1 THR 133 45.128 16.051 9.085 935 HG21 THR 133 HG21 THR 133 42.438 18.397 9.037 936 HG22 THR 133 HG22 THR 133 42.077 17.174 7.818 937 HG23 THR 133 HG23 THR 133 42.652 18.767 7.325 Start of MODEL 8 1 HA2 GLY 1 HA2 GLY 1 10.197 0.072 -2.636 2 HA3 GLY 1 HA3 GLY 1 8.972 -0.988 -1.956 3 H SER 2 H SER 2 6.694 -0.506 -2.757 4 HA SER 2 HA SER 2 5.164 -0.400 -4.419 5 HB2 SER 2 HB2 SER 2 7.008 1.665 -5.640 6 HB3 SER 2 HB3 SER 2 5.285 1.470 -5.959 7 HG SER 2 HG SER 2 6.074 3.125 -4.337 8 H GLY 3 H GLY 3 7.472 -2.253 -4.664 9 HA2 GLY 3 HA2 GLY 3 7.755 -4.017 -6.161 10 HA3 GLY 3 HA3 GLY 3 6.862 -3.102 -7.365 11 H ASN 4 H ASN 4 9.627 -1.870 -5.595 12 HA ASN 4 HA ASN 4 11.736 -1.270 -6.200 13 HB2 ASN 4 HB2 ASN 4 11.852 -3.695 -6.900 14 HB3 ASN 4 HB3 ASN 4 11.434 -3.184 -8.528 15 HD21 ASN 4 HD22 ASN 4 13.327 -3.840 -9.459 16 HD22 ASN 4 HD21 ASN 4 14.852 -3.090 -9.145 17 H SER 5 H SER 5 9.321 0.027 -7.249 18 HA SER 5 HA SER 5 10.564 1.737 -9.186 19 HB2 SER 5 HB2 SER 5 8.674 1.424 -10.859 20 HB3 SER 5 HB3 SER 5 9.831 0.096 -10.764 21 HG SER 5 HG SER 5 7.786 -0.236 -9.007 22 H GLN 6 H GLN 6 8.946 3.500 -9.842 23 HA GLN 6 HA GLN 6 7.653 5.226 -9.250 24 HB2 GLN 6 HB2 GLN 6 5.935 3.426 -9.462 25 HB3 GLN 6 HB3 GLN 6 6.056 3.175 -7.726 26 HG2 GLN 6 HG2 GLN 6 4.156 4.540 -8.214 27 HG3 GLN 6 HG3 GLN 6 5.371 5.486 -7.363 28 HE21 GLN 6 HE22 GLN 6 6.340 7.201 -8.373 29 HE22 GLN 6 HE21 GLN 6 5.824 7.807 -9.908 30 HA PRO 7 HA PRO 7 9.714 5.766 -5.195 31 HB2 PRO 7 HB2 PRO 7 10.579 8.328 -6.258 32 HB3 PRO 7 HB3 PRO 7 11.560 6.945 -5.771 33 HG2 PRO 7 HG2 PRO 7 11.305 7.751 -8.355 34 HG3 PRO 7 HG3 PRO 7 11.608 6.068 -7.888 35 HD2 PRO 7 HD2 PRO 7 9.029 7.383 -8.664 36 HD3 PRO 7 HD3 PRO 7 9.664 5.788 -9.127 37 H ILE 8 H ILE 8 9.932 8.287 -4.197 38 HA ILE 8 HA ILE 8 7.315 8.651 -3.171 39 HB ILE 8 HB ILE 8 9.349 8.930 -1.825 40 HG12 ILE 8 HG12 ILE 8 7.854 11.550 -1.925 41 HG13 ILE 8 HG13 ILE 8 7.173 10.079 -1.232 42 HG21 ILE 8 HG21 ILE 8 9.786 11.438 -3.438 43 HG22 ILE 8 HG22 ILE 8 10.768 9.975 -3.504 44 HG23 ILE 8 HG23 ILE 8 10.720 10.940 -2.028 45 HD11 ILE 8 HD11 ILE 8 9.681 11.451 -0.309 46 HD12 ILE 8 HD12 ILE 8 8.955 10.015 0.410 47 HD13 ILE 8 HD13 ILE 8 8.104 11.558 0.469 48 H TRP 9 H TRP 9 8.653 9.851 -5.994 49 HA TRP 9 HA TRP 9 7.343 12.428 -5.948 50 HB2 TRP 9 HB2 TRP 9 8.630 11.014 -8.295 51 HB3 TRP 9 HB3 TRP 9 8.195 12.715 -8.205 52 HD1 TRP 9 HD1 TRP 9 10.985 10.337 -7.448 53 HE1 TRP 9 HE1 TRP 9 12.957 11.601 -6.392 54 HE3 TRP 9 HE3 TRP 9 8.685 14.815 -6.527 55 HZ2 TRP 9 HZ2 TRP 9 13.476 14.158 -5.309 56 HZ3 TRP 9 HZ3 TRP 9 9.993 16.617 -5.477 57 HH2 TRP 9 HH2 TRP 9 12.338 16.296 -4.878 58 H THR 10 H THR 10 5.419 10.853 -5.350 59 HA THR 10 HA THR 10 3.951 10.131 -7.785 60 HB THR 10 HB THR 10 2.336 9.147 -5.998 61 HG1 THR 10 HG1 THR 10 3.082 9.795 -4.070 62 HG21 THR 10 HG21 THR 10 3.672 7.772 -7.503 63 HG22 THR 10 HG22 THR 10 3.647 7.073 -5.884 64 HG23 THR 10 HG23 THR 10 5.072 7.947 -6.446 65 H ASN 11 H ASN 11 3.653 11.934 -4.768 66 HA ASN 11 HA ASN 11 1.651 13.647 -6.005 67 HB2 ASN 11 HB2 ASN 11 0.329 13.618 -3.861 68 HB3 ASN 11 HB3 ASN 11 0.258 12.129 -4.790 69 HD21 ASN 11 HD22 ASN 11 -0.175 12.738 -1.925 70 HD22 ASN 11 HD21 ASN 11 0.863 11.647 -1.076 71 HA PRO 12 HA PRO 12 4.056 17.051 -4.724 72 HB2 PRO 12 HB2 PRO 12 1.416 18.070 -3.765 73 HB3 PRO 12 HB3 PRO 12 2.642 18.879 -4.747 74 HG2 PRO 12 HG2 PRO 12 0.425 17.831 -5.835 75 HG3 PRO 12 HG3 PRO 12 1.980 17.828 -6.681 76 HD2 PRO 12 HD2 PRO 12 0.501 15.581 -5.478 77 HD3 PRO 12 HD3 PRO 12 1.747 15.573 -6.737 78 H ASN 13 H ASN 13 1.435 16.392 -2.402 79 HA ASN 13 HA ASN 13 2.554 17.587 -0.181 80 HB2 ASN 13 HB2 ASN 13 0.269 16.877 -0.128 81 HB3 ASN 13 HB3 ASN 13 0.719 15.197 -0.380 82 HD21 ASN 13 HD22 ASN 13 0.550 17.810 1.910 83 HD22 ASN 13 HD21 ASN 13 0.794 16.847 3.327 84 H ALA 14 H ALA 14 3.023 14.286 -1.348 85 HA ALA 14 HA ALA 14 4.275 13.335 1.010 86 HB1 ALA 14 HB1 ALA 14 4.870 11.390 -0.347 87 HB2 ALA 14 HB2 ALA 14 4.370 12.257 -1.800 88 HB3 ALA 14 HB3 ALA 14 3.180 11.846 -0.565 89 H ALA 15 H ALA 15 5.584 14.245 -2.160 90 HA ALA 15 HA ALA 15 8.289 13.793 -1.476 91 HB1 ALA 15 HB1 ALA 15 7.171 15.556 -3.653 92 HB2 ALA 15 HB2 ALA 15 7.466 13.823 -3.793 93 HB3 ALA 15 HB3 ALA 15 8.818 14.931 -3.557 94 H MET 16 H MET 16 6.282 16.709 -1.515 95 HA MET 16 HA MET 16 8.360 18.510 -0.910 96 HB2 MET 16 HB2 MET 16 5.535 18.597 -1.315 97 HB3 MET 16 HB3 MET 16 5.918 19.495 0.149 98 HG2 MET 16 HG2 MET 16 7.170 19.942 -2.545 99 HG3 MET 16 HG3 MET 16 5.839 20.873 -1.875 100 HE1 MET 16 HE1 MET 16 10.270 21.441 -1.151 101 HE2 MET 16 HE2 MET 16 9.418 20.947 -2.614 102 HE3 MET 16 HE3 MET 16 9.613 19.812 -1.284 103 H THR 17 H THR 17 6.386 16.444 1.076 104 HA THR 17 HA THR 17 6.758 17.657 3.561 105 HB THR 17 HB THR 17 6.358 14.755 2.825 106 HG1 THR 17 HG1 THR 17 4.557 16.050 2.446 107 HG21 THR 17 HG21 THR 17 6.326 16.009 5.575 108 HG22 THR 17 HG22 THR 17 7.494 14.827 4.986 109 HG23 THR 17 HG23 THR 17 5.804 14.368 5.194 110 H MET 18 H MET 18 8.723 15.068 2.029 111 HA MET 18 HA MET 18 10.540 14.995 4.210 112 HB2 MET 18 HB2 MET 18 11.988 13.625 2.699 113 HB3 MET 18 HB3 MET 18 10.362 13.012 2.919 114 HG2 MET 18 HG2 MET 18 10.773 12.698 0.672 115 HG3 MET 18 HG3 MET 18 9.826 14.178 0.706 116 HE1 MET 18 HE1 MET 18 10.610 14.549 -1.829 117 HE2 MET 18 HE2 MET 18 11.623 13.108 -1.769 118 HE3 MET 18 HE3 MET 18 12.301 14.640 -2.322 119 H THR 19 H THR 19 10.511 16.747 1.167 120 HA THR 19 HA THR 19 13.138 17.729 1.257 121 HB THR 19 HB THR 19 10.673 19.056 0.128 122 HG1 THR 19 HG1 THR 19 11.850 16.784 -0.561 123 HG21 THR 19 HG21 THR 19 13.592 19.430 -0.539 124 HG22 THR 19 HG22 THR 19 12.553 20.593 0.292 125 HG23 THR 19 HG23 THR 19 12.238 20.173 -1.392 126 H ASN 20 H ASN 20 10.093 19.093 2.486 127 HA ASN 20 HA ASN 20 11.279 21.437 3.557 128 HB2 ASN 20 HB2 ASN 20 8.618 20.090 3.880 129 HB3 ASN 20 HB3 ASN 20 9.051 21.459 4.897 130 HD21 ASN 20 HD22 ASN 20 7.104 20.986 2.626 131 HD22 ASN 20 HD21 ASN 20 7.367 22.323 1.568 132 H ASN 21 H ASN 21 10.686 18.222 4.835 133 HA ASN 21 HA ASN 21 11.126 18.874 7.548 134 HB2 ASN 21 HB2 ASN 21 11.272 16.295 6.013 135 HB3 ASN 21 HB3 ASN 21 11.707 16.372 7.714 136 HD21 ASN 21 HD22 ASN 21 9.579 14.872 6.548 137 HD22 ASN 21 HD21 ASN 21 8.105 15.458 7.235 138 H LEU 22 H LEU 22 13.260 18.242 4.877 139 HA LEU 22 HA LEU 22 15.643 17.874 6.366 140 HB2 LEU 22 HB2 LEU 22 15.542 17.279 4.020 141 HB3 LEU 22 HB3 LEU 22 15.168 18.933 3.576 142 HG LEU 22 HG LEU 22 17.425 19.620 4.349 143 HD11 LEU 22 HD11 LEU 22 17.854 16.656 4.695 144 HD12 LEU 22 HD12 LEU 22 17.846 17.873 5.971 145 HD13 LEU 22 HD13 LEU 22 19.115 17.888 4.747 146 HD21 LEU 22 HD21 LEU 22 17.015 19.139 2.002 147 HD22 LEU 22 HD22 LEU 22 17.374 17.434 2.273 148 HD23 LEU 22 HD23 LEU 22 18.642 18.644 2.467 149 H VAL 23 H VAL 23 13.976 20.686 5.071 150 HA VAL 23 HA VAL 23 15.934 22.606 5.761 151 HB VAL 23 HB VAL 23 12.962 23.025 5.391 152 HG11 VAL 23 HG11 VAL 23 15.275 24.960 5.270 153 HG12 VAL 23 HG12 VAL 23 13.998 24.919 6.486 154 HG13 VAL 23 HG13 VAL 23 13.612 25.337 4.817 155 HG21 VAL 23 HG21 VAL 23 13.536 23.634 3.084 156 HG22 VAL 23 HG22 VAL 23 13.943 21.955 3.440 157 HG23 VAL 23 HG23 VAL 23 15.212 23.178 3.386 158 H GLN 24 H GLN 24 12.953 21.542 7.391 159 HA GLN 24 HA GLN 24 13.138 23.378 9.537 160 HB2 GLN 24 HB2 GLN 24 11.429 22.012 10.627 161 HB3 GLN 24 HB3 GLN 24 11.044 22.253 8.930 162 HG2 GLN 24 HG2 GLN 24 10.562 20.051 9.128 163 HG3 GLN 24 HG3 GLN 24 12.258 19.946 8.662 164 HE21 GLN 24 HE22 GLN 24 12.594 17.966 9.603 165 HE22 GLN 24 HE21 GLN 24 12.601 17.724 11.317 166 H CYS 25 H CYS 25 14.663 20.339 8.938 167 HA CYS 25 HA CYS 25 15.381 19.870 11.690 168 HB2 CYS 25 HB2 CYS 25 14.976 18.019 10.092 169 HB3 CYS 25 HB3 CYS 25 16.377 18.539 9.165 170 H ALA 26 H ALA 26 17.051 20.939 8.734 171 HA ALA 26 HA ALA 26 19.585 21.075 10.116 172 HB1 ALA 26 HB1 ALA 26 18.871 21.925 7.310 173 HB2 ALA 26 HB2 ALA 26 19.455 20.330 7.786 174 HB3 ALA 26 HB3 ALA 26 20.499 21.740 7.962 175 H SER 27 H SER 27 17.013 23.109 10.158 176 HA SER 27 HA SER 27 18.662 25.536 10.252 177 HB2 SER 27 HB2 SER 27 16.386 26.654 10.509 178 HB3 SER 27 HB3 SER 27 16.679 25.858 8.961 179 HG SER 27 HG SER 27 15.213 24.398 9.410 180 H ARG 28 H ARG 28 17.162 23.163 12.089 181 HA ARG 28 HA ARG 28 17.242 24.727 14.553 182 HB2 ARG 28 HB2 ARG 28 15.179 23.832 14.679 183 HB3 ARG 28 HB3 ARG 28 15.514 22.684 13.399 184 HG2 ARG 28 HG2 ARG 28 14.980 21.368 15.215 185 HG3 ARG 28 HG3 ARG 28 16.742 21.340 15.171 186 HD2 ARG 28 HD2 ARG 28 16.860 22.983 16.932 187 HD3 ARG 28 HD3 ARG 28 15.110 23.189 16.912 188 HE ARG 28 HE ARG 28 15.170 20.676 17.547 189 HH11 ARG 28 HH11 ARG 28 17.436 23.121 18.638 190 HH12 ARG 28 HH12 ARG 28 17.731 22.338 20.158 191 HH21 ARG 28 HH21 ARG 28 15.557 19.663 19.551 192 HH22 ARG 28 HH22 ARG 28 16.666 20.381 20.677 193 H SER 29 H SER 29 18.839 22.357 12.733 194 HA SER 29 HA SER 29 20.039 20.788 14.699 195 HB2 SER 29 HB2 SER 29 21.776 20.318 13.001 196 HB3 SER 29 HB3 SER 29 20.150 20.199 12.327 197 HG SER 29 HG SER 29 21.412 21.392 10.921 198 H GLY 30 H GLY 30 20.971 23.863 13.255 199 HA2 GLY 30 HA2 GLY 30 22.080 25.623 14.308 200 HA3 GLY 30 HA3 GLY 30 22.476 24.548 15.643 201 H VAL 31 H VAL 31 23.159 23.065 12.735 202 HA VAL 31 HA VAL 31 26.006 23.568 13.153 203 HB VAL 31 HB VAL 31 24.928 21.221 13.026 204 HG11 VAL 31 HG11 VAL 31 24.791 20.220 10.833 205 HG12 VAL 31 HG12 VAL 31 25.192 21.763 10.082 206 HG13 VAL 31 HG13 VAL 31 23.675 21.580 10.965 207 HG21 VAL 31 HG21 VAL 31 27.319 21.585 13.158 208 HG22 VAL 31 HG22 VAL 31 27.395 21.883 11.421 209 HG23 VAL 31 HG23 VAL 31 26.967 20.281 12.024 210 H LEU 32 H LEU 32 23.455 24.275 10.977 211 HA LEU 32 HA LEU 32 25.217 25.064 8.812 212 HB2 LEU 32 HB2 LEU 32 22.249 25.064 9.228 213 HB3 LEU 32 HB3 LEU 32 22.937 26.098 7.993 214 HG LEU 32 HG LEU 32 23.976 24.045 6.973 215 HD11 LEU 32 HD11 LEU 32 23.932 22.583 8.899 216 HD12 LEU 32 HD12 LEU 32 23.023 21.874 7.564 217 HD13 LEU 32 HD13 LEU 32 22.169 22.623 8.915 218 HD21 LEU 32 HD21 LEU 32 20.972 24.103 7.186 219 HD22 LEU 32 HD22 LEU 32 21.903 23.283 5.935 220 HD23 LEU 32 HD23 LEU 32 21.955 25.039 6.061 221 H THR 33 H THR 33 24.992 27.345 7.962 222 HA THR 33 HA THR 33 25.336 29.174 10.189 223 HB THR 33 HB THR 33 26.262 30.732 8.599 224 HG1 THR 33 HG1 THR 33 26.235 30.246 6.353 225 HG21 THR 33 HG21 THR 33 27.732 28.894 9.285 226 HG22 THR 33 HG22 THR 33 28.083 29.418 7.637 227 HG23 THR 33 HG23 THR 33 27.165 27.936 7.914 228 H ALA 34 H ALA 34 24.422 31.418 9.944 229 HA ALA 34 HA ALA 34 21.630 31.391 9.767 230 HB1 ALA 34 HB1 ALA 34 22.827 33.073 11.050 231 HB2 ALA 34 HB2 ALA 34 21.782 33.845 9.860 232 HB3 ALA 34 HB3 ALA 34 23.516 33.735 9.571 233 H ASP 35 H ASP 35 24.128 32.036 7.420 234 HA ASP 35 HA ASP 35 22.434 32.958 5.327 235 HB2 ASP 35 HB2 ASP 35 25.116 31.554 5.139 236 HB3 ASP 35 HB3 ASP 35 24.331 32.451 3.846 237 H GLN 36 H GLN 36 23.951 29.829 6.021 238 HA GLN 36 HA GLN 36 22.980 28.441 3.820 239 HB2 GLN 36 HB2 GLN 36 23.880 27.541 6.542 240 HB3 GLN 36 HB3 GLN 36 23.351 26.390 5.320 241 HG2 GLN 36 HG2 GLN 36 25.095 27.233 3.810 242 HG3 GLN 36 HG3 GLN 36 25.631 28.338 5.077 243 HE21 GLN 36 HE22 GLN 36 27.682 27.387 5.153 244 HE22 GLN 36 HE21 GLN 36 27.948 25.825 5.845 245 H MET 37 H MET 37 21.519 28.786 7.054 246 HA MET 37 HA MET 37 19.422 26.946 6.513 247 HB2 MET 37 HB2 MET 37 18.373 27.758 8.538 248 HB3 MET 37 HB3 MET 37 20.093 27.514 8.799 249 HG2 MET 37 HG2 MET 37 20.466 29.915 8.588 250 HG3 MET 37 HG3 MET 37 18.741 30.159 8.319 251 HE1 MET 37 HE1 MET 37 21.499 29.001 10.809 252 HE2 MET 37 HE2 MET 37 20.414 27.610 10.889 253 HE3 MET 37 HE3 MET 37 20.589 28.673 12.282 254 H ASP 38 H ASP 38 19.876 30.279 5.731 255 HA ASP 38 HA ASP 38 17.092 30.751 5.108 256 HB2 ASP 38 HB2 ASP 38 18.509 32.631 5.775 257 HB3 ASP 38 HB3 ASP 38 19.578 32.333 4.410 258 H ASP 39 H ASP 39 20.080 30.012 3.404 259 HA ASP 39 HA ASP 39 19.067 30.009 0.786 260 HB2 ASP 39 HB2 ASP 39 21.395 28.648 2.105 261 HB3 ASP 39 HB3 ASP 39 20.984 28.273 0.436 262 H MET 40 H MET 40 19.053 27.565 3.308 263 HA MET 40 HA MET 40 18.111 25.379 1.850 264 HB2 MET 40 HB2 MET 40 17.535 26.169 4.712 265 HB3 MET 40 HB3 MET 40 17.121 24.607 4.022 266 HG2 MET 40 HG2 MET 40 19.922 25.693 4.139 267 HG3 MET 40 HG3 MET 40 19.217 24.656 5.375 268 HE1 MET 40 HE1 MET 40 17.556 22.515 3.908 269 HE2 MET 40 HE2 MET 40 18.775 22.113 5.116 270 HE3 MET 40 HE3 MET 40 18.756 21.271 3.567 271 H GLY 41 H GLY 41 16.436 28.190 3.102 272 HA2 GLY 41 HA2 GLY 41 13.786 27.243 2.775 273 HA3 GLY 41 HA3 GLY 41 14.273 28.932 2.870 274 H MET 42 H MET 42 15.767 29.365 0.697 275 HA MET 42 HA MET 42 13.865 29.462 -1.404 276 HB2 MET 42 HB2 MET 42 15.577 30.526 -2.721 277 HB3 MET 42 HB3 MET 42 15.670 31.146 -1.080 278 HG2 MET 42 HG2 MET 42 17.533 29.621 -0.626 279 HG3 MET 42 HG3 MET 42 17.459 29.052 -2.288 280 HE1 MET 42 HE1 MET 42 17.075 32.741 -0.857 281 HE2 MET 42 HE2 MET 42 18.743 33.293 -1.000 282 HE3 MET 42 HE3 MET 42 18.339 31.988 0.113 283 H MET 43 H MET 43 16.375 27.243 -0.540 284 HA MET 43 HA MET 43 16.704 25.887 -2.979 285 HB2 MET 43 HB2 MET 43 18.230 25.598 -1.118 286 HB3 MET 43 HB3 MET 43 16.943 24.939 -0.122 287 HG2 MET 43 HG2 MET 43 16.781 23.118 -1.932 288 HG3 MET 43 HG3 MET 43 18.376 23.692 -2.417 289 HE1 MET 43 HE1 MET 43 16.750 23.474 1.173 290 HE2 MET 43 HE2 MET 43 17.347 21.897 1.692 291 HE3 MET 43 HE3 MET 43 16.224 22.012 0.335 292 H ALA 44 H ALA 44 14.555 25.280 -0.216 293 HA ALA 44 HA ALA 44 13.300 22.987 -1.253 294 HB1 ALA 44 HB1 ALA 44 11.565 23.387 0.414 295 HB2 ALA 44 HB2 ALA 44 12.186 25.014 0.686 296 HB3 ALA 44 HB3 ALA 44 13.169 23.613 1.105 297 H ASP 45 H ASP 45 12.567 26.416 -1.566 298 HA ASP 45 HA ASP 45 10.096 26.263 -2.849 299 HB2 ASP 45 HB2 ASP 45 11.045 28.378 -2.050 300 HB3 ASP 45 HB3 ASP 45 12.301 28.289 -3.282 301 H SER 46 H SER 46 13.350 26.306 -4.217 302 HA SER 46 HA SER 46 12.713 26.124 -6.914 303 HB2 SER 46 HB2 SER 46 14.984 26.554 -6.016 304 HB3 SER 46 HB3 SER 46 15.072 24.880 -5.474 305 HG SER 46 HG SER 46 16.082 24.925 -7.422 306 H VAL 47 H VAL 47 12.949 23.622 -4.440 307 HA VAL 47 HA VAL 47 12.834 21.412 -6.204 308 HB VAL 47 HB VAL 47 12.036 21.511 -3.289 309 HG11 VAL 47 HG11 VAL 47 11.163 19.533 -4.389 310 HG12 VAL 47 HG12 VAL 47 12.504 19.088 -3.332 311 HG13 VAL 47 HG13 VAL 47 12.750 19.182 -5.075 312 HG21 VAL 47 HG21 VAL 47 14.677 20.784 -4.557 313 HG22 VAL 47 HG22 VAL 47 14.296 20.717 -2.834 314 HG23 VAL 47 HG23 VAL 47 14.336 22.271 -3.671 315 H ASN 48 H ASN 48 10.258 22.954 -4.200 316 HA ASN 48 HA ASN 48 8.320 21.121 -5.162 317 HB2 ASN 48 HB2 ASN 48 6.624 22.617 -4.162 318 HB3 ASN 48 HB3 ASN 48 7.870 22.114 -3.041 319 HD21 ASN 48 HD22 ASN 48 8.921 23.608 -1.945 320 HD22 ASN 48 HD21 ASN 48 8.771 25.310 -2.181 321 H SER 49 H SER 49 9.348 24.307 -6.260 322 HA SER 49 HA SER 49 7.201 24.738 -8.023 323 HB2 SER 49 HB2 SER 49 8.885 26.476 -7.438 324 HB3 SER 49 HB3 SER 49 10.069 25.614 -8.422 325 HG SER 49 HG SER 49 9.103 27.259 -9.633 326 H GLN 50 H GLN 50 10.365 23.176 -8.561 327 HA GLN 50 HA GLN 50 9.903 22.469 -11.247 328 HB2 GLN 50 HB2 GLN 50 11.690 21.255 -9.138 329 HB3 GLN 50 HB3 GLN 50 11.681 20.722 -10.815 330 HG2 GLN 50 HG2 GLN 50 12.375 22.904 -11.562 331 HG3 GLN 50 HG3 GLN 50 12.261 23.536 -9.919 332 HE21 GLN 50 HE22 GLN 50 13.852 23.043 -8.440 333 HE22 GLN 50 HE21 GLN 50 15.365 22.342 -8.901 334 H MET 51 H MET 51 8.983 20.963 -8.235 335 HA MET 51 HA MET 51 8.113 18.504 -9.404 336 HB2 MET 51 HB2 MET 51 8.775 18.584 -7.071 337 HB3 MET 51 HB3 MET 51 7.520 19.763 -6.720 338 HG2 MET 51 HG2 MET 51 6.571 17.247 -7.898 339 HG3 MET 51 HG3 MET 51 7.300 17.102 -6.299 340 HE1 MET 51 HE1 MET 51 5.074 19.388 -4.092 341 HE2 MET 51 HE2 MET 51 6.580 19.841 -4.885 342 HE3 MET 51 HE3 MET 51 6.417 18.249 -4.146 343 H GLN 52 H GLN 52 6.636 21.620 -8.782 344 HA GLN 52 HA GLN 52 3.952 20.842 -9.288 345 HB2 GLN 52 HB2 GLN 52 5.342 23.508 -9.584 346 HB3 GLN 52 HB3 GLN 52 3.612 23.283 -9.792 347 HG2 GLN 52 HG2 GLN 52 3.365 22.621 -7.502 348 HG3 GLN 52 HG3 GLN 52 5.114 22.639 -7.269 349 HE21 GLN 52 HE22 GLN 52 4.992 24.137 -5.621 350 HE22 GLN 52 HE21 GLN 52 4.628 25.802 -5.906 351 H LYS 53 H LYS 53 6.578 22.037 -11.337 352 HA LYS 53 HA LYS 53 5.037 21.953 -13.745 353 HB2 LYS 53 HB2 LYS 53 7.973 22.256 -13.154 354 HB3 LYS 53 HB3 LYS 53 7.379 22.114 -14.801 355 HG2 LYS 53 HG2 LYS 53 7.732 24.429 -14.204 356 HG3 LYS 53 HG3 LYS 53 6.024 24.123 -14.490 357 HD2 LYS 53 HD2 LYS 53 5.619 24.048 -12.099 358 HD3 LYS 53 HD3 LYS 53 7.340 24.249 -11.779 359 HE2 LYS 53 HE2 LYS 53 7.274 26.454 -12.830 360 HE3 LYS 53 HE3 LYS 53 5.554 26.252 -13.157 361 HZ1 LYS 53 HZ1 LYS 53 5.874 27.570 -11.186 362 HZ2 LYS 53 HZ2 LYS 53 6.832 26.371 -10.476 363 HZ3 LYS 53 HZ3 LYS 53 5.184 26.087 -10.754 364 H MET 54 H MET 54 6.440 19.594 -11.823 365 HA MET 54 HA MET 54 7.018 17.641 -13.831 366 HB2 MET 54 HB2 MET 54 8.005 17.373 -11.651 367 HB3 MET 54 HB3 MET 54 6.430 17.433 -10.873 368 HG2 MET 54 HG2 MET 54 5.890 15.333 -12.214 369 HG3 MET 54 HG3 MET 54 7.621 15.234 -12.519 370 HE1 MET 54 HE1 MET 54 9.058 14.817 -8.903 371 HE2 MET 54 HE2 MET 54 8.829 16.338 -9.768 372 HE3 MET 54 HE3 MET 54 9.438 14.918 -10.620 373 H GLY 55 H GLY 55 4.321 18.123 -11.569 374 HA2 GLY 55 HA2 GLY 55 2.041 17.983 -12.149 375 HA3 GLY 55 HA3 GLY 55 2.486 17.078 -13.589 376 HA PRO 56 HA PRO 56 1.351 14.261 -9.810 377 HB2 PRO 56 HB2 PRO 56 -1.338 14.009 -10.236 378 HB3 PRO 56 HB3 PRO 56 -0.638 15.145 -9.077 379 HG2 PRO 56 HG2 PRO 56 -1.586 15.632 -11.873 380 HG3 PRO 56 HG3 PRO 56 -1.846 16.616 -10.418 381 HD2 PRO 56 HD2 PRO 56 0.010 17.267 -12.242 382 HD3 PRO 56 HD3 PRO 56 0.284 17.528 -10.507 383 H ASN 57 H ASN 57 1.734 12.249 -10.387 384 HA ASN 57 HA ASN 57 2.045 10.377 -11.628 385 HB2 ASN 57 HB2 ASN 57 -0.543 11.250 -12.936 386 HB3 ASN 57 HB3 ASN 57 0.209 9.672 -13.149 387 HD21 ASN 57 HD22 ASN 57 -2.399 10.470 -12.023 388 HD22 ASN 57 HD21 ASN 57 -2.451 9.777 -10.442 389 HA PRO 58 HA PRO 58 3.710 12.831 -15.154 390 HB2 PRO 58 HB2 PRO 58 6.180 13.266 -14.278 391 HB3 PRO 58 HB3 PRO 58 4.818 14.159 -13.595 392 HG2 PRO 58 HG2 PRO 58 6.381 11.915 -12.440 393 HG3 PRO 58 HG3 PRO 58 5.596 13.273 -11.623 394 HD2 PRO 58 HD2 PRO 58 4.589 10.631 -11.951 395 HD3 PRO 58 HD3 PRO 58 3.745 12.029 -11.254 396 HA PRO 59 HA PRO 59 5.977 9.625 -17.290 397 HB2 PRO 59 HB2 PRO 59 8.049 10.980 -18.464 398 HB3 PRO 59 HB3 PRO 59 6.395 10.978 -19.085 399 HG2 PRO 59 HG2 PRO 59 7.805 13.036 -17.446 400 HG3 PRO 59 HG3 PRO 59 6.676 13.256 -18.795 401 HD2 PRO 59 HD2 PRO 59 5.945 13.565 -16.210 402 HD3 PRO 59 HD3 PRO 59 4.825 12.972 -17.452 403 H GLN 60 H GLN 60 7.600 8.200 -16.927 404 HA GLN 60 HA GLN 60 8.737 8.113 -14.417 405 HB2 GLN 60 HB2 GLN 60 9.694 6.672 -16.894 406 HB3 GLN 60 HB3 GLN 60 10.057 6.215 -15.237 407 HG2 GLN 60 HG2 GLN 60 7.327 6.251 -16.499 408 HG3 GLN 60 HG3 GLN 60 8.306 4.821 -16.179 409 HE21 GLN 60 HE22 GLN 60 8.546 4.107 -14.058 410 HE22 GLN 60 HE21 GLN 60 7.504 4.640 -12.787 411 H HIS 61 H HIS 61 10.173 9.357 -17.391 412 HA HIS 61 HA HIS 61 12.828 9.433 -16.418 413 HB2 HIS 61 HB2 HIS 61 13.365 10.816 -18.331 414 HB3 HIS 61 HB3 HIS 61 12.298 9.512 -18.824 415 HD1 HIS 61 HD1 HIS 61 10.360 10.188 -20.213 416 HD2 HIS 61 HD2 HIS 61 11.923 13.377 -18.061 417 HE1 HIS 61 HE1 HIS 61 9.119 12.220 -21.022 418 H ARG 62 H ARG 62 10.129 11.566 -15.905 419 HA ARG 62 HA ARG 62 11.672 13.838 -15.113 420 HB2 ARG 62 HB2 ARG 62 8.810 13.017 -14.756 421 HB3 ARG 62 HB3 ARG 62 9.445 14.390 -13.861 422 HG2 ARG 62 HG2 ARG 62 9.613 14.158 -16.853 423 HG3 ARG 62 HG3 ARG 62 8.270 14.935 -16.011 424 HD2 ARG 62 HD2 ARG 62 9.788 16.536 -15.009 425 HD3 ARG 62 HD3 ARG 62 11.169 15.728 -15.746 426 HE ARG 62 HE ARG 62 10.244 16.409 -17.922 427 HH11 ARG 62 HH11 ARG 62 9.176 18.139 -15.062 428 HH12 ARG 62 HH12 ARG 62 8.814 19.594 -15.928 429 HH21 ARG 62 HH21 ARG 62 9.772 18.328 -19.048 430 HH22 ARG 62 HH22 ARG 62 9.150 19.703 -18.191 431 H LEU 63 H LEU 63 10.449 10.991 -13.526 432 HA LEU 63 HA LEU 63 10.915 11.722 -10.848 433 HB2 LEU 63 HB2 LEU 63 10.723 9.125 -12.327 434 HB3 LEU 63 HB3 LEU 63 11.232 9.126 -10.654 435 HG LEU 63 HG LEU 63 9.120 9.922 -9.906 436 HD11 LEU 63 HD11 LEU 63 8.446 10.408 -12.804 437 HD12 LEU 63 HD12 LEU 63 8.690 11.634 -11.558 438 HD13 LEU 63 HD13 LEU 63 7.313 10.537 -11.460 439 HD21 LEU 63 HD21 LEU 63 9.247 7.537 -10.596 440 HD22 LEU 63 HD22 LEU 63 8.543 7.993 -12.145 441 HD23 LEU 63 HD23 LEU 63 7.621 8.213 -10.658 442 H ARG 64 H ARG 64 12.948 10.255 -13.309 443 HA ARG 64 HA ARG 64 15.168 9.850 -11.529 444 HB2 ARG 64 HB2 ARG 64 14.722 8.329 -13.402 445 HB3 ARG 64 HB3 ARG 64 14.992 9.642 -14.538 446 HG2 ARG 64 HG2 ARG 64 17.302 9.788 -13.905 447 HG3 ARG 64 HG3 ARG 64 17.065 8.598 -12.624 448 HD2 ARG 64 HD2 ARG 64 16.553 6.893 -14.258 449 HD3 ARG 64 HD3 ARG 64 16.663 8.075 -15.564 450 HE ARG 64 HE ARG 64 18.984 8.078 -15.354 451 HH11 ARG 64 HH11 ARG 64 17.509 5.998 -12.956 452 HH12 ARG 64 HH12 ARG 64 18.989 5.210 -12.537 453 HH21 ARG 64 HH21 ARG 64 20.951 7.067 -14.770 454 HH22 ARG 64 HH22 ARG 64 20.949 5.819 -13.568 455 H ALA 65 H ALA 65 13.954 12.498 -13.198 456 HA ALA 65 HA ALA 65 16.541 13.752 -13.644 457 HB1 ALA 65 HB1 ALA 65 14.767 14.016 -15.317 458 HB2 ALA 65 HB2 ALA 65 15.278 15.568 -14.657 459 HB3 ALA 65 HB3 ALA 65 13.764 14.837 -14.122 460 H MET 66 H MET 66 14.420 13.419 -11.077 461 HA MET 66 HA MET 66 14.725 16.141 -10.102 462 HB2 MET 66 HB2 MET 66 13.228 13.774 -8.985 463 HB3 MET 66 HB3 MET 66 13.278 15.356 -8.219 464 HG2 MET 66 HG2 MET 66 12.150 14.707 -10.930 465 HG3 MET 66 HG3 MET 66 11.238 15.089 -9.471 466 HE1 MET 66 HE1 MET 66 12.877 17.496 -8.199 467 HE2 MET 66 HE2 MET 66 11.121 17.464 -8.362 468 HE3 MET 66 HE3 MET 66 12.033 18.866 -8.922 469 H ASN 67 H ASN 67 16.032 12.953 -9.437 470 HA ASN 67 HA ASN 67 17.009 13.544 -6.855 471 HB2 ASN 67 HB2 ASN 67 18.566 11.613 -7.209 472 HB3 ASN 67 HB3 ASN 67 16.870 11.238 -7.476 473 HD21 ASN 67 HD22 ASN 67 16.209 10.571 -9.453 474 HD22 ASN 67 HD21 ASN 67 17.281 10.289 -10.777 475 H THR 68 H THR 68 18.528 13.777 -10.053 476 HA THR 68 HA THR 68 21.046 14.655 -9.189 477 HB THR 68 HB THR 68 19.774 15.579 -11.759 478 HG1 THR 68 HG1 THR 68 20.781 12.984 -11.119 479 HG21 THR 68 HG21 THR 68 22.064 15.279 -12.620 480 HG22 THR 68 HG22 THR 68 22.592 14.768 -11.016 481 HG23 THR 68 HG23 THR 68 22.014 16.416 -11.272 482 H ALA 69 H ALA 69 18.151 16.460 -10.158 483 HA ALA 69 HA ALA 69 19.280 19.025 -10.008 484 HB1 ALA 69 HB1 ALA 69 16.391 18.225 -9.705 485 HB2 ALA 69 HB2 ALA 69 17.221 18.528 -11.229 486 HB3 ALA 69 HB3 ALA 69 16.986 19.842 -10.076 487 H MET 70 H MET 70 17.388 17.181 -7.614 488 HA MET 70 HA MET 70 17.266 19.327 -5.751 489 HB2 MET 70 HB2 MET 70 15.717 17.295 -5.899 490 HB3 MET 70 HB3 MET 70 16.976 16.405 -5.059 491 HG2 MET 70 HG2 MET 70 15.911 18.948 -3.908 492 HG3 MET 70 HG3 MET 70 15.016 17.444 -3.723 493 HE1 MET 70 HE1 MET 70 15.493 15.691 -1.959 494 HE2 MET 70 HE2 MET 70 17.115 15.318 -1.371 495 HE3 MET 70 HE3 MET 70 16.740 15.154 -3.086 496 H ALA 71 H ALA 71 19.356 16.498 -6.084 497 HA ALA 71 HA ALA 71 20.839 16.845 -3.722 498 HB1 ALA 71 HB1 ALA 71 21.699 15.592 -6.325 499 HB2 ALA 71 HB2 ALA 71 20.862 14.774 -5.007 500 HB3 ALA 71 HB3 ALA 71 22.498 15.388 -4.765 501 H ALA 72 H ALA 72 21.042 18.373 -6.855 502 HA ALA 72 HA ALA 72 23.639 19.516 -6.414 503 HB1 ALA 72 HB1 ALA 72 22.808 19.070 -8.677 504 HB2 ALA 72 HB2 ALA 72 23.218 20.771 -8.457 505 HB3 ALA 72 HB3 ALA 72 21.530 20.262 -8.437 506 H GLU 73 H GLU 73 20.378 20.376 -5.627 507 HA GLU 73 HA GLU 73 20.885 23.178 -5.265 508 HB2 GLU 73 HB2 GLU 73 18.594 21.476 -4.257 509 HB3 GLU 73 HB3 GLU 73 18.655 23.232 -4.217 510 HG2 GLU 73 HG2 GLU 73 18.737 21.579 -6.730 511 HG3 GLU 73 HG3 GLU 73 17.287 22.320 -6.058 512 H VAL 74 H VAL 74 20.541 20.373 -3.110 513 HA VAL 74 HA VAL 74 20.966 21.814 -0.709 514 HB VAL 74 HB VAL 74 21.388 19.630 0.343 515 HG11 VAL 74 HG11 VAL 74 19.211 18.623 -0.115 516 HG12 VAL 74 HG12 VAL 74 19.058 19.613 -1.565 517 HG13 VAL 74 HG13 VAL 74 19.089 20.376 0.024 518 HG21 VAL 74 HG21 VAL 74 21.169 18.525 -2.449 519 HG22 VAL 74 HG22 VAL 74 21.263 17.576 -0.966 520 HG23 VAL 74 HG23 VAL 74 22.630 18.571 -1.465 521 H ALA 75 H ALA 75 23.111 20.569 -3.098 522 HA ALA 75 HA ALA 75 25.458 20.261 -1.590 523 HB1 ALA 75 HB1 ALA 75 25.149 19.411 -3.883 524 HB2 ALA 75 HB2 ALA 75 26.639 20.335 -3.691 525 HB3 ALA 75 HB3 ALA 75 25.243 21.065 -4.486 526 H GLU 76 H GLU 76 23.878 23.102 -2.818 527 HA GLU 76 HA GLU 76 26.054 24.845 -2.987 528 HB2 GLU 76 HB2 GLU 76 23.151 25.393 -2.384 529 HB3 GLU 76 HB3 GLU 76 24.338 26.654 -2.691 530 HG2 GLU 76 HG2 GLU 76 23.721 24.444 -4.635 531 HG3 GLU 76 HG3 GLU 76 22.921 26.015 -4.650 532 H VAL 77 H VAL 77 23.929 24.136 -0.223 533 HA VAL 77 HA VAL 77 25.201 26.075 1.442 534 HB VAL 77 HB VAL 77 23.937 25.111 3.298 535 HG11 VAL 77 HG11 VAL 77 22.268 25.419 0.806 536 HG12 VAL 77 HG12 VAL 77 22.860 26.733 1.823 537 HG13 VAL 77 HG13 VAL 77 21.696 25.574 2.468 538 HG21 VAL 77 HG21 VAL 77 24.055 22.752 2.725 539 HG22 VAL 77 HG22 VAL 77 23.034 23.025 1.313 540 HG23 VAL 77 HG23 VAL 77 22.378 23.252 2.934 541 H VAL 78 H VAL 78 25.637 22.649 0.860 542 HA VAL 78 HA VAL 78 27.347 22.180 3.085 543 HB VAL 78 HB VAL 78 27.214 20.595 0.515 544 HG11 VAL 78 HG11 VAL 78 27.994 18.736 1.900 545 HG12 VAL 78 HG12 VAL 78 28.093 19.813 3.293 546 HG13 VAL 78 HG13 VAL 78 29.150 20.069 1.904 547 HG21 VAL 78 HG21 VAL 78 25.589 20.287 3.037 548 HG22 VAL 78 HG22 VAL 78 25.584 19.173 1.671 549 HG23 VAL 78 HG23 VAL 78 24.987 20.820 1.468 550 H ALA 79 H ALA 79 27.892 23.036 -0.301 551 HA ALA 79 HA ALA 79 30.732 22.871 -0.205 552 HB1 ALA 79 HB1 ALA 79 28.929 24.391 -2.087 553 HB2 ALA 79 HB2 ALA 79 29.532 22.748 -2.306 554 HB3 ALA 79 HB3 ALA 79 30.654 24.107 -2.331 555 H THR 80 H THR 80 28.651 24.993 1.273 556 HA THR 80 HA THR 80 30.417 27.305 1.129 557 HB THR 80 HB THR 80 27.800 26.925 2.612 558 HG1 THR 80 HG1 THR 80 27.474 26.862 0.368 559 HG21 THR 80 HG21 THR 80 29.365 29.442 2.014 560 HG22 THR 80 HG22 THR 80 29.130 28.717 3.603 561 HG23 THR 80 HG23 THR 80 27.753 29.388 2.728 562 H SER 81 H SER 81 30.253 24.484 2.849 563 HA SER 81 HA SER 81 30.986 25.623 5.431 564 HB2 SER 81 HB2 SER 81 30.440 22.760 4.615 565 HB3 SER 81 HB3 SER 81 30.707 23.326 6.268 566 HG SER 81 HG SER 81 28.481 23.594 4.628 567 HA PRO 82 HA PRO 82 35.369 24.914 4.701 568 HB2 PRO 82 HB2 PRO 82 35.485 25.031 7.657 569 HB3 PRO 82 HB3 PRO 82 36.343 26.007 6.460 570 HG2 PRO 82 HG2 PRO 82 34.343 27.035 7.905 571 HG3 PRO 82 HG3 PRO 82 34.586 27.487 6.208 572 HD2 PRO 82 HD2 PRO 82 32.592 25.599 7.399 573 HD3 PRO 82 HD3 PRO 82 32.387 26.781 6.090 574 HA PRO 83 HA PRO 83 36.107 20.631 5.056 575 HB2 PRO 83 HB2 PRO 83 38.499 21.335 6.712 576 HB3 PRO 83 HB3 PRO 83 38.365 20.210 5.353 577 HG2 PRO 83 HG2 PRO 83 39.400 22.621 4.986 578 HG3 PRO 83 HG3 PRO 83 38.309 21.919 3.778 579 HD2 PRO 83 HD2 PRO 83 37.810 24.089 5.750 580 HD3 PRO 83 HD3 PRO 83 37.117 23.846 4.133 581 H GLN 84 H GLN 84 36.926 22.189 8.178 582 HA GLN 84 HA GLN 84 36.505 19.873 9.720 583 HB2 GLN 84 HB2 GLN 84 36.487 21.417 11.659 584 HB3 GLN 84 HB3 GLN 84 37.851 21.661 10.581 585 HG2 GLN 84 HG2 GLN 84 36.661 23.571 9.568 586 HG3 GLN 84 HG3 GLN 84 35.369 23.352 10.748 587 HE21 GLN 84 HE22 GLN 84 35.676 25.366 11.664 588 HE22 GLN 84 HE21 GLN 84 37.055 25.749 12.635 589 H SER 85 H SER 85 34.313 22.442 8.743 590 HA SER 85 HA SER 85 32.203 21.429 10.475 591 HB2 SER 85 HB2 SER 85 32.032 23.684 8.469 592 HB3 SER 85 HB3 SER 85 30.988 23.400 9.864 593 HG SER 85 HG SER 85 33.044 23.656 11.115 594 H TYR 86 H TYR 86 33.396 20.925 7.396 595 HA TYR 86 HA TYR 86 31.164 20.775 5.756 596 HB2 TYR 86 HB2 TYR 86 33.551 20.745 5.036 597 HB3 TYR 86 HB3 TYR 86 33.657 19.078 5.586 598 HD1 TYR 86 HD1 TYR 86 32.544 17.291 4.355 599 HD2 TYR 86 HD2 TYR 86 32.381 21.320 3.010 600 HE1 TYR 86 HE1 TYR 86 31.794 16.517 2.146 601 HE2 TYR 86 HE2 TYR 86 31.626 20.562 0.802 602 HH TYR 86 HH TYR 86 31.715 18.567 -0.580 603 H SER 87 H SER 87 32.811 18.062 7.416 604 HA SER 87 HA SER 87 30.884 16.158 6.621 605 HB2 SER 87 HB2 SER 87 32.930 16.103 8.841 606 HB3 SER 87 HB3 SER 87 31.923 14.719 8.408 607 HG SER 87 HG SER 87 34.142 15.728 7.165 608 H ALA 88 H ALA 88 31.000 18.388 9.274 609 HA ALA 88 HA ALA 88 29.101 17.082 10.942 610 HB1 ALA 88 HB1 ALA 88 29.831 20.008 10.783 611 HB2 ALA 88 HB2 ALA 88 30.604 18.799 11.812 612 HB3 ALA 88 HB3 ALA 88 28.917 19.242 12.084 613 H VAL 89 H VAL 89 28.897 19.556 8.442 614 HA VAL 89 HA VAL 89 26.059 19.845 8.569 615 HB VAL 89 HB VAL 89 28.031 20.544 6.383 616 HG11 VAL 89 HG11 VAL 89 25.142 21.369 6.689 617 HG12 VAL 89 HG12 VAL 89 25.791 20.295 5.451 618 HG13 VAL 89 HG13 VAL 89 26.264 21.993 5.481 619 HG21 VAL 89 HG21 VAL 89 26.723 22.262 8.488 620 HG22 VAL 89 HG22 VAL 89 27.813 22.828 7.223 621 HG23 VAL 89 HG23 VAL 89 28.406 21.740 8.478 622 H LEU 90 H LEU 90 28.311 17.958 6.606 623 HA LEU 90 HA LEU 90 26.580 16.869 4.743 624 HB2 LEU 90 HB2 LEU 90 29.160 16.723 5.057 625 HB3 LEU 90 HB3 LEU 90 28.803 15.292 5.997 626 HG LEU 90 HG LEU 90 29.463 14.798 3.687 627 HD11 LEU 90 HD11 LEU 90 27.634 13.247 3.162 628 HD12 LEU 90 HD12 LEU 90 26.623 14.054 4.358 629 HD13 LEU 90 HD13 LEU 90 28.081 13.201 4.866 630 HD21 LEU 90 HD21 LEU 90 26.917 16.221 2.940 631 HD22 LEU 90 HD22 LEU 90 27.943 15.305 1.842 632 HD23 LEU 90 HD23 LEU 90 28.558 16.770 2.602 633 H ASN 91 H ASN 91 27.551 15.496 7.895 634 HA ASN 91 HA ASN 91 25.934 13.224 7.833 635 HB2 ASN 91 HB2 ASN 91 26.819 14.864 10.217 636 HB3 ASN 91 HB3 ASN 91 26.067 13.277 10.332 637 HD21 ASN 91 HD22 ASN 91 28.669 14.139 11.236 638 HD22 ASN 91 HD21 ASN 91 29.825 13.135 10.433 639 H THR 92 H THR 92 25.228 16.494 8.906 640 HA THR 92 HA THR 92 22.696 16.017 10.015 641 HB THR 92 HB THR 92 23.723 18.553 8.718 642 HG1 THR 92 HG1 THR 92 25.117 17.976 10.372 643 HG21 THR 92 HG21 THR 92 22.153 19.674 10.268 644 HG22 THR 92 HG22 THR 92 21.528 18.094 10.741 645 HG23 THR 92 HG23 THR 92 21.324 18.661 9.084 646 H ILE 93 H ILE 93 23.696 16.904 6.727 647 HA ILE 93 HA ILE 93 21.169 17.148 5.560 648 HB ILE 93 HB ILE 93 23.702 16.120 4.278 649 HG12 ILE 93 HG12 ILE 93 23.970 18.353 5.247 650 HG13 ILE 93 HG13 ILE 93 23.979 18.430 3.489 651 HG21 ILE 93 HG21 ILE 93 21.179 17.198 3.019 652 HG22 ILE 93 HG22 ILE 93 21.761 15.534 2.945 653 HG23 ILE 93 HG23 ILE 93 22.672 16.823 2.156 654 HD11 ILE 93 HD11 ILE 93 22.706 20.264 4.407 655 HD12 ILE 93 HD12 ILE 93 21.678 19.139 5.296 656 HD13 ILE 93 HD13 ILE 93 21.636 19.169 3.532 657 H GLY 94 H GLY 94 23.252 14.283 5.830 658 HA2 GLY 94 HA2 GLY 94 21.417 12.537 4.547 659 HA3 GLY 94 HA3 GLY 94 22.784 12.047 5.531 660 H ALA 95 H ALA 95 21.925 13.423 7.881 661 HA ALA 95 HA ALA 95 20.345 11.383 9.039 662 HB1 ALA 95 HB1 ALA 95 22.024 12.619 10.312 663 HB2 ALA 95 HB2 ALA 95 20.436 12.736 11.069 664 HB3 ALA 95 HB3 ALA 95 21.072 14.094 10.142 665 H CYS 96 H CYS 96 19.672 14.750 8.151 666 HA CYS 96 HA CYS 96 16.926 14.524 9.033 667 HB2 CYS 96 HB2 CYS 96 18.301 16.776 7.566 668 HB3 CYS 96 HB3 CYS 96 16.738 16.857 8.366 669 H LEU 97 H LEU 97 18.390 13.305 6.427 670 HA LEU 97 HA LEU 97 16.111 13.866 4.655 671 HB2 LEU 97 HB2 LEU 97 18.896 13.749 4.149 672 HB3 LEU 97 HB3 LEU 97 18.132 12.426 3.283 673 HG LEU 97 HG LEU 97 17.267 15.312 3.079 674 HD11 LEU 97 HD11 LEU 97 18.943 13.650 1.223 675 HD12 LEU 97 HD12 LEU 97 19.493 15.022 2.182 676 HD13 LEU 97 HD13 LEU 97 18.326 15.266 0.882 677 HD21 LEU 97 HD21 LEU 97 16.528 12.880 1.451 678 HD22 LEU 97 HD22 LEU 97 15.994 14.532 1.143 679 HD23 LEU 97 HD23 LEU 97 15.485 13.700 2.612 680 H ARG 98 H ARG 98 17.680 11.419 6.503 681 HA ARG 98 HA ARG 98 16.523 9.231 5.025 682 HB2 ARG 98 HB2 ARG 98 17.385 7.810 6.861 683 HB3 ARG 98 HB3 ARG 98 18.619 8.826 6.132 684 HG2 ARG 98 HG2 ARG 98 18.456 10.373 8.007 685 HG3 ARG 98 HG3 ARG 98 17.208 9.362 8.736 686 HD2 ARG 98 HD2 ARG 98 18.809 7.511 8.893 687 HD3 ARG 98 HD3 ARG 98 20.052 8.532 8.166 688 HE ARG 98 HE ARG 98 19.018 9.843 10.422 689 HH11 ARG 98 HH11 ARG 98 20.934 7.013 9.643 690 HH12 ARG 98 HH12 ARG 98 21.821 7.052 11.132 691 HH21 ARG 98 HH21 ARG 98 20.176 9.900 12.371 692 HH22 ARG 98 HH22 ARG 98 21.389 8.704 12.695 693 H GLU 99 H GLU 99 15.876 10.746 8.172 694 HA GLU 99 HA GLU 99 13.698 8.974 8.702 695 HB2 GLU 99 HB2 GLU 99 13.232 10.664 10.602 696 HB3 GLU 99 HB3 GLU 99 14.666 9.665 10.667 697 HG2 GLU 99 HG2 GLU 99 15.390 11.760 11.355 698 HG3 GLU 99 HG3 GLU 99 15.909 11.661 9.681 699 H SER 100 H SER 100 13.974 12.272 7.559 700 HA SER 100 HA SER 100 11.303 12.996 7.507 701 HB2 SER 100 HB2 SER 100 12.026 14.459 5.551 702 HB3 SER 100 HB3 SER 100 12.945 14.642 7.044 703 HG SER 100 HG SER 100 14.617 14.207 5.882 704 H MET 101 H MET 101 13.093 10.942 5.309 705 HA MET 101 HA MET 101 11.229 10.817 3.219 706 HB2 MET 101 HB2 MET 101 13.463 9.077 4.148 707 HB3 MET 101 HB3 MET 101 12.340 8.432 2.960 708 HG2 MET 101 HG2 MET 101 13.842 11.018 2.638 709 HG3 MET 101 HG3 MET 101 14.383 9.465 2.000 710 HE1 MET 101 HE1 MET 101 11.715 8.086 1.045 711 HE2 MET 101 HE2 MET 101 13.186 8.143 0.075 712 HE3 MET 101 HE3 MET 101 11.640 8.618 -0.635 713 H MET 102 H MET 102 11.588 8.739 6.107 714 HA MET 102 HA MET 102 9.316 7.167 5.342 715 HB2 MET 102 HB2 MET 102 9.501 6.103 7.557 716 HB3 MET 102 HB3 MET 102 10.998 6.062 6.639 717 HG2 MET 102 HG2 MET 102 12.035 7.595 8.034 718 HG3 MET 102 HG3 MET 102 10.506 8.191 8.682 719 HE1 MET 102 HE1 MET 102 12.668 4.797 8.468 720 HE2 MET 102 HE2 MET 102 10.981 4.476 8.061 721 HE3 MET 102 HE3 MET 102 11.667 3.834 9.557 722 H GLN 103 H GLN 103 9.872 9.943 7.406 723 HA GLN 103 HA GLN 103 7.271 9.970 8.559 724 HB2 GLN 103 HB2 GLN 103 9.547 11.857 8.400 725 HB3 GLN 103 HB3 GLN 103 7.963 12.577 8.649 726 HG2 GLN 103 HG2 GLN 103 8.955 12.240 10.778 727 HG3 GLN 103 HG3 GLN 103 7.653 11.070 10.599 728 HE21 GLN 103 HE22 GLN 103 8.165 8.884 10.354 729 HE22 GLN 103 HE21 GLN 103 9.727 8.261 10.762 730 H ALA 104 H ALA 104 8.414 10.651 5.440 731 HA ALA 104 HA ALA 104 6.175 12.326 4.709 732 HB1 ALA 104 HB1 ALA 104 8.338 12.583 3.578 733 HB2 ALA 104 HB2 ALA 104 7.045 12.189 2.446 734 HB3 ALA 104 HB3 ALA 104 8.192 10.944 2.942 735 H THR 105 H THR 105 7.285 9.124 3.541 736 HA THR 105 HA THR 105 4.932 7.761 4.134 737 HB THR 105 HB THR 105 3.735 9.106 2.552 738 HG1 THR 105 HG1 THR 105 2.886 7.181 2.186 739 HG21 THR 105 HG21 THR 105 5.813 8.338 0.500 740 HG22 THR 105 HG22 THR 105 5.626 9.931 1.229 741 HG23 THR 105 HG23 THR 105 4.354 9.280 0.193 742 H GLY 106 H GLY 106 7.493 8.021 1.660 743 HA2 GLY 106 HA2 GLY 106 7.191 5.230 0.988 744 HA3 GLY 106 HA3 GLY 106 8.276 6.377 0.228 745 H SER 107 H SER 107 8.186 5.702 3.690 746 HA SER 107 HA SER 107 9.758 4.946 5.132 747 HB2 SER 107 HB2 SER 107 10.387 3.067 2.847 748 HB3 SER 107 HB3 SER 107 10.783 2.807 4.546 749 HG SER 107 HG SER 107 8.151 3.113 3.516 750 H VAL 108 H VAL 108 12.324 3.960 4.838 751 HA VAL 108 HA VAL 108 13.758 6.238 3.699 752 HB VAL 108 HB VAL 108 14.892 3.931 5.296 753 HG11 VAL 108 HG11 VAL 108 16.535 5.107 3.935 754 HG12 VAL 108 HG12 VAL 108 16.798 5.432 5.649 755 HG13 VAL 108 HG13 VAL 108 16.026 6.646 4.630 756 HG21 VAL 108 HG21 VAL 108 14.140 6.675 6.293 757 HG22 VAL 108 HG22 VAL 108 14.824 5.354 7.242 758 HG23 VAL 108 HG23 VAL 108 13.199 5.210 6.570 759 H ASP 109 H ASP 109 13.597 5.819 1.527 760 HA ASP 109 HA ASP 109 13.810 3.282 0.352 761 HB2 ASP 109 HB2 ASP 109 12.736 5.226 -0.744 762 HB3 ASP 109 HB3 ASP 109 14.325 5.959 -0.956 763 H ASN 110 H ASN 110 15.448 2.144 -0.471 764 HA ASN 110 HA ASN 110 18.005 2.636 0.704 765 HB2 ASN 110 HB2 ASN 110 17.133 0.464 -1.215 766 HB3 ASN 110 HB3 ASN 110 18.636 0.477 -0.298 767 HD21 ASN 110 HD22 ASN 110 15.206 0.044 -0.180 768 HD22 ASN 110 HD21 ASN 110 15.136 -0.619 1.416 769 H ALA 111 H ALA 111 16.626 3.319 -2.375 770 HA ALA 111 HA ALA 111 19.273 3.539 -3.626 771 HB1 ALA 111 HB1 ALA 111 18.081 3.776 -5.730 772 HB2 ALA 111 HB2 ALA 111 16.539 3.825 -4.876 773 HB3 ALA 111 HB3 ALA 111 17.505 2.349 -4.866 774 H PHE 112 H PHE 112 16.346 5.449 -3.000 775 HA PHE 112 HA PHE 112 17.148 7.836 -4.179 776 HB2 PHE 112 HB2 PHE 112 14.855 7.375 -3.398 777 HB3 PHE 112 HB3 PHE 112 15.407 7.487 -1.733 778 HD1 PHE 112 HD1 PHE 112 14.878 9.402 -4.841 779 HD2 PHE 112 HD2 PHE 112 15.664 9.581 -0.662 780 HE1 PHE 112 HE1 PHE 112 14.433 11.821 -4.864 781 HE2 PHE 112 HE2 PHE 112 15.222 12.001 -0.680 782 HZ PHE 112 HZ PHE 112 14.605 13.124 -2.782 783 H THR 113 H THR 113 17.298 7.089 -0.678 784 HA THR 113 HA THR 113 18.705 9.400 0.038 785 HB THR 113 HB THR 113 19.372 8.130 2.097 786 HG1 THR 113 HG1 THR 113 17.734 5.998 1.251 787 HG21 THR 113 HG21 THR 113 17.260 9.330 2.045 788 HG22 THR 113 HG22 THR 113 17.076 7.822 2.941 789 HG23 THR 113 HG23 THR 113 16.468 7.947 1.289 790 H ASN 114 H ASN 114 19.802 6.253 -1.002 791 HA ASN 114 HA ASN 114 22.549 6.533 -0.427 792 HB2 ASN 114 HB2 ASN 114 21.549 4.366 -0.779 793 HB3 ASN 114 HB3 ASN 114 21.036 4.809 -2.398 794 HD21 ASN 114 HD22 ASN 114 22.482 4.729 -4.068 795 HD22 ASN 114 HD21 ASN 114 24.037 3.999 -3.921 796 H GLU 115 H GLU 115 20.747 6.990 -3.485 797 HA GLU 115 HA GLU 115 22.986 7.738 -4.989 798 HB2 GLU 115 HB2 GLU 115 21.015 6.829 -6.027 799 HB3 GLU 115 HB3 GLU 115 20.018 8.122 -5.371 800 HG2 GLU 115 HG2 GLU 115 20.995 9.713 -6.762 801 HG3 GLU 115 HG3 GLU 115 22.291 8.620 -7.220 802 H VAL 116 H VAL 116 20.442 9.590 -3.331 803 HA VAL 116 HA VAL 116 21.319 12.152 -4.045 804 HB VAL 116 HB VAL 116 19.893 11.231 -1.540 805 HG11 VAL 116 HG11 VAL 116 20.356 14.042 -2.533 806 HG12 VAL 116 HG12 VAL 116 21.036 13.326 -1.073 807 HG13 VAL 116 HG13 VAL 116 19.297 13.590 -1.197 808 HG21 VAL 116 HG21 VAL 116 18.904 12.584 -4.051 809 HG22 VAL 116 HG22 VAL 116 17.919 12.173 -2.648 810 HG23 VAL 116 HG23 VAL 116 18.653 10.894 -3.615 811 H MET 117 H MET 117 22.169 10.161 -1.198 812 HA MET 117 HA MET 117 23.954 11.911 0.012 813 HB2 MET 117 HB2 MET 117 23.538 8.996 0.036 814 HB3 MET 117 HB3 MET 117 25.133 9.528 0.536 815 HG2 MET 117 HG2 MET 117 22.605 10.638 1.721 816 HG3 MET 117 HG3 MET 117 23.406 9.205 2.356 817 HE1 MET 117 HE1 MET 117 24.557 13.559 3.056 818 HE2 MET 117 HE2 MET 117 23.023 12.907 2.477 819 HE3 MET 117 HE3 MET 117 24.389 13.069 1.373 820 H GLN 118 H GLN 118 24.682 9.435 -2.445 821 HA GLN 118 HA GLN 118 27.410 9.960 -2.694 822 HB2 GLN 118 HB2 GLN 118 26.426 8.023 -3.750 823 HB3 GLN 118 HB3 GLN 118 25.416 9.039 -4.771 824 HG2 GLN 118 HG2 GLN 118 27.459 9.926 -5.840 825 HG3 GLN 118 HG3 GLN 118 28.414 8.806 -4.873 826 HE21 GLN 118 HE22 GLN 118 29.215 7.819 -6.719 827 HE22 GLN 118 HE21 GLN 118 28.255 6.741 -7.673 828 H LEU 119 H LEU 119 24.680 11.347 -4.491 829 HA LEU 119 HA LEU 119 26.219 13.016 -6.146 830 HB2 LEU 119 HB2 LEU 119 23.344 13.037 -5.305 831 HB3 LEU 119 HB3 LEU 119 23.998 14.291 -6.343 832 HG LEU 119 HG LEU 119 24.308 11.397 -7.080 833 HD11 LEU 119 HD11 LEU 119 21.909 11.811 -6.640 834 HD12 LEU 119 HD12 LEU 119 22.245 11.517 -8.344 835 HD13 LEU 119 HD13 LEU 119 21.954 13.161 -7.773 836 HD21 LEU 119 HD21 LEU 119 24.400 12.324 -9.333 837 HD22 LEU 119 HD22 LEU 119 25.617 13.062 -8.292 838 HD23 LEU 119 HD23 LEU 119 24.141 13.945 -8.686 839 H VAL 120 H VAL 120 24.495 13.758 -3.105 840 HA VAL 120 HA VAL 120 25.084 16.481 -3.002 841 HB VAL 120 HB VAL 120 24.829 14.558 -0.678 842 HG11 VAL 120 HG11 VAL 120 24.336 16.525 0.680 843 HG12 VAL 120 HG12 VAL 120 24.627 17.570 -0.711 844 HG13 VAL 120 HG13 VAL 120 25.952 16.635 -0.020 845 HG21 VAL 120 HG21 VAL 120 22.848 14.588 -2.075 846 HG22 VAL 120 HG22 VAL 120 22.806 16.349 -2.016 847 HG23 VAL 120 HG23 VAL 120 22.525 15.411 -0.550 848 H LYS 121 H LYS 121 26.871 13.802 -1.494 849 HA LYS 121 HA LYS 121 28.936 15.319 -0.393 850 HB2 LYS 121 HB2 LYS 121 28.973 12.472 -1.403 851 HB3 LYS 121 HB3 LYS 121 30.198 13.187 -0.366 852 HG2 LYS 121 HG2 LYS 121 28.645 13.459 1.414 853 HG3 LYS 121 HG3 LYS 121 27.290 13.019 0.375 854 HD2 LYS 121 HD2 LYS 121 27.748 11.127 1.715 855 HD3 LYS 121 HD3 LYS 121 28.394 10.763 0.115 856 HE2 LYS 121 HE2 LYS 121 30.633 11.355 0.865 857 HE3 LYS 121 HE3 LYS 121 30.001 11.789 2.452 858 HZ1 LYS 121 HZ1 LYS 121 29.937 9.076 1.246 859 HZ2 LYS 121 HZ2 LYS 121 29.315 9.491 2.760 860 HZ3 LYS 121 HZ3 LYS 121 30.978 9.589 2.476 861 H MET 122 H MET 122 28.574 13.939 -3.582 862 HA MET 122 HA MET 122 31.234 14.531 -4.429 863 HB2 MET 122 HB2 MET 122 30.069 12.653 -5.390 864 HB3 MET 122 HB3 MET 122 28.750 13.684 -5.914 865 HG2 MET 122 HG2 MET 122 30.200 14.765 -7.522 866 HG3 MET 122 HG3 MET 122 31.565 13.796 -6.965 867 HE1 MET 122 HE1 MET 122 27.968 13.648 -8.530 868 HE2 MET 122 HE2 MET 122 27.865 12.378 -7.309 869 HE3 MET 122 HE3 MET 122 27.847 11.959 -9.020 870 H LEU 123 H LEU 123 28.071 16.013 -5.026 871 HA LEU 123 HA LEU 123 29.147 17.965 -6.828 872 HB2 LEU 123 HB2 LEU 123 26.475 17.868 -5.424 873 HB3 LEU 123 HB3 LEU 123 26.895 18.968 -6.722 874 HG LEU 123 HG LEU 123 26.800 15.963 -6.996 875 HD11 LEU 123 HD11 LEU 123 24.738 16.338 -8.257 876 HD12 LEU 123 HD12 LEU 123 24.810 18.056 -7.859 877 HD13 LEU 123 HD13 LEU 123 24.582 16.862 -6.580 878 HD21 LEU 123 HD21 LEU 123 28.334 16.981 -8.566 879 HD22 LEU 123 HD22 LEU 123 27.115 18.165 -9.031 880 HD23 LEU 123 HD23 LEU 123 26.876 16.460 -9.409 881 H SER 124 H SER 124 29.315 17.694 -3.502 882 HA SER 124 HA SER 124 29.154 20.609 -3.113 883 HB2 SER 124 HB2 SER 124 29.270 18.453 -0.993 884 HB3 SER 124 HB3 SER 124 29.013 20.173 -0.722 885 HG SER 124 HG SER 124 27.300 18.328 -2.005 886 H ALA 125 H ALA 125 31.422 18.265 -3.727 887 HA ALA 125 HA ALA 125 33.501 19.636 -2.186 888 HB1 ALA 125 HB1 ALA 125 34.981 17.827 -2.831 889 HB2 ALA 125 HB2 ALA 125 33.692 17.099 -3.790 890 HB3 ALA 125 HB3 ALA 125 33.530 17.213 -2.037 891 H ASP 126 H ASP 126 33.619 21.484 -3.322 892 HA ASP 126 HA ASP 126 35.186 21.432 -5.715 893 HB2 ASP 126 HB2 ASP 126 32.743 21.221 -6.426 894 HB3 ASP 126 HB3 ASP 126 32.534 22.860 -5.824 895 H SER 127 H SER 127 36.702 22.652 -4.869 896 HA SER 127 HA SER 127 37.859 24.455 -4.190 897 HB2 SER 127 HB2 SER 127 35.234 25.761 -4.770 898 HB3 SER 127 HB3 SER 127 36.638 26.677 -4.226 899 HG SER 127 HG SER 127 36.128 25.437 -6.666 900 H ALA 128 H ALA 128 35.624 22.952 -2.426 901 HA ALA 128 HA ALA 128 35.808 24.734 -0.125 902 HB1 ALA 128 HB1 ALA 128 33.629 23.704 -0.587 903 HB2 ALA 128 HB2 ALA 128 34.265 23.185 0.973 904 HB3 ALA 128 HB3 ALA 128 34.350 22.104 -0.417 905 H ASN 129 H ASN 129 37.923 24.591 0.536 906 HA ASN 129 HA ASN 129 38.817 22.126 1.713 907 HB2 ASN 129 HB2 ASN 129 39.351 21.785 -0.685 908 HB3 ASN 129 HB3 ASN 129 40.338 23.241 -0.649 909 HD21 ASN 129 HD22 ASN 129 42.198 22.180 -1.197 910 HD22 ASN 129 HD21 ASN 129 43.020 21.106 -0.119 911 H GLU 130 H GLU 130 39.593 25.405 0.722 912 HA GLU 130 HA GLU 130 41.689 25.611 2.709 913 HB2 GLU 130 HB2 GLU 130 40.566 27.606 0.746 914 HB3 GLU 130 HB3 GLU 130 41.788 28.019 1.936 915 HG2 GLU 130 HG2 GLU 130 42.921 27.629 -0.086 916 HG3 GLU 130 HG3 GLU 130 43.227 26.227 0.935 917 H VAL 131 H VAL 131 41.704 27.116 4.406 918 HA VAL 131 HA VAL 131 39.237 28.527 5.020 919 HB VAL 131 HB VAL 131 38.946 26.558 6.366 920 HG11 VAL 131 HG11 VAL 131 41.232 25.721 6.370 921 HG12 VAL 131 HG12 VAL 131 40.591 25.801 8.012 922 HG13 VAL 131 HG13 VAL 131 41.720 27.030 7.445 923 HG21 VAL 131 HG21 VAL 131 39.969 28.836 8.069 924 HG22 VAL 131 HG22 VAL 131 38.965 27.505 8.643 925 HG23 VAL 131 HG23 VAL 131 38.328 28.639 7.453 926 H SER 132 H SER 132 39.878 30.571 5.034 927 HA SER 132 HA SER 132 42.505 31.410 5.672 928 HB2 SER 132 HB2 SER 132 39.991 33.088 5.681 929 HB3 SER 132 HB3 SER 132 41.645 33.654 5.459 930 HG SER 132 HG SER 132 41.288 33.361 3.418 931 H THR 133 H THR 133 39.463 32.066 7.344 932 HA THR 133 HA THR 133 40.523 31.165 9.843 933 HB THR 133 HB THR 133 39.658 34.021 9.714 934 HG1 THR 133 HG1 THR 133 42.068 32.933 9.146 935 HG21 THR 133 HG21 THR 133 39.216 32.970 11.834 936 HG22 THR 133 HG22 THR 133 40.589 34.063 12.014 937 HG23 THR 133 HG23 THR 133 40.854 32.322 11.886 Start of MODEL 9 1 HA2 GLY 1 HA2 GLY 1 8.428 -6.118 -1.754 2 HA3 GLY 1 HA3 GLY 1 7.879 -5.607 -0.162 3 H SER 2 H SER 2 8.810 -3.530 -0.591 4 HA SER 2 HA SER 2 10.414 -1.929 -0.443 5 HB2 SER 2 HB2 SER 2 10.802 -3.165 1.739 6 HB3 SER 2 HB3 SER 2 12.107 -4.030 0.931 7 HG SER 2 HG SER 2 12.661 -2.060 2.171 8 H GLY 3 H GLY 3 10.280 -3.019 -2.857 9 HA2 GLY 3 HA2 GLY 3 12.926 -2.656 -3.888 10 HA3 GLY 3 HA3 GLY 3 12.401 -4.329 -3.995 11 H ASN 4 H ASN 4 10.764 -1.210 -4.487 12 HA ASN 4 HA ASN 4 10.258 -1.965 -7.275 13 HB2 ASN 4 HB2 ASN 4 8.278 -2.594 -5.800 14 HB3 ASN 4 HB3 ASN 4 8.080 -0.876 -5.478 15 HD21 ASN 4 HD22 ASN 4 6.270 -2.753 -6.768 16 HD22 ASN 4 HD21 ASN 4 5.938 -2.101 -8.334 17 H SER 5 H SER 5 10.298 -0.225 -8.657 18 HA SER 5 HA SER 5 11.413 2.194 -7.608 19 HB2 SER 5 HB2 SER 5 11.320 2.868 -10.073 20 HB3 SER 5 HB3 SER 5 12.321 1.476 -9.661 21 HG SER 5 HG SER 5 9.621 1.184 -10.466 22 H GLN 6 H GLN 6 9.384 2.487 -6.278 23 HA GLN 6 HA GLN 6 7.645 4.344 -7.725 24 HB2 GLN 6 HB2 GLN 6 6.423 2.278 -7.024 25 HB3 GLN 6 HB3 GLN 6 6.852 2.629 -5.359 26 HG2 GLN 6 HG2 GLN 6 4.718 3.442 -5.462 27 HG3 GLN 6 HG3 GLN 6 5.660 4.891 -5.797 28 HE21 GLN 6 HE22 GLN 6 6.265 3.955 -8.554 29 HE22 GLN 6 HE21 GLN 6 4.817 4.232 -9.447 30 HA PRO 7 HA PRO 7 10.230 6.364 -4.501 31 HB2 PRO 7 HB2 PRO 7 10.350 8.599 -6.382 32 HB3 PRO 7 HB3 PRO 7 11.666 7.634 -5.706 33 HG2 PRO 7 HG2 PRO 7 10.946 7.470 -8.303 34 HG3 PRO 7 HG3 PRO 7 11.570 6.076 -7.399 35 HD2 PRO 7 HD2 PRO 7 8.731 6.779 -8.075 36 HD3 PRO 7 HD3 PRO 7 9.548 5.199 -8.146 37 H ILE 8 H ILE 8 10.162 8.589 -3.591 38 HA ILE 8 HA ILE 8 7.600 9.113 -2.567 39 HB ILE 8 HB ILE 8 9.681 9.490 -1.332 40 HG12 ILE 8 HG12 ILE 8 9.187 11.891 -0.543 41 HG13 ILE 8 HG13 ILE 8 7.869 11.859 -1.708 42 HG21 ILE 8 HG21 ILE 8 11.118 11.383 -1.799 43 HG22 ILE 8 HG22 ILE 8 10.138 11.800 -3.203 44 HG23 ILE 8 HG23 ILE 8 11.048 10.289 -3.180 45 HD11 ILE 8 HD11 ILE 8 8.223 9.922 0.556 46 HD12 ILE 8 HD12 ILE 8 6.865 9.990 -0.569 47 HD13 ILE 8 HD13 ILE 8 7.147 11.318 0.559 48 H TRP 9 H TRP 9 8.982 10.106 -5.488 49 HA TRP 9 HA TRP 9 7.889 12.756 -5.613 50 HB2 TRP 9 HB2 TRP 9 9.031 11.014 -7.796 51 HB3 TRP 9 HB3 TRP 9 8.675 12.727 -7.946 52 HD1 TRP 9 HD1 TRP 9 11.455 10.471 -7.281 53 HE1 TRP 9 HE1 TRP 9 13.466 11.725 -6.275 54 HE3 TRP 9 HE3 TRP 9 9.113 14.826 -5.999 55 HZ2 TRP 9 HZ2 TRP 9 13.977 14.234 -5.078 56 HZ3 TRP 9 HZ3 TRP 9 10.430 16.603 -4.924 57 HH2 TRP 9 HH2 TRP 9 12.814 16.313 -4.471 58 H THR 10 H THR 10 6.282 9.947 -5.607 59 HA THR 10 HA THR 10 4.635 10.352 -7.949 60 HB THR 10 HB THR 10 3.285 8.433 -6.804 61 HG1 THR 10 HG1 THR 10 5.758 7.858 -5.576 62 HG21 THR 10 HG21 THR 10 4.621 8.184 -8.837 63 HG22 THR 10 HG22 THR 10 4.811 6.782 -7.783 64 HG23 THR 10 HG23 THR 10 6.083 8.003 -7.863 65 H ASN 11 H ASN 11 4.739 11.763 -4.978 66 HA ASN 11 HA ASN 11 2.082 12.852 -5.358 67 HB2 ASN 11 HB2 ASN 11 1.596 11.036 -3.827 68 HB3 ASN 11 HB3 ASN 11 2.917 11.526 -2.770 69 HD21 ASN 11 HD22 ASN 11 1.445 11.689 -1.044 70 HD22 ASN 11 HD21 ASN 11 0.374 13.034 -0.900 71 HA PRO 12 HA PRO 12 4.686 16.421 -4.776 72 HB2 PRO 12 HB2 PRO 12 1.964 17.621 -4.547 73 HB3 PRO 12 HB3 PRO 12 3.345 18.148 -5.516 74 HG2 PRO 12 HG2 PRO 12 1.298 16.888 -6.654 75 HG3 PRO 12 HG3 PRO 12 2.966 16.554 -7.161 76 HD2 PRO 12 HD2 PRO 12 1.131 14.915 -5.476 77 HD3 PRO 12 HD3 PRO 12 2.366 14.394 -6.639 78 H ASN 13 H ASN 13 1.776 15.885 -2.797 79 HA ASN 13 HA ASN 13 2.495 17.626 -0.705 80 HB2 ASN 13 HB2 ASN 13 0.198 16.785 -1.021 81 HB3 ASN 13 HB3 ASN 13 0.731 15.162 -0.596 82 HD21 ASN 13 HD22 ASN 13 -0.628 15.006 1.166 83 HD22 ASN 13 HD21 ASN 13 -0.382 15.905 2.621 84 H ALA 14 H ALA 14 3.134 14.216 -1.266 85 HA ALA 14 HA ALA 14 4.221 13.707 1.321 86 HB1 ALA 14 HB1 ALA 14 3.246 11.945 -0.086 87 HB2 ALA 14 HB2 ALA 14 4.895 11.566 0.406 88 HB3 ALA 14 HB3 ALA 14 4.574 12.138 -1.230 89 H ALA 15 H ALA 15 5.607 14.340 -1.871 90 HA ALA 15 HA ALA 15 8.308 14.064 -1.113 91 HB1 ALA 15 HB1 ALA 15 7.542 13.987 -3.443 92 HB2 ALA 15 HB2 ALA 15 8.829 15.169 -3.210 93 HB3 ALA 15 HB3 ALA 15 7.156 15.705 -3.365 94 H MET 16 H MET 16 6.213 16.927 -1.392 95 HA MET 16 HA MET 16 8.176 18.821 -0.744 96 HB2 MET 16 HB2 MET 16 5.349 18.783 -1.214 97 HB3 MET 16 HB3 MET 16 5.698 19.793 0.187 98 HG2 MET 16 HG2 MET 16 6.966 20.070 -2.528 99 HG3 MET 16 HG3 MET 16 5.628 21.039 -1.922 100 HE1 MET 16 HE1 MET 16 10.055 21.703 -1.260 101 HE2 MET 16 HE2 MET 16 9.201 21.086 -2.673 102 HE3 MET 16 HE3 MET 16 9.437 20.055 -1.266 103 H THR 17 H THR 17 6.128 16.818 1.259 104 HA THR 17 HA THR 17 6.465 18.111 3.713 105 HB THR 17 HB THR 17 6.021 15.195 3.067 106 HG1 THR 17 HG1 THR 17 4.249 16.481 2.579 107 HG21 THR 17 HG21 THR 17 7.084 15.282 5.255 108 HG22 THR 17 HG22 THR 17 5.365 14.936 5.450 109 HG23 THR 17 HG23 THR 17 5.980 16.556 5.769 110 H MET 18 H MET 18 8.414 15.468 2.270 111 HA MET 18 HA MET 18 10.190 15.412 4.492 112 HB2 MET 18 HB2 MET 18 11.604 13.931 3.089 113 HB3 MET 18 HB3 MET 18 9.940 13.399 3.236 114 HG2 MET 18 HG2 MET 18 10.450 13.010 1.019 115 HG3 MET 18 HG3 MET 18 9.577 14.539 0.976 116 HE1 MET 18 HE1 MET 18 12.291 14.705 -1.909 117 HE2 MET 18 HE2 MET 18 10.564 14.697 -1.547 118 HE3 MET 18 HE3 MET 18 11.521 13.235 -1.309 119 H THR 19 H THR 19 10.154 17.174 1.481 120 HA THR 19 HA THR 19 12.833 18.058 1.511 121 HB THR 19 HB THR 19 10.433 19.544 0.421 122 HG1 THR 19 HG1 THR 19 11.458 17.155 -0.286 123 HG21 THR 19 HG21 THR 19 13.329 19.562 -0.430 124 HG22 THR 19 HG22 THR 19 12.534 20.833 0.500 125 HG23 THR 19 HG23 THR 19 12.020 20.498 -1.154 126 H ASN 20 H ASN 20 9.840 19.468 2.840 127 HA ASN 20 HA ASN 20 11.089 21.789 3.885 128 HB2 ASN 20 HB2 ASN 20 8.442 20.455 4.349 129 HB3 ASN 20 HB3 ASN 20 8.951 21.781 5.384 130 HD21 ASN 20 HD22 ASN 20 7.973 20.839 2.202 131 HD22 ASN 20 HD21 ASN 20 7.726 22.435 1.576 132 H ASN 21 H ASN 21 10.409 18.594 5.220 133 HA ASN 21 HA ASN 21 11.128 19.199 7.880 134 HB2 ASN 21 HB2 ASN 21 11.072 16.609 6.350 135 HB3 ASN 21 HB3 ASN 21 11.513 16.695 8.047 136 HD21 ASN 21 HD22 ASN 21 9.322 15.306 6.849 137 HD22 ASN 21 HD21 ASN 21 7.873 15.954 7.543 138 H LEU 22 H LEU 22 12.986 18.238 5.068 139 HA LEU 22 HA LEU 22 15.434 17.698 6.351 140 HB2 LEU 22 HB2 LEU 22 15.042 17.090 4.027 141 HB3 LEU 22 HB3 LEU 22 14.852 18.775 3.587 142 HG LEU 22 HG LEU 22 17.236 19.161 4.165 143 HD11 LEU 22 HD11 LEU 22 18.708 17.224 4.453 144 HD12 LEU 22 HD12 LEU 22 17.296 16.166 4.500 145 HD13 LEU 22 HD13 LEU 22 17.542 17.367 5.768 146 HD21 LEU 22 HD21 LEU 22 16.586 18.742 1.865 147 HD22 LEU 22 HD22 LEU 22 16.702 17.003 2.127 148 HD23 LEU 22 HD23 LEU 22 18.151 18.004 2.202 149 H VAL 23 H VAL 23 14.038 20.641 5.008 150 HA VAL 23 HA VAL 23 16.175 22.379 5.570 151 HB VAL 23 HB VAL 23 13.229 23.043 5.411 152 HG11 VAL 23 HG11 VAL 23 15.638 24.821 5.051 153 HG12 VAL 23 HG12 VAL 23 14.571 24.813 6.454 154 HG13 VAL 23 HG13 VAL 23 13.951 25.303 4.879 155 HG21 VAL 23 HG21 VAL 23 15.348 23.028 3.270 156 HG22 VAL 23 HG22 VAL 23 13.698 23.617 3.073 157 HG23 VAL 23 HG23 VAL 23 13.992 21.910 3.407 158 H GLN 24 H GLN 24 13.184 21.693 7.395 159 HA GLN 24 HA GLN 24 13.760 23.530 9.458 160 HB2 GLN 24 HB2 GLN 24 11.904 22.609 10.642 161 HB3 GLN 24 HB3 GLN 24 11.491 22.593 8.936 162 HG2 GLN 24 HG2 GLN 24 10.755 20.532 9.540 163 HG3 GLN 24 HG3 GLN 24 12.407 20.132 9.078 164 HE21 GLN 24 HE22 GLN 24 12.520 18.338 10.381 165 HE22 GLN 24 HE21 GLN 24 12.582 18.428 12.106 166 H CYS 25 H CYS 25 14.643 20.193 8.966 167 HA CYS 25 HA CYS 25 15.532 19.649 11.597 168 HB2 CYS 25 HB2 CYS 25 15.037 17.897 9.921 169 HB3 CYS 25 HB3 CYS 25 16.430 18.420 8.982 170 H ALA 26 H ALA 26 17.280 20.598 8.639 171 HA ALA 26 HA ALA 26 19.808 20.812 9.880 172 HB1 ALA 26 HB1 ALA 26 20.498 21.989 7.870 173 HB2 ALA 26 HB2 ALA 26 18.814 22.204 7.395 174 HB3 ALA 26 HB3 ALA 26 19.515 20.587 7.451 175 H SER 27 H SER 27 17.118 23.006 9.558 176 HA SER 27 HA SER 27 18.459 25.379 10.308 177 HB2 SER 27 HB2 SER 27 15.549 24.604 10.564 178 HB3 SER 27 HB3 SER 27 16.178 26.237 10.781 179 HG SER 27 HG SER 27 16.228 24.660 8.420 180 H ARG 28 H ARG 28 17.607 22.629 12.083 181 HA ARG 28 HA ARG 28 17.722 24.122 14.618 182 HB2 ARG 28 HB2 ARG 28 16.447 21.452 13.991 183 HB3 ARG 28 HB3 ARG 28 16.518 22.176 15.592 184 HG2 ARG 28 HG2 ARG 28 15.193 23.486 13.235 185 HG3 ARG 28 HG3 ARG 28 14.346 22.441 14.378 186 HD2 ARG 28 HD2 ARG 28 15.876 24.917 15.159 187 HD3 ARG 28 HD3 ARG 28 14.142 24.885 14.850 188 HE ARG 28 HE ARG 28 15.539 23.637 17.104 189 HH11 ARG 28 HH11 ARG 28 12.554 24.489 15.492 190 HH12 ARG 28 HH12 ARG 28 11.552 24.030 16.828 191 HH21 ARG 28 HH21 ARG 28 14.215 23.044 18.878 192 HH22 ARG 28 HH22 ARG 28 12.494 23.220 18.760 193 H SER 29 H SER 29 19.743 22.633 12.681 194 HA SER 29 HA SER 29 20.841 20.550 14.285 195 HB2 SER 29 HB2 SER 29 22.703 20.573 12.677 196 HB3 SER 29 HB3 SER 29 21.151 20.608 11.842 197 HG SER 29 HG SER 29 21.518 22.611 11.179 198 H GLY 30 H GLY 30 21.734 23.923 13.684 199 HA2 GLY 30 HA2 GLY 30 22.870 25.362 15.148 200 HA3 GLY 30 HA3 GLY 30 23.283 23.977 16.153 201 H VAL 31 H VAL 31 23.842 23.149 13.016 202 HA VAL 31 HA VAL 31 26.719 23.616 13.312 203 HB VAL 31 HB VAL 31 25.259 21.871 11.320 204 HG11 VAL 31 HG11 VAL 31 27.429 20.846 10.911 205 HG12 VAL 31 HG12 VAL 31 28.184 21.964 12.046 206 HG13 VAL 31 HG13 VAL 31 27.470 22.573 10.553 207 HG21 VAL 31 HG21 VAL 31 25.975 19.974 12.696 208 HG22 VAL 31 HG22 VAL 31 24.893 21.053 13.577 209 HG23 VAL 31 HG23 VAL 31 26.628 21.093 13.892 210 H LEU 32 H LEU 32 24.054 24.079 11.068 211 HA LEU 32 HA LEU 32 25.697 25.547 9.187 212 HB2 LEU 32 HB2 LEU 32 22.766 24.832 9.249 213 HB3 LEU 32 HB3 LEU 32 23.468 25.836 8.000 214 HG LEU 32 HG LEU 32 24.986 23.891 7.433 215 HD11 LEU 32 HD11 LEU 32 24.804 22.628 9.494 216 HD12 LEU 32 HD12 LEU 32 24.238 21.660 8.133 217 HD13 LEU 32 HD13 LEU 32 23.075 22.404 9.231 218 HD21 LEU 32 HD21 LEU 32 22.019 23.439 7.149 219 HD22 LEU 32 HD22 LEU 32 23.286 22.754 6.133 220 HD23 LEU 32 HD23 LEU 32 22.996 24.492 6.128 221 H THR 33 H THR 33 25.110 27.738 8.509 222 HA THR 33 HA THR 33 24.655 29.410 10.816 223 HB THR 33 HB THR 33 25.154 31.287 9.341 224 HG1 THR 33 HG1 THR 33 25.773 30.610 7.081 225 HG21 THR 33 HG21 THR 33 27.413 30.662 8.638 226 HG22 THR 33 HG22 THR 33 27.007 28.956 8.845 227 HG23 THR 33 HG23 THR 33 27.047 30.034 10.244 228 H ALA 34 H ALA 34 23.139 31.311 10.660 229 HA ALA 34 HA ALA 34 20.501 30.435 10.248 230 HB1 ALA 34 HB1 ALA 34 21.155 32.247 11.803 231 HB2 ALA 34 HB2 ALA 34 19.822 32.693 10.738 232 HB3 ALA 34 HB3 ALA 34 21.450 33.289 10.412 233 H ASP 35 H ASP 35 22.802 31.943 8.156 234 HA ASP 35 HA ASP 35 20.880 32.721 6.152 235 HB2 ASP 35 HB2 ASP 35 23.896 32.484 6.010 236 HB3 ASP 35 HB3 ASP 35 22.876 33.210 4.774 237 H GLN 36 H GLN 36 23.235 30.164 6.639 238 HA GLN 36 HA GLN 36 22.953 28.888 4.147 239 HB2 GLN 36 HB2 GLN 36 24.842 28.668 5.766 240 HB3 GLN 36 HB3 GLN 36 23.795 27.710 6.797 241 HG2 GLN 36 HG2 GLN 36 23.648 25.996 5.106 242 HG3 GLN 36 HG3 GLN 36 24.611 26.976 4.000 243 HE21 GLN 36 HE22 GLN 36 26.207 25.398 3.859 244 HE22 GLN 36 HE21 GLN 36 27.324 25.112 5.145 245 H MET 37 H MET 37 21.364 28.396 7.271 246 HA MET 37 HA MET 37 19.920 26.070 6.482 247 HB2 MET 37 HB2 MET 37 19.390 28.031 8.724 248 HB3 MET 37 HB3 MET 37 18.597 26.474 8.538 249 HG2 MET 37 HG2 MET 37 20.702 25.324 8.824 250 HG3 MET 37 HG3 MET 37 21.557 26.862 8.906 251 HE1 MET 37 HE1 MET 37 20.121 28.324 12.287 252 HE2 MET 37 HE2 MET 37 19.451 28.564 10.676 253 HE3 MET 37 HE3 MET 37 21.196 28.625 10.922 254 H ASP 38 H ASP 38 19.190 29.515 6.520 255 HA ASP 38 HA ASP 38 16.434 29.213 5.856 256 HB2 ASP 38 HB2 ASP 38 17.335 31.223 6.988 257 HB3 ASP 38 HB3 ASP 38 18.209 31.638 5.517 258 H ASP 39 H ASP 39 19.392 29.603 4.016 259 HA ASP 39 HA ASP 39 18.268 30.125 1.498 260 HB2 ASP 39 HB2 ASP 39 20.704 30.294 2.040 261 HB3 ASP 39 HB3 ASP 39 20.781 28.535 2.064 262 H MET 40 H MET 40 18.708 27.159 3.308 263 HA MET 40 HA MET 40 18.009 25.347 1.258 264 HB2 MET 40 HB2 MET 40 17.662 25.114 4.252 265 HB3 MET 40 HB3 MET 40 17.440 23.793 3.116 266 HG2 MET 40 HG2 MET 40 19.779 23.982 2.443 267 HG3 MET 40 HG3 MET 40 20.001 25.297 3.595 268 HE1 MET 40 HE1 MET 40 19.233 21.479 3.140 269 HE2 MET 40 HE2 MET 40 17.844 22.021 4.084 270 HE3 MET 40 HE3 MET 40 19.039 20.946 4.809 271 H GLY 41 H GLY 41 16.142 27.413 3.346 272 HA2 GLY 41 HA2 GLY 41 13.615 26.182 2.999 273 HA3 GLY 41 HA3 GLY 41 13.891 27.849 3.481 274 H MET 42 H MET 42 15.258 28.784 1.247 275 HA MET 42 HA MET 42 13.091 29.044 -0.630 276 HB2 MET 42 HB2 MET 42 14.454 30.700 -1.724 277 HB3 MET 42 HB3 MET 42 14.517 30.962 0.010 278 HG2 MET 42 HG2 MET 42 16.684 29.691 0.005 279 HG3 MET 42 HG3 MET 42 16.623 29.769 -1.753 280 HE1 MET 42 HE1 MET 42 15.491 32.481 0.897 281 HE2 MET 42 HE2 MET 42 16.981 33.412 1.043 282 HE3 MET 42 HE3 MET 42 16.934 31.735 1.582 283 H MET 43 H MET 43 15.898 27.118 -0.297 284 HA MET 43 HA MET 43 16.203 26.286 -2.982 285 HB2 MET 43 HB2 MET 43 17.905 25.832 -1.294 286 HB3 MET 43 HB3 MET 43 16.775 24.848 -0.381 287 HG2 MET 43 HG2 MET 43 17.475 24.119 -3.188 288 HG3 MET 43 HG3 MET 43 18.568 23.719 -1.865 289 HE1 MET 43 HE1 MET 43 17.887 22.162 0.182 290 HE2 MET 43 HE2 MET 43 16.322 21.365 0.338 291 HE3 MET 43 HE3 MET 43 16.438 23.115 0.507 292 H ALA 44 H ALA 44 14.090 25.309 -0.351 293 HA ALA 44 HA ALA 44 12.899 23.076 -1.559 294 HB1 ALA 44 HB1 ALA 44 12.631 23.675 0.820 295 HB2 ALA 44 HB2 ALA 44 11.088 23.383 0.018 296 HB3 ALA 44 HB3 ALA 44 11.614 25.035 0.341 297 H ASP 45 H ASP 45 12.300 26.525 -1.878 298 HA ASP 45 HA ASP 45 9.909 26.415 -3.362 299 HB2 ASP 45 HB2 ASP 45 12.121 28.466 -3.302 300 HB3 ASP 45 HB3 ASP 45 10.645 28.679 -4.235 301 H SER 46 H SER 46 13.181 25.779 -4.222 302 HA SER 46 HA SER 46 12.746 25.935 -7.061 303 HB2 SER 46 HB2 SER 46 14.986 26.298 -6.093 304 HB3 SER 46 HB3 SER 46 14.982 24.655 -5.455 305 HG SER 46 HG SER 46 16.138 24.765 -7.398 306 H VAL 47 H VAL 47 13.010 23.396 -4.606 307 HA VAL 47 HA VAL 47 12.790 21.177 -6.285 308 HB VAL 47 HB VAL 47 11.818 21.396 -3.431 309 HG11 VAL 47 HG11 VAL 47 10.954 19.421 -4.591 310 HG12 VAL 47 HG12 VAL 47 12.120 18.979 -3.345 311 HG13 VAL 47 HG13 VAL 47 12.597 18.965 -5.042 312 HG21 VAL 47 HG21 VAL 47 14.147 22.061 -3.625 313 HG22 VAL 47 HG22 VAL 47 14.511 20.589 -4.530 314 HG23 VAL 47 HG23 VAL 47 14.022 20.487 -2.837 315 H ASN 48 H ASN 48 10.196 22.871 -4.475 316 HA ASN 48 HA ASN 48 8.187 21.138 -5.478 317 HB2 ASN 48 HB2 ASN 48 6.594 22.881 -4.574 318 HB3 ASN 48 HB3 ASN 48 7.683 22.152 -3.412 319 HD21 ASN 48 HD22 ASN 48 7.662 23.772 -1.953 320 HD22 ASN 48 HD21 ASN 48 8.317 25.342 -2.251 321 H SER 49 H SER 49 9.520 24.167 -6.600 322 HA SER 49 HA SER 49 7.560 24.757 -8.530 323 HB2 SER 49 HB2 SER 49 9.299 26.375 -7.883 324 HB3 SER 49 HB3 SER 49 10.535 25.341 -8.599 325 HG SER 49 HG SER 49 9.347 27.234 -9.816 326 H GLN 50 H GLN 50 10.544 22.831 -8.706 327 HA GLN 50 HA GLN 50 10.205 22.164 -11.453 328 HB2 GLN 50 HB2 GLN 50 11.836 20.663 -9.406 329 HB3 GLN 50 HB3 GLN 50 12.046 20.644 -11.151 330 HG2 GLN 50 HG2 GLN 50 12.650 23.029 -11.076 331 HG3 GLN 50 HG3 GLN 50 12.506 22.987 -9.320 332 HE21 GLN 50 HE22 GLN 50 14.599 23.418 -8.824 333 HE22 GLN 50 HE21 GLN 50 15.914 22.364 -9.221 334 H MET 51 H MET 51 9.349 20.628 -8.413 335 HA MET 51 HA MET 51 8.523 18.144 -9.411 336 HB2 MET 51 HB2 MET 51 8.882 18.586 -7.029 337 HB3 MET 51 HB3 MET 51 7.498 19.668 -7.010 338 HG2 MET 51 HG2 MET 51 6.024 17.806 -7.526 339 HG3 MET 51 HG3 MET 51 7.408 16.717 -7.584 340 HE1 MET 51 HE1 MET 51 6.884 19.676 -4.954 341 HE2 MET 51 HE2 MET 51 5.917 18.825 -3.746 342 HE3 MET 51 HE3 MET 51 5.269 19.103 -5.364 343 H GLN 52 H GLN 52 6.802 21.215 -9.108 344 HA GLN 52 HA GLN 52 4.274 20.063 -9.806 345 HB2 GLN 52 HB2 GLN 52 5.175 22.929 -9.577 346 HB3 GLN 52 HB3 GLN 52 3.524 22.454 -9.952 347 HG2 GLN 52 HG2 GLN 52 3.373 21.261 -7.835 348 HG3 GLN 52 HG3 GLN 52 5.034 21.709 -7.455 349 HE21 GLN 52 HE22 GLN 52 5.497 23.830 -6.894 350 HE22 GLN 52 HE21 GLN 52 4.263 24.945 -6.420 351 H LYS 53 H LYS 53 6.887 21.571 -11.603 352 HA LYS 53 HA LYS 53 5.319 21.704 -14.025 353 HB2 LYS 53 HB2 LYS 53 7.249 22.527 -15.102 354 HB3 LYS 53 HB3 LYS 53 7.241 23.250 -13.505 355 HG2 LYS 53 HG2 LYS 53 8.874 21.542 -12.777 356 HG3 LYS 53 HG3 LYS 53 8.939 20.953 -14.441 357 HD2 LYS 53 HD2 LYS 53 9.639 23.186 -15.183 358 HD3 LYS 53 HD3 LYS 53 9.621 23.736 -13.509 359 HE2 LYS 53 HE2 LYS 53 11.320 21.968 -12.998 360 HE3 LYS 53 HE3 LYS 53 11.411 21.635 -14.724 361 HZ1 LYS 53 HZ1 LYS 53 13.171 23.127 -13.993 362 HZ2 LYS 53 HZ2 LYS 53 12.026 24.244 -13.446 363 HZ3 LYS 53 HZ3 LYS 53 12.145 23.898 -15.094 364 H MET 54 H MET 54 6.994 19.354 -12.296 365 HA MET 54 HA MET 54 7.535 17.584 -14.493 366 HB2 MET 54 HB2 MET 54 8.853 17.435 -12.434 367 HB3 MET 54 HB3 MET 54 7.398 17.079 -11.509 368 HG2 MET 54 HG2 MET 54 7.143 14.976 -12.589 369 HG3 MET 54 HG3 MET 54 8.424 15.345 -13.737 370 HE1 MET 54 HE1 MET 54 7.547 14.309 -10.048 371 HE2 MET 54 HE2 MET 54 8.259 15.908 -9.820 372 HE3 MET 54 HE3 MET 54 9.114 14.471 -9.255 373 H GLY 55 H GLY 55 4.978 18.131 -12.168 374 HA2 GLY 55 HA2 GLY 55 2.705 17.840 -12.932 375 HA3 GLY 55 HA3 GLY 55 3.239 16.426 -13.827 376 HA PRO 56 HA PRO 56 1.892 15.258 -9.401 377 HB2 PRO 56 HB2 PRO 56 -0.787 15.334 -9.418 378 HB3 PRO 56 HB3 PRO 56 0.173 16.769 -9.026 379 HG2 PRO 56 HG2 PRO 56 -1.168 16.028 -11.599 380 HG3 PRO 56 HG3 PRO 56 -1.113 17.601 -10.783 381 HD2 PRO 56 HD2 PRO 56 0.512 16.913 -12.881 382 HD3 PRO 56 HD3 PRO 56 0.948 18.110 -11.645 383 H ASN 57 H ASN 57 2.056 14.202 -12.277 384 HA ASN 57 HA ASN 57 1.355 11.492 -11.741 385 HB2 ASN 57 HB2 ASN 57 -0.817 12.851 -12.528 386 HB3 ASN 57 HB3 ASN 57 -0.111 12.582 -14.117 387 HD21 ASN 57 HD22 ASN 57 -1.730 11.199 -11.439 388 HD22 ASN 57 HD21 ASN 57 -1.966 9.622 -12.114 389 HA PRO 58 HA PRO 58 4.479 12.902 -14.888 390 HB2 PRO 58 HB2 PRO 58 6.741 12.705 -13.496 391 HB3 PRO 58 HB3 PRO 58 5.595 14.019 -13.210 392 HG2 PRO 58 HG2 PRO 58 6.143 11.600 -11.578 393 HG3 PRO 58 HG3 PRO 58 5.626 13.212 -11.063 394 HD2 PRO 58 HD2 PRO 58 3.994 10.919 -11.452 395 HD3 PRO 58 HD3 PRO 58 3.459 12.571 -11.093 396 HA PRO 59 HA PRO 59 6.095 8.992 -16.340 397 HB2 PRO 59 HB2 PRO 59 8.269 10.353 -17.697 398 HB3 PRO 59 HB3 PRO 59 6.831 9.605 -18.392 399 HG2 PRO 59 HG2 PRO 59 7.278 12.292 -18.378 400 HG3 PRO 59 HG3 PRO 59 5.661 11.567 -18.404 401 HD2 PRO 59 HD2 PRO 59 7.181 12.740 -16.111 402 HD3 PRO 59 HD3 PRO 59 5.452 12.851 -16.498 403 H GLN 60 H GLN 60 7.883 7.591 -16.130 404 HA GLN 60 HA GLN 60 9.052 7.730 -13.602 405 HB2 GLN 60 HB2 GLN 60 8.522 5.673 -14.942 406 HB3 GLN 60 HB3 GLN 60 9.968 5.989 -15.886 407 HG2 GLN 60 HG2 GLN 60 10.486 4.340 -14.254 408 HG3 GLN 60 HG3 GLN 60 11.294 5.838 -13.796 409 HE21 GLN 60 HE22 GLN 60 10.465 3.482 -12.216 410 HE22 GLN 60 HE21 GLN 60 9.481 4.104 -10.933 411 H HIS 61 H HIS 61 10.369 8.646 -16.743 412 HA HIS 61 HA HIS 61 13.084 8.671 -15.949 413 HB2 HIS 61 HB2 HIS 61 13.547 9.930 -17.982 414 HB3 HIS 61 HB3 HIS 61 12.432 8.618 -18.322 415 HD1 HIS 61 HD1 HIS 61 10.501 9.246 -19.728 416 HD2 HIS 61 HD2 HIS 61 12.069 12.536 -17.730 417 HE1 HIS 61 HE1 HIS 61 9.222 11.229 -20.584 418 H ARG 62 H ARG 62 10.517 10.882 -15.391 419 HA ARG 62 HA ARG 62 12.109 13.205 -14.944 420 HB2 ARG 62 HB2 ARG 62 9.309 12.412 -14.204 421 HB3 ARG 62 HB3 ARG 62 10.014 13.905 -13.605 422 HG2 ARG 62 HG2 ARG 62 9.751 13.191 -16.514 423 HG3 ARG 62 HG3 ARG 62 8.613 14.196 -15.616 424 HD2 ARG 62 HD2 ARG 62 10.635 15.650 -15.035 425 HD3 ARG 62 HD3 ARG 62 11.478 14.768 -16.309 426 HE ARG 62 HE ARG 62 9.060 15.699 -17.347 427 HH11 ARG 62 HH11 ARG 62 12.148 16.929 -16.251 428 HH12 ARG 62 HH12 ARG 62 12.041 18.389 -17.187 429 HH21 ARG 62 HH21 ARG 62 8.912 17.627 -18.570 430 HH22 ARG 62 HH22 ARG 62 10.204 18.777 -18.506 431 H LEU 63 H LEU 63 10.800 10.674 -12.865 432 HA LEU 63 HA LEU 63 11.433 11.884 -10.413 433 HB2 LEU 63 HB2 LEU 63 10.967 9.007 -11.169 434 HB3 LEU 63 HB3 LEU 63 11.250 9.512 -9.517 435 HG LEU 63 HG LEU 63 9.222 11.010 -9.736 436 HD11 LEU 63 HD11 LEU 63 8.915 9.462 -12.293 437 HD12 LEU 63 HD12 LEU 63 8.972 11.214 -12.081 438 HD13 LEU 63 HD13 LEU 63 7.586 10.298 -11.490 439 HD21 LEU 63 HD21 LEU 63 9.162 8.881 -8.548 440 HD22 LEU 63 HD22 LEU 63 8.786 8.047 -10.057 441 HD23 LEU 63 HD23 LEU 63 7.638 9.201 -9.377 442 H ARG 64 H ARG 64 13.275 9.767 -12.528 443 HA ARG 64 HA ARG 64 15.361 9.231 -10.682 444 HB2 ARG 64 HB2 ARG 64 14.803 8.661 -13.474 445 HB3 ARG 64 HB3 ARG 64 16.498 9.048 -13.218 446 HG2 ARG 64 HG2 ARG 64 16.248 6.694 -13.034 447 HG3 ARG 64 HG3 ARG 64 16.546 7.330 -11.417 448 HD2 ARG 64 HD2 ARG 64 14.116 7.255 -10.980 449 HD3 ARG 64 HD3 ARG 64 13.876 6.538 -12.573 450 HE ARG 64 HE ARG 64 15.438 5.246 -10.419 451 HH11 ARG 64 HH11 ARG 64 13.212 5.069 -13.120 452 HH12 ARG 64 HH12 ARG 64 12.998 3.354 -12.993 453 HH21 ARG 64 HH21 ARG 64 15.146 2.986 -10.248 454 HH22 ARG 64 HH22 ARG 64 14.092 2.168 -11.363 455 H ALA 65 H ALA 65 14.591 12.011 -12.515 456 HA ALA 65 HA ALA 65 17.364 12.949 -12.407 457 HB1 ALA 65 HB1 ALA 65 15.017 14.128 -13.886 458 HB2 ALA 65 HB2 ALA 65 16.247 13.073 -14.582 459 HB3 ALA 65 HB3 ALA 65 16.691 14.673 -13.985 460 H MET 66 H MET 66 14.384 13.301 -10.779 461 HA MET 66 HA MET 66 14.715 16.025 -9.953 462 HB2 MET 66 HB2 MET 66 12.978 13.766 -8.978 463 HB3 MET 66 HB3 MET 66 13.019 15.320 -8.155 464 HG2 MET 66 HG2 MET 66 12.293 14.897 -11.042 465 HG3 MET 66 HG3 MET 66 11.149 15.125 -9.722 466 HE1 MET 66 HE1 MET 66 11.893 18.807 -8.612 467 HE2 MET 66 HE2 MET 66 12.579 17.327 -7.940 468 HE3 MET 66 HE3 MET 66 10.869 17.391 -8.369 469 H ASN 67 H ASN 67 15.775 12.941 -8.849 470 HA ASN 67 HA ASN 67 16.635 13.526 -6.255 471 HB2 ASN 67 HB2 ASN 67 18.135 11.746 -8.180 472 HB3 ASN 67 HB3 ASN 67 17.967 11.564 -6.436 473 HD21 ASN 67 HD22 ASN 67 17.281 9.917 -8.899 474 HD22 ASN 67 HD21 ASN 67 15.654 9.404 -8.609 475 H THR 68 H THR 68 18.381 13.633 -9.328 476 HA THR 68 HA THR 68 20.757 14.790 -8.393 477 HB THR 68 HB THR 68 19.610 15.175 -11.156 478 HG1 THR 68 HG1 THR 68 21.248 13.001 -10.836 479 HG21 THR 68 HG21 THR 68 22.437 14.883 -10.131 480 HG22 THR 68 HG22 THR 68 21.680 16.375 -10.691 481 HG23 THR 68 HG23 THR 68 21.977 15.054 -11.823 482 H ALA 69 H ALA 69 17.757 16.190 -9.633 483 HA ALA 69 HA ALA 69 18.599 18.839 -9.891 484 HB1 ALA 69 HB1 ALA 69 16.487 18.007 -10.801 485 HB2 ALA 69 HB2 ALA 69 16.235 19.438 -9.802 486 HB3 ALA 69 HB3 ALA 69 15.848 17.837 -9.167 487 H MET 70 H MET 70 17.102 17.191 -7.103 488 HA MET 70 HA MET 70 17.151 19.416 -5.359 489 HB2 MET 70 HB2 MET 70 15.836 17.387 -4.880 490 HB3 MET 70 HB3 MET 70 17.321 16.469 -4.685 491 HG2 MET 70 HG2 MET 70 17.844 18.310 -2.892 492 HG3 MET 70 HG3 MET 70 16.094 18.493 -2.889 493 HE1 MET 70 HE1 MET 70 14.912 14.919 -1.787 494 HE2 MET 70 HE2 MET 70 15.110 15.490 -3.443 495 HE3 MET 70 HE3 MET 70 14.405 16.552 -2.222 496 H ALA 71 H ALA 71 19.381 16.736 -5.881 497 HA ALA 71 HA ALA 71 21.209 17.243 -3.867 498 HB1 ALA 71 HB1 ALA 71 21.145 15.195 -5.202 499 HB2 ALA 71 HB2 ALA 71 22.765 15.890 -5.139 500 HB3 ALA 71 HB3 ALA 71 21.775 16.085 -6.587 501 H ALA 72 H ALA 72 21.121 18.543 -7.165 502 HA ALA 72 HA ALA 72 23.615 19.860 -7.051 503 HB1 ALA 72 HB1 ALA 72 22.843 21.107 -9.007 504 HB2 ALA 72 HB2 ALA 72 21.203 20.516 -8.737 505 HB3 ALA 72 HB3 ALA 72 22.488 19.386 -9.159 506 H GLU 73 H GLU 73 20.388 20.806 -6.039 507 HA GLU 73 HA GLU 73 21.042 23.558 -5.597 508 HB2 GLU 73 HB2 GLU 73 18.793 21.925 -4.401 509 HB3 GLU 73 HB3 GLU 73 18.898 23.677 -4.434 510 HG2 GLU 73 HG2 GLU 73 18.718 21.938 -6.878 511 HG3 GLU 73 HG3 GLU 73 17.343 22.717 -6.104 512 H VAL 74 H VAL 74 20.856 20.650 -3.599 513 HA VAL 74 HA VAL 74 21.419 21.966 -1.135 514 HB VAL 74 HB VAL 74 21.751 19.036 -1.814 515 HG11 VAL 74 HG11 VAL 74 21.534 18.668 0.594 516 HG12 VAL 74 HG12 VAL 74 21.450 20.410 0.856 517 HG13 VAL 74 HG13 VAL 74 22.929 19.683 0.229 518 HG21 VAL 74 HG21 VAL 74 19.477 19.801 -2.251 519 HG22 VAL 74 HG22 VAL 74 19.392 20.496 -0.633 520 HG23 VAL 74 HG23 VAL 74 19.524 18.751 -0.834 521 H ALA 75 H ALA 75 23.378 20.589 -3.670 522 HA ALA 75 HA ALA 75 25.801 20.278 -2.308 523 HB1 ALA 75 HB1 ALA 75 25.427 21.083 -5.189 524 HB2 ALA 75 HB2 ALA 75 25.365 19.429 -4.579 525 HB3 ALA 75 HB3 ALA 75 26.867 20.351 -4.479 526 H GLU 76 H GLU 76 24.236 23.134 -3.569 527 HA GLU 76 HA GLU 76 26.412 24.897 -3.585 528 HB2 GLU 76 HB2 GLU 76 23.468 25.386 -3.145 529 HB3 GLU 76 HB3 GLU 76 24.646 26.681 -3.306 530 HG2 GLU 76 HG2 GLU 76 24.051 24.582 -5.381 531 HG3 GLU 76 HG3 GLU 76 23.466 26.246 -5.397 532 H VAL 77 H VAL 77 23.971 24.358 -1.031 533 HA VAL 77 HA VAL 77 25.224 26.138 0.784 534 HB VAL 77 HB VAL 77 23.763 25.217 2.517 535 HG11 VAL 77 HG11 VAL 77 21.617 25.782 1.481 536 HG12 VAL 77 HG12 VAL 77 22.368 25.682 -0.111 537 HG13 VAL 77 HG13 VAL 77 22.887 26.920 1.034 538 HG21 VAL 77 HG21 VAL 77 22.147 23.452 1.995 539 HG22 VAL 77 HG22 VAL 77 23.807 22.865 1.897 540 HG23 VAL 77 HG23 VAL 77 22.910 23.222 0.422 541 H VAL 78 H VAL 78 25.638 22.738 0.101 542 HA VAL 78 HA VAL 78 27.128 22.176 2.471 543 HB VAL 78 HB VAL 78 26.989 20.689 -0.157 544 HG11 VAL 78 HG11 VAL 78 28.016 18.810 1.039 545 HG12 VAL 78 HG12 VAL 78 28.243 19.840 2.453 546 HG13 VAL 78 HG13 VAL 78 29.100 20.199 0.954 547 HG21 VAL 78 HG21 VAL 78 24.886 20.733 1.071 548 HG22 VAL 78 HG22 VAL 78 25.708 20.169 2.528 549 HG23 VAL 78 HG23 VAL 78 25.593 19.117 1.118 550 H ALA 79 H ALA 79 28.014 23.023 -0.866 551 HA ALA 79 HA ALA 79 30.788 22.739 -0.575 552 HB1 ALA 79 HB1 ALA 79 30.966 24.059 -2.607 553 HB2 ALA 79 HB2 ALA 79 29.291 24.587 -2.426 554 HB3 ALA 79 HB3 ALA 79 29.653 22.889 -2.737 555 H THR 80 H THR 80 28.675 25.226 0.561 556 HA THR 80 HA THR 80 30.683 27.282 0.672 557 HB THR 80 HB THR 80 28.047 27.487 0.551 558 HG1 THR 80 HG1 THR 80 29.932 29.144 0.878 559 HG21 THR 80 HG21 THR 80 27.067 28.078 2.709 560 HG22 THR 80 HG22 THR 80 28.569 27.621 3.516 561 HG23 THR 80 HG23 THR 80 27.605 26.398 2.689 562 H SER 81 H SER 81 30.215 24.535 2.449 563 HA SER 81 HA SER 81 30.834 25.684 5.046 564 HB2 SER 81 HB2 SER 81 30.462 22.781 4.294 565 HB3 SER 81 HB3 SER 81 30.448 23.463 5.920 566 HG SER 81 HG SER 81 28.508 23.580 3.910 567 HA PRO 82 HA PRO 82 35.245 24.929 4.519 568 HB2 PRO 82 HB2 PRO 82 35.266 25.273 7.451 569 HB3 PRO 82 HB3 PRO 82 36.147 26.170 6.212 570 HG2 PRO 82 HG2 PRO 82 34.096 27.266 7.545 571 HG3 PRO 82 HG3 PRO 82 34.400 27.631 5.836 572 HD2 PRO 82 HD2 PRO 82 32.369 25.800 7.054 573 HD3 PRO 82 HD3 PRO 82 32.209 26.906 5.672 574 HA PRO 83 HA PRO 83 35.571 20.629 5.384 575 HB2 PRO 83 HB2 PRO 83 38.231 20.533 6.223 576 HB3 PRO 83 HB3 PRO 83 37.671 20.446 4.550 577 HG2 PRO 83 HG2 PRO 83 38.716 22.785 6.083 578 HG3 PRO 83 HG3 PRO 83 38.971 22.349 4.382 579 HD2 PRO 83 HD2 PRO 83 37.273 24.297 5.069 580 HD3 PRO 83 HD3 PRO 83 36.903 23.187 3.730 581 H GLN 84 H GLN 84 36.650 22.900 7.810 582 HA GLN 84 HA GLN 84 37.049 21.163 9.966 583 HB2 GLN 84 HB2 GLN 84 36.163 24.054 9.948 584 HB3 GLN 84 HB3 GLN 84 36.741 23.190 11.366 585 HG2 GLN 84 HG2 GLN 84 38.915 22.941 10.418 586 HG3 GLN 84 HG3 GLN 84 38.366 23.568 8.865 587 HE21 GLN 84 HE22 GLN 84 39.911 25.186 8.876 588 HE22 GLN 84 HE21 GLN 84 39.793 26.572 9.905 589 H SER 85 H SER 85 34.103 22.451 8.598 590 HA SER 85 HA SER 85 32.583 21.134 10.757 591 HB2 SER 85 HB2 SER 85 31.667 23.524 9.141 592 HB3 SER 85 HB3 SER 85 30.874 22.822 10.552 593 HG SER 85 HG SER 85 32.792 23.410 11.749 594 H TYR 86 H TYR 86 33.482 20.830 7.653 595 HA TYR 86 HA TYR 86 31.106 20.586 6.180 596 HB2 TYR 86 HB2 TYR 86 33.397 20.856 5.226 597 HB3 TYR 86 HB3 TYR 86 33.743 19.193 5.677 598 HD1 TYR 86 HD2 TYR 86 32.423 17.350 4.599 599 HD2 TYR 86 HD1 TYR 86 32.268 21.368 3.219 600 HE1 TYR 86 HE2 TYR 86 31.514 16.574 2.448 601 HE2 TYR 86 HE1 TYR 86 31.360 20.603 1.065 602 HH TYR 86 HH TYR 86 31.338 18.514 -0.296 603 H SER 87 H SER 87 33.079 18.129 7.819 604 HA SER 87 HA SER 87 31.620 15.885 7.038 605 HB2 SER 87 HB2 SER 87 33.033 16.167 9.687 606 HB3 SER 87 HB3 SER 87 32.839 14.714 8.702 607 HG SER 87 HG SER 87 34.634 15.242 7.756 608 H ALA 88 H ALA 88 31.012 18.230 9.556 609 HA ALA 88 HA ALA 88 29.071 16.665 10.963 610 HB1 ALA 88 HB1 ALA 88 30.268 18.464 12.093 611 HB2 ALA 88 HB2 ALA 88 28.529 18.757 12.124 612 HB3 ALA 88 HB3 ALA 88 29.552 19.645 10.995 613 H VAL 89 H VAL 89 29.032 19.043 8.399 614 HA VAL 89 HA VAL 89 26.213 19.313 8.202 615 HB VAL 89 HB VAL 89 28.343 19.780 6.102 616 HG11 VAL 89 HG11 VAL 89 26.163 19.574 5.074 617 HG12 VAL 89 HG12 VAL 89 26.678 21.261 5.049 618 HG13 VAL 89 HG13 VAL 89 25.481 20.722 6.227 619 HG21 VAL 89 HG21 VAL 89 28.678 21.108 8.137 620 HG22 VAL 89 HG22 VAL 89 27.039 21.742 7.986 621 HG23 VAL 89 HG23 VAL 89 28.246 22.113 6.754 622 H LEU 90 H LEU 90 28.611 17.193 6.765 623 HA LEU 90 HA LEU 90 27.181 15.867 4.818 624 HB2 LEU 90 HB2 LEU 90 29.620 15.606 6.019 625 HB3 LEU 90 HB3 LEU 90 28.805 14.180 6.618 626 HG LEU 90 HG LEU 90 29.977 13.474 4.744 627 HD11 LEU 90 HD11 LEU 90 27.707 12.622 4.732 628 HD12 LEU 90 HD12 LEU 90 28.302 12.845 3.086 629 HD13 LEU 90 HD13 LEU 90 27.179 14.012 3.783 630 HD21 LEU 90 HD21 LEU 90 28.911 15.856 3.265 631 HD22 LEU 90 HD22 LEU 90 29.957 14.602 2.596 632 HD23 LEU 90 HD23 LEU 90 30.551 15.653 3.880 633 H ASN 91 H ASN 91 27.524 14.940 8.230 634 HA ASN 91 HA ASN 91 25.767 12.727 8.044 635 HB2 ASN 91 HB2 ASN 91 26.859 14.233 10.425 636 HB3 ASN 91 HB3 ASN 91 25.859 12.790 10.570 637 HD21 ASN 91 HD22 ASN 91 28.652 13.310 11.345 638 HD22 ASN 91 HD21 ASN 91 29.582 12.082 10.563 639 H THR 92 H THR 92 25.323 16.072 9.026 640 HA THR 92 HA THR 92 22.749 15.853 10.113 641 HB THR 92 HB THR 92 23.941 18.203 8.614 642 HG1 THR 92 HG1 THR 92 25.254 17.726 10.357 643 HG21 THR 92 HG21 THR 92 21.680 18.079 10.613 644 HG22 THR 92 HG22 THR 92 21.526 18.417 8.889 645 HG23 THR 92 HG23 THR 92 22.374 19.555 9.939 646 H ILE 93 H ILE 93 23.766 16.683 6.797 647 HA ILE 93 HA ILE 93 21.236 16.900 5.648 648 HB ILE 93 HB ILE 93 23.836 15.994 4.411 649 HG12 ILE 93 HG12 ILE 93 23.912 18.255 5.326 650 HG13 ILE 93 HG13 ILE 93 23.939 18.306 3.568 651 HG21 ILE 93 HG21 ILE 93 21.992 15.226 3.034 652 HG22 ILE 93 HG22 ILE 93 22.854 16.546 2.243 653 HG23 ILE 93 HG23 ILE 93 21.301 16.849 3.025 654 HD11 ILE 93 HD11 ILE 93 21.561 18.851 5.332 655 HD12 ILE 93 HD12 ILE 93 21.547 18.854 3.569 656 HD13 ILE 93 HD13 ILE 93 22.510 20.044 4.443 657 H GLY 94 H GLY 94 23.359 14.069 5.863 658 HA2 GLY 94 HA2 GLY 94 21.686 12.295 4.467 659 HA3 GLY 94 HA3 GLY 94 22.950 11.827 5.586 660 H ALA 95 H ALA 95 21.957 12.944 7.919 661 HA ALA 95 HA ALA 95 20.212 10.861 8.727 662 HB1 ALA 95 HB1 ALA 95 21.838 11.885 10.251 663 HB2 ALA 95 HB2 ALA 95 20.199 11.944 10.899 664 HB3 ALA 95 HB3 ALA 95 20.922 13.394 10.203 665 H CYS 96 H CYS 96 19.712 14.367 8.354 666 HA CYS 96 HA CYS 96 17.052 14.396 9.217 667 HB2 CYS 96 HB2 CYS 96 18.499 16.267 7.339 668 HB3 CYS 96 HB3 CYS 96 16.910 16.582 8.029 669 H LEU 97 H LEU 97 18.407 13.853 5.996 670 HA LEU 97 HA LEU 97 15.884 14.004 4.660 671 HB2 LEU 97 HB2 LEU 97 18.240 14.339 3.687 672 HB3 LEU 97 HB3 LEU 97 18.320 12.590 3.615 673 HG LEU 97 HG LEU 97 16.018 13.999 2.312 674 HD11 LEU 97 HD11 LEU 97 18.057 15.157 1.564 675 HD12 LEU 97 HD12 LEU 97 17.282 14.243 0.271 676 HD13 LEU 97 HD13 LEU 97 18.728 13.607 1.056 677 HD21 LEU 97 HD21 LEU 97 15.997 11.558 2.473 678 HD22 LEU 97 HD22 LEU 97 17.561 11.489 1.661 679 HD23 LEU 97 HD23 LEU 97 16.146 12.087 0.798 680 H ARG 98 H ARG 98 17.861 11.398 5.979 681 HA ARG 98 HA ARG 98 16.407 9.248 4.884 682 HB2 ARG 98 HB2 ARG 98 18.599 8.846 5.670 683 HB3 ARG 98 HB3 ARG 98 18.251 9.550 7.241 684 HG2 ARG 98 HG2 ARG 98 16.485 7.374 6.873 685 HG3 ARG 98 HG3 ARG 98 18.113 6.837 6.439 686 HD2 ARG 98 HD2 ARG 98 17.365 8.273 8.977 687 HD3 ARG 98 HD3 ARG 98 17.627 6.534 8.839 688 HE ARG 98 HE ARG 98 19.951 7.449 7.940 689 HH11 ARG 98 HH11 ARG 98 18.065 8.489 10.709 690 HH12 ARG 98 HH12 ARG 98 19.465 8.959 11.633 691 HH21 ARG 98 HH21 ARG 98 21.788 8.065 9.164 692 HH22 ARG 98 HH22 ARG 98 21.570 8.725 10.756 693 H GLU 99 H GLU 99 16.026 11.115 7.850 694 HA GLU 99 HA GLU 99 13.942 9.459 8.915 695 HB2 GLU 99 HB2 GLU 99 14.546 12.354 9.561 696 HB3 GLU 99 HB3 GLU 99 13.612 11.236 10.541 697 HG2 GLU 99 HG2 GLU 99 16.532 10.911 9.912 698 HG3 GLU 99 HG3 GLU 99 15.904 11.672 11.370 699 H SER 100 H SER 100 13.981 12.698 7.468 700 HA SER 100 HA SER 100 11.264 13.198 7.611 701 HB2 SER 100 HB2 SER 100 11.687 14.858 5.770 702 HB3 SER 100 HB3 SER 100 12.758 14.997 7.163 703 HG SER 100 HG SER 100 14.399 14.263 6.005 704 H MET 101 H MET 101 13.052 11.475 5.110 705 HA MET 101 HA MET 101 11.140 11.430 3.106 706 HB2 MET 101 HB2 MET 101 13.493 10.602 2.916 707 HB3 MET 101 HB3 MET 101 12.993 9.151 3.781 708 HG2 MET 101 HG2 MET 101 11.370 8.685 2.079 709 HG3 MET 101 HG3 MET 101 11.832 10.144 1.215 710 HE1 MET 101 HE1 MET 101 11.658 7.387 -0.168 711 HE2 MET 101 HE2 MET 101 13.081 7.565 -1.202 712 HE3 MET 101 HE3 MET 101 12.055 8.962 -0.849 713 H MET 102 H MET 102 11.553 9.170 5.851 714 HA MET 102 HA MET 102 9.181 7.721 4.989 715 HB2 MET 102 HB2 MET 102 9.650 6.145 6.703 716 HB3 MET 102 HB3 MET 102 11.171 6.531 5.918 717 HG2 MET 102 HG2 MET 102 11.773 7.990 7.766 718 HG3 MET 102 HG3 MET 102 10.226 7.651 8.547 719 HE1 MET 102 HE1 MET 102 10.608 3.716 9.047 720 HE2 MET 102 HE2 MET 102 10.075 4.499 7.558 721 HE3 MET 102 HE3 MET 102 9.484 5.074 9.118 722 H GLN 103 H GLN 103 9.955 10.326 7.019 723 HA GLN 103 HA GLN 103 7.777 10.179 8.829 724 HB2 GLN 103 HB2 GLN 103 9.757 12.166 8.083 725 HB3 GLN 103 HB3 GLN 103 8.186 12.892 8.364 726 HG2 GLN 103 HG2 GLN 103 9.439 12.942 10.394 727 HG3 GLN 103 HG3 GLN 103 8.102 11.809 10.567 728 HE21 GLN 103 HE22 GLN 103 8.534 9.609 10.687 729 HE22 GLN 103 HE21 GLN 103 10.113 9.007 11.059 730 H ALA 104 H ALA 104 8.027 11.091 5.502 731 HA ALA 104 HA ALA 104 5.620 12.595 5.351 732 HB1 ALA 104 HB1 ALA 104 7.106 11.155 3.153 733 HB2 ALA 104 HB2 ALA 104 7.419 12.803 3.689 734 HB3 ALA 104 HB3 ALA 104 5.877 12.401 2.935 735 H THR 105 H THR 105 6.344 9.414 3.921 736 HA THR 105 HA THR 105 4.360 7.842 4.848 737 HB THR 105 HB THR 105 2.737 9.618 4.192 738 HG1 THR 105 HG1 THR 105 1.265 8.169 3.361 739 HG21 THR 105 HG21 THR 105 2.222 9.989 1.839 740 HG22 THR 105 HG22 THR 105 3.522 8.893 1.368 741 HG23 THR 105 HG23 THR 105 3.902 10.413 2.180 742 H GLY 106 H GLY 106 6.357 8.871 2.264 743 HA2 GLY 106 HA2 GLY 106 5.815 6.586 0.567 744 HA3 GLY 106 HA3 GLY 106 6.947 7.891 0.242 745 H SER 107 H SER 107 7.225 6.434 3.349 746 HA SER 107 HA SER 107 8.839 5.219 4.337 747 HB2 SER 107 HB2 SER 107 8.997 3.897 1.625 748 HB3 SER 107 HB3 SER 107 9.734 3.272 3.099 749 HG SER 107 HG SER 107 7.206 3.019 2.226 750 H VAL 108 H VAL 108 11.276 4.458 3.934 751 HA VAL 108 HA VAL 108 12.619 6.670 2.566 752 HB VAL 108 HB VAL 108 12.980 6.950 4.898 753 HG11 VAL 108 HG11 VAL 108 12.368 4.737 5.674 754 HG12 VAL 108 HG12 VAL 108 13.916 5.239 6.356 755 HG13 VAL 108 HG13 VAL 108 13.874 4.081 5.027 756 HG21 VAL 108 HG21 VAL 108 15.425 5.662 3.697 757 HG22 VAL 108 HG22 VAL 108 15.407 6.738 5.095 758 HG23 VAL 108 HG23 VAL 108 14.933 7.346 3.509 759 H ASP 109 H ASP 109 13.239 5.903 0.706 760 HA ASP 109 HA ASP 109 13.745 3.137 0.223 761 HB2 ASP 109 HB2 ASP 109 12.712 4.505 -1.498 762 HB3 ASP 109 HB3 ASP 109 14.115 5.566 -1.541 763 H ASN 110 H ASN 110 15.643 2.138 -0.383 764 HA ASN 110 HA ASN 110 17.901 3.044 1.125 765 HB2 ASN 110 HB2 ASN 110 18.877 0.914 0.659 766 HB3 ASN 110 HB3 ASN 110 17.161 0.638 0.925 767 HD21 ASN 110 HD22 ASN 110 15.849 0.056 -0.823 768 HD22 ASN 110 HD21 ASN 110 16.512 -0.514 -2.314 769 H ALA 111 H ALA 111 16.960 3.254 -2.193 770 HA ALA 111 HA ALA 111 19.716 3.675 -3.079 771 HB1 ALA 111 HB1 ALA 111 18.285 2.257 -4.459 772 HB2 ALA 111 HB2 ALA 111 18.773 3.708 -5.335 773 HB3 ALA 111 HB3 ALA 111 17.147 3.590 -4.662 774 H PHE 112 H PHE 112 16.606 5.366 -2.925 775 HA PHE 112 HA PHE 112 17.307 7.752 -4.151 776 HB2 PHE 112 HB2 PHE 112 15.010 7.235 -3.534 777 HB3 PHE 112 HB3 PHE 112 15.426 7.305 -1.826 778 HD1 PHE 112 HD2 PHE 112 15.172 9.349 -4.902 779 HD2 PHE 112 HD1 PHE 112 15.355 9.339 -0.651 780 HE1 PHE 112 HE2 PHE 112 14.601 11.739 -4.870 781 HE2 PHE 112 HE1 PHE 112 14.783 11.729 -0.618 782 HZ PHE 112 HZ PHE 112 14.405 12.930 -2.730 783 H THR 113 H THR 113 17.379 7.081 -0.647 784 HA THR 113 HA THR 113 18.503 9.519 0.125 785 HB THR 113 HB THR 113 19.263 8.232 2.184 786 HG1 THR 113 HG1 THR 113 17.691 6.073 1.333 787 HG21 THR 113 HG21 THR 113 16.968 7.856 2.984 788 HG22 THR 113 HG22 THR 113 16.376 7.966 1.325 789 HG23 THR 113 HG23 THR 113 17.107 9.375 2.096 790 H ASN 114 H ASN 114 20.000 6.473 -0.764 791 HA ASN 114 HA ASN 114 22.672 7.162 -0.201 792 HB2 ASN 114 HB2 ASN 114 22.137 4.862 -0.419 793 HB3 ASN 114 HB3 ASN 114 21.384 5.105 -1.990 794 HD21 ASN 114 HD22 ASN 114 22.619 5.106 -3.803 795 HD22 ASN 114 HD21 ASN 114 24.302 4.727 -3.807 796 H GLU 115 H GLU 115 20.791 7.310 -3.226 797 HA GLU 115 HA GLU 115 22.857 8.080 -4.908 798 HB2 GLU 115 HB2 GLU 115 20.573 7.161 -5.482 799 HB3 GLU 115 HB3 GLU 115 19.931 8.767 -5.165 800 HG2 GLU 115 HG2 GLU 115 21.283 9.685 -6.892 801 HG3 GLU 115 HG3 GLU 115 22.037 8.124 -7.183 802 H VAL 116 H VAL 116 20.366 10.031 -3.257 803 HA VAL 116 HA VAL 116 21.246 12.540 -4.155 804 HB VAL 116 HB VAL 116 19.846 11.866 -1.558 805 HG11 VAL 116 HG11 VAL 116 20.117 14.509 -2.990 806 HG12 VAL 116 HG12 VAL 116 20.868 14.075 -1.456 807 HG13 VAL 116 HG13 VAL 116 19.114 14.208 -1.571 808 HG21 VAL 116 HG21 VAL 116 17.806 12.526 -2.765 809 HG22 VAL 116 HG22 VAL 116 18.588 11.125 -3.497 810 HG23 VAL 116 HG23 VAL 116 18.757 12.716 -4.240 811 H MET 117 H MET 117 22.129 10.683 -1.262 812 HA MET 117 HA MET 117 23.752 12.554 -0.002 813 HB2 MET 117 HB2 MET 117 23.589 9.587 0.001 814 HB3 MET 117 HB3 MET 117 25.044 10.306 0.673 815 HG2 MET 117 HG2 MET 117 22.423 11.357 1.583 816 HG3 MET 117 HG3 MET 117 22.923 9.765 2.150 817 HE1 MET 117 HE1 MET 117 25.027 13.090 1.418 818 HE2 MET 117 HE2 MET 117 25.141 13.722 3.060 819 HE3 MET 117 HE3 MET 117 23.569 13.621 2.260 820 H GLN 118 H GLN 118 24.689 10.084 -2.383 821 HA GLN 118 HA GLN 118 27.421 10.843 -2.436 822 HB2 GLN 118 HB2 GLN 118 26.715 8.620 -3.132 823 HB3 GLN 118 HB3 GLN 118 25.778 9.302 -4.453 824 HG2 GLN 118 HG2 GLN 118 27.731 9.965 -5.618 825 HG3 GLN 118 HG3 GLN 118 28.756 9.647 -4.219 826 HE21 GLN 118 HE22 GLN 118 28.890 8.590 -6.959 827 HE22 GLN 118 HE21 GLN 118 28.834 6.870 -6.792 828 H LEU 119 H LEU 119 24.641 11.672 -4.463 829 HA LEU 119 HA LEU 119 25.996 13.127 -6.418 830 HB2 LEU 119 HB2 LEU 119 23.204 13.163 -5.369 831 HB3 LEU 119 HB3 LEU 119 23.710 14.384 -6.519 832 HG LEU 119 HG LEU 119 24.088 11.467 -7.120 833 HD11 LEU 119 HD11 LEU 119 21.625 13.116 -7.697 834 HD12 LEU 119 HD12 LEU 119 21.721 11.788 -6.543 835 HD13 LEU 119 HD13 LEU 119 21.937 11.476 -8.265 836 HD21 LEU 119 HD21 LEU 119 23.957 12.280 -9.426 837 HD22 LEU 119 HD22 LEU 119 25.251 13.066 -8.525 838 HD23 LEU 119 HD23 LEU 119 23.743 13.925 -8.828 839 H VAL 120 H VAL 120 24.464 14.313 -3.413 840 HA VAL 120 HA VAL 120 25.037 17.019 -3.777 841 HB VAL 120 HB VAL 120 24.904 15.518 -1.152 842 HG11 VAL 120 HG11 VAL 120 24.681 18.474 -1.722 843 HG12 VAL 120 HG12 VAL 120 26.003 17.672 -0.874 844 HG13 VAL 120 HG13 VAL 120 24.391 17.708 -0.161 845 HG21 VAL 120 HG21 VAL 120 22.867 15.293 -2.476 846 HG22 VAL 120 HG22 VAL 120 22.782 17.047 -2.656 847 HG23 VAL 120 HG23 VAL 120 22.592 16.312 -1.062 848 H LYS 121 H LYS 121 27.017 14.473 -2.304 849 HA LYS 121 HA LYS 121 29.160 16.170 -1.547 850 HB2 LYS 121 HB2 LYS 121 28.730 13.248 -1.802 851 HB3 LYS 121 HB3 LYS 121 30.392 13.812 -1.780 852 HG2 LYS 121 HG2 LYS 121 29.539 13.130 0.431 853 HG3 LYS 121 HG3 LYS 121 30.108 14.794 0.371 854 HD2 LYS 121 HD2 LYS 121 27.211 14.269 -0.087 855 HD3 LYS 121 HD3 LYS 121 27.839 14.144 1.556 856 HE2 LYS 121 HE2 LYS 121 28.848 16.443 1.196 857 HE3 LYS 121 HE3 LYS 121 27.869 16.541 -0.265 858 HZ1 LYS 121 HZ1 LYS 121 26.841 16.151 2.488 859 HZ2 LYS 121 HZ2 LYS 121 25.893 16.222 1.089 860 HZ3 LYS 121 HZ3 LYS 121 26.760 17.583 1.591 861 H MET 122 H MET 122 28.712 14.043 -4.348 862 HA MET 122 HA MET 122 31.218 14.568 -5.506 863 HB2 MET 122 HB2 MET 122 30.064 12.603 -6.148 864 HB3 MET 122 HB3 MET 122 28.624 13.501 -6.593 865 HG2 MET 122 HG2 MET 122 31.038 14.201 -8.106 866 HG3 MET 122 HG3 MET 122 30.451 12.555 -8.340 867 HE1 MET 122 HE1 MET 122 28.149 11.915 -9.314 868 HE2 MET 122 HE2 MET 122 26.875 13.058 -9.728 869 HE3 MET 122 HE3 MET 122 27.309 12.796 -8.039 870 H LEU 123 H LEU 123 28.271 16.368 -5.545 871 HA LEU 123 HA LEU 123 29.144 18.015 -7.784 872 HB2 LEU 123 HB2 LEU 123 26.637 18.089 -6.110 873 HB3 LEU 123 HB3 LEU 123 26.955 19.153 -7.466 874 HG LEU 123 HG LEU 123 26.798 16.147 -7.694 875 HD11 LEU 123 HD11 LEU 123 24.645 17.009 -6.991 876 HD12 LEU 123 HD12 LEU 123 24.584 16.517 -8.684 877 HD13 LEU 123 HD13 LEU 123 24.692 18.228 -8.266 878 HD21 LEU 123 HD21 LEU 123 28.106 17.197 -9.446 879 HD22 LEU 123 HD22 LEU 123 26.802 18.342 -9.763 880 HD23 LEU 123 HD23 LEU 123 26.568 16.625 -10.090 881 H SER 124 H SER 124 30.054 17.946 -4.689 882 HA SER 124 HA SER 124 30.337 20.876 -4.588 883 HB2 SER 124 HB2 SER 124 30.103 20.725 -2.074 884 HB3 SER 124 HB3 SER 124 28.620 20.451 -2.984 885 HG SER 124 HG SER 124 28.750 18.298 -2.573 886 H ALA 125 H ALA 125 31.420 17.925 -2.922 887 HA ALA 125 HA ALA 125 34.178 18.478 -3.547 888 HB1 ALA 125 HB1 ALA 125 33.841 19.926 -1.596 889 HB2 ALA 125 HB2 ALA 125 34.949 18.603 -1.236 890 HB3 ALA 125 HB3 ALA 125 33.281 18.537 -0.664 891 H ASP 126 H ASP 126 34.828 16.536 -4.175 892 HA ASP 126 HA ASP 126 33.313 14.211 -3.478 893 HB2 ASP 126 HB2 ASP 126 34.058 14.543 -5.768 894 HB3 ASP 126 HB3 ASP 126 35.735 14.561 -5.246 895 H SER 127 H SER 127 36.117 15.642 -2.304 896 HA SER 127 HA SER 127 36.949 13.123 -1.018 897 HB2 SER 127 HB2 SER 127 38.687 15.488 -1.760 898 HB3 SER 127 HB3 SER 127 39.238 13.989 -1.012 899 HG SER 127 HG SER 127 38.457 12.891 -2.896 900 H ALA 128 H ALA 128 35.234 15.686 -0.263 901 HA ALA 128 HA ALA 128 36.670 16.470 2.139 902 HB1 ALA 128 HB1 ALA 128 35.581 18.214 0.821 903 HB2 ALA 128 HB2 ALA 128 34.912 18.122 2.451 904 HB3 ALA 128 HB3 ALA 128 34.018 17.440 1.092 905 H ASN 129 H ASN 129 36.621 14.779 3.493 906 HA ASN 129 HA ASN 129 34.123 14.394 4.916 907 HB2 ASN 129 HB2 ASN 129 34.055 12.537 3.319 908 HB3 ASN 129 HB3 ASN 129 35.683 12.055 3.783 909 HD21 ASN 129 HD22 ASN 129 36.012 11.037 5.770 910 HD22 ASN 129 HD21 ASN 129 34.715 10.368 6.692 911 H GLU 130 H GLU 130 37.523 13.869 4.565 912 HA GLU 130 HA GLU 130 39.275 13.804 5.961 913 HB2 GLU 130 HB2 GLU 130 38.286 15.790 7.019 914 HB3 GLU 130 HB3 GLU 130 37.348 14.750 8.083 915 HG2 GLU 130 HG2 GLU 130 39.313 15.640 9.212 916 HG3 GLU 130 HG3 GLU 130 39.397 13.885 9.070 917 H VAL 131 H VAL 131 39.806 11.751 6.005 918 HA VAL 131 HA VAL 131 39.318 10.229 8.358 919 HB VAL 131 HB VAL 131 37.245 9.719 7.127 920 HG11 VAL 131 HG11 VAL 131 39.063 8.616 4.994 921 HG12 VAL 131 HG12 VAL 131 38.013 10.026 4.853 922 HG13 VAL 131 HG13 VAL 131 37.311 8.421 5.050 923 HG21 VAL 131 HG21 VAL 131 37.413 7.265 7.207 924 HG22 VAL 131 HG22 VAL 131 38.162 8.035 8.608 925 HG23 VAL 131 HG23 VAL 131 39.170 7.406 7.303 926 H SER 132 H SER 132 40.952 8.764 8.665 927 HA SER 132 HA SER 132 43.193 9.066 6.881 928 HB2 SER 132 HB2 SER 132 42.973 7.481 9.447 929 HB3 SER 132 HB3 SER 132 44.465 7.915 8.610 930 HG SER 132 HG SER 132 43.566 10.175 8.866 931 H THR 133 H THR 133 41.754 7.938 5.227 932 HA THR 133 HA THR 133 42.823 5.241 4.967 933 HB THR 133 HB THR 133 40.495 4.748 3.780 934 HG1 THR 133 HG1 THR 133 39.147 5.883 5.777 935 HG21 THR 133 HG21 THR 133 39.718 3.679 5.860 936 HG22 THR 133 HG22 THR 133 40.924 4.591 6.766 937 HG23 THR 133 HG23 THR 133 41.434 3.399 5.571 Start of MODEL 10 1 HA2 GLY 1 HA2 GLY 1 13.427 -4.155 2.684 2 HA3 GLY 1 HA3 GLY 1 14.897 -3.529 1.950 3 H SER 2 H SER 2 13.703 -1.484 2.612 4 HA SER 2 HA SER 2 11.467 -0.656 1.060 5 HB2 SER 2 HB2 SER 2 13.477 1.040 2.564 6 HB3 SER 2 HB3 SER 2 11.876 1.551 2.022 7 HG SER 2 HG SER 2 11.106 -0.282 3.371 8 H GLY 3 H GLY 3 11.561 -0.360 -1.066 9 HA2 GLY 3 HA2 GLY 3 13.020 1.608 -2.320 10 HA3 GLY 3 HA3 GLY 3 13.999 0.156 -2.454 11 H ASN 4 H ASN 4 11.202 1.828 -3.539 12 HA ASN 4 HA ASN 4 10.459 -0.409 -5.293 13 HB2 ASN 4 HB2 ASN 4 8.332 0.775 -5.642 14 HB3 ASN 4 HB3 ASN 4 8.615 0.476 -3.933 15 HD21 ASN 4 HD22 ASN 4 6.954 2.465 -5.334 16 HD22 ASN 4 HD21 ASN 4 7.465 4.003 -4.722 17 H SER 5 H SER 5 9.288 0.831 -7.392 18 HA SER 5 HA SER 5 11.616 2.057 -8.654 19 HB2 SER 5 HB2 SER 5 10.185 1.594 -10.766 20 HB3 SER 5 HB3 SER 5 10.894 0.224 -9.915 21 HG SER 5 HG SER 5 8.450 0.391 -10.527 22 H GLN 6 H GLN 6 8.999 3.159 -7.088 23 HA GLN 6 HA GLN 6 8.921 5.604 -8.699 24 HB2 GLN 6 HB2 GLN 6 6.654 4.409 -7.090 25 HB3 GLN 6 HB3 GLN 6 6.606 5.977 -7.883 26 HG2 GLN 6 HG2 GLN 6 7.051 3.393 -9.352 27 HG3 GLN 6 HG3 GLN 6 5.462 4.107 -9.095 28 HE21 GLN 6 HE22 GLN 6 8.515 4.411 -10.739 29 HE22 GLN 6 HE21 GLN 6 7.991 5.582 -11.901 30 HA PRO 7 HA PRO 7 10.744 6.443 -4.607 31 HB2 PRO 7 HB2 PRO 7 12.465 8.370 -5.394 32 HB3 PRO 7 HB3 PRO 7 12.782 6.648 -5.638 33 HG2 PRO 7 HG2 PRO 7 11.766 8.682 -7.578 34 HG3 PRO 7 HG3 PRO 7 12.958 7.395 -7.829 35 HD2 PRO 7 HD2 PRO 7 10.345 7.204 -8.605 36 HD3 PRO 7 HD3 PRO 7 11.346 5.803 -8.177 37 H ILE 8 H ILE 8 8.355 7.340 -4.571 38 HA ILE 8 HA ILE 8 7.062 8.736 -3.396 39 HB ILE 8 HB ILE 8 9.074 8.779 -1.880 40 HG12 ILE 8 HG12 ILE 8 7.555 11.365 -1.715 41 HG13 ILE 8 HG13 ILE 8 6.733 9.823 -1.474 42 HG21 ILE 8 HG21 ILE 8 10.577 10.133 -3.237 43 HG22 ILE 8 HG22 ILE 8 10.297 10.886 -1.667 44 HG23 ILE 8 HG23 ILE 8 9.479 11.507 -3.100 45 HD11 ILE 8 HD11 ILE 8 9.048 10.883 0.127 46 HD12 ILE 8 HD12 ILE 8 8.264 9.321 0.370 47 HD13 ILE 8 HD13 ILE 8 7.361 10.813 0.638 48 H TRP 9 H TRP 9 8.910 10.074 -5.924 49 HA TRP 9 HA TRP 9 7.956 12.742 -5.782 50 HB2 TRP 9 HB2 TRP 9 9.181 11.156 -8.024 51 HB3 TRP 9 HB3 TRP 9 8.766 12.859 -8.168 52 HD1 TRP 9 HD1 TRP 9 11.537 10.663 -7.290 53 HE1 TRP 9 HE1 TRP 9 13.424 11.973 -6.135 54 HE3 TRP 9 HE3 TRP 9 8.990 14.954 -6.230 55 HZ2 TRP 9 HZ2 TRP 9 13.776 14.500 -4.903 56 HZ3 TRP 9 HZ3 TRP 9 10.159 16.771 -5.051 57 HH2 TRP 9 HH2 TRP 9 12.507 16.543 -4.401 58 H THR 10 H THR 10 6.236 9.987 -6.481 59 HA THR 10 HA THR 10 4.635 11.110 -8.595 60 HB THR 10 HB THR 10 5.002 8.727 -8.673 61 HG1 THR 10 HG1 THR 10 2.406 9.640 -8.089 62 HG21 THR 10 HG21 THR 10 5.357 8.315 -6.280 63 HG22 THR 10 HG22 THR 10 4.151 7.215 -6.949 64 HG23 THR 10 HG23 THR 10 3.643 8.595 -5.978 65 H ASN 11 H ASN 11 4.782 11.491 -5.289 66 HA ASN 11 HA ASN 11 2.026 12.503 -5.253 67 HB2 ASN 11 HB2 ASN 11 2.042 10.424 -3.961 68 HB3 ASN 11 HB3 ASN 11 3.389 11.015 -2.996 69 HD21 ASN 11 HD22 ASN 11 2.092 10.669 -1.146 70 HD22 ASN 11 HD21 ASN 11 0.866 11.808 -0.696 71 HA PRO 12 HA PRO 12 4.644 16.109 -4.732 72 HB2 PRO 12 HB2 PRO 12 1.914 17.290 -4.524 73 HB3 PRO 12 HB3 PRO 12 3.300 17.820 -5.486 74 HG2 PRO 12 HG2 PRO 12 1.271 16.538 -6.634 75 HG3 PRO 12 HG3 PRO 12 2.946 16.214 -7.124 76 HD2 PRO 12 HD2 PRO 12 1.111 14.571 -5.440 77 HD3 PRO 12 HD3 PRO 12 2.347 14.056 -6.604 78 H ASN 13 H ASN 13 1.736 15.564 -2.750 79 HA ASN 13 HA ASN 13 2.391 17.302 -0.665 80 HB2 ASN 13 HB2 ASN 13 0.167 16.296 -0.886 81 HB3 ASN 13 HB3 ASN 13 0.834 14.709 -0.518 82 HD21 ASN 13 HD22 ASN 13 -0.081 17.805 0.756 83 HD22 ASN 13 HD21 ASN 13 0.014 17.373 2.429 84 H ALA 14 H ALA 14 3.203 13.903 -1.155 85 HA ALA 14 HA ALA 14 4.436 13.554 1.388 86 HB1 ALA 14 HB1 ALA 14 4.782 11.932 -1.130 87 HB2 ALA 14 HB2 ALA 14 3.526 11.680 0.083 88 HB3 ALA 14 HB3 ALA 14 5.221 11.433 0.503 89 H ALA 15 H ALA 15 5.644 14.196 -1.872 90 HA ALA 15 HA ALA 15 8.374 14.024 -1.256 91 HB1 ALA 15 HB1 ALA 15 7.515 13.947 -3.542 92 HB2 ALA 15 HB2 ALA 15 8.749 15.193 -3.360 93 HB3 ALA 15 HB3 ALA 15 7.044 15.642 -3.424 94 H MET 16 H MET 16 6.165 16.825 -1.300 95 HA MET 16 HA MET 16 8.150 18.684 -0.523 96 HB2 MET 16 HB2 MET 16 5.278 18.707 -0.945 97 HB3 MET 16 HB3 MET 16 5.766 19.732 0.400 98 HG2 MET 16 HG2 MET 16 6.836 19.863 -2.407 99 HG3 MET 16 HG3 MET 16 5.667 20.964 -1.689 100 HE1 MET 16 HE1 MET 16 10.142 21.276 -1.614 101 HE2 MET 16 HE2 MET 16 9.036 20.694 -2.857 102 HE3 MET 16 HE3 MET 16 9.440 19.666 -1.484 103 H THR 17 H THR 17 6.114 16.490 1.284 104 HA THR 17 HA THR 17 6.409 17.605 3.837 105 HB THR 17 HB THR 17 6.229 14.675 3.082 106 HG1 THR 17 HG1 THR 17 4.427 16.043 2.459 107 HG21 THR 17 HG21 THR 17 5.822 16.053 5.740 108 HG22 THR 17 HG22 THR 17 7.080 14.883 5.337 109 HG23 THR 17 HG23 THR 17 5.390 14.380 5.401 110 H MET 18 H MET 18 8.473 15.339 2.049 111 HA MET 18 HA MET 18 10.453 14.956 4.003 112 HB2 MET 18 HB2 MET 18 11.093 15.197 1.076 113 HB3 MET 18 HB3 MET 18 11.871 14.184 2.276 114 HG2 MET 18 HG2 MET 18 9.872 12.778 2.362 115 HG3 MET 18 HG3 MET 18 9.124 13.791 1.127 116 HE1 MET 18 HE1 MET 18 11.795 14.489 -0.598 117 HE2 MET 18 HE2 MET 18 10.241 14.127 -1.351 118 HE3 MET 18 HE3 MET 18 11.688 13.264 -1.863 119 H THR 19 H THR 19 10.316 17.202 1.291 120 HA THR 19 HA THR 19 12.824 18.353 1.660 121 HB THR 19 HB THR 19 10.536 19.834 0.394 122 HG1 THR 19 HG1 THR 19 10.307 17.784 -0.473 123 HG21 THR 19 HG21 THR 19 12.813 20.842 0.492 124 HG22 THR 19 HG22 THR 19 12.238 20.563 -1.151 125 HG23 THR 19 HG23 THR 19 13.413 19.461 -0.431 126 H ASN 20 H ASN 20 9.627 19.430 2.825 127 HA ASN 20 HA ASN 20 10.552 21.869 3.920 128 HB2 ASN 20 HB2 ASN 20 8.093 20.201 4.347 129 HB3 ASN 20 HB3 ASN 20 8.424 21.571 5.400 130 HD21 ASN 20 HD22 ASN 20 7.489 20.548 2.238 131 HD22 ASN 20 HD21 ASN 20 7.080 22.117 1.627 132 H ASN 21 H ASN 21 10.133 18.629 5.274 133 HA ASN 21 HA ASN 21 10.898 19.314 7.904 134 HB2 ASN 21 HB2 ASN 21 10.769 16.721 6.390 135 HB3 ASN 21 HB3 ASN 21 11.452 16.783 8.008 136 HD21 ASN 21 HD22 ASN 21 9.084 15.410 7.040 137 HD22 ASN 21 HD21 ASN 21 7.766 16.002 7.987 138 H LEU 22 H LEU 22 12.688 18.297 5.061 139 HA LEU 22 HA LEU 22 15.190 17.865 6.223 140 HB2 LEU 22 HB2 LEU 22 14.721 17.268 3.921 141 HB3 LEU 22 HB3 LEU 22 14.466 18.950 3.502 142 HG LEU 22 HG LEU 22 16.869 19.386 4.026 143 HD11 LEU 22 HD11 LEU 22 17.007 16.381 4.206 144 HD12 LEU 22 HD12 LEU 22 17.268 17.518 5.527 145 HD13 LEU 22 HD13 LEU 22 18.388 17.475 4.167 146 HD21 LEU 22 HD21 LEU 22 16.147 19.086 1.740 147 HD22 LEU 22 HD22 LEU 22 16.262 17.335 1.903 148 HD23 LEU 22 HD23 LEU 22 17.720 18.325 1.970 149 H VAL 23 H VAL 23 13.804 20.820 4.829 150 HA VAL 23 HA VAL 23 15.986 22.502 5.403 151 HB VAL 23 HB VAL 23 13.069 23.254 5.114 152 HG11 VAL 23 HG11 VAL 23 14.347 25.030 6.183 153 HG12 VAL 23 HG12 VAL 23 13.903 25.485 4.538 154 HG13 VAL 23 HG13 VAL 23 15.549 24.960 4.893 155 HG21 VAL 23 HG21 VAL 23 13.647 23.775 2.793 156 HG22 VAL 23 HG22 VAL 23 13.914 22.071 3.159 157 HG23 VAL 23 HG23 VAL 23 15.283 23.178 3.066 158 H GLN 24 H GLN 24 13.005 21.816 7.225 159 HA GLN 24 HA GLN 24 13.585 23.735 9.242 160 HB2 GLN 24 HB2 GLN 24 11.652 22.954 10.376 161 HB3 GLN 24 HB3 GLN 24 11.293 22.870 8.662 162 HG2 GLN 24 HG2 GLN 24 10.576 20.821 9.048 163 HG3 GLN 24 HG3 GLN 24 12.270 20.363 9.223 164 HE21 GLN 24 HE22 GLN 24 9.318 21.132 10.872 165 HE22 GLN 24 HE21 GLN 24 9.793 20.536 12.425 166 H CYS 25 H CYS 25 14.267 20.306 8.879 167 HA CYS 25 HA CYS 25 15.158 19.832 11.515 168 HB2 CYS 25 HB2 CYS 25 14.655 17.981 10.031 169 HB3 CYS 25 HB3 CYS 25 15.914 18.491 8.910 170 H ALA 26 H ALA 26 16.941 20.688 8.556 171 HA ALA 26 HA ALA 26 19.473 20.773 9.817 172 HB1 ALA 26 HB1 ALA 26 19.095 20.524 7.368 173 HB2 ALA 26 HB2 ALA 26 20.282 21.754 7.794 174 HB3 ALA 26 HB3 ALA 26 18.654 22.231 7.312 175 H SER 27 H SER 27 16.877 23.050 9.552 176 HA SER 27 HA SER 27 18.381 25.374 10.281 177 HB2 SER 27 HB2 SER 27 16.219 25.461 9.039 178 HB3 SER 27 HB3 SER 27 15.402 24.875 10.490 179 HG SER 27 HG SER 27 16.963 27.251 10.405 180 H ARG 28 H ARG 28 17.143 22.698 11.974 181 HA ARG 28 HA ARG 28 17.303 24.143 14.538 182 HB2 ARG 28 HB2 ARG 28 15.698 21.675 13.844 183 HB3 ARG 28 HB3 ARG 28 15.741 22.457 15.418 184 HG2 ARG 28 HG2 ARG 28 14.747 23.754 12.891 185 HG3 ARG 28 HG3 ARG 28 13.717 22.977 14.092 186 HD2 ARG 28 HD2 ARG 28 15.568 25.287 14.666 187 HD3 ARG 28 HD3 ARG 28 13.846 25.450 14.319 188 HE ARG 28 HE ARG 28 14.384 23.634 16.474 189 HH11 ARG 28 HH11 ARG 28 13.999 27.019 15.651 190 HH12 ARG 28 HH12 ARG 28 13.496 27.476 17.244 191 HH21 ARG 28 HH21 ARG 28 13.698 24.246 18.568 192 HH22 ARG 28 HH22 ARG 28 13.310 25.905 18.894 193 H SER 29 H SER 29 19.340 22.653 12.833 194 HA SER 29 HA SER 29 19.959 20.259 14.277 195 HB2 SER 29 HB2 SER 29 21.986 20.226 12.841 196 HB3 SER 29 HB3 SER 29 20.503 20.435 11.908 197 HG SER 29 HG SER 29 21.082 22.422 11.387 198 H GLY 30 H GLY 30 21.259 23.543 14.148 199 HA2 GLY 30 HA2 GLY 30 22.469 24.639 15.843 200 HA3 GLY 30 HA3 GLY 30 22.694 23.091 16.649 201 H VAL 31 H VAL 31 23.277 22.517 13.513 202 HA VAL 31 HA VAL 31 26.177 22.709 13.909 203 HB VAL 31 HB VAL 31 24.604 21.047 11.931 204 HG11 VAL 31 HG11 VAL 31 26.808 21.581 11.085 205 HG12 VAL 31 HG12 VAL 31 26.729 19.879 11.544 206 HG13 VAL 31 HG13 VAL 31 27.544 21.041 12.593 207 HG21 VAL 31 HG21 VAL 31 25.219 19.138 13.327 208 HG22 VAL 31 HG22 VAL 31 24.247 20.306 14.225 209 HG23 VAL 31 HG23 VAL 31 25.991 20.227 14.481 210 H LEU 32 H LEU 32 23.584 23.568 11.691 211 HA LEU 32 HA LEU 32 25.431 24.714 9.769 212 HB2 LEU 32 HB2 LEU 32 22.416 24.862 9.820 213 HB3 LEU 32 HB3 LEU 32 23.454 25.309 8.482 214 HG LEU 32 HG LEU 32 22.819 22.566 9.510 215 HD11 LEU 32 HD11 LEU 32 22.625 23.862 6.800 216 HD12 LEU 32 HD12 LEU 32 21.284 23.537 7.897 217 HD13 LEU 32 HD13 LEU 32 22.182 22.199 7.177 218 HD21 LEU 32 HD21 LEU 32 24.446 21.673 7.918 219 HD22 LEU 32 HD22 LEU 32 25.227 22.619 9.185 220 HD23 LEU 32 HD23 LEU 32 25.005 23.309 7.577 221 H THR 33 H THR 33 24.585 26.975 8.906 222 HA THR 33 HA THR 33 24.225 28.704 11.265 223 HB THR 33 HB THR 33 26.471 29.009 10.347 224 HG1 THR 33 HG1 THR 33 26.330 31.275 10.042 225 HG21 THR 33 HG21 THR 33 25.080 29.762 7.777 226 HG22 THR 33 HG22 THR 33 26.060 28.320 8.041 227 HG23 THR 33 HG23 THR 33 26.808 29.916 8.094 228 H ALA 34 H ALA 34 23.263 30.872 10.652 229 HA ALA 34 HA ALA 34 20.718 30.491 9.552 230 HB1 ALA 34 HB1 ALA 34 21.253 32.274 11.149 231 HB2 ALA 34 HB2 ALA 34 20.467 32.910 9.704 232 HB3 ALA 34 HB3 ALA 34 22.209 33.093 9.912 233 H ASP 35 H ASP 35 23.724 31.570 8.133 234 HA ASP 35 HA ASP 35 22.736 32.601 5.716 235 HB2 ASP 35 HB2 ASP 35 25.046 32.952 6.480 236 HB3 ASP 35 HB3 ASP 35 25.386 31.241 6.254 237 H GLN 36 H GLN 36 23.714 29.353 6.651 238 HA GLN 36 HA GLN 36 23.335 28.190 4.096 239 HB2 GLN 36 HB2 GLN 36 23.644 27.073 6.863 240 HB3 GLN 36 HB3 GLN 36 23.328 26.029 5.483 241 HG2 GLN 36 HG2 GLN 36 25.359 26.672 4.430 242 HG3 GLN 36 HG3 GLN 36 25.631 27.957 5.608 243 HE21 GLN 36 HE22 GLN 36 27.240 25.597 4.826 244 HE22 GLN 36 HE21 GLN 36 27.563 24.759 6.300 245 H MET 37 H MET 37 21.249 28.853 6.783 246 HA MET 37 HA MET 37 19.198 26.996 6.142 247 HB2 MET 37 HB2 MET 37 19.031 29.577 7.711 248 HB3 MET 37 HB3 MET 37 17.792 28.336 7.667 249 HG2 MET 37 HG2 MET 37 19.362 26.762 8.674 250 HG3 MET 37 HG3 MET 37 20.572 28.044 8.751 251 HE1 MET 37 HE1 MET 37 21.054 28.208 11.159 252 HE2 MET 37 HE2 MET 37 20.173 26.692 11.343 253 HE3 MET 37 HE3 MET 37 19.868 28.029 12.452 254 H ASP 38 H ASP 38 19.825 30.346 5.197 255 HA ASP 38 HA ASP 38 17.291 30.741 3.960 256 HB2 ASP 38 HB2 ASP 38 18.792 32.608 4.674 257 HB3 ASP 38 HB3 ASP 38 19.871 32.196 3.343 258 H ASP 39 H ASP 39 20.453 29.684 2.777 259 HA ASP 39 HA ASP 39 19.743 29.438 0.061 260 HB2 ASP 39 HB2 ASP 39 21.825 28.050 1.740 261 HB3 ASP 39 HB3 ASP 39 21.605 27.670 0.035 262 H MET 40 H MET 40 19.386 27.277 2.809 263 HA MET 40 HA MET 40 18.376 25.045 1.408 264 HB2 MET 40 HB2 MET 40 17.927 26.001 4.239 265 HB3 MET 40 HB3 MET 40 17.315 24.471 3.630 266 HG2 MET 40 HG2 MET 40 20.228 25.204 3.586 267 HG3 MET 40 HG3 MET 40 19.458 24.373 4.937 268 HE1 MET 40 HE1 MET 40 17.433 22.383 3.670 269 HE2 MET 40 HE2 MET 40 18.607 21.960 4.916 270 HE3 MET 40 HE3 MET 40 18.451 20.957 3.472 271 H GLY 41 H GLY 41 16.866 27.952 2.686 272 HA2 GLY 41 HA2 GLY 41 14.176 27.208 2.316 273 HA3 GLY 41 HA3 GLY 41 14.780 28.856 2.391 274 H MET 42 H MET 42 16.370 29.023 0.170 275 HA MET 42 HA MET 42 14.421 29.294 -1.885 276 HB2 MET 42 HB2 MET 42 16.200 30.164 -3.260 277 HB3 MET 42 HB3 MET 42 16.355 30.823 -1.639 278 HG2 MET 42 HG2 MET 42 18.094 29.149 -1.162 279 HG3 MET 42 HG3 MET 42 17.970 28.585 -2.825 280 HE1 MET 42 HE1 MET 42 19.016 31.484 -0.441 281 HE2 MET 42 HE2 MET 42 17.832 32.317 -1.449 282 HE3 MET 42 HE3 MET 42 19.539 32.741 -1.562 283 H MET 43 H MET 43 16.686 26.845 -1.005 284 HA MET 43 HA MET 43 16.774 25.384 -3.407 285 HB2 MET 43 HB2 MET 43 18.321 24.937 -1.593 286 HB3 MET 43 HB3 MET 43 17.004 24.495 -0.524 287 HG2 MET 43 HG2 MET 43 17.493 22.965 -3.042 288 HG3 MET 43 HG3 MET 43 18.454 22.652 -1.603 289 HE1 MET 43 HE1 MET 43 16.308 23.131 0.721 290 HE2 MET 43 HE2 MET 43 17.430 21.770 0.693 291 HE3 MET 43 HE3 MET 43 15.708 21.490 0.949 292 H ALA 44 H ALA 44 14.530 25.353 -0.680 293 HA ALA 44 HA ALA 44 12.964 23.169 -1.447 294 HB1 ALA 44 HB1 ALA 44 12.828 24.208 0.760 295 HB2 ALA 44 HB2 ALA 44 11.239 24.099 0.002 296 HB3 ALA 44 HB3 ALA 44 12.092 25.642 0.045 297 H ASP 45 H ASP 45 12.730 26.591 -2.319 298 HA ASP 45 HA ASP 45 10.316 26.474 -3.751 299 HB2 ASP 45 HB2 ASP 45 11.316 28.603 -3.092 300 HB3 ASP 45 HB3 ASP 45 12.693 28.309 -4.147 301 H SER 46 H SER 46 13.651 25.933 -4.753 302 HA SER 46 HA SER 46 13.240 25.614 -7.494 303 HB2 SER 46 HB2 SER 46 15.455 25.826 -6.345 304 HB3 SER 46 HB3 SER 46 15.258 24.188 -5.736 305 HG SER 46 HG SER 46 16.546 24.475 -7.706 306 H VAL 47 H VAL 47 12.939 23.362 -4.797 307 HA VAL 47 HA VAL 47 12.540 21.055 -6.437 308 HB VAL 47 HB VAL 47 11.923 21.433 -3.501 309 HG11 VAL 47 HG11 VAL 47 12.051 18.988 -3.383 310 HG12 VAL 47 HG12 VAL 47 12.253 18.916 -5.133 311 HG13 VAL 47 HG13 VAL 47 10.747 19.522 -4.443 312 HG21 VAL 47 HG21 VAL 47 14.272 21.851 -3.975 313 HG22 VAL 47 HG22 VAL 47 14.384 20.330 -4.860 314 HG23 VAL 47 HG23 VAL 47 14.079 20.318 -3.124 315 H ASN 48 H ASN 48 10.300 22.944 -4.341 316 HA ASN 48 HA ASN 48 8.101 21.308 -5.023 317 HB2 ASN 48 HB2 ASN 48 6.714 23.106 -3.954 318 HB3 ASN 48 HB3 ASN 48 7.973 22.424 -2.946 319 HD21 ASN 48 HD22 ASN 48 8.280 24.064 -1.582 320 HD22 ASN 48 HD21 ASN 48 8.845 25.629 -2.047 321 H SER 49 H SER 49 9.374 24.211 -6.488 322 HA SER 49 HA SER 49 7.115 24.837 -8.054 323 HB2 SER 49 HB2 SER 49 9.093 26.329 -7.673 324 HB3 SER 49 HB3 SER 49 10.018 25.303 -8.766 325 HG SER 49 HG SER 49 9.125 27.139 -9.811 326 H GLN 50 H GLN 50 10.058 22.987 -8.857 327 HA GLN 50 HA GLN 50 9.219 22.251 -11.446 328 HB2 GLN 50 HB2 GLN 50 11.207 20.971 -9.568 329 HB3 GLN 50 HB3 GLN 50 10.982 20.472 -11.238 330 HG2 GLN 50 HG2 GLN 50 11.688 22.635 -12.026 331 HG3 GLN 50 HG3 GLN 50 11.787 23.238 -10.373 332 HE21 GLN 50 HE22 GLN 50 13.493 22.625 -9.070 333 HE22 GLN 50 HE21 GLN 50 14.913 21.860 -9.707 334 H MET 51 H MET 51 8.776 20.769 -8.296 335 HA MET 51 HA MET 51 7.863 18.251 -9.169 336 HB2 MET 51 HB2 MET 51 8.621 18.736 -6.871 337 HB3 MET 51 HB3 MET 51 7.189 19.723 -6.619 338 HG2 MET 51 HG2 MET 51 5.816 17.682 -7.091 339 HG3 MET 51 HG3 MET 51 7.315 16.755 -7.065 340 HE1 MET 51 HE1 MET 51 4.934 19.076 -5.136 341 HE2 MET 51 HE2 MET 51 6.446 19.862 -4.676 342 HE3 MET 51 HE3 MET 51 5.504 18.981 -3.470 343 H GLN 52 H GLN 52 6.147 21.268 -8.444 344 HA GLN 52 HA GLN 52 3.539 20.181 -8.707 345 HB2 GLN 52 HB2 GLN 52 4.552 23.018 -8.913 346 HB3 GLN 52 HB3 GLN 52 2.847 22.591 -8.971 347 HG2 GLN 52 HG2 GLN 52 2.959 21.679 -6.739 348 HG3 GLN 52 HG3 GLN 52 4.696 21.969 -6.679 349 HE21 GLN 52 HE22 GLN 52 5.458 24.062 -6.452 350 HE22 GLN 52 HE21 GLN 52 4.448 25.359 -5.917 351 H LYS 53 H LYS 53 5.917 21.108 -10.989 352 HA LYS 53 HA LYS 53 3.967 21.221 -13.164 353 HB2 LYS 53 HB2 LYS 53 6.908 21.882 -13.036 354 HB3 LYS 53 HB3 LYS 53 5.985 21.876 -14.530 355 HG2 LYS 53 HG2 LYS 53 4.477 23.579 -13.539 356 HG3 LYS 53 HG3 LYS 53 5.543 23.646 -12.138 357 HD2 LYS 53 HD2 LYS 53 6.499 24.136 -14.947 358 HD3 LYS 53 HD3 LYS 53 5.902 25.422 -13.901 359 HE2 LYS 53 HE2 LYS 53 8.188 23.583 -13.222 360 HE3 LYS 53 HE3 LYS 53 8.371 25.197 -13.907 361 HZ1 LYS 53 HZ1 LYS 53 7.140 24.529 -11.288 362 HZ2 LYS 53 HZ2 LYS 53 7.205 26.079 -11.957 363 HZ3 LYS 53 HZ3 LYS 53 8.634 25.285 -11.536 364 H MET 54 H MET 54 5.473 18.863 -11.565 365 HA MET 54 HA MET 54 6.608 17.363 -13.733 366 HB2 MET 54 HB2 MET 54 7.533 17.052 -11.535 367 HB3 MET 54 HB3 MET 54 5.959 16.633 -10.875 368 HG2 MET 54 HG2 MET 54 6.034 14.508 -11.665 369 HG3 MET 54 HG3 MET 54 6.994 14.947 -13.073 370 HE1 MET 54 HE1 MET 54 8.938 14.764 -8.882 371 HE2 MET 54 HE2 MET 54 7.221 14.401 -9.089 372 HE3 MET 54 HE3 MET 54 7.826 16.022 -9.430 373 H GLY 55 H GLY 55 3.605 17.197 -11.855 374 HA2 GLY 55 HA2 GLY 55 1.518 16.619 -12.810 375 HA3 GLY 55 HA3 GLY 55 2.369 15.816 -14.119 376 HA PRO 56 HA PRO 56 1.389 12.891 -10.286 377 HB2 PRO 56 HB2 PRO 56 -1.447 12.931 -11.145 378 HB3 PRO 56 HB3 PRO 56 -0.766 12.871 -9.514 379 HG2 PRO 56 HG2 PRO 56 -1.885 15.103 -10.443 380 HG3 PRO 56 HG3 PRO 56 -0.431 15.162 -9.429 381 HD2 PRO 56 HD2 PRO 56 -0.685 15.476 -12.396 382 HD3 PRO 56 HD3 PRO 56 0.340 16.365 -11.251 383 H ASN 57 H ASN 57 1.477 10.768 -10.726 384 HA ASN 57 HA ASN 57 1.650 8.831 -11.900 385 HB2 ASN 57 HB2 ASN 57 -0.688 9.981 -13.443 386 HB3 ASN 57 HB3 ASN 57 -0.150 8.308 -13.523 387 HD21 ASN 57 HD22 ASN 57 -1.838 10.695 -11.693 388 HD22 ASN 57 HD21 ASN 57 -2.468 9.633 -10.484 389 HA PRO 58 HA PRO 58 3.575 11.054 -15.537 390 HB2 PRO 58 HB2 PRO 58 5.886 11.933 -14.609 391 HB3 PRO 58 HB3 PRO 58 4.386 12.739 -14.129 392 HG2 PRO 58 HG2 PRO 58 6.104 10.857 -12.585 393 HG3 PRO 58 HG3 PRO 58 5.170 12.251 -12.017 394 HD2 PRO 58 HD2 PRO 58 4.390 9.520 -11.947 395 HD3 PRO 58 HD3 PRO 58 3.382 10.930 -11.563 396 HA PRO 59 HA PRO 59 6.525 7.832 -16.709 397 HB2 PRO 59 HB2 PRO 59 8.245 9.717 -18.096 398 HB3 PRO 59 HB3 PRO 59 7.180 8.487 -18.776 399 HG2 PRO 59 HG2 PRO 59 6.744 11.175 -19.001 400 HG3 PRO 59 HG3 PRO 59 5.459 9.954 -19.061 401 HD2 PRO 59 HD2 PRO 59 6.267 11.758 -16.828 402 HD3 PRO 59 HD3 PRO 59 4.650 11.190 -17.297 403 H GLN 60 H GLN 60 8.739 7.141 -16.287 404 HA GLN 60 HA GLN 60 9.570 8.143 -13.764 405 HB2 GLN 60 HB2 GLN 60 11.027 6.331 -13.628 406 HB3 GLN 60 HB3 GLN 60 9.711 5.727 -14.617 407 HG2 GLN 60 HG2 GLN 60 12.369 6.694 -15.646 408 HG3 GLN 60 HG3 GLN 60 11.907 5.012 -15.419 409 HE21 GLN 60 HE22 GLN 60 12.776 6.303 -17.819 410 HE22 GLN 60 HE21 GLN 60 11.493 6.144 -18.967 411 H HIS 61 H HIS 61 10.385 9.074 -16.939 412 HA HIS 61 HA HIS 61 13.023 9.980 -16.406 413 HB2 HIS 61 HB2 HIS 61 12.972 11.125 -18.487 414 HB3 HIS 61 HB3 HIS 61 12.069 9.640 -18.719 415 HD1 HIS 61 HD1 HIS 61 10.081 9.997 -20.129 416 HD2 HIS 61 HD2 HIS 61 10.960 13.373 -17.866 417 HE1 HIS 61 HE1 HIS 61 8.397 11.733 -20.814 418 H ARG 62 H ARG 62 9.908 11.186 -15.616 419 HA ARG 62 HA ARG 62 10.701 13.897 -15.110 420 HB2 ARG 62 HB2 ARG 62 8.326 12.243 -14.261 421 HB3 ARG 62 HB3 ARG 62 8.552 13.903 -13.736 422 HG2 ARG 62 HG2 ARG 62 8.384 13.047 -16.614 423 HG3 ARG 62 HG3 ARG 62 7.021 13.643 -15.668 424 HD2 ARG 62 HD2 ARG 62 8.383 15.719 -15.229 425 HD3 ARG 62 HD3 ARG 62 9.527 15.126 -16.432 426 HE ARG 62 HE ARG 62 6.920 15.144 -17.512 427 HH11 ARG 62 HH11 ARG 62 9.515 17.296 -16.594 428 HH12 ARG 62 HH12 ARG 62 9.031 18.561 -17.676 429 HH21 ARG 62 HH21 ARG 62 6.274 16.787 -18.954 430 HH22 ARG 62 HH22 ARG 62 7.193 18.255 -19.052 431 H LEU 63 H LEU 63 10.110 11.043 -13.114 432 HA LEU 63 HA LEU 63 10.644 12.237 -10.625 433 HB2 LEU 63 HB2 LEU 63 11.104 9.328 -11.230 434 HB3 LEU 63 HB3 LEU 63 10.573 10.055 -9.726 435 HG LEU 63 HG LEU 63 8.930 9.837 -12.252 436 HD11 LEU 63 HD11 LEU 63 8.739 8.381 -9.625 437 HD12 LEU 63 HD12 LEU 63 9.249 7.694 -11.167 438 HD13 LEU 63 HD13 LEU 63 7.590 8.255 -10.957 439 HD21 LEU 63 HD21 LEU 63 8.131 10.833 -9.523 440 HD22 LEU 63 HD22 LEU 63 7.084 10.677 -10.928 441 HD23 LEU 63 HD23 LEU 63 8.400 11.851 -10.936 442 H ARG 64 H ARG 64 12.663 10.372 -12.850 443 HA ARG 64 HA ARG 64 14.906 10.051 -11.210 444 HB2 ARG 64 HB2 ARG 64 14.491 8.767 -13.258 445 HB3 ARG 64 HB3 ARG 64 14.760 10.210 -14.222 446 HG2 ARG 64 HG2 ARG 64 17.072 10.287 -13.530 447 HG3 ARG 64 HG3 ARG 64 16.824 8.903 -12.461 448 HD2 ARG 64 HD2 ARG 64 16.292 7.501 -14.364 449 HD3 ARG 64 HD3 ARG 64 16.442 8.880 -15.450 450 HE ARG 64 HE ARG 64 18.868 8.836 -14.353 451 HH11 ARG 64 HH11 ARG 64 16.912 6.240 -15.650 452 HH12 ARG 64 HH12 ARG 64 18.273 5.297 -16.168 453 HH21 ARG 64 HH21 ARG 64 20.664 7.611 -15.057 454 HH22 ARG 64 HH22 ARG 64 20.409 6.076 -15.825 455 H ALA 65 H ALA 65 13.820 12.829 -12.962 456 HA ALA 65 HA ALA 65 16.454 14.064 -12.922 457 HB1 ALA 65 HB1 ALA 65 15.010 14.326 -14.903 458 HB2 ALA 65 HB2 ALA 65 15.442 15.869 -14.170 459 HB3 ALA 65 HB3 ALA 65 13.836 15.191 -13.910 460 H MET 66 H MET 66 14.126 13.621 -10.662 461 HA MET 66 HA MET 66 14.343 16.340 -9.576 462 HB2 MET 66 HB2 MET 66 12.415 14.103 -8.970 463 HB3 MET 66 HB3 MET 66 12.480 15.607 -8.059 464 HG2 MET 66 HG2 MET 66 11.911 15.357 -11.003 465 HG3 MET 66 HG3 MET 66 10.715 15.639 -9.742 466 HE1 MET 66 HE1 MET 66 11.659 19.215 -8.480 467 HE2 MET 66 HE2 MET 66 12.216 17.680 -7.814 468 HE3 MET 66 HE3 MET 66 10.540 17.862 -8.331 469 H ASN 67 H ASN 67 14.979 12.960 -8.793 470 HA ASN 67 HA ASN 67 15.834 13.363 -6.139 471 HB2 ASN 67 HB2 ASN 67 17.302 11.242 -6.720 472 HB3 ASN 67 HB3 ASN 67 15.553 11.114 -6.573 473 HD21 ASN 67 HD22 ASN 67 18.257 11.131 -8.762 474 HD22 ASN 67 HD21 ASN 67 17.376 10.573 -10.150 475 H THR 68 H THR 68 17.637 13.396 -9.196 476 HA THR 68 HA THR 68 20.137 14.063 -8.036 477 HB THR 68 HB THR 68 19.168 14.596 -10.854 478 HG1 THR 68 HG1 THR 68 19.987 12.285 -9.510 479 HG21 THR 68 HG21 THR 68 21.982 14.279 -9.789 480 HG22 THR 68 HG22 THR 68 21.237 15.813 -10.225 481 HG23 THR 68 HG23 THR 68 21.526 14.590 -11.464 482 H ALA 69 H ALA 69 17.347 15.915 -8.989 483 HA ALA 69 HA ALA 69 18.509 18.451 -9.262 484 HB1 ALA 69 HB1 ALA 69 16.228 17.919 -9.999 485 HB2 ALA 69 HB2 ALA 69 16.274 19.344 -8.957 486 HB3 ALA 69 HB3 ALA 69 15.723 17.796 -8.311 487 H MET 70 H MET 70 16.986 16.924 -6.417 488 HA MET 70 HA MET 70 17.303 19.074 -4.650 489 HB2 MET 70 HB2 MET 70 15.910 17.106 -4.126 490 HB3 MET 70 HB3 MET 70 17.357 16.116 -4.000 491 HG2 MET 70 HG2 MET 70 18.088 17.807 -2.198 492 HG3 MET 70 HG3 MET 70 16.393 18.285 -2.175 493 HE1 MET 70 HE1 MET 70 14.403 16.617 -1.536 494 HE2 MET 70 HE2 MET 70 14.653 14.927 -1.095 495 HE3 MET 70 HE3 MET 70 14.955 15.462 -2.748 496 H ALA 71 H ALA 71 19.359 16.306 -5.321 497 HA ALA 71 HA ALA 71 21.371 16.721 -3.464 498 HB1 ALA 71 HB1 ALA 71 21.599 15.544 -6.229 499 HB2 ALA 71 HB2 ALA 71 21.125 14.678 -4.768 500 HB3 ALA 71 HB3 ALA 71 22.759 15.327 -4.916 501 H ALA 72 H ALA 72 21.007 18.065 -6.715 502 HA ALA 72 HA ALA 72 23.549 19.336 -6.763 503 HB1 ALA 72 HB1 ALA 72 22.347 18.787 -8.812 504 HB2 ALA 72 HB2 ALA 72 22.706 20.512 -8.730 505 HB3 ALA 72 HB3 ALA 72 21.076 19.933 -8.382 506 H GLU 73 H GLU 73 20.276 20.457 -5.987 507 HA GLU 73 HA GLU 73 20.929 23.181 -5.700 508 HB2 GLU 73 HB2 GLU 73 18.704 21.676 -4.315 509 HB3 GLU 73 HB3 GLU 73 18.794 23.413 -4.559 510 HG2 GLU 73 HG2 GLU 73 18.542 21.341 -6.724 511 HG3 GLU 73 HG3 GLU 73 17.245 22.358 -6.106 512 H VAL 74 H VAL 74 20.784 20.540 -3.318 513 HA VAL 74 HA VAL 74 21.356 22.304 -1.121 514 HB VAL 74 HB VAL 74 21.562 20.278 0.247 515 HG11 VAL 74 HG11 VAL 74 19.153 20.346 -1.558 516 HG12 VAL 74 HG12 VAL 74 19.375 21.245 -0.057 517 HG13 VAL 74 HG13 VAL 74 19.242 19.487 -0.019 518 HG21 VAL 74 HG21 VAL 74 21.099 18.079 -0.715 519 HG22 VAL 74 HG22 VAL 74 22.571 18.789 -1.379 520 HG23 VAL 74 HG23 VAL 74 21.084 18.794 -2.327 521 H ALA 75 H ALA 75 23.255 20.511 -3.364 522 HA ALA 75 HA ALA 75 25.606 20.122 -1.911 523 HB1 ALA 75 HB1 ALA 75 25.385 20.767 -4.847 524 HB2 ALA 75 HB2 ALA 75 25.205 19.162 -4.141 525 HB3 ALA 75 HB3 ALA 75 26.752 20.001 -4.040 526 H GLU 76 H GLU 76 24.363 22.966 -3.556 527 HA GLU 76 HA GLU 76 26.625 24.609 -3.403 528 HB2 GLU 76 HB2 GLU 76 23.693 25.340 -3.258 529 HB3 GLU 76 HB3 GLU 76 24.999 26.495 -3.490 530 HG2 GLU 76 HG2 GLU 76 24.259 24.247 -5.349 531 HG3 GLU 76 HG3 GLU 76 23.943 25.965 -5.598 532 H VAL 77 H VAL 77 24.051 23.980 -1.080 533 HA VAL 77 HA VAL 77 24.843 25.850 0.883 534 HB VAL 77 HB VAL 77 23.438 23.210 1.339 535 HG11 VAL 77 HG11 VAL 77 23.418 25.759 2.950 536 HG12 VAL 77 HG12 VAL 77 24.235 24.258 3.388 537 HG13 VAL 77 HG13 VAL 77 22.475 24.311 3.296 538 HG21 VAL 77 HG21 VAL 77 21.341 24.476 1.128 539 HG22 VAL 77 HG22 VAL 77 22.264 24.457 -0.375 540 HG23 VAL 77 HG23 VAL 77 22.265 25.897 0.642 541 H VAL 78 H VAL 78 25.619 22.458 0.326 542 HA VAL 78 HA VAL 78 27.146 22.093 2.687 543 HB VAL 78 HB VAL 78 27.244 20.521 0.106 544 HG11 VAL 78 HG11 VAL 78 29.167 20.093 1.544 545 HG12 VAL 78 HG12 VAL 78 28.093 18.694 1.481 546 HG13 VAL 78 HG13 VAL 78 28.087 19.747 2.897 547 HG21 VAL 78 HG21 VAL 78 24.987 20.606 0.988 548 HG22 VAL 78 HG22 VAL 78 25.566 20.116 2.580 549 HG23 VAL 78 HG23 VAL 78 25.670 18.996 1.221 550 H ALA 79 H ALA 79 27.952 23.046 -0.621 551 HA ALA 79 HA ALA 79 30.744 22.883 -0.449 552 HB1 ALA 79 HB1 ALA 79 30.786 24.385 -2.359 553 HB2 ALA 79 HB2 ALA 79 29.098 24.809 -2.081 554 HB3 ALA 79 HB3 ALA 79 29.527 23.166 -2.554 555 H THR 80 H THR 80 28.530 25.275 0.773 556 HA THR 80 HA THR 80 30.420 27.369 1.138 557 HB THR 80 HB THR 80 27.836 26.929 2.651 558 HG1 THR 80 HG1 THR 80 26.964 28.297 0.957 559 HG21 THR 80 HG21 THR 80 29.341 29.472 2.005 560 HG22 THR 80 HG22 THR 80 29.316 28.676 3.578 561 HG23 THR 80 HG23 THR 80 27.833 29.351 2.910 562 H SER 81 H SER 81 29.848 24.449 2.801 563 HA SER 81 HA SER 81 30.422 25.318 5.450 564 HB2 SER 81 HB2 SER 81 30.623 22.513 4.353 565 HB3 SER 81 HB3 SER 81 30.368 22.992 6.032 566 HG SER 81 HG SER 81 28.590 22.980 3.879 567 HA PRO 82 HA PRO 82 34.906 25.494 5.205 568 HB2 PRO 82 HB2 PRO 82 34.630 25.042 8.127 569 HB3 PRO 82 HB3 PRO 82 35.492 26.320 7.266 570 HG2 PRO 82 HG2 PRO 82 33.189 26.819 8.517 571 HG3 PRO 82 HG3 PRO 82 33.588 27.594 6.974 572 HD2 PRO 82 HD2 PRO 82 31.726 25.326 7.529 573 HD3 PRO 82 HD3 PRO 82 31.568 26.662 6.369 574 HA PRO 83 HA PRO 83 35.828 21.194 4.935 575 HB2 PRO 83 HB2 PRO 83 38.529 21.321 5.609 576 HB3 PRO 83 HB3 PRO 83 37.858 21.544 3.992 577 HG2 PRO 83 HG2 PRO 83 38.682 23.588 6.002 578 HG3 PRO 83 HG3 PRO 83 38.855 23.613 4.238 579 HD2 PRO 83 HD2 PRO 83 36.962 25.047 5.472 580 HD3 PRO 83 HD3 PRO 83 36.649 24.263 3.909 581 H GLN 84 H GLN 84 36.838 22.959 7.810 582 HA GLN 84 HA GLN 84 37.252 20.527 9.324 583 HB2 GLN 84 HB2 GLN 84 37.400 23.441 10.100 584 HB3 GLN 84 HB3 GLN 84 37.739 22.112 11.201 585 HG2 GLN 84 HG2 GLN 84 39.579 21.386 9.797 586 HG3 GLN 84 HG3 GLN 84 39.215 22.660 8.635 587 HE21 GLN 84 HE22 GLN 84 39.749 24.774 9.117 588 HE22 GLN 84 HE21 GLN 84 40.808 25.194 10.416 589 H SER 85 H SER 85 34.547 22.084 8.376 590 HA SER 85 HA SER 85 33.074 21.165 10.758 591 HB2 SER 85 HB2 SER 85 33.104 23.679 10.441 592 HB3 SER 85 HB3 SER 85 32.223 23.433 8.937 593 HG SER 85 HG SER 85 31.273 23.560 11.425 594 H TYR 86 H TYR 86 33.713 20.738 7.534 595 HA TYR 86 HA TYR 86 31.284 20.351 6.259 596 HB2 TYR 86 HB2 TYR 86 33.444 20.424 5.093 597 HB3 TYR 86 HB3 TYR 86 33.896 18.885 5.813 598 HD1 TYR 86 HD1 TYR 86 32.680 16.807 5.137 599 HD2 TYR 86 HD2 TYR 86 32.092 20.519 3.138 600 HE1 TYR 86 HE1 TYR 86 31.695 15.613 3.228 601 HE2 TYR 86 HE2 TYR 86 31.102 19.333 1.227 602 HH TYR 86 HH TYR 86 31.249 16.996 0.236 603 H SER 87 H SER 87 33.242 18.009 8.066 604 HA SER 87 HA SER 87 31.782 15.726 7.476 605 HB2 SER 87 HB2 SER 87 33.190 16.284 10.092 606 HB3 SER 87 HB3 SER 87 32.904 14.711 9.349 607 HG SER 87 HG SER 87 34.268 15.414 7.605 608 H ALA 88 H ALA 88 31.256 18.153 9.975 609 HA ALA 88 HA ALA 88 29.182 16.670 11.282 610 HB1 ALA 88 HB1 ALA 88 29.851 19.607 11.460 611 HB2 ALA 88 HB2 ALA 88 30.530 18.335 12.474 612 HB3 ALA 88 HB3 ALA 88 28.808 18.709 12.564 613 H VAL 89 H VAL 89 29.361 19.112 8.786 614 HA VAL 89 HA VAL 89 26.588 19.728 8.675 615 HB VAL 89 HB VAL 89 28.756 20.032 6.589 616 HG11 VAL 89 HG11 VAL 89 27.233 21.582 5.454 617 HG12 VAL 89 HG12 VAL 89 25.968 21.188 6.618 618 HG13 VAL 89 HG13 VAL 89 26.568 19.949 5.516 619 HG21 VAL 89 HG21 VAL 89 27.508 22.051 8.454 620 HG22 VAL 89 HG22 VAL 89 28.766 22.373 7.260 621 HG23 VAL 89 HG23 VAL 89 29.107 21.328 8.641 622 H LEU 90 H LEU 90 28.670 17.571 6.777 623 HA LEU 90 HA LEU 90 26.756 16.653 4.972 624 HB2 LEU 90 HB2 LEU 90 29.368 16.357 5.196 625 HB3 LEU 90 HB3 LEU 90 28.918 14.864 5.989 626 HG LEU 90 HG LEU 90 29.485 14.685 3.554 627 HD11 LEU 90 HD11 LEU 90 27.634 13.156 3.029 628 HD12 LEU 90 HD12 LEU 90 26.741 13.794 4.411 629 HD13 LEU 90 HD13 LEU 90 28.256 12.927 4.663 630 HD21 LEU 90 HD21 LEU 90 27.840 15.354 1.913 631 HD22 LEU 90 HD22 LEU 90 28.382 16.760 2.831 632 HD23 LEU 90 HD23 LEU 90 26.814 16.030 3.176 633 H ASN 91 H ASN 91 27.707 15.394 8.146 634 HA ASN 91 HA ASN 91 26.021 13.135 8.116 635 HB2 ASN 91 HB2 ASN 91 27.439 14.649 10.270 636 HB3 ASN 91 HB3 ASN 91 26.221 13.465 10.727 637 HD21 ASN 91 HD22 ASN 91 29.348 13.964 9.302 638 HD22 ASN 91 HD21 ASN 91 29.832 12.304 9.314 639 H THR 92 H THR 92 25.464 16.478 9.012 640 HA THR 92 HA THR 92 22.942 16.113 10.237 641 HB THR 92 HB THR 92 24.008 18.547 8.775 642 HG1 THR 92 HG1 THR 92 25.338 17.977 10.530 643 HG21 THR 92 HG21 THR 92 22.397 19.805 10.146 644 HG22 THR 92 HG22 THR 92 21.770 18.289 10.791 645 HG23 THR 92 HG23 THR 92 21.587 18.659 9.077 646 H ILE 93 H ILE 93 23.949 16.750 6.903 647 HA ILE 93 HA ILE 93 21.429 17.058 5.733 648 HB ILE 93 HB ILE 93 23.895 15.834 4.489 649 HG12 ILE 93 HG12 ILE 93 24.338 18.070 5.384 650 HG13 ILE 93 HG13 ILE 93 24.338 18.098 3.625 651 HG21 ILE 93 HG21 ILE 93 21.431 17.023 3.221 652 HG22 ILE 93 HG22 ILE 93 21.947 15.339 3.159 653 HG23 ILE 93 HG23 ILE 93 22.898 16.582 2.351 654 HD11 ILE 93 HD11 ILE 93 22.106 19.021 5.420 655 HD12 ILE 93 HD12 ILE 93 22.066 19.014 3.657 656 HD13 ILE 93 HD13 ILE 93 23.216 20.042 4.508 657 H GLY 94 H GLY 94 23.417 14.131 6.058 658 HA2 GLY 94 HA2 GLY 94 21.617 12.366 4.836 659 HA3 GLY 94 HA3 GLY 94 22.883 11.902 5.957 660 H ALA 95 H ALA 95 22.005 13.239 8.218 661 HA ALA 95 HA ALA 95 20.209 11.369 9.288 662 HB1 ALA 95 HB1 ALA 95 21.808 12.578 10.663 663 HB2 ALA 95 HB2 ALA 95 20.167 12.797 11.270 664 HB3 ALA 95 HB3 ALA 95 20.950 14.088 10.357 665 H CYS 96 H CYS 96 19.697 14.797 8.456 666 HA CYS 96 HA CYS 96 16.969 14.824 9.159 667 HB2 CYS 96 HB2 CYS 96 18.537 16.610 7.296 668 HB3 CYS 96 HB3 CYS 96 16.879 16.924 7.803 669 H LEU 97 H LEU 97 18.599 14.251 6.065 670 HA LEU 97 HA LEU 97 16.277 14.259 4.474 671 HB2 LEU 97 HB2 LEU 97 18.739 14.383 3.768 672 HB3 LEU 97 HB3 LEU 97 18.750 12.639 3.908 673 HG LEU 97 HG LEU 97 18.448 13.606 1.576 674 HD11 LEU 97 HD11 LEU 97 16.358 11.701 2.610 675 HD12 LEU 97 HD12 LEU 97 17.979 11.279 2.057 676 HD13 LEU 97 HD13 LEU 97 16.798 11.927 0.918 677 HD21 LEU 97 HD21 LEU 97 16.859 15.376 2.224 678 HD22 LEU 97 HD22 LEU 97 15.652 14.133 2.568 679 HD23 LEU 97 HD23 LEU 97 16.253 14.347 0.925 680 H ARG 98 H ARG 98 17.992 11.643 6.140 681 HA ARG 98 HA ARG 98 16.576 9.468 5.163 682 HB2 ARG 98 HB2 ARG 98 18.595 9.207 6.432 683 HB3 ARG 98 HB3 ARG 98 17.868 9.962 7.842 684 HG2 ARG 98 HG2 ARG 98 16.321 8.061 8.033 685 HG3 ARG 98 HG3 ARG 98 17.130 7.297 6.659 686 HD2 ARG 98 HD2 ARG 98 19.211 7.233 7.857 687 HD3 ARG 98 HD3 ARG 98 18.508 8.131 9.199 688 HE ARG 98 HE ARG 98 17.017 5.781 8.787 689 HH11 ARG 98 HH11 ARG 98 20.150 6.814 9.933 690 HH12 ARG 98 HH12 ARG 98 20.366 5.461 10.988 691 HH21 ARG 98 HH21 ARG 98 17.287 3.972 10.179 692 HH22 ARG 98 HH22 ARG 98 18.724 3.848 11.142 693 H GLU 99 H GLU 99 15.915 11.330 8.155 694 HA GLU 99 HA GLU 99 13.604 9.792 8.766 695 HB2 GLU 99 HB2 GLU 99 13.138 11.545 10.462 696 HB3 GLU 99 HB3 GLU 99 14.751 10.862 10.574 697 HG2 GLU 99 HG2 GLU 99 15.686 12.823 9.503 698 HG3 GLU 99 HG3 GLU 99 14.069 13.498 9.290 699 H SER 100 H SER 100 14.089 12.941 7.241 700 HA SER 100 HA SER 100 11.428 13.759 7.134 701 HB2 SER 100 HB2 SER 100 13.661 14.350 5.181 702 HB3 SER 100 HB3 SER 100 12.146 15.244 5.295 703 HG SER 100 HG SER 100 14.269 15.098 7.148 704 H MET 101 H MET 101 13.249 11.688 4.914 705 HA MET 101 HA MET 101 11.322 11.619 2.870 706 HB2 MET 101 HB2 MET 101 13.673 10.901 2.572 707 HB3 MET 101 HB3 MET 101 13.335 9.478 3.556 708 HG2 MET 101 HG2 MET 101 11.676 8.761 1.989 709 HG3 MET 101 HG3 MET 101 11.930 10.210 1.029 710 HE1 MET 101 HE1 MET 101 13.331 7.912 -1.483 711 HE2 MET 101 HE2 MET 101 12.289 9.271 -1.052 712 HE3 MET 101 HE3 MET 101 11.911 7.654 -0.467 713 H MET 102 H MET 102 11.966 9.323 5.525 714 HA MET 102 HA MET 102 9.767 7.665 4.752 715 HB2 MET 102 HB2 MET 102 10.279 6.316 6.648 716 HB3 MET 102 HB3 MET 102 11.791 6.797 5.901 717 HG2 MET 102 HG2 MET 102 12.170 8.439 7.616 718 HG3 MET 102 HG3 MET 102 10.588 8.110 8.324 719 HE1 MET 102 HE1 MET 102 9.915 5.639 9.181 720 HE2 MET 102 HE2 MET 102 11.083 4.340 9.427 721 HE3 MET 102 HE3 MET 102 10.647 4.834 7.790 722 H GLN 103 H GLN 103 10.186 10.366 6.842 723 HA GLN 103 HA GLN 103 7.962 10.076 8.529 724 HB2 GLN 103 HB2 GLN 103 9.890 12.068 8.005 725 HB3 GLN 103 HB3 GLN 103 8.324 12.836 7.791 726 HG2 GLN 103 HG2 GLN 103 8.990 13.153 10.045 727 HG3 GLN 103 HG3 GLN 103 7.674 11.980 10.035 728 HE21 GLN 103 HE22 GLN 103 8.128 9.811 10.500 729 HE22 GLN 103 HE21 GLN 103 9.599 9.333 11.269 730 H ALA 104 H ALA 104 8.215 11.010 5.199 731 HA ALA 104 HA ALA 104 5.768 12.368 4.916 732 HB1 ALA 104 HB1 ALA 104 6.056 11.978 2.521 733 HB2 ALA 104 HB2 ALA 104 7.335 10.815 2.865 734 HB3 ALA 104 HB3 ALA 104 7.558 12.515 3.273 735 H THR 105 H THR 105 6.486 9.124 3.607 736 HA THR 105 HA THR 105 4.425 7.709 4.780 737 HB THR 105 HB THR 105 2.828 9.230 3.766 738 HG1 THR 105 HG1 THR 105 2.254 6.994 3.812 739 HG21 THR 105 HG21 THR 105 4.232 10.016 1.909 740 HG22 THR 105 HG22 THR 105 2.632 9.516 1.359 741 HG23 THR 105 HG23 THR 105 4.024 8.462 1.104 742 H GLY 106 H GLY 106 6.399 8.278 1.953 743 HA2 GLY 106 HA2 GLY 106 6.002 5.595 0.928 744 HA3 GLY 106 HA3 GLY 106 6.994 6.852 0.209 745 H SER 107 H SER 107 7.627 6.415 3.513 746 HA SER 107 HA SER 107 9.385 5.659 4.669 747 HB2 SER 107 HB2 SER 107 9.323 3.518 2.542 748 HB3 SER 107 HB3 SER 107 10.346 3.449 3.980 749 HG SER 107 HG SER 107 7.993 4.000 4.903 750 H VAL 108 H VAL 108 11.822 4.718 4.114 751 HA VAL 108 HA VAL 108 12.924 6.881 2.497 752 HB VAL 108 HB VAL 108 13.595 7.219 4.721 753 HG11 VAL 108 HG11 VAL 108 14.314 4.301 4.877 754 HG12 VAL 108 HG12 VAL 108 12.957 5.100 5.675 755 HG13 VAL 108 HG13 VAL 108 14.613 5.495 6.141 756 HG21 VAL 108 HG21 VAL 108 15.834 5.757 3.343 757 HG22 VAL 108 HG22 VAL 108 16.017 6.838 4.725 758 HG23 VAL 108 HG23 VAL 108 15.433 7.467 3.186 759 H ASP 109 H ASP 109 13.457 6.223 0.612 760 HA ASP 109 HA ASP 109 13.898 3.502 -0.102 761 HB2 ASP 109 HB2 ASP 109 12.808 5.010 -1.650 762 HB3 ASP 109 HB3 ASP 109 14.214 6.066 -1.669 763 H ASN 110 H ASN 110 15.764 2.576 -1.049 764 HA ASN 110 HA ASN 110 18.137 3.302 0.416 765 HB2 ASN 110 HB2 ASN 110 19.070 1.206 -0.454 766 HB3 ASN 110 HB3 ASN 110 17.481 0.955 0.259 767 HD21 ASN 110 HD22 ASN 110 15.758 0.392 -1.045 768 HD22 ASN 110 HD21 ASN 110 15.968 -0.129 -2.685 769 H ALA 111 H ALA 111 16.998 3.707 -2.845 770 HA ALA 111 HA ALA 111 19.716 4.108 -3.864 771 HB1 ALA 111 HB1 ALA 111 18.653 4.276 -6.061 772 HB2 ALA 111 HB2 ALA 111 17.064 4.160 -5.307 773 HB3 ALA 111 HB3 ALA 111 18.177 2.795 -5.232 774 H PHE 112 H PHE 112 16.668 5.835 -3.453 775 HA PHE 112 HA PHE 112 17.346 8.324 -4.486 776 HB2 PHE 112 HB2 PHE 112 15.084 7.723 -3.769 777 HB3 PHE 112 HB3 PHE 112 15.613 7.646 -2.096 778 HD1 PHE 112 HD1 PHE 112 16.289 9.760 -0.933 779 HD2 PHE 112 HD2 PHE 112 14.414 9.746 -4.753 780 HE1 PHE 112 HE1 PHE 112 15.645 12.112 -0.624 781 HE2 PHE 112 HE2 PHE 112 13.778 12.103 -4.441 782 HZ PHE 112 HZ PHE 112 14.389 13.283 -2.381 783 H THR 113 H THR 113 17.578 7.313 -1.080 784 HA THR 113 HA THR 113 18.822 9.659 -0.194 785 HB THR 113 HB THR 113 19.498 8.282 1.793 786 HG1 THR 113 HG1 THR 113 17.944 6.148 0.895 787 HG21 THR 113 HG21 THR 113 17.319 9.419 1.674 788 HG22 THR 113 HG22 THR 113 17.225 7.910 2.577 789 HG23 THR 113 HG23 THR 113 16.621 7.985 0.922 790 H ASN 114 H ASN 114 20.157 6.594 -1.320 791 HA ASN 114 HA ASN 114 22.852 7.161 -0.686 792 HB2 ASN 114 HB2 ASN 114 22.314 4.894 -1.039 793 HB3 ASN 114 HB3 ASN 114 21.512 5.226 -2.567 794 HD21 ASN 114 HD22 ASN 114 22.689 5.316 -4.421 795 HD22 ASN 114 HD21 ASN 114 24.365 4.908 -4.506 796 H GLU 115 H GLU 115 20.971 7.698 -3.694 797 HA GLU 115 HA GLU 115 23.097 8.659 -5.211 798 HB2 GLU 115 HB2 GLU 115 20.858 7.988 -6.097 799 HB3 GLU 115 HB3 GLU 115 20.188 9.458 -5.392 800 HG2 GLU 115 HG2 GLU 115 21.790 10.751 -6.706 801 HG3 GLU 115 HG3 GLU 115 22.308 9.263 -7.478 802 H VAL 116 H VAL 116 20.610 10.358 -3.307 803 HA VAL 116 HA VAL 116 21.596 12.944 -3.549 804 HB VAL 116 HB VAL 116 20.281 11.674 -1.134 805 HG11 VAL 116 HG11 VAL 116 20.632 14.594 -1.814 806 HG12 VAL 116 HG12 VAL 116 21.422 13.729 -0.494 807 HG13 VAL 116 HG13 VAL 116 19.672 13.959 -0.478 808 HG21 VAL 116 HG21 VAL 116 19.123 13.285 -3.409 809 HG22 VAL 116 HG22 VAL 116 18.229 12.697 -2.005 810 HG23 VAL 116 HG23 VAL 116 18.922 11.552 -3.154 811 H MET 117 H MET 117 22.407 10.532 -1.053 812 HA MET 117 HA MET 117 24.401 12.180 0.171 813 HB2 MET 117 HB2 MET 117 23.789 9.238 0.448 814 HB3 MET 117 HB3 MET 117 24.951 10.095 1.439 815 HG2 MET 117 HG2 MET 117 21.982 10.256 1.417 816 HG3 MET 117 HG3 MET 117 23.086 10.095 2.778 817 HE1 MET 117 HE1 MET 117 24.415 13.763 3.208 818 HE2 MET 117 HE2 MET 117 25.193 12.569 2.166 819 HE3 MET 117 HE3 MET 117 24.545 12.086 3.738 820 H GLN 118 H GLN 118 24.520 10.847 -2.765 821 HA GLN 118 HA GLN 118 27.419 10.349 -2.600 822 HB2 GLN 118 HB2 GLN 118 26.100 8.570 -3.697 823 HB3 GLN 118 HB3 GLN 118 25.473 9.745 -4.843 824 HG2 GLN 118 HG2 GLN 118 27.811 10.140 -5.603 825 HG3 GLN 118 HG3 GLN 118 28.315 8.806 -4.567 826 HE21 GLN 118 HE22 GLN 118 27.685 6.699 -5.098 827 HE22 GLN 118 HE21 GLN 118 27.129 6.289 -6.683 828 H LEU 119 H LEU 119 24.967 11.949 -4.598 829 HA LEU 119 HA LEU 119 26.857 13.512 -6.007 830 HB2 LEU 119 HB2 LEU 119 23.878 13.499 -5.830 831 HB3 LEU 119 HB3 LEU 119 24.700 14.828 -6.624 832 HG LEU 119 HG LEU 119 25.833 13.121 -8.089 833 HD11 LEU 119 HD11 LEU 119 23.744 11.306 -6.921 834 HD12 LEU 119 HD12 LEU 119 25.490 11.152 -6.722 835 HD13 LEU 119 HD13 LEU 119 24.761 10.945 -8.316 836 HD21 LEU 119 HD21 LEU 119 22.840 13.347 -8.198 837 HD22 LEU 119 HD22 LEU 119 23.874 12.832 -9.531 838 HD23 LEU 119 HD23 LEU 119 24.005 14.470 -8.896 839 H VAL 120 H VAL 120 24.859 14.173 -3.137 840 HA VAL 120 HA VAL 120 25.237 16.933 -2.998 841 HB VAL 120 HB VAL 120 25.017 14.911 -0.760 842 HG11 VAL 120 HG11 VAL 120 24.913 17.919 -0.550 843 HG12 VAL 120 HG12 VAL 120 26.211 16.891 0.052 844 HG13 VAL 120 HG13 VAL 120 24.598 16.773 0.753 845 HG21 VAL 120 HG21 VAL 120 23.062 16.877 -1.950 846 HG22 VAL 120 HG22 VAL 120 22.746 15.846 -0.556 847 HG23 VAL 120 HG23 VAL 120 23.036 15.124 -2.139 848 H LYS 121 H LYS 121 27.366 14.313 -2.097 849 HA LYS 121 HA LYS 121 29.381 16.011 -0.952 850 HB2 LYS 121 HB2 LYS 121 29.574 13.131 -1.857 851 HB3 LYS 121 HB3 LYS 121 30.695 13.968 -0.791 852 HG2 LYS 121 HG2 LYS 121 29.058 14.115 0.936 853 HG3 LYS 121 HG3 LYS 121 27.792 13.517 -0.139 854 HD2 LYS 121 HD2 LYS 121 28.477 11.729 1.303 855 HD3 LYS 121 HD3 LYS 121 29.044 11.381 -0.329 856 HE2 LYS 121 HE2 LYS 121 31.269 12.298 0.305 857 HE3 LYS 121 HE3 LYS 121 30.682 12.475 1.957 858 HZ1 LYS 121 HZ1 LYS 121 30.949 9.931 0.450 859 HZ2 LYS 121 HZ2 LYS 121 30.295 10.068 1.999 860 HZ3 LYS 121 HZ3 LYS 121 31.923 10.444 1.736 861 H MET 122 H MET 122 29.006 14.152 -3.955 862 HA MET 122 HA MET 122 31.551 14.791 -5.005 863 HB2 MET 122 HB2 MET 122 30.307 12.837 -5.734 864 HB3 MET 122 HB3 MET 122 29.035 13.857 -6.387 865 HG2 MET 122 HG2 MET 122 30.616 14.770 -8.017 866 HG3 MET 122 HG3 MET 122 31.875 13.721 -7.367 867 HE1 MET 122 HE1 MET 122 28.096 12.181 -9.537 868 HE2 MET 122 HE2 MET 122 28.469 13.892 -9.320 869 HE3 MET 122 HE3 MET 122 28.051 12.895 -7.929 870 H LEU 123 H LEU 123 28.444 16.408 -5.250 871 HA LEU 123 HA LEU 123 29.316 18.088 -7.446 872 HB2 LEU 123 HB2 LEU 123 26.808 18.247 -5.769 873 HB3 LEU 123 HB3 LEU 123 27.117 19.161 -7.228 874 HG LEU 123 HG LEU 123 26.879 16.150 -7.129 875 HD11 LEU 123 HD11 LEU 123 24.774 17.230 -6.530 876 HD12 LEU 123 HD12 LEU 123 24.674 16.477 -8.122 877 HD13 LEU 123 HD13 LEU 123 24.867 18.224 -7.983 878 HD21 LEU 123 HD21 LEU 123 28.194 16.876 -9.015 879 HD22 LEU 123 HD22 LEU 123 26.999 18.108 -9.420 880 HD23 LEU 123 HD23 LEU 123 26.590 16.398 -9.581 881 H SER 124 H SER 124 30.184 18.106 -4.338 882 HA SER 124 HA SER 124 30.401 21.034 -4.283 883 HB2 SER 124 HB2 SER 124 30.151 20.922 -1.792 884 HB3 SER 124 HB3 SER 124 28.688 20.474 -2.667 885 HG SER 124 HG SER 124 28.830 18.503 -1.910 886 H ALA 125 H ALA 125 31.529 18.277 -2.347 887 HA ALA 125 HA ALA 125 34.218 18.374 -3.200 888 HB1 ALA 125 HB1 ALA 125 35.293 19.361 -1.275 889 HB2 ALA 125 HB2 ALA 125 33.728 19.673 -0.527 890 HB3 ALA 125 HB3 ALA 125 34.186 20.530 -1.997 891 H ASP 126 H ASP 126 34.527 16.253 -3.056 892 HA ASP 126 HA ASP 126 33.562 14.788 -0.720 893 HB2 ASP 126 HB2 ASP 126 33.136 13.891 -3.001 894 HB3 ASP 126 HB3 ASP 126 34.871 13.742 -3.245 895 H SER 127 H SER 127 36.090 16.607 -1.280 896 HA SER 127 HA SER 127 38.344 15.008 -0.697 897 HB2 SER 127 HB2 SER 127 38.059 17.946 -0.068 898 HB3 SER 127 HB3 SER 127 39.536 17.062 -0.448 899 HG SER 127 HG SER 127 38.479 16.658 -2.559 900 H ALA 128 H ALA 128 35.811 16.131 1.255 901 HA ALA 128 HA ALA 128 37.414 15.906 3.705 902 HB1 ALA 128 HB1 ALA 128 34.654 17.066 3.327 903 HB2 ALA 128 HB2 ALA 128 36.153 17.989 3.430 904 HB3 ALA 128 HB3 ALA 128 35.587 17.066 4.823 905 H ASN 129 H ASN 129 36.360 13.701 1.993 906 HA ASN 129 HA ASN 129 34.324 12.380 3.517 907 HB2 ASN 129 HB2 ASN 129 34.843 12.036 1.043 908 HB3 ASN 129 HB3 ASN 129 36.247 11.108 1.562 909 HD21 ASN 129 HD22 ASN 129 35.511 9.221 0.653 910 HD22 ASN 129 HD21 ASN 129 34.174 8.332 1.296 911 H GLU 130 H GLU 130 37.717 12.709 3.691 912 HA GLU 130 HA GLU 130 38.213 10.366 5.298 913 HB2 GLU 130 HB2 GLU 130 39.794 11.891 3.725 914 HB3 GLU 130 HB3 GLU 130 40.130 12.634 5.280 915 HG2 GLU 130 HG2 GLU 130 40.465 9.715 4.631 916 HG3 GLU 130 HG3 GLU 130 41.759 10.908 4.682 917 H VAL 131 H VAL 131 36.966 10.498 7.140 918 HA VAL 131 HA VAL 131 36.743 12.980 8.580 919 HB VAL 131 HB VAL 131 34.794 11.483 8.287 920 HG11 VAL 131 HG11 VAL 131 36.232 9.648 10.199 921 HG12 VAL 131 HG12 VAL 131 35.910 9.325 8.496 922 HG13 VAL 131 HG13 VAL 131 34.571 9.463 9.635 923 HG21 VAL 131 HG21 VAL 131 33.971 11.629 10.603 924 HG22 VAL 131 HG22 VAL 131 34.765 13.109 10.066 925 HG23 VAL 131 HG23 VAL 131 35.609 11.998 11.140 926 H SER 132 H SER 132 37.761 13.548 10.367 927 HA SER 132 HA SER 132 39.853 11.765 11.373 928 HB2 SER 132 HB2 SER 132 40.764 13.952 12.310 929 HB3 SER 132 HB3 SER 132 40.729 13.810 10.552 930 HG SER 132 HG SER 132 39.620 15.686 12.029 931 H THR 133 H THR 133 36.997 11.690 12.242 932 HA THR 133 HA THR 133 36.874 12.814 14.861 933 HB THR 133 HB THR 133 34.832 12.387 13.521 934 HG1 THR 133 HG1 THR 133 35.230 11.689 16.129 935 HG21 THR 133 HG21 THR 133 35.458 10.237 12.527 936 HG22 THR 133 HG22 THR 133 33.916 10.123 13.373 937 HG23 THR 133 HG23 THR 133 35.377 9.476 14.116 Start of MODEL 11 1 HA2 GLY 1 HA2 GLY 1 -0.571 -0.546 -6.820 2 HA3 GLY 1 HA3 GLY 1 -0.606 -1.291 -5.228 3 H SER 2 H SER 2 2.141 -1.335 -7.455 4 HA SER 2 HA SER 2 3.613 0.306 -5.501 5 HB2 SER 2 HB2 SER 2 4.730 -1.789 -7.377 6 HB3 SER 2 HB3 SER 2 5.626 -0.903 -6.144 7 HG SER 2 HG SER 2 4.455 -3.181 -5.824 8 H GLY 3 H GLY 3 2.376 0.202 -8.621 9 HA2 GLY 3 HA2 GLY 3 2.443 1.851 -10.246 10 HA3 GLY 3 HA3 GLY 3 3.681 2.680 -9.310 11 H ASN 4 H ASN 4 5.521 2.857 -10.388 12 HA ASN 4 HA ASN 4 6.499 0.542 -11.894 13 HB2 ASN 4 HB2 ASN 4 5.589 1.855 -13.638 14 HB3 ASN 4 HB3 ASN 4 6.183 3.354 -12.934 15 HD21 ASN 4 HD22 ASN 4 7.057 0.467 -14.678 16 HD22 ASN 4 HD21 ASN 4 8.573 1.049 -15.270 17 H SER 5 H SER 5 7.417 3.863 -10.983 18 HA SER 5 HA SER 5 9.735 2.898 -9.564 19 HB2 SER 5 HB2 SER 5 10.471 2.966 -11.979 20 HB3 SER 5 HB3 SER 5 10.156 4.699 -11.970 21 HG SER 5 HG SER 5 11.663 4.691 -10.080 22 H GLN 6 H GLN 6 7.327 4.352 -9.007 23 HA GLN 6 HA GLN 6 8.275 7.050 -8.437 24 HB2 GLN 6 HB2 GLN 6 5.492 5.875 -8.291 25 HB3 GLN 6 HB3 GLN 6 5.902 7.535 -7.894 26 HG2 GLN 6 HG2 GLN 6 4.963 7.543 -10.062 27 HG3 GLN 6 HG3 GLN 6 6.691 7.819 -10.248 28 HE21 GLN 6 HE22 GLN 6 6.610 7.145 -12.407 29 HE22 GLN 6 HE21 GLN 6 6.443 5.475 -12.835 30 HA PRO 7 HA PRO 7 8.838 5.112 -4.364 31 HB2 PRO 7 HB2 PRO 7 10.737 7.210 -3.795 32 HB3 PRO 7 HB3 PRO 7 11.042 5.492 -4.055 33 HG2 PRO 7 HG2 PRO 7 11.829 7.481 -5.781 34 HG3 PRO 7 HG3 PRO 7 11.560 5.795 -6.256 35 HD2 PRO 7 HD2 PRO 7 9.777 8.174 -6.604 36 HD3 PRO 7 HD3 PRO 7 10.059 6.797 -7.696 37 H ILE 8 H ILE 8 9.381 8.633 -4.306 38 HA ILE 8 HA ILE 8 7.123 8.865 -2.443 39 HB ILE 8 HB ILE 8 9.281 8.862 -1.220 40 HG12 ILE 8 HG12 ILE 8 8.054 11.617 -1.125 41 HG13 ILE 8 HG13 ILE 8 7.233 10.192 -0.493 42 HG21 ILE 8 HG21 ILE 8 9.845 11.362 -2.815 43 HG22 ILE 8 HG22 ILE 8 10.715 9.831 -2.918 44 HG23 ILE 8 HG23 ILE 8 10.794 10.794 -1.442 45 HD11 ILE 8 HD11 ILE 8 8.438 11.536 1.209 46 HD12 ILE 8 HD12 ILE 8 9.951 11.101 0.411 47 HD13 ILE 8 HD13 ILE 8 8.939 9.848 1.130 48 H TRP 9 H TRP 9 8.491 9.837 -5.305 49 HA TRP 9 HA TRP 9 7.422 12.542 -5.277 50 HB2 TRP 9 HB2 TRP 9 8.738 10.968 -7.503 51 HB3 TRP 9 HB3 TRP 9 8.282 12.662 -7.593 52 HD1 TRP 9 HD1 TRP 9 11.064 10.398 -6.502 53 HE1 TRP 9 HE1 TRP 9 12.998 11.802 -5.536 54 HE3 TRP 9 HE3 TRP 9 8.689 14.913 -6.144 55 HZ2 TRP 9 HZ2 TRP 9 13.448 14.470 -4.727 56 HZ3 TRP 9 HZ3 TRP 9 9.937 16.840 -5.260 57 HH2 TRP 9 HH2 TRP 9 12.270 16.620 -4.565 58 H THR 10 H THR 10 6.021 9.738 -5.293 59 HA THR 10 HA THR 10 4.455 9.562 -7.627 60 HB THR 10 HB THR 10 3.395 8.581 -5.021 61 HG1 THR 10 HG1 THR 10 5.094 6.781 -5.485 62 HG21 THR 10 HG21 THR 10 2.338 7.986 -7.166 63 HG22 THR 10 HG22 THR 10 2.977 6.569 -6.335 64 HG23 THR 10 HG23 THR 10 3.856 7.259 -7.699 65 H ASN 11 H ASN 11 4.046 11.168 -4.547 66 HA ASN 11 HA ASN 11 1.728 12.597 -5.605 67 HB2 ASN 11 HB2 ASN 11 0.702 12.503 -3.312 68 HB3 ASN 11 HB3 ASN 11 0.742 10.961 -4.154 69 HD21 ASN 11 HD22 ASN 11 0.534 11.589 -1.307 70 HD22 ASN 11 HD21 ASN 11 1.841 10.750 -0.549 71 HA PRO 12 HA PRO 12 4.073 16.170 -4.669 72 HB2 PRO 12 HB2 PRO 12 1.930 17.856 -4.095 73 HB3 PRO 12 HB3 PRO 12 2.591 17.540 -5.701 74 HG2 PRO 12 HG2 PRO 12 0.214 16.342 -4.357 75 HG3 PRO 12 HG3 PRO 12 0.442 16.782 -6.059 76 HD2 PRO 12 HD2 PRO 12 0.565 14.232 -5.256 77 HD3 PRO 12 HD3 PRO 12 1.642 14.847 -6.526 78 H ASN 13 H ASN 13 1.439 15.345 -2.447 79 HA ASN 13 HA ASN 13 2.203 17.022 -0.338 80 HB2 ASN 13 HB2 ASN 13 0.017 16.021 -0.341 81 HB3 ASN 13 HB3 ASN 13 0.702 14.400 -0.324 82 HD21 ASN 13 HD22 ASN 13 0.148 17.294 1.544 83 HD22 ASN 13 HD21 ASN 13 0.372 16.563 3.098 84 H ALA 14 H ALA 14 3.170 13.705 -1.103 85 HA ALA 14 HA ALA 14 4.532 13.259 1.354 86 HB1 ALA 14 HB1 ALA 14 4.840 11.851 -1.293 87 HB2 ALA 14 HB2 ALA 14 3.694 11.427 -0.023 88 HB3 ALA 14 HB3 ALA 14 5.427 11.267 0.264 89 H ALA 15 H ALA 15 5.642 14.046 -1.923 90 HA ALA 15 HA ALA 15 8.382 14.058 -1.442 91 HB1 ALA 15 HB1 ALA 15 6.847 15.775 -3.388 92 HB2 ALA 15 HB2 ALA 15 7.369 14.114 -3.674 93 HB3 ALA 15 HB3 ALA 15 8.567 15.393 -3.466 94 H MET 16 H MET 16 6.177 16.866 -1.507 95 HA MET 16 HA MET 16 8.076 18.725 -0.698 96 HB2 MET 16 HB2 MET 16 5.206 18.611 -1.136 97 HB3 MET 16 HB3 MET 16 5.659 19.755 0.127 98 HG2 MET 16 HG2 MET 16 5.549 20.420 -2.421 99 HG3 MET 16 HG3 MET 16 6.719 21.117 -1.319 100 HE1 MET 16 HE1 MET 16 10.044 20.200 -2.646 101 HE2 MET 16 HE2 MET 16 9.193 20.325 -1.106 102 HE3 MET 16 HE3 MET 16 8.992 21.579 -2.326 103 H THR 17 H THR 17 6.074 16.562 1.212 104 HA THR 17 HA THR 17 6.397 17.800 3.704 105 HB THR 17 HB THR 17 6.056 14.886 2.991 106 HG1 THR 17 HG1 THR 17 4.171 15.910 2.624 107 HG21 THR 17 HG21 THR 17 7.185 14.958 5.139 108 HG22 THR 17 HG22 THR 17 5.491 14.528 5.382 109 HG23 THR 17 HG23 THR 17 6.044 16.165 5.729 110 H MET 18 H MET 18 8.412 15.290 2.134 111 HA MET 18 HA MET 18 10.202 15.200 4.338 112 HB2 MET 18 HB2 MET 18 11.645 13.802 2.889 113 HB3 MET 18 HB3 MET 18 9.994 13.229 3.008 114 HG2 MET 18 HG2 MET 18 10.549 12.936 0.779 115 HG3 MET 18 HG3 MET 18 9.603 14.420 0.789 116 HE1 MET 18 HE1 MET 18 10.594 14.646 -1.725 117 HE2 MET 18 HE2 MET 18 11.674 13.265 -1.520 118 HE3 MET 18 HE3 MET 18 12.315 14.812 -2.077 119 H THR 19 H THR 19 10.090 17.094 1.423 120 HA THR 19 HA THR 19 12.777 18.015 1.554 121 HB THR 19 HB THR 19 10.418 19.416 0.284 122 HG1 THR 19 HG1 THR 19 11.568 17.044 -0.309 123 HG21 THR 19 HG21 THR 19 12.092 20.381 -1.198 124 HG22 THR 19 HG22 THR 19 13.366 19.495 -0.362 125 HG23 THR 19 HG23 THR 19 12.475 20.761 0.482 126 H ASN 20 H ASN 20 9.680 19.283 2.776 127 HA ASN 20 HA ASN 20 10.777 21.697 3.797 128 HB2 ASN 20 HB2 ASN 20 8.202 20.229 4.205 129 HB3 ASN 20 HB3 ASN 20 8.621 21.547 5.289 130 HD21 ASN 20 HD22 ASN 20 7.701 20.655 2.089 131 HD22 ASN 20 HD21 ASN 20 7.393 22.260 1.508 132 H ASN 21 H ASN 21 10.049 18.551 5.269 133 HA ASN 21 HA ASN 21 10.765 19.297 7.885 134 HB2 ASN 21 HB2 ASN 21 10.572 16.622 6.522 135 HB3 ASN 21 HB3 ASN 21 11.041 16.776 8.208 136 HD21 ASN 21 HD22 ASN 21 8.733 15.444 7.173 137 HD22 ASN 21 HD21 ASN 21 7.347 16.243 7.824 138 H LEU 22 H LEU 22 12.635 18.238 5.149 139 HA LEU 22 HA LEU 22 15.066 17.693 6.472 140 HB2 LEU 22 HB2 LEU 22 14.762 17.037 4.177 141 HB3 LEU 22 HB3 LEU 22 14.468 18.695 3.689 142 HG LEU 22 HG LEU 22 16.831 19.233 4.286 143 HD11 LEU 22 HD11 LEU 22 18.411 17.391 4.582 144 HD12 LEU 22 HD12 LEU 22 17.072 16.245 4.606 145 HD13 LEU 22 HD13 LEU 22 17.229 17.444 5.889 146 HD21 LEU 22 HD21 LEU 22 16.228 18.809 1.989 147 HD22 LEU 22 HD22 LEU 22 16.385 17.071 2.237 148 HD23 LEU 22 HD23 LEU 22 17.811 18.105 2.324 149 H VAL 23 H VAL 23 13.774 20.639 4.988 150 HA VAL 23 HA VAL 23 15.981 22.289 5.579 151 HB VAL 23 HB VAL 23 13.096 23.090 5.135 152 HG11 VAL 23 HG11 VAL 23 13.984 25.281 4.538 153 HG12 VAL 23 HG12 VAL 23 15.619 24.736 4.912 154 HG13 VAL 23 HG13 VAL 23 14.416 24.864 6.196 155 HG21 VAL 23 HG21 VAL 23 13.802 23.510 2.823 156 HG22 VAL 23 HG22 VAL 23 13.987 21.813 3.267 157 HG23 VAL 23 HG23 VAL 23 15.400 22.868 3.198 158 H GLN 24 H GLN 24 12.883 21.784 7.279 159 HA GLN 24 HA GLN 24 13.402 23.714 9.279 160 HB2 GLN 24 HB2 GLN 24 11.487 22.877 10.420 161 HB3 GLN 24 HB3 GLN 24 11.144 22.754 8.703 162 HG2 GLN 24 HG2 GLN 24 10.375 20.738 9.379 163 HG3 GLN 24 HG3 GLN 24 12.053 20.303 9.058 164 HE21 GLN 24 HE22 GLN 24 12.052 18.596 10.506 165 HE22 GLN 24 HE21 GLN 24 12.004 18.826 12.219 166 H CYS 25 H CYS 25 14.278 20.352 8.948 167 HA CYS 25 HA CYS 25 15.108 19.893 11.614 168 HB2 CYS 25 HB2 CYS 25 14.668 18.111 9.903 169 HB3 CYS 25 HB3 CYS 25 16.159 18.582 9.095 170 H ALA 26 H ALA 26 16.874 20.877 8.685 171 HA ALA 26 HA ALA 26 19.384 21.139 10.010 172 HB1 ALA 26 HB1 ALA 26 18.475 22.362 7.403 173 HB2 ALA 26 HB2 ALA 26 19.191 20.761 7.590 174 HB3 ALA 26 HB3 ALA 26 20.143 22.200 7.958 175 H SER 27 H SER 27 16.680 23.273 9.428 176 HA SER 27 HA SER 27 17.948 25.716 10.062 177 HB2 SER 27 HB2 SER 27 15.757 25.544 8.909 178 HB3 SER 27 HB3 SER 27 15.040 24.949 10.407 179 HG SER 27 HG SER 27 16.315 27.187 10.991 180 H ARG 28 H ARG 28 16.886 23.089 12.000 181 HA ARG 28 HA ARG 28 17.098 24.747 14.421 182 HB2 ARG 28 HB2 ARG 28 15.673 22.117 14.009 183 HB3 ARG 28 HB3 ARG 28 15.776 22.981 15.539 184 HG2 ARG 28 HG2 ARG 28 14.420 23.936 13.024 185 HG3 ARG 28 HG3 ARG 28 13.628 23.352 14.490 186 HD2 ARG 28 HD2 ARG 28 14.573 25.219 15.748 187 HD3 ARG 28 HD3 ARG 28 15.391 25.793 14.297 188 HE ARG 28 HE ARG 28 12.473 25.555 14.255 189 HH11 ARG 28 HH11 ARG 28 15.327 27.583 14.321 190 HH12 ARG 28 HH12 ARG 28 14.473 29.032 13.893 191 HH21 ARG 28 HH21 ARG 28 11.335 27.461 13.686 192 HH22 ARG 28 HH22 ARG 28 12.202 28.956 13.507 193 H SER 29 H SER 29 19.079 23.065 12.660 194 HA SER 29 HA SER 29 20.076 21.106 14.491 195 HB2 SER 29 HB2 SER 29 21.932 20.856 12.915 196 HB3 SER 29 HB3 SER 29 20.399 20.898 12.044 197 HG SER 29 HG SER 29 20.882 22.825 11.224 198 H GLY 30 H GLY 30 21.039 24.366 13.523 199 HA2 GLY 30 HA2 GLY 30 22.211 25.949 14.777 200 HA3 GLY 30 HA3 GLY 30 22.492 24.724 16.008 201 H VAL 31 H VAL 31 23.174 23.415 13.064 202 HA VAL 31 HA VAL 31 26.044 23.631 13.543 203 HB VAL 31 HB VAL 31 24.554 21.879 11.581 204 HG11 VAL 31 HG11 VAL 31 27.407 21.791 12.553 205 HG12 VAL 31 HG12 VAL 31 26.861 22.231 10.934 206 HG13 VAL 31 HG13 VAL 31 26.644 20.582 11.520 207 HG21 VAL 31 HG21 VAL 31 23.926 21.356 13.884 208 HG22 VAL 31 HG22 VAL 31 25.629 21.192 14.314 209 HG23 VAL 31 HG23 VAL 31 24.893 20.063 13.175 210 H LEU 32 H LEU 32 23.640 24.247 11.046 211 HA LEU 32 HA LEU 32 25.617 25.187 9.164 212 HB2 LEU 32 HB2 LEU 32 22.605 25.064 9.082 213 HB3 LEU 32 HB3 LEU 32 23.556 25.788 7.802 214 HG LEU 32 HG LEU 32 24.718 23.538 7.568 215 HD11 LEU 32 HD11 LEU 32 24.092 22.550 9.685 216 HD12 LEU 32 HD12 LEU 32 23.464 21.584 8.353 217 HD13 LEU 32 HD13 LEU 32 22.386 22.648 9.254 218 HD21 LEU 32 HD21 LEU 32 21.774 23.753 6.979 219 HD22 LEU 32 HD22 LEU 32 22.882 22.598 6.239 220 HD23 LEU 32 HD23 LEU 32 23.096 24.327 5.964 221 H THR 33 H THR 33 25.524 27.333 8.222 222 HA THR 33 HA THR 33 25.341 29.353 10.257 223 HB THR 33 HB THR 33 26.211 30.882 8.597 224 HG1 THR 33 HG1 THR 33 26.587 29.918 6.405 225 HG21 THR 33 HG21 THR 33 27.502 28.181 8.241 226 HG22 THR 33 HG22 THR 33 27.794 29.276 9.591 227 HG23 THR 33 HG23 THR 33 28.265 29.747 7.958 228 H ALA 34 H ALA 34 24.233 31.476 9.728 229 HA ALA 34 HA ALA 34 21.463 31.050 9.400 230 HB1 ALA 34 HB1 ALA 34 22.991 33.646 9.259 231 HB2 ALA 34 HB2 ALA 34 22.402 32.886 10.737 232 HB3 ALA 34 HB3 ALA 34 21.257 33.469 9.528 233 H ASP 35 H ASP 35 24.033 31.731 7.208 234 HA ASP 35 HA ASP 35 22.339 32.567 5.030 235 HB2 ASP 35 HB2 ASP 35 25.177 31.563 4.806 236 HB3 ASP 35 HB3 ASP 35 24.324 32.647 3.716 237 H GLN 36 H GLN 36 24.249 29.692 5.847 238 HA GLN 36 HA GLN 36 23.664 28.067 3.691 239 HB2 GLN 36 HB2 GLN 36 24.424 27.599 6.527 240 HB3 GLN 36 HB3 GLN 36 23.817 26.221 5.619 241 HG2 GLN 36 HG2 GLN 36 25.563 26.460 3.992 242 HG3 GLN 36 HG3 GLN 36 26.117 27.953 4.752 243 HE21 GLN 36 HE22 GLN 36 27.447 25.327 4.262 244 HE22 GLN 36 HE21 GLN 36 28.046 24.841 5.810 245 H MET 37 H MET 37 21.795 28.481 6.680 246 HA MET 37 HA MET 37 19.871 26.490 6.085 247 HB2 MET 37 HB2 MET 37 19.720 28.895 7.911 248 HB3 MET 37 HB3 MET 37 18.480 27.650 7.823 249 HG2 MET 37 HG2 MET 37 20.138 25.972 8.507 250 HG3 MET 37 HG3 MET 37 21.349 27.248 8.637 251 HE1 MET 37 HE1 MET 37 19.718 29.658 9.898 252 HE2 MET 37 HE2 MET 37 21.311 29.154 10.465 253 HE3 MET 37 HE3 MET 37 19.995 29.378 11.619 254 H ASP 38 H ASP 38 20.090 29.906 5.296 255 HA ASP 38 HA ASP 38 17.378 30.132 4.406 256 HB2 ASP 38 HB2 ASP 38 18.683 32.083 5.191 257 HB3 ASP 38 HB3 ASP 38 19.740 31.918 3.791 258 H ASP 39 H ASP 39 20.482 29.476 2.872 259 HA ASP 39 HA ASP 39 19.661 29.472 0.196 260 HB2 ASP 39 HB2 ASP 39 21.752 27.861 1.650 261 HB3 ASP 39 HB3 ASP 39 21.464 27.656 -0.073 262 H MET 40 H MET 40 19.427 27.004 2.701 263 HA MET 40 HA MET 40 18.394 24.972 0.997 264 HB2 MET 40 HB2 MET 40 18.251 25.298 3.997 265 HB3 MET 40 HB3 MET 40 17.692 23.872 3.134 266 HG2 MET 40 HG2 MET 40 19.991 23.567 2.260 267 HG3 MET 40 HG3 MET 40 20.507 24.921 3.262 268 HE1 MET 40 HE1 MET 40 19.027 21.310 3.211 269 HE2 MET 40 HE2 MET 40 17.834 22.136 4.213 270 HE3 MET 40 HE3 MET 40 18.899 20.924 4.925 271 H GLY 41 H GLY 41 16.963 27.525 2.924 272 HA2 GLY 41 HA2 GLY 41 14.282 26.713 2.826 273 HA3 GLY 41 HA3 GLY 41 14.833 28.377 2.971 274 H MET 42 H MET 42 16.085 28.834 0.607 275 HA MET 42 HA MET 42 13.873 29.165 -1.158 276 HB2 MET 42 HB2 MET 42 15.404 30.313 -2.622 277 HB3 MET 42 HB3 MET 42 15.706 30.818 -0.967 278 HG2 MET 42 HG2 MET 42 17.603 29.251 -0.872 279 HG3 MET 42 HG3 MET 42 17.321 28.851 -2.564 280 HE1 MET 42 HE1 MET 42 17.057 32.382 -0.782 281 HE2 MET 42 HE2 MET 42 18.694 32.989 -1.042 282 HE3 MET 42 HE3 MET 42 18.427 31.588 -0.008 283 H MET 43 H MET 43 16.358 26.807 -0.802 284 HA MET 43 HA MET 43 16.282 25.647 -3.370 285 HB2 MET 43 HB2 MET 43 18.049 25.145 -1.759 286 HB3 MET 43 HB3 MET 43 16.881 24.416 -0.670 287 HG2 MET 43 HG2 MET 43 17.309 23.337 -3.430 288 HG3 MET 43 HG3 MET 43 18.373 22.894 -2.098 289 HE1 MET 43 HE1 MET 43 16.198 22.870 0.349 290 HE2 MET 43 HE2 MET 43 17.496 21.695 0.134 291 HE3 MET 43 HE3 MET 43 15.836 21.143 0.361 292 H ALA 44 H ALA 44 14.396 25.086 -0.430 293 HA ALA 44 HA ALA 44 12.881 22.907 -1.356 294 HB1 ALA 44 HB1 ALA 44 12.155 25.000 0.689 295 HB2 ALA 44 HB2 ALA 44 12.998 23.485 1.000 296 HB3 ALA 44 HB3 ALA 44 11.322 23.465 0.457 297 H ASP 45 H ASP 45 12.402 26.393 -1.631 298 HA ASP 45 HA ASP 45 9.838 26.327 -2.795 299 HB2 ASP 45 HB2 ASP 45 12.091 28.325 -3.010 300 HB3 ASP 45 HB3 ASP 45 10.540 28.563 -3.807 301 H SER 46 H SER 46 13.078 26.184 -4.182 302 HA SER 46 HA SER 46 12.340 26.179 -6.892 303 HB2 SER 46 HB2 SER 46 14.651 26.546 -6.129 304 HB3 SER 46 HB3 SER 46 14.736 24.878 -5.567 305 HG SER 46 HG SER 46 15.411 25.708 -7.904 306 H VAL 47 H VAL 47 12.776 23.522 -4.576 307 HA VAL 47 HA VAL 47 12.277 21.433 -6.413 308 HB VAL 47 HB VAL 47 11.805 21.430 -3.425 309 HG11 VAL 47 HG11 VAL 47 11.983 18.999 -3.596 310 HG12 VAL 47 HG12 VAL 47 12.155 19.129 -5.347 311 HG13 VAL 47 HG13 VAL 47 10.643 19.604 -4.572 312 HG21 VAL 47 HG21 VAL 47 14.217 20.556 -5.016 313 HG22 VAL 47 HG22 VAL 47 14.016 20.411 -3.270 314 HG23 VAL 47 HG23 VAL 47 14.111 22.005 -4.016 315 H ASN 48 H ASN 48 10.153 23.319 -4.304 316 HA ASN 48 HA ASN 48 7.746 22.026 -4.603 317 HB2 ASN 48 HB2 ASN 48 8.550 24.837 -4.156 318 HB3 ASN 48 HB3 ASN 48 6.920 24.608 -4.774 319 HD21 ASN 48 HD22 ASN 48 9.076 24.100 -2.109 320 HD22 ASN 48 HD21 ASN 48 7.859 23.662 -0.958 321 H SER 49 H SER 49 9.012 24.577 -6.756 322 HA SER 49 HA SER 49 6.940 24.472 -8.609 323 HB2 SER 49 HB2 SER 49 9.816 25.263 -9.081 324 HB3 SER 49 HB3 SER 49 8.397 25.821 -9.948 325 HG SER 49 HG SER 49 9.314 27.192 -8.169 326 H GLN 50 H GLN 50 10.017 22.731 -8.446 327 HA GLN 50 HA GLN 50 9.804 21.664 -11.081 328 HB2 GLN 50 HB2 GLN 50 11.596 20.948 -8.764 329 HB3 GLN 50 HB3 GLN 50 11.727 20.224 -10.364 330 HG2 GLN 50 HG2 GLN 50 12.109 22.456 -11.318 331 HG3 GLN 50 HG3 GLN 50 12.035 23.145 -9.699 332 HE21 GLN 50 HE22 GLN 50 13.755 22.864 -8.305 333 HE22 GLN 50 HE21 GLN 50 15.286 22.262 -8.832 334 H MET 51 H MET 51 8.923 20.497 -7.889 335 HA MET 51 HA MET 51 8.267 17.862 -8.734 336 HB2 MET 51 HB2 MET 51 8.743 18.280 -6.411 337 HB3 MET 51 HB3 MET 51 7.471 19.484 -6.313 338 HG2 MET 51 HG2 MET 51 6.779 16.671 -7.020 339 HG3 MET 51 HG3 MET 51 7.117 17.094 -5.343 340 HE1 MET 51 HE1 MET 51 4.379 19.795 -4.620 341 HE2 MET 51 HE2 MET 51 6.117 19.884 -4.919 342 HE3 MET 51 HE3 MET 51 5.470 18.655 -3.826 343 H GLN 52 H GLN 52 6.431 20.863 -8.349 344 HA GLN 52 HA GLN 52 3.904 19.691 -8.903 345 HB2 GLN 52 HB2 GLN 52 4.838 22.555 -9.003 346 HB3 GLN 52 HB3 GLN 52 3.168 22.067 -9.259 347 HG2 GLN 52 HG2 GLN 52 3.082 21.121 -7.021 348 HG3 GLN 52 HG3 GLN 52 4.770 21.558 -6.761 349 HE21 GLN 52 HE22 GLN 52 5.314 23.716 -6.475 350 HE22 GLN 52 HE21 GLN 52 4.133 24.916 -6.069 351 H LYS 53 H LYS 53 6.407 21.090 -10.938 352 HA LYS 53 HA LYS 53 4.803 21.224 -13.294 353 HB2 LYS 53 HB2 LYS 53 6.780 21.722 -14.477 354 HB3 LYS 53 HB3 LYS 53 6.973 22.470 -12.899 355 HG2 LYS 53 HG2 LYS 53 8.411 20.662 -12.183 356 HG3 LYS 53 HG3 LYS 53 8.167 19.833 -13.722 357 HD2 LYS 53 HD2 LYS 53 9.180 21.734 -14.891 358 HD3 LYS 53 HD3 LYS 53 9.452 22.530 -13.342 359 HE2 LYS 53 HE2 LYS 53 10.882 20.666 -12.640 360 HE3 LYS 53 HE3 LYS 53 10.613 19.877 -14.191 361 HZ1 LYS 53 HZ1 LYS 53 11.944 22.505 -13.803 362 HZ2 LYS 53 HZ2 LYS 53 11.694 21.734 -15.285 363 HZ3 LYS 53 HZ3 LYS 53 12.726 21.043 -14.140 364 H MET 54 H MET 54 6.221 18.684 -11.575 365 HA MET 54 HA MET 54 6.563 16.908 -13.822 366 HB2 MET 54 HB2 MET 54 8.068 16.698 -11.941 367 HB3 MET 54 HB3 MET 54 6.721 16.464 -10.838 368 HG2 MET 54 HG2 MET 54 6.276 14.326 -11.651 369 HG3 MET 54 HG3 MET 54 7.234 14.582 -13.108 370 HE1 MET 54 HE1 MET 54 7.360 14.234 -9.209 371 HE2 MET 54 HE2 MET 54 8.401 15.639 -9.459 372 HE3 MET 54 HE3 MET 54 9.092 14.108 -8.907 373 H GLY 55 H GLY 55 4.320 17.232 -11.081 374 HA2 GLY 55 HA2 GLY 55 2.038 16.887 -11.090 375 HA3 GLY 55 HA3 GLY 55 2.158 16.390 -12.769 376 HA PRO 56 HA PRO 56 1.278 12.669 -10.049 377 HB2 PRO 56 HB2 PRO 56 -1.100 12.009 -11.155 378 HB3 PRO 56 HB3 PRO 56 -0.962 13.177 -9.836 379 HG2 PRO 56 HG2 PRO 56 -1.254 13.668 -12.775 380 HG3 PRO 56 HG3 PRO 56 -2.061 14.478 -11.420 381 HD2 PRO 56 HD2 PRO 56 0.082 15.541 -12.714 382 HD3 PRO 56 HD3 PRO 56 -0.259 15.846 -11.001 383 H ASN 57 H ASN 57 1.443 10.521 -10.659 384 HA ASN 57 HA ASN 57 2.292 8.807 -11.879 385 HB2 ASN 57 HB2 ASN 57 0.361 10.000 -13.865 386 HB3 ASN 57 HB3 ASN 57 1.208 8.484 -14.149 387 HD21 ASN 57 HD22 ASN 57 -1.643 9.024 -13.894 388 HD22 ASN 57 HD21 ASN 57 -2.204 8.027 -12.600 389 HA PRO 58 HA PRO 58 5.235 11.622 -14.131 390 HB2 PRO 58 HB2 PRO 58 7.277 10.852 -12.237 391 HB3 PRO 58 HB3 PRO 58 6.597 12.452 -12.534 392 HG2 PRO 58 HG2 PRO 58 6.199 11.042 -10.228 393 HG3 PRO 58 HG3 PRO 58 5.061 12.249 -10.855 394 HD2 PRO 58 HD2 PRO 58 4.959 9.264 -11.053 395 HD3 PRO 58 HD3 PRO 58 3.644 10.417 -10.737 396 HA PRO 59 HA PRO 59 6.955 8.009 -16.219 397 HB2 PRO 59 HB2 PRO 59 8.296 9.485 -18.106 398 HB3 PRO 59 HB3 PRO 59 6.596 9.030 -18.237 399 HG2 PRO 59 HG2 PRO 59 7.809 11.611 -17.356 400 HG3 PRO 59 HG3 PRO 59 6.377 11.329 -18.361 401 HD2 PRO 59 HD2 PRO 59 6.205 12.003 -15.756 402 HD3 PRO 59 HD3 PRO 59 5.020 10.937 -16.537 403 H GLN 60 H GLN 60 9.197 7.348 -16.789 404 HA GLN 60 HA GLN 60 10.719 7.439 -14.464 405 HB2 GLN 60 HB2 GLN 60 11.485 6.574 -17.251 406 HB3 GLN 60 HB3 GLN 60 12.514 6.336 -15.850 407 HG2 GLN 60 HG2 GLN 60 11.402 4.290 -16.258 408 HG3 GLN 60 HG3 GLN 60 10.663 5.000 -14.826 409 HE21 GLN 60 HE22 GLN 60 8.542 5.658 -14.900 410 HE22 GLN 60 HE21 GLN 60 7.483 5.273 -16.209 411 H HIS 61 H HIS 61 11.137 9.253 -17.470 412 HA HIS 61 HA HIS 61 13.688 10.283 -16.798 413 HB2 HIS 61 HB2 HIS 61 13.408 11.806 -18.683 414 HB3 HIS 61 HB3 HIS 61 12.919 10.177 -19.122 415 HD1 HIS 61 HD1 HIS 61 10.607 9.904 -20.069 416 HD2 HIS 61 HD2 HIS 61 11.179 13.622 -18.300 417 HE1 HIS 61 HE1 HIS 61 8.566 11.255 -20.651 418 H ARG 62 H ARG 62 10.649 11.047 -15.563 419 HA ARG 62 HA ARG 62 11.255 13.823 -15.012 420 HB2 ARG 62 HB2 ARG 62 8.973 12.007 -14.278 421 HB3 ARG 62 HB3 ARG 62 9.140 13.607 -13.567 422 HG2 ARG 62 HG2 ARG 62 9.020 13.102 -16.528 423 HG3 ARG 62 HG3 ARG 62 7.612 13.482 -15.534 424 HD2 ARG 62 HD2 ARG 62 8.715 15.588 -14.849 425 HD3 ARG 62 HD3 ARG 62 10.049 15.211 -15.938 426 HE ARG 62 HE ARG 62 8.013 15.132 -17.634 427 HH11 ARG 62 HH11 ARG 62 8.721 17.441 -15.108 428 HH12 ARG 62 HH12 ARG 62 7.966 18.768 -15.929 429 HH21 ARG 62 HH21 ARG 62 7.024 16.892 -18.732 430 HH22 ARG 62 HH22 ARG 62 7.025 18.461 -17.992 431 H LEU 63 H LEU 63 11.015 10.795 -13.169 432 HA LEU 63 HA LEU 63 11.668 11.918 -10.656 433 HB2 LEU 63 HB2 LEU 63 12.075 9.094 -11.668 434 HB3 LEU 63 HB3 LEU 63 12.268 9.584 -10.001 435 HG LEU 63 HG LEU 63 10.177 8.616 -9.994 436 HD11 LEU 63 HD11 LEU 63 10.083 10.846 -9.021 437 HD12 LEU 63 HD12 LEU 63 8.537 10.371 -9.727 438 HD13 LEU 63 HD13 LEU 63 9.584 11.503 -10.581 439 HD21 LEU 63 HD21 LEU 63 9.484 9.986 -12.582 440 HD22 LEU 63 HD22 LEU 63 8.502 8.812 -11.705 441 HD23 LEU 63 HD23 LEU 63 10.028 8.317 -12.435 442 H ARG 64 H ARG 64 13.550 10.730 -13.339 443 HA ARG 64 HA ARG 64 16.037 10.492 -12.040 444 HB2 ARG 64 HB2 ARG 64 15.263 10.792 -14.917 445 HB3 ARG 64 HB3 ARG 64 16.945 10.670 -14.410 446 HG2 ARG 64 HG2 ARG 64 16.449 8.522 -13.330 447 HG3 ARG 64 HG3 ARG 64 14.781 8.641 -13.892 448 HD2 ARG 64 HD2 ARG 64 16.102 7.210 -15.342 449 HD3 ARG 64 HD3 ARG 64 15.546 8.648 -16.190 450 HE ARG 64 HE ARG 64 17.937 9.478 -15.520 451 HH11 ARG 64 HH11 ARG 64 17.038 6.271 -16.613 452 HH12 ARG 64 HH12 ARG 64 18.566 5.965 -17.364 453 HH21 ARG 64 HH21 ARG 64 19.943 9.077 -16.505 454 HH22 ARG 64 HH22 ARG 64 20.222 7.564 -17.307 455 H ALA 65 H ALA 65 14.332 13.235 -13.270 456 HA ALA 65 HA ALA 65 16.696 14.912 -13.294 457 HB1 ALA 65 HB1 ALA 65 15.164 16.708 -13.914 458 HB2 ALA 65 HB2 ALA 65 13.789 15.636 -13.640 459 HB3 ALA 65 HB3 ALA 65 14.931 15.292 -14.940 460 H MET 66 H MET 66 14.000 14.186 -11.200 461 HA MET 66 HA MET 66 14.140 16.529 -9.623 462 HB2 MET 66 HB2 MET 66 12.868 13.853 -9.103 463 HB3 MET 66 HB3 MET 66 12.696 15.235 -8.028 464 HG2 MET 66 HG2 MET 66 11.801 15.044 -10.891 465 HG3 MET 66 HG3 MET 66 10.780 15.091 -9.457 466 HE1 MET 66 HE1 MET 66 12.330 17.284 -7.712 467 HE2 MET 66 HE2 MET 66 10.575 17.255 -7.870 468 HE3 MET 66 HE3 MET 66 11.463 18.750 -8.163 469 H ASN 67 H ASN 67 15.577 13.311 -9.201 470 HA ASN 67 HA ASN 67 16.513 13.712 -6.581 471 HB2 ASN 67 HB2 ASN 67 18.127 11.911 -7.024 472 HB3 ASN 67 HB3 ASN 67 16.525 11.485 -7.606 473 HD21 ASN 67 HD22 ASN 67 16.228 11.067 -9.723 474 HD22 ASN 67 HD21 ASN 67 17.493 11.095 -10.902 475 H THR 68 H THR 68 17.915 14.519 -9.708 476 HA THR 68 HA THR 68 20.386 15.445 -8.598 477 HB THR 68 HB THR 68 19.242 15.997 -11.344 478 HG1 THR 68 HG1 THR 68 19.950 13.669 -10.245 479 HG21 THR 68 HG21 THR 68 21.598 16.231 -11.995 480 HG22 THR 68 HG22 THR 68 22.089 15.966 -10.323 481 HG23 THR 68 HG23 THR 68 21.160 17.403 -10.752 482 H ALA 69 H ALA 69 17.311 16.851 -9.508 483 HA ALA 69 HA ALA 69 17.965 19.542 -9.605 484 HB1 ALA 69 HB1 ALA 69 15.790 18.679 -10.279 485 HB2 ALA 69 HB2 ALA 69 15.609 19.975 -9.095 486 HB3 ALA 69 HB3 ALA 69 15.409 18.292 -8.601 487 H MET 70 H MET 70 17.008 17.580 -6.799 488 HA MET 70 HA MET 70 17.218 19.707 -4.920 489 HB2 MET 70 HB2 MET 70 15.919 17.662 -4.467 490 HB3 MET 70 HB3 MET 70 17.402 16.718 -4.479 491 HG2 MET 70 HG2 MET 70 18.192 18.204 -2.582 492 HG3 MET 70 HG3 MET 70 16.531 18.782 -2.484 493 HE1 MET 70 HE1 MET 70 14.908 16.112 -3.231 494 HE2 MET 70 HE2 MET 70 14.443 17.192 -1.917 495 HE3 MET 70 HE3 MET 70 14.600 15.460 -1.621 496 H ALA 71 H ALA 71 19.339 17.035 -5.818 497 HA ALA 71 HA ALA 71 21.327 17.400 -3.923 498 HB1 ALA 71 HB1 ALA 71 22.717 16.018 -5.333 499 HB2 ALA 71 HB2 ALA 71 21.654 16.313 -6.709 500 HB3 ALA 71 HB3 ALA 71 21.063 15.403 -5.318 501 H ALA 72 H ALA 72 21.068 18.827 -7.168 502 HA ALA 72 HA ALA 72 23.684 19.946 -7.120 503 HB1 ALA 72 HB1 ALA 72 23.004 21.152 -9.119 504 HB2 ALA 72 HB2 ALA 72 21.325 20.697 -8.835 505 HB3 ALA 72 HB3 ALA 72 22.524 19.457 -9.207 506 H GLU 73 H GLU 73 20.566 21.089 -6.023 507 HA GLU 73 HA GLU 73 21.379 23.832 -5.829 508 HB2 GLU 73 HB2 GLU 73 19.026 22.412 -4.574 509 HB3 GLU 73 HB3 GLU 73 19.269 24.152 -4.588 510 HG2 GLU 73 HG2 GLU 73 18.812 22.376 -6.971 511 HG3 GLU 73 HG3 GLU 73 17.678 23.532 -6.277 512 H VAL 74 H VAL 74 21.050 21.128 -3.558 513 HA VAL 74 HA VAL 74 21.750 22.725 -1.286 514 HB VAL 74 HB VAL 74 21.936 20.570 -0.071 515 HG11 VAL 74 HG11 VAL 74 19.810 21.764 -0.209 516 HG12 VAL 74 HG12 VAL 74 19.559 20.020 -0.190 517 HG13 VAL 74 HG13 VAL 74 19.423 20.913 -1.704 518 HG21 VAL 74 HG21 VAL 74 22.715 19.178 -1.919 519 HG22 VAL 74 HG22 VAL 74 21.148 19.355 -2.710 520 HG23 VAL 74 HG23 VAL 74 21.267 18.507 -1.169 521 H ALA 75 H ALA 75 23.544 21.123 -3.701 522 HA ALA 75 HA ALA 75 25.910 20.456 -2.433 523 HB1 ALA 75 HB1 ALA 75 25.414 19.967 -4.789 524 HB2 ALA 75 HB2 ALA 75 26.996 20.723 -4.585 525 HB3 ALA 75 HB3 ALA 75 25.633 21.675 -5.177 526 H GLU 76 H GLU 76 24.668 23.602 -3.284 527 HA GLU 76 HA GLU 76 26.999 25.129 -3.097 528 HB2 GLU 76 HB2 GLU 76 24.127 25.828 -2.496 529 HB3 GLU 76 HB3 GLU 76 25.424 27.012 -2.527 530 HG2 GLU 76 HG2 GLU 76 24.575 25.286 -4.842 531 HG3 GLU 76 HG3 GLU 76 24.154 26.983 -4.611 532 H VAL 77 H VAL 77 24.612 24.310 -0.573 533 HA VAL 77 HA VAL 77 25.930 25.841 1.431 534 HB VAL 77 HB VAL 77 24.412 24.911 3.027 535 HG11 VAL 77 HG11 VAL 77 23.475 26.545 1.506 536 HG12 VAL 77 HG12 VAL 77 22.255 25.363 1.973 537 HG13 VAL 77 HG13 VAL 77 23.014 25.265 0.385 538 HG21 VAL 77 HG21 VAL 77 24.570 22.559 2.465 539 HG22 VAL 77 HG22 VAL 77 23.706 22.840 0.953 540 HG23 VAL 77 HG23 VAL 77 22.879 23.063 2.496 541 H VAL 78 H VAL 78 26.247 22.596 0.267 542 HA VAL 78 HA VAL 78 27.737 21.609 2.496 543 HB VAL 78 HB VAL 78 27.608 20.572 -0.342 544 HG11 VAL 78 HG11 VAL 78 29.561 19.733 0.835 545 HG12 VAL 78 HG12 VAL 78 28.369 18.450 0.620 546 HG13 VAL 78 HG13 VAL 78 28.549 19.235 2.191 547 HG21 VAL 78 HG21 VAL 78 26.049 19.774 2.117 548 HG22 VAL 78 HG22 VAL 78 25.965 18.983 0.543 549 HG23 VAL 78 HG23 VAL 78 25.414 20.648 0.723 550 H ALA 79 H ALA 79 28.535 23.042 -0.627 551 HA ALA 79 HA ALA 79 31.334 22.756 -0.471 552 HB1 ALA 79 HB1 ALA 79 31.434 24.482 -2.175 553 HB2 ALA 79 HB2 ALA 79 29.760 24.931 -1.853 554 HB3 ALA 79 HB3 ALA 79 30.133 23.348 -2.538 555 H THR 80 H THR 80 29.113 25.016 0.956 556 HA THR 80 HA THR 80 31.032 26.954 1.771 557 HB THR 80 HB THR 80 28.346 26.430 3.064 558 HG1 THR 80 HG1 THR 80 27.406 27.524 1.410 559 HG21 THR 80 HG21 THR 80 29.763 28.066 4.207 560 HG22 THR 80 HG22 THR 80 28.370 28.851 3.463 561 HG23 THR 80 HG23 THR 80 29.957 28.962 2.701 562 H SER 81 H SER 81 30.468 23.802 2.806 563 HA SER 81 HA SER 81 31.145 24.331 5.595 564 HB2 SER 81 HB2 SER 81 30.464 21.717 4.231 565 HB3 SER 81 HB3 SER 81 30.623 21.976 5.969 566 HG SER 81 HG SER 81 28.658 23.003 4.208 567 HA PRO 82 HA PRO 82 35.401 23.446 4.444 568 HB2 PRO 82 HB2 PRO 82 36.514 24.261 6.756 569 HB3 PRO 82 HB3 PRO 82 35.896 25.411 5.564 570 HG2 PRO 82 HG2 PRO 82 34.628 24.434 8.093 571 HG3 PRO 82 HG3 PRO 82 34.688 26.079 7.432 572 HD2 PRO 82 HD2 PRO 82 32.524 24.419 7.187 573 HD3 PRO 82 HD3 PRO 82 32.910 25.711 6.033 574 HA PRO 83 HA PRO 83 36.272 19.504 6.319 575 HB2 PRO 83 HB2 PRO 83 38.960 19.602 6.682 576 HB3 PRO 83 HB3 PRO 83 38.199 19.367 5.107 577 HG2 PRO 83 HG2 PRO 83 39.316 21.861 6.325 578 HG3 PRO 83 HG3 PRO 83 39.473 21.258 4.663 579 HD2 PRO 83 HD2 PRO 83 37.730 23.204 5.321 580 HD3 PRO 83 HD3 PRO 83 37.373 22.004 4.060 581 H GLN 84 H GLN 84 35.752 21.836 8.167 582 HA GLN 84 HA GLN 84 36.801 20.508 10.570 583 HB2 GLN 84 HB2 GLN 84 36.312 23.475 10.219 584 HB3 GLN 84 HB3 GLN 84 36.772 22.696 11.726 585 HG2 GLN 84 HG2 GLN 84 38.868 21.948 10.651 586 HG3 GLN 84 HG3 GLN 84 38.414 22.851 9.209 587 HE21 GLN 84 HE22 GLN 84 40.182 24.187 9.319 588 HE22 GLN 84 HE21 GLN 84 40.367 25.407 10.530 589 H SER 85 H SER 85 34.149 21.141 8.737 590 HA SER 85 HA SER 85 32.348 20.498 10.916 591 HB2 SER 85 HB2 SER 85 31.966 23.027 9.288 592 HB3 SER 85 HB3 SER 85 30.810 22.372 10.448 593 HG SER 85 HG SER 85 33.162 22.548 11.665 594 H TYR 86 H TYR 86 33.379 19.547 8.175 595 HA TYR 86 HA TYR 86 31.166 19.673 6.380 596 HB2 TYR 86 HB2 TYR 86 33.453 19.370 5.564 597 HB3 TYR 86 HB3 TYR 86 33.571 17.837 6.417 598 HD1 TYR 86 HD2 TYR 86 31.934 19.580 3.602 599 HD2 TYR 86 HD1 TYR 86 32.695 15.832 5.471 600 HE1 TYR 86 HE2 TYR 86 31.115 18.415 1.600 601 HE2 TYR 86 HE1 TYR 86 31.882 14.661 3.468 602 HH TYR 86 HH TYR 86 31.346 16.290 0.502 603 H SER 87 H SER 87 32.509 17.093 8.442 604 HA SER 87 HA SER 87 30.349 15.298 7.826 605 HB2 SER 87 HB2 SER 87 32.424 15.128 10.023 606 HB3 SER 87 HB3 SER 87 31.373 13.817 9.485 607 HG SER 87 HG SER 87 33.653 14.883 8.323 608 H ALA 88 H ALA 88 30.234 18.028 9.494 609 HA ALA 88 HA ALA 88 28.345 17.006 11.495 610 HB1 ALA 88 HB1 ALA 88 28.387 19.270 12.432 611 HB2 ALA 88 HB2 ALA 88 29.458 19.795 11.132 612 HB3 ALA 88 HB3 ALA 88 30.016 18.607 12.311 613 H VAL 89 H VAL 89 28.647 19.190 8.735 614 HA VAL 89 HA VAL 89 25.850 19.845 8.678 615 HB VAL 89 HB VAL 89 27.998 20.262 6.584 616 HG11 VAL 89 HG11 VAL 89 25.211 21.411 6.730 617 HG12 VAL 89 HG12 VAL 89 25.775 20.210 5.570 618 HG13 VAL 89 HG13 VAL 89 26.446 21.840 5.546 619 HG21 VAL 89 HG21 VAL 89 26.788 22.156 8.597 620 HG22 VAL 89 HG22 VAL 89 27.944 22.598 7.342 621 HG23 VAL 89 HG23 VAL 89 28.424 21.499 8.635 622 H LEU 90 H LEU 90 28.002 17.857 6.646 623 HA LEU 90 HA LEU 90 26.077 16.781 4.938 624 HB2 LEU 90 HB2 LEU 90 28.752 16.612 5.166 625 HB3 LEU 90 HB3 LEU 90 28.323 15.064 5.861 626 HG LEU 90 HG LEU 90 28.896 14.896 3.499 627 HD11 LEU 90 HD11 LEU 90 26.936 13.642 2.739 628 HD12 LEU 90 HD12 LEU 90 25.996 14.332 4.063 629 HD13 LEU 90 HD13 LEU 90 27.360 13.268 4.409 630 HD21 LEU 90 HD21 LEU 90 28.176 17.103 2.775 631 HD22 LEU 90 HD22 LEU 90 26.490 16.635 3.013 632 HD23 LEU 90 HD23 LEU 90 27.461 15.834 1.778 633 H ASN 91 H ASN 91 27.195 15.786 8.113 634 HA ASN 91 HA ASN 91 25.867 13.371 8.451 635 HB2 ASN 91 HB2 ASN 91 27.530 14.777 9.962 636 HB3 ASN 91 HB3 ASN 91 26.035 15.333 10.701 637 HD21 ASN 91 HD22 ASN 91 28.239 13.759 11.744 638 HD22 ASN 91 HD21 ASN 91 27.536 12.304 12.356 639 H THR 92 H THR 92 24.797 16.662 9.197 640 HA THR 92 HA THR 92 22.252 15.990 10.188 641 HB THR 92 HB THR 92 23.142 18.587 8.913 642 HG1 THR 92 HG1 THR 92 24.508 18.185 10.622 643 HG21 THR 92 HG21 THR 92 20.905 17.989 10.857 644 HG22 THR 92 HG22 THR 92 20.724 18.489 9.175 645 HG23 THR 92 HG23 THR 92 21.415 19.600 10.358 646 H ILE 93 H ILE 93 23.374 16.917 6.947 647 HA ILE 93 HA ILE 93 20.889 17.146 5.697 648 HB ILE 93 HB ILE 93 23.495 16.221 4.482 649 HG12 ILE 93 HG12 ILE 93 23.702 18.422 5.508 650 HG13 ILE 93 HG13 ILE 93 23.716 18.575 3.756 651 HG21 ILE 93 HG21 ILE 93 21.007 17.287 3.150 652 HG22 ILE 93 HG22 ILE 93 21.615 15.634 3.063 653 HG23 ILE 93 HG23 ILE 93 22.539 16.952 2.343 654 HD11 ILE 93 HD11 ILE 93 21.357 19.248 3.819 655 HD12 ILE 93 HD12 ILE 93 22.398 20.333 4.742 656 HD13 ILE 93 HD13 ILE 93 21.395 19.149 5.581 657 H GLY 94 H GLY 94 23.067 14.311 5.733 658 HA2 GLY 94 HA2 GLY 94 21.303 12.626 4.325 659 HA3 GLY 94 HA3 GLY 94 22.640 12.089 5.326 660 H ALA 95 H ALA 95 21.631 13.303 7.725 661 HA ALA 95 HA ALA 95 20.088 11.106 8.652 662 HB1 ALA 95 HB1 ALA 95 21.744 12.245 10.060 663 HB2 ALA 95 HB2 ALA 95 20.149 12.215 10.814 664 HB3 ALA 95 HB3 ALA 95 20.739 13.695 10.056 665 H CYS 96 H CYS 96 19.371 14.594 8.392 666 HA CYS 96 HA CYS 96 16.696 14.326 9.245 667 HB2 CYS 96 HB2 CYS 96 17.990 16.507 7.601 668 HB3 CYS 96 HB3 CYS 96 16.403 16.619 8.356 669 H LEU 97 H LEU 97 18.217 14.003 6.123 670 HA LEU 97 HA LEU 97 15.894 14.267 4.537 671 HB2 LEU 97 HB2 LEU 97 18.576 13.956 4.053 672 HB3 LEU 97 HB3 LEU 97 17.901 12.436 3.493 673 HG LEU 97 HG LEU 97 16.977 15.163 2.591 674 HD11 LEU 97 HD11 LEU 97 18.689 13.136 1.178 675 HD12 LEU 97 HD12 LEU 97 19.248 14.659 1.868 676 HD13 LEU 97 HD13 LEU 97 18.114 14.667 0.517 677 HD21 LEU 97 HD21 LEU 97 16.316 12.421 1.524 678 HD22 LEU 97 HD22 LEU 97 15.749 13.961 0.878 679 HD23 LEU 97 HD23 LEU 97 15.236 13.433 2.480 680 H ARG 98 H ARG 98 17.613 11.353 5.701 681 HA ARG 98 HA ARG 98 15.824 9.528 4.513 682 HB2 ARG 98 HB2 ARG 98 16.765 7.867 6.142 683 HB3 ARG 98 HB3 ARG 98 17.949 8.698 5.147 684 HG2 ARG 98 HG2 ARG 98 18.566 10.115 6.979 685 HG3 ARG 98 HG3 ARG 98 17.273 9.450 7.979 686 HD2 ARG 98 HD2 ARG 98 19.440 8.487 8.559 687 HD3 ARG 98 HD3 ARG 98 18.340 7.266 7.928 688 HE ARG 98 HE ARG 98 19.607 7.657 5.749 689 HH11 ARG 98 HH11 ARG 98 21.057 8.043 8.906 690 HH12 ARG 98 HH12 ARG 98 22.635 7.552 8.386 691 HH21 ARG 98 HH21 ARG 98 21.701 6.977 5.063 692 HH22 ARG 98 HH22 ARG 98 22.995 6.923 6.214 693 H GLU 99 H GLU 99 15.887 10.919 7.747 694 HA GLU 99 HA GLU 99 13.760 9.514 8.885 695 HB2 GLU 99 HB2 GLU 99 14.572 12.391 9.335 696 HB3 GLU 99 HB3 GLU 99 13.524 11.458 10.391 697 HG2 GLU 99 HG2 GLU 99 16.384 10.778 9.777 698 HG3 GLU 99 HG3 GLU 99 15.828 11.644 11.205 699 H SER 100 H SER 100 13.714 12.699 7.345 700 HA SER 100 HA SER 100 10.975 13.149 7.451 701 HB2 SER 100 HB2 SER 100 12.906 14.109 5.327 702 HB3 SER 100 HB3 SER 100 11.352 14.834 5.732 703 HG SER 100 HG SER 100 13.764 14.862 7.147 704 H MET 101 H MET 101 12.867 11.389 5.065 705 HA MET 101 HA MET 101 11.009 11.074 3.036 706 HB2 MET 101 HB2 MET 101 13.190 9.289 4.068 707 HB3 MET 101 HB3 MET 101 12.174 8.788 2.726 708 HG2 MET 101 HG2 MET 101 13.685 11.378 2.712 709 HG3 MET 101 HG3 MET 101 14.398 9.861 2.167 710 HE1 MET 101 HE1 MET 101 12.017 8.362 0.732 711 HE2 MET 101 HE2 MET 101 13.643 8.522 0.070 712 HE3 MET 101 HE3 MET 101 12.242 8.928 -0.923 713 H MET 102 H MET 102 11.524 8.916 5.834 714 HA MET 102 HA MET 102 9.285 7.285 5.073 715 HB2 MET 102 HB2 MET 102 9.795 5.942 6.986 716 HB3 MET 102 HB3 MET 102 11.295 6.357 6.176 717 HG2 MET 102 HG2 MET 102 11.738 8.071 7.848 718 HG3 MET 102 HG3 MET 102 10.222 7.675 8.659 719 HE1 MET 102 HE1 MET 102 9.706 5.106 9.403 720 HE2 MET 102 HE2 MET 102 10.960 3.877 9.576 721 HE3 MET 102 HE3 MET 102 10.458 4.403 7.968 722 H GLN 103 H GLN 103 9.714 10.083 6.997 723 HA GLN 103 HA GLN 103 7.338 9.701 8.554 724 HB2 GLN 103 HB2 GLN 103 9.395 11.789 8.290 725 HB3 GLN 103 HB3 GLN 103 7.786 12.377 8.692 726 HG2 GLN 103 HG2 GLN 103 7.695 11.159 10.667 727 HG3 GLN 103 HG3 GLN 103 9.020 10.102 10.187 728 HE21 GLN 103 HE22 GLN 103 11.104 10.745 10.506 729 HE22 GLN 103 HE21 GLN 103 11.531 12.145 11.431 730 H ALA 104 H ALA 104 8.036 10.822 5.389 731 HA ALA 104 HA ALA 104 5.535 12.190 5.029 732 HB1 ALA 104 HB1 ALA 104 7.474 12.733 3.635 733 HB2 ALA 104 HB2 ALA 104 6.114 12.189 2.651 734 HB3 ALA 104 HB3 ALA 104 7.461 11.097 2.978 735 H THR 105 H THR 105 6.847 9.164 3.676 736 HA THR 105 HA THR 105 4.947 7.374 4.396 737 HB THR 105 HB THR 105 3.249 8.855 3.334 738 HG1 THR 105 HG1 THR 105 2.143 7.135 2.590 739 HG21 THR 105 HG21 THR 105 4.592 8.066 0.744 740 HG22 THR 105 HG22 THR 105 4.668 9.669 1.478 741 HG23 THR 105 HG23 THR 105 3.121 9.030 0.912 742 H GLY 106 H GLY 106 7.235 8.488 2.095 743 HA2 GLY 106 HA2 GLY 106 7.150 6.115 0.450 744 HA3 GLY 106 HA3 GLY 106 8.242 7.476 0.264 745 H SER 107 H SER 107 8.095 6.140 3.417 746 HA SER 107 HA SER 107 9.663 5.197 4.731 747 HB2 SER 107 HB2 SER 107 10.536 3.012 3.988 748 HB3 SER 107 HB3 SER 107 8.810 3.171 3.677 749 HG SER 107 HG SER 107 10.052 4.050 1.522 750 H VAL 108 H VAL 108 12.103 4.094 4.485 751 HA VAL 108 HA VAL 108 13.681 6.299 3.414 752 HB VAL 108 HB VAL 108 14.647 3.951 5.050 753 HG11 VAL 108 HG11 VAL 108 16.395 5.022 3.725 754 HG12 VAL 108 HG12 VAL 108 16.624 5.338 5.445 755 HG13 VAL 108 HG13 VAL 108 15.954 6.590 4.399 756 HG21 VAL 108 HG21 VAL 108 13.889 6.733 5.941 757 HG22 VAL 108 HG22 VAL 108 14.699 5.530 6.947 758 HG23 VAL 108 HG23 VAL 108 13.062 5.229 6.359 759 H ASP 109 H ASP 109 13.576 5.877 1.207 760 HA ASP 109 HA ASP 109 14.382 3.349 0.135 761 HB2 ASP 109 HB2 ASP 109 12.908 4.942 -1.105 762 HB3 ASP 109 HB3 ASP 109 14.290 6.019 -1.288 763 H ASN 110 H ASN 110 16.370 2.616 0.284 764 HA ASN 110 HA ASN 110 18.523 4.232 1.134 765 HB2 ASN 110 HB2 ASN 110 18.359 1.399 0.144 766 HB3 ASN 110 HB3 ASN 110 19.899 2.142 0.549 767 HD21 ASN 110 HD22 ASN 110 16.939 2.882 2.273 768 HD22 ASN 110 HD21 ASN 110 17.387 2.097 3.745 769 H ALA 111 H ALA 111 17.574 3.001 -2.027 770 HA ALA 111 HA ALA 111 19.961 3.653 -3.383 771 HB1 ALA 111 HB1 ALA 111 18.270 2.148 -4.321 772 HB2 ALA 111 HB2 ALA 111 18.667 3.457 -5.432 773 HB3 ALA 111 HB3 ALA 111 17.163 3.509 -4.511 774 H PHE 112 H PHE 112 16.889 5.453 -3.099 775 HA PHE 112 HA PHE 112 17.693 7.726 -4.528 776 HB2 PHE 112 HB2 PHE 112 15.356 7.290 -3.961 777 HB3 PHE 112 HB3 PHE 112 15.712 7.503 -2.250 778 HD1 PHE 112 HD2 PHE 112 15.757 9.299 -5.504 779 HD2 PHE 112 HD1 PHE 112 15.508 9.601 -1.266 780 HE1 PHE 112 HE2 PHE 112 15.253 11.698 -5.707 781 HE2 PHE 112 HE1 PHE 112 15.003 12.001 -1.462 782 HZ PHE 112 HZ PHE 112 14.875 13.052 -3.685 783 H THR 113 H THR 113 17.659 7.247 -0.980 784 HA THR 113 HA THR 113 18.802 9.715 -0.345 785 HB THR 113 HB THR 113 19.548 8.559 1.797 786 HG1 THR 113 HG1 THR 113 18.009 6.400 0.753 787 HG21 THR 113 HG21 THR 113 17.250 8.315 2.624 788 HG22 THR 113 HG22 THR 113 16.657 8.312 0.964 789 HG23 THR 113 HG23 THR 113 17.426 9.756 1.622 790 H ASN 114 H ASN 114 20.368 6.588 -0.960 791 HA ASN 114 HA ASN 114 23.018 7.392 -0.483 792 HB2 ASN 114 HB2 ASN 114 22.676 5.082 -0.637 793 HB3 ASN 114 HB3 ASN 114 21.748 5.217 -2.123 794 HD21 ASN 114 HD22 ASN 114 22.793 5.261 -4.066 795 HD22 ASN 114 HD21 ASN 114 24.476 4.935 -4.237 796 H GLU 115 H GLU 115 21.073 7.504 -3.457 797 HA GLU 115 HA GLU 115 23.142 8.329 -5.141 798 HB2 GLU 115 HB2 GLU 115 21.087 7.265 -5.911 799 HB3 GLU 115 HB3 GLU 115 20.145 8.635 -5.336 800 HG2 GLU 115 HG2 GLU 115 21.015 10.045 -6.950 801 HG3 GLU 115 HG3 GLU 115 22.311 8.927 -7.346 802 H VAL 116 H VAL 116 20.620 10.086 -3.355 803 HA VAL 116 HA VAL 116 21.334 12.680 -4.121 804 HB VAL 116 HB VAL 116 20.238 11.749 -1.455 805 HG11 VAL 116 HG11 VAL 116 20.333 14.521 -2.646 806 HG12 VAL 116 HG12 VAL 116 21.235 13.957 -1.239 807 HG13 VAL 116 HG13 VAL 116 19.475 14.067 -1.173 808 HG21 VAL 116 HG21 VAL 116 18.076 12.464 -2.372 809 HG22 VAL 116 HG22 VAL 116 18.799 11.171 -3.327 810 HG23 VAL 116 HG23 VAL 116 18.857 12.836 -3.908 811 H MET 117 H MET 117 22.425 10.799 -1.290 812 HA MET 117 HA MET 117 24.306 12.574 -0.283 813 HB2 MET 117 HB2 MET 117 24.259 9.562 -0.329 814 HB3 MET 117 HB3 MET 117 25.480 10.468 0.545 815 HG2 MET 117 HG2 MET 117 22.561 10.907 1.043 816 HG3 MET 117 HG3 MET 117 23.432 9.586 1.814 817 HE1 MET 117 HE1 MET 117 22.790 13.305 1.482 818 HE2 MET 117 HE2 MET 117 24.523 13.572 1.269 819 HE3 MET 117 HE3 MET 117 23.731 14.062 2.764 820 H GLN 118 H GLN 118 24.750 10.044 -2.713 821 HA GLN 118 HA GLN 118 27.436 10.372 -3.299 822 HB2 GLN 118 HB2 GLN 118 26.120 8.555 -4.201 823 HB3 GLN 118 HB3 GLN 118 25.109 9.677 -5.100 824 HG2 GLN 118 HG2 GLN 118 27.198 10.342 -6.356 825 HG3 GLN 118 HG3 GLN 118 27.976 8.948 -5.605 826 HE21 GLN 118 HE22 GLN 118 28.273 7.913 -7.576 827 HE22 GLN 118 HE21 GLN 118 26.964 7.202 -8.452 828 H LEU 119 H LEU 119 24.681 11.882 -4.956 829 HA LEU 119 HA LEU 119 26.219 13.462 -6.698 830 HB2 LEU 119 HB2 LEU 119 23.366 13.617 -5.773 831 HB3 LEU 119 HB3 LEU 119 24.031 14.757 -6.928 832 HG LEU 119 HG LEU 119 24.227 11.811 -7.452 833 HD11 LEU 119 HD11 LEU 119 21.860 13.575 -8.086 834 HD12 LEU 119 HD12 LEU 119 21.872 12.230 -6.943 835 HD13 LEU 119 HD13 LEU 119 22.105 11.927 -8.666 836 HD21 LEU 119 HD21 LEU 119 24.059 14.258 -9.206 837 HD22 LEU 119 HD22 LEU 119 24.174 12.597 -9.780 838 HD23 LEU 119 HD23 LEU 119 25.504 13.307 -8.867 839 H VAL 120 H VAL 120 24.580 14.330 -3.653 840 HA VAL 120 HA VAL 120 25.081 17.057 -3.690 841 HB VAL 120 HB VAL 120 24.889 15.198 -1.315 842 HG11 VAL 120 HG11 VAL 120 26.088 17.245 -0.693 843 HG12 VAL 120 HG12 VAL 120 24.489 17.180 0.046 844 HG13 VAL 120 HG13 VAL 120 24.771 18.214 -1.354 845 HG21 VAL 120 HG21 VAL 120 22.890 17.077 -2.567 846 HG22 VAL 120 HG22 VAL 120 22.619 16.076 -1.141 847 HG23 VAL 120 HG23 VAL 120 22.887 15.320 -2.712 848 H LYS 121 H LYS 121 27.103 14.480 -2.308 849 HA LYS 121 HA LYS 121 29.137 16.228 -1.369 850 HB2 LYS 121 HB2 LYS 121 29.270 13.275 -2.011 851 HB3 LYS 121 HB3 LYS 121 30.459 14.171 -1.076 852 HG2 LYS 121 HG2 LYS 121 28.856 14.585 0.665 853 HG3 LYS 121 HG3 LYS 121 27.568 13.857 -0.295 854 HD2 LYS 121 HD2 LYS 121 28.098 12.093 1.064 855 HD3 LYS 121 HD3 LYS 121 29.188 11.784 -0.285 856 HE2 LYS 121 HE2 LYS 121 29.898 13.135 2.318 857 HE3 LYS 121 HE3 LYS 121 30.351 11.506 1.829 858 HZ1 LYS 121 HZ1 LYS 121 31.559 12.575 -0.080 859 HZ2 LYS 121 HZ2 LYS 121 32.207 12.878 1.454 860 HZ3 LYS 121 HZ3 LYS 121 31.290 14.069 0.682 861 H MET 122 H MET 122 28.747 14.285 -4.287 862 HA MET 122 HA MET 122 31.327 14.751 -5.338 863 HB2 MET 122 HB2 MET 122 30.037 12.853 -6.070 864 HB3 MET 122 HB3 MET 122 28.744 13.895 -6.644 865 HG2 MET 122 HG2 MET 122 30.216 14.779 -8.375 866 HG3 MET 122 HG3 MET 122 31.521 13.744 -7.794 867 HE1 MET 122 HE1 MET 122 27.607 12.080 -9.615 868 HE2 MET 122 HE2 MET 122 27.890 13.793 -9.295 869 HE3 MET 122 HE3 MET 122 27.705 12.662 -7.953 870 H LEU 123 H LEU 123 28.364 16.578 -5.510 871 HA LEU 123 HA LEU 123 29.328 18.194 -7.721 872 HB2 LEU 123 HB2 LEU 123 26.790 18.322 -6.098 873 HB3 LEU 123 HB3 LEU 123 27.155 19.390 -7.439 874 HG LEU 123 HG LEU 123 26.906 16.388 -7.673 875 HD11 LEU 123 HD11 LEU 123 24.753 16.832 -8.734 876 HD12 LEU 123 HD12 LEU 123 24.933 18.551 -8.384 877 HD13 LEU 123 HD13 LEU 123 24.773 17.395 -7.061 878 HD21 LEU 123 HD21 LEU 123 26.802 16.844 -10.079 879 HD22 LEU 123 HD22 LEU 123 28.335 17.378 -9.384 880 HD23 LEU 123 HD23 LEU 123 27.077 18.557 -9.764 881 H SER 124 H SER 124 30.203 18.190 -4.614 882 HA SER 124 HA SER 124 30.448 21.116 -4.561 883 HB2 SER 124 HB2 SER 124 30.018 21.011 -2.067 884 HB3 SER 124 HB3 SER 124 28.612 20.711 -3.087 885 HG SER 124 HG SER 124 28.601 18.640 -2.517 886 H ALA 125 H ALA 125 31.317 18.404 -2.463 887 HA ALA 125 HA ALA 125 34.114 18.580 -2.978 888 HB1 ALA 125 HB1 ALA 125 33.125 19.679 -0.347 889 HB2 ALA 125 HB2 ALA 125 33.873 20.615 -1.640 890 HB3 ALA 125 HB3 ALA 125 34.811 19.394 -0.780 891 H ASP 126 H ASP 126 34.588 16.486 -2.878 892 HA ASP 126 HA ASP 126 33.267 14.861 -0.805 893 HB2 ASP 126 HB2 ASP 126 32.676 14.339 -3.183 894 HB3 ASP 126 HB3 ASP 126 34.361 13.925 -3.465 895 H SER 127 H SER 127 35.898 16.436 -0.926 896 HA SER 127 HA SER 127 37.599 14.232 0.027 897 HB2 SER 127 HB2 SER 127 38.560 16.739 -1.369 898 HB3 SER 127 HB3 SER 127 39.554 15.380 -0.845 899 HG SER 127 HG SER 127 38.200 14.083 -2.303 900 H ALA 128 H ALA 128 35.794 16.601 1.139 901 HA ALA 128 HA ALA 128 37.763 17.876 2.863 902 HB1 ALA 128 HB1 ALA 128 34.783 18.309 2.721 903 HB2 ALA 128 HB2 ALA 128 35.994 19.243 1.841 904 HB3 ALA 128 HB3 ALA 128 35.946 19.298 3.604 905 H ASN 129 H ASN 129 38.430 16.357 4.339 906 HA ASN 129 HA ASN 129 36.325 15.388 6.163 907 HB2 ASN 129 HB2 ASN 129 37.576 13.569 4.985 908 HB3 ASN 129 HB3 ASN 129 39.055 14.149 5.745 909 HD21 ASN 129 HD22 ASN 129 35.856 13.985 7.218 910 HD22 ASN 129 HD21 ASN 129 36.279 12.830 8.432 911 H GLU 130 H GLU 130 36.570 15.715 8.331 912 HA GLU 130 HA GLU 130 38.002 17.929 9.225 913 HB2 GLU 130 HB2 GLU 130 36.823 15.613 10.760 914 HB3 GLU 130 HB3 GLU 130 37.522 17.024 11.536 915 HG2 GLU 130 HG2 GLU 130 35.135 17.232 11.472 916 HG3 GLU 130 HG3 GLU 130 35.858 18.439 10.411 917 H VAL 131 H VAL 131 40.086 18.195 9.509 918 HA VAL 131 HA VAL 131 41.934 16.045 9.843 919 HB VAL 131 HB VAL 131 42.351 18.984 10.442 920 HG11 VAL 131 HG11 VAL 131 44.733 18.475 10.084 921 HG12 VAL 131 HG12 VAL 131 44.327 16.767 9.902 922 HG13 VAL 131 HG13 VAL 131 44.055 17.581 11.444 923 HG21 VAL 131 HG21 VAL 131 43.320 19.126 8.187 924 HG22 VAL 131 HG22 VAL 131 41.611 18.690 8.145 925 HG23 VAL 131 HG23 VAL 131 42.842 17.455 7.888 926 H SER 132 H SER 132 41.963 14.853 11.631 927 HA SER 132 HA SER 132 40.822 15.776 14.077 928 HB2 SER 132 HB2 SER 132 40.807 13.380 13.190 929 HB3 SER 132 HB3 SER 132 42.478 13.274 13.731 930 HG SER 132 HG SER 132 40.734 14.269 15.611 931 H THR 133 H THR 133 42.186 17.636 14.339 932 HA THR 133 HA THR 133 44.685 16.955 15.727 933 HB THR 133 HB THR 133 45.323 18.071 13.702 934 HG1 THR 133 HG1 THR 133 45.395 20.012 15.797 935 HG21 THR 133 HG21 THR 133 43.413 20.286 14.449 936 HG22 THR 133 HG22 THR 133 43.182 19.116 13.150 937 HG23 THR 133 HG23 THR 133 44.503 20.280 13.062 Start of MODEL 12 1 HA2 GLY 1 HA2 GLY 1 1.614 3.276 -0.859 2 HA3 GLY 1 HA3 GLY 1 2.129 1.762 -0.126 3 H SER 2 H SER 2 3.383 3.718 -2.104 4 HA SER 2 HA SER 2 3.688 2.058 -4.465 5 HB2 SER 2 HB2 SER 2 3.495 4.598 -4.529 6 HB3 SER 2 HB3 SER 2 5.123 4.649 -3.855 7 HG SER 2 HG SER 2 5.870 4.279 -5.780 8 H GLY 3 H GLY 3 5.385 0.770 -4.872 9 HA2 GLY 3 HA2 GLY 3 7.855 1.092 -3.339 10 HA3 GLY 3 HA3 GLY 3 7.012 -0.446 -3.199 11 H ASN 4 H ASN 4 9.644 -0.076 -4.230 12 HA ASN 4 HA ASN 4 10.965 -0.891 -5.886 13 HB2 ASN 4 HB2 ASN 4 9.342 -2.736 -6.050 14 HB3 ASN 4 HB3 ASN 4 8.383 -1.792 -7.183 15 HD21 ASN 4 HD22 ASN 4 8.575 -3.254 -8.847 16 HD22 ASN 4 HD21 ASN 4 10.067 -3.555 -9.673 17 H SER 5 H SER 5 8.072 0.253 -7.633 18 HA SER 5 HA SER 5 9.821 2.004 -9.219 19 HB2 SER 5 HB2 SER 5 7.868 2.029 -10.823 20 HB3 SER 5 HB3 SER 5 8.622 0.450 -10.608 21 HG SER 5 HG SER 5 6.122 1.375 -9.746 22 H GLN 6 H GLN 6 9.060 4.141 -9.714 23 HA GLN 6 HA GLN 6 8.262 6.190 -9.206 24 HB2 GLN 6 HB2 GLN 6 5.909 4.585 -8.198 25 HB3 GLN 6 HB3 GLN 6 5.913 6.335 -8.361 26 HG2 GLN 6 HG2 GLN 6 6.420 4.457 -10.654 27 HG3 GLN 6 HG3 GLN 6 4.826 5.076 -10.233 28 HE21 GLN 6 HE22 GLN 6 4.625 6.107 -12.217 29 HE22 GLN 6 HE21 GLN 6 5.498 7.555 -12.594 30 HA PRO 7 HA PRO 7 9.592 5.910 -4.852 31 HB2 PRO 7 HB2 PRO 7 11.907 7.393 -5.269 32 HB3 PRO 7 HB3 PRO 7 11.792 5.634 -5.286 33 HG2 PRO 7 HG2 PRO 7 12.359 7.363 -7.479 34 HG3 PRO 7 HG3 PRO 7 12.158 5.606 -7.513 35 HD2 PRO 7 HD2 PRO 7 10.242 7.739 -8.237 36 HD3 PRO 7 HD3 PRO 7 10.314 6.050 -8.782 37 H ILE 8 H ILE 8 7.917 7.263 -4.227 38 HA ILE 8 HA ILE 8 7.105 8.913 -2.979 39 HB ILE 8 HB ILE 8 9.424 8.844 -1.964 40 HG12 ILE 8 HG12 ILE 8 8.043 11.517 -1.749 41 HG13 ILE 8 HG13 ILE 8 7.345 10.040 -1.093 42 HG21 ILE 8 HG21 ILE 8 10.812 10.845 -2.219 43 HG22 ILE 8 HG22 ILE 8 9.728 11.436 -3.478 44 HG23 ILE 8 HG23 ILE 8 10.668 9.968 -3.743 45 HD11 ILE 8 HD11 ILE 8 9.979 11.255 -0.303 46 HD12 ILE 8 HD12 ILE 8 9.290 9.770 0.355 47 HD13 ILE 8 HD13 ILE 8 8.477 11.314 0.622 48 H TRP 9 H TRP 9 8.842 10.052 -5.816 49 HA TRP 9 HA TRP 9 7.721 12.671 -5.763 50 HB2 TRP 9 HB2 TRP 9 8.891 11.095 -8.066 51 HB3 TRP 9 HB3 TRP 9 8.479 12.807 -8.123 52 HD1 TRP 9 HD1 TRP 9 11.158 10.423 -6.944 53 HE1 TRP 9 HE1 TRP 9 13.151 11.763 -6.013 54 HE3 TRP 9 HE3 TRP 9 9.050 15.086 -6.862 55 HZ2 TRP 9 HZ2 TRP 9 13.752 14.430 -5.336 56 HZ3 TRP 9 HZ3 TRP 9 10.406 16.978 -6.059 57 HH2 TRP 9 HH2 TRP 9 12.708 16.654 -5.309 58 H THR 10 H THR 10 6.307 9.720 -6.284 59 HA THR 10 HA THR 10 4.402 10.321 -8.284 60 HB THR 10 HB THR 10 3.277 8.503 -6.425 61 HG1 THR 10 HG1 THR 10 5.364 7.071 -6.690 62 HG21 THR 10 HG21 THR 10 4.797 8.012 -8.990 63 HG22 THR 10 HG22 THR 10 3.079 8.389 -8.865 64 HG23 THR 10 HG23 THR 10 3.699 6.874 -8.208 65 H ASN 11 H ASN 11 4.750 11.284 -5.025 66 HA ASN 11 HA ASN 11 2.135 12.600 -5.151 67 HB2 ASN 11 HB2 ASN 11 1.872 10.763 -3.583 68 HB3 ASN 11 HB3 ASN 11 3.334 11.243 -2.726 69 HD21 ASN 11 HD22 ASN 11 2.092 11.358 -0.808 70 HD22 ASN 11 HD21 ASN 11 1.077 12.724 -0.486 71 HA PRO 12 HA PRO 12 5.074 15.978 -5.007 72 HB2 PRO 12 HB2 PRO 12 2.467 17.418 -4.897 73 HB3 PRO 12 HB3 PRO 12 3.871 17.713 -5.929 74 HG2 PRO 12 HG2 PRO 12 1.696 16.527 -6.899 75 HG3 PRO 12 HG3 PRO 12 3.317 16.005 -7.396 76 HD2 PRO 12 HD2 PRO 12 1.398 14.708 -5.516 77 HD3 PRO 12 HD3 PRO 12 2.546 13.970 -6.651 78 H ASN 13 H ASN 13 2.237 15.617 -2.926 79 HA ASN 13 HA ASN 13 2.969 17.551 -1.010 80 HB2 ASN 13 HB2 ASN 13 0.701 16.636 -1.129 81 HB3 ASN 13 HB3 ASN 13 1.300 15.049 -0.668 82 HD21 ASN 13 HD22 ASN 13 0.648 18.295 0.418 83 HD22 ASN 13 HD21 ASN 13 0.703 17.951 2.111 84 H ALA 14 H ALA 14 3.630 14.090 -1.256 85 HA ALA 14 HA ALA 14 4.953 13.874 1.256 86 HB1 ALA 14 HB1 ALA 14 3.968 11.941 0.118 87 HB2 ALA 14 HB2 ALA 14 5.677 11.688 0.468 88 HB3 ALA 14 HB3 ALA 14 5.164 12.092 -1.167 89 H ALA 15 H ALA 15 6.034 14.298 -2.070 90 HA ALA 15 HA ALA 15 8.796 14.146 -1.576 91 HB1 ALA 15 HB1 ALA 15 7.818 13.924 -3.808 92 HB2 ALA 15 HB2 ALA 15 9.067 15.172 -3.765 93 HB3 ALA 15 HB3 ALA 15 7.364 15.628 -3.772 94 H MET 16 H MET 16 6.565 16.918 -1.649 95 HA MET 16 HA MET 16 8.579 18.842 -1.144 96 HB2 MET 16 HB2 MET 16 5.719 18.807 -1.460 97 HB3 MET 16 HB3 MET 16 6.174 19.839 -0.111 98 HG2 MET 16 HG2 MET 16 7.290 20.052 -2.893 99 HG3 MET 16 HG3 MET 16 5.967 21.021 -2.260 100 HE1 MET 16 HE1 MET 16 9.563 20.905 -3.039 101 HE2 MET 16 HE2 MET 16 9.834 20.088 -1.504 102 HE3 MET 16 HE3 MET 16 10.422 21.729 -1.740 103 H THR 17 H THR 17 6.498 16.923 0.939 104 HA THR 17 HA THR 17 6.991 18.244 3.347 105 HB THR 17 HB THR 17 6.370 15.323 2.849 106 HG1 THR 17 HG1 THR 17 4.658 16.597 2.221 107 HG21 THR 17 HG21 THR 17 5.641 15.272 5.205 108 HG22 THR 17 HG22 THR 17 6.284 16.900 5.425 109 HG23 THR 17 HG23 THR 17 7.374 15.564 5.053 110 H MET 18 H MET 18 8.730 15.473 1.900 111 HA MET 18 HA MET 18 10.585 15.208 4.011 112 HB2 MET 18 HB2 MET 18 11.895 13.827 2.524 113 HB3 MET 18 HB3 MET 18 10.193 13.456 2.298 114 HG2 MET 18 HG2 MET 18 10.117 14.670 0.254 115 HG3 MET 18 HG3 MET 18 11.728 15.328 0.521 116 HE1 MET 18 HE1 MET 18 12.388 13.102 -2.552 117 HE2 MET 18 HE2 MET 18 12.373 14.730 -1.862 118 HE3 MET 18 HE3 MET 18 10.853 13.918 -2.251 119 H THR 19 H THR 19 10.554 17.185 1.120 120 HA THR 19 HA THR 19 13.274 17.988 1.196 121 HB THR 19 HB THR 19 10.894 19.328 -0.106 122 HG1 THR 19 HG1 THR 19 11.021 17.342 -1.028 123 HG21 THR 19 HG21 THR 19 12.844 20.799 0.024 124 HG22 THR 19 HG22 THR 19 12.527 20.297 -1.638 125 HG23 THR 19 HG23 THR 19 13.837 19.544 -0.727 126 H ASN 20 H ASN 20 10.264 19.370 2.446 127 HA ASN 20 HA ASN 20 11.530 21.795 3.324 128 HB2 ASN 20 HB2 ASN 20 8.761 20.666 3.578 129 HB3 ASN 20 HB3 ASN 20 9.237 22.106 4.468 130 HD21 ASN 20 HD22 ASN 20 7.361 21.571 2.184 131 HD22 ASN 20 HD21 ASN 20 7.793 22.735 0.987 132 H ASN 21 H ASN 21 10.549 18.754 4.840 133 HA ASN 21 HA ASN 21 10.982 19.643 7.494 134 HB2 ASN 21 HB2 ASN 21 10.807 16.922 6.239 135 HB3 ASN 21 HB3 ASN 21 11.276 17.102 7.923 136 HD21 ASN 21 HD22 ASN 21 8.984 15.768 6.949 137 HD22 ASN 21 HD21 ASN 21 7.591 16.585 7.568 138 H LEU 22 H LEU 22 13.071 18.581 4.971 139 HA LEU 22 HA LEU 22 15.369 17.924 6.427 140 HB2 LEU 22 HB2 LEU 22 15.220 17.514 4.042 141 HB3 LEU 22 HB3 LEU 22 15.045 19.227 3.720 142 HG LEU 22 HG LEU 22 17.363 19.581 4.541 143 HD11 LEU 22 HD11 LEU 22 18.834 17.656 4.817 144 HD12 LEU 22 HD12 LEU 22 17.459 16.570 4.608 145 HD13 LEU 22 HD13 LEU 22 17.532 17.639 6.008 146 HD21 LEU 22 HD21 LEU 22 18.469 18.588 2.585 147 HD22 LEU 22 HD22 LEU 22 16.938 19.359 2.167 148 HD23 LEU 22 HD23 LEU 22 17.037 17.602 2.291 149 H VAL 23 H VAL 23 13.989 20.980 5.426 150 HA VAL 23 HA VAL 23 16.154 22.637 6.202 151 HB VAL 23 HB VAL 23 13.236 23.393 5.982 152 HG11 VAL 23 HG11 VAL 23 14.592 25.061 7.125 153 HG12 VAL 23 HG12 VAL 23 14.098 25.643 5.535 154 HG13 VAL 23 HG13 VAL 23 15.742 25.059 5.789 155 HG21 VAL 23 HG21 VAL 23 13.737 24.037 3.677 156 HG22 VAL 23 HG22 VAL 23 14.003 22.314 3.932 157 HG23 VAL 23 HG23 VAL 23 15.376 23.415 3.857 158 H GLN 24 H GLN 24 13.136 21.645 7.819 159 HA GLN 24 HA GLN 24 13.561 23.346 10.061 160 HB2 GLN 24 HB2 GLN 24 11.701 22.171 11.124 161 HB3 GLN 24 HB3 GLN 24 11.310 22.611 9.475 162 HG2 GLN 24 HG2 GLN 24 10.448 20.494 9.641 163 HG3 GLN 24 HG3 GLN 24 12.018 20.210 8.901 164 HE21 GLN 24 HE22 GLN 24 11.629 20.932 12.303 165 HE22 GLN 24 HE21 GLN 24 12.076 19.364 12.873 166 H CYS 25 H CYS 25 14.393 20.011 9.360 167 HA CYS 25 HA CYS 25 15.204 19.342 11.992 168 HB2 CYS 25 HB2 CYS 25 14.704 17.596 10.389 169 HB3 CYS 25 HB3 CYS 25 15.980 18.162 9.317 170 H ALA 26 H ALA 26 16.976 20.489 9.133 171 HA ALA 26 HA ALA 26 19.514 20.488 10.408 172 HB1 ALA 26 HB1 ALA 26 20.295 21.706 8.477 173 HB2 ALA 26 HB2 ALA 26 18.635 22.087 8.009 174 HB3 ALA 26 HB3 ALA 26 19.205 20.418 7.963 175 H SER 27 H SER 27 16.872 22.728 10.323 176 HA SER 27 HA SER 27 18.271 25.030 11.219 177 HB2 SER 27 HB2 SER 27 16.006 25.094 10.182 178 HB3 SER 27 HB3 SER 27 15.354 24.311 11.622 179 HG SER 27 HG SER 27 16.855 26.529 12.186 180 H ARG 28 H ARG 28 17.305 22.136 12.746 181 HA ARG 28 HA ARG 28 17.636 23.341 15.411 182 HB2 ARG 28 HB2 ARG 28 16.093 20.881 14.565 183 HB3 ARG 28 HB3 ARG 28 16.329 21.376 16.238 184 HG2 ARG 28 HG2 ARG 28 14.979 23.056 14.141 185 HG3 ARG 28 HG3 ARG 28 14.128 22.025 15.295 186 HD2 ARG 28 HD2 ARG 28 14.910 23.317 17.134 187 HD3 ARG 28 HD3 ARG 28 16.037 24.205 16.116 188 HE ARG 28 HE ARG 28 13.871 25.000 14.969 189 HH11 ARG 28 HH11 ARG 28 14.161 24.315 18.389 190 HH12 ARG 28 HH12 ARG 28 13.051 25.563 18.859 191 HH21 ARG 28 HH21 ARG 28 12.426 26.646 15.584 192 HH22 ARG 28 HH22 ARG 28 12.070 26.895 17.266 193 H SER 29 H SER 29 19.610 22.246 13.418 194 HA SER 29 HA SER 29 20.701 19.926 14.741 195 HB2 SER 29 HB2 SER 29 22.533 20.128 13.103 196 HB3 SER 29 HB3 SER 29 20.958 20.178 12.310 197 HG SER 29 HG SER 29 21.301 22.189 11.724 198 H GLY 30 H GLY 30 21.426 23.368 14.478 199 HA2 GLY 30 HA2 GLY 30 22.624 24.710 15.964 200 HA3 GLY 30 HA3 GLY 30 23.076 23.266 16.863 201 H VAL 31 H VAL 31 23.498 22.951 13.540 202 HA VAL 31 HA VAL 31 26.401 23.285 13.865 203 HB VAL 31 HB VAL 31 24.903 21.559 11.882 204 HG11 VAL 31 HG11 VAL 31 27.111 20.586 11.403 205 HG12 VAL 31 HG12 VAL 31 27.852 21.793 12.454 206 HG13 VAL 31 HG13 VAL 31 27.022 22.297 10.982 207 HG21 VAL 31 HG21 VAL 31 26.394 20.818 14.393 208 HG22 VAL 31 HG22 VAL 31 25.793 19.669 13.200 209 HG23 VAL 31 HG23 VAL 31 24.661 20.668 14.109 210 H LEU 32 H LEU 32 23.696 23.882 11.652 211 HA LEU 32 HA LEU 32 25.378 25.074 9.653 212 HB2 LEU 32 HB2 LEU 32 22.375 25.131 9.882 213 HB3 LEU 32 HB3 LEU 32 23.311 25.569 8.467 214 HG LEU 32 HG LEU 32 22.987 22.828 9.658 215 HD11 LEU 32 HD11 LEU 32 22.001 22.316 7.489 216 HD12 LEU 32 HD12 LEU 32 22.226 23.993 6.992 217 HD13 LEU 32 HD13 LEU 32 21.124 23.606 8.315 218 HD21 LEU 32 HD21 LEU 32 24.740 23.695 7.366 219 HD22 LEU 32 HD22 LEU 32 24.393 22.027 7.821 220 HD23 LEU 32 HD23 LEU 32 25.285 23.074 8.924 221 H THR 33 H THR 33 24.605 27.231 8.725 222 HA THR 33 HA THR 33 24.753 29.183 10.901 223 HB THR 33 HB THR 33 25.520 30.763 9.267 224 HG1 THR 33 HG1 THR 33 25.664 29.991 6.998 225 HG21 THR 33 HG21 THR 33 26.747 28.082 8.631 226 HG22 THR 33 HG22 THR 33 27.180 29.100 10.008 227 HG23 THR 33 HG23 THR 33 27.493 29.659 8.364 228 H ALA 34 H ALA 34 23.549 31.296 10.456 229 HA ALA 34 HA ALA 34 20.775 30.761 10.232 230 HB1 ALA 34 HB1 ALA 34 20.493 33.188 10.415 231 HB2 ALA 34 HB2 ALA 34 22.228 33.406 10.188 232 HB3 ALA 34 HB3 ALA 34 21.624 32.579 11.623 233 H ASP 35 H ASP 35 23.257 31.796 8.042 234 HA ASP 35 HA ASP 35 21.564 32.598 5.899 235 HB2 ASP 35 HB2 ASP 35 23.845 33.345 5.882 236 HB3 ASP 35 HB3 ASP 35 24.448 31.696 5.999 237 H GLN 36 H GLN 36 23.391 29.637 6.570 238 HA GLN 36 HA GLN 36 22.576 28.162 4.357 239 HB2 GLN 36 HB2 GLN 36 23.588 27.447 7.081 240 HB3 GLN 36 HB3 GLN 36 23.027 26.172 6.003 241 HG2 GLN 36 HG2 GLN 36 24.661 26.776 4.355 242 HG3 GLN 36 HG3 GLN 36 25.137 28.194 5.289 243 HE21 GLN 36 HE22 GLN 36 26.663 25.832 4.362 244 HE22 GLN 36 HE21 GLN 36 27.400 25.182 5.786 245 H MET 37 H MET 37 21.110 28.277 7.609 246 HA MET 37 HA MET 37 19.189 26.283 7.134 247 HB2 MET 37 HB2 MET 37 19.156 28.595 9.071 248 HB3 MET 37 HB3 MET 37 17.965 27.302 9.068 249 HG2 MET 37 HG2 MET 37 19.759 25.673 9.471 250 HG3 MET 37 HG3 MET 37 20.923 26.994 9.535 251 HE1 MET 37 HE1 MET 37 20.959 28.851 11.444 252 HE2 MET 37 HE2 MET 37 19.762 28.946 12.735 253 HE3 MET 37 HE3 MET 37 19.285 29.263 11.065 254 H ASP 38 H ASP 38 19.089 29.766 6.548 255 HA ASP 38 HA ASP 38 16.286 29.698 5.876 256 HB2 ASP 38 HB2 ASP 38 17.285 31.712 6.879 257 HB3 ASP 38 HB3 ASP 38 18.311 31.906 5.461 258 H ASP 39 H ASP 39 19.357 29.798 4.149 259 HA ASP 39 HA ASP 39 18.314 30.176 1.557 260 HB2 ASP 39 HB2 ASP 39 20.723 30.419 2.207 261 HB3 ASP 39 HB3 ASP 39 20.833 28.665 2.285 262 H MET 40 H MET 40 18.764 27.312 3.536 263 HA MET 40 HA MET 40 18.231 25.350 1.608 264 HB2 MET 40 HB2 MET 40 17.659 25.411 4.572 265 HB3 MET 40 HB3 MET 40 17.388 23.989 3.578 266 HG2 MET 40 HG2 MET 40 19.770 23.967 2.991 267 HG3 MET 40 HG3 MET 40 20.022 25.368 4.029 268 HE1 MET 40 HE1 MET 40 18.796 21.181 5.531 269 HE2 MET 40 HE2 MET 40 19.148 21.569 3.847 270 HE3 MET 40 HE3 MET 40 17.702 22.220 4.617 271 H GLY 41 H GLY 41 16.088 27.398 3.485 272 HA2 GLY 41 HA2 GLY 41 13.671 26.099 2.714 273 HA3 GLY 41 HA3 GLY 41 13.808 27.717 3.390 274 H MET 42 H MET 42 15.758 28.394 1.205 275 HA MET 42 HA MET 42 13.749 29.264 -0.684 276 HB2 MET 42 HB2 MET 42 16.708 29.847 -0.510 277 HB3 MET 42 HB3 MET 42 15.629 30.538 -1.711 278 HG2 MET 42 HG2 MET 42 14.275 31.437 0.232 279 HG3 MET 42 HG3 MET 42 15.640 30.989 1.251 280 HE1 MET 42 HE1 MET 42 18.503 33.256 -0.167 281 HE2 MET 42 HE2 MET 42 18.141 31.564 -0.503 282 HE3 MET 42 HE3 MET 42 18.036 32.178 1.147 283 H MET 43 H MET 43 16.402 26.953 -0.560 284 HA MET 43 HA MET 43 16.524 26.509 -3.373 285 HB2 MET 43 HB2 MET 43 18.102 24.895 -2.898 286 HB3 MET 43 HB3 MET 43 18.202 25.864 -1.433 287 HG2 MET 43 HG2 MET 43 16.394 24.223 -0.559 288 HG3 MET 43 HG3 MET 43 16.977 23.188 -1.858 289 HE1 MET 43 HE1 MET 43 18.255 22.116 1.801 290 HE2 MET 43 HE2 MET 43 17.097 21.724 0.528 291 HE3 MET 43 HE3 MET 43 16.890 23.191 1.483 292 H ALA 44 H ALA 44 14.671 25.205 -0.715 293 HA ALA 44 HA ALA 44 13.563 22.956 -1.949 294 HB1 ALA 44 HB1 ALA 44 11.847 23.062 -0.223 295 HB2 ALA 44 HB2 ALA 44 12.323 24.715 0.167 296 HB3 ALA 44 HB3 ALA 44 13.440 23.381 0.462 297 H ASP 45 H ASP 45 12.779 26.338 -2.213 298 HA ASP 45 HA ASP 45 10.192 26.123 -3.282 299 HB2 ASP 45 HB2 ASP 45 11.056 28.257 -2.495 300 HB3 ASP 45 HB3 ASP 45 12.287 28.249 -3.757 301 H SER 46 H SER 46 13.352 26.280 -4.878 302 HA SER 46 HA SER 46 12.419 26.144 -7.493 303 HB2 SER 46 HB2 SER 46 15.035 25.260 -6.271 304 HB3 SER 46 HB3 SER 46 14.743 25.599 -7.962 305 HG SER 46 HG SER 46 15.671 27.393 -6.908 306 H VAL 47 H VAL 47 12.984 23.719 -5.045 307 HA VAL 47 HA VAL 47 13.038 21.444 -6.715 308 HB VAL 47 HB VAL 47 12.115 21.641 -3.841 309 HG11 VAL 47 HG11 VAL 47 12.581 19.240 -3.734 310 HG12 VAL 47 HG12 VAL 47 12.960 19.235 -5.453 311 HG13 VAL 47 HG13 VAL 47 11.322 19.597 -4.913 312 HG21 VAL 47 HG21 VAL 47 14.382 20.857 -3.300 313 HG22 VAL 47 HG22 VAL 47 14.401 22.421 -4.115 314 HG23 VAL 47 HG23 VAL 47 14.812 20.956 -5.007 315 H ASN 48 H ASN 48 10.326 22.863 -4.830 316 HA ASN 48 HA ASN 48 8.459 21.048 -5.966 317 HB2 ASN 48 HB2 ASN 48 6.714 22.462 -4.947 318 HB3 ASN 48 HB3 ASN 48 7.946 21.969 -3.804 319 HD21 ASN 48 HD22 ASN 48 8.917 23.466 -2.643 320 HD22 ASN 48 HD21 ASN 48 8.755 25.169 -2.867 321 H SER 49 H SER 49 9.628 24.202 -6.881 322 HA SER 49 HA SER 49 7.608 24.912 -8.683 323 HB2 SER 49 HB2 SER 49 9.500 26.388 -7.968 324 HB3 SER 49 HB3 SER 49 10.573 25.443 -8.998 325 HG SER 49 HG SER 49 8.283 26.898 -9.854 326 H GLN 50 H GLN 50 10.490 22.893 -9.104 327 HA GLN 50 HA GLN 50 9.926 22.351 -11.862 328 HB2 GLN 50 HB2 GLN 50 11.839 21.060 -9.912 329 HB3 GLN 50 HB3 GLN 50 11.772 20.689 -11.631 330 HG2 GLN 50 HG2 GLN 50 12.425 22.916 -12.204 331 HG3 GLN 50 HG3 GLN 50 12.297 23.437 -10.526 332 HE21 GLN 50 HE22 GLN 50 13.910 22.880 -9.071 333 HE22 GLN 50 HE21 GLN 50 15.449 22.277 -9.585 334 H MET 51 H MET 51 9.209 20.848 -8.799 335 HA MET 51 HA MET 51 8.332 18.349 -9.813 336 HB2 MET 51 HB2 MET 51 8.988 18.734 -7.454 337 HB3 MET 51 HB3 MET 51 7.554 19.727 -7.239 338 HG2 MET 51 HG2 MET 51 6.150 17.779 -7.742 339 HG3 MET 51 HG3 MET 51 7.601 16.792 -7.897 340 HE1 MET 51 HE1 MET 51 6.183 18.755 -3.969 341 HE2 MET 51 HE2 MET 51 5.452 19.009 -5.557 342 HE3 MET 51 HE3 MET 51 7.039 19.686 -5.199 343 H GLN 52 H GLN 52 6.717 21.428 -9.202 344 HA GLN 52 HA GLN 52 4.087 20.532 -9.730 345 HB2 GLN 52 HB2 GLN 52 5.362 23.260 -9.961 346 HB3 GLN 52 HB3 GLN 52 3.648 22.975 -10.239 347 HG2 GLN 52 HG2 GLN 52 3.396 22.171 -7.959 348 HG3 GLN 52 HG3 GLN 52 5.121 22.400 -7.677 349 HE21 GLN 52 HE22 GLN 52 5.934 24.472 -7.431 350 HE22 GLN 52 HE21 GLN 52 4.916 25.841 -7.146 351 H LYS 53 H LYS 53 6.758 21.404 -11.755 352 HA LYS 53 HA LYS 53 5.145 21.360 -14.163 353 HB2 LYS 53 HB2 LYS 53 8.086 21.808 -13.663 354 HB3 LYS 53 HB3 LYS 53 7.402 21.699 -15.280 355 HG2 LYS 53 HG2 LYS 53 5.937 23.611 -14.762 356 HG3 LYS 53 HG3 LYS 53 6.696 23.740 -13.177 357 HD2 LYS 53 HD2 LYS 53 8.360 23.807 -15.666 358 HD3 LYS 53 HD3 LYS 53 7.521 25.256 -15.117 359 HE2 LYS 53 HE2 LYS 53 9.366 23.650 -13.364 360 HE3 LYS 53 HE3 LYS 53 9.911 25.002 -14.353 361 HZ1 LYS 53 HZ1 LYS 53 8.331 26.427 -13.171 362 HZ2 LYS 53 HZ2 LYS 53 9.459 25.738 -12.119 363 HZ3 LYS 53 HZ3 LYS 53 7.883 25.127 -12.183 364 H MET 54 H MET 54 5.994 19.041 -12.206 365 HA MET 54 HA MET 54 6.989 17.125 -14.158 366 HB2 MET 54 HB2 MET 54 7.857 16.925 -11.909 367 HB3 MET 54 HB3 MET 54 6.233 16.863 -11.240 368 HG2 MET 54 HG2 MET 54 5.905 14.730 -12.529 369 HG3 MET 54 HG3 MET 54 7.630 14.774 -12.883 370 HE1 MET 54 HE1 MET 54 9.173 14.499 -9.268 371 HE2 MET 54 HE2 MET 54 8.803 15.987 -10.147 372 HE3 MET 54 HE3 MET 54 9.528 14.616 -10.992 373 H GLY 55 H GLY 55 4.082 17.730 -12.229 374 HA2 GLY 55 HA2 GLY 55 1.915 17.500 -13.289 375 HA3 GLY 55 HA3 GLY 55 2.562 16.135 -14.187 376 HA PRO 56 HA PRO 56 0.509 14.701 -10.154 377 HB2 PRO 56 HB2 PRO 56 -1.910 13.931 -11.049 378 HB3 PRO 56 HB3 PRO 56 -1.588 15.597 -10.543 379 HG2 PRO 56 HG2 PRO 56 -1.725 14.439 -13.297 380 HG3 PRO 56 HG3 PRO 56 -2.346 15.989 -12.701 381 HD2 PRO 56 HD2 PRO 56 0.003 15.708 -14.089 382 HD3 PRO 56 HD3 PRO 56 -0.325 17.029 -12.954 383 H ASN 57 H ASN 57 1.965 13.517 -12.607 384 HA ASN 57 HA ASN 57 1.691 10.775 -11.939 385 HB2 ASN 57 HB2 ASN 57 -0.271 11.637 -13.652 386 HB3 ASN 57 HB3 ASN 57 0.961 11.066 -14.774 387 HD21 ASN 57 HD22 ASN 57 -1.745 10.083 -13.868 388 HD22 ASN 57 HD21 ASN 57 -1.483 8.419 -13.472 389 HA PRO 58 HA PRO 58 5.645 12.416 -13.526 390 HB2 PRO 58 HB2 PRO 58 7.231 10.785 -12.026 391 HB3 PRO 58 HB3 PRO 58 6.529 12.291 -11.429 392 HG2 PRO 58 HG2 PRO 58 5.595 9.477 -11.039 393 HG3 PRO 58 HG3 PRO 58 5.673 10.804 -9.865 394 HD2 PRO 58 HD2 PRO 58 3.368 10.082 -11.066 395 HD3 PRO 58 HD3 PRO 58 3.720 11.767 -10.635 396 HA PRO 59 HA PRO 59 6.655 9.037 -16.366 397 HB2 PRO 59 HB2 PRO 59 8.122 11.059 -17.824 398 HB3 PRO 59 HB3 PRO 59 6.684 10.173 -18.328 399 HG2 PRO 59 HG2 PRO 59 6.715 12.857 -17.774 400 HG3 PRO 59 HG3 PRO 59 5.275 11.834 -17.657 401 HD2 PRO 59 HD2 PRO 59 7.075 12.830 -15.490 402 HD3 PRO 59 HD3 PRO 59 5.312 12.617 -15.487 403 H GLN 60 H GLN 60 8.745 8.134 -16.895 404 HA GLN 60 HA GLN 60 10.497 8.203 -14.723 405 HB2 GLN 60 HB2 GLN 60 12.030 6.845 -16.201 406 HB3 GLN 60 HB3 GLN 60 10.407 6.210 -15.976 407 HG2 GLN 60 HG2 GLN 60 10.471 5.942 -18.191 408 HG3 GLN 60 HG3 GLN 60 10.056 7.651 -18.224 409 HE21 GLN 60 HE22 GLN 60 11.437 6.079 -20.200 410 HE22 GLN 60 HE21 GLN 60 12.991 6.809 -20.420 411 H HIS 61 H HIS 61 10.615 10.018 -17.732 412 HA HIS 61 HA HIS 61 13.329 10.813 -17.447 413 HB2 HIS 61 HB2 HIS 61 12.925 12.410 -19.226 414 HB3 HIS 61 HB3 HIS 61 12.190 10.867 -19.629 415 HD1 HIS 61 HD1 HIS 61 9.815 10.937 -20.338 416 HD2 HIS 61 HD2 HIS 61 10.964 14.412 -18.376 417 HE1 HIS 61 HE1 HIS 61 7.876 12.513 -20.569 418 H ARG 62 H ARG 62 10.534 11.756 -15.797 419 HA ARG 62 HA ARG 62 11.609 14.349 -15.034 420 HB2 ARG 62 HB2 ARG 62 9.142 12.830 -14.187 421 HB3 ARG 62 HB3 ARG 62 9.631 14.340 -13.435 422 HG2 ARG 62 HG2 ARG 62 8.981 13.980 -16.353 423 HG3 ARG 62 HG3 ARG 62 7.902 14.664 -15.135 424 HD2 ARG 62 HD2 ARG 62 9.613 16.422 -14.705 425 HD3 ARG 62 HD3 ARG 62 10.544 15.776 -16.055 426 HE ARG 62 HE ARG 62 7.799 16.543 -16.625 427 HH11 ARG 62 HH11 ARG 62 11.195 17.405 -16.741 428 HH12 ARG 62 HH12 ARG 62 10.964 18.671 -17.904 429 HH21 ARG 62 HH21 ARG 62 7.494 18.212 -18.153 430 HH22 ARG 62 HH22 ARG 62 8.861 19.121 -18.712 431 H LEU 63 H LEU 63 11.085 11.148 -13.651 432 HA LEU 63 HA LEU 63 11.948 11.686 -11.036 433 HB2 LEU 63 HB2 LEU 63 12.214 9.094 -12.560 434 HB3 LEU 63 HB3 LEU 63 12.208 9.279 -10.817 435 HG LEU 63 HG LEU 63 9.862 9.861 -12.630 436 HD11 LEU 63 HD11 LEU 63 10.404 7.542 -10.781 437 HD12 LEU 63 HD12 LEU 63 10.367 7.483 -12.544 438 HD13 LEU 63 HD13 LEU 63 8.894 7.839 -11.641 439 HD21 LEU 63 HD21 LEU 63 8.607 9.956 -10.500 440 HD22 LEU 63 HD22 LEU 63 9.800 11.246 -10.659 441 HD23 LEU 63 HD23 LEU 63 10.138 9.854 -9.628 442 H ARG 64 H ARG 64 13.690 10.577 -13.900 443 HA ARG 64 HA ARG 64 16.160 10.083 -12.652 444 HB2 ARG 64 HB2 ARG 64 15.474 10.729 -15.512 445 HB3 ARG 64 HB3 ARG 64 17.081 10.252 -14.977 446 HG2 ARG 64 HG2 ARG 64 16.183 8.132 -14.166 447 HG3 ARG 64 HG3 ARG 64 14.573 8.609 -14.708 448 HD2 ARG 64 HD2 ARG 64 15.323 8.684 -16.998 449 HD3 ARG 64 HD3 ARG 64 16.979 8.343 -16.499 450 HE ARG 64 HE ARG 64 15.538 6.242 -15.528 451 HH11 ARG 64 HH11 ARG 64 15.900 7.667 -18.704 452 HH12 ARG 64 HH12 ARG 64 15.720 6.160 -19.538 453 HH21 ARG 64 HH21 ARG 64 15.274 4.262 -16.617 454 HH22 ARG 64 HH22 ARG 64 15.354 4.214 -18.348 455 H ALA 65 H ALA 65 14.738 13.020 -13.877 456 HA ALA 65 HA ALA 65 17.246 14.457 -13.747 457 HB1 ALA 65 HB1 ALA 65 15.597 14.968 -15.500 458 HB2 ALA 65 HB2 ALA 65 15.979 16.375 -14.508 459 HB3 ALA 65 HB3 ALA 65 14.467 15.503 -14.256 460 H MET 66 H MET 66 14.209 14.285 -11.937 461 HA MET 66 HA MET 66 14.680 16.551 -10.339 462 HB2 MET 66 HB2 MET 66 12.874 14.179 -9.934 463 HB3 MET 66 HB3 MET 66 12.911 15.555 -8.840 464 HG2 MET 66 HG2 MET 66 12.218 15.622 -11.767 465 HG3 MET 66 HG3 MET 66 11.091 15.754 -10.420 466 HE1 MET 66 HE1 MET 66 12.036 19.204 -8.860 467 HE2 MET 66 HE2 MET 66 12.657 17.625 -8.379 468 HE3 MET 66 HE3 MET 66 10.951 17.816 -8.787 469 H ASN 67 H ASN 67 15.540 13.154 -9.826 470 HA ASN 67 HA ASN 67 16.177 13.457 -7.088 471 HB2 ASN 67 HB2 ASN 67 17.268 11.336 -7.192 472 HB3 ASN 67 HB3 ASN 67 15.860 11.242 -8.239 473 HD21 ASN 67 HD22 ASN 67 16.129 10.924 -10.398 474 HD22 ASN 67 HD21 ASN 67 17.661 10.579 -11.127 475 H THR 68 H THR 68 17.997 14.017 -10.025 476 HA THR 68 HA THR 68 20.464 14.496 -8.599 477 HB THR 68 HB THR 68 19.823 15.050 -11.503 478 HG1 THR 68 HG1 THR 68 20.014 12.709 -10.191 479 HG21 THR 68 HG21 THR 68 22.460 14.578 -10.102 480 HG22 THR 68 HG22 THR 68 21.865 16.139 -10.662 481 HG23 THR 68 HG23 THR 68 22.237 14.868 -11.826 482 H ALA 69 H ALA 69 17.933 16.349 -10.211 483 HA ALA 69 HA ALA 69 19.115 18.882 -10.101 484 HB1 ALA 69 HB1 ALA 69 16.875 19.763 -10.411 485 HB2 ALA 69 HB2 ALA 69 16.181 18.208 -9.955 486 HB3 ALA 69 HB3 ALA 69 17.125 18.351 -11.437 487 H MET 70 H MET 70 17.071 17.187 -7.746 488 HA MET 70 HA MET 70 16.996 19.369 -5.903 489 HB2 MET 70 HB2 MET 70 15.330 17.463 -6.039 490 HB3 MET 70 HB3 MET 70 16.543 16.442 -5.288 491 HG2 MET 70 HG2 MET 70 15.705 18.983 -3.962 492 HG3 MET 70 HG3 MET 70 14.693 17.547 -3.847 493 HE1 MET 70 HE1 MET 70 16.737 15.074 -1.778 494 HE2 MET 70 HE2 MET 70 16.289 15.102 -3.484 495 HE3 MET 70 HE3 MET 70 15.118 15.585 -2.254 496 H ALA 71 H ALA 71 18.912 16.420 -6.198 497 HA ALA 71 HA ALA 71 20.392 16.604 -3.837 498 HB1 ALA 71 HB1 ALA 71 22.006 15.134 -4.925 499 HB2 ALA 71 HB2 ALA 71 21.253 15.458 -6.487 500 HB3 ALA 71 HB3 ALA 71 20.350 14.608 -5.233 501 H ALA 72 H ALA 72 20.808 18.204 -6.930 502 HA ALA 72 HA ALA 72 23.438 19.167 -6.437 503 HB1 ALA 72 HB1 ALA 72 21.374 20.263 -8.342 504 HB2 ALA 72 HB2 ALA 72 22.484 18.941 -8.697 505 HB3 ALA 72 HB3 ALA 72 23.113 20.559 -8.387 506 H GLU 73 H GLU 73 20.210 20.546 -5.962 507 HA GLU 73 HA GLU 73 21.250 23.132 -5.318 508 HB2 GLU 73 HB2 GLU 73 18.466 22.006 -5.040 509 HB3 GLU 73 HB3 GLU 73 18.894 23.689 -4.746 510 HG2 GLU 73 HG2 GLU 73 19.858 23.624 -7.138 511 HG3 GLU 73 HG3 GLU 73 18.886 22.167 -7.320 512 H VAL 74 H VAL 74 20.247 20.325 -3.444 513 HA VAL 74 HA VAL 74 20.367 21.705 -0.933 514 HB VAL 74 HB VAL 74 20.396 19.470 0.109 515 HG11 VAL 74 HG11 VAL 74 18.184 18.756 -0.656 516 HG12 VAL 74 HG12 VAL 74 18.348 19.782 -2.081 517 HG13 VAL 74 HG13 VAL 74 18.275 20.508 -0.476 518 HG21 VAL 74 HG21 VAL 74 20.186 17.462 -1.268 519 HG22 VAL 74 HG22 VAL 74 21.725 18.278 -1.538 520 HG23 VAL 74 HG23 VAL 74 20.426 18.434 -2.719 521 H ALA 75 H ALA 75 22.654 20.270 -3.055 522 HA ALA 75 HA ALA 75 24.763 19.950 -1.150 523 HB1 ALA 75 HB1 ALA 75 24.941 20.152 -4.155 524 HB2 ALA 75 HB2 ALA 75 24.655 18.666 -3.252 525 HB3 ALA 75 HB3 ALA 75 26.180 19.531 -3.067 526 H GLU 76 H GLU 76 23.438 22.603 -2.835 527 HA GLU 76 HA GLU 76 25.686 24.231 -3.192 528 HB2 GLU 76 HB2 GLU 76 22.786 24.916 -2.740 529 HB3 GLU 76 HB3 GLU 76 24.007 26.115 -3.130 530 HG2 GLU 76 HG2 GLU 76 23.192 23.776 -4.834 531 HG3 GLU 76 HG3 GLU 76 22.787 25.470 -5.111 532 H VAL 77 H VAL 77 23.385 24.086 -0.473 533 HA VAL 77 HA VAL 77 24.706 26.077 1.050 534 HB VAL 77 HB VAL 77 23.387 25.293 2.965 535 HG11 VAL 77 HG11 VAL 77 22.346 26.790 1.356 536 HG12 VAL 77 HG12 VAL 77 21.160 25.672 2.029 537 HG13 VAL 77 HG13 VAL 77 21.800 25.409 0.407 538 HG21 VAL 77 HG21 VAL 77 21.830 23.412 2.730 539 HG22 VAL 77 HG22 VAL 77 23.509 22.890 2.590 540 HG23 VAL 77 HG23 VAL 77 22.512 23.051 1.144 541 H VAL 78 H VAL 78 25.261 22.720 0.559 542 HA VAL 78 HA VAL 78 26.872 22.328 2.907 543 HB VAL 78 HB VAL 78 26.748 20.590 0.432 544 HG11 VAL 78 HG11 VAL 78 27.526 19.954 3.274 545 HG12 VAL 78 HG12 VAL 78 28.629 20.112 1.909 546 HG13 VAL 78 HG13 VAL 78 27.449 18.804 1.940 547 HG21 VAL 78 HG21 VAL 78 25.048 20.493 2.920 548 HG22 VAL 78 HG22 VAL 78 25.067 19.270 1.652 549 HG23 VAL 78 HG23 VAL 78 24.503 20.901 1.294 550 H ALA 79 H ALA 79 27.368 23.257 -0.420 551 HA ALA 79 HA ALA 79 30.193 22.914 -0.471 552 HB1 ALA 79 HB1 ALA 79 28.433 24.668 -2.180 553 HB2 ALA 79 HB2 ALA 79 28.875 22.996 -2.519 554 HB3 ALA 79 HB3 ALA 79 30.112 24.253 -2.519 555 H THR 80 H THR 80 28.134 25.265 0.911 556 HA THR 80 HA THR 80 30.070 27.392 0.994 557 HB THR 80 HB THR 80 27.642 27.155 2.776 558 HG1 THR 80 HG1 THR 80 26.712 28.428 0.862 559 HG21 THR 80 HG21 THR 80 27.630 29.597 2.594 560 HG22 THR 80 HG22 THR 80 29.019 29.534 1.508 561 HG23 THR 80 HG23 THR 80 29.189 29.029 3.191 562 H SER 81 H SER 81 30.001 24.472 2.445 563 HA SER 81 HA SER 81 30.952 25.391 5.059 564 HB2 SER 81 HB2 SER 81 30.267 22.581 4.164 565 HB3 SER 81 HB3 SER 81 30.565 23.122 5.820 566 HG SER 81 HG SER 81 28.321 23.421 4.220 567 HA PRO 82 HA PRO 82 35.181 24.654 3.679 568 HB2 PRO 82 HB2 PRO 82 35.593 24.645 6.625 569 HB3 PRO 82 HB3 PRO 82 36.432 25.570 5.375 570 HG2 PRO 82 HG2 PRO 82 34.663 26.750 6.973 571 HG3 PRO 82 HG3 PRO 82 34.762 27.175 5.253 572 HD2 PRO 82 HD2 PRO 82 32.762 25.462 6.672 573 HD3 PRO 82 HD3 PRO 82 32.519 26.622 5.348 574 HA PRO 83 HA PRO 83 35.541 20.289 3.734 575 HB2 PRO 83 HB2 PRO 83 38.391 20.793 4.486 576 HB3 PRO 83 HB3 PRO 83 37.727 19.750 3.221 577 HG2 PRO 83 HG2 PRO 83 38.759 22.114 2.598 578 HG3 PRO 83 HG3 PRO 83 37.286 21.535 1.800 579 HD2 PRO 83 HD2 PRO 83 37.608 23.619 3.904 580 HD3 PRO 83 HD3 PRO 83 36.430 23.520 2.580 581 H GLN 84 H GLN 84 37.148 21.929 6.454 582 HA GLN 84 HA GLN 84 37.311 19.560 8.038 583 HB2 GLN 84 HB2 GLN 84 37.992 21.118 9.858 584 HB3 GLN 84 HB3 GLN 84 38.941 21.279 8.387 585 HG2 GLN 84 HG2 GLN 84 37.582 23.238 7.762 586 HG3 GLN 84 HG3 GLN 84 36.719 23.096 9.294 587 HE21 GLN 84 HE22 GLN 84 37.393 25.116 9.983 588 HE22 GLN 84 HE21 GLN 84 39.016 25.420 10.493 589 H SER 85 H SER 85 34.885 21.984 7.589 590 HA SER 85 HA SER 85 33.412 21.057 9.957 591 HB2 SER 85 HB2 SER 85 32.724 23.386 8.152 592 HB3 SER 85 HB3 SER 85 32.111 23.062 9.773 593 HG SER 85 HG SER 85 34.001 23.681 10.637 594 H TYR 86 H TYR 86 33.712 20.497 6.728 595 HA TYR 86 HA TYR 86 31.116 20.409 5.714 596 HB2 TYR 86 HB2 TYR 86 33.154 20.338 4.341 597 HB3 TYR 86 HB3 TYR 86 33.521 18.735 4.965 598 HD1 TYR 86 HD1 TYR 86 32.031 16.817 4.360 599 HD2 TYR 86 HD2 TYR 86 31.655 20.646 2.550 600 HE1 TYR 86 HE1 TYR 86 30.751 15.812 2.519 601 HE2 TYR 86 HE2 TYR 86 30.371 19.655 0.708 602 HH TYR 86 HH TYR 86 29.953 17.579 -0.341 603 H SER 87 H SER 87 33.048 17.925 7.329 604 HA SER 87 HA SER 87 31.440 15.729 6.843 605 HB2 SER 87 HB2 SER 87 33.004 16.186 9.383 606 HB3 SER 87 HB3 SER 87 32.636 14.645 8.608 607 HG SER 87 HG SER 87 34.335 14.904 7.412 608 H ALA 88 H ALA 88 31.109 18.213 9.310 609 HA ALA 88 HA ALA 88 29.118 16.793 10.808 610 HB1 ALA 88 HB1 ALA 88 29.806 19.735 10.835 611 HB2 ALA 88 HB2 ALA 88 30.554 18.499 11.846 612 HB3 ALA 88 HB3 ALA 88 28.842 18.880 12.040 613 H VAL 89 H VAL 89 29.152 19.175 8.241 614 HA VAL 89 HA VAL 89 26.368 19.777 8.313 615 HB VAL 89 HB VAL 89 28.393 20.120 6.091 616 HG11 VAL 89 HG11 VAL 89 26.127 20.094 5.191 617 HG12 VAL 89 HG12 VAL 89 26.803 21.721 5.128 618 HG13 VAL 89 HG13 VAL 89 25.632 21.302 6.375 619 HG21 VAL 89 HG21 VAL 89 28.424 22.470 6.811 620 HG22 VAL 89 HG22 VAL 89 28.963 21.380 8.089 621 HG23 VAL 89 HG23 VAL 89 27.339 22.066 8.142 622 H LEU 90 H LEU 90 28.375 17.617 6.351 623 HA LEU 90 HA LEU 90 26.443 16.695 4.589 624 HB2 LEU 90 HB2 LEU 90 29.005 16.357 4.698 625 HB3 LEU 90 HB3 LEU 90 28.629 14.965 5.689 626 HG LEU 90 HG LEU 90 29.055 14.499 3.266 627 HD11 LEU 90 HD11 LEU 90 27.923 12.865 4.639 628 HD12 LEU 90 HD12 LEU 90 27.200 12.898 3.031 629 HD13 LEU 90 HD13 LEU 90 26.379 13.680 4.382 630 HD21 LEU 90 HD21 LEU 90 26.345 15.764 2.885 631 HD22 LEU 90 HD22 LEU 90 27.305 14.942 1.654 632 HD23 LEU 90 HD23 LEU 90 27.880 16.455 2.355 633 H ASN 91 H ASN 91 27.479 15.303 7.704 634 HA ASN 91 HA ASN 91 25.699 13.134 7.686 635 HB2 ASN 91 HB2 ASN 91 27.141 14.561 9.897 636 HB3 ASN 91 HB3 ASN 91 25.960 13.312 10.274 637 HD21 ASN 91 HD22 ASN 91 29.119 13.994 9.143 638 HD22 ASN 91 HD21 ASN 91 29.642 12.353 8.972 639 H THR 92 H THR 92 25.287 16.447 8.814 640 HA THR 92 HA THR 92 22.797 16.136 10.068 641 HB THR 92 HB THR 92 23.863 18.560 8.600 642 HG1 THR 92 HG1 THR 92 25.231 17.986 10.307 643 HG21 THR 92 HG21 THR 92 21.443 18.684 8.965 644 HG22 THR 92 HG22 THR 92 22.298 19.833 9.995 645 HG23 THR 92 HG23 THR 92 21.681 18.328 10.677 646 H ILE 93 H ILE 93 23.594 17.070 6.726 647 HA ILE 93 HA ILE 93 20.976 17.270 5.756 648 HB ILE 93 HB ILE 93 23.461 16.433 4.252 649 HG12 ILE 93 HG12 ILE 93 23.704 18.619 5.330 650 HG13 ILE 93 HG13 ILE 93 23.594 18.793 3.582 651 HG21 ILE 93 HG21 ILE 93 22.279 17.180 2.243 652 HG22 ILE 93 HG22 ILE 93 20.835 17.484 3.209 653 HG23 ILE 93 HG23 ILE 93 21.446 15.840 3.028 654 HD11 ILE 93 HD11 ILE 93 21.380 19.291 5.562 655 HD12 ILE 93 HD12 ILE 93 21.242 19.440 3.810 656 HD13 ILE 93 HD13 ILE 93 22.316 20.516 4.705 657 H GLY 94 H GLY 94 23.213 14.516 5.762 658 HA2 GLY 94 HA2 GLY 94 21.565 12.709 4.405 659 HA3 GLY 94 HA3 GLY 94 22.860 12.266 5.497 660 H ALA 95 H ALA 95 21.923 13.239 7.870 661 HA ALA 95 HA ALA 95 20.224 11.117 8.641 662 HB1 ALA 95 HB1 ALA 95 20.959 13.605 10.175 663 HB2 ALA 95 HB2 ALA 95 21.873 12.096 10.152 664 HB3 ALA 95 HB3 ALA 95 20.255 12.139 10.854 665 H CYS 96 H CYS 96 19.678 14.608 8.354 666 HA CYS 96 HA CYS 96 16.996 14.534 9.206 667 HB2 CYS 96 HB2 CYS 96 18.512 16.557 7.563 668 HB3 CYS 96 HB3 CYS 96 16.869 16.809 8.150 669 H LEU 97 H LEU 97 18.455 14.283 5.985 670 HA LEU 97 HA LEU 97 16.047 14.505 4.530 671 HB2 LEU 97 HB2 LEU 97 18.291 14.701 3.537 672 HB3 LEU 97 HB3 LEU 97 18.522 12.977 3.771 673 HG LEU 97 HG LEU 97 16.765 12.465 2.198 674 HD11 LEU 97 HD11 LEU 97 15.618 14.269 0.951 675 HD12 LEU 97 HD12 LEU 97 16.352 15.451 2.035 676 HD13 LEU 97 HD13 LEU 97 15.211 14.264 2.667 677 HD21 LEU 97 HD21 LEU 97 18.995 12.898 1.321 678 HD22 LEU 97 HD22 LEU 97 18.588 14.604 1.140 679 HD23 LEU 97 HD23 LEU 97 17.746 13.390 0.175 680 H ARG 98 H ARG 98 17.778 11.716 5.847 681 HA ARG 98 HA ARG 98 16.189 9.676 4.797 682 HB2 ARG 98 HB2 ARG 98 17.719 9.837 7.393 683 HB3 ARG 98 HB3 ARG 98 16.941 8.367 6.827 684 HG2 ARG 98 HG2 ARG 98 18.366 8.267 4.913 685 HG3 ARG 98 HG3 ARG 98 19.039 9.860 5.273 686 HD2 ARG 98 HD2 ARG 98 20.004 9.006 7.334 687 HD3 ARG 98 HD3 ARG 98 19.296 7.423 7.030 688 HE ARG 98 HE ARG 98 20.744 7.606 4.877 689 HH11 ARG 98 HH11 ARG 98 21.633 8.678 8.093 690 HH12 ARG 98 HH12 ARG 98 23.328 8.415 7.847 691 HH21 ARG 98 HH21 ARG 98 22.983 7.256 4.558 692 HH22 ARG 98 HH22 ARG 98 24.098 7.617 5.834 693 H GLU 99 H GLU 99 15.938 11.210 8.006 694 HA GLU 99 HA GLU 99 13.614 9.808 8.751 695 HB2 GLU 99 HB2 GLU 99 13.377 11.549 10.515 696 HB3 GLU 99 HB3 GLU 99 14.958 10.791 10.460 697 HG2 GLU 99 HG2 GLU 99 15.868 12.724 9.314 698 HG3 GLU 99 HG3 GLU 99 14.273 13.476 9.300 699 H SER 100 H SER 100 14.041 12.963 7.217 700 HA SER 100 HA SER 100 11.410 13.864 7.414 701 HB2 SER 100 HB2 SER 100 13.469 14.403 5.269 702 HB3 SER 100 HB3 SER 100 11.955 15.290 5.439 703 HG SER 100 HG SER 100 14.156 15.199 7.207 704 H MET 101 H MET 101 12.843 11.578 5.169 705 HA MET 101 HA MET 101 10.706 11.579 3.303 706 HB2 MET 101 HB2 MET 101 12.814 9.513 3.925 707 HB3 MET 101 HB3 MET 101 11.645 9.339 2.626 708 HG2 MET 101 HG2 MET 101 12.499 11.406 1.607 709 HG3 MET 101 HG3 MET 101 13.704 11.519 2.890 710 HE1 MET 101 HE1 MET 101 13.569 8.101 -0.216 711 HE2 MET 101 HE2 MET 101 12.388 9.408 -0.134 712 HE3 MET 101 HE3 MET 101 12.453 8.197 1.147 713 H MET 102 H MET 102 11.393 9.662 6.198 714 HA MET 102 HA MET 102 8.991 8.090 5.830 715 HB2 MET 102 HB2 MET 102 9.619 6.872 7.757 716 HB3 MET 102 HB3 MET 102 11.102 7.188 6.872 717 HG2 MET 102 HG2 MET 102 11.599 9.034 8.408 718 HG3 MET 102 HG3 MET 102 10.133 8.655 9.310 719 HE1 MET 102 HE1 MET 102 11.039 4.895 10.340 720 HE2 MET 102 HE2 MET 102 10.463 5.336 8.733 721 HE3 MET 102 HE3 MET 102 9.721 6.055 10.164 722 H GLN 103 H GLN 103 9.887 11.022 7.395 723 HA GLN 103 HA GLN 103 7.636 11.212 9.132 724 HB2 GLN 103 HB2 GLN 103 9.508 13.247 7.942 725 HB3 GLN 103 HB3 GLN 103 8.153 13.717 8.949 726 HG2 GLN 103 HG2 GLN 103 10.408 11.911 9.787 727 HG3 GLN 103 HG3 GLN 103 10.248 13.617 10.201 728 HE21 GLN 103 HE22 GLN 103 10.406 11.328 11.969 729 HE22 GLN 103 HE21 GLN 103 8.961 11.350 12.917 730 H ALA 104 H ALA 104 8.145 11.600 5.763 731 HA ALA 104 HA ALA 104 5.710 13.063 5.290 732 HB1 ALA 104 HB1 ALA 104 6.215 12.699 2.918 733 HB2 ALA 104 HB2 ALA 104 7.543 11.629 3.366 734 HB3 ALA 104 HB3 ALA 104 7.608 13.340 3.784 735 H THR 105 H THR 105 6.792 9.857 4.141 736 HA THR 105 HA THR 105 4.691 8.326 5.061 737 HB THR 105 HB THR 105 3.258 9.916 3.764 738 HG1 THR 105 HG1 THR 105 1.916 8.319 3.266 739 HG21 THR 105 HG21 THR 105 4.574 8.657 1.358 740 HG22 THR 105 HG22 THR 105 4.796 10.321 1.897 741 HG23 THR 105 HG23 THR 105 3.213 9.781 1.331 742 H GLY 106 H GLY 106 7.117 8.955 2.672 743 HA2 GLY 106 HA2 GLY 106 6.827 6.415 1.334 744 HA3 GLY 106 HA3 GLY 106 8.018 7.652 0.981 745 H SER 107 H SER 107 8.027 6.984 4.266 746 HA SER 107 HA SER 107 9.452 5.903 5.658 747 HB2 SER 107 HB2 SER 107 8.420 3.885 4.582 748 HB3 SER 107 HB3 SER 107 9.751 3.874 3.429 749 HG SER 107 HG SER 107 9.791 2.591 5.590 750 H VAL 108 H VAL 108 11.834 4.507 5.193 751 HA VAL 108 HA VAL 108 13.488 6.644 4.026 752 HB VAL 108 HB VAL 108 14.371 4.520 5.989 753 HG11 VAL 108 HG11 VAL 108 15.725 7.027 4.998 754 HG12 VAL 108 HG12 VAL 108 16.183 5.366 4.620 755 HG13 VAL 108 HG13 VAL 108 16.340 5.971 6.270 756 HG21 VAL 108 HG21 VAL 108 12.761 5.979 7.063 757 HG22 VAL 108 HG22 VAL 108 13.644 7.400 6.504 758 HG23 VAL 108 HG23 VAL 108 14.383 6.304 7.674 759 H ASP 109 H ASP 109 13.796 6.077 1.967 760 HA ASP 109 HA ASP 109 14.137 3.408 1.057 761 HB2 ASP 109 HB2 ASP 109 13.313 5.307 -0.360 762 HB3 ASP 109 HB3 ASP 109 14.955 5.947 -0.371 763 H ASN 110 H ASN 110 16.137 2.654 -0.090 764 HA ASN 110 HA ASN 110 18.467 3.395 1.556 765 HB2 ASN 110 HB2 ASN 110 17.567 0.669 0.623 766 HB3 ASN 110 HB3 ASN 110 19.161 0.981 1.298 767 HD21 ASN 110 HD22 ASN 110 15.761 0.762 1.964 768 HD22 ASN 110 HD21 ASN 110 15.895 0.742 3.683 769 H ALA 111 H ALA 111 17.326 3.617 -1.479 770 HA ALA 111 HA ALA 111 20.033 3.340 -2.636 771 HB1 ALA 111 HB1 ALA 111 17.400 2.980 -4.069 772 HB2 ALA 111 HB2 ALA 111 18.466 1.675 -3.550 773 HB3 ALA 111 HB3 ALA 111 19.007 2.821 -4.777 774 H PHE 112 H PHE 112 16.928 5.043 -2.924 775 HA PHE 112 HA PHE 112 17.829 7.147 -4.555 776 HB2 PHE 112 HB2 PHE 112 15.476 6.793 -4.333 777 HB3 PHE 112 HB3 PHE 112 15.551 6.936 -2.582 778 HD1 PHE 112 HD1 PHE 112 15.910 8.863 -5.736 779 HD2 PHE 112 HD2 PHE 112 15.263 9.001 -1.531 780 HE1 PHE 112 HE1 PHE 112 15.362 11.258 -5.898 781 HE2 PHE 112 HE2 PHE 112 14.716 11.391 -1.686 782 HZ PHE 112 HZ PHE 112 14.767 12.524 -3.870 783 H THR 113 H THR 113 17.204 7.219 -1.041 784 HA THR 113 HA THR 113 18.255 9.754 -0.573 785 HB THR 113 HB THR 113 18.481 7.658 1.534 786 HG1 THR 113 HG1 THR 113 15.904 8.604 1.056 787 HG21 THR 113 HG21 THR 113 17.213 10.398 1.450 788 HG22 THR 113 HG22 THR 113 18.831 10.037 2.050 789 HG23 THR 113 HG23 THR 113 17.418 9.394 2.886 790 H ASN 114 H ASN 114 19.773 6.645 -0.842 791 HA ASN 114 HA ASN 114 22.272 7.374 0.343 792 HB2 ASN 114 HB2 ASN 114 21.540 5.051 0.323 793 HB3 ASN 114 HB3 ASN 114 21.490 5.051 -1.435 794 HD21 ASN 114 HD22 ASN 114 22.918 3.396 -1.646 795 HD22 ASN 114 HD21 ASN 114 24.603 3.554 -1.301 796 H GLU 115 H GLU 115 21.152 6.993 -3.039 797 HA GLU 115 HA GLU 115 23.656 7.678 -4.115 798 HB2 GLU 115 HB2 GLU 115 21.778 6.299 -5.137 799 HB3 GLU 115 HB3 GLU 115 20.987 7.832 -5.490 800 HG2 GLU 115 HG2 GLU 115 22.621 8.478 -6.948 801 HG3 GLU 115 HG3 GLU 115 23.789 7.325 -6.325 802 H VAL 116 H VAL 116 20.730 9.476 -3.287 803 HA VAL 116 HA VAL 116 21.472 11.994 -4.287 804 HB VAL 116 HB VAL 116 19.901 11.275 -1.800 805 HG11 VAL 116 HG11 VAL 116 20.209 13.990 -3.081 806 HG12 VAL 116 HG12 VAL 116 20.905 13.499 -1.538 807 HG13 VAL 116 HG13 VAL 116 19.153 13.592 -1.725 808 HG21 VAL 116 HG21 VAL 116 17.973 11.962 -3.153 809 HG22 VAL 116 HG22 VAL 116 18.849 10.625 -3.897 810 HG23 VAL 116 HG23 VAL 116 19.046 12.263 -4.521 811 H MET 117 H MET 117 22.243 10.407 -1.204 812 HA MET 117 HA MET 117 23.852 12.353 -0.055 813 HB2 MET 117 HB2 MET 117 23.856 9.363 0.062 814 HB3 MET 117 HB3 MET 117 25.119 10.266 0.874 815 HG2 MET 117 HG2 MET 117 22.249 10.912 1.375 816 HG3 MET 117 HG3 MET 117 23.008 9.539 2.174 817 HE1 MET 117 HE1 MET 117 23.825 13.993 2.960 818 HE2 MET 117 HE2 MET 117 22.693 13.312 1.789 819 HE3 MET 117 HE3 MET 117 24.420 13.341 1.434 820 H GLN 118 H GLN 118 24.839 9.727 -2.229 821 HA GLN 118 HA GLN 118 27.534 10.390 -2.438 822 HB2 GLN 118 HB2 GLN 118 26.550 8.297 -3.264 823 HB3 GLN 118 HB3 GLN 118 25.728 9.184 -4.538 824 HG2 GLN 118 HG2 GLN 118 27.817 9.749 -5.569 825 HG3 GLN 118 HG3 GLN 118 28.718 9.042 -4.228 826 HE21 GLN 118 HE22 GLN 118 28.750 8.407 -7.087 827 HE22 GLN 118 HE21 GLN 118 28.383 6.721 -7.194 828 H LEU 119 H LEU 119 24.761 11.544 -4.307 829 HA LEU 119 HA LEU 119 26.213 13.167 -6.096 830 HB2 LEU 119 HB2 LEU 119 23.363 13.102 -5.181 831 HB3 LEU 119 HB3 LEU 119 23.929 14.397 -6.219 832 HG LEU 119 HG LEU 119 24.424 11.568 -7.038 833 HD11 LEU 119 HD11 LEU 119 21.833 13.070 -7.429 834 HD12 LEU 119 HD12 LEU 119 22.054 11.617 -6.454 835 HD13 LEU 119 HD13 LEU 119 22.264 11.546 -8.204 836 HD21 LEU 119 HD21 LEU 119 23.849 14.104 -8.558 837 HD22 LEU 119 HD22 LEU 119 24.262 12.542 -9.262 838 HD23 LEU 119 HD23 LEU 119 25.443 13.408 -8.282 839 H VAL 120 H VAL 120 24.557 13.978 -3.033 840 HA VAL 120 HA VAL 120 25.100 16.715 -3.032 841 HB VAL 120 HB VAL 120 24.897 14.861 -0.648 842 HG11 VAL 120 HG11 VAL 120 24.672 17.866 -0.770 843 HG12 VAL 120 HG12 VAL 120 25.993 16.957 -0.039 844 HG13 VAL 120 HG13 VAL 120 24.372 16.869 0.651 845 HG21 VAL 120 HG21 VAL 120 22.844 16.578 -2.030 846 HG22 VAL 120 HG22 VAL 120 22.582 15.703 -0.521 847 HG23 VAL 120 HG23 VAL 120 22.902 14.816 -2.013 848 H LYS 121 H LYS 121 27.035 14.023 -1.823 849 HA LYS 121 HA LYS 121 29.152 15.489 -0.714 850 HB2 LYS 121 HB2 LYS 121 29.071 12.731 -1.953 851 HB3 LYS 121 HB3 LYS 121 30.464 13.364 -1.090 852 HG2 LYS 121 HG2 LYS 121 29.470 13.158 0.951 853 HG3 LYS 121 HG3 LYS 121 27.844 13.401 0.306 854 HD2 LYS 121 HD2 LYS 121 27.704 11.195 -0.484 855 HD3 LYS 121 HD3 LYS 121 29.445 10.930 -0.309 856 HE2 LYS 121 HE2 LYS 121 29.165 11.115 2.149 857 HE3 LYS 121 HE3 LYS 121 27.427 11.266 1.908 858 HZ1 LYS 121 HZ1 LYS 121 27.388 9.067 0.930 859 HZ2 LYS 121 HZ2 LYS 121 28.093 8.993 2.467 860 HZ3 LYS 121 HZ3 LYS 121 29.065 8.925 1.089 861 H MET 122 H MET 122 28.673 14.233 -3.988 862 HA MET 122 HA MET 122 31.293 15.078 -4.838 863 HB2 MET 122 HB2 MET 122 30.600 13.025 -5.732 864 HB3 MET 122 HB3 MET 122 29.005 13.633 -6.131 865 HG2 MET 122 HG2 MET 122 31.295 14.882 -7.518 866 HG3 MET 122 HG3 MET 122 30.903 13.217 -7.944 867 HE1 MET 122 HE1 MET 122 28.580 12.428 -8.839 868 HE2 MET 122 HE2 MET 122 27.236 13.497 -9.234 869 HE3 MET 122 HE3 MET 122 27.659 13.203 -7.550 870 H LEU 123 H LEU 123 28.085 16.387 -4.974 871 HA LEU 123 HA LEU 123 28.795 18.234 -7.122 872 HB2 LEU 123 HB2 LEU 123 26.207 17.724 -5.665 873 HB3 LEU 123 HB3 LEU 123 26.405 18.995 -6.856 874 HG LEU 123 HG LEU 123 26.778 16.050 -7.417 875 HD11 LEU 123 HD11 LEU 123 24.648 16.217 -8.616 876 HD12 LEU 123 HD12 LEU 123 24.463 17.875 -8.046 877 HD13 LEU 123 HD13 LEU 123 24.455 16.542 -6.894 878 HD21 LEU 123 HD21 LEU 123 28.085 17.491 -8.890 879 HD22 LEU 123 HD22 LEU 123 26.642 18.434 -9.263 880 HD23 LEU 123 HD23 LEU 123 26.747 16.746 -9.762 881 H SER 124 H SER 124 29.699 18.268 -4.141 882 HA SER 124 HA SER 124 29.191 21.145 -3.823 883 HB2 SER 124 HB2 SER 124 29.545 20.700 -1.334 884 HB3 SER 124 HB3 SER 124 28.036 20.102 -2.026 885 HG SER 124 HG SER 124 28.686 18.093 -1.781 886 H ALA 125 H ALA 125 31.410 18.637 -2.581 887 HA ALA 125 HA ALA 125 33.734 19.821 -3.703 888 HB1 ALA 125 HB1 ALA 125 33.255 21.547 -2.020 889 HB2 ALA 125 HB2 ALA 125 34.774 20.709 -1.698 890 HB3 ALA 125 HB3 ALA 125 33.334 20.317 -0.756 891 H ASP 126 H ASP 126 34.953 18.068 -4.028 892 HA ASP 126 HA ASP 126 34.847 15.869 -2.122 893 HB2 ASP 126 HB2 ASP 126 34.814 15.535 -4.653 894 HB3 ASP 126 HB3 ASP 126 36.522 15.960 -4.627 895 H SER 127 H SER 127 35.782 17.496 -0.614 896 HA SER 127 HA SER 127 38.671 17.025 -0.474 897 HB2 SER 127 HB2 SER 127 37.347 19.698 0.070 898 HB3 SER 127 HB3 SER 127 39.059 19.334 0.270 899 HG SER 127 HG SER 127 39.211 19.017 -1.964 900 H ALA 128 H ALA 128 36.169 15.981 0.722 901 HA ALA 128 HA ALA 128 36.180 17.019 3.439 902 HB1 ALA 128 HB1 ALA 128 34.046 16.707 2.278 903 HB2 ALA 128 HB2 ALA 128 34.150 15.726 3.739 904 HB3 ALA 128 HB3 ALA 128 34.370 14.978 2.158 905 H ASN 129 H ASN 129 38.084 14.887 1.973 906 HA ASN 129 HA ASN 129 37.935 12.595 3.618 907 HB2 ASN 129 HB2 ASN 129 39.188 12.655 1.491 908 HB3 ASN 129 HB3 ASN 129 40.372 13.721 2.234 909 HD21 ASN 129 HD22 ASN 129 38.803 11.025 3.843 910 HD22 ASN 129 HD21 ASN 129 40.226 10.061 4.018 911 H GLU 130 H GLU 130 38.333 12.392 5.655 912 HA GLU 130 HA GLU 130 39.130 14.643 7.207 913 HB2 GLU 130 HB2 GLU 130 38.939 11.887 8.359 914 HB3 GLU 130 HB3 GLU 130 38.470 13.423 9.072 915 HG2 GLU 130 HG2 GLU 130 36.416 12.570 8.643 916 HG3 GLU 130 HG3 GLU 130 36.703 13.392 7.111 917 H VAL 131 H VAL 131 40.993 15.084 8.210 918 HA VAL 131 HA VAL 131 43.291 13.374 7.682 919 HB VAL 131 HB VAL 131 43.183 16.094 9.010 920 HG11 VAL 131 HG11 VAL 131 45.551 14.539 7.970 921 HG12 VAL 131 HG12 VAL 131 45.140 14.767 9.669 922 HG13 VAL 131 HG13 VAL 131 45.595 16.154 8.678 923 HG21 VAL 131 HG21 VAL 131 42.474 16.267 6.709 924 HG22 VAL 131 HG22 VAL 131 43.859 15.316 6.175 925 HG23 VAL 131 HG23 VAL 131 44.105 16.921 6.865 926 H SER 132 H SER 132 44.066 12.022 9.151 927 HA SER 132 HA SER 132 42.638 11.662 11.597 928 HB2 SER 132 HB2 SER 132 44.384 9.786 11.892 929 HB3 SER 132 HB3 SER 132 43.255 9.659 10.542 930 HG SER 132 HG SER 132 45.726 9.403 10.266 931 H THR 133 H THR 133 43.234 13.841 12.381 932 HA THR 133 HA THR 133 45.631 13.628 14.064 933 HB THR 133 HB THR 133 44.450 16.245 13.280 934 HG1 THR 133 HG1 THR 133 46.380 14.700 11.878 935 HG21 THR 133 HG21 THR 133 46.684 17.082 13.842 936 HG22 THR 133 HG22 THR 133 47.196 15.438 14.215 937 HG23 THR 133 HG23 THR 133 45.956 16.221 15.196 Start of MODEL 13 1 HA2 GLY 1 HA2 GLY 1 7.777 -7.672 -1.725 2 HA3 GLY 1 HA3 GLY 1 7.118 -7.680 -0.095 3 H SER 2 H SER 2 5.977 -5.947 -1.705 4 HA SER 2 HA SER 2 5.428 -3.782 -2.045 5 HB2 SER 2 HB2 SER 2 7.153 -3.248 0.388 6 HB3 SER 2 HB3 SER 2 5.932 -2.167 -0.284 7 HG SER 2 HG SER 2 4.443 -3.264 0.712 8 H GLY 3 H GLY 3 6.815 -4.123 -3.988 9 HA2 GLY 3 HA2 GLY 3 8.909 -2.055 -4.022 10 HA3 GLY 3 HA3 GLY 3 9.224 -3.635 -4.729 11 H ASN 4 H ASN 4 8.742 -0.677 -5.684 12 HA ASN 4 HA ASN 4 7.422 -1.447 -8.133 13 HB2 ASN 4 HB2 ASN 4 5.530 -0.900 -6.627 14 HB3 ASN 4 HB3 ASN 4 6.205 0.707 -6.388 15 HD21 ASN 4 HD22 ASN 4 5.822 2.252 -7.862 16 HD22 ASN 4 HD21 ASN 4 4.899 2.024 -9.312 17 H SER 5 H SER 5 7.699 0.092 -9.824 18 HA SER 5 HA SER 5 10.263 1.338 -9.641 19 HB2 SER 5 HB2 SER 5 8.336 1.452 -11.960 20 HB3 SER 5 HB3 SER 5 10.094 1.604 -12.009 21 HG SER 5 HG SER 5 9.963 -0.643 -11.006 22 H GLN 6 H GLN 6 7.512 2.552 -8.518 23 HA GLN 6 HA GLN 6 7.984 5.254 -9.519 24 HB2 GLN 6 HB2 GLN 6 5.606 3.932 -8.287 25 HB3 GLN 6 HB3 GLN 6 5.801 5.666 -8.117 26 HG2 GLN 6 HG2 GLN 6 4.384 5.276 -9.979 27 HG3 GLN 6 HG3 GLN 6 5.936 5.830 -10.598 28 HE21 GLN 6 HE22 GLN 6 7.184 4.440 -11.815 29 HE22 GLN 6 HE21 GLN 6 6.582 2.934 -12.418 30 HA PRO 7 HA PRO 7 10.084 5.800 -5.546 31 HB2 PRO 7 HB2 PRO 7 10.836 8.378 -6.729 32 HB3 PRO 7 HB3 PRO 7 11.866 7.065 -6.153 33 HG2 PRO 7 HG2 PRO 7 11.602 7.635 -8.772 34 HG3 PRO 7 HG3 PRO 7 11.851 5.983 -8.180 35 HD2 PRO 7 HD2 PRO 7 9.322 7.311 -9.081 36 HD3 PRO 7 HD3 PRO 7 9.900 5.657 -9.384 37 H ILE 8 H ILE 8 10.432 8.271 -4.505 38 HA ILE 8 HA ILE 8 7.940 8.738 -3.255 39 HB ILE 8 HB ILE 8 10.020 8.980 -2.046 40 HG12 ILE 8 HG12 ILE 8 9.728 11.370 -1.153 41 HG13 ILE 8 HG13 ILE 8 8.407 11.509 -2.304 42 HG21 ILE 8 HG21 ILE 8 10.623 11.281 -3.890 43 HG22 ILE 8 HG22 ILE 8 11.455 9.725 -3.835 44 HG23 ILE 8 HG23 ILE 8 11.563 10.832 -2.466 45 HD11 ILE 8 HD11 ILE 8 8.614 9.522 -0.066 46 HD12 ILE 8 HD12 ILE 8 7.292 9.618 -1.232 47 HD13 ILE 8 HD13 ILE 8 7.583 10.950 -0.114 48 H TRP 9 H TRP 9 9.304 10.059 -6.108 49 HA TRP 9 HA TRP 9 8.027 12.639 -5.931 50 HB2 TRP 9 HB2 TRP 9 9.271 11.311 -8.350 51 HB3 TRP 9 HB3 TRP 9 8.881 13.015 -8.175 52 HD1 TRP 9 HD1 TRP 9 11.591 10.517 -7.524 53 HE1 TRP 9 HE1 TRP 9 13.628 11.682 -6.452 54 HE3 TRP 9 HE3 TRP 9 9.456 15.036 -6.469 55 HZ2 TRP 9 HZ2 TRP 9 14.232 14.204 -5.320 56 HZ3 TRP 9 HZ3 TRP 9 10.828 16.772 -5.396 57 HH2 TRP 9 HH2 TRP 9 13.168 16.362 -4.832 58 H THR 10 H THR 10 6.305 10.259 -5.748 59 HA THR 10 HA THR 10 4.809 10.203 -8.229 60 HB THR 10 HB THR 10 3.272 8.805 -6.513 61 HG1 THR 10 HG1 THR 10 5.784 8.037 -5.553 62 HG21 THR 10 HG21 THR 10 5.797 7.785 -7.813 63 HG22 THR 10 HG22 THR 10 4.235 7.981 -8.608 64 HG23 THR 10 HG23 THR 10 4.419 6.806 -7.305 65 H ASN 11 H ASN 11 4.404 11.325 -4.914 66 HA ASN 11 HA ASN 11 1.989 12.772 -5.760 67 HB2 ASN 11 HB2 ASN 11 1.374 11.111 -4.135 68 HB3 ASN 11 HB3 ASN 11 2.700 11.570 -3.079 69 HD21 ASN 11 HD22 ASN 11 1.246 11.862 -1.372 70 HD22 ASN 11 HD21 ASN 11 0.204 13.238 -1.283 71 HA PRO 12 HA PRO 12 4.514 16.386 -5.265 72 HB2 PRO 12 HB2 PRO 12 2.336 18.120 -5.041 73 HB3 PRO 12 HB3 PRO 12 3.139 17.656 -6.542 74 HG2 PRO 12 HG2 PRO 12 0.638 16.592 -5.325 75 HG3 PRO 12 HG3 PRO 12 1.041 16.845 -7.033 76 HD2 PRO 12 HD2 PRO 12 1.054 14.401 -5.935 77 HD3 PRO 12 HD3 PRO 12 2.245 14.865 -7.170 78 H ASN 13 H ASN 13 1.699 15.813 -3.197 79 HA ASN 13 HA ASN 13 2.475 17.602 -1.150 80 HB2 ASN 13 HB2 ASN 13 0.176 16.801 -1.340 81 HB3 ASN 13 HB3 ASN 13 0.705 15.152 -1.016 82 HD21 ASN 13 HD22 ASN 13 0.237 18.331 0.348 83 HD22 ASN 13 HD21 ASN 13 0.254 17.828 2.005 84 H ALA 14 H ALA 14 3.080 14.177 -1.703 85 HA ALA 14 HA ALA 14 4.252 13.676 0.847 86 HB1 ALA 14 HB1 ALA 14 4.939 11.536 -0.133 87 HB2 ALA 14 HB2 ALA 14 4.453 12.112 -1.727 88 HB3 ALA 14 HB3 ALA 14 3.244 11.887 -0.463 89 H ALA 15 H ALA 15 5.542 14.300 -2.381 90 HA ALA 15 HA ALA 15 8.262 13.947 -1.727 91 HB1 ALA 15 HB1 ALA 15 8.727 15.091 -3.836 92 HB2 ALA 15 HB2 ALA 15 7.045 15.610 -3.932 93 HB3 ALA 15 HB3 ALA 15 7.445 13.897 -4.029 94 H MET 16 H MET 16 6.202 16.834 -1.865 95 HA MET 16 HA MET 16 8.186 18.712 -1.228 96 HB2 MET 16 HB2 MET 16 5.351 18.671 -1.577 97 HB3 MET 16 HB3 MET 16 5.714 19.551 -0.099 98 HG2 MET 16 HG2 MET 16 7.014 20.151 -2.736 99 HG3 MET 16 HG3 MET 16 5.515 20.903 -2.209 100 HE1 MET 16 HE1 MET 16 9.758 21.891 -0.837 101 HE2 MET 16 HE2 MET 16 9.256 21.097 -2.329 102 HE3 MET 16 HE3 MET 16 9.225 20.216 -0.806 103 H THR 17 H THR 17 6.097 16.727 0.790 104 HA THR 17 HA THR 17 6.606 17.910 3.257 105 HB THR 17 HB THR 17 6.006 15.015 2.618 106 HG1 THR 17 HG1 THR 17 4.321 16.387 2.006 107 HG21 THR 17 HG21 THR 17 5.917 16.499 5.253 108 HG22 THR 17 HG22 THR 17 6.971 15.147 4.841 109 HG23 THR 17 HG23 THR 17 5.232 14.899 4.982 110 H MET 18 H MET 18 8.319 15.170 1.700 111 HA MET 18 HA MET 18 10.139 14.891 3.861 112 HB2 MET 18 HB2 MET 18 11.406 13.380 2.403 113 HB3 MET 18 HB3 MET 18 9.693 13.002 2.424 114 HG2 MET 18 HG2 MET 18 10.300 12.747 0.207 115 HG3 MET 18 HG3 MET 18 9.558 14.343 0.252 116 HE1 MET 18 HE1 MET 18 10.690 14.661 -2.187 117 HE2 MET 18 HE2 MET 18 11.511 13.103 -2.056 118 HE3 MET 18 HE3 MET 18 12.430 14.555 -2.465 119 H THR 19 H THR 19 10.133 16.861 0.996 120 HA THR 19 HA THR 19 12.866 17.623 1.086 121 HB THR 19 HB THR 19 10.452 19.006 -0.084 122 HG1 THR 19 HG1 THR 19 11.555 16.801 -0.806 123 HG21 THR 19 HG21 THR 19 12.295 20.585 0.281 124 HG22 THR 19 HG22 THR 19 12.006 20.294 -1.435 125 HG23 THR 19 HG23 THR 19 13.374 19.520 -0.631 126 H ASN 20 H ASN 20 9.880 19.121 2.324 127 HA ASN 20 HA ASN 20 11.135 21.444 3.323 128 HB2 ASN 20 HB2 ASN 20 8.476 20.149 3.871 129 HB3 ASN 20 HB3 ASN 20 8.972 21.640 4.663 130 HD21 ASN 20 HD22 ASN 20 6.846 20.980 2.679 131 HD22 ASN 20 HD21 ASN 20 7.065 22.127 1.404 132 H ASN 21 H ASN 21 10.413 18.314 4.774 133 HA ASN 21 HA ASN 21 10.986 19.056 7.430 134 HB2 ASN 21 HB2 ASN 21 10.864 16.439 6.001 135 HB3 ASN 21 HB3 ASN 21 11.549 16.506 7.618 136 HD21 ASN 21 HD22 ASN 21 8.724 16.641 5.708 137 HD22 ASN 21 HD21 ASN 21 7.581 16.704 7.012 138 H LEU 22 H LEU 22 13.011 18.237 4.735 139 HA LEU 22 HA LEU 22 15.391 17.660 6.139 140 HB2 LEU 22 HB2 LEU 22 15.150 17.169 3.766 141 HB3 LEU 22 HB3 LEU 22 14.960 18.872 3.403 142 HG LEU 22 HG LEU 22 17.299 19.250 4.179 143 HD11 LEU 22 HD11 LEU 22 17.526 17.335 5.650 144 HD12 LEU 22 HD12 LEU 22 18.777 17.317 4.407 145 HD13 LEU 22 HD13 LEU 22 17.386 16.240 4.275 146 HD21 LEU 22 HD21 LEU 22 16.809 19.024 1.819 147 HD22 LEU 22 HD22 LEU 22 16.911 17.269 1.941 148 HD23 LEU 22 HD23 LEU 22 18.351 18.255 2.192 149 H VAL 23 H VAL 23 13.952 20.639 4.950 150 HA VAL 23 HA VAL 23 16.082 22.350 5.688 151 HB VAL 23 HB VAL 23 13.166 23.061 5.336 152 HG11 VAL 23 HG11 VAL 23 14.481 24.804 6.445 153 HG12 VAL 23 HG12 VAL 23 13.975 25.300 4.830 154 HG13 VAL 23 HG13 VAL 23 15.636 24.777 5.111 155 HG21 VAL 23 HG21 VAL 23 13.751 23.609 3.023 156 HG22 VAL 23 HG22 VAL 23 14.017 21.901 3.368 157 HG23 VAL 23 HG23 VAL 23 15.387 23.008 3.294 158 H GLN 24 H GLN 24 13.008 21.497 7.289 159 HA GLN 24 HA GLN 24 13.381 23.282 9.457 160 HB2 GLN 24 HB2 GLN 24 11.517 22.188 10.524 161 HB3 GLN 24 HB3 GLN 24 11.172 22.354 8.812 162 HG2 GLN 24 HG2 GLN 24 10.436 20.231 9.217 163 HG3 GLN 24 HG3 GLN 24 12.082 19.926 8.670 164 HE21 GLN 24 HE22 GLN 24 12.224 17.962 9.729 165 HE22 GLN 24 HE21 GLN 24 12.339 17.837 11.448 166 H CYS 25 H CYS 25 14.344 19.951 8.924 167 HA CYS 25 HA CYS 25 15.103 19.419 11.609 168 HB2 CYS 25 HB2 CYS 25 14.669 17.578 10.115 169 HB3 CYS 25 HB3 CYS 25 15.922 18.127 9.004 170 H ALA 26 H ALA 26 16.869 20.525 8.746 171 HA ALA 26 HA ALA 26 19.403 20.572 10.032 172 HB1 ALA 26 HB1 ALA 26 20.182 21.742 8.078 173 HB2 ALA 26 HB2 ALA 26 18.526 22.101 7.587 174 HB3 ALA 26 HB3 ALA 26 19.106 20.436 7.585 175 H SER 27 H SER 27 16.755 22.817 9.772 176 HA SER 27 HA SER 27 18.118 25.123 10.703 177 HB2 SER 27 HB2 SER 27 15.916 25.195 9.555 178 HB3 SER 27 HB3 SER 27 15.180 24.415 10.956 179 HG SER 27 HG SER 27 16.609 26.576 11.713 180 H ARG 28 H ARG 28 17.021 22.265 12.233 181 HA ARG 28 HA ARG 28 17.124 23.499 14.888 182 HB2 ARG 28 HB2 ARG 28 15.896 20.970 13.879 183 HB3 ARG 28 HB3 ARG 28 16.098 21.303 15.594 184 HG2 ARG 28 HG2 ARG 28 14.750 23.327 15.358 185 HG3 ARG 28 HG3 ARG 28 14.534 22.971 13.639 186 HD2 ARG 28 HD2 ARG 28 13.604 20.775 14.327 187 HD3 ARG 28 HD3 ARG 28 13.611 21.349 15.987 188 HE ARG 28 HE ARG 28 12.229 23.266 14.652 189 HH11 ARG 28 HH11 ARG 28 11.918 19.792 14.907 190 HH12 ARG 28 HH12 ARG 28 10.202 19.795 14.666 191 HH21 ARG 28 HH21 ARG 28 9.959 23.278 14.348 192 HH22 ARG 28 HH22 ARG 28 9.086 21.778 14.362 193 H SER 29 H SER 29 19.302 22.312 12.926 194 HA SER 29 HA SER 29 20.394 20.097 14.345 195 HB2 SER 29 HB2 SER 29 22.330 20.362 12.840 196 HB3 SER 29 HB3 SER 29 20.811 20.420 11.945 197 HG SER 29 HG SER 29 21.106 22.497 11.518 198 H GLY 30 H GLY 30 21.196 23.541 14.169 199 HA2 GLY 30 HA2 GLY 30 22.320 24.853 15.724 200 HA3 GLY 30 HA3 GLY 30 22.551 23.422 16.721 201 H VAL 31 H VAL 31 23.386 22.903 13.514 202 HA VAL 31 HA VAL 31 26.245 23.172 14.164 203 HB VAL 31 HB VAL 31 24.873 21.278 12.244 204 HG11 VAL 31 HG11 VAL 31 27.049 21.948 11.377 205 HG12 VAL 31 HG12 VAL 31 27.091 20.274 11.929 206 HG13 VAL 31 HG13 VAL 31 27.800 21.546 12.920 207 HG21 VAL 31 HG21 VAL 31 25.702 19.533 13.783 208 HG22 VAL 31 HG22 VAL 31 24.548 20.627 14.543 209 HG23 VAL 31 HG23 VAL 31 26.271 20.800 14.871 210 H LEU 32 H LEU 32 23.769 23.795 11.743 211 HA LEU 32 HA LEU 32 25.657 24.740 9.785 212 HB2 LEU 32 HB2 LEU 32 22.667 25.117 9.790 213 HB3 LEU 32 HB3 LEU 32 23.746 25.257 8.419 214 HG LEU 32 HG LEU 32 22.985 22.742 9.876 215 HD11 LEU 32 HD11 LEU 32 21.285 23.522 8.361 216 HD12 LEU 32 HD12 LEU 32 22.089 22.116 7.662 217 HD13 LEU 32 HD13 LEU 32 22.478 23.733 7.081 218 HD21 LEU 32 HD21 LEU 32 24.946 23.117 7.625 219 HD22 LEU 32 HD22 LEU 32 24.352 21.565 8.216 220 HD23 LEU 32 HD23 LEU 32 25.321 22.597 9.269 221 H THR 33 H THR 33 25.104 26.918 8.746 222 HA THR 33 HA THR 33 25.177 28.935 10.870 223 HB THR 33 HB THR 33 26.091 30.451 9.168 224 HG1 THR 33 HG1 THR 33 26.703 28.952 7.154 225 HG21 THR 33 HG21 THR 33 27.641 29.008 10.418 226 HG22 THR 33 HG22 THR 33 28.229 29.350 8.792 227 HG23 THR 33 HG23 THR 33 27.503 27.786 9.153 228 H ALA 34 H ALA 34 24.143 31.080 10.246 229 HA ALA 34 HA ALA 34 21.379 30.659 9.759 230 HB1 ALA 34 HB1 ALA 34 22.951 33.233 9.854 231 HB2 ALA 34 HB2 ALA 34 22.160 32.448 11.221 232 HB3 ALA 34 HB3 ALA 34 21.195 33.099 9.898 233 H ASP 35 H ASP 35 24.102 31.522 7.823 234 HA ASP 35 HA ASP 35 22.671 32.383 5.502 235 HB2 ASP 35 HB2 ASP 35 24.989 33.049 5.868 236 HB3 ASP 35 HB3 ASP 35 25.503 31.367 5.882 237 H GLN 36 H GLN 36 24.239 29.397 6.511 238 HA GLN 36 HA GLN 36 23.888 27.922 4.163 239 HB2 GLN 36 HB2 GLN 36 25.413 27.432 6.108 240 HB3 GLN 36 HB3 GLN 36 24.007 26.832 6.972 241 HG2 GLN 36 HG2 GLN 36 23.808 24.974 5.626 242 HG3 GLN 36 HG3 GLN 36 24.709 25.714 4.301 243 HE21 GLN 36 HE22 GLN 36 26.184 24.113 4.093 244 HE22 GLN 36 HE21 GLN 36 27.419 23.796 5.267 245 H MET 37 H MET 37 21.866 28.134 7.070 246 HA MET 37 HA MET 37 20.012 26.147 6.237 247 HB2 MET 37 HB2 MET 37 19.724 28.385 8.247 248 HB3 MET 37 HB3 MET 37 18.551 27.094 8.028 249 HG2 MET 37 HG2 MET 37 20.264 25.450 8.640 250 HG3 MET 37 HG3 MET 37 21.414 26.760 8.887 251 HE1 MET 37 HE1 MET 37 19.585 28.995 10.248 252 HE2 MET 37 HE2 MET 37 21.200 28.576 10.817 253 HE3 MET 37 HE3 MET 37 19.852 28.639 11.955 254 H ASP 38 H ASP 38 20.357 29.525 5.548 255 HA ASP 38 HA ASP 38 17.624 29.972 4.844 256 HB2 ASP 38 HB2 ASP 38 19.186 31.773 5.604 257 HB3 ASP 38 HB3 ASP 38 20.026 31.629 4.062 258 H ASP 39 H ASP 39 20.579 29.202 3.058 259 HA ASP 39 HA ASP 39 19.524 29.392 0.461 260 HB2 ASP 39 HB2 ASP 39 21.812 27.888 1.664 261 HB3 ASP 39 HB3 ASP 39 21.295 27.475 0.036 262 H MET 40 H MET 40 19.350 26.865 2.875 263 HA MET 40 HA MET 40 18.327 24.824 1.210 264 HB2 MET 40 HB2 MET 40 17.924 25.252 4.176 265 HB3 MET 40 HB3 MET 40 17.538 23.777 3.302 266 HG2 MET 40 HG2 MET 40 19.928 23.595 2.671 267 HG3 MET 40 HG3 MET 40 20.263 24.979 3.708 268 HE1 MET 40 HE1 MET 40 17.739 21.970 4.266 269 HE2 MET 40 HE2 MET 40 18.768 20.870 5.186 270 HE3 MET 40 HE3 MET 40 19.156 21.246 3.507 271 H GLY 41 H GLY 41 16.809 27.423 3.034 272 HA2 GLY 41 HA2 GLY 41 14.141 26.563 2.719 273 HA3 GLY 41 HA3 GLY 41 14.654 28.210 3.048 274 H MET 42 H MET 42 16.179 28.657 0.724 275 HA MET 42 HA MET 42 14.007 29.393 -0.983 276 HB2 MET 42 HB2 MET 42 15.674 30.569 -2.314 277 HB3 MET 42 HB3 MET 42 15.869 30.923 -0.606 278 HG2 MET 42 HG2 MET 42 17.715 29.358 -0.481 279 HG3 MET 42 HG3 MET 42 17.515 28.968 -2.184 280 HE1 MET 42 HE1 MET 42 18.879 33.094 -0.620 281 HE2 MET 42 HE2 MET 42 18.484 31.725 0.420 282 HE3 MET 42 HE3 MET 42 17.212 32.536 -0.493 283 H MET 43 H MET 43 16.392 26.817 -1.043 284 HA MET 43 HA MET 43 15.982 26.294 -3.838 285 HB2 MET 43 HB2 MET 43 17.374 24.339 -3.502 286 HB3 MET 43 HB3 MET 43 18.115 25.736 -2.756 287 HG2 MET 43 HG2 MET 43 18.466 24.091 -1.199 288 HG3 MET 43 HG3 MET 43 17.008 24.875 -0.595 289 HE1 MET 43 HE1 MET 43 16.248 22.998 0.915 290 HE2 MET 43 HE2 MET 43 17.734 22.111 0.566 291 HE3 MET 43 HE3 MET 43 16.175 21.291 0.467 292 H ALA 44 H ALA 44 14.612 25.285 -0.815 293 HA ALA 44 HA ALA 44 13.183 23.021 -1.639 294 HB1 ALA 44 HB1 ALA 44 13.433 23.664 0.708 295 HB2 ALA 44 HB2 ALA 44 11.738 23.439 0.284 296 HB3 ALA 44 HB3 ALA 44 12.398 25.066 0.439 297 H ASP 45 H ASP 45 12.518 26.450 -1.919 298 HA ASP 45 HA ASP 45 9.869 26.351 -2.820 299 HB2 ASP 45 HB2 ASP 45 12.093 28.290 -3.461 300 HB3 ASP 45 HB3 ASP 45 10.426 28.528 -3.975 301 H SER 46 H SER 46 12.920 26.265 -4.629 302 HA SER 46 HA SER 46 11.800 26.098 -7.177 303 HB2 SER 46 HB2 SER 46 14.471 25.042 -6.247 304 HB3 SER 46 HB3 SER 46 14.034 25.643 -7.834 305 HG SER 46 HG SER 46 14.217 27.648 -7.173 306 H VAL 47 H VAL 47 12.474 23.687 -4.723 307 HA VAL 47 HA VAL 47 12.416 21.393 -6.343 308 HB VAL 47 HB VAL 47 11.527 21.632 -3.456 309 HG11 VAL 47 HG11 VAL 47 12.294 19.205 -5.080 310 HG12 VAL 47 HG12 VAL 47 10.679 19.595 -4.489 311 HG13 VAL 47 HG13 VAL 47 11.967 19.216 -3.347 312 HG21 VAL 47 HG21 VAL 47 13.776 20.831 -2.919 313 HG22 VAL 47 HG22 VAL 47 13.837 22.361 -3.795 314 HG23 VAL 47 HG23 VAL 47 14.195 20.850 -4.633 315 H ASN 48 H ASN 48 9.745 22.915 -4.472 316 HA ASN 48 HA ASN 48 7.830 21.083 -5.468 317 HB2 ASN 48 HB2 ASN 48 6.131 22.708 -4.597 318 HB3 ASN 48 HB3 ASN 48 7.284 22.127 -3.412 319 HD21 ASN 48 HD22 ASN 48 8.507 23.551 -2.341 320 HD22 ASN 48 HD21 ASN 48 8.460 25.259 -2.581 321 H SER 49 H SER 49 8.968 24.199 -6.583 322 HA SER 49 HA SER 49 6.943 24.756 -8.423 323 HB2 SER 49 HB2 SER 49 8.827 26.294 -7.740 324 HB3 SER 49 HB3 SER 49 9.882 25.367 -8.807 325 HG SER 49 HG SER 49 8.582 27.396 -9.540 326 H GLN 50 H GLN 50 10.018 23.019 -8.914 327 HA GLN 50 HA GLN 50 9.450 22.342 -11.615 328 HB2 GLN 50 HB2 GLN 50 11.423 21.133 -9.673 329 HB3 GLN 50 HB3 GLN 50 11.394 20.831 -11.406 330 HG2 GLN 50 HG2 GLN 50 11.903 23.131 -11.868 331 HG3 GLN 50 HG3 GLN 50 11.785 23.537 -10.156 332 HE21 GLN 50 HE22 GLN 50 13.433 22.922 -8.758 333 HE22 GLN 50 HE21 GLN 50 14.988 22.415 -9.330 334 H MET 51 H MET 51 9.123 20.606 -8.554 335 HA MET 51 HA MET 51 8.518 18.103 -9.714 336 HB2 MET 51 HB2 MET 51 9.428 18.177 -7.510 337 HB3 MET 51 HB3 MET 51 8.133 19.217 -6.940 338 HG2 MET 51 HG2 MET 51 7.335 16.589 -8.012 339 HG3 MET 51 HG3 MET 51 8.224 16.588 -6.490 340 HE1 MET 51 HE1 MET 51 7.316 19.275 -5.083 341 HE2 MET 51 HE2 MET 51 7.426 17.703 -4.294 342 HE3 MET 51 HE3 MET 51 5.959 18.672 -4.127 343 H GLN 52 H GLN 52 6.452 20.748 -8.540 344 HA GLN 52 HA GLN 52 4.053 19.209 -8.865 345 HB2 GLN 52 HB2 GLN 52 4.498 22.158 -8.423 346 HB3 GLN 52 HB3 GLN 52 2.902 21.430 -8.549 347 HG2 GLN 52 HG2 GLN 52 3.417 19.999 -6.622 348 HG3 GLN 52 HG3 GLN 52 4.996 20.771 -6.487 349 HE21 GLN 52 HE22 GLN 52 3.944 23.398 -7.202 350 HE22 GLN 52 HE21 GLN 52 3.089 23.966 -5.811 351 H LYS 53 H LYS 53 5.944 21.306 -10.899 352 HA LYS 53 HA LYS 53 3.922 21.452 -12.953 353 HB2 LYS 53 HB2 LYS 53 6.854 22.187 -12.976 354 HB3 LYS 53 HB3 LYS 53 5.765 22.435 -14.332 355 HG2 LYS 53 HG2 LYS 53 4.434 23.974 -13.054 356 HG3 LYS 53 HG3 LYS 53 5.384 23.646 -11.605 357 HD2 LYS 53 HD2 LYS 53 7.390 24.502 -12.825 358 HD3 LYS 53 HD3 LYS 53 6.316 24.984 -14.141 359 HE2 LYS 53 HE2 LYS 53 5.097 26.450 -12.640 360 HE3 LYS 53 HE3 LYS 53 6.100 25.930 -11.286 361 HZ1 LYS 53 HZ1 LYS 53 8.031 26.857 -12.416 362 HZ2 LYS 53 HZ2 LYS 53 6.855 28.045 -12.155 363 HZ3 LYS 53 HZ3 LYS 53 7.053 27.378 -13.694 364 H MET 54 H MET 54 6.181 19.172 -11.918 365 HA MET 54 HA MET 54 6.642 17.831 -14.377 366 HB2 MET 54 HB2 MET 54 8.091 17.399 -12.492 367 HB3 MET 54 HB3 MET 54 6.732 16.870 -11.513 368 HG2 MET 54 HG2 MET 54 6.485 14.880 -12.745 369 HG3 MET 54 HG3 MET 54 7.551 15.451 -14.026 370 HE1 MET 54 HE1 MET 54 7.319 14.359 -10.271 371 HE2 MET 54 HE2 MET 54 8.259 15.847 -10.119 372 HE3 MET 54 HE3 MET 54 9.016 14.285 -9.797 373 H GLY 55 H GLY 55 4.187 17.625 -11.869 374 HA2 GLY 55 HA2 GLY 55 1.930 17.179 -12.249 375 HA3 GLY 55 HA3 GLY 55 2.341 16.560 -13.842 376 HA PRO 56 HA PRO 56 1.741 12.984 -10.807 377 HB2 PRO 56 HB2 PRO 56 -0.836 12.334 -11.256 378 HB3 PRO 56 HB3 PRO 56 -0.367 13.507 -10.022 379 HG2 PRO 56 HG2 PRO 56 -1.436 13.975 -12.774 380 HG3 PRO 56 HG3 PRO 56 -1.823 14.816 -11.263 381 HD2 PRO 56 HD2 PRO 56 -0.094 15.792 -13.148 382 HD3 PRO 56 HD3 PRO 56 -0.007 16.201 -11.426 383 H ASN 57 H ASN 57 1.805 10.865 -11.476 384 HA ASN 57 HA ASN 57 2.212 9.129 -12.887 385 HB2 ASN 57 HB2 ASN 57 0.247 10.578 -14.670 386 HB3 ASN 57 HB3 ASN 57 0.813 8.932 -14.928 387 HD21 ASN 57 HD22 ASN 57 -1.271 10.997 -13.149 388 HD22 ASN 57 HD21 ASN 57 -2.128 9.761 -12.295 389 HA PRO 58 HA PRO 58 4.800 11.997 -15.532 390 HB2 PRO 58 HB2 PRO 58 6.991 12.197 -13.799 391 HB3 PRO 58 HB3 PRO 58 5.708 13.389 -13.999 392 HG2 PRO 58 HG2 PRO 58 6.229 11.856 -11.689 393 HG3 PRO 58 HG3 PRO 58 4.800 12.853 -11.997 394 HD2 PRO 58 HD2 PRO 58 5.158 9.913 -12.301 395 HD3 PRO 58 HD3 PRO 58 3.713 10.836 -11.832 396 HA PRO 59 HA PRO 59 7.537 8.852 -17.136 397 HB2 PRO 59 HB2 PRO 59 9.315 10.980 -18.086 398 HB3 PRO 59 HB3 PRO 59 8.369 9.819 -19.020 399 HG2 PRO 59 HG2 PRO 59 7.760 12.452 -18.916 400 HG3 PRO 59 HG3 PRO 59 6.532 11.190 -19.111 401 HD2 PRO 59 HD2 PRO 59 7.282 12.752 -16.677 402 HD3 PRO 59 HD3 PRO 59 5.684 12.206 -17.225 403 H GLN 60 H GLN 60 9.360 7.793 -16.426 404 HA GLN 60 HA GLN 60 10.291 8.575 -13.892 405 HB2 GLN 60 HB2 GLN 60 11.743 6.630 -13.970 406 HB3 GLN 60 HB3 GLN 60 10.131 6.236 -14.537 407 HG2 GLN 60 HG2 GLN 60 10.874 6.227 -16.816 408 HG3 GLN 60 HG3 GLN 60 12.471 6.802 -16.337 409 HE21 GLN 60 HE22 GLN 60 10.299 4.086 -16.386 410 HE22 GLN 60 HE21 GLN 60 11.474 2.889 -15.974 411 H HIS 61 H HIS 61 11.582 9.261 -17.060 412 HA HIS 61 HA HIS 61 14.229 9.832 -16.150 413 HB2 HIS 61 HB2 HIS 61 14.689 10.694 -18.307 414 HB3 HIS 61 HB3 HIS 61 13.577 9.362 -18.562 415 HD1 HIS 61 HD1 HIS 61 11.603 9.857 -20.014 416 HD2 HIS 61 HD2 HIS 61 13.356 13.320 -18.517 417 HE1 HIS 61 HE1 HIS 61 10.485 11.764 -21.214 418 H ARG 62 H ARG 62 11.246 11.537 -16.001 419 HA ARG 62 HA ARG 62 12.390 14.133 -15.521 420 HB2 ARG 62 HB2 ARG 62 9.664 12.966 -15.008 421 HB3 ARG 62 HB3 ARG 62 10.097 14.599 -14.526 422 HG2 ARG 62 HG2 ARG 62 10.843 14.334 -17.222 423 HG3 ARG 62 HG3 ARG 62 9.224 13.645 -17.064 424 HD2 ARG 62 HD2 ARG 62 8.615 15.729 -15.772 425 HD3 ARG 62 HD3 ARG 62 10.149 16.404 -16.304 426 HE ARG 62 HE ARG 62 9.283 15.990 -18.633 427 HH11 ARG 62 HH11 ARG 62 7.099 16.562 -15.943 428 HH12 ARG 62 HH12 ARG 62 5.847 17.235 -16.935 429 HH21 ARG 62 HH21 ARG 62 7.637 16.900 -19.933 430 HH22 ARG 62 HH22 ARG 62 6.162 17.448 -19.197 431 H LEU 63 H LEU 63 10.944 11.605 -13.502 432 HA LEU 63 HA LEU 63 11.523 12.694 -10.997 433 HB2 LEU 63 HB2 LEU 63 11.293 9.815 -11.873 434 HB3 LEU 63 HB3 LEU 63 11.499 10.289 -10.199 435 HG LEU 63 HG LEU 63 9.352 11.619 -10.434 436 HD11 LEU 63 HD11 LEU 63 9.161 10.021 -12.978 437 HD12 LEU 63 HD12 LEU 63 9.224 11.778 -12.837 438 HD13 LEU 63 HD13 LEU 63 7.828 10.891 -12.225 439 HD21 LEU 63 HD21 LEU 63 9.457 9.475 -9.278 440 HD22 LEU 63 HD22 LEU 63 9.215 8.632 -10.808 441 HD23 LEU 63 HD23 LEU 63 7.934 9.652 -10.150 442 H ARG 64 H ARG 64 13.435 10.762 -13.192 443 HA ARG 64 HA ARG 64 15.627 10.086 -11.671 444 HB2 ARG 64 HB2 ARG 64 15.209 9.468 -14.074 445 HB3 ARG 64 HB3 ARG 64 15.736 11.084 -14.527 446 HG2 ARG 64 HG2 ARG 64 17.601 9.702 -14.856 447 HG3 ARG 64 HG3 ARG 64 17.916 10.551 -13.340 448 HD2 ARG 64 HD2 ARG 64 16.836 8.510 -12.218 449 HD3 ARG 64 HD3 ARG 64 17.070 7.710 -13.769 450 HE ARG 64 HE ARG 64 19.468 8.095 -13.495 451 HH11 ARG 64 HH11 ARG 64 17.449 8.397 -10.650 452 HH12 ARG 64 HH12 ARG 64 18.749 8.118 -9.527 453 HH21 ARG 64 HH21 ARG 64 21.179 7.707 -12.013 454 HH22 ARG 64 HH22 ARG 64 20.855 7.698 -10.300 455 H ALA 65 H ALA 65 15.104 13.085 -13.497 456 HA ALA 65 HA ALA 65 17.594 14.214 -12.659 457 HB1 ALA 65 HB1 ALA 65 16.885 16.200 -13.865 458 HB2 ALA 65 HB2 ALA 65 15.250 15.552 -14.003 459 HB3 ALA 65 HB3 ALA 65 16.587 14.754 -14.829 460 H MET 66 H MET 66 14.339 14.247 -11.461 461 HA MET 66 HA MET 66 14.341 16.577 -9.942 462 HB2 MET 66 HB2 MET 66 12.983 13.924 -9.530 463 HB3 MET 66 HB3 MET 66 12.740 15.270 -8.425 464 HG2 MET 66 HG2 MET 66 12.375 15.926 -11.258 465 HG3 MET 66 HG3 MET 66 11.225 14.759 -10.610 466 HE1 MET 66 HE1 MET 66 11.827 18.947 -8.746 467 HE2 MET 66 HE2 MET 66 12.746 18.388 -10.144 468 HE3 MET 66 HE3 MET 66 12.985 17.626 -8.569 469 H ASN 67 H ASN 67 15.595 13.361 -9.130 470 HA ASN 67 HA ASN 67 16.336 13.941 -6.472 471 HB2 ASN 67 HB2 ASN 67 17.902 12.082 -8.264 472 HB3 ASN 67 HB3 ASN 67 17.682 11.982 -6.521 473 HD21 ASN 67 HD22 ASN 67 16.473 11.154 -9.588 474 HD22 ASN 67 HD21 ASN 67 15.095 10.256 -9.049 475 H THR 68 H THR 68 18.170 14.075 -9.502 476 HA THR 68 HA THR 68 20.606 14.922 -8.430 477 HB THR 68 HB THR 68 19.556 15.603 -11.180 478 HG1 THR 68 HG1 THR 68 20.741 13.203 -10.187 479 HG21 THR 68 HG21 THR 68 21.929 15.469 -11.811 480 HG22 THR 68 HG22 THR 68 22.355 15.141 -10.133 481 HG23 THR 68 HG23 THR 68 21.661 16.699 -10.579 482 H ALA 69 H ALA 69 17.894 16.809 -9.748 483 HA ALA 69 HA ALA 69 19.107 19.329 -9.620 484 HB1 ALA 69 HB1 ALA 69 16.863 20.243 -9.797 485 HB2 ALA 69 HB2 ALA 69 16.172 18.676 -9.370 486 HB3 ALA 69 HB3 ALA 69 17.055 18.869 -10.885 487 H MET 70 H MET 70 17.051 17.656 -7.248 488 HA MET 70 HA MET 70 17.061 19.783 -5.373 489 HB2 MET 70 HB2 MET 70 15.360 17.969 -5.417 490 HB3 MET 70 HB3 MET 70 16.584 16.833 -4.880 491 HG2 MET 70 HG2 MET 70 16.167 19.246 -3.219 492 HG3 MET 70 HG3 MET 70 14.890 18.034 -3.216 493 HE1 MET 70 HE1 MET 70 16.210 15.280 -3.420 494 HE2 MET 70 HE2 MET 70 15.041 15.712 -2.171 495 HE3 MET 70 HE3 MET 70 16.548 14.910 -1.729 496 H ALA 71 H ALA 71 18.921 16.784 -5.646 497 HA ALA 71 HA ALA 71 20.497 17.084 -3.351 498 HB1 ALA 71 HB1 ALA 71 21.212 15.727 -5.945 499 HB2 ALA 71 HB2 ALA 71 20.326 14.999 -4.605 500 HB3 ALA 71 HB3 ALA 71 22.010 15.479 -4.389 501 H ALA 72 H ALA 72 20.915 18.342 -6.621 502 HA ALA 72 HA ALA 72 23.556 19.292 -6.334 503 HB1 ALA 72 HB1 ALA 72 22.476 19.036 -8.507 504 HB2 ALA 72 HB2 ALA 72 23.079 20.679 -8.289 505 HB3 ALA 72 HB3 ALA 72 21.356 20.339 -8.114 506 H GLU 73 H GLU 73 20.414 20.879 -5.827 507 HA GLU 73 HA GLU 73 21.589 23.381 -5.138 508 HB2 GLU 73 HB2 GLU 73 18.788 22.355 -4.670 509 HB3 GLU 73 HB3 GLU 73 19.309 24.024 -4.442 510 HG2 GLU 73 HG2 GLU 73 20.012 24.021 -6.850 511 HG3 GLU 73 HG3 GLU 73 19.215 22.460 -7.004 512 H VAL 74 H VAL 74 20.607 20.545 -3.317 513 HA VAL 74 HA VAL 74 21.028 21.695 -0.745 514 HB VAL 74 HB VAL 74 21.210 18.804 -1.628 515 HG11 VAL 74 HG11 VAL 74 21.096 18.212 0.728 516 HG12 VAL 74 HG12 VAL 74 21.074 19.917 1.177 517 HG13 VAL 74 HG13 VAL 74 22.512 19.222 0.428 518 HG21 VAL 74 HG21 VAL 74 18.990 19.769 -1.896 519 HG22 VAL 74 HG22 VAL 74 19.020 20.339 -0.228 520 HG23 VAL 74 HG23 VAL 74 19.001 18.610 -0.569 521 H ALA 75 H ALA 75 23.105 19.979 -3.043 522 HA ALA 75 HA ALA 75 25.446 19.883 -1.526 523 HB1 ALA 75 HB1 ALA 75 25.150 18.728 -3.674 524 HB2 ALA 75 HB2 ALA 75 26.631 19.685 -3.632 525 HB3 ALA 75 HB3 ALA 75 25.218 20.282 -4.504 526 H GLU 76 H GLU 76 24.066 22.470 -3.460 527 HA GLU 76 HA GLU 76 26.185 24.285 -3.375 528 HB2 GLU 76 HB2 GLU 76 23.202 24.671 -3.540 529 HB3 GLU 76 HB3 GLU 76 24.321 26.027 -3.574 530 HG2 GLU 76 HG2 GLU 76 24.384 23.726 -5.511 531 HG3 GLU 76 HG3 GLU 76 23.586 25.270 -5.812 532 H VAL 77 H VAL 77 23.589 23.698 -1.021 533 HA VAL 77 HA VAL 77 24.354 25.891 0.646 534 HB VAL 77 HB VAL 77 22.701 25.274 2.136 535 HG11 VAL 77 HG11 VAL 77 21.786 25.665 -0.125 536 HG12 VAL 77 HG12 VAL 77 20.754 24.657 0.889 537 HG13 VAL 77 HG13 VAL 77 21.741 23.921 -0.375 538 HG21 VAL 77 HG21 VAL 77 21.821 23.004 2.453 539 HG22 VAL 77 HG22 VAL 77 23.556 23.085 2.757 540 HG23 VAL 77 HG23 VAL 77 22.956 22.400 1.246 541 H VAL 78 H VAL 78 25.319 22.569 0.338 542 HA VAL 78 HA VAL 78 26.711 22.467 2.850 543 HB VAL 78 HB VAL 78 27.003 20.655 0.442 544 HG11 VAL 78 HG11 VAL 78 28.877 20.467 1.989 545 HG12 VAL 78 HG12 VAL 78 27.869 19.023 2.045 546 HG13 VAL 78 HG13 VAL 78 27.758 20.224 3.330 547 HG21 VAL 78 HG21 VAL 78 25.477 19.151 1.623 548 HG22 VAL 78 HG22 VAL 78 24.706 20.688 1.237 549 HG23 VAL 78 HG23 VAL 78 25.257 20.364 2.880 550 H ALA 79 H ALA 79 27.419 23.485 -0.377 551 HA ALA 79 HA ALA 79 30.237 23.286 -0.300 552 HB1 ALA 79 HB1 ALA 79 30.191 24.705 -2.277 553 HB2 ALA 79 HB2 ALA 79 28.501 25.099 -1.967 554 HB3 ALA 79 HB3 ALA 79 28.960 23.447 -2.379 555 H THR 80 H THR 80 28.134 25.418 1.303 556 HA THR 80 HA THR 80 29.908 27.675 1.381 557 HB THR 80 HB THR 80 27.318 27.625 1.750 558 HG1 THR 80 HG1 THR 80 27.560 29.619 2.549 559 HG21 THR 80 HG21 THR 80 26.671 27.596 4.106 560 HG22 THR 80 HG22 THR 80 28.315 27.139 4.546 561 HG23 THR 80 HG23 THR 80 27.322 26.040 3.593 562 H SER 81 H SER 81 30.017 24.666 2.746 563 HA SER 81 HA SER 81 31.007 25.461 5.354 564 HB2 SER 81 HB2 SER 81 30.987 22.658 4.248 565 HB3 SER 81 HB3 SER 81 30.890 23.179 5.932 566 HG SER 81 HG SER 81 28.918 23.078 3.967 567 HA PRO 82 HA PRO 82 35.307 25.194 3.982 568 HB2 PRO 82 HB2 PRO 82 36.379 25.345 6.496 569 HB3 PRO 82 HB3 PRO 82 35.880 26.762 5.568 570 HG2 PRO 82 HG2 PRO 82 34.445 25.323 7.756 571 HG3 PRO 82 HG3 PRO 82 34.568 27.066 7.452 572 HD2 PRO 82 HD2 PRO 82 32.372 25.617 6.805 573 HD3 PRO 82 HD3 PRO 82 32.894 27.032 5.870 574 HA PRO 83 HA PRO 83 36.247 20.921 4.305 575 HB2 PRO 83 HB2 PRO 83 38.909 21.661 5.431 576 HB3 PRO 83 HB3 PRO 83 38.516 20.614 4.062 577 HG2 PRO 83 HG2 PRO 83 39.440 23.070 3.655 578 HG3 PRO 83 HG3 PRO 83 38.157 22.403 2.627 579 HD2 PRO 83 HD2 PRO 83 37.977 24.414 4.822 580 HD3 PRO 83 HD3 PRO 83 37.061 24.309 3.305 581 H GLN 84 H GLN 84 36.941 22.873 7.131 582 HA GLN 84 HA GLN 84 37.370 20.732 8.937 583 HB2 GLN 84 HB2 GLN 84 38.217 22.962 9.393 584 HB3 GLN 84 HB3 GLN 84 36.579 23.604 9.421 585 HG2 GLN 84 HG2 GLN 84 36.076 22.305 11.401 586 HG3 GLN 84 HG3 GLN 84 37.687 21.588 11.360 587 HE21 GLN 84 HE22 GLN 84 35.843 24.469 11.966 588 HE22 GLN 84 HE21 GLN 84 37.087 25.326 12.809 589 H SER 85 H SER 85 34.528 22.877 8.473 590 HA SER 85 HA SER 85 33.027 21.256 10.346 591 HB2 SER 85 HB2 SER 85 31.242 22.992 9.952 592 HB3 SER 85 HB3 SER 85 32.763 23.620 10.588 593 HG SER 85 HG SER 85 31.532 24.482 8.489 594 H TYR 86 H TYR 86 33.626 21.138 7.090 595 HA TYR 86 HA TYR 86 31.213 20.698 5.838 596 HB2 TYR 86 HB2 TYR 86 33.324 20.808 4.618 597 HB3 TYR 86 HB3 TYR 86 33.846 19.290 5.337 598 HD1 TYR 86 HD2 TYR 86 32.852 17.170 4.627 599 HD2 TYR 86 HD1 TYR 86 31.735 20.847 2.804 600 HE1 TYR 86 HE2 TYR 86 31.829 15.930 2.763 601 HE2 TYR 86 HE1 TYR 86 30.703 19.620 0.942 602 HH TYR 86 HH TYR 86 30.693 17.516 -0.113 603 H SER 87 H SER 87 33.208 18.337 7.588 604 HA SER 87 HA SER 87 31.698 16.067 6.997 605 HB2 SER 87 HB2 SER 87 33.286 16.595 9.522 606 HB3 SER 87 HB3 SER 87 32.851 15.015 8.864 607 HG SER 87 HG SER 87 35.050 16.013 8.402 608 H ALA 88 H ALA 88 31.320 18.461 9.542 609 HA ALA 88 HA ALA 88 29.373 16.956 11.004 610 HB1 ALA 88 HB1 ALA 88 29.060 18.993 12.302 611 HB2 ALA 88 HB2 ALA 88 29.982 19.911 11.110 612 HB3 ALA 88 HB3 ALA 88 30.778 18.664 12.072 613 H VAL 89 H VAL 89 29.313 19.380 8.490 614 HA VAL 89 HA VAL 89 26.510 19.857 8.520 615 HB VAL 89 HB VAL 89 28.537 20.213 6.302 616 HG11 VAL 89 HG11 VAL 89 26.884 21.720 5.277 617 HG12 VAL 89 HG12 VAL 89 25.716 21.266 6.517 618 HG13 VAL 89 HG13 VAL 89 26.297 20.061 5.371 619 HG21 VAL 89 HG21 VAL 89 29.035 21.563 8.257 620 HG22 VAL 89 HG22 VAL 89 27.382 22.179 8.281 621 HG23 VAL 89 HG23 VAL 89 28.457 22.588 6.943 622 H LEU 90 H LEU 90 28.620 17.798 6.571 623 HA LEU 90 HA LEU 90 26.741 16.758 4.821 624 HB2 LEU 90 HB2 LEU 90 29.347 16.610 4.977 625 HB3 LEU 90 HB3 LEU 90 29.024 15.126 5.847 626 HG LEU 90 HG LEU 90 29.533 14.827 3.436 627 HD11 LEU 90 HD11 LEU 90 26.805 13.924 4.340 628 HD12 LEU 90 HD12 LEU 90 28.335 13.094 4.623 629 HD13 LEU 90 HD13 LEU 90 27.705 13.248 2.984 630 HD21 LEU 90 HD21 LEU 90 26.855 16.142 3.015 631 HD22 LEU 90 HD22 LEU 90 27.856 15.395 1.775 632 HD23 LEU 90 HD23 LEU 90 28.421 16.842 2.606 633 H ASN 91 H ASN 91 27.872 15.415 7.927 634 HA ASN 91 HA ASN 91 26.287 13.093 7.817 635 HB2 ASN 91 HB2 ASN 91 27.630 14.538 10.082 636 HB3 ASN 91 HB3 ASN 91 26.595 13.145 10.389 637 HD21 ASN 91 HD22 ASN 91 29.614 14.246 9.116 638 HD22 ASN 91 HD21 ASN 91 30.320 12.683 8.886 639 H THR 92 H THR 92 25.563 16.335 8.915 640 HA THR 92 HA THR 92 23.143 15.699 10.255 641 HB THR 92 HB THR 92 24.013 18.309 8.989 642 HG1 THR 92 HG1 THR 92 25.435 18.027 10.594 643 HG21 THR 92 HG21 THR 92 22.386 19.361 10.486 644 HG22 THR 92 HG22 THR 92 21.882 17.776 11.068 645 HG23 THR 92 HG23 THR 92 21.588 18.233 9.390 646 H ILE 93 H ILE 93 23.910 16.708 6.942 647 HA ILE 93 HA ILE 93 21.311 16.904 5.931 648 HB ILE 93 HB ILE 93 23.801 15.986 4.483 649 HG12 ILE 93 HG12 ILE 93 24.100 18.193 5.485 650 HG13 ILE 93 HG13 ILE 93 23.957 18.335 3.736 651 HG21 ILE 93 HG21 ILE 93 21.769 15.404 3.258 652 HG22 ILE 93 HG22 ILE 93 22.662 16.683 2.437 653 HG23 ILE 93 HG23 ILE 93 21.218 17.074 3.369 654 HD11 ILE 93 HD11 ILE 93 21.808 18.926 5.757 655 HD12 ILE 93 HD12 ILE 93 21.610 19.007 4.008 656 HD13 ILE 93 HD13 ILE 93 22.730 20.100 4.817 657 H GLY 94 H GLY 94 23.520 14.120 6.000 658 HA2 GLY 94 HA2 GLY 94 21.774 12.319 4.709 659 HA3 GLY 94 HA3 GLY 94 23.159 11.875 5.690 660 H ALA 95 H ALA 95 21.880 13.405 7.976 661 HA ALA 95 HA ALA 95 20.396 11.170 9.021 662 HB1 ALA 95 HB1 ALA 95 21.967 12.446 10.426 663 HB2 ALA 95 HB2 ALA 95 20.337 12.413 11.098 664 HB3 ALA 95 HB3 ALA 95 20.923 13.861 10.279 665 H CYS 96 H CYS 96 19.693 14.592 8.381 666 HA CYS 96 HA CYS 96 16.982 14.473 9.120 667 HB2 CYS 96 HB2 CYS 96 18.434 16.404 7.314 668 HB3 CYS 96 HB3 CYS 96 16.797 16.644 7.915 669 H LEU 97 H LEU 97 18.575 14.065 5.994 670 HA LEU 97 HA LEU 97 16.226 14.073 4.418 671 HB2 LEU 97 HB2 LEU 97 18.660 14.362 3.690 672 HB3 LEU 97 HB3 LEU 97 18.794 12.620 3.778 673 HG LEU 97 HG LEU 97 18.409 13.673 1.481 674 HD11 LEU 97 HD11 LEU 97 18.205 11.289 1.868 675 HD12 LEU 97 HD12 LEU 97 16.975 11.848 0.736 676 HD13 LEU 97 HD13 LEU 97 16.539 11.504 2.410 677 HD21 LEU 97 HD21 LEU 97 16.644 15.230 2.153 678 HD22 LEU 97 HD22 LEU 97 15.585 13.871 2.519 679 HD23 LEU 97 HD23 LEU 97 16.113 14.155 0.862 680 H ARG 98 H ARG 98 17.823 11.657 6.322 681 HA ARG 98 HA ARG 98 16.555 9.400 5.145 682 HB2 ARG 98 HB2 ARG 98 18.428 8.668 6.187 683 HB3 ARG 98 HB3 ARG 98 18.365 9.925 7.412 684 HG2 ARG 98 HG2 ARG 98 16.364 7.733 7.559 685 HG3 ARG 98 HG3 ARG 98 18.034 7.375 8.000 686 HD2 ARG 98 HD2 ARG 98 18.035 8.996 9.715 687 HD3 ARG 98 HD3 ARG 98 16.545 9.729 9.123 688 HE ARG 98 HE ARG 98 16.045 7.055 9.826 689 HH11 ARG 98 HH11 ARG 98 16.870 10.102 11.357 690 HH12 ARG 98 HH12 ARG 98 15.995 9.750 12.813 691 HH21 ARG 98 HH21 ARG 98 14.877 6.604 11.742 692 HH22 ARG 98 HH22 ARG 98 14.854 7.768 13.027 693 H GLU 99 H GLU 99 15.745 11.507 7.874 694 HA GLU 99 HA GLU 99 13.690 9.687 8.770 695 HB2 GLU 99 HB2 GLU 99 13.198 11.473 10.447 696 HB3 GLU 99 HB3 GLU 99 14.832 10.844 10.489 697 HG2 GLU 99 HG2 GLU 99 15.620 12.818 9.292 698 HG3 GLU 99 HG3 GLU 99 13.973 13.445 9.253 699 H SER 100 H SER 100 13.836 12.744 7.045 700 HA SER 100 HA SER 100 11.122 13.414 7.237 701 HB2 SER 100 HB2 SER 100 11.619 14.842 5.230 702 HB3 SER 100 HB3 SER 100 12.717 15.068 6.589 703 HG SER 100 HG SER 100 13.364 14.537 4.153 704 H MET 101 H MET 101 12.835 11.293 5.056 705 HA MET 101 HA MET 101 10.975 11.035 3.014 706 HB2 MET 101 HB2 MET 101 13.056 9.210 4.146 707 HB3 MET 101 HB3 MET 101 11.960 8.615 2.908 708 HG2 MET 101 HG2 MET 101 13.588 11.111 2.564 709 HG3 MET 101 HG3 MET 101 14.185 9.512 2.120 710 HE1 MET 101 HE1 MET 101 13.340 8.099 0.121 711 HE2 MET 101 HE2 MET 101 11.854 8.440 -0.771 712 HE3 MET 101 HE3 MET 101 11.777 7.986 0.931 713 H MET 102 H MET 102 11.198 9.126 6.035 714 HA MET 102 HA MET 102 8.782 7.721 5.341 715 HB2 MET 102 HB2 MET 102 8.969 6.589 7.478 716 HB3 MET 102 HB3 MET 102 10.483 6.532 6.593 717 HG2 MET 102 HG2 MET 102 11.547 7.961 8.058 718 HG3 MET 102 HG3 MET 102 10.032 8.640 8.657 719 HE1 MET 102 HE1 MET 102 10.154 4.926 8.016 720 HE2 MET 102 HE2 MET 102 10.770 4.199 9.506 721 HE3 MET 102 HE3 MET 102 11.869 5.059 8.423 722 H GLN 103 H GLN 103 9.658 10.475 7.284 723 HA GLN 103 HA GLN 103 7.278 10.746 8.754 724 HB2 GLN 103 HB2 GLN 103 9.546 12.453 8.081 725 HB3 GLN 103 HB3 GLN 103 8.041 13.349 8.211 726 HG2 GLN 103 HG2 GLN 103 9.257 13.285 10.327 727 HG3 GLN 103 HG3 GLN 103 7.681 12.508 10.444 728 HE21 GLN 103 HE22 GLN 103 11.109 12.058 10.552 729 HE22 GLN 103 HE21 GLN 103 11.086 10.424 11.105 730 H ALA 104 H ALA 104 8.050 11.489 5.437 731 HA ALA 104 HA ALA 104 5.701 12.967 4.854 732 HB1 ALA 104 HB1 ALA 104 7.476 11.348 3.026 733 HB2 ALA 104 HB2 ALA 104 7.658 13.062 3.408 734 HB3 ALA 104 HB3 ALA 104 6.250 12.504 2.505 735 H THR 105 H THR 105 6.561 9.698 3.779 736 HA THR 105 HA THR 105 4.492 8.201 4.688 737 HB THR 105 HB THR 105 2.886 9.741 3.647 738 HG1 THR 105 HG1 THR 105 1.890 7.864 3.518 739 HG21 THR 105 HG21 THR 105 2.735 9.929 1.206 740 HG22 THR 105 HG22 THR 105 4.209 8.975 1.045 741 HG23 THR 105 HG23 THR 105 4.266 10.562 1.812 742 H GLY 106 H GLY 106 6.683 8.988 2.142 743 HA2 GLY 106 HA2 GLY 106 6.381 6.566 0.642 744 HA3 GLY 106 HA3 GLY 106 7.631 7.781 0.427 745 H SER 107 H SER 107 7.620 6.897 3.646 746 HA SER 107 HA SER 107 9.081 5.788 4.946 747 HB2 SER 107 HB2 SER 107 9.192 3.858 2.624 748 HB3 SER 107 HB3 SER 107 9.742 3.528 4.266 749 HG SER 107 HG SER 107 7.142 3.769 3.254 750 H VAL 108 H VAL 108 11.456 4.911 4.930 751 HA VAL 108 HA VAL 108 12.965 6.745 3.234 752 HB VAL 108 HB VAL 108 13.485 7.298 5.418 753 HG11 VAL 108 HG11 VAL 108 13.663 4.371 6.079 754 HG12 VAL 108 HG12 VAL 108 12.386 5.498 6.556 755 HG13 VAL 108 HG13 VAL 108 14.024 5.693 7.193 756 HG21 VAL 108 HG21 VAL 108 15.615 5.309 4.643 757 HG22 VAL 108 HG22 VAL 108 15.801 6.625 5.801 758 HG23 VAL 108 HG23 VAL 108 15.515 6.983 4.098 759 H ASP 109 H ASP 109 13.351 5.705 1.431 760 HA ASP 109 HA ASP 109 14.276 2.989 1.335 761 HB2 ASP 109 HB2 ASP 109 13.010 3.672 -0.548 762 HB3 ASP 109 HB3 ASP 109 13.951 5.147 -0.745 763 H ASN 110 H ASN 110 16.324 2.305 0.597 764 HA ASN 110 HA ASN 110 18.440 3.895 1.764 765 HB2 ASN 110 HB2 ASN 110 18.299 1.103 0.650 766 HB3 ASN 110 HB3 ASN 110 19.830 1.841 1.104 767 HD21 ASN 110 HD22 ASN 110 16.869 2.492 2.832 768 HD22 ASN 110 HD21 ASN 110 17.301 1.639 4.270 769 H ALA 111 H ALA 111 17.412 2.869 -1.436 770 HA ALA 111 HA ALA 111 19.829 3.549 -2.774 771 HB1 ALA 111 HB1 ALA 111 18.210 2.000 -3.749 772 HB2 ALA 111 HB2 ALA 111 18.518 3.359 -4.832 773 HB3 ALA 111 HB3 ALA 111 17.033 3.306 -3.883 774 H PHE 112 H PHE 112 16.696 5.213 -2.465 775 HA PHE 112 HA PHE 112 17.304 7.554 -3.831 776 HB2 PHE 112 HB2 PHE 112 15.052 7.015 -3.028 777 HB3 PHE 112 HB3 PHE 112 15.578 7.237 -1.364 778 HD1 PHE 112 HD2 PHE 112 14.828 8.940 -4.531 779 HD2 PHE 112 HD1 PHE 112 15.790 9.432 -0.414 780 HE1 PHE 112 HE2 PHE 112 14.214 11.318 -4.674 781 HE2 PHE 112 HE1 PHE 112 15.173 11.810 -0.550 782 HZ PHE 112 HZ PHE 112 14.386 12.758 -2.683 783 H THR 113 H THR 113 17.538 7.070 -0.298 784 HA THR 113 HA THR 113 18.718 9.502 0.312 785 HB THR 113 HB THR 113 19.684 8.278 2.333 786 HG1 THR 113 HG1 THR 113 18.009 6.128 1.646 787 HG21 THR 113 HG21 THR 113 17.546 9.451 2.428 788 HG22 THR 113 HG22 THR 113 17.482 7.963 3.373 789 HG23 THR 113 HG23 THR 113 16.726 8.030 1.780 790 H ASN 114 H ASN 114 20.305 6.406 -0.403 791 HA ASN 114 HA ASN 114 22.962 7.198 -0.090 792 HB2 ASN 114 HB2 ASN 114 22.454 4.880 -0.293 793 HB3 ASN 114 HB3 ASN 114 21.649 5.112 -1.837 794 HD21 ASN 114 HD22 ASN 114 22.864 3.625 -2.915 795 HD22 ASN 114 HD21 ASN 114 24.538 3.840 -3.273 796 H GLU 115 H GLU 115 20.991 7.236 -3.096 797 HA GLU 115 HA GLU 115 23.071 8.156 -4.711 798 HB2 GLU 115 HB2 GLU 115 21.172 7.002 -5.634 799 HB3 GLU 115 HB3 GLU 115 20.071 8.236 -5.029 800 HG2 GLU 115 HG2 GLU 115 20.805 9.801 -6.545 801 HG3 GLU 115 HG3 GLU 115 22.273 8.903 -6.897 802 H VAL 116 H VAL 116 20.408 9.836 -3.049 803 HA VAL 116 HA VAL 116 21.037 12.434 -3.906 804 HB VAL 116 HB VAL 116 19.790 11.527 -1.300 805 HG11 VAL 116 HG11 VAL 116 18.992 13.831 -1.054 806 HG12 VAL 116 HG12 VAL 116 19.909 14.303 -2.483 807 HG13 VAL 116 HG13 VAL 116 20.754 13.759 -1.034 808 HG21 VAL 116 HG21 VAL 116 18.521 10.945 -3.314 809 HG22 VAL 116 HG22 VAL 116 18.559 12.633 -3.826 810 HG23 VAL 116 HG23 VAL 116 17.688 12.175 -2.361 811 H MET 117 H MET 117 22.091 10.680 -0.989 812 HA MET 117 HA MET 117 23.792 12.618 0.067 813 HB2 MET 117 HB2 MET 117 23.890 9.608 0.193 814 HB3 MET 117 HB3 MET 117 25.001 10.623 1.091 815 HG2 MET 117 HG2 MET 117 22.049 10.305 1.425 816 HG3 MET 117 HG3 MET 117 23.329 10.122 2.622 817 HE1 MET 117 HE1 MET 117 25.071 12.772 2.048 818 HE2 MET 117 HE2 MET 117 24.676 12.185 3.664 819 HE3 MET 117 HE3 MET 117 24.364 13.867 3.239 820 H GLN 118 H GLN 118 24.531 9.990 -2.191 821 HA GLN 118 HA GLN 118 27.241 10.459 -2.560 822 HB2 GLN 118 HB2 GLN 118 26.013 8.525 -3.480 823 HB3 GLN 118 HB3 GLN 118 25.211 9.587 -4.628 824 HG2 GLN 118 HG2 GLN 118 27.528 10.175 -5.475 825 HG3 GLN 118 HG3 GLN 118 28.104 8.805 -4.526 826 HE21 GLN 118 HE22 GLN 118 27.461 6.706 -5.116 827 HE22 GLN 118 HE21 GLN 118 26.859 6.366 -6.703 828 H LEU 119 H LEU 119 24.484 11.822 -4.326 829 HA LEU 119 HA LEU 119 26.010 13.425 -6.068 830 HB2 LEU 119 HB2 LEU 119 23.136 13.499 -5.202 831 HB3 LEU 119 HB3 LEU 119 23.791 14.660 -6.342 832 HG LEU 119 HG LEU 119 24.083 11.720 -6.855 833 HD11 LEU 119 HD11 LEU 119 21.697 13.433 -7.550 834 HD12 LEU 119 HD12 LEU 119 21.706 12.065 -6.437 835 HD13 LEU 119 HD13 LEU 119 22.001 11.805 -8.156 836 HD21 LEU 119 HD21 LEU 119 24.167 12.452 -9.166 837 HD22 LEU 119 HD22 LEU 119 25.362 13.325 -8.206 838 HD23 LEU 119 HD23 LEU 119 23.855 14.114 -8.674 839 H VAL 120 H VAL 120 24.406 14.188 -2.977 840 HA VAL 120 HA VAL 120 24.959 16.926 -2.929 841 HB VAL 120 HB VAL 120 24.765 14.990 -0.611 842 HG11 VAL 120 HG11 VAL 120 24.727 18.009 -0.577 843 HG12 VAL 120 HG12 VAL 120 25.990 16.976 0.093 844 HG13 VAL 120 HG13 VAL 120 24.373 16.965 0.799 845 HG21 VAL 120 HG21 VAL 120 22.503 15.908 -0.368 846 HG22 VAL 120 HG22 VAL 120 22.732 15.156 -1.946 847 HG23 VAL 120 HG23 VAL 120 22.759 16.912 -1.796 848 H LYS 121 H LYS 121 26.933 14.203 -1.856 849 HA LYS 121 HA LYS 121 29.064 15.793 -0.840 850 HB2 LYS 121 HB2 LYS 121 28.941 12.894 -1.686 851 HB3 LYS 121 HB3 LYS 121 30.293 13.624 -0.829 852 HG2 LYS 121 HG2 LYS 121 29.089 13.872 1.129 853 HG3 LYS 121 HG3 LYS 121 27.534 13.792 0.301 854 HD2 LYS 121 HD2 LYS 121 27.902 11.759 1.564 855 HD3 LYS 121 HD3 LYS 121 27.929 11.405 -0.163 856 HE2 LYS 121 HE2 LYS 121 30.364 11.371 -0.133 857 HE3 LYS 121 HE3 LYS 121 30.362 11.791 1.580 858 HZ1 LYS 121 HZ1 LYS 121 29.123 9.336 0.473 859 HZ2 LYS 121 HZ2 LYS 121 29.339 9.714 2.104 860 HZ3 LYS 121 HZ3 LYS 121 30.682 9.393 1.122 861 H MET 122 H MET 122 28.484 14.130 -3.902 862 HA MET 122 HA MET 122 31.081 14.666 -4.958 863 HB2 MET 122 HB2 MET 122 29.855 12.721 -5.691 864 HB3 MET 122 HB3 MET 122 28.519 13.716 -6.246 865 HG2 MET 122 HG2 MET 122 29.921 14.657 -7.988 866 HG3 MET 122 HG3 MET 122 31.290 13.707 -7.413 867 HE1 MET 122 HE1 MET 122 27.540 12.433 -7.557 868 HE2 MET 122 HE2 MET 122 27.468 11.826 -9.212 869 HE3 MET 122 HE3 MET 122 27.668 13.551 -8.916 870 H LEU 123 H LEU 123 28.053 16.367 -4.981 871 HA LEU 123 HA LEU 123 28.975 18.137 -7.112 872 HB2 LEU 123 HB2 LEU 123 26.325 17.981 -5.682 873 HB3 LEU 123 HB3 LEU 123 26.699 19.119 -6.962 874 HG LEU 123 HG LEU 123 26.694 16.114 -7.284 875 HD11 LEU 123 HD11 LEU 123 24.659 18.167 -8.140 876 HD12 LEU 123 HD12 LEU 123 24.452 16.973 -6.860 877 HD13 LEU 123 HD13 LEU 123 24.624 16.449 -8.535 878 HD21 LEU 123 HD21 LEU 123 26.913 18.338 -9.312 879 HD22 LEU 123 HD22 LEU 123 26.804 16.615 -9.675 880 HD23 LEU 123 HD23 LEU 123 28.212 17.250 -8.822 881 H SER 124 H SER 124 29.750 17.991 -4.053 882 HA SER 124 HA SER 124 29.605 20.913 -3.718 883 HB2 SER 124 HB2 SER 124 29.942 20.437 -1.247 884 HB3 SER 124 HB3 SER 124 28.383 19.944 -1.910 885 HG SER 124 HG SER 124 28.887 17.899 -1.648 886 H ALA 125 H ALA 125 31.595 18.168 -2.599 887 HA ALA 125 HA ALA 125 33.971 19.567 -3.573 888 HB1 ALA 125 HB1 ALA 125 35.162 19.239 -1.484 889 HB2 ALA 125 HB2 ALA 125 33.714 18.543 -0.753 890 HB3 ALA 125 HB3 ALA 125 33.729 20.239 -1.237 891 H ASP 126 H ASP 126 34.597 18.125 -5.022 892 HA ASP 126 HA ASP 126 34.399 15.284 -4.546 893 HB2 ASP 126 HB2 ASP 126 33.938 16.219 -6.776 894 HB3 ASP 126 HB3 ASP 126 35.593 16.804 -6.878 895 H SER 127 H SER 127 35.844 15.971 -2.579 896 HA SER 127 HA SER 127 38.411 14.776 -3.044 897 HB2 SER 127 HB2 SER 127 38.281 17.628 -2.037 898 HB3 SER 127 HB3 SER 127 39.731 16.629 -2.065 899 HG SER 127 HG SER 127 38.545 16.685 -4.500 900 H ALA 128 H ALA 128 35.911 15.923 -1.032 901 HA ALA 128 HA ALA 128 37.237 15.524 1.465 902 HB1 ALA 128 HB1 ALA 128 34.297 15.862 0.892 903 HB2 ALA 128 HB2 ALA 128 35.444 17.164 1.220 904 HB3 ALA 128 HB3 ALA 128 35.071 15.977 2.472 905 H ASN 129 H ASN 129 37.963 13.458 1.625 906 HA ASN 129 HA ASN 129 37.841 11.419 2.632 907 HB2 ASN 129 HB2 ASN 129 35.853 12.343 3.843 908 HB3 ASN 129 HB3 ASN 129 34.829 11.685 2.575 909 HD21 ASN 129 HD22 ASN 129 36.987 10.896 5.215 910 HD22 ASN 129 HD21 ASN 129 36.441 9.271 5.430 911 H GLU 130 H GLU 130 36.727 12.185 -0.347 912 HA GLU 130 HA GLU 130 35.783 9.721 -1.328 913 HB2 GLU 130 HB2 GLU 130 36.233 12.234 -2.403 914 HB3 GLU 130 HB3 GLU 130 37.406 11.226 -3.239 915 HG2 GLU 130 HG2 GLU 130 34.430 10.783 -3.115 916 HG3 GLU 130 HG3 GLU 130 35.352 11.361 -4.501 917 H VAL 131 H VAL 131 36.799 7.974 -2.157 918 HA VAL 131 HA VAL 131 38.313 6.304 -2.229 919 HB VAL 131 HB VAL 131 39.094 7.924 -4.078 920 HG11 VAL 131 HG11 VAL 131 41.401 8.256 -2.169 921 HG12 VAL 131 HG12 VAL 131 40.315 9.524 -2.743 922 HG13 VAL 131 HG13 VAL 131 41.408 8.717 -3.871 923 HG21 VAL 131 HG21 VAL 131 40.987 6.459 -4.632 924 HG22 VAL 131 HG22 VAL 131 39.572 5.560 -4.090 925 HG23 VAL 131 HG23 VAL 131 40.933 5.797 -2.997 926 H SER 132 H SER 132 38.209 8.049 0.299 927 HA SER 132 HA SER 132 40.816 7.372 1.434 928 HB2 SER 132 HB2 SER 132 38.518 8.883 2.704 929 HB3 SER 132 HB3 SER 132 40.160 8.742 3.335 930 HG SER 132 HG SER 132 39.827 9.740 0.743 931 H THR 133 H THR 133 40.740 5.185 1.682 932 HA THR 133 HA THR 133 38.559 4.015 3.232 933 HB THR 133 HB THR 133 39.679 1.840 2.677 934 HG1 THR 133 HG1 THR 133 41.780 2.946 2.310 935 HG21 THR 133 HG21 THR 133 37.844 2.676 1.297 936 HG22 THR 133 HG22 THR 133 39.039 1.848 0.301 937 HG23 THR 133 HG23 THR 133 38.980 3.610 0.327 Start of MODEL 14 1 HA2 GLY 1 HA2 GLY 1 14.460 -4.839 -2.104 2 HA3 GLY 1 HA3 GLY 1 14.140 -6.488 -2.626 3 H SER 2 H SER 2 13.038 -3.540 -3.061 4 HA SER 2 HA SER 2 10.265 -4.428 -3.348 5 HB2 SER 2 HB2 SER 2 11.036 -1.755 -2.145 6 HB3 SER 2 HB3 SER 2 9.399 -2.358 -2.400 7 HG SER 2 HG SER 2 9.772 -3.951 -0.865 8 H GLY 3 H GLY 3 10.021 -4.366 -5.493 9 HA2 GLY 3 HA2 GLY 3 11.416 -2.407 -7.107 10 HA3 GLY 3 HA3 GLY 3 10.383 -3.706 -7.693 11 H ASN 4 H ASN 4 10.078 -0.749 -5.738 12 HA ASN 4 HA ASN 4 7.488 -0.227 -7.007 13 HB2 ASN 4 HB2 ASN 4 7.455 -0.119 -4.589 14 HB3 ASN 4 HB3 ASN 4 8.826 0.986 -4.577 15 HD21 ASN 4 HD22 ASN 4 7.703 2.549 -3.456 16 HD22 ASN 4 HD21 ASN 4 6.462 3.503 -4.188 17 H SER 5 H SER 5 7.282 1.297 -8.532 18 HA SER 5 HA SER 5 9.655 2.869 -9.187 19 HB2 SER 5 HB2 SER 5 8.364 3.300 -11.344 20 HB3 SER 5 HB3 SER 5 8.858 1.633 -11.053 21 HG SER 5 HG SER 5 6.827 1.053 -10.806 22 H GLN 6 H GLN 6 7.123 3.322 -7.258 23 HA GLN 6 HA GLN 6 6.781 6.140 -7.966 24 HB2 GLN 6 HB2 GLN 6 5.156 4.297 -6.222 25 HB3 GLN 6 HB3 GLN 6 4.959 6.038 -6.163 26 HG2 GLN 6 HG2 GLN 6 3.245 5.155 -7.544 27 HG3 GLN 6 HG3 GLN 6 4.389 5.991 -8.589 28 HE21 GLN 6 HE22 GLN 6 5.518 4.844 -10.102 29 HE22 GLN 6 HE21 GLN 6 5.248 3.170 -10.439 30 HA PRO 7 HA PRO 7 9.570 6.240 -4.363 31 HB2 PRO 7 HB2 PRO 7 11.527 7.741 -5.448 32 HB3 PRO 7 HB3 PRO 7 11.362 6.016 -5.786 33 HG2 PRO 7 HG2 PRO 7 10.840 8.315 -7.535 34 HG3 PRO 7 HG3 PRO 7 11.120 6.620 -7.960 35 HD2 PRO 7 HD2 PRO 7 8.602 8.036 -7.734 36 HD3 PRO 7 HD3 PRO 7 8.894 6.377 -8.290 37 H ILE 8 H ILE 8 7.529 7.622 -3.831 38 HA ILE 8 HA ILE 8 6.789 9.267 -2.516 39 HB ILE 8 HB ILE 8 9.166 9.080 -1.544 40 HG12 ILE 8 HG12 ILE 8 7.748 11.712 -1.135 41 HG13 ILE 8 HG13 ILE 8 7.110 10.183 -0.532 42 HG21 ILE 8 HG21 ILE 8 9.398 11.766 -2.899 43 HG22 ILE 8 HG22 ILE 8 10.359 10.334 -3.260 44 HG23 ILE 8 HG23 ILE 8 10.509 11.123 -1.692 45 HD11 ILE 8 HD11 ILE 8 9.809 11.289 0.178 46 HD12 ILE 8 HD12 ILE 8 9.004 9.891 0.890 47 HD13 ILE 8 HD13 ILE 8 8.353 11.510 1.142 48 H TRP 9 H TRP 9 8.372 10.168 -5.453 49 HA TRP 9 HA TRP 9 7.277 12.848 -5.458 50 HB2 TRP 9 HB2 TRP 9 8.474 11.249 -7.736 51 HB3 TRP 9 HB3 TRP 9 8.112 12.970 -7.764 52 HD1 TRP 9 HD1 TRP 9 10.774 10.530 -6.813 53 HE1 TRP 9 HE1 TRP 9 12.789 11.771 -5.795 54 HE3 TRP 9 HE3 TRP 9 8.667 15.146 -6.236 55 HZ2 TRP 9 HZ2 TRP 9 13.402 14.378 -4.888 56 HZ3 TRP 9 HZ3 TRP 9 10.034 16.961 -5.293 57 HH2 TRP 9 HH2 TRP 9 12.352 16.583 -4.631 58 H THR 10 H THR 10 5.684 10.219 -5.313 59 HA THR 10 HA THR 10 4.125 9.914 -7.608 60 HB THR 10 HB THR 10 3.077 9.428 -4.829 61 HG1 THR 10 HG1 THR 10 4.210 7.320 -5.151 62 HG21 THR 10 HG21 THR 10 1.589 8.980 -6.740 63 HG22 THR 10 HG22 THR 10 2.028 7.495 -5.897 64 HG23 THR 10 HG23 THR 10 2.805 7.904 -7.425 65 H ASN 11 H ASN 11 3.684 11.959 -4.749 66 HA ASN 11 HA ASN 11 1.834 13.596 -6.254 67 HB2 ASN 11 HB2 ASN 11 0.144 13.597 -4.535 68 HB3 ASN 11 HB3 ASN 11 0.436 11.944 -5.036 69 HD21 ASN 11 HD22 ASN 11 0.449 14.181 -2.467 70 HD22 ASN 11 HD21 ASN 11 0.946 13.086 -1.219 71 HA PRO 12 HA PRO 12 4.098 17.050 -4.810 72 HB2 PRO 12 HB2 PRO 12 1.368 18.055 -4.103 73 HB3 PRO 12 HB3 PRO 12 2.682 18.878 -4.951 74 HG2 PRO 12 HG2 PRO 12 0.612 17.825 -6.280 75 HG3 PRO 12 HG3 PRO 12 2.254 17.803 -6.946 76 HD2 PRO 12 HD2 PRO 12 0.632 15.578 -5.876 77 HD3 PRO 12 HD3 PRO 12 1.998 15.542 -7.002 78 H ASN 13 H ASN 13 1.323 16.272 -2.699 79 HA ASN 13 HA ASN 13 2.297 17.603 -0.433 80 HB2 ASN 13 HB2 ASN 13 -0.064 16.890 -0.761 81 HB3 ASN 13 HB3 ASN 13 0.432 15.222 -0.491 82 HD21 ASN 13 HD22 ASN 13 0.919 14.543 1.587 83 HD22 ASN 13 HD21 ASN 13 0.555 15.492 2.987 84 H ALA 14 H ALA 14 2.823 14.327 -1.576 85 HA ALA 14 HA ALA 14 3.858 13.285 0.853 86 HB1 ALA 14 HB1 ALA 14 4.298 12.327 -1.970 87 HB2 ALA 14 HB2 ALA 14 2.942 11.877 -0.936 88 HB3 ALA 14 HB3 ALA 14 4.585 11.399 -0.497 89 H ALA 15 H ALA 15 5.382 14.522 -2.083 90 HA ALA 15 HA ALA 15 8.040 14.016 -1.170 91 HB1 ALA 15 HB1 ALA 15 7.463 13.978 -3.540 92 HB2 ALA 15 HB2 ALA 15 8.734 15.154 -3.208 93 HB3 ALA 15 HB3 ALA 15 7.077 15.696 -3.477 94 H MET 16 H MET 16 6.008 16.917 -1.410 95 HA MET 16 HA MET 16 8.006 18.755 -0.735 96 HB2 MET 16 HB2 MET 16 5.160 18.779 -1.104 97 HB3 MET 16 HB3 MET 16 5.593 19.749 0.300 98 HG2 MET 16 HG2 MET 16 6.665 20.062 -2.491 99 HG3 MET 16 HG3 MET 16 5.470 21.082 -1.712 100 HE1 MET 16 HE1 MET 16 9.954 21.467 -1.590 101 HE2 MET 16 HE2 MET 16 8.916 20.595 -2.721 102 HE3 MET 16 HE3 MET 16 9.363 19.864 -1.187 103 H THR 17 H THR 17 6.059 16.646 1.211 104 HA THR 17 HA THR 17 6.374 17.857 3.705 105 HB THR 17 HB THR 17 6.031 14.949 2.959 106 HG1 THR 17 HG1 THR 17 4.160 15.943 2.508 107 HG21 THR 17 HG21 THR 17 5.872 16.255 5.686 108 HG22 THR 17 HG22 THR 17 7.040 15.036 5.173 109 HG23 THR 17 HG23 THR 17 5.332 14.618 5.320 110 H MET 18 H MET 18 8.403 15.343 2.147 111 HA MET 18 HA MET 18 10.192 15.278 4.360 112 HB2 MET 18 HB2 MET 18 11.671 13.919 2.884 113 HB3 MET 18 HB3 MET 18 10.045 13.288 3.070 114 HG2 MET 18 HG2 MET 18 10.579 12.973 0.831 115 HG3 MET 18 HG3 MET 18 9.520 14.380 0.850 116 HE1 MET 18 HE1 MET 18 10.408 14.560 -1.696 117 HE2 MET 18 HE2 MET 18 11.646 13.317 -1.496 118 HE3 MET 18 HE3 MET 18 12.087 14.906 -2.122 119 H THR 19 H THR 19 10.027 17.183 1.458 120 HA THR 19 HA THR 19 12.684 18.171 1.545 121 HB THR 19 HB THR 19 10.301 19.689 0.503 122 HG1 THR 19 HG1 THR 19 11.278 17.263 -0.292 123 HG21 THR 19 HG21 THR 19 12.460 20.865 0.539 124 HG22 THR 19 HG22 THR 19 11.909 20.560 -1.108 125 HG23 THR 19 HG23 THR 19 13.179 19.558 -0.403 126 H ASN 20 H ASN 20 9.607 19.376 2.889 127 HA ASN 20 HA ASN 20 10.719 21.733 4.014 128 HB2 ASN 20 HB2 ASN 20 8.139 20.250 4.392 129 HB3 ASN 20 HB3 ASN 20 8.562 21.562 5.482 130 HD21 ASN 20 HD22 ASN 20 7.675 20.694 2.249 131 HD22 ASN 20 HD21 ASN 20 7.356 22.299 1.690 132 H ASN 21 H ASN 21 10.057 18.505 5.309 133 HA ASN 21 HA ASN 21 10.781 19.047 7.963 134 HB2 ASN 21 HB2 ASN 21 10.764 16.503 6.344 135 HB3 ASN 21 HB3 ASN 21 11.195 16.532 8.048 136 HD21 ASN 21 HD22 ASN 21 9.427 15.182 8.484 137 HD22 ASN 21 HD21 ASN 21 7.815 15.799 8.531 138 H LEU 22 H LEU 22 12.686 18.323 5.132 139 HA LEU 22 HA LEU 22 15.138 17.733 6.392 140 HB2 LEU 22 HB2 LEU 22 14.780 17.284 4.035 141 HB3 LEU 22 HB3 LEU 22 14.537 18.988 3.711 142 HG LEU 22 HG LEU 22 16.913 19.389 4.398 143 HD11 LEU 22 HD11 LEU 22 18.422 17.436 4.405 144 HD12 LEU 22 HD12 LEU 22 17.014 16.376 4.374 145 HD13 LEU 22 HD13 LEU 22 17.290 17.433 5.758 146 HD21 LEU 22 HD21 LEU 22 16.425 17.520 2.083 147 HD22 LEU 22 HD22 LEU 22 17.865 18.512 2.307 148 HD23 LEU 22 HD23 LEU 22 16.295 19.279 2.061 149 H VAL 23 H VAL 23 13.770 20.749 5.146 150 HA VAL 23 HA VAL 23 15.909 22.433 5.808 151 HB VAL 23 HB VAL 23 12.973 23.138 5.628 152 HG11 VAL 23 HG11 VAL 23 15.426 24.884 5.448 153 HG12 VAL 23 HG12 VAL 23 14.229 24.885 6.743 154 HG13 VAL 23 HG13 VAL 23 13.775 25.409 5.122 155 HG21 VAL 23 HG21 VAL 23 13.789 22.061 3.599 156 HG22 VAL 23 HG22 VAL 23 15.131 23.204 3.522 157 HG23 VAL 23 HG23 VAL 23 13.474 23.774 3.320 158 H GLN 24 H GLN 24 12.954 21.631 7.640 159 HA GLN 24 HA GLN 24 13.499 23.432 9.761 160 HB2 GLN 24 HB2 GLN 24 11.700 22.380 10.945 161 HB3 GLN 24 HB3 GLN 24 11.251 22.463 9.249 162 HG2 GLN 24 HG2 GLN 24 11.842 20.125 8.972 163 HG3 GLN 24 HG3 GLN 24 12.294 20.033 10.670 164 HE21 GLN 24 HE22 GLN 24 9.641 20.406 8.435 165 HE22 GLN 24 HE21 GLN 24 8.390 19.998 9.554 166 H CYS 25 H CYS 25 14.334 20.066 9.210 167 HA CYS 25 HA CYS 25 15.358 19.536 11.796 168 HB2 CYS 25 HB2 CYS 25 14.776 17.742 10.221 169 HB3 CYS 25 HB3 CYS 25 16.043 18.276 9.126 170 H ALA 26 H ALA 26 16.857 20.641 8.775 171 HA ALA 26 HA ALA 26 19.502 20.660 9.825 172 HB1 ALA 26 HB1 ALA 26 18.423 22.100 7.406 173 HB2 ALA 26 HB2 ALA 26 19.002 20.436 7.429 174 HB3 ALA 26 HB3 ALA 26 20.116 21.761 7.759 175 H SER 27 H SER 27 16.883 22.914 9.981 176 HA SER 27 HA SER 27 18.485 25.237 10.430 177 HB2 SER 27 HB2 SER 27 15.582 24.716 11.112 178 HB3 SER 27 HB3 SER 27 16.371 26.293 11.131 179 HG SER 27 HG SER 27 16.005 24.604 8.871 180 H ARG 28 H ARG 28 17.227 22.671 12.404 181 HA ARG 28 HA ARG 28 17.979 24.102 14.845 182 HB2 ARG 28 HB2 ARG 28 16.091 21.897 14.267 183 HB3 ARG 28 HB3 ARG 28 16.793 22.024 15.877 184 HG2 ARG 28 HG2 ARG 28 15.969 24.297 16.076 185 HG3 ARG 28 HG3 ARG 28 15.298 24.203 14.445 186 HD2 ARG 28 HD2 ARG 28 13.795 22.511 15.086 187 HD3 ARG 28 HD3 ARG 28 14.556 22.324 16.658 188 HE ARG 28 HE ARG 28 13.751 24.644 17.122 189 HH11 ARG 28 HH11 ARG 28 12.127 22.692 14.713 190 HH12 ARG 28 HH12 ARG 28 10.582 23.428 14.974 191 HH21 ARG 28 HH21 ARG 28 11.719 25.623 17.459 192 HH22 ARG 28 HH22 ARG 28 10.353 25.109 16.523 193 H SER 29 H SER 29 19.653 22.525 12.797 194 HA SER 29 HA SER 29 20.675 20.275 14.192 195 HB2 SER 29 HB2 SER 29 22.471 20.333 12.487 196 HB3 SER 29 HB3 SER 29 20.867 20.452 11.764 197 HG SER 29 HG SER 29 21.296 22.417 11.097 198 H GLY 30 H GLY 30 21.840 23.565 13.675 199 HA2 GLY 30 HA2 GLY 30 23.011 24.846 15.301 200 HA3 GLY 30 HA3 GLY 30 23.513 23.343 16.073 201 H VAL 31 H VAL 31 23.783 22.740 12.910 202 HA VAL 31 HA VAL 31 26.641 23.387 12.959 203 HB VAL 31 HB VAL 31 25.805 20.966 12.816 204 HG11 VAL 31 HG11 VAL 31 25.315 20.103 10.606 205 HG12 VAL 31 HG12 VAL 31 25.364 21.736 9.946 206 HG13 VAL 31 HG13 VAL 31 24.109 21.292 11.102 207 HG21 VAL 31 HG21 VAL 31 27.778 22.013 10.793 208 HG22 VAL 31 HG22 VAL 31 27.658 20.337 11.333 209 HG23 VAL 31 HG23 VAL 31 28.117 21.601 12.474 210 H LEU 32 H LEU 32 23.710 23.700 11.053 211 HA LEU 32 HA LEU 32 25.028 24.927 8.821 212 HB2 LEU 32 HB2 LEU 32 22.197 24.509 9.644 213 HB3 LEU 32 HB3 LEU 32 22.530 25.803 8.510 214 HG LEU 32 HG LEU 32 23.684 24.072 7.058 215 HD11 LEU 32 HD11 LEU 32 24.008 22.351 8.739 216 HD12 LEU 32 HD12 LEU 32 23.043 21.745 7.395 217 HD13 LEU 32 HD13 LEU 32 22.264 22.177 8.918 218 HD21 LEU 32 HD21 LEU 32 21.517 24.947 6.495 219 HD22 LEU 32 HD22 LEU 32 20.735 23.833 7.614 220 HD23 LEU 32 HD23 LEU 32 21.546 23.214 6.176 221 H THR 33 H THR 33 25.296 27.071 8.393 222 HA THR 33 HA THR 33 25.372 28.846 10.633 223 HB THR 33 HB THR 33 26.280 30.480 9.124 224 HG1 THR 33 HG1 THR 33 26.313 29.992 6.819 225 HG21 THR 33 HG21 THR 33 28.119 29.245 8.086 226 HG22 THR 33 HG22 THR 33 27.225 27.736 8.295 227 HG23 THR 33 HG23 THR 33 27.782 28.636 9.707 228 H ALA 34 H ALA 34 24.398 31.088 10.453 229 HA ALA 34 HA ALA 34 21.602 30.952 10.310 230 HB1 ALA 34 HB1 ALA 34 23.387 33.377 10.220 231 HB2 ALA 34 HB2 ALA 34 22.763 32.599 11.671 232 HB3 ALA 34 HB3 ALA 34 21.657 33.389 10.549 233 H ASP 35 H ASP 35 24.020 31.638 7.925 234 HA ASP 35 HA ASP 35 22.234 32.702 5.947 235 HB2 ASP 35 HB2 ASP 35 24.964 31.431 5.595 236 HB3 ASP 35 HB3 ASP 35 24.108 32.383 4.389 237 H GLN 36 H GLN 36 23.949 29.635 6.366 238 HA GLN 36 HA GLN 36 22.977 28.288 4.160 239 HB2 GLN 36 HB2 GLN 36 24.022 27.399 6.819 240 HB3 GLN 36 HB3 GLN 36 23.404 26.209 5.678 241 HG2 GLN 36 HG2 GLN 36 25.020 26.915 4.027 242 HG3 GLN 36 HG3 GLN 36 25.600 28.184 5.107 243 HE21 GLN 36 HE22 GLN 36 26.927 25.829 3.896 244 HE22 GLN 36 HE21 GLN 36 27.628 24.970 5.224 245 H MET 37 H MET 37 21.541 28.467 7.403 246 HA MET 37 HA MET 37 19.557 26.508 6.936 247 HB2 MET 37 HB2 MET 37 18.454 27.378 8.928 248 HB3 MET 37 HB3 MET 37 20.184 27.221 9.192 249 HG2 MET 37 HG2 MET 37 20.471 29.609 8.878 250 HG3 MET 37 HG3 MET 37 18.749 29.786 8.543 251 HE1 MET 37 HE1 MET 37 21.445 28.836 11.227 252 HE2 MET 37 HE2 MET 37 20.381 27.429 11.263 253 HE3 MET 37 HE3 MET 37 20.447 28.519 12.648 254 H ASP 38 H ASP 38 19.743 29.898 6.178 255 HA ASP 38 HA ASP 38 16.909 30.149 5.660 256 HB2 ASP 38 HB2 ASP 38 18.348 32.032 6.517 257 HB3 ASP 38 HB3 ASP 38 19.123 32.081 4.936 258 H ASP 39 H ASP 39 19.902 29.804 3.833 259 HA ASP 39 HA ASP 39 18.768 30.073 1.257 260 HB2 ASP 39 HB2 ASP 39 21.279 28.725 2.235 261 HB3 ASP 39 HB3 ASP 39 20.821 28.715 0.535 262 H MET 40 H MET 40 18.893 27.438 3.509 263 HA MET 40 HA MET 40 18.200 25.299 1.848 264 HB2 MET 40 HB2 MET 40 17.461 25.891 4.714 265 HB3 MET 40 HB3 MET 40 17.075 24.371 3.919 266 HG2 MET 40 HG2 MET 40 19.879 25.420 4.118 267 HG3 MET 40 HG3 MET 40 19.146 24.426 5.374 268 HE1 MET 40 HE1 MET 40 18.607 21.014 3.643 269 HE2 MET 40 HE2 MET 40 17.416 22.300 3.830 270 HE3 MET 40 HE3 MET 40 18.535 21.936 5.145 271 H GLY 41 H GLY 41 16.325 27.973 3.052 272 HA2 GLY 41 HA2 GLY 41 13.741 26.892 2.640 273 HA3 GLY 41 HA3 GLY 41 14.136 28.598 2.775 274 H MET 42 H MET 42 15.729 29.051 0.604 275 HA MET 42 HA MET 42 13.818 29.215 -1.473 276 HB2 MET 42 HB2 MET 42 15.574 30.199 -2.825 277 HB3 MET 42 HB3 MET 42 15.636 30.858 -1.197 278 HG2 MET 42 HG2 MET 42 17.469 29.322 -0.663 279 HG3 MET 42 HG3 MET 42 17.423 28.716 -2.316 280 HE1 MET 42 HE1 MET 42 18.153 31.798 -0.010 281 HE2 MET 42 HE2 MET 42 16.933 32.436 -1.108 282 HE3 MET 42 HE3 MET 42 18.586 33.037 -1.188 283 H MET 43 H MET 43 16.299 26.905 -0.708 284 HA MET 43 HA MET 43 16.413 25.587 -3.205 285 HB2 MET 43 HB2 MET 43 18.110 25.256 -1.492 286 HB3 MET 43 HB3 MET 43 16.914 24.561 -0.408 287 HG2 MET 43 HG2 MET 43 16.574 22.773 -2.169 288 HG3 MET 43 HG3 MET 43 18.028 23.405 -2.940 289 HE1 MET 43 HE1 MET 43 17.900 21.572 1.289 290 HE2 MET 43 HE2 MET 43 16.509 21.650 0.205 291 HE3 MET 43 HE3 MET 43 17.180 23.133 0.890 292 H ALA 44 H ALA 44 14.496 25.039 -0.270 293 HA ALA 44 HA ALA 44 13.105 22.766 -1.142 294 HB1 ALA 44 HB1 ALA 44 12.169 24.908 0.767 295 HB2 ALA 44 HB2 ALA 44 13.142 23.499 1.192 296 HB3 ALA 44 HB3 ALA 44 11.489 23.287 0.612 297 H ASP 45 H ASP 45 12.471 26.203 -1.571 298 HA ASP 45 HA ASP 45 9.933 25.984 -2.777 299 HB2 ASP 45 HB2 ASP 45 10.716 28.126 -1.984 300 HB3 ASP 45 HB3 ASP 45 12.086 28.083 -3.090 301 H SER 46 H SER 46 13.194 26.081 -4.149 302 HA SER 46 HA SER 46 12.453 25.924 -6.846 303 HB2 SER 46 HB2 SER 46 14.714 26.524 -6.090 304 HB3 SER 46 HB3 SER 46 14.956 24.883 -5.496 305 HG SER 46 HG SER 46 15.697 24.521 -7.415 306 H VAL 47 H VAL 47 12.969 23.420 -4.410 307 HA VAL 47 HA VAL 47 12.841 21.186 -6.100 308 HB VAL 47 HB VAL 47 11.969 21.392 -3.211 309 HG11 VAL 47 HG11 VAL 47 12.608 18.951 -4.869 310 HG12 VAL 47 HG12 VAL 47 11.011 19.422 -4.288 311 HG13 VAL 47 HG13 VAL 47 12.268 18.962 -3.140 312 HG21 VAL 47 HG21 VAL 47 14.186 20.427 -2.736 313 HG22 VAL 47 HG22 VAL 47 14.297 22.006 -3.512 314 HG23 VAL 47 HG23 VAL 47 14.587 20.541 -4.450 315 H ASN 48 H ASN 48 10.200 22.774 -4.251 316 HA ASN 48 HA ASN 48 8.256 20.996 -5.293 317 HB2 ASN 48 HB2 ASN 48 6.577 22.506 -4.343 318 HB3 ASN 48 HB3 ASN 48 7.816 22.087 -3.184 319 HD21 ASN 48 HD22 ASN 48 8.216 23.694 -1.906 320 HD22 ASN 48 HD21 ASN 48 8.300 25.362 -2.344 321 H SER 49 H SER 49 9.596 23.998 -6.432 322 HA SER 49 HA SER 49 7.660 24.597 -8.373 323 HB2 SER 49 HB2 SER 49 9.504 26.133 -7.753 324 HB3 SER 49 HB3 SER 49 10.655 25.041 -8.518 325 HG SER 49 HG SER 49 8.817 26.787 -9.663 326 H GLN 50 H GLN 50 10.671 22.722 -8.646 327 HA GLN 50 HA GLN 50 10.297 21.840 -11.285 328 HB2 GLN 50 HB2 GLN 50 11.816 20.580 -8.999 329 HB3 GLN 50 HB3 GLN 50 11.955 20.082 -10.679 330 HG2 GLN 50 HG2 GLN 50 12.951 22.125 -11.305 331 HG3 GLN 50 HG3 GLN 50 12.526 22.886 -9.772 332 HE21 GLN 50 HE22 GLN 50 13.722 22.434 -7.952 333 HE22 GLN 50 HE21 GLN 50 15.283 21.679 -8.011 334 H MET 51 H MET 51 9.294 20.482 -8.196 335 HA MET 51 HA MET 51 8.413 17.998 -9.249 336 HB2 MET 51 HB2 MET 51 9.029 18.137 -6.935 337 HB3 MET 51 HB3 MET 51 7.839 19.397 -6.640 338 HG2 MET 51 HG2 MET 51 6.692 16.940 -7.714 339 HG3 MET 51 HG3 MET 51 7.493 16.733 -6.158 340 HE1 MET 51 HE1 MET 51 6.816 17.787 -3.983 341 HE2 MET 51 HE2 MET 51 5.543 18.986 -3.755 342 HE3 MET 51 HE3 MET 51 7.033 19.428 -4.592 343 H GLN 52 H GLN 52 6.678 20.998 -8.401 344 HA GLN 52 HA GLN 52 4.115 19.918 -8.981 345 HB2 GLN 52 HB2 GLN 52 5.084 22.772 -8.801 346 HB3 GLN 52 HB3 GLN 52 3.401 22.337 -9.072 347 HG2 GLN 52 HG2 GLN 52 3.298 21.207 -6.953 348 HG3 GLN 52 HG3 GLN 52 5.022 21.468 -6.690 349 HE21 GLN 52 HE22 GLN 52 5.756 23.542 -6.196 350 HE22 GLN 52 HE21 GLN 52 4.690 24.764 -5.592 351 H LYS 53 H LYS 53 6.502 21.650 -10.901 352 HA LYS 53 HA LYS 53 4.771 21.832 -13.192 353 HB2 LYS 53 HB2 LYS 53 7.709 22.406 -12.827 354 HB3 LYS 53 HB3 LYS 53 6.813 22.712 -14.312 355 HG2 LYS 53 HG2 LYS 53 5.424 24.322 -13.224 356 HG3 LYS 53 HG3 LYS 53 6.099 23.911 -11.648 357 HD2 LYS 53 HD2 LYS 53 7.040 25.993 -12.527 358 HD3 LYS 53 HD3 LYS 53 8.269 24.743 -12.339 359 HE2 LYS 53 HE2 LYS 53 8.179 24.260 -14.708 360 HE3 LYS 53 HE3 LYS 53 6.885 25.435 -14.924 361 HZ1 LYS 53 HZ1 LYS 53 9.022 26.344 -15.575 362 HZ2 LYS 53 HZ2 LYS 53 9.648 26.054 -14.033 363 HZ3 LYS 53 HZ3 LYS 53 8.407 27.182 -14.242 364 H MET 54 H MET 54 6.217 19.266 -11.831 365 HA MET 54 HA MET 54 7.417 17.953 -14.046 366 HB2 MET 54 HB2 MET 54 7.799 17.268 -11.697 367 HB3 MET 54 HB3 MET 54 6.120 16.759 -11.582 368 HG2 MET 54 HG2 MET 54 6.560 15.124 -13.407 369 HG3 MET 54 HG3 MET 54 8.264 15.562 -13.317 370 HE1 MET 54 HE1 MET 54 8.481 15.998 -10.051 371 HE2 MET 54 HE2 MET 54 9.721 15.253 -11.057 372 HE3 MET 54 HE3 MET 54 9.125 14.413 -9.620 373 H GLY 55 H GLY 55 4.153 18.075 -12.736 374 HA2 GLY 55 HA2 GLY 55 2.287 18.046 -14.261 375 HA3 GLY 55 HA3 GLY 55 3.184 16.921 -15.267 376 HA PRO 56 HA PRO 56 0.342 14.790 -11.971 377 HB2 PRO 56 HB2 PRO 56 -1.817 14.323 -13.610 378 HB3 PRO 56 HB3 PRO 56 -1.725 15.639 -12.439 379 HG2 PRO 56 HG2 PRO 56 -1.250 15.692 -15.388 380 HG3 PRO 56 HG3 PRO 56 -2.065 16.885 -14.361 381 HD2 PRO 56 HD2 PRO 56 0.454 17.236 -15.244 382 HD3 PRO 56 HD3 PRO 56 -0.076 17.818 -13.651 383 H ASN 57 H ASN 57 0.392 12.603 -11.913 384 HA ASN 57 HA ASN 57 1.104 10.516 -12.425 385 HB2 ASN 57 HB2 ASN 57 0.161 11.284 -15.197 386 HB3 ASN 57 HB3 ASN 57 0.684 9.663 -14.747 387 HD21 ASN 57 HD22 ASN 57 -1.822 12.034 -14.522 388 HD22 ASN 57 HD21 ASN 57 -3.000 11.022 -13.761 389 HA PRO 58 HA PRO 58 5.096 12.469 -13.615 390 HB2 PRO 58 HB2 PRO 58 6.044 10.692 -11.459 391 HB3 PRO 58 HB3 PRO 58 6.281 12.430 -11.668 392 HG2 PRO 58 HG2 PRO 58 4.640 11.492 -9.790 393 HG3 PRO 58 HG3 PRO 58 4.229 12.952 -10.713 394 HD2 PRO 58 HD2 PRO 58 3.247 10.140 -11.081 395 HD3 PRO 58 HD3 PRO 58 2.328 11.662 -11.095 396 HA PRO 59 HA PRO 59 6.390 8.770 -15.843 397 HB2 PRO 59 HB2 PRO 59 7.685 10.031 -17.812 398 HB3 PRO 59 HB3 PRO 59 5.924 9.970 -17.757 399 HG2 PRO 59 HG2 PRO 59 7.768 12.208 -17.045 400 HG3 PRO 59 HG3 PRO 59 6.181 12.264 -17.832 401 HD2 PRO 59 HD2 PRO 59 6.662 12.758 -15.132 402 HD3 PRO 59 HD3 PRO 59 5.084 12.362 -15.839 403 H GLN 60 H GLN 60 8.422 7.717 -16.111 404 HA GLN 60 HA GLN 60 10.034 8.186 -13.866 405 HB2 GLN 60 HB2 GLN 60 11.372 6.281 -14.606 406 HB3 GLN 60 HB3 GLN 60 9.652 5.949 -14.705 407 HG2 GLN 60 HG2 GLN 60 10.448 5.022 -16.649 408 HG3 GLN 60 HG3 GLN 60 9.911 6.608 -17.193 409 HE21 GLN 60 HE22 GLN 60 11.287 6.551 -18.967 410 HE22 GLN 60 HE21 GLN 60 12.999 6.754 -18.817 411 H HIS 61 H HIS 61 10.474 9.261 -17.174 412 HA HIS 61 HA HIS 61 13.256 9.734 -17.017 413 HB2 HIS 61 HB2 HIS 61 13.075 11.017 -18.994 414 HB3 HIS 61 HB3 HIS 61 11.840 9.776 -19.132 415 HD1 HIS 61 HD1 HIS 61 12.346 13.380 -19.300 416 HD2 HIS 61 HD2 HIS 61 9.154 10.832 -18.572 417 HE1 HIS 61 HE1 HIS 61 10.278 14.751 -19.676 418 H ARG 62 H ARG 62 10.562 11.384 -15.682 419 HA ARG 62 HA ARG 62 11.993 13.831 -15.096 420 HB2 ARG 62 HB2 ARG 62 9.317 12.748 -14.190 421 HB3 ARG 62 HB3 ARG 62 9.957 14.305 -13.689 422 HG2 ARG 62 HG2 ARG 62 9.644 13.646 -16.587 423 HG3 ARG 62 HG3 ARG 62 8.271 14.208 -15.634 424 HD2 ARG 62 HD2 ARG 62 9.886 16.121 -14.924 425 HD3 ARG 62 HD3 ARG 62 10.796 15.641 -16.358 426 HE ARG 62 HE ARG 62 8.097 15.949 -17.055 427 HH11 ARG 62 HH11 ARG 62 10.872 17.887 -16.160 428 HH12 ARG 62 HH12 ARG 62 10.287 19.312 -16.959 429 HH21 ARG 62 HH21 ARG 62 7.326 17.812 -18.094 430 HH22 ARG 62 HH22 ARG 62 8.265 19.270 -18.056 431 H LEU 63 H LEU 63 10.837 10.981 -13.392 432 HA LEU 63 HA LEU 63 11.593 11.632 -10.798 433 HB2 LEU 63 HB2 LEU 63 11.177 9.050 -12.254 434 HB3 LEU 63 HB3 LEU 63 11.813 9.025 -10.623 435 HG LEU 63 HG LEU 63 9.810 10.022 -9.744 436 HD11 LEU 63 HD11 LEU 63 8.804 10.212 -12.579 437 HD12 LEU 63 HD12 LEU 63 9.366 11.572 -11.609 438 HD13 LEU 63 HD13 LEU 63 7.934 10.672 -11.118 439 HD21 LEU 63 HD21 LEU 63 9.764 7.613 -10.126 440 HD22 LEU 63 HD22 LEU 63 9.117 7.876 -11.745 441 HD23 LEU 63 HD23 LEU 63 8.163 8.321 -10.332 442 H ARG 64 H ARG 64 13.404 9.894 -13.300 443 HA ARG 64 HA ARG 64 15.696 9.424 -11.697 444 HB2 ARG 64 HB2 ARG 64 15.071 9.198 -14.605 445 HB3 ARG 64 HB3 ARG 64 16.751 9.130 -14.090 446 HG2 ARG 64 HG2 ARG 64 16.265 7.240 -12.657 447 HG3 ARG 64 HG3 ARG 64 14.554 7.339 -13.078 448 HD2 ARG 64 HD2 ARG 64 14.920 6.611 -15.255 449 HD3 ARG 64 HD3 ARG 64 16.635 7.012 -15.200 450 HE ARG 64 HE ARG 64 16.777 5.112 -13.534 451 HH11 ARG 64 HH11 ARG 64 14.323 5.179 -16.041 452 HH12 ARG 64 HH12 ARG 64 14.263 3.452 -16.193 453 HH21 ARG 64 HH21 ARG 64 16.679 2.850 -13.721 454 HH22 ARG 64 HH22 ARG 64 15.590 2.120 -14.858 455 H ALA 65 H ALA 65 14.549 12.291 -12.908 456 HA ALA 65 HA ALA 65 17.242 13.436 -13.161 457 HB1 ALA 65 HB1 ALA 65 14.592 14.622 -13.981 458 HB2 ALA 65 HB2 ALA 65 15.735 13.824 -15.061 459 HB3 ALA 65 HB3 ALA 65 16.183 15.329 -14.258 460 H MET 66 H MET 66 14.873 12.988 -10.894 461 HA MET 66 HA MET 66 14.983 15.661 -9.739 462 HB2 MET 66 HB2 MET 66 13.496 13.183 -8.860 463 HB3 MET 66 HB3 MET 66 13.405 14.736 -8.043 464 HG2 MET 66 HG2 MET 66 12.530 14.137 -10.858 465 HG3 MET 66 HG3 MET 66 11.484 14.415 -9.466 466 HE1 MET 66 HE1 MET 66 12.109 18.221 -8.731 467 HE2 MET 66 HE2 MET 66 12.992 16.876 -8.014 468 HE3 MET 66 HE3 MET 66 11.246 16.763 -8.244 469 H ASN 67 H ASN 67 16.080 12.402 -9.062 470 HA ASN 67 HA ASN 67 17.137 12.768 -6.510 471 HB2 ASN 67 HB2 ASN 67 18.863 10.969 -7.458 472 HB3 ASN 67 HB3 ASN 67 17.191 10.552 -7.097 473 HD21 ASN 67 HD22 ASN 67 19.520 11.120 -9.623 474 HD22 ASN 67 HD21 ASN 67 18.542 10.518 -10.917 475 H THR 68 H THR 68 18.644 13.320 -9.674 476 HA THR 68 HA THR 68 21.091 14.268 -8.525 477 HB THR 68 HB THR 68 20.102 14.603 -11.361 478 HG1 THR 68 HG1 THR 68 21.700 12.516 -10.241 479 HG21 THR 68 HG21 THR 68 22.015 16.021 -10.811 480 HG22 THR 68 HG22 THR 68 22.496 14.725 -11.908 481 HG23 THR 68 HG23 THR 68 22.889 14.619 -10.192 482 H ALA 69 H ALA 69 18.078 15.704 -9.552 483 HA ALA 69 HA ALA 69 18.926 18.367 -9.842 484 HB1 ALA 69 HB1 ALA 69 16.590 18.985 -9.589 485 HB2 ALA 69 HB2 ALA 69 16.219 17.388 -8.936 486 HB3 ALA 69 HB3 ALA 69 16.738 17.556 -10.613 487 H MET 70 H MET 70 17.348 16.802 -7.046 488 HA MET 70 HA MET 70 17.581 18.975 -5.288 489 HB2 MET 70 HB2 MET 70 16.167 17.006 -4.824 490 HB3 MET 70 HB3 MET 70 17.609 16.026 -4.606 491 HG2 MET 70 HG2 MET 70 18.239 17.715 -2.779 492 HG3 MET 70 HG3 MET 70 16.554 18.221 -2.865 493 HE1 MET 70 HE1 MET 70 15.069 15.505 -3.489 494 HE2 MET 70 HE2 MET 70 14.494 16.618 -2.245 495 HE3 MET 70 HE3 MET 70 14.694 14.904 -1.872 496 H ALA 71 H ALA 71 19.676 16.225 -5.878 497 HA ALA 71 HA ALA 71 21.608 16.569 -3.960 498 HB1 ALA 71 HB1 ALA 71 21.464 14.665 -5.507 499 HB2 ALA 71 HB2 ALA 71 23.091 15.337 -5.412 500 HB3 ALA 71 HB3 ALA 71 22.068 15.696 -6.801 501 H ALA 72 H ALA 72 21.466 18.096 -7.164 502 HA ALA 72 HA ALA 72 23.952 19.426 -6.959 503 HB1 ALA 72 HB1 ALA 72 22.850 19.018 -9.099 504 HB2 ALA 72 HB2 ALA 72 23.198 20.730 -8.872 505 HB3 ALA 72 HB3 ALA 72 21.557 20.130 -8.649 506 H GLU 73 H GLU 73 20.662 20.358 -6.103 507 HA GLU 73 HA GLU 73 21.328 23.090 -5.613 508 HB2 GLU 73 HB2 GLU 73 18.912 21.536 -4.669 509 HB3 GLU 73 HB3 GLU 73 19.069 23.288 -4.733 510 HG2 GLU 73 HG2 GLU 73 19.446 23.021 -7.223 511 HG3 GLU 73 HG3 GLU 73 18.906 21.356 -7.021 512 H VAL 74 H VAL 74 20.874 20.238 -3.551 513 HA VAL 74 HA VAL 74 21.364 21.567 -1.096 514 HB VAL 74 HB VAL 74 21.899 18.662 -1.767 515 HG11 VAL 74 HG11 VAL 74 21.653 18.286 0.642 516 HG12 VAL 74 HG12 VAL 74 21.474 20.024 0.891 517 HG13 VAL 74 HG13 VAL 74 22.998 19.372 0.287 518 HG21 VAL 74 HG21 VAL 74 19.683 18.217 -0.830 519 HG22 VAL 74 HG22 VAL 74 19.583 19.271 -2.240 520 HG23 VAL 74 HG23 VAL 74 19.424 19.949 -0.620 521 H ALA 75 H ALA 75 23.421 20.218 -3.574 522 HA ALA 75 HA ALA 75 25.849 20.116 -2.190 523 HB1 ALA 75 HB1 ALA 75 25.493 19.115 -4.403 524 HB2 ALA 75 HB2 ALA 75 26.919 20.153 -4.366 525 HB3 ALA 75 HB3 ALA 75 25.428 20.729 -5.111 526 H GLU 76 H GLU 76 24.198 22.794 -3.757 527 HA GLU 76 HA GLU 76 26.281 24.640 -3.856 528 HB2 GLU 76 HB2 GLU 76 23.314 25.063 -3.479 529 HB3 GLU 76 HB3 GLU 76 24.454 26.371 -3.766 530 HG2 GLU 76 HG2 GLU 76 23.881 24.075 -5.627 531 HG3 GLU 76 HG3 GLU 76 23.327 25.739 -5.813 532 H VAL 77 H VAL 77 23.816 24.250 -1.291 533 HA VAL 77 HA VAL 77 24.934 26.287 0.331 534 HB VAL 77 HB VAL 77 23.473 25.481 2.126 535 HG11 VAL 77 HG11 VAL 77 21.336 25.831 0.995 536 HG12 VAL 77 HG12 VAL 77 22.116 25.570 -0.564 537 HG13 VAL 77 HG13 VAL 77 22.561 26.962 0.421 538 HG21 VAL 77 HG21 VAL 77 23.659 23.080 1.762 539 HG22 VAL 77 HG22 VAL 77 22.786 23.232 0.236 540 HG23 VAL 77 HG23 VAL 77 21.968 23.584 1.759 541 H VAL 78 H VAL 78 25.571 22.880 0.035 542 HA VAL 78 HA VAL 78 27.010 22.708 2.527 543 HB VAL 78 HB VAL 78 26.899 20.737 0.233 544 HG11 VAL 78 HG11 VAL 78 28.859 20.411 1.666 545 HG12 VAL 78 HG12 VAL 78 27.701 19.094 1.841 546 HG13 VAL 78 HG13 VAL 78 27.812 20.339 3.084 547 HG21 VAL 78 HG21 VAL 78 25.323 20.860 2.804 548 HG22 VAL 78 HG22 VAL 78 25.296 19.521 1.656 549 HG23 VAL 78 HG23 VAL 78 24.699 21.108 1.173 550 H ALA 79 H ALA 79 27.771 23.323 -0.836 551 HA ALA 79 HA ALA 79 30.552 22.826 -0.704 552 HB1 ALA 79 HB1 ALA 79 29.297 22.997 -2.817 553 HB2 ALA 79 HB2 ALA 79 30.704 24.059 -2.783 554 HB3 ALA 79 HB3 ALA 79 29.091 24.726 -2.535 555 H THR 80 H THR 80 28.599 25.448 0.384 556 HA THR 80 HA THR 80 30.815 27.313 0.577 557 HB THR 80 HB THR 80 28.093 27.748 1.787 558 HG1 THR 80 HG1 THR 80 28.821 27.824 -0.972 559 HG21 THR 80 HG21 THR 80 29.805 29.457 2.157 560 HG22 THR 80 HG22 THR 80 28.524 30.073 1.113 561 HG23 THR 80 HG23 THR 80 30.069 29.582 0.417 562 H SER 81 H SER 81 30.338 24.666 2.229 563 HA SER 81 HA SER 81 30.338 25.733 4.933 564 HB2 SER 81 HB2 SER 81 30.629 22.856 4.035 565 HB3 SER 81 HB3 SER 81 30.256 23.426 5.663 566 HG SER 81 HG SER 81 28.651 23.477 3.350 567 HA PRO 82 HA PRO 82 34.821 25.834 5.294 568 HB2 PRO 82 HB2 PRO 82 34.146 25.423 8.160 569 HB3 PRO 82 HB3 PRO 82 35.156 26.664 7.409 570 HG2 PRO 82 HG2 PRO 82 32.727 27.259 8.316 571 HG3 PRO 82 HG3 PRO 82 33.337 27.973 6.814 572 HD2 PRO 82 HD2 PRO 82 31.374 25.749 7.197 573 HD3 PRO 82 HD3 PRO 82 31.381 27.059 5.997 574 HA PRO 83 HA PRO 83 36.109 21.637 5.229 575 HB2 PRO 83 HB2 PRO 83 38.205 22.477 7.186 576 HB3 PRO 83 HB3 PRO 83 38.373 21.559 5.685 577 HG2 PRO 83 HG2 PRO 83 39.029 24.128 5.755 578 HG3 PRO 83 HG3 PRO 83 38.181 23.455 4.351 579 HD2 PRO 83 HD2 PRO 83 37.139 25.186 6.542 580 HD3 PRO 83 HD3 PRO 83 36.679 25.128 4.830 581 H GLN 84 H GLN 84 36.414 22.961 8.548 582 HA GLN 84 HA GLN 84 36.048 20.358 9.709 583 HB2 GLN 84 HB2 GLN 84 36.141 23.086 11.001 584 HB3 GLN 84 HB3 GLN 84 36.142 21.559 11.870 585 HG2 GLN 84 HG2 GLN 84 38.260 22.481 9.938 586 HG3 GLN 84 HG3 GLN 84 38.380 22.507 11.697 587 HE21 GLN 84 HE22 GLN 84 40.024 21.132 9.716 588 HE22 GLN 84 HE21 GLN 84 39.970 19.454 10.127 589 H SER 85 H SER 85 33.905 22.509 8.411 590 HA SER 85 HA SER 85 31.747 21.776 10.259 591 HB2 SER 85 HB2 SER 85 31.675 23.712 7.936 592 HB3 SER 85 HB3 SER 85 30.439 23.508 9.175 593 HG SER 85 HG SER 85 32.849 23.988 10.297 594 H TYR 86 H TYR 86 32.942 21.339 7.025 595 HA TYR 86 HA TYR 86 30.702 20.565 5.632 596 HB2 TYR 86 HB2 TYR 86 32.927 20.947 4.628 597 HB3 TYR 86 HB3 TYR 86 33.485 19.426 5.325 598 HD1 TYR 86 HD2 TYR 86 32.734 17.288 4.416 599 HD2 TYR 86 HD1 TYR 86 31.426 20.969 2.731 600 HE1 TYR 86 HE2 TYR 86 31.925 16.087 2.428 601 HE2 TYR 86 HE1 TYR 86 30.610 19.778 0.745 602 HH TYR 86 HH TYR 86 30.903 17.718 -0.425 603 H SER 87 H SER 87 32.913 18.408 7.414 604 HA SER 87 HA SER 87 31.580 16.035 6.741 605 HB2 SER 87 HB2 SER 87 33.260 16.581 9.195 606 HB3 SER 87 HB3 SER 87 32.907 14.998 8.498 607 HG SER 87 HG SER 87 33.878 16.202 6.504 608 H ALA 88 H ALA 88 31.029 18.337 9.306 609 HA ALA 88 HA ALA 88 29.273 16.631 10.806 610 HB1 ALA 88 HB1 ALA 88 30.516 18.426 11.901 611 HB2 ALA 88 HB2 ALA 88 28.779 18.645 12.104 612 HB3 ALA 88 HB3 ALA 88 29.659 19.621 10.929 613 H VAL 89 H VAL 89 28.959 19.128 8.360 614 HA VAL 89 HA VAL 89 26.117 19.300 8.433 615 HB VAL 89 HB VAL 89 28.052 20.015 6.214 616 HG11 VAL 89 HG11 VAL 89 26.239 21.368 5.285 617 HG12 VAL 89 HG12 VAL 89 25.149 20.779 6.541 618 HG13 VAL 89 HG13 VAL 89 25.793 19.663 5.335 619 HG21 VAL 89 HG21 VAL 89 27.740 22.315 6.994 620 HG22 VAL 89 HG22 VAL 89 28.409 21.289 8.265 621 HG23 VAL 89 HG23 VAL 89 26.702 21.729 8.294 622 H LEU 90 H LEU 90 28.447 17.377 6.660 623 HA LEU 90 HA LEU 90 26.825 16.176 4.751 624 HB2 LEU 90 HB2 LEU 90 29.398 16.010 5.272 625 HB3 LEU 90 HB3 LEU 90 28.926 14.606 6.203 626 HG LEU 90 HG LEU 90 28.334 14.946 3.266 627 HD11 LEU 90 HD11 LEU 90 30.741 14.873 3.664 628 HD12 LEU 90 HD12 LEU 90 30.161 13.420 2.849 629 HD13 LEU 90 HD13 LEU 90 30.541 13.376 4.574 630 HD21 LEU 90 HD21 LEU 90 27.970 12.525 3.320 631 HD22 LEU 90 HD22 LEU 90 26.828 13.390 4.351 632 HD23 LEU 90 HD23 LEU 90 28.197 12.537 5.070 633 H ASN 91 H ASN 91 27.592 15.029 8.030 634 HA ASN 91 HA ASN 91 25.907 12.754 7.906 635 HB2 ASN 91 HB2 ASN 91 27.234 14.222 10.174 636 HB3 ASN 91 HB3 ASN 91 26.157 12.862 10.473 637 HD21 ASN 91 HD22 ASN 91 29.235 13.861 9.204 638 HD22 ASN 91 HD21 ASN 91 29.906 12.274 9.047 639 H THR 92 H THR 92 25.454 16.023 9.140 640 HA THR 92 HA THR 92 22.981 15.643 10.396 641 HB THR 92 HB THR 92 24.037 18.146 9.063 642 HG1 THR 92 HG1 THR 92 25.481 17.522 10.637 643 HG21 THR 92 HG21 THR 92 21.658 18.341 9.536 644 HG22 THR 92 HG22 THR 92 22.586 19.330 10.669 645 HG23 THR 92 HG23 THR 92 21.922 17.778 11.187 646 H ILE 93 H ILE 93 23.693 16.825 7.107 647 HA ILE 93 HA ILE 93 21.056 17.136 6.235 648 HB ILE 93 HB ILE 93 23.524 16.420 4.644 649 HG12 ILE 93 HG12 ILE 93 23.677 18.568 5.799 650 HG13 ILE 93 HG13 ILE 93 23.543 18.806 4.062 651 HG21 ILE 93 HG21 ILE 93 22.319 17.160 2.662 652 HG22 ILE 93 HG22 ILE 93 20.865 17.417 3.629 653 HG23 ILE 93 HG23 ILE 93 21.509 15.787 3.418 654 HD11 ILE 93 HD11 ILE 93 21.345 19.143 6.089 655 HD12 ILE 93 HD12 ILE 93 21.156 19.320 4.347 656 HD13 ILE 93 HD13 ILE 93 22.202 20.426 5.235 657 H GLY 94 H GLY 94 23.229 14.350 5.964 658 HA2 GLY 94 HA2 GLY 94 21.514 12.673 4.522 659 HA3 GLY 94 HA3 GLY 94 22.824 12.127 5.551 660 H ALA 95 H ALA 95 21.909 13.077 7.992 661 HA ALA 95 HA ALA 95 20.174 10.988 8.769 662 HB1 ALA 95 HB1 ALA 95 20.201 12.028 10.971 663 HB2 ALA 95 HB2 ALA 95 20.907 13.491 10.285 664 HB3 ALA 95 HB3 ALA 95 21.824 11.984 10.283 665 H CYS 96 H CYS 96 19.652 14.497 8.467 666 HA CYS 96 HA CYS 96 16.954 14.500 9.211 667 HB2 CYS 96 HB2 CYS 96 18.451 16.370 7.372 668 HB3 CYS 96 HB3 CYS 96 16.830 16.671 7.989 669 H LEU 97 H LEU 97 18.460 14.113 6.025 670 HA LEU 97 HA LEU 97 16.077 14.142 4.521 671 HB2 LEU 97 HB2 LEU 97 18.578 14.281 3.792 672 HB3 LEU 97 HB3 LEU 97 18.496 12.533 3.756 673 HG LEU 97 HG LEU 97 18.203 13.706 1.540 674 HD11 LEU 97 HD11 LEU 97 16.072 11.839 2.526 675 HD12 LEU 97 HD12 LEU 97 17.564 11.439 1.677 676 HD13 LEU 97 HD13 LEU 97 16.271 12.290 0.833 677 HD21 LEU 97 HD21 LEU 97 16.787 15.543 2.359 678 HD22 LEU 97 HD22 LEU 97 15.485 14.388 2.643 679 HD23 LEU 97 HD23 LEU 97 16.066 14.677 1.003 680 H ARG 98 H ARG 98 17.937 11.491 5.976 681 HA ARG 98 HA ARG 98 16.509 9.286 5.147 682 HB2 ARG 98 HB2 ARG 98 18.593 9.253 6.430 683 HB3 ARG 98 HB3 ARG 98 17.747 9.873 7.837 684 HG2 ARG 98 HG2 ARG 98 16.347 7.782 7.772 685 HG3 ARG 98 HG3 ARG 98 17.488 7.167 6.568 686 HD2 ARG 98 HD2 ARG 98 18.401 6.374 8.537 687 HD3 ARG 98 HD3 ARG 98 19.278 7.887 8.280 688 HE ARG 98 HE ARG 98 16.929 8.229 9.895 689 HH11 ARG 98 HH11 ARG 98 20.321 7.315 9.968 690 HH12 ARG 98 HH12 ARG 98 20.509 7.701 11.649 691 HH21 ARG 98 HH21 ARG 98 17.179 8.728 12.084 692 HH22 ARG 98 HH22 ARG 98 18.721 8.496 12.857 693 H GLU 99 H GLU 99 16.006 11.122 8.147 694 HA GLU 99 HA GLU 99 13.733 9.751 9.034 695 HB2 GLU 99 HB2 GLU 99 14.391 12.658 9.530 696 HB3 GLU 99 HB3 GLU 99 13.381 11.619 10.527 697 HG2 GLU 99 HG2 GLU 99 16.311 11.166 10.042 698 HG3 GLU 99 HG3 GLU 99 15.652 12.030 11.427 699 H SER 100 H SER 100 14.002 12.832 7.326 700 HA SER 100 HA SER 100 11.352 13.540 7.159 701 HB2 SER 100 HB2 SER 100 13.499 13.991 5.078 702 HB3 SER 100 HB3 SER 100 11.989 14.894 5.208 703 HG SER 100 HG SER 100 14.222 14.891 6.926 704 H MET 101 H MET 101 13.137 11.360 5.011 705 HA MET 101 HA MET 101 11.164 11.054 3.041 706 HB2 MET 101 HB2 MET 101 13.364 9.240 4.004 707 HB3 MET 101 HB3 MET 101 12.275 8.759 2.712 708 HG2 MET 101 HG2 MET 101 13.932 11.264 2.642 709 HG3 MET 101 HG3 MET 101 14.460 9.719 1.978 710 HE1 MET 101 HE1 MET 101 13.385 8.546 -0.108 711 HE2 MET 101 HE2 MET 101 11.924 9.115 -0.915 712 HE3 MET 101 HE3 MET 101 11.836 8.500 0.734 713 H MET 102 H MET 102 11.765 9.152 5.992 714 HA MET 102 HA MET 102 9.584 7.381 5.470 715 HB2 MET 102 HB2 MET 102 10.727 6.131 6.919 716 HB3 MET 102 HB3 MET 102 11.852 7.456 7.144 717 HG2 MET 102 HG2 MET 102 11.240 7.026 9.280 718 HG3 MET 102 HG3 MET 102 10.097 8.293 8.860 719 HE1 MET 102 HE1 MET 102 9.032 3.804 9.065 720 HE2 MET 102 HE2 MET 102 10.620 4.461 9.458 721 HE3 MET 102 HE3 MET 102 10.052 4.465 7.788 722 H GLN 103 H GLN 103 10.068 10.313 7.300 723 HA GLN 103 HA GLN 103 7.652 10.234 8.784 724 HB2 GLN 103 HB2 GLN 103 9.734 12.228 8.221 725 HB3 GLN 103 HB3 GLN 103 8.135 12.905 8.485 726 HG2 GLN 103 HG2 GLN 103 9.285 12.877 10.568 727 HG3 GLN 103 HG3 GLN 103 8.005 11.670 10.623 728 HE21 GLN 103 HE22 GLN 103 8.556 9.483 10.647 729 HE22 GLN 103 HE21 GLN 103 10.158 8.952 11.026 730 H ALA 104 H ALA 104 8.313 11.021 5.481 731 HA ALA 104 HA ALA 104 6.036 12.664 5.052 732 HB1 ALA 104 HB1 ALA 104 7.988 12.697 3.569 733 HB2 ALA 104 HB2 ALA 104 6.491 12.388 2.689 734 HB3 ALA 104 HB3 ALA 104 7.600 11.059 3.038 735 H THR 105 H THR 105 6.628 9.395 3.740 736 HA THR 105 HA THR 105 4.337 8.172 4.686 737 HB THR 105 HB THR 105 3.047 9.840 3.452 738 HG1 THR 105 HG1 THR 105 2.006 7.906 3.508 739 HG21 THR 105 HG21 THR 105 3.093 9.938 1.007 740 HG22 THR 105 HG22 THR 105 4.423 8.778 0.985 741 HG23 THR 105 HG23 THR 105 4.658 10.376 1.697 742 H GLY 106 H GLY 106 6.552 8.521 1.971 743 HA2 GLY 106 HA2 GLY 106 6.075 5.796 1.084 744 HA3 GLY 106 HA3 GLY 106 7.118 6.982 0.312 745 H SER 107 H SER 107 7.296 6.151 3.715 746 HA SER 107 HA SER 107 9.015 5.523 5.013 747 HB2 SER 107 HB2 SER 107 10.179 3.374 4.247 748 HB3 SER 107 HB3 SER 107 8.439 3.310 4.485 749 HG SER 107 HG SER 107 9.171 4.004 1.932 750 H VAL 108 H VAL 108 11.536 4.562 4.634 751 HA VAL 108 HA VAL 108 12.766 6.808 3.222 752 HB VAL 108 HB VAL 108 13.277 7.024 5.503 753 HG11 VAL 108 HG11 VAL 108 12.608 4.860 6.296 754 HG12 VAL 108 HG12 VAL 108 14.237 5.226 6.875 755 HG13 VAL 108 HG13 VAL 108 14.010 4.107 5.529 756 HG21 VAL 108 HG21 VAL 108 15.617 5.680 4.165 757 HG22 VAL 108 HG22 VAL 108 15.708 6.691 5.608 758 HG23 VAL 108 HG23 VAL 108 15.191 7.389 4.073 759 H ASP 109 H ASP 109 13.243 6.149 1.299 760 HA ASP 109 HA ASP 109 13.808 3.523 0.495 761 HB2 ASP 109 HB2 ASP 109 12.952 5.227 -1.039 762 HB3 ASP 109 HB3 ASP 109 14.447 6.145 -0.875 763 H ASN 110 H ASN 110 15.817 2.775 -0.548 764 HA ASN 110 HA ASN 110 18.158 3.660 1.021 765 HB2 ASN 110 HB2 ASN 110 17.374 0.938 -0.010 766 HB3 ASN 110 HB3 ASN 110 19.027 1.301 0.464 767 HD21 ASN 110 HD22 ASN 110 16.257 2.680 2.104 768 HD22 ASN 110 HD21 ASN 110 16.445 1.787 3.571 769 H ALA 111 H ALA 111 16.862 3.804 -2.020 770 HA ALA 111 HA ALA 111 19.485 3.679 -3.354 771 HB1 ALA 111 HB1 ALA 111 16.721 3.728 -4.570 772 HB2 ALA 111 HB2 ALA 111 17.726 2.296 -4.346 773 HB3 ALA 111 HB3 ALA 111 18.241 3.569 -5.451 774 H PHE 112 H PHE 112 16.514 5.662 -3.515 775 HA PHE 112 HA PHE 112 17.625 7.892 -4.783 776 HB2 PHE 112 HB2 PHE 112 15.231 7.655 -4.578 777 HB3 PHE 112 HB3 PHE 112 15.329 7.655 -2.822 778 HD1 PHE 112 HD2 PHE 112 15.506 9.727 -5.843 779 HD2 PHE 112 HD1 PHE 112 15.517 9.707 -1.581 780 HE1 PHE 112 HE2 PHE 112 15.144 12.159 -5.831 781 HE2 PHE 112 HE1 PHE 112 15.147 12.137 -1.572 782 HZ PHE 112 HZ PHE 112 14.968 13.364 -3.695 783 H THR 113 H THR 113 17.054 7.341 -1.346 784 HA THR 113 HA THR 113 18.201 9.639 -0.304 785 HB THR 113 HB THR 113 18.417 7.037 1.152 786 HG1 THR 113 HG1 THR 113 16.292 6.708 1.103 787 HG21 THR 113 HG21 THR 113 17.666 8.306 3.008 788 HG22 THR 113 HG22 THR 113 17.123 9.622 1.970 789 HG23 THR 113 HG23 THR 113 18.850 9.320 2.178 790 H ASN 114 H ASN 114 19.686 6.800 -1.605 791 HA ASN 114 HA ASN 114 22.233 7.222 -0.287 792 HB2 ASN 114 HB2 ASN 114 21.729 4.950 -0.541 793 HB3 ASN 114 HB3 ASN 114 21.116 5.166 -2.173 794 HD21 ASN 114 HD22 ASN 114 22.470 4.947 -3.871 795 HD22 ASN 114 HD21 ASN 114 24.144 4.543 -3.722 796 H GLU 115 H GLU 115 20.993 7.335 -3.654 797 HA GLU 115 HA GLU 115 23.435 8.096 -4.763 798 HB2 GLU 115 HB2 GLU 115 21.590 7.048 -6.013 799 HB3 GLU 115 HB3 GLU 115 20.635 8.516 -5.807 800 HG2 GLU 115 HG2 GLU 115 22.243 9.772 -7.029 801 HG3 GLU 115 HG3 GLU 115 23.283 8.365 -7.167 802 H VAL 116 H VAL 116 20.606 9.972 -3.679 803 HA VAL 116 HA VAL 116 21.514 12.473 -4.582 804 HB VAL 116 HB VAL 116 19.188 12.012 -3.765 805 HG11 VAL 116 HG11 VAL 116 18.707 12.267 -1.367 806 HG12 VAL 116 HG12 VAL 116 20.440 12.229 -1.040 807 HG13 VAL 116 HG13 VAL 116 19.642 10.814 -1.727 808 HG21 VAL 116 HG21 VAL 116 19.907 14.279 -4.161 809 HG22 VAL 116 HG22 VAL 116 20.599 14.373 -2.544 810 HG23 VAL 116 HG23 VAL 116 18.854 14.227 -2.750 811 H MET 117 H MET 117 22.100 10.703 -1.596 812 HA MET 117 HA MET 117 23.488 12.684 -0.199 813 HB2 MET 117 HB2 MET 117 23.142 9.788 -0.011 814 HB3 MET 117 HB3 MET 117 24.686 10.339 0.610 815 HG2 MET 117 HG2 MET 117 22.038 11.476 1.473 816 HG3 MET 117 HG3 MET 117 22.842 10.140 2.290 817 HE1 MET 117 HE1 MET 117 23.720 14.578 2.661 818 HE2 MET 117 HE2 MET 117 22.387 13.784 1.821 819 HE3 MET 117 HE3 MET 117 23.960 13.936 1.040 820 H GLN 118 H GLN 118 24.701 10.115 -2.314 821 HA GLN 118 HA GLN 118 27.437 10.772 -2.081 822 HB2 GLN 118 HB2 GLN 118 26.705 8.589 -2.866 823 HB3 GLN 118 HB3 GLN 118 25.941 9.317 -4.270 824 HG2 GLN 118 HG2 GLN 118 28.108 9.994 -5.127 825 HG3 GLN 118 HG3 GLN 118 28.897 9.332 -3.696 826 HE21 GLN 118 HE22 GLN 118 29.080 7.119 -3.463 827 HE22 GLN 118 HE21 GLN 118 28.796 6.018 -4.767 828 H LEU 119 H LEU 119 24.977 11.663 -4.469 829 HA LEU 119 HA LEU 119 26.677 13.065 -6.196 830 HB2 LEU 119 HB2 LEU 119 23.734 13.068 -5.707 831 HB3 LEU 119 HB3 LEU 119 24.430 14.301 -6.740 832 HG LEU 119 HG LEU 119 24.947 11.383 -7.249 833 HD11 LEU 119 HD11 LEU 119 23.075 11.352 -8.771 834 HD12 LEU 119 HD12 LEU 119 22.695 13.033 -8.398 835 HD13 LEU 119 HD13 LEU 119 22.491 11.789 -7.164 836 HD21 LEU 119 HD21 LEU 119 24.940 13.825 -9.020 837 HD22 LEU 119 HD22 LEU 119 25.347 12.182 -9.512 838 HD23 LEU 119 HD23 LEU 119 26.372 13.036 -8.361 839 H VAL 120 H VAL 120 24.728 14.244 -3.437 840 HA VAL 120 HA VAL 120 25.276 16.956 -3.684 841 HB VAL 120 HB VAL 120 25.017 15.365 -1.122 842 HG11 VAL 120 HG11 VAL 120 24.521 17.510 -0.044 843 HG12 VAL 120 HG12 VAL 120 24.878 18.347 -1.554 844 HG13 VAL 120 HG13 VAL 120 26.155 17.481 -0.703 845 HG21 VAL 120 HG21 VAL 120 22.731 16.183 -1.099 846 HG22 VAL 120 HG22 VAL 120 23.048 15.288 -2.586 847 HG23 VAL 120 HG23 VAL 120 23.010 17.051 -2.608 848 H LYS 121 H LYS 121 27.148 14.525 -1.853 849 HA LYS 121 HA LYS 121 29.236 16.166 -1.030 850 HB2 LYS 121 HB2 LYS 121 28.951 13.237 -1.516 851 HB3 LYS 121 HB3 LYS 121 30.559 13.885 -1.248 852 HG2 LYS 121 HG2 LYS 121 29.529 12.998 0.789 853 HG3 LYS 121 HG3 LYS 121 29.934 14.707 0.914 854 HD2 LYS 121 HD2 LYS 121 27.184 13.992 0.039 855 HD3 LYS 121 HD3 LYS 121 27.600 13.732 1.732 856 HE2 LYS 121 HE2 LYS 121 28.414 16.133 1.762 857 HE3 LYS 121 HE3 LYS 121 27.663 16.313 0.180 858 HZ1 LYS 121 HZ1 LYS 121 25.541 15.715 1.151 859 HZ2 LYS 121 HZ2 LYS 121 26.197 17.056 1.941 860 HZ3 LYS 121 HZ3 LYS 121 26.256 15.532 2.672 861 H MET 122 H MET 122 28.994 14.211 -3.984 862 HA MET 122 HA MET 122 31.590 14.842 -4.899 863 HB2 MET 122 HB2 MET 122 30.379 12.848 -5.620 864 HB3 MET 122 HB3 MET 122 29.165 13.851 -6.400 865 HG2 MET 122 HG2 MET 122 30.804 14.643 -7.997 866 HG3 MET 122 HG3 MET 122 32.067 13.718 -7.186 867 HE1 MET 122 HE1 MET 122 28.642 13.484 -9.067 868 HE2 MET 122 HE2 MET 122 28.360 12.405 -7.700 869 HE3 MET 122 HE3 MET 122 28.480 11.750 -9.334 870 H LEU 123 H LEU 123 28.516 16.438 -5.268 871 HA LEU 123 HA LEU 123 29.542 18.201 -7.336 872 HB2 LEU 123 HB2 LEU 123 26.876 18.140 -5.925 873 HB3 LEU 123 HB3 LEU 123 27.278 19.198 -7.263 874 HG LEU 123 HG LEU 123 27.259 16.183 -7.445 875 HD11 LEU 123 HD11 LEU 123 25.165 18.171 -8.320 876 HD12 LEU 123 HD12 LEU 123 25.012 17.018 -6.993 877 HD13 LEU 123 HD13 LEU 123 25.150 16.438 -8.654 878 HD21 LEU 123 HD21 LEU 123 27.365 18.315 -9.574 879 HD22 LEU 123 HD22 LEU 123 27.307 16.575 -9.847 880 HD23 LEU 123 HD23 LEU 123 28.713 17.298 -9.065 881 H SER 124 H SER 124 29.993 18.102 -4.101 882 HA SER 124 HA SER 124 30.007 21.046 -3.916 883 HB2 SER 124 HB2 SER 124 29.588 20.789 -1.459 884 HB3 SER 124 HB3 SER 124 28.244 20.288 -2.478 885 HG SER 124 HG SER 124 28.739 18.175 -2.107 886 H ALA 125 H ALA 125 31.647 18.063 -3.159 887 HA ALA 125 HA ALA 125 33.722 19.319 -1.657 888 HB1 ALA 125 HB1 ALA 125 34.838 17.164 -1.762 889 HB2 ALA 125 HB2 ALA 125 33.630 16.596 -2.915 890 HB3 ALA 125 HB3 ALA 125 33.152 17.003 -1.267 891 H ASP 126 H ASP 126 34.405 20.931 -2.971 892 HA ASP 126 HA ASP 126 35.716 20.307 -5.486 893 HB2 ASP 126 HB2 ASP 126 34.355 22.375 -5.271 894 HB3 ASP 126 HB3 ASP 126 35.465 22.955 -4.037 895 H SER 127 H SER 127 37.080 18.857 -4.134 896 HA SER 127 HA SER 127 39.033 18.242 -3.205 897 HB2 SER 127 HB2 SER 127 39.772 20.972 -4.201 898 HB3 SER 127 HB3 SER 127 40.946 19.837 -3.538 899 HG SER 127 HG SER 127 40.308 19.968 -5.991 900 H ALA 128 H ALA 128 36.978 19.978 -1.712 901 HA ALA 128 HA ALA 128 38.491 21.404 0.243 902 HB1 ALA 128 HB1 ALA 128 36.230 22.103 -0.353 903 HB2 ALA 128 HB2 ALA 128 36.345 21.739 1.369 904 HB3 ALA 128 HB3 ALA 128 35.586 20.584 0.272 905 H ASN 129 H ASN 129 39.903 19.998 1.161 906 HA ASN 129 HA ASN 129 38.779 18.232 3.192 907 HB2 ASN 129 HB2 ASN 129 39.308 16.788 1.220 908 HB3 ASN 129 HB3 ASN 129 40.974 17.342 1.302 909 HD21 ASN 129 HD22 ASN 129 39.969 14.655 1.487 910 HD22 ASN 129 HD21 ASN 129 40.473 14.039 3.021 911 H GLU 130 H GLU 130 41.821 19.236 1.743 912 HA GLU 130 HA GLU 130 43.175 19.486 4.245 913 HB2 GLU 130 HB2 GLU 130 44.345 18.911 2.141 914 HB3 GLU 130 HB3 GLU 130 43.931 20.489 1.490 915 HG2 GLU 130 HG2 GLU 130 46.224 20.454 2.237 916 HG3 GLU 130 HG3 GLU 130 45.270 21.560 3.224 917 H VAL 131 H VAL 131 43.161 21.202 5.571 918 HA VAL 131 HA VAL 131 41.647 23.538 4.891 919 HB VAL 131 HB VAL 131 43.444 23.119 7.289 920 HG11 VAL 131 HG11 VAL 131 42.019 24.855 8.326 921 HG12 VAL 131 HG12 VAL 131 41.222 25.090 6.770 922 HG13 VAL 131 HG13 VAL 131 42.938 25.454 6.945 923 HG21 VAL 131 HG21 VAL 131 40.489 22.609 6.989 924 HG22 VAL 131 HG22 VAL 131 41.401 22.502 8.493 925 HG23 VAL 131 HG23 VAL 131 41.741 21.386 7.173 926 H SER 132 H SER 132 42.645 24.449 3.133 927 HA SER 132 HA SER 132 45.128 25.881 3.749 928 HB2 SER 132 HB2 SER 132 45.443 23.885 2.166 929 HB3 SER 132 HB3 SER 132 44.495 24.798 0.996 930 HG SER 132 HG SER 132 46.202 26.532 1.642 931 H THR 133 H THR 133 43.879 27.661 4.275 932 HA THR 133 HA THR 133 43.004 29.204 1.976 933 HB THR 133 HB THR 133 40.912 28.228 2.730 934 HG1 THR 133 HG1 THR 133 40.816 30.418 2.096 935 HG21 THR 133 HG21 THR 133 41.495 27.652 5.013 936 HG22 THR 133 HG22 THR 133 40.030 28.636 4.988 937 HG23 THR 133 HG23 THR 133 41.571 29.360 5.444 Start of MODEL 15 1 HA2 GLY 1 HA2 GLY 1 5.242 -3.273 -0.357 2 HA3 GLY 1 HA3 GLY 1 4.733 -2.144 -1.603 3 H SER 2 H SER 2 7.065 -3.685 -1.789 4 HA SER 2 HA SER 2 9.251 -1.812 -1.255 5 HB2 SER 2 HB2 SER 2 9.350 -4.634 -2.360 6 HB3 SER 2 HB3 SER 2 10.729 -3.667 -1.836 7 HG SER 2 HG SER 2 8.664 -4.807 -0.278 8 H GLY 3 H GLY 3 9.799 -0.395 -2.790 9 HA2 GLY 3 HA2 GLY 3 9.222 -1.132 -5.592 10 HA3 GLY 3 HA3 GLY 3 8.969 0.489 -4.964 11 H ASN 4 H ASN 4 11.262 -1.791 -6.166 12 HA ASN 4 HA ASN 4 13.616 -0.296 -5.630 13 HB2 ASN 4 HB2 ASN 4 13.029 -2.359 -7.768 14 HB3 ASN 4 HB3 ASN 4 14.622 -1.677 -7.469 15 HD21 ASN 4 HD22 ASN 4 15.519 -3.633 -6.951 16 HD22 ASN 4 HD21 ASN 4 15.160 -4.471 -5.480 17 H SER 5 H SER 5 11.119 -0.092 -7.977 18 HA SER 5 HA SER 5 12.530 2.122 -9.296 19 HB2 SER 5 HB2 SER 5 11.006 1.550 -11.279 20 HB3 SER 5 HB3 SER 5 12.319 0.420 -10.944 21 HG SER 5 HG SER 5 9.612 0.134 -10.123 22 H GLN 6 H GLN 6 11.088 3.838 -10.085 23 HA GLN 6 HA GLN 6 9.574 5.465 -9.712 24 HB2 GLN 6 HB2 GLN 6 7.872 3.780 -10.273 25 HB3 GLN 6 HB3 GLN 6 7.843 3.245 -8.599 26 HG2 GLN 6 HG2 GLN 6 7.036 5.444 -7.909 27 HG3 GLN 6 HG3 GLN 6 7.064 5.977 -9.590 28 HE21 GLN 6 HE22 GLN 6 5.484 5.258 -10.997 29 HE22 GLN 6 HE21 GLN 6 4.056 4.446 -10.465 30 HA PRO 7 HA PRO 7 11.041 5.905 -5.440 31 HB2 PRO 7 HB2 PRO 7 12.046 8.375 -5.709 32 HB3 PRO 7 HB3 PRO 7 12.888 6.959 -6.353 33 HG2 PRO 7 HG2 PRO 7 11.192 8.967 -7.778 34 HG3 PRO 7 HG3 PRO 7 12.720 8.229 -8.291 35 HD2 PRO 7 HD2 PRO 7 10.230 7.408 -9.145 36 HD3 PRO 7 HD3 PRO 7 11.674 6.374 -9.125 37 H ILE 8 H ILE 8 10.925 8.234 -4.116 38 HA ILE 8 HA ILE 8 8.172 8.331 -3.443 39 HB ILE 8 HB ILE 8 9.916 8.491 -1.750 40 HG12 ILE 8 HG12 ILE 8 8.485 11.145 -1.730 41 HG13 ILE 8 HG13 ILE 8 7.619 9.634 -1.486 42 HG21 ILE 8 HG21 ILE 8 11.576 9.709 -3.033 43 HG22 ILE 8 HG22 ILE 8 11.263 10.516 -1.495 44 HG23 ILE 8 HG23 ILE 8 10.574 11.158 -2.986 45 HD11 ILE 8 HD11 ILE 8 9.854 10.706 0.216 46 HD12 ILE 8 HD12 ILE 8 9.046 9.158 0.455 47 HD13 ILE 8 HD13 ILE 8 8.140 10.662 0.632 48 H TRP 9 H TRP 9 9.771 9.918 -5.880 49 HA TRP 9 HA TRP 9 8.426 12.456 -5.758 50 HB2 TRP 9 HB2 TRP 9 9.812 11.085 -8.071 51 HB3 TRP 9 HB3 TRP 9 9.265 12.754 -8.064 52 HD1 TRP 9 HD1 TRP 9 12.224 10.668 -7.349 53 HE1 TRP 9 HE1 TRP 9 14.079 12.069 -6.248 54 HE3 TRP 9 HE3 TRP 9 9.501 14.837 -6.204 55 HZ2 TRP 9 HZ2 TRP 9 14.346 14.612 -5.054 56 HZ3 TRP 9 HZ3 TRP 9 10.634 16.715 -5.089 57 HH2 TRP 9 HH2 TRP 9 13.007 16.604 -4.525 58 H THR 10 H THR 10 6.772 9.935 -5.695 59 HA THR 10 HA THR 10 5.538 9.666 -8.264 60 HB THR 10 HB THR 10 4.126 8.734 -5.808 61 HG1 THR 10 HG1 THR 10 6.728 8.018 -6.549 62 HG21 THR 10 HG21 THR 10 4.758 7.471 -8.477 63 HG22 THR 10 HG22 THR 10 3.242 8.260 -8.043 64 HG23 THR 10 HG23 THR 10 3.727 6.775 -7.228 65 H ASN 11 H ASN 11 4.636 11.247 -5.208 66 HA ASN 11 HA ASN 11 2.651 12.763 -6.719 67 HB2 ASN 11 HB2 ASN 11 1.009 12.575 -4.991 68 HB3 ASN 11 HB3 ASN 11 1.527 10.956 -5.410 69 HD21 ASN 11 HD22 ASN 11 1.281 13.322 -2.966 70 HD22 ASN 11 HD21 ASN 11 1.907 12.365 -1.667 71 HA PRO 12 HA PRO 12 4.794 16.382 -5.528 72 HB2 PRO 12 HB2 PRO 12 1.983 17.320 -5.118 73 HB3 PRO 12 HB3 PRO 12 3.320 18.115 -5.955 74 HG2 PRO 12 HG2 PRO 12 1.394 16.828 -7.302 75 HG3 PRO 12 HG3 PRO 12 3.079 16.829 -7.850 76 HD2 PRO 12 HD2 PRO 12 1.492 14.635 -6.685 77 HD3 PRO 12 HD3 PRO 12 2.948 14.565 -7.689 78 H ASN 13 H ASN 13 1.900 15.770 -3.523 79 HA ASN 13 HA ASN 13 2.661 17.381 -1.381 80 HB2 ASN 13 HB2 ASN 13 0.381 16.482 -1.724 81 HB3 ASN 13 HB3 ASN 13 0.958 14.883 -1.268 82 HD21 ASN 13 HD22 ASN 13 -0.401 14.727 0.493 83 HD22 ASN 13 HD21 ASN 13 -0.182 15.663 1.929 84 H ALA 14 H ALA 14 3.430 14.019 -2.051 85 HA ALA 14 HA ALA 14 4.409 13.401 0.547 86 HB1 ALA 14 HB1 ALA 14 4.960 12.047 -2.093 87 HB2 ALA 14 HB2 ALA 14 3.620 11.685 -1.007 88 HB3 ALA 14 HB3 ALA 14 5.280 11.369 -0.495 89 H ALA 15 H ALA 15 5.972 14.276 -2.500 90 HA ALA 15 HA ALA 15 8.623 14.048 -1.499 91 HB1 ALA 15 HB1 ALA 15 9.303 15.031 -3.610 92 HB2 ALA 15 HB2 ALA 15 7.643 15.534 -3.937 93 HB3 ALA 15 HB3 ALA 15 8.052 13.818 -3.883 94 H MET 16 H MET 16 6.396 16.745 -1.953 95 HA MET 16 HA MET 16 8.146 18.816 -1.276 96 HB2 MET 16 HB2 MET 16 5.357 18.486 -1.758 97 HB3 MET 16 HB3 MET 16 5.540 19.407 -0.272 98 HG2 MET 16 HG2 MET 16 6.843 20.114 -2.887 99 HG3 MET 16 HG3 MET 16 5.304 20.760 -2.336 100 HE1 MET 16 HE1 MET 16 9.485 22.090 -1.126 101 HE2 MET 16 HE2 MET 16 8.972 21.219 -2.571 102 HE3 MET 16 HE3 MET 16 9.119 20.371 -1.033 103 H THR 17 H THR 17 6.184 16.670 0.695 104 HA THR 17 HA THR 17 6.477 17.929 3.162 105 HB THR 17 HB THR 17 6.121 14.995 2.521 106 HG1 THR 17 HG1 THR 17 4.353 16.201 1.859 107 HG21 THR 17 HG21 THR 17 5.863 16.455 5.159 108 HG22 THR 17 HG22 THR 17 6.992 15.157 4.772 109 HG23 THR 17 HG23 THR 17 5.263 14.824 4.861 110 H MET 18 H MET 18 8.587 15.527 1.578 111 HA MET 18 HA MET 18 10.421 15.129 3.667 112 HB2 MET 18 HB2 MET 18 11.215 15.386 0.774 113 HB3 MET 18 HB3 MET 18 12.024 14.462 2.025 114 HG2 MET 18 HG2 MET 18 10.186 12.888 2.072 115 HG3 MET 18 HG3 MET 18 9.329 13.839 0.854 116 HE1 MET 18 HE1 MET 18 10.527 14.441 -1.536 117 HE2 MET 18 HE2 MET 18 11.946 13.592 -2.141 118 HE3 MET 18 HE3 MET 18 12.107 14.742 -0.811 119 H THR 19 H THR 19 10.280 17.509 1.093 120 HA THR 19 HA THR 19 12.785 18.609 1.263 121 HB THR 19 HB THR 19 10.432 20.361 0.691 122 HG1 THR 19 HG1 THR 19 11.347 18.156 -0.883 123 HG21 THR 19 HG21 THR 19 12.740 21.177 0.401 124 HG22 THR 19 HG22 THR 19 11.841 21.121 -1.114 125 HG23 THR 19 HG23 THR 19 13.031 19.866 -0.747 126 H ASN 20 H ASN 20 9.854 19.935 2.865 127 HA ASN 20 HA ASN 20 11.382 21.965 4.164 128 HB2 ASN 20 HB2 ASN 20 9.181 22.263 5.492 129 HB3 ASN 20 HB3 ASN 20 9.200 22.642 3.775 130 HD21 ASN 20 HD22 ASN 20 8.004 21.468 2.392 131 HD22 ASN 20 HD21 ASN 20 6.916 20.223 2.871 132 H ASN 21 H ASN 21 10.572 18.703 4.994 133 HA ASN 21 HA ASN 21 11.014 18.964 7.798 134 HB2 ASN 21 HB2 ASN 21 10.818 16.681 5.898 135 HB3 ASN 21 HB3 ASN 21 11.650 16.392 7.420 136 HD21 ASN 21 HD22 ASN 21 8.627 17.044 5.894 137 HD22 ASN 21 HD21 ASN 21 7.635 16.788 7.288 138 H LEU 22 H LEU 22 13.064 18.307 5.023 139 HA LEU 22 HA LEU 22 15.461 17.836 6.438 140 HB2 LEU 22 HB2 LEU 22 15.208 17.315 4.058 141 HB3 LEU 22 HB3 LEU 22 15.024 19.019 3.689 142 HG LEU 22 HG LEU 22 17.346 19.403 4.491 143 HD11 LEU 22 HD11 LEU 22 17.568 17.511 5.992 144 HD12 LEU 22 HD12 LEU 22 18.824 17.454 4.753 145 HD13 LEU 22 HD13 LEU 22 17.421 16.391 4.638 146 HD21 LEU 22 HD21 LEU 22 17.009 17.389 2.274 147 HD22 LEU 22 HD22 LEU 22 18.441 18.385 2.541 148 HD23 LEU 22 HD23 LEU 22 16.903 19.143 2.127 149 H VAL 23 H VAL 23 13.923 20.746 5.196 150 HA VAL 23 HA VAL 23 15.952 22.575 5.884 151 HB VAL 23 HB VAL 23 12.978 23.069 5.622 152 HG11 VAL 23 HG11 VAL 23 14.117 24.876 6.801 153 HG12 VAL 23 HG12 VAL 23 13.605 25.396 5.195 154 HG13 VAL 23 HG13 VAL 23 15.297 24.996 5.497 155 HG21 VAL 23 HG21 VAL 23 15.197 23.282 3.589 156 HG22 VAL 23 HG22 VAL 23 13.523 23.772 3.330 157 HG23 VAL 23 HG23 VAL 23 13.912 22.074 3.610 158 H GLN 24 H GLN 24 13.028 21.526 7.620 159 HA GLN 24 HA GLN 24 13.427 23.312 9.791 160 HB2 GLN 24 HB2 GLN 24 11.615 22.185 10.875 161 HB3 GLN 24 HB3 GLN 24 11.231 22.312 9.168 162 HG2 GLN 24 HG2 GLN 24 10.667 20.172 9.351 163 HG3 GLN 24 HG3 GLN 24 12.401 19.869 9.255 164 HE21 GLN 24 HE22 GLN 24 9.630 20.052 11.317 165 HE22 GLN 24 HE21 GLN 24 10.326 19.258 12.683 166 H CYS 25 H CYS 25 14.639 20.158 9.039 167 HA CYS 25 HA CYS 25 15.550 19.596 11.705 168 HB2 CYS 25 HB2 CYS 25 15.007 17.797 10.094 169 HB3 CYS 25 HB3 CYS 25 16.347 18.321 9.078 170 H ALA 26 H ALA 26 17.030 20.765 8.691 171 HA ALA 26 HA ALA 26 19.672 20.796 9.756 172 HB1 ALA 26 HB1 ALA 26 19.195 20.582 7.350 173 HB2 ALA 26 HB2 ALA 26 20.296 21.911 7.705 174 HB3 ALA 26 HB3 ALA 26 18.605 22.244 7.337 175 H SER 27 H SER 27 17.053 23.077 9.808 176 HA SER 27 HA SER 27 18.624 25.411 10.175 177 HB2 SER 27 HB2 SER 27 16.420 26.359 11.070 178 HB3 SER 27 HB3 SER 27 16.423 25.775 9.405 179 HG SER 27 HG SER 27 15.091 24.228 9.941 180 H ARG 28 H ARG 28 17.103 23.151 12.436 181 HA ARG 28 HA ARG 28 18.348 24.662 14.613 182 HB2 ARG 28 HB2 ARG 28 16.814 23.212 16.067 183 HB3 ARG 28 HB3 ARG 28 16.112 24.531 15.147 184 HG2 ARG 28 HG2 ARG 28 14.666 22.647 14.995 185 HG3 ARG 28 HG3 ARG 28 15.422 22.891 13.422 186 HD2 ARG 28 HD2 ARG 28 16.977 21.103 13.852 187 HD3 ARG 28 HD3 ARG 28 16.352 20.912 15.486 188 HE ARG 28 HE ARG 28 14.385 20.597 13.391 189 HH11 ARG 28 HH11 ARG 28 16.713 19.000 15.463 190 HH12 ARG 28 HH12 ARG 28 16.025 17.425 15.232 191 HH21 ARG 28 HH21 ARG 28 13.497 18.529 13.051 192 HH22 ARG 28 HH22 ARG 28 14.202 17.149 13.841 193 H SER 29 H SER 29 19.489 22.577 12.741 194 HA SER 29 HA SER 29 20.197 20.320 14.249 195 HB2 SER 29 HB2 SER 29 22.029 20.055 12.606 196 HB3 SER 29 HB3 SER 29 20.489 20.409 11.820 197 HG SER 29 HG SER 29 21.235 22.290 11.165 198 H GLY 30 H GLY 30 21.991 23.305 13.572 199 HA2 GLY 30 HA2 GLY 30 23.039 24.521 15.386 200 HA3 GLY 30 HA3 GLY 30 23.373 22.971 16.150 201 H VAL 31 H VAL 31 23.893 22.375 13.020 202 HA VAL 31 HA VAL 31 26.763 22.848 13.350 203 HB VAL 31 HB VAL 31 25.843 20.511 13.013 204 HG11 VAL 31 HG11 VAL 31 25.558 21.437 10.168 205 HG12 VAL 31 HG12 VAL 31 24.238 20.995 11.254 206 HG13 VAL 31 HG13 VAL 31 25.409 19.775 10.745 207 HG21 VAL 31 HG21 VAL 31 27.947 21.548 11.127 208 HG22 VAL 31 HG22 VAL 31 27.715 19.854 11.559 209 HG23 VAL 31 HG23 VAL 31 28.191 21.022 12.792 210 H LEU 32 H LEU 32 24.073 23.462 11.175 211 HA LEU 32 HA LEU 32 25.720 24.813 9.228 212 HB2 LEU 32 HB2 LEU 32 22.723 24.697 9.612 213 HB3 LEU 32 HB3 LEU 32 23.484 25.662 8.365 214 HG LEU 32 HG LEU 32 24.541 23.403 7.610 215 HD11 LEU 32 HD11 LEU 32 22.145 22.419 9.142 216 HD12 LEU 32 HD12 LEU 32 23.829 22.114 9.558 217 HD13 LEU 32 HD13 LEU 32 23.157 21.460 8.065 218 HD21 LEU 32 HD21 LEU 32 22.606 22.970 6.186 219 HD22 LEU 32 HD22 LEU 32 22.936 24.698 6.307 220 HD23 LEU 32 HD23 LEU 32 21.607 23.988 7.223 221 H THR 33 H THR 33 25.258 27.171 8.722 222 HA THR 33 HA THR 33 24.941 28.634 11.249 223 HB THR 33 HB THR 33 27.035 29.126 10.103 224 HG1 THR 33 HG1 THR 33 26.076 30.850 11.222 225 HG21 THR 33 HG21 THR 33 25.318 30.045 7.798 226 HG22 THR 33 HG22 THR 33 26.392 28.646 7.808 227 HG23 THR 33 HG23 THR 33 27.062 30.270 7.930 228 H ALA 34 H ALA 34 23.800 30.749 11.079 229 HA ALA 34 HA ALA 34 21.172 30.430 10.221 230 HB1 ALA 34 HB1 ALA 34 22.663 33.004 10.710 231 HB2 ALA 34 HB2 ALA 34 21.832 32.039 11.930 232 HB3 ALA 34 HB3 ALA 34 20.912 32.822 10.646 233 H ASP 35 H ASP 35 23.956 31.803 8.612 234 HA ASP 35 HA ASP 35 22.389 32.745 6.356 235 HB2 ASP 35 HB2 ASP 35 25.356 32.825 6.933 236 HB3 ASP 35 HB3 ASP 35 24.602 33.527 5.504 237 H GLN 36 H GLN 36 22.732 29.877 7.095 238 HA GLN 36 HA GLN 36 23.394 28.950 4.394 239 HB2 GLN 36 HB2 GLN 36 25.247 28.443 6.003 240 HB3 GLN 36 HB3 GLN 36 24.112 27.478 6.936 241 HG2 GLN 36 HG2 GLN 36 23.805 26.001 5.012 242 HG3 GLN 36 HG3 GLN 36 24.956 26.970 4.097 243 HE21 GLN 36 HE22 GLN 36 26.341 25.239 3.796 244 HE22 GLN 36 HE21 GLN 36 27.322 24.609 5.079 245 H MET 37 H MET 37 21.754 28.411 7.450 246 HA MET 37 HA MET 37 20.040 26.340 6.481 247 HB2 MET 37 HB2 MET 37 18.864 26.615 8.610 248 HB3 MET 37 HB3 MET 37 20.603 26.541 8.857 249 HG2 MET 37 HG2 MET 37 20.630 29.017 8.986 250 HG3 MET 37 HG3 MET 37 18.873 29.003 8.888 251 HE1 MET 37 HE1 MET 37 22.007 27.944 10.966 252 HE2 MET 37 HE2 MET 37 21.151 26.406 10.834 253 HE3 MET 37 HE3 MET 37 21.281 27.212 12.397 254 H ASP 38 H ASP 38 19.948 29.803 6.442 255 HA ASP 38 HA ASP 38 17.114 30.071 6.208 256 HB2 ASP 38 HB2 ASP 38 18.563 31.898 7.013 257 HB3 ASP 38 HB3 ASP 38 19.309 32.000 5.424 258 H ASP 39 H ASP 39 19.787 29.839 3.938 259 HA ASP 39 HA ASP 39 18.285 30.333 1.592 260 HB2 ASP 39 HB2 ASP 39 20.868 28.806 1.988 261 HB3 ASP 39 HB3 ASP 39 20.199 29.247 0.419 262 H MET 40 H MET 40 18.722 27.550 3.596 263 HA MET 40 HA MET 40 17.887 25.505 1.875 264 HB2 MET 40 HB2 MET 40 17.559 25.860 4.855 265 HB3 MET 40 HB3 MET 40 17.095 24.390 4.012 266 HG2 MET 40 HG2 MET 40 19.873 25.495 3.823 267 HG3 MET 40 HG3 MET 40 19.374 24.461 5.159 268 HE1 MET 40 HE1 MET 40 18.574 21.088 3.446 269 HE2 MET 40 HE2 MET 40 17.415 22.357 3.828 270 HE3 MET 40 HE3 MET 40 18.710 21.981 4.961 271 H GLY 41 H GLY 41 16.096 27.933 3.656 272 HA2 GLY 41 HA2 GLY 41 13.522 26.815 3.431 273 HA3 GLY 41 HA3 GLY 41 13.882 28.520 3.658 274 H MET 42 H MET 42 15.194 29.184 1.372 275 HA MET 42 HA MET 42 13.013 29.305 -0.484 276 HB2 MET 42 HB2 MET 42 14.419 30.795 -1.776 277 HB3 MET 42 HB3 MET 42 14.480 31.239 -0.078 278 HG2 MET 42 HG2 MET 42 16.618 29.956 0.086 279 HG3 MET 42 HG3 MET 42 16.563 29.783 -1.666 280 HE1 MET 42 HE1 MET 42 15.485 32.885 0.552 281 HE2 MET 42 HE2 MET 42 16.997 33.789 0.579 282 HE3 MET 42 HE3 MET 42 16.901 32.207 1.353 283 H MET 43 H MET 43 15.761 27.304 -0.075 284 HA MET 43 HA MET 43 16.055 26.315 -2.693 285 HB2 MET 43 HB2 MET 43 17.713 25.817 -1.013 286 HB3 MET 43 HB3 MET 43 16.522 25.031 0.006 287 HG2 MET 43 HG2 MET 43 17.169 23.981 -2.719 288 HG3 MET 43 HG3 MET 43 18.173 23.589 -1.329 289 HE1 MET 43 HE1 MET 43 17.241 22.326 0.838 290 HE2 MET 43 HE2 MET 43 15.605 21.687 0.977 291 HE3 MET 43 HE3 MET 43 15.875 23.431 0.994 292 H ALA 44 H ALA 44 13.966 25.363 -0.006 293 HA ALA 44 HA ALA 44 12.760 23.130 -1.176 294 HB1 ALA 44 HB1 ALA 44 11.595 25.067 0.823 295 HB2 ALA 44 HB2 ALA 44 12.568 23.645 1.196 296 HB3 ALA 44 HB3 ALA 44 10.973 23.454 0.471 297 H ASP 45 H ASP 45 12.119 26.541 -1.509 298 HA ASP 45 HA ASP 45 9.620 26.430 -2.781 299 HB2 ASP 45 HB2 ASP 45 10.511 28.517 -1.913 300 HB3 ASP 45 HB3 ASP 45 11.854 28.448 -3.048 301 H SER 46 H SER 46 12.907 26.314 -4.037 302 HA SER 46 HA SER 46 12.200 26.347 -6.779 303 HB2 SER 46 HB2 SER 46 14.447 26.954 -5.906 304 HB3 SER 46 HB3 SER 46 14.709 25.268 -5.470 305 HG SER 46 HG SER 46 15.643 25.489 -7.431 306 H VAL 47 H VAL 47 12.440 23.843 -4.373 307 HA VAL 47 HA VAL 47 12.682 21.619 -6.084 308 HB VAL 47 HB VAL 47 11.454 21.729 -3.326 309 HG11 VAL 47 HG11 VAL 47 11.987 19.334 -3.226 310 HG12 VAL 47 HG12 VAL 47 12.518 19.384 -4.907 311 HG13 VAL 47 HG13 VAL 47 10.828 19.694 -4.506 312 HG21 VAL 47 HG21 VAL 47 14.272 21.177 -4.238 313 HG22 VAL 47 HG22 VAL 47 13.688 20.963 -2.589 314 HG23 VAL 47 HG23 VAL 47 13.716 22.572 -3.316 315 H ASN 48 H ASN 48 9.758 22.974 -4.491 316 HA ASN 48 HA ASN 48 8.035 21.105 -5.728 317 HB2 ASN 48 HB2 ASN 48 6.193 22.577 -4.984 318 HB3 ASN 48 HB3 ASN 48 7.312 22.179 -3.695 319 HD21 ASN 48 HD22 ASN 48 8.355 23.781 -2.657 320 HD22 ASN 48 HD21 ASN 48 8.145 25.456 -3.007 321 H SER 49 H SER 49 9.349 24.141 -6.769 322 HA SER 49 HA SER 49 7.566 24.715 -8.834 323 HB2 SER 49 HB2 SER 49 10.526 25.279 -8.576 324 HB3 SER 49 HB3 SER 49 9.437 26.049 -9.712 325 HG SER 49 HG SER 49 9.362 26.214 -6.883 326 H GLN 50 H GLN 50 10.705 23.019 -8.912 327 HA GLN 50 HA GLN 50 10.489 22.276 -11.647 328 HB2 GLN 50 HB2 GLN 50 12.246 21.199 -9.437 329 HB3 GLN 50 HB3 GLN 50 12.448 20.830 -11.143 330 HG2 GLN 50 HG2 GLN 50 12.989 23.099 -11.643 331 HG3 GLN 50 HG3 GLN 50 12.560 23.613 -10.011 332 HE21 GLN 50 HE22 GLN 50 13.973 23.229 -8.330 333 HE22 GLN 50 HE21 GLN 50 15.614 22.746 -8.582 334 H MET 51 H MET 51 9.545 20.774 -8.660 335 HA MET 51 HA MET 51 9.396 18.104 -9.565 336 HB2 MET 51 HB2 MET 51 9.603 18.689 -7.192 337 HB3 MET 51 HB3 MET 51 8.014 19.437 -7.233 338 HG2 MET 51 HG2 MET 51 7.830 16.748 -8.188 339 HG3 MET 51 HG3 MET 51 8.654 16.778 -6.630 340 HE1 MET 51 HE1 MET 51 7.653 17.766 -4.445 341 HE2 MET 51 HE2 MET 51 6.045 18.477 -4.298 342 HE3 MET 51 HE3 MET 51 7.308 19.323 -5.195 343 H GLN 52 H GLN 52 6.838 20.531 -8.993 344 HA GLN 52 HA GLN 52 4.754 18.786 -9.764 345 HB2 GLN 52 HB2 GLN 52 4.789 21.802 -9.640 346 HB3 GLN 52 HB3 GLN 52 3.345 20.817 -9.821 347 HG2 GLN 52 HG2 GLN 52 3.830 19.761 -7.647 348 HG3 GLN 52 HG3 GLN 52 5.214 20.839 -7.465 349 HE21 GLN 52 HE22 GLN 52 4.854 23.046 -7.133 350 HE22 GLN 52 HE21 GLN 52 3.324 23.649 -6.599 351 H LYS 53 H LYS 53 6.720 21.092 -11.547 352 HA LYS 53 HA LYS 53 5.242 21.074 -13.929 353 HB2 LYS 53 HB2 LYS 53 7.986 21.853 -13.110 354 HB3 LYS 53 HB3 LYS 53 7.671 21.653 -14.827 355 HG2 LYS 53 HG2 LYS 53 7.430 23.975 -14.071 356 HG3 LYS 53 HG3 LYS 53 5.953 23.318 -14.758 357 HD2 LYS 53 HD2 LYS 53 6.249 23.099 -11.829 358 HD3 LYS 53 HD3 LYS 53 6.021 24.725 -12.478 359 HE2 LYS 53 HE2 LYS 53 4.000 23.918 -13.668 360 HE3 LYS 53 HE3 LYS 53 4.216 22.342 -12.909 361 HZ1 LYS 53 HZ1 LYS 53 3.721 24.901 -11.491 362 HZ2 LYS 53 HZ2 LYS 53 3.963 23.411 -10.745 363 HZ3 LYS 53 HZ3 LYS 53 2.602 23.656 -11.714 364 H MET 54 H MET 54 7.045 18.543 -12.527 365 HA MET 54 HA MET 54 7.878 17.271 -14.918 366 HB2 MET 54 HB2 MET 54 7.300 16.239 -12.147 367 HB3 MET 54 HB3 MET 54 7.860 15.213 -13.446 368 HG2 MET 54 HG2 MET 54 9.823 16.831 -13.652 369 HG3 MET 54 HG3 MET 54 9.305 17.445 -12.083 370 HE1 MET 54 HE1 MET 54 9.305 15.967 -9.833 371 HE2 MET 54 HE2 MET 54 9.690 14.247 -9.812 372 HE3 MET 54 HE3 MET 54 8.239 14.818 -10.641 373 H GLY 55 H GLY 55 4.883 17.319 -13.080 374 HA2 GLY 55 HA2 GLY 55 2.862 17.085 -14.498 375 HA3 GLY 55 HA3 GLY 55 3.651 15.685 -15.210 376 HA PRO 56 HA PRO 56 1.019 14.441 -11.450 377 HB2 PRO 56 HB2 PRO 56 -1.097 13.365 -12.723 378 HB3 PRO 56 HB3 PRO 56 -1.033 15.081 -12.296 379 HG2 PRO 56 HG2 PRO 56 -0.433 13.755 -14.918 380 HG3 PRO 56 HG3 PRO 56 -1.395 15.216 -14.603 381 HD2 PRO 56 HD2 PRO 56 1.172 15.330 -15.451 382 HD3 PRO 56 HD3 PRO 56 0.483 16.546 -14.359 383 H ASN 57 H ASN 57 2.216 13.154 -14.317 384 HA ASN 57 HA ASN 57 2.486 10.517 -13.130 385 HB2 ASN 57 HB2 ASN 57 0.394 10.745 -14.645 386 HB3 ASN 57 HB3 ASN 57 1.550 10.767 -15.974 387 HD21 ASN 57 HD22 ASN 57 0.082 8.895 -13.491 388 HD22 ASN 57 HD21 ASN 57 0.658 7.350 -14.011 389 HA PRO 58 HA PRO 58 6.207 12.181 -15.274 390 HB2 PRO 58 HB2 PRO 58 7.934 11.904 -13.235 391 HB3 PRO 58 HB3 PRO 58 6.823 13.274 -13.340 392 HG2 PRO 58 HG2 PRO 58 6.610 10.785 -11.697 393 HG3 PRO 58 HG3 PRO 58 6.233 12.458 -11.248 394 HD2 PRO 58 HD2 PRO 58 4.357 10.601 -12.000 395 HD3 PRO 58 HD3 PRO 58 4.144 12.351 -12.162 396 HA PRO 59 HA PRO 59 7.584 8.004 -16.180 397 HB2 PRO 59 HB2 PRO 59 9.162 8.665 -18.271 398 HB3 PRO 59 HB3 PRO 59 7.403 8.582 -18.401 399 HG2 PRO 59 HG2 PRO 59 9.172 10.967 -18.088 400 HG3 PRO 59 HG3 PRO 59 7.732 10.761 -19.101 401 HD2 PRO 59 HD2 PRO 59 7.728 12.056 -16.689 402 HD3 PRO 59 HD3 PRO 59 6.305 11.250 -17.376 403 H GLN 60 H GLN 60 9.793 7.009 -16.491 404 HA GLN 60 HA GLN 60 11.169 7.430 -14.115 405 HB2 GLN 60 HB2 GLN 60 11.871 5.875 -16.586 406 HB3 GLN 60 HB3 GLN 60 12.952 5.932 -15.203 407 HG2 GLN 60 HG2 GLN 60 11.679 3.940 -15.035 408 HG3 GLN 60 HG3 GLN 60 11.083 5.048 -13.803 409 HE21 GLN 60 HE22 GLN 60 9.020 5.889 -13.991 410 HE22 GLN 60 HE21 GLN 60 7.852 5.251 -15.094 411 H HIS 61 H HIS 61 11.889 8.682 -17.332 412 HA HIS 61 HA HIS 61 14.546 9.473 -16.743 413 HB2 HIS 61 HB2 HIS 61 14.560 10.610 -18.838 414 HB3 HIS 61 HB3 HIS 61 13.618 9.146 -19.061 415 HD1 HIS 61 HD1 HIS 61 11.279 9.426 -19.979 416 HD2 HIS 61 HD2 HIS 61 12.956 13.024 -18.733 417 HE1 HIS 61 HE1 HIS 61 9.724 11.222 -20.796 418 H ARG 62 H ARG 62 11.592 10.739 -15.729 419 HA ARG 62 HA ARG 62 12.667 13.424 -15.338 420 HB2 ARG 62 HB2 ARG 62 9.942 12.216 -14.932 421 HB3 ARG 62 HB3 ARG 62 10.357 13.779 -14.241 422 HG2 ARG 62 HG2 ARG 62 10.535 13.102 -17.167 423 HG3 ARG 62 HG3 ARG 62 9.179 13.934 -16.406 424 HD2 ARG 62 HD2 ARG 62 10.750 15.702 -15.655 425 HD3 ARG 62 HD3 ARG 62 12.040 14.890 -16.541 426 HE ARG 62 HE ARG 62 9.836 15.417 -18.246 427 HH11 ARG 62 HH11 ARG 62 12.513 17.021 -16.642 428 HH12 ARG 62 HH12 ARG 62 12.620 18.291 -17.816 429 HH21 ARG 62 HH21 ARG 62 9.966 17.095 -19.782 430 HH22 ARG 62 HH22 ARG 62 11.168 18.336 -19.598 431 H LEU 63 H LEU 63 11.397 10.727 -13.381 432 HA LEU 63 HA LEU 63 11.731 11.929 -10.887 433 HB2 LEU 63 HB2 LEU 63 11.859 9.009 -11.629 434 HB3 LEU 63 HB3 LEU 63 11.862 9.593 -9.979 435 HG LEU 63 HG LEU 63 9.658 9.189 -10.113 436 HD11 LEU 63 HD11 LEU 63 8.336 11.104 -10.662 437 HD12 LEU 63 HD12 LEU 63 9.613 11.751 -11.689 438 HD13 LEU 63 HD13 LEU 63 9.853 11.648 -9.946 439 HD21 LEU 63 HD21 LEU 63 9.808 8.075 -12.254 440 HD22 LEU 63 HD22 LEU 63 9.783 9.627 -13.088 441 HD23 LEU 63 HD23 LEU 63 8.367 9.088 -12.188 442 H ARG 64 H ARG 64 13.997 9.914 -12.738 443 HA ARG 64 HA ARG 64 15.933 9.757 -10.694 444 HB2 ARG 64 HB2 ARG 64 17.381 8.792 -12.265 445 HB3 ARG 64 HB3 ARG 64 15.769 8.286 -12.745 446 HG2 ARG 64 HG2 ARG 64 15.810 9.497 -14.666 447 HG3 ARG 64 HG3 ARG 64 16.878 10.735 -13.993 448 HD2 ARG 64 HD2 ARG 64 18.670 8.952 -13.951 449 HD3 ARG 64 HD3 ARG 64 17.592 7.987 -14.960 450 HE ARG 64 HE ARG 64 17.673 9.959 -16.537 451 HH11 ARG 64 HH11 ARG 64 20.323 9.176 -14.374 452 HH12 ARG 64 HH12 ARG 64 21.520 9.936 -15.372 453 HH21 ARG 64 HH21 ARG 64 19.263 10.936 -17.851 454 HH22 ARG 64 HH22 ARG 64 20.920 10.934 -17.337 455 H ALA 65 H ALA 65 15.332 12.143 -13.180 456 HA ALA 65 HA ALA 65 17.889 13.423 -12.852 457 HB1 ALA 65 HB1 ALA 65 17.056 15.048 -14.474 458 HB2 ALA 65 HB2 ALA 65 15.442 14.340 -14.365 459 HB3 ALA 65 HB3 ALA 65 16.775 13.396 -15.031 460 H MET 66 H MET 66 14.692 13.734 -11.518 461 HA MET 66 HA MET 66 14.890 16.386 -10.623 462 HB2 MET 66 HB2 MET 66 12.777 15.191 -10.878 463 HB3 MET 66 HB3 MET 66 13.246 14.079 -9.607 464 HG2 MET 66 HG2 MET 66 11.717 15.686 -8.815 465 HG3 MET 66 HG3 MET 66 13.280 15.863 -8.029 466 HE1 MET 66 HE1 MET 66 12.971 18.270 -7.168 467 HE2 MET 66 HE2 MET 66 11.319 17.873 -7.626 468 HE3 MET 66 HE3 MET 66 11.997 19.446 -8.059 469 H ASN 67 H ASN 67 15.934 13.301 -9.280 470 HA ASN 67 HA ASN 67 16.493 14.149 -6.662 471 HB2 ASN 67 HB2 ASN 67 18.152 12.170 -8.236 472 HB3 ASN 67 HB3 ASN 67 18.033 12.293 -6.488 473 HD21 ASN 67 HD22 ASN 67 16.755 10.962 -9.315 474 HD22 ASN 67 HD21 ASN 67 15.433 10.108 -8.598 475 H THR 68 H THR 68 18.471 14.138 -9.586 476 HA THR 68 HA THR 68 20.793 15.266 -8.535 477 HB THR 68 HB THR 68 19.734 15.719 -11.331 478 HG1 THR 68 HG1 THR 68 21.146 13.482 -10.250 479 HG21 THR 68 HG21 THR 68 22.116 15.743 -11.931 480 HG22 THR 68 HG22 THR 68 22.543 15.523 -10.236 481 HG23 THR 68 HG23 THR 68 21.739 17.003 -10.755 482 H ALA 69 H ALA 69 17.829 16.747 -9.739 483 HA ALA 69 HA ALA 69 18.734 19.409 -9.826 484 HB1 ALA 69 HB1 ALA 69 15.931 18.396 -9.363 485 HB2 ALA 69 HB2 ALA 69 16.684 18.665 -10.936 486 HB3 ALA 69 HB3 ALA 69 16.378 20.029 -9.860 487 H MET 70 H MET 70 16.886 17.695 -7.284 488 HA MET 70 HA MET 70 16.889 19.922 -5.513 489 HB2 MET 70 HB2 MET 70 15.288 17.954 -5.433 490 HB3 MET 70 HB3 MET 70 16.588 17.025 -4.702 491 HG2 MET 70 HG2 MET 70 16.680 18.573 -2.839 492 HG3 MET 70 HG3 MET 70 15.424 19.563 -3.576 493 HE1 MET 70 HE1 MET 70 16.294 16.428 -1.507 494 HE2 MET 70 HE2 MET 70 15.873 15.637 -3.028 495 HE3 MET 70 HE3 MET 70 14.837 15.439 -1.614 496 H ALA 71 H ALA 71 18.914 17.070 -5.863 497 HA ALA 71 HA ALA 71 20.516 17.429 -3.582 498 HB1 ALA 71 HB1 ALA 71 20.478 15.345 -4.844 499 HB2 ALA 71 HB2 ALA 71 22.123 15.958 -4.693 500 HB3 ALA 71 HB3 ALA 71 21.246 16.146 -6.212 501 H ALA 72 H ALA 72 20.718 18.785 -6.832 502 HA ALA 72 HA ALA 72 23.278 19.979 -6.493 503 HB1 ALA 72 HB1 ALA 72 22.762 21.233 -8.508 504 HB2 ALA 72 HB2 ALA 72 21.066 20.768 -8.387 505 HB3 ALA 72 HB3 ALA 72 22.294 19.543 -8.706 506 H GLU 73 H GLU 73 19.952 21.140 -6.105 507 HA GLU 73 HA GLU 73 20.500 23.818 -5.587 508 HB2 GLU 73 HB2 GLU 73 18.266 22.077 -4.543 509 HB3 GLU 73 HB3 GLU 73 18.318 23.826 -4.353 510 HG2 GLU 73 HG2 GLU 73 18.363 22.419 -7.012 511 HG3 GLU 73 HG3 GLU 73 16.900 23.013 -6.234 512 H VAL 74 H VAL 74 20.440 21.058 -3.363 513 HA VAL 74 HA VAL 74 21.073 22.755 -1.110 514 HB VAL 74 HB VAL 74 21.240 20.676 0.206 515 HG11 VAL 74 HG11 VAL 74 18.777 20.864 -1.518 516 HG12 VAL 74 HG12 VAL 74 19.095 21.781 -0.046 517 HG13 VAL 74 HG13 VAL 74 18.884 20.032 0.034 518 HG21 VAL 74 HG21 VAL 74 20.622 18.535 -0.809 519 HG22 VAL 74 HG22 VAL 74 22.110 19.181 -1.500 520 HG23 VAL 74 HG23 VAL 74 20.597 19.301 -2.397 521 H ALA 75 H ALA 75 22.829 20.718 -3.362 522 HA ALA 75 HA ALA 75 25.221 20.409 -1.952 523 HB1 ALA 75 HB1 ALA 75 26.284 20.067 -4.123 524 HB2 ALA 75 HB2 ALA 75 24.863 20.728 -4.929 525 HB3 ALA 75 HB3 ALA 75 24.742 19.216 -4.029 526 H GLU 76 H GLU 76 24.045 23.058 -3.935 527 HA GLU 76 HA GLU 76 26.362 24.601 -4.055 528 HB2 GLU 76 HB2 GLU 76 23.496 25.551 -3.911 529 HB3 GLU 76 HB3 GLU 76 24.863 26.500 -4.472 530 HG2 GLU 76 HG2 GLU 76 23.874 23.972 -5.764 531 HG3 GLU 76 HG3 GLU 76 23.496 25.607 -6.302 532 H VAL 77 H VAL 77 23.846 24.457 -1.550 533 HA VAL 77 HA VAL 77 25.063 26.625 -0.080 534 HB VAL 77 HB VAL 77 22.569 26.162 -0.143 535 HG11 VAL 77 HG11 VAL 77 23.314 24.024 1.840 536 HG12 VAL 77 HG12 VAL 77 22.553 23.788 0.265 537 HG13 VAL 77 HG13 VAL 77 21.678 24.620 1.551 538 HG21 VAL 77 HG21 VAL 77 23.528 27.768 1.387 539 HG22 VAL 77 HG22 VAL 77 23.904 26.482 2.533 540 HG23 VAL 77 HG23 VAL 77 22.224 26.881 2.180 541 H VAL 78 H VAL 78 25.134 23.142 -0.046 542 HA VAL 78 HA VAL 78 26.348 22.836 2.513 543 HB VAL 78 HB VAL 78 26.353 21.011 0.098 544 HG11 VAL 78 HG11 VAL 78 28.270 20.498 1.517 545 HG12 VAL 78 HG12 VAL 78 27.053 19.227 1.633 546 HG13 VAL 78 HG13 VAL 78 27.217 20.411 2.930 547 HG21 VAL 78 HG21 VAL 78 24.142 21.422 1.070 548 HG22 VAL 78 HG22 VAL 78 24.745 20.928 2.653 549 HG23 VAL 78 HG23 VAL 78 24.660 19.757 1.336 550 H ALA 79 H ALA 79 27.538 23.485 -0.710 551 HA ALA 79 HA ALA 79 30.256 22.855 -0.286 552 HB1 ALA 79 HB1 ALA 79 29.072 24.826 -2.238 553 HB2 ALA 79 HB2 ALA 79 29.258 23.093 -2.510 554 HB3 ALA 79 HB3 ALA 79 30.684 24.113 -2.321 555 H THR 80 H THR 80 28.389 25.361 0.960 556 HA THR 80 HA THR 80 30.409 27.374 1.181 557 HB THR 80 HB THR 80 27.876 27.038 2.809 558 HG1 THR 80 HG1 THR 80 26.884 27.596 1.037 559 HG21 THR 80 HG21 THR 80 29.604 29.455 2.261 560 HG22 THR 80 HG22 THR 80 29.389 28.645 3.813 561 HG23 THR 80 HG23 THR 80 28.038 29.496 3.068 562 H SER 81 H SER 81 29.753 24.454 2.811 563 HA SER 81 HA SER 81 30.743 25.210 5.393 564 HB2 SER 81 HB2 SER 81 30.511 22.401 4.321 565 HB3 SER 81 HB3 SER 81 30.402 22.940 5.998 566 HG SER 81 HG SER 81 28.492 22.914 4.010 567 HA PRO 82 HA PRO 82 35.113 24.881 4.325 568 HB2 PRO 82 HB2 PRO 82 35.347 24.821 7.280 569 HB3 PRO 82 HB3 PRO 82 36.126 25.894 6.117 570 HG2 PRO 82 HG2 PRO 82 34.153 26.771 7.678 571 HG3 PRO 82 HG3 PRO 82 34.301 27.312 5.995 572 HD2 PRO 82 HD2 PRO 82 32.439 25.290 7.180 573 HD3 PRO 82 HD3 PRO 82 32.128 26.515 5.932 574 HA PRO 83 HA PRO 83 35.850 20.532 4.487 575 HB2 PRO 83 HB2 PRO 83 38.589 21.259 5.431 576 HB3 PRO 83 HB3 PRO 83 38.100 20.192 4.110 577 HG2 PRO 83 HG2 PRO 83 39.006 22.639 3.603 578 HG3 PRO 83 HG3 PRO 83 37.667 21.953 2.667 579 HD2 PRO 83 HD2 PRO 83 37.616 24.028 4.802 580 HD3 PRO 83 HD3 PRO 83 36.587 23.858 3.368 581 H GLN 84 H GLN 84 37.005 22.433 7.233 582 HA GLN 84 HA GLN 84 37.397 20.282 9.013 583 HB2 GLN 84 HB2 GLN 84 36.823 23.197 9.559 584 HB3 GLN 84 HB3 GLN 84 37.355 22.039 10.770 585 HG2 GLN 84 HG2 GLN 84 39.444 21.720 9.600 586 HG3 GLN 84 HG3 GLN 84 38.908 22.790 8.304 587 HE21 GLN 84 HE22 GLN 84 40.633 24.192 8.613 588 HE22 GLN 84 HE21 GLN 84 40.717 25.259 9.969 589 H SER 85 H SER 85 34.536 21.982 8.029 590 HA SER 85 HA SER 85 33.022 20.706 10.215 591 HB2 SER 85 HB2 SER 85 32.216 23.189 8.692 592 HB3 SER 85 HB3 SER 85 31.502 22.558 10.178 593 HG SER 85 HG SER 85 32.987 23.561 11.272 594 H TYR 86 H TYR 86 33.661 20.438 7.013 595 HA TYR 86 HA TYR 86 31.167 20.395 5.754 596 HB2 TYR 86 HB2 TYR 86 33.277 20.458 4.513 597 HB3 TYR 86 HB3 TYR 86 33.659 18.828 5.057 598 HD1 TYR 86 HD2 TYR 86 31.556 20.838 2.819 599 HD2 TYR 86 HD1 TYR 86 32.549 16.903 4.096 600 HE1 TYR 86 HE2 TYR 86 30.374 19.912 0.869 601 HE2 TYR 86 HE1 TYR 86 31.369 15.968 2.152 602 HH TYR 86 HH TYR 86 30.182 17.974 -0.437 603 H SER 87 H SER 87 33.040 17.693 7.135 604 HA SER 87 HA SER 87 31.196 15.688 6.454 605 HB2 SER 87 HB2 SER 87 33.164 15.716 8.756 606 HB3 SER 87 HB3 SER 87 32.401 14.289 8.055 607 HG SER 87 HG SER 87 33.728 14.362 6.413 608 H ALA 88 H ALA 88 31.414 17.841 9.198 609 HA ALA 88 HA ALA 88 29.536 16.489 10.847 610 HB1 ALA 88 HB1 ALA 88 30.320 19.401 10.875 611 HB2 ALA 88 HB2 ALA 88 31.162 18.107 11.730 612 HB3 ALA 88 HB3 ALA 88 29.506 18.527 12.172 613 H VAL 89 H VAL 89 29.310 19.042 8.449 614 HA VAL 89 HA VAL 89 26.515 19.512 8.784 615 HB VAL 89 HB VAL 89 28.376 20.129 6.481 616 HG11 VAL 89 HG11 VAL 89 26.076 20.001 5.677 617 HG12 VAL 89 HG12 VAL 89 26.631 21.676 5.696 618 HG13 VAL 89 HG13 VAL 89 25.552 21.088 6.963 619 HG21 VAL 89 HG21 VAL 89 28.282 22.426 7.349 620 HG22 VAL 89 HG22 VAL 89 28.947 21.299 8.532 621 HG23 VAL 89 HG23 VAL 89 27.286 21.867 8.692 622 H LEU 90 H LEU 90 28.468 17.602 6.519 623 HA LEU 90 HA LEU 90 26.437 16.691 4.853 624 HB2 LEU 90 HB2 LEU 90 29.062 16.491 4.805 625 HB3 LEU 90 HB3 LEU 90 28.756 14.952 5.582 626 HG LEU 90 HG LEU 90 29.085 14.798 3.142 627 HD11 LEU 90 HD11 LEU 90 27.148 13.359 2.676 628 HD12 LEU 90 HD12 LEU 90 26.363 13.978 4.129 629 HD13 LEU 90 HD13 LEU 90 27.856 13.049 4.260 630 HD21 LEU 90 HD21 LEU 90 28.058 16.919 2.512 631 HD22 LEU 90 HD22 LEU 90 26.474 16.288 2.963 632 HD23 LEU 90 HD23 LEU 90 27.360 15.569 1.620 633 H ASN 91 H ASN 91 27.783 15.206 7.796 634 HA ASN 91 HA ASN 91 26.185 12.910 7.827 635 HB2 ASN 91 HB2 ASN 91 27.558 14.465 10.009 636 HB3 ASN 91 HB3 ASN 91 26.590 13.041 10.378 637 HD21 ASN 91 HD22 ASN 91 29.491 13.579 10.620 638 HD22 ASN 91 HD21 ASN 91 30.272 12.317 9.734 639 H THR 92 H THR 92 25.554 16.162 8.988 640 HA THR 92 HA THR 92 23.125 15.571 10.321 641 HB THR 92 HB THR 92 24.067 18.187 9.122 642 HG1 THR 92 HG1 THR 92 25.530 17.601 10.676 643 HG21 THR 92 HG21 THR 92 21.964 17.634 11.225 644 HG22 THR 92 HG22 THR 92 21.665 18.223 9.590 645 HG23 THR 92 HG23 THR 92 22.538 19.232 10.748 646 H ILE 93 H ILE 93 23.880 16.716 7.040 647 HA ILE 93 HA ILE 93 21.263 16.932 6.069 648 HB ILE 93 HB ILE 93 23.747 16.123 4.551 649 HG12 ILE 93 HG12 ILE 93 24.023 18.280 5.656 650 HG13 ILE 93 HG13 ILE 93 23.876 18.501 3.917 651 HG21 ILE 93 HG21 ILE 93 21.775 15.550 3.287 652 HG22 ILE 93 HG22 ILE 93 22.552 16.959 2.560 653 HG23 ILE 93 HG23 ILE 93 21.102 17.160 3.546 654 HD11 ILE 93 HD11 ILE 93 22.633 20.202 5.069 655 HD12 ILE 93 HD12 ILE 93 21.737 18.985 5.974 656 HD13 ILE 93 HD13 ILE 93 21.512 19.128 4.231 657 H GLY 94 H GLY 94 23.491 14.188 6.069 658 HA2 GLY 94 HA2 GLY 94 21.824 12.383 4.710 659 HA3 GLY 94 HA3 GLY 94 23.147 11.942 5.770 660 H ALA 95 H ALA 95 22.105 13.115 8.124 661 HA ALA 95 HA ALA 95 20.493 10.951 9.013 662 HB1 ALA 95 HB1 ALA 95 21.157 13.520 10.448 663 HB2 ALA 95 HB2 ALA 95 22.138 12.053 10.467 664 HB3 ALA 95 HB3 ALA 95 20.524 12.047 11.182 665 H CYS 96 H CYS 96 19.858 14.420 8.530 666 HA CYS 96 HA CYS 96 17.164 14.342 9.337 667 HB2 CYS 96 HB2 CYS 96 18.556 16.243 7.444 668 HB3 CYS 96 HB3 CYS 96 16.954 16.501 8.126 669 H LEU 97 H LEU 97 18.708 13.791 6.225 670 HA LEU 97 HA LEU 97 16.434 13.826 4.598 671 HB2 LEU 97 HB2 LEU 97 19.058 13.560 4.136 672 HB3 LEU 97 HB3 LEU 97 18.608 11.873 4.022 673 HG LEU 97 HG LEU 97 18.713 12.970 1.827 674 HD11 LEU 97 HD11 LEU 97 15.948 12.110 2.641 675 HD12 LEU 97 HD12 LEU 97 17.249 11.076 2.044 676 HD13 LEU 97 HD13 LEU 97 16.517 12.277 0.979 677 HD21 LEU 97 HD21 LEU 97 16.417 14.647 2.818 678 HD22 LEU 97 HD22 LEU 97 17.074 14.638 1.182 679 HD23 LEU 97 HD23 LEU 97 18.060 15.217 2.526 680 H ARG 98 H ARG 98 17.808 11.287 6.625 681 HA ARG 98 HA ARG 98 16.350 9.091 5.635 682 HB2 ARG 98 HB2 ARG 98 17.164 9.521 8.518 683 HB3 ARG 98 HB3 ARG 98 16.855 7.981 7.728 684 HG2 ARG 98 HG2 ARG 98 19.139 9.865 7.232 685 HG3 ARG 98 HG3 ARG 98 19.208 8.251 7.947 686 HD2 ARG 98 HD2 ARG 98 18.538 7.254 5.860 687 HD3 ARG 98 HD3 ARG 98 18.287 8.848 5.148 688 HE ARG 98 HE ARG 98 20.800 9.111 5.631 689 HH11 ARG 98 HH11 ARG 98 19.244 6.122 4.707 690 HH12 ARG 98 HH12 ARG 98 20.649 5.478 3.924 691 HH21 ARG 98 HH21 ARG 98 22.667 8.259 4.603 692 HH22 ARG 98 HH22 ARG 98 22.595 6.687 3.870 693 H GLU 99 H GLU 99 15.695 11.134 8.429 694 HA GLU 99 HA GLU 99 13.200 9.925 9.015 695 HB2 GLU 99 HB2 GLU 99 12.895 11.923 10.524 696 HB3 GLU 99 HB3 GLU 99 14.312 10.935 10.821 697 HG2 GLU 99 HG2 GLU 99 15.630 12.603 9.500 698 HG3 GLU 99 HG3 GLU 99 14.191 13.622 9.493 699 H SER 100 H SER 100 14.089 12.818 7.219 700 HA SER 100 HA SER 100 11.590 13.958 6.873 701 HB2 SER 100 HB2 SER 100 13.893 13.825 4.918 702 HB3 SER 100 HB3 SER 100 12.490 14.878 4.731 703 HG SER 100 HG SER 100 13.510 15.156 7.194 704 H MET 101 H MET 101 12.998 11.191 5.198 705 HA MET 101 HA MET 101 11.016 11.032 3.171 706 HB2 MET 101 HB2 MET 101 12.948 9.007 4.271 707 HB3 MET 101 HB3 MET 101 11.821 8.630 2.978 708 HG2 MET 101 HG2 MET 101 12.860 10.654 1.779 709 HG3 MET 101 HG3 MET 101 14.165 10.482 2.954 710 HE1 MET 101 HE1 MET 101 12.113 8.875 0.143 711 HE2 MET 101 HE2 MET 101 11.999 7.543 1.294 712 HE3 MET 101 HE3 MET 101 12.936 7.352 -0.185 713 H MET 102 H MET 102 11.414 9.318 6.268 714 HA MET 102 HA MET 102 9.080 7.742 5.794 715 HB2 MET 102 HB2 MET 102 9.435 6.752 7.919 716 HB3 MET 102 HB3 MET 102 11.000 6.948 7.150 717 HG2 MET 102 HG2 MET 102 11.404 8.940 8.529 718 HG3 MET 102 HG3 MET 102 9.853 8.678 9.329 719 HE1 MET 102 HE1 MET 102 10.552 5.009 10.775 720 HE2 MET 102 HE2 MET 102 10.067 5.347 9.113 721 HE3 MET 102 HE3 MET 102 9.294 6.202 10.450 722 H GLN 103 H GLN 103 9.692 10.784 7.400 723 HA GLN 103 HA GLN 103 7.146 10.881 8.694 724 HB2 GLN 103 HB2 GLN 103 9.373 12.768 8.249 725 HB3 GLN 103 HB3 GLN 103 7.783 13.502 8.404 726 HG2 GLN 103 HG2 GLN 103 8.891 13.411 10.551 727 HG3 GLN 103 HG3 GLN 103 7.458 12.388 10.547 728 HE21 GLN 103 HE22 GLN 103 10.888 12.504 10.791 729 HE22 GLN 103 HE21 GLN 103 11.131 10.841 11.197 730 H ALA 104 H ALA 104 8.235 11.369 5.485 731 HA ALA 104 HA ALA 104 5.971 12.888 4.607 732 HB1 ALA 104 HB1 ALA 104 8.103 12.968 3.403 733 HB2 ALA 104 HB2 ALA 104 6.784 12.445 2.355 734 HB3 ALA 104 HB3 ALA 104 7.929 11.262 2.989 735 H THR 105 H THR 105 6.981 9.560 3.767 736 HA THR 105 HA THR 105 4.627 8.281 4.493 737 HB THR 105 HB THR 105 3.459 9.666 2.858 738 HG1 THR 105 HG1 THR 105 2.566 7.645 2.980 739 HG21 THR 105 HG21 THR 105 5.337 8.453 0.826 740 HG22 THR 105 HG22 THR 105 5.301 10.141 1.335 741 HG23 THR 105 HG23 THR 105 3.935 9.458 0.454 742 H GLY 106 H GLY 106 7.376 8.417 2.314 743 HA2 GLY 106 HA2 GLY 106 6.989 5.645 1.510 744 HA3 GLY 106 HA3 GLY 106 8.172 6.761 0.852 745 H SER 107 H SER 107 7.844 6.280 4.299 746 HA SER 107 HA SER 107 9.358 5.673 5.865 747 HB2 SER 107 HB2 SER 107 10.291 3.313 5.482 748 HB3 SER 107 HB3 SER 107 8.542 3.499 5.533 749 HG SER 107 HG SER 107 9.660 3.748 3.019 750 H VAL 108 H VAL 108 11.777 4.263 5.793 751 HA VAL 108 HA VAL 108 13.479 6.249 4.501 752 HB VAL 108 HB VAL 108 14.310 4.033 6.381 753 HG11 VAL 108 HG11 VAL 108 15.721 6.553 5.508 754 HG12 VAL 108 HG12 VAL 108 16.124 4.908 5.016 755 HG13 VAL 108 HG13 VAL 108 16.323 5.399 6.697 756 HG21 VAL 108 HG21 VAL 108 14.331 5.717 8.148 757 HG22 VAL 108 HG22 VAL 108 12.711 5.533 7.474 758 HG23 VAL 108 HG23 VAL 108 13.701 6.919 7.021 759 H ASP 109 H ASP 109 13.459 5.677 2.387 760 HA ASP 109 HA ASP 109 13.661 2.973 1.498 761 HB2 ASP 109 HB2 ASP 109 12.433 4.488 0.123 762 HB3 ASP 109 HB3 ASP 109 13.788 5.609 0.040 763 H ASN 110 H ASN 110 15.304 2.129 0.106 764 HA ASN 110 HA ASN 110 17.928 2.705 1.233 765 HB2 ASN 110 HB2 ASN 110 18.581 0.529 0.519 766 HB3 ASN 110 HB3 ASN 110 16.977 0.383 1.218 767 HD21 ASN 110 HD22 ASN 110 15.590 1.407 -1.178 768 HD22 ASN 110 HD21 ASN 110 15.704 0.146 -2.348 769 H ALA 111 H ALA 111 16.282 3.646 -1.512 770 HA ALA 111 HA ALA 111 18.753 3.685 -3.130 771 HB1 ALA 111 HB1 ALA 111 15.891 3.897 -4.068 772 HB2 ALA 111 HB2 ALA 111 16.900 2.451 -4.152 773 HB3 ALA 111 HB3 ALA 111 17.327 3.882 -5.093 774 H PHE 112 H PHE 112 15.839 5.649 -2.463 775 HA PHE 112 HA PHE 112 16.697 7.984 -3.724 776 HB2 PHE 112 HB2 PHE 112 14.392 7.644 -2.958 777 HB3 PHE 112 HB3 PHE 112 14.924 7.745 -1.284 778 HD1 PHE 112 HD1 PHE 112 14.540 9.662 -4.420 779 HD2 PHE 112 HD2 PHE 112 15.221 9.835 -0.226 780 HE1 PHE 112 HE1 PHE 112 14.184 12.095 -4.459 781 HE2 PHE 112 HE2 PHE 112 14.864 12.266 -0.261 782 HZ PHE 112 HZ PHE 112 14.343 13.400 -2.381 783 H THR 113 H THR 113 17.032 7.116 -0.281 784 HA THR 113 HA THR 113 18.409 9.388 0.561 785 HB THR 113 HB THR 113 19.355 7.904 2.361 786 HG1 THR 113 HG1 THR 113 17.720 5.785 1.655 787 HG21 THR 113 HG21 THR 113 17.172 7.394 3.387 788 HG22 THR 113 HG22 THR 113 16.388 7.693 1.837 789 HG23 THR 113 HG23 THR 113 17.212 9.007 2.676 790 H ASN 114 H ASN 114 19.571 6.374 -0.797 791 HA ASN 114 HA ASN 114 22.338 6.816 -0.623 792 HB2 ASN 114 HB2 ASN 114 21.527 4.617 -1.053 793 HB3 ASN 114 HB3 ASN 114 20.600 5.155 -2.448 794 HD21 ASN 114 HD22 ASN 114 21.562 5.306 -4.407 795 HD22 ASN 114 HD21 ASN 114 23.175 4.785 -4.715 796 H GLU 115 H GLU 115 20.074 7.408 -3.317 797 HA GLU 115 HA GLU 115 21.869 8.427 -5.155 798 HB2 GLU 115 HB2 GLU 115 18.972 9.089 -4.644 799 HB3 GLU 115 HB3 GLU 115 19.853 9.557 -6.076 800 HG2 GLU 115 HG2 GLU 115 19.210 6.767 -5.196 801 HG3 GLU 115 HG3 GLU 115 18.490 7.645 -6.541 802 H VAL 116 H VAL 116 19.837 10.148 -2.794 803 HA VAL 116 HA VAL 116 20.752 12.733 -3.333 804 HB VAL 116 HB VAL 116 19.736 11.603 -0.719 805 HG11 VAL 116 HG11 VAL 116 20.936 13.680 -0.327 806 HG12 VAL 116 HG12 VAL 116 19.202 13.931 -0.136 807 HG13 VAL 116 HG13 VAL 116 20.015 14.475 -1.603 808 HG21 VAL 116 HG21 VAL 116 18.144 11.372 -2.544 809 HG22 VAL 116 HG22 VAL 116 18.321 13.083 -2.935 810 HG23 VAL 116 HG23 VAL 116 17.599 12.599 -1.401 811 H MET 117 H MET 117 21.933 10.367 -0.949 812 HA MET 117 HA MET 117 23.915 11.951 0.217 813 HB2 MET 117 HB2 MET 117 23.636 8.986 -0.149 814 HB3 MET 117 HB3 MET 117 25.029 9.666 0.667 815 HG2 MET 117 HG2 MET 117 22.224 10.278 1.532 816 HG3 MET 117 HG3 MET 117 23.081 8.847 2.090 817 HE1 MET 117 HE1 MET 117 24.444 12.816 1.796 818 HE2 MET 117 HE2 MET 117 23.747 13.197 3.374 819 HE3 MET 117 HE3 MET 117 22.713 12.615 2.070 820 H GLN 118 H GLN 118 24.177 9.710 -2.536 821 HA GLN 118 HA GLN 118 26.897 10.161 -3.074 822 HB2 GLN 118 HB2 GLN 118 25.703 8.299 -4.074 823 HB3 GLN 118 HB3 GLN 118 24.633 9.398 -4.929 824 HG2 GLN 118 HG2 GLN 118 26.624 10.256 -6.167 825 HG3 GLN 118 HG3 GLN 118 27.574 8.979 -5.409 826 HE21 GLN 118 HE22 GLN 118 27.273 6.858 -6.048 827 HE22 GLN 118 HE21 GLN 118 26.389 6.432 -7.471 828 H LEU 119 H LEU 119 23.990 11.684 -4.425 829 HA LEU 119 HA LEU 119 25.406 13.302 -6.257 830 HB2 LEU 119 HB2 LEU 119 22.589 13.313 -5.240 831 HB3 LEU 119 HB3 LEU 119 23.161 14.534 -6.361 832 HG LEU 119 HG LEU 119 23.532 11.644 -7.039 833 HD11 LEU 119 HD11 LEU 119 21.348 11.652 -8.163 834 HD12 LEU 119 HD12 LEU 119 20.995 13.232 -7.463 835 HD13 LEU 119 HD13 LEU 119 21.176 11.823 -6.416 836 HD21 LEU 119 HD21 LEU 119 24.607 13.338 -8.413 837 HD22 LEU 119 HD22 LEU 119 23.054 14.130 -8.675 838 HD23 LEU 119 HD23 LEU 119 23.338 12.510 -9.313 839 H VAL 120 H VAL 120 23.963 14.098 -3.066 840 HA VAL 120 HA VAL 120 24.467 16.856 -3.209 841 HB VAL 120 HB VAL 120 24.300 15.067 -0.781 842 HG11 VAL 120 HG11 VAL 120 25.553 17.083 -0.213 843 HG12 VAL 120 HG12 VAL 120 23.953 17.112 0.527 844 HG13 VAL 120 HG13 VAL 120 24.279 18.083 -0.909 845 HG21 VAL 120 HG21 VAL 120 22.055 15.993 -0.573 846 HG22 VAL 120 HG22 VAL 120 22.269 15.196 -2.133 847 HG23 VAL 120 HG23 VAL 120 22.311 16.957 -2.031 848 H LYS 121 H LYS 121 26.513 14.214 -2.071 849 HA LYS 121 HA LYS 121 28.619 15.869 -1.121 850 HB2 LYS 121 HB2 LYS 121 28.590 12.965 -1.962 851 HB3 LYS 121 HB3 LYS 121 29.952 13.754 -1.185 852 HG2 LYS 121 HG2 LYS 121 28.665 14.146 0.801 853 HG3 LYS 121 HG3 LYS 121 27.207 13.530 0.025 854 HD2 LYS 121 HD2 LYS 121 27.873 11.705 1.261 855 HD3 LYS 121 HD3 LYS 121 28.628 11.367 -0.294 856 HE2 LYS 121 HE2 LYS 121 30.024 12.695 2.028 857 HE3 LYS 121 HE3 LYS 121 30.114 10.975 1.672 858 HZ1 LYS 121 HZ1 LYS 121 31.084 11.570 -0.506 859 HZ2 LYS 121 HZ2 LYS 121 32.037 12.064 0.797 860 HZ3 LYS 121 HZ3 LYS 121 31.104 13.196 -0.038 861 H MET 122 H MET 122 28.053 14.153 -4.155 862 HA MET 122 HA MET 122 30.630 14.831 -5.202 863 HB2 MET 122 HB2 MET 122 29.745 12.720 -5.820 864 HB3 MET 122 HB3 MET 122 28.218 13.421 -6.321 865 HG2 MET 122 HG2 MET 122 30.660 14.269 -7.766 866 HG3 MET 122 HG3 MET 122 30.067 12.632 -8.041 867 HE1 MET 122 HE1 MET 122 27.686 12.052 -8.917 868 HE2 MET 122 HE2 MET 122 26.495 13.227 -9.471 869 HE3 MET 122 HE3 MET 122 26.833 13.064 -7.749 870 H LEU 123 H LEU 123 27.439 16.198 -5.425 871 HA LEU 123 HA LEU 123 28.106 17.828 -7.710 872 HB2 LEU 123 HB2 LEU 123 25.730 17.877 -5.856 873 HB3 LEU 123 HB3 LEU 123 25.903 18.909 -7.262 874 HG LEU 123 HG LEU 123 25.724 15.894 -7.304 875 HD11 LEU 123 HD11 LEU 123 23.608 16.938 -6.737 876 HD12 LEU 123 HD12 LEU 123 23.556 16.289 -8.375 877 HD13 LEU 123 HD13 LEU 123 23.753 18.022 -8.120 878 HD21 LEU 123 HD21 LEU 123 25.515 16.220 -9.756 879 HD22 LEU 123 HD22 LEU 123 27.104 16.635 -9.118 880 HD23 LEU 123 HD23 LEU 123 25.960 17.913 -9.527 881 H SER 124 H SER 124 28.868 18.010 -4.456 882 HA SER 124 HA SER 124 28.866 20.951 -4.508 883 HB2 SER 124 HB2 SER 124 29.191 20.762 -2.014 884 HB3 SER 124 HB3 SER 124 27.645 20.147 -2.596 885 HG SER 124 HG SER 124 28.214 18.158 -2.090 886 H ALA 125 H ALA 125 30.807 18.333 -3.087 887 HA ALA 125 HA ALA 125 33.222 19.273 -4.290 888 HB1 ALA 125 HB1 ALA 125 32.929 20.983 -2.568 889 HB2 ALA 125 HB2 ALA 125 34.346 19.984 -2.253 890 HB3 ALA 125 HB3 ALA 125 32.862 19.726 -1.335 891 H ASP 126 H ASP 126 34.137 17.398 -4.749 892 HA ASP 126 HA ASP 126 34.006 15.174 -2.869 893 HB2 ASP 126 HB2 ASP 126 33.769 14.857 -5.374 894 HB3 ASP 126 HB3 ASP 126 35.469 15.290 -5.521 895 H SER 127 H SER 127 35.431 17.787 -2.527 896 HA SER 127 HA SER 127 38.223 17.015 -2.275 897 HB2 SER 127 HB2 SER 127 36.949 19.624 -1.446 898 HB3 SER 127 HB3 SER 127 38.634 19.325 -1.861 899 HG SER 127 HG SER 127 37.945 18.924 -4.015 900 H ALA 128 H ALA 128 36.002 15.870 -0.616 901 HA ALA 128 HA ALA 128 36.253 17.018 1.992 902 HB1 ALA 128 HB1 ALA 128 34.857 15.143 2.731 903 HB2 ALA 128 HB2 ALA 128 34.988 14.423 1.127 904 HB3 ALA 128 HB3 ALA 128 34.170 15.971 1.334 905 H ASN 129 H ASN 129 38.637 16.871 1.994 906 HA ASN 129 HA ASN 129 39.413 14.302 3.197 907 HB2 ASN 129 HB2 ASN 129 41.767 14.820 2.517 908 HB3 ASN 129 HB3 ASN 129 40.686 14.494 1.170 909 HD21 ASN 129 HD22 ASN 129 40.191 16.123 -0.258 910 HD22 ASN 129 HD21 ASN 129 41.040 17.627 -0.292 911 H GLU 130 H GLU 130 40.157 14.362 5.188 912 HA GLU 130 HA GLU 130 39.898 16.784 6.670 913 HB2 GLU 130 HB2 GLU 130 40.687 15.380 8.602 914 HB3 GLU 130 HB3 GLU 130 39.253 14.783 7.785 915 HG2 GLU 130 HG2 GLU 130 41.990 13.745 7.133 916 HG3 GLU 130 HG3 GLU 130 41.036 13.097 8.465 917 H VAL 131 H VAL 131 41.472 17.940 7.773 918 HA VAL 131 HA VAL 131 44.102 17.782 6.524 919 HB VAL 131 HB VAL 131 42.882 19.930 6.383 920 HG11 VAL 131 HG11 VAL 131 42.669 21.345 8.385 921 HG12 VAL 131 HG12 VAL 131 43.178 19.982 9.379 922 HG13 VAL 131 HG13 VAL 131 41.672 19.893 8.470 923 HG21 VAL 131 HG21 VAL 131 45.331 19.870 6.303 924 HG22 VAL 131 HG22 VAL 131 45.383 20.110 8.049 925 HG23 VAL 131 HG23 VAL 131 44.722 21.367 7.008 926 H SER 132 H SER 132 45.909 17.347 7.651 927 HA SER 132 HA SER 132 45.526 16.449 10.416 928 HB2 SER 132 HB2 SER 132 47.753 15.787 8.470 929 HB3 SER 132 HB3 SER 132 47.471 15.028 10.037 930 HG SER 132 HG SER 132 46.062 13.772 9.130 931 H THR 133 H THR 133 46.166 19.256 9.404 932 HA THR 133 HA THR 133 48.122 19.849 11.433 933 HB THR 133 HB THR 133 49.637 19.467 9.589 934 HG1 THR 133 HG1 THR 133 49.272 22.282 9.895 935 HG21 THR 133 HG21 THR 133 47.985 21.450 8.024 936 HG22 THR 133 HG22 THR 133 48.078 19.715 7.729 937 HG23 THR 133 HG23 THR 133 49.502 20.727 7.491 Start of MODEL 16 1 HA2 GLY 1 HA2 GLY 1 5.695 -4.581 -7.752 2 HA3 GLY 1 HA3 GLY 1 5.953 -3.389 -9.018 3 H SER 2 H SER 2 8.145 -4.371 -7.816 4 HA SER 2 HA SER 2 8.972 -2.947 -5.501 5 HB2 SER 2 HB2 SER 2 10.758 -4.198 -7.596 6 HB3 SER 2 HB3 SER 2 11.123 -3.934 -5.890 7 HG SER 2 HG SER 2 10.523 -6.006 -5.921 8 H GLY 3 H GLY 3 9.703 -2.592 -8.952 9 HA2 GLY 3 HA2 GLY 3 10.876 0.044 -8.458 10 HA3 GLY 3 HA3 GLY 3 10.941 -0.855 -9.970 11 H ASN 4 H ASN 4 9.145 1.357 -8.034 12 HA ASN 4 HA ASN 4 6.869 1.290 -9.864 13 HB2 ASN 4 HB2 ASN 4 6.566 1.326 -7.345 14 HB3 ASN 4 HB3 ASN 4 7.168 2.981 -7.376 15 HD21 ASN 4 HD22 ASN 4 5.230 3.811 -6.618 16 HD22 ASN 4 HD21 ASN 4 3.807 3.879 -7.598 17 H SER 5 H SER 5 6.031 3.264 -10.782 18 HA SER 5 HA SER 5 8.167 4.886 -11.855 19 HB2 SER 5 HB2 SER 5 6.338 4.021 -13.298 20 HB3 SER 5 HB3 SER 5 5.182 4.992 -12.390 21 HG SER 5 HG SER 5 6.652 6.822 -13.041 22 H GLN 6 H GLN 6 6.588 5.045 -9.052 23 HA GLN 6 HA GLN 6 7.247 7.780 -8.658 24 HB2 GLN 6 HB2 GLN 6 4.971 8.425 -7.810 25 HB3 GLN 6 HB3 GLN 6 5.130 8.275 -9.552 26 HG2 GLN 6 HG2 GLN 6 4.248 5.921 -8.017 27 HG3 GLN 6 HG3 GLN 6 3.102 7.238 -8.237 28 HE21 GLN 6 HE22 GLN 6 4.203 7.929 -10.872 29 HE22 GLN 6 HE21 GLN 6 3.653 6.701 -11.952 30 HA PRO 7 HA PRO 7 7.893 5.298 -4.899 31 HB2 PRO 7 HB2 PRO 7 10.039 6.764 -4.047 32 HB3 PRO 7 HB3 PRO 7 10.160 5.397 -5.158 33 HG2 PRO 7 HG2 PRO 7 10.210 8.322 -5.732 34 HG3 PRO 7 HG3 PRO 7 11.117 7.007 -6.499 35 HD2 PRO 7 HD2 PRO 7 8.911 8.184 -7.609 36 HD3 PRO 7 HD3 PRO 7 9.411 6.516 -7.950 37 H ILE 8 H ILE 8 8.864 8.698 -4.485 38 HA ILE 8 HA ILE 8 6.620 9.016 -2.607 39 HB ILE 8 HB ILE 8 8.803 9.013 -1.449 40 HG12 ILE 8 HG12 ILE 8 7.570 11.776 -1.463 41 HG13 ILE 8 HG13 ILE 8 6.857 10.389 -0.646 42 HG21 ILE 8 HG21 ILE 8 9.386 11.407 -3.189 43 HG22 ILE 8 HG22 ILE 8 10.234 9.860 -3.189 44 HG23 ILE 8 HG23 ILE 8 10.343 10.926 -1.788 45 HD11 ILE 8 HD11 ILE 8 8.054 11.808 0.907 46 HD12 ILE 8 HD12 ILE 8 9.534 11.625 -0.037 47 HD13 ILE 8 HD13 ILE 8 8.832 10.230 0.784 48 H TRP 9 H TRP 9 8.069 10.045 -5.464 49 HA TRP 9 HA TRP 9 7.033 12.741 -5.425 50 HB2 TRP 9 HB2 TRP 9 8.225 11.174 -7.734 51 HB3 TRP 9 HB3 TRP 9 7.926 12.907 -7.697 52 HD1 TRP 9 HD1 TRP 9 10.506 10.342 -6.827 53 HE1 TRP 9 HE1 TRP 9 12.547 11.478 -5.739 54 HE3 TRP 9 HE3 TRP 9 8.529 14.985 -6.046 55 HZ2 TRP 9 HZ2 TRP 9 13.222 14.007 -4.682 56 HZ3 TRP 9 HZ3 TRP 9 9.936 16.709 -4.988 57 HH2 TRP 9 HH2 TRP 9 12.233 16.230 -4.318 58 H THR 10 H THR 10 5.001 11.167 -4.850 59 HA THR 10 HA THR 10 3.533 10.364 -7.219 60 HB THR 10 HB THR 10 1.760 9.769 -5.479 61 HG1 THR 10 HG1 THR 10 2.215 10.811 -3.644 62 HG21 THR 10 HG21 THR 10 4.498 8.513 -5.217 63 HG22 THR 10 HG22 THR 10 3.264 8.082 -6.402 64 HG23 THR 10 HG23 THR 10 2.982 7.783 -4.689 65 H ASN 11 H ASN 11 3.337 12.761 -4.645 66 HA ASN 11 HA ASN 11 1.644 14.455 -6.247 67 HB2 ASN 11 HB2 ASN 11 -0.084 14.625 -4.506 68 HB3 ASN 11 HB3 ASN 11 0.018 12.995 -5.146 69 HD21 ASN 11 HD22 ASN 11 0.228 14.980 -2.387 70 HD22 ASN 11 HD21 ASN 11 0.592 13.734 -1.242 71 HA PRO 12 HA PRO 12 3.900 17.848 -4.652 72 HB2 PRO 12 HB2 PRO 12 1.222 18.852 -3.771 73 HB3 PRO 12 HB3 PRO 12 2.514 19.701 -4.626 74 HG2 PRO 12 HG2 PRO 12 0.372 18.766 -5.922 75 HG3 PRO 12 HG3 PRO 12 1.983 18.742 -6.659 76 HD2 PRO 12 HD2 PRO 12 0.356 16.501 -5.632 77 HD3 PRO 12 HD3 PRO 12 1.659 16.495 -6.830 78 H ASN 13 H ASN 13 1.172 17.100 -2.475 79 HA ASN 13 HA ASN 13 2.324 18.206 -0.177 80 HB2 ASN 13 HB2 ASN 13 -0.081 17.712 -0.390 81 HB3 ASN 13 HB3 ASN 13 0.275 15.989 -0.349 82 HD21 ASN 13 HD22 ASN 13 0.733 15.005 1.597 83 HD22 ASN 13 HD21 ASN 13 0.575 15.814 3.117 84 H ALA 14 H ALA 14 2.586 14.994 -1.551 85 HA ALA 14 HA ALA 14 3.596 13.658 0.717 86 HB1 ALA 14 HB1 ALA 14 4.031 13.049 -2.202 87 HB2 ALA 14 HB2 ALA 14 2.673 12.494 -1.225 88 HB3 ALA 14 HB3 ALA 14 4.310 11.938 -0.862 89 H ALA 15 H ALA 15 5.246 15.104 -2.058 90 HA ALA 15 HA ALA 15 7.839 14.335 -1.089 91 HB1 ALA 15 HB1 ALA 15 7.316 14.360 -3.485 92 HB2 ALA 15 HB2 ALA 15 8.691 15.392 -3.095 93 HB3 ALA 15 HB3 ALA 15 7.113 16.109 -3.413 94 H MET 16 H MET 16 5.943 17.309 -1.240 95 HA MET 16 HA MET 16 8.015 19.058 -0.506 96 HB2 MET 16 HB2 MET 16 5.161 19.183 -0.869 97 HB3 MET 16 HB3 MET 16 5.633 20.099 0.556 98 HG2 MET 16 HG2 MET 16 6.794 20.454 -2.193 99 HG3 MET 16 HG3 MET 16 5.518 21.442 -1.498 100 HE1 MET 16 HE1 MET 16 9.097 21.324 -2.322 101 HE2 MET 16 HE2 MET 16 9.311 20.278 -0.924 102 HE3 MET 16 HE3 MET 16 9.991 21.900 -0.919 103 H THR 17 H THR 17 5.960 16.949 1.355 104 HA THR 17 HA THR 17 6.319 17.991 3.906 105 HB THR 17 HB THR 17 5.984 15.118 3.022 106 HG1 THR 17 HG1 THR 17 4.189 16.398 2.561 107 HG21 THR 17 HG21 THR 17 6.947 15.032 5.228 108 HG22 THR 17 HG22 THR 17 5.212 14.747 5.397 109 HG23 THR 17 HG23 THR 17 5.888 16.325 5.797 110 H MET 18 H MET 18 8.260 15.453 2.285 111 HA MET 18 HA MET 18 10.087 15.188 4.427 112 HB2 MET 18 HB2 MET 18 11.452 13.874 2.936 113 HB3 MET 18 HB3 MET 18 9.765 13.471 2.650 114 HG2 MET 18 HG2 MET 18 9.726 14.775 0.644 115 HG3 MET 18 HG3 MET 18 11.345 15.394 0.966 116 HE1 MET 18 HE1 MET 18 10.465 14.049 -1.843 117 HE2 MET 18 HE2 MET 18 11.980 13.200 -2.146 118 HE3 MET 18 HE3 MET 18 12.000 14.820 -1.443 119 H THR 19 H THR 19 10.037 17.223 1.576 120 HA THR 19 HA THR 19 12.695 18.122 1.654 121 HB THR 19 HB THR 19 10.352 19.744 0.661 122 HG1 THR 19 HG1 THR 19 10.111 17.692 -0.255 123 HG21 THR 19 HG21 THR 19 12.603 20.791 0.650 124 HG22 THR 19 HG22 THR 19 11.930 20.578 -0.967 125 HG23 THR 19 HG23 THR 19 13.172 19.473 -0.376 126 H ASN 20 H ASN 20 9.710 19.447 3.085 127 HA ASN 20 HA ASN 20 10.957 21.754 4.182 128 HB2 ASN 20 HB2 ASN 20 8.307 20.412 4.619 129 HB3 ASN 20 HB3 ASN 20 8.820 21.727 5.668 130 HD21 ASN 20 HD22 ASN 20 7.760 20.833 2.505 131 HD22 ASN 20 HD21 ASN 20 7.542 22.440 1.899 132 H ASN 21 H ASN 21 10.169 18.560 5.474 133 HA ASN 21 HA ASN 21 10.855 19.142 8.144 134 HB2 ASN 21 HB2 ASN 21 10.604 16.579 6.600 135 HB3 ASN 21 HB3 ASN 21 11.146 16.582 8.271 136 HD21 ASN 21 HD22 ASN 21 8.766 15.422 7.117 137 HD22 ASN 21 HD21 ASN 21 7.425 16.142 7.937 138 H LEU 22 H LEU 22 12.752 18.168 5.379 139 HA LEU 22 HA LEU 22 15.141 17.506 6.701 140 HB2 LEU 22 HB2 LEU 22 14.894 17.006 4.369 141 HB3 LEU 22 HB3 LEU 22 14.611 18.690 3.978 142 HG LEU 22 HG LEU 22 16.949 19.212 4.587 143 HD11 LEU 22 HD11 LEU 22 18.544 17.363 4.872 144 HD12 LEU 22 HD12 LEU 22 17.196 16.228 4.930 145 HD13 LEU 22 HD13 LEU 22 17.373 17.453 6.186 146 HD21 LEU 22 HD21 LEU 22 16.646 17.026 2.534 147 HD22 LEU 22 HD22 LEU 22 17.978 18.178 2.636 148 HD23 LEU 22 HD23 LEU 22 16.348 18.742 2.271 149 H VAL 23 H VAL 23 13.900 20.571 5.466 150 HA VAL 23 HA VAL 23 16.116 22.163 6.159 151 HB VAL 23 HB VAL 23 13.230 23.036 5.925 152 HG11 VAL 23 HG11 VAL 23 14.654 24.700 6.992 153 HG12 VAL 23 HG12 VAL 23 14.168 25.230 5.381 154 HG13 VAL 23 HG13 VAL 23 15.794 24.600 5.649 155 HG21 VAL 23 HG21 VAL 23 15.363 22.886 3.795 156 HG22 VAL 23 HG22 VAL 23 13.744 23.559 3.594 157 HG23 VAL 23 HG23 VAL 23 13.950 21.838 3.923 158 H GLN 24 H GLN 24 13.060 21.489 7.871 159 HA GLN 24 HA GLN 24 13.587 23.301 9.987 160 HB2 GLN 24 HB2 GLN 24 11.679 22.316 11.111 161 HB3 GLN 24 HB3 GLN 24 11.317 22.539 9.409 162 HG2 GLN 24 HG2 GLN 24 10.490 20.476 9.593 163 HG3 GLN 24 HG3 GLN 24 12.171 20.003 9.357 164 HE21 GLN 24 HE22 GLN 24 9.576 20.328 11.631 165 HE22 GLN 24 HE21 GLN 24 10.297 19.400 12.898 166 H CYS 25 H CYS 25 14.525 20.011 9.421 167 HA CYS 25 HA CYS 25 15.355 19.496 12.120 168 HB2 CYS 25 HB2 CYS 25 14.746 17.648 10.622 169 HB3 CYS 25 HB3 CYS 25 16.055 18.085 9.532 170 H ALA 26 H ALA 26 17.010 20.274 9.078 171 HA ALA 26 HA ALA 26 19.615 20.180 10.204 172 HB1 ALA 26 HB1 ALA 26 20.354 21.055 8.056 173 HB2 ALA 26 HB2 ALA 26 18.687 21.418 7.622 174 HB3 ALA 26 HB3 ALA 26 19.195 19.746 7.843 175 H SER 27 H SER 27 17.289 22.768 9.751 176 HA SER 27 HA SER 27 19.080 24.925 10.093 177 HB2 SER 27 HB2 SER 27 16.116 24.790 10.699 178 HB3 SER 27 HB3 SER 27 17.068 26.269 10.557 179 HG SER 27 HG SER 27 16.395 24.393 8.551 180 H ARG 28 H ARG 28 17.576 22.761 12.348 181 HA ARG 28 HA ARG 28 18.424 24.479 14.586 182 HB2 ARG 28 HB2 ARG 28 16.419 22.215 14.572 183 HB3 ARG 28 HB3 ARG 28 16.823 23.218 15.960 184 HG2 ARG 28 HG2 ARG 28 15.552 24.180 13.405 185 HG3 ARG 28 HG3 ARG 28 14.712 23.884 14.929 186 HD2 ARG 28 HD2 ARG 28 16.062 25.613 16.012 187 HD3 ARG 28 HD3 ARG 28 16.920 25.896 14.497 188 HE ARG 28 HE ARG 28 14.023 26.230 14.454 189 HH11 ARG 28 HH11 ARG 28 17.162 27.763 14.708 190 HH12 ARG 28 HH12 ARG 28 16.596 29.308 14.163 191 HH21 ARG 28 HH21 ARG 28 13.269 28.264 13.752 192 HH22 ARG 28 HH22 ARG 28 14.377 29.592 13.610 193 H SER 29 H SER 29 19.988 22.510 12.915 194 HA SER 29 HA SER 29 20.596 20.289 14.598 195 HB2 SER 29 HB2 SER 29 22.537 19.986 13.071 196 HB3 SER 29 HB3 SER 29 21.014 20.176 12.199 197 HG SER 29 HG SER 29 21.734 21.961 11.340 198 H GLY 30 H GLY 30 21.877 23.525 14.206 199 HA2 GLY 30 HA2 GLY 30 23.245 24.703 15.702 200 HA3 GLY 30 HA3 GLY 30 23.557 23.200 16.564 201 H VAL 31 H VAL 31 23.847 22.609 13.344 202 HA VAL 31 HA VAL 31 26.776 22.762 13.497 203 HB VAL 31 HB VAL 31 25.021 21.105 11.668 204 HG11 VAL 31 HG11 VAL 31 27.107 19.938 11.082 205 HG12 VAL 31 HG12 VAL 31 28.012 21.100 12.050 206 HG13 VAL 31 HG13 VAL 31 27.141 21.639 10.615 207 HG21 VAL 31 HG21 VAL 31 25.747 19.198 13.004 208 HG22 VAL 31 HG22 VAL 31 24.905 20.381 14.004 209 HG23 VAL 31 HG23 VAL 31 26.664 20.273 14.058 210 H LEU 32 H LEU 32 24.041 23.436 11.345 211 HA LEU 32 HA LEU 32 25.714 24.529 9.282 212 HB2 LEU 32 HB2 LEU 32 22.724 24.806 9.578 213 HB3 LEU 32 HB3 LEU 32 23.665 25.045 8.121 214 HG LEU 32 HG LEU 32 23.104 22.444 9.523 215 HD11 LEU 32 HD11 LEU 32 22.064 21.869 7.373 216 HD12 LEU 32 HD12 LEU 32 22.394 23.503 6.796 217 HD13 LEU 32 HD13 LEU 32 21.292 23.251 8.150 218 HD21 LEU 32 HD21 LEU 32 24.903 22.956 7.161 219 HD22 LEU 32 HD22 LEU 32 24.403 21.368 7.744 220 HD23 LEU 32 HD23 LEU 32 25.406 22.405 8.759 221 H THR 33 H THR 33 24.720 26.753 8.367 222 HA THR 33 HA THR 33 24.897 28.662 10.600 223 HB THR 33 HB THR 33 26.932 28.769 9.255 224 HG1 THR 33 HG1 THR 33 26.332 30.770 9.999 225 HG21 THR 33 HG21 THR 33 25.977 27.899 7.150 226 HG22 THR 33 HG22 THR 33 26.926 29.367 6.916 227 HG23 THR 33 HG23 THR 33 25.165 29.446 6.914 228 H ALA 34 H ALA 34 23.966 30.839 9.996 229 HA ALA 34 HA ALA 34 21.228 30.573 9.550 230 HB1 ALA 34 HB1 ALA 34 22.223 32.420 10.797 231 HB2 ALA 34 HB2 ALA 34 21.167 33.011 9.514 232 HB3 ALA 34 HB3 ALA 34 22.918 33.057 9.307 233 H ASP 35 H ASP 35 23.845 31.207 7.309 234 HA ASP 35 HA ASP 35 22.194 32.079 5.148 235 HB2 ASP 35 HB2 ASP 35 24.991 30.925 5.157 236 HB3 ASP 35 HB3 ASP 35 24.201 31.609 3.741 237 H GLN 36 H GLN 36 23.714 28.993 5.962 238 HA GLN 36 HA GLN 36 22.894 27.584 3.697 239 HB2 GLN 36 HB2 GLN 36 23.640 26.648 6.458 240 HB3 GLN 36 HB3 GLN 36 23.301 25.545 5.130 241 HG2 GLN 36 HG2 GLN 36 25.136 26.467 3.851 242 HG3 GLN 36 HG3 GLN 36 25.446 27.657 5.116 243 HE21 GLN 36 HE22 GLN 36 27.561 26.907 5.410 244 HE22 GLN 36 HE21 GLN 36 27.891 25.401 6.193 245 H MET 37 H MET 37 21.376 27.884 6.891 246 HA MET 37 HA MET 37 19.319 26.012 6.395 247 HB2 MET 37 HB2 MET 37 18.216 26.930 8.364 248 HB3 MET 37 HB3 MET 37 19.933 26.726 8.661 249 HG2 MET 37 HG2 MET 37 20.299 29.096 8.346 250 HG3 MET 37 HG3 MET 37 18.594 29.325 7.966 251 HE1 MET 37 HE1 MET 37 20.214 28.144 12.123 252 HE2 MET 37 HE2 MET 37 21.225 28.470 10.719 253 HE3 MET 37 HE3 MET 37 20.213 27.026 10.760 254 H ASP 38 H ASP 38 19.620 29.428 5.701 255 HA ASP 38 HA ASP 38 16.842 29.738 5.011 256 HB2 ASP 38 HB2 ASP 38 18.175 31.643 5.850 257 HB3 ASP 38 HB3 ASP 38 19.185 31.554 4.409 258 H ASP 39 H ASP 39 19.888 29.251 3.307 259 HA ASP 39 HA ASP 39 18.838 29.489 0.693 260 HB2 ASP 39 HB2 ASP 39 21.307 28.144 1.775 261 HB3 ASP 39 HB3 ASP 39 20.895 28.088 0.065 262 H MET 40 H MET 40 18.940 26.861 2.993 263 HA MET 40 HA MET 40 18.141 24.800 1.229 264 HB2 MET 40 HB2 MET 40 17.702 25.129 4.200 265 HB3 MET 40 HB3 MET 40 17.261 23.682 3.308 266 HG2 MET 40 HG2 MET 40 19.612 23.387 2.661 267 HG3 MET 40 HG3 MET 40 20.035 24.807 3.614 268 HE1 MET 40 HE1 MET 40 18.802 21.101 3.661 269 HE2 MET 40 HE2 MET 40 17.438 21.937 4.401 270 HE3 MET 40 HE3 MET 40 18.434 20.851 5.367 271 H GLY 41 H GLY 41 16.447 27.387 2.805 272 HA2 GLY 41 HA2 GLY 41 13.804 26.425 2.429 273 HA3 GLY 41 HA3 GLY 41 14.268 28.105 2.669 274 H MET 42 H MET 42 15.888 28.539 0.462 275 HA MET 42 HA MET 42 13.913 28.759 -1.603 276 HB2 MET 42 HB2 MET 42 15.547 29.992 -2.857 277 HB3 MET 42 HB3 MET 42 15.605 30.529 -1.189 278 HG2 MET 42 HG2 MET 42 17.577 29.123 -0.827 279 HG3 MET 42 HG3 MET 42 17.527 28.643 -2.521 280 HE1 MET 42 HE1 MET 42 16.790 32.213 -0.966 281 HE2 MET 42 HE2 MET 42 18.398 32.930 -1.049 282 HE3 MET 42 HE3 MET 42 18.099 31.552 0.014 283 H MET 43 H MET 43 16.510 26.611 -0.844 284 HA MET 43 HA MET 43 16.712 25.267 -3.310 285 HB2 MET 43 HB2 MET 43 18.333 24.918 -1.525 286 HB3 MET 43 HB3 MET 43 17.085 24.265 -0.480 287 HG2 MET 43 HG2 MET 43 17.747 22.956 -3.084 288 HG3 MET 43 HG3 MET 43 18.712 22.657 -1.641 289 HE1 MET 43 HE1 MET 43 16.399 22.783 0.656 290 HE2 MET 43 HE2 MET 43 17.735 21.633 0.595 291 HE3 MET 43 HE3 MET 43 16.079 21.052 0.784 292 H ALA 44 H ALA 44 14.636 24.785 -0.485 293 HA ALA 44 HA ALA 44 13.140 22.623 -1.469 294 HB1 ALA 44 HB1 ALA 44 13.127 23.319 0.884 295 HB2 ALA 44 HB2 ALA 44 11.494 23.220 0.227 296 HB3 ALA 44 HB3 ALA 44 12.265 24.791 0.438 297 H ASP 45 H ASP 45 12.897 26.076 -1.961 298 HA ASP 45 HA ASP 45 10.356 26.114 -3.217 299 HB2 ASP 45 HB2 ASP 45 11.565 28.116 -2.296 300 HB3 ASP 45 HB3 ASP 45 12.658 28.024 -3.672 301 H SER 46 H SER 46 13.620 25.554 -4.361 302 HA SER 46 HA SER 46 12.995 25.504 -7.126 303 HB2 SER 46 HB2 SER 46 15.307 25.766 -6.284 304 HB3 SER 46 HB3 SER 46 15.247 24.138 -5.617 305 HG SER 46 HG SER 46 16.292 24.274 -7.689 306 H VAL 47 H VAL 47 12.898 23.167 -4.519 307 HA VAL 47 HA VAL 47 12.547 20.858 -6.115 308 HB VAL 47 HB VAL 47 11.647 21.268 -3.257 309 HG11 VAL 47 HG11 VAL 47 12.199 18.753 -4.834 310 HG12 VAL 47 HG12 VAL 47 10.614 19.337 -4.325 311 HG13 VAL 47 HG13 VAL 47 11.793 18.826 -3.118 312 HG21 VAL 47 HG21 VAL 47 14.018 21.730 -3.466 313 HG22 VAL 47 HG22 VAL 47 14.256 20.230 -4.364 314 HG23 VAL 47 HG23 VAL 47 13.780 20.175 -2.666 315 H ASN 48 H ASN 48 10.139 22.772 -4.241 316 HA ASN 48 HA ASN 48 7.993 21.191 -5.189 317 HB2 ASN 48 HB2 ASN 48 6.535 23.002 -4.250 318 HB3 ASN 48 HB3 ASN 48 7.655 22.279 -3.115 319 HD21 ASN 48 HD22 ASN 48 7.765 23.939 -1.714 320 HD22 ASN 48 HD21 ASN 48 8.450 25.481 -2.096 321 H SER 49 H SER 49 9.579 23.982 -6.461 322 HA SER 49 HA SER 49 7.616 24.750 -8.335 323 HB2 SER 49 HB2 SER 49 9.722 26.028 -7.658 324 HB3 SER 49 HB3 SER 49 10.611 24.952 -8.735 325 HG SER 49 HG SER 49 9.380 27.163 -9.372 326 H GLN 50 H GLN 50 10.380 22.523 -8.540 327 HA GLN 50 HA GLN 50 9.757 21.776 -11.250 328 HB2 GLN 50 HB2 GLN 50 11.778 20.739 -9.266 329 HB3 GLN 50 HB3 GLN 50 11.623 20.122 -10.906 330 HG2 GLN 50 HG2 GLN 50 12.177 22.287 -11.814 331 HG3 GLN 50 HG3 GLN 50 12.223 22.984 -10.196 332 HE21 GLN 50 HE22 GLN 50 13.975 22.608 -8.881 333 HE22 GLN 50 HE21 GLN 50 15.439 21.893 -9.461 334 H MET 51 H MET 51 9.300 20.388 -8.060 335 HA MET 51 HA MET 51 8.672 17.765 -8.816 336 HB2 MET 51 HB2 MET 51 9.223 18.244 -6.543 337 HB3 MET 51 HB3 MET 51 7.902 19.394 -6.401 338 HG2 MET 51 HG2 MET 51 7.050 16.704 -7.137 339 HG3 MET 51 HG3 MET 51 7.849 16.801 -5.570 340 HE1 MET 51 HE1 MET 51 7.087 18.197 -3.599 341 HE2 MET 51 HE2 MET 51 5.615 19.161 -3.514 342 HE3 MET 51 HE3 MET 51 6.985 19.724 -4.474 343 H GLN 52 H GLN 52 6.508 20.545 -8.244 344 HA GLN 52 HA GLN 52 4.135 19.055 -8.712 345 HB2 GLN 52 HB2 GLN 52 4.630 22.032 -8.863 346 HB3 GLN 52 HB3 GLN 52 3.042 21.279 -8.922 347 HG2 GLN 52 HG2 GLN 52 3.443 20.337 -6.681 348 HG3 GLN 52 HG3 GLN 52 4.986 21.192 -6.628 349 HE21 GLN 52 HE22 GLN 52 5.000 23.431 -6.483 350 HE22 GLN 52 HE21 GLN 52 3.614 24.320 -5.954 351 H LYS 53 H LYS 53 6.390 20.702 -10.780 352 HA LYS 53 HA LYS 53 4.591 20.529 -13.054 353 HB2 LYS 53 HB2 LYS 53 7.324 21.754 -12.733 354 HB3 LYS 53 HB3 LYS 53 6.386 21.784 -14.223 355 HG2 LYS 53 HG2 LYS 53 4.653 23.067 -13.178 356 HG3 LYS 53 HG3 LYS 53 5.433 22.914 -11.604 357 HD2 LYS 53 HD2 LYS 53 5.815 25.107 -12.646 358 HD3 LYS 53 HD3 LYS 53 7.311 24.215 -12.370 359 HE2 LYS 53 HE2 LYS 53 7.460 23.608 -14.661 360 HE3 LYS 53 HE3 LYS 53 5.844 24.229 -14.994 361 HZ1 LYS 53 HZ1 LYS 53 7.558 25.760 -15.741 362 HZ2 LYS 53 HZ2 LYS 53 8.184 25.861 -14.177 363 HZ3 LYS 53 HZ3 LYS 53 6.637 26.453 -14.506 364 H MET 54 H MET 54 6.416 18.359 -11.568 365 HA MET 54 HA MET 54 7.737 17.167 -13.833 366 HB2 MET 54 HB2 MET 54 8.411 16.804 -11.410 367 HB3 MET 54 HB3 MET 54 6.972 15.806 -11.238 368 HG2 MET 54 HG2 MET 54 7.888 14.457 -13.207 369 HG3 MET 54 HG3 MET 54 9.404 15.306 -12.919 370 HE1 MET 54 HE1 MET 54 10.243 14.081 -9.243 371 HE2 MET 54 HE2 MET 54 9.345 15.539 -9.684 372 HE3 MET 54 HE3 MET 54 10.789 15.083 -10.590 373 H GLY 55 H GLY 55 4.615 17.181 -12.406 374 HA2 GLY 55 HA2 GLY 55 2.693 16.594 -13.698 375 HA3 GLY 55 HA3 GLY 55 3.654 15.363 -14.505 376 HA PRO 56 HA PRO 56 1.559 13.843 -10.357 377 HB2 PRO 56 HB2 PRO 56 -1.020 13.414 -11.190 378 HB3 PRO 56 HB3 PRO 56 -0.508 14.831 -10.268 379 HG2 PRO 56 HG2 PRO 56 -0.922 14.536 -13.214 380 HG3 PRO 56 HG3 PRO 56 -1.391 15.873 -12.148 381 HD2 PRO 56 HD2 PRO 56 0.775 16.028 -13.722 382 HD3 PRO 56 HD3 PRO 56 0.763 16.745 -12.095 383 H ASN 57 H ASN 57 2.006 11.764 -10.260 384 HA ASN 57 HA ASN 57 2.657 9.690 -10.911 385 HB2 ASN 57 HB2 ASN 57 0.467 10.017 -12.977 386 HB3 ASN 57 HB3 ASN 57 1.332 8.513 -12.670 387 HD21 ASN 57 HD22 ASN 57 -1.085 10.704 -11.570 388 HD22 ASN 57 HD21 ASN 57 -1.690 9.724 -10.278 389 HA PRO 58 HA PRO 58 5.102 12.007 -14.070 390 HB2 PRO 58 HB2 PRO 58 7.509 11.745 -12.896 391 HB3 PRO 58 HB3 PRO 58 6.326 12.946 -12.365 392 HG2 PRO 58 HG2 PRO 58 6.939 10.251 -11.206 393 HG3 PRO 58 HG3 PRO 58 6.706 11.798 -10.371 394 HD2 PRO 58 HD2 PRO 58 4.757 9.930 -10.560 395 HD3 PRO 58 HD3 PRO 58 4.414 11.670 -10.507 396 HA PRO 59 HA PRO 59 6.946 8.667 -16.388 397 HB2 PRO 59 HB2 PRO 59 9.075 10.480 -17.265 398 HB3 PRO 59 HB3 PRO 59 7.789 9.729 -18.211 399 HG2 PRO 59 HG2 PRO 59 7.823 12.372 -17.685 400 HG3 PRO 59 HG3 PRO 59 6.315 11.451 -17.826 401 HD2 PRO 59 HD2 PRO 59 7.761 12.357 -15.362 402 HD3 PRO 59 HD3 PRO 59 6.019 12.365 -15.718 403 H GLN 60 H GLN 60 8.559 7.181 -16.228 404 HA GLN 60 HA GLN 60 9.966 6.978 -13.842 405 HB2 GLN 60 HB2 GLN 60 9.322 5.086 -15.313 406 HB3 GLN 60 HB3 GLN 60 10.576 5.570 -16.445 407 HG2 GLN 60 HG2 GLN 60 12.265 5.189 -14.692 408 HG3 GLN 60 HG3 GLN 60 10.984 4.625 -13.618 409 HE21 GLN 60 HE22 GLN 60 13.324 3.209 -14.633 410 HE22 GLN 60 HE21 GLN 60 12.719 1.809 -15.447 411 H HIS 61 H HIS 61 11.117 8.055 -17.029 412 HA HIS 61 HA HIS 61 13.852 8.101 -16.283 413 HB2 HIS 61 HB2 HIS 61 14.294 9.180 -18.373 414 HB3 HIS 61 HB3 HIS 61 13.028 7.994 -18.648 415 HD1 HIS 61 HD1 HIS 61 10.964 8.822 -19.802 416 HD2 HIS 61 HD2 HIS 61 13.257 11.928 -18.269 417 HE1 HIS 61 HE1 HIS 61 9.921 10.930 -20.672 418 H ARG 62 H ARG 62 11.288 10.230 -15.576 419 HA ARG 62 HA ARG 62 12.958 12.570 -15.286 420 HB2 ARG 62 HB2 ARG 62 10.065 11.976 -14.941 421 HB3 ARG 62 HB3 ARG 62 10.728 13.344 -14.056 422 HG2 ARG 62 HG2 ARG 62 10.968 12.968 -17.037 423 HG3 ARG 62 HG3 ARG 62 9.741 13.954 -16.242 424 HD2 ARG 62 HD2 ARG 62 11.529 15.315 -15.222 425 HD3 ARG 62 HD3 ARG 62 12.727 14.357 -16.090 426 HE ARG 62 HE ARG 62 11.037 15.309 -18.028 427 HH11 ARG 62 HH11 ARG 62 13.069 16.736 -15.558 428 HH12 ARG 62 HH12 ARG 62 13.345 18.198 -16.448 429 HH21 ARG 62 HH21 ARG 62 11.405 17.235 -19.200 430 HH22 ARG 62 HH22 ARG 62 12.408 18.478 -18.518 431 H LEU 63 H LEU 63 11.920 9.934 -13.345 432 HA LEU 63 HA LEU 63 12.252 11.116 -10.793 433 HB2 LEU 63 HB2 LEU 63 12.648 8.223 -11.562 434 HB3 LEU 63 HB3 LEU 63 12.339 8.839 -9.952 435 HG LEU 63 HG LEU 63 10.415 8.838 -12.275 436 HD11 LEU 63 HD11 LEU 63 10.715 6.664 -11.241 437 HD12 LEU 63 HD12 LEU 63 9.128 7.321 -10.849 438 HD13 LEU 63 HD13 LEU 63 10.418 7.361 -9.650 439 HD21 LEU 63 HD21 LEU 63 8.788 9.720 -10.634 440 HD22 LEU 63 HD22 LEU 63 10.085 10.857 -11.001 441 HD23 LEU 63 HD23 LEU 63 10.108 9.949 -9.487 442 H ARG 64 H ARG 64 14.384 9.093 -12.783 443 HA ARG 64 HA ARG 64 16.623 9.040 -11.146 444 HB2 ARG 64 HB2 ARG 64 16.212 8.783 -14.087 445 HB3 ARG 64 HB3 ARG 64 17.853 8.913 -13.470 446 HG2 ARG 64 HG2 ARG 64 17.438 6.952 -12.034 447 HG3 ARG 64 HG3 ARG 64 15.828 6.802 -12.748 448 HD2 ARG 64 HD2 ARG 64 16.731 6.368 -14.898 449 HD3 ARG 64 HD3 ARG 64 18.352 6.823 -14.382 450 HE ARG 64 HE ARG 64 17.518 4.670 -12.811 451 HH11 ARG 64 HH11 ARG 64 18.243 5.348 -16.160 452 HH12 ARG 64 HH12 ARG 64 18.866 3.763 -16.488 453 HH21 ARG 64 HH21 ARG 64 18.332 2.565 -13.225 454 HH22 ARG 64 HH22 ARG 64 18.905 2.168 -14.817 455 H ALA 65 H ALA 65 15.420 11.626 -13.096 456 HA ALA 65 HA ALA 65 17.936 13.044 -13.093 457 HB1 ALA 65 HB1 ALA 65 16.713 14.787 -14.292 458 HB2 ALA 65 HB2 ALA 65 15.204 13.919 -14.018 459 HB3 ALA 65 HB3 ALA 65 16.460 13.205 -15.027 460 H MET 66 H MET 66 15.097 12.872 -11.104 461 HA MET 66 HA MET 66 15.324 15.545 -10.104 462 HB2 MET 66 HB2 MET 66 13.143 14.758 -10.180 463 HB3 MET 66 HB3 MET 66 13.581 13.185 -9.531 464 HG2 MET 66 HG2 MET 66 12.330 14.449 -7.937 465 HG3 MET 66 HG3 MET 66 13.965 14.174 -7.358 466 HE1 MET 66 HE1 MET 66 11.312 16.783 -8.506 467 HE2 MET 66 HE2 MET 66 12.434 16.894 -9.865 468 HE3 MET 66 HE3 MET 66 12.269 18.245 -8.741 469 H ASN 67 H ASN 67 16.010 12.287 -8.801 470 HA ASN 67 HA ASN 67 16.916 13.164 -6.291 471 HB2 ASN 67 HB2 ASN 67 18.472 10.965 -6.671 472 HB3 ASN 67 HB3 ASN 67 16.803 10.912 -6.125 473 HD21 ASN 67 HD22 ASN 67 18.956 10.451 -8.833 474 HD22 ASN 67 HD21 ASN 67 17.824 9.587 -9.819 475 H THR 68 H THR 68 18.522 13.002 -9.399 476 HA THR 68 HA THR 68 21.104 13.740 -8.413 477 HB THR 68 HB THR 68 20.007 14.128 -11.211 478 HG1 THR 68 HG1 THR 68 20.744 11.835 -9.817 479 HG21 THR 68 HG21 THR 68 22.850 13.728 -10.270 480 HG22 THR 68 HG22 THR 68 22.140 15.299 -10.650 481 HG23 THR 68 HG23 THR 68 22.314 14.078 -11.915 482 H ALA 69 H ALA 69 18.372 15.474 -9.854 483 HA ALA 69 HA ALA 69 19.562 18.003 -10.034 484 HB1 ALA 69 HB1 ALA 69 17.513 17.358 -11.223 485 HB2 ALA 69 HB2 ALA 69 17.323 18.868 -10.333 486 HB3 ALA 69 HB3 ALA 69 16.633 17.374 -9.694 487 H MET 70 H MET 70 17.487 16.636 -7.457 488 HA MET 70 HA MET 70 17.478 19.027 -5.930 489 HB2 MET 70 HB2 MET 70 15.857 17.044 -5.741 490 HB3 MET 70 HB3 MET 70 17.096 16.281 -4.752 491 HG2 MET 70 HG2 MET 70 16.990 18.057 -3.142 492 HG3 MET 70 HG3 MET 70 15.891 18.974 -4.168 493 HE1 MET 70 HE1 MET 70 14.839 15.355 -1.541 494 HE2 MET 70 HE2 MET 70 16.291 16.346 -1.427 495 HE3 MET 70 HE3 MET 70 16.095 15.228 -2.780 496 H ALA 71 H ALA 71 19.471 16.115 -5.862 497 HA ALA 71 HA ALA 71 21.115 16.663 -3.713 498 HB1 ALA 71 HB1 ALA 71 21.981 15.514 -6.358 499 HB2 ALA 71 HB2 ALA 71 21.194 14.604 -5.070 500 HB3 ALA 71 HB3 ALA 71 22.788 15.310 -4.805 501 H ALA 72 H ALA 72 21.436 17.777 -7.064 502 HA ALA 72 HA ALA 72 23.799 19.242 -6.779 503 HB1 ALA 72 HB1 ALA 72 23.173 20.343 -8.846 504 HB2 ALA 72 HB2 ALA 72 21.507 19.801 -8.660 505 HB3 ALA 72 HB3 ALA 72 22.788 18.624 -8.939 506 H GLU 73 H GLU 73 20.435 20.167 -6.227 507 HA GLU 73 HA GLU 73 20.948 22.935 -5.845 508 HB2 GLU 73 HB2 GLU 73 18.623 21.258 -4.879 509 HB3 GLU 73 HB3 GLU 73 18.672 23.016 -4.911 510 HG2 GLU 73 HG2 GLU 73 18.873 21.247 -7.337 511 HG3 GLU 73 HG3 GLU 73 17.399 22.035 -6.779 512 H VAL 74 H VAL 74 20.598 20.203 -3.600 513 HA VAL 74 HA VAL 74 20.864 21.804 -1.252 514 HB VAL 74 HB VAL 74 21.413 18.842 -1.522 515 HG11 VAL 74 HG11 VAL 74 20.678 20.502 0.889 516 HG12 VAL 74 HG12 VAL 74 22.261 19.794 0.558 517 HG13 VAL 74 HG13 VAL 74 20.873 18.750 0.863 518 HG21 VAL 74 HG21 VAL 74 19.187 19.368 -2.348 519 HG22 VAL 74 HG22 VAL 74 18.835 20.253 -0.863 520 HG23 VAL 74 HG23 VAL 74 19.097 18.508 -0.809 521 H ALA 75 H ALA 75 23.093 20.336 -3.462 522 HA ALA 75 HA ALA 75 25.411 20.279 -1.884 523 HB1 ALA 75 HB1 ALA 75 26.633 20.306 -4.006 524 HB2 ALA 75 HB2 ALA 75 25.151 20.757 -4.848 525 HB3 ALA 75 HB3 ALA 75 25.271 19.187 -4.056 526 H GLU 76 H GLU 76 23.723 22.907 -3.398 527 HA GLU 76 HA GLU 76 25.859 24.742 -3.561 528 HB2 GLU 76 HB2 GLU 76 22.873 25.135 -3.476 529 HB3 GLU 76 HB3 GLU 76 24.006 26.466 -3.675 530 HG2 GLU 76 HG2 GLU 76 23.669 24.106 -5.508 531 HG3 GLU 76 HG3 GLU 76 23.172 25.770 -5.820 532 H VAL 77 H VAL 77 23.757 23.849 -0.910 533 HA VAL 77 HA VAL 77 24.497 26.184 0.632 534 HB VAL 77 HB VAL 77 23.119 25.368 2.395 535 HG11 VAL 77 HG11 VAL 77 21.819 24.730 -0.245 536 HG12 VAL 77 HG12 VAL 77 21.946 26.324 0.497 537 HG13 VAL 77 HG13 VAL 77 20.976 25.068 1.267 538 HG21 VAL 77 HG21 VAL 77 22.942 22.743 0.921 539 HG22 VAL 77 HG22 VAL 77 22.058 23.167 2.386 540 HG23 VAL 77 HG23 VAL 77 23.815 23.034 2.424 541 H VAL 78 H VAL 78 25.487 22.864 0.324 542 HA VAL 78 HA VAL 78 27.099 22.834 2.696 543 HB VAL 78 HB VAL 78 27.222 21.002 0.289 544 HG11 VAL 78 HG11 VAL 78 28.212 20.585 3.109 545 HG12 VAL 78 HG12 VAL 78 29.226 20.914 1.705 546 HG13 VAL 78 HG13 VAL 78 28.296 19.419 1.788 547 HG21 VAL 78 HG21 VAL 78 25.848 19.479 1.676 548 HG22 VAL 78 HG22 VAL 78 25.004 20.963 1.236 549 HG23 VAL 78 HG23 VAL 78 25.663 20.771 2.859 550 H ALA 79 H ALA 79 27.442 23.958 -0.525 551 HA ALA 79 HA ALA 79 30.274 23.891 -0.717 552 HB1 ALA 79 HB1 ALA 79 29.979 25.428 -2.600 553 HB2 ALA 79 HB2 ALA 79 28.298 25.682 -2.135 554 HB3 ALA 79 HB3 ALA 79 28.831 24.095 -2.679 555 H THR 80 H THR 80 28.161 25.717 1.151 556 HA THR 80 HA THR 80 30.131 27.865 1.536 557 HB THR 80 HB THR 80 27.348 27.892 2.680 558 HG1 THR 80 HG1 THR 80 26.588 28.742 0.755 559 HG21 THR 80 HG21 THR 80 29.182 30.085 1.693 560 HG22 THR 80 HG22 THR 80 28.969 29.620 3.380 561 HG23 THR 80 HG23 THR 80 27.620 30.309 2.479 562 H SER 81 H SER 81 30.119 25.018 2.611 563 HA SER 81 HA SER 81 30.037 25.605 5.484 564 HB2 SER 81 HB2 SER 81 30.357 22.960 4.042 565 HB3 SER 81 HB3 SER 81 30.221 23.168 5.788 566 HG SER 81 HG SER 81 28.223 24.260 4.162 567 HA PRO 82 HA PRO 82 34.490 26.014 5.500 568 HB2 PRO 82 HB2 PRO 82 34.829 25.594 8.192 569 HB3 PRO 82 HB3 PRO 82 34.357 27.142 7.486 570 HG2 PRO 82 HG2 PRO 82 32.654 25.045 8.771 571 HG3 PRO 82 HG3 PRO 82 32.555 26.811 8.903 572 HD2 PRO 82 HD2 PRO 82 30.887 25.396 7.329 573 HD3 PRO 82 HD3 PRO 82 31.439 27.027 6.894 574 HA PRO 83 HA PRO 83 35.690 21.791 4.780 575 HB2 PRO 83 HB2 PRO 83 38.303 22.940 5.674 576 HB3 PRO 83 HB3 PRO 83 37.950 21.905 4.285 577 HG2 PRO 83 HG2 PRO 83 38.305 24.512 3.951 578 HG3 PRO 83 HG3 PRO 83 37.038 23.654 3.052 579 HD2 PRO 83 HD2 PRO 83 36.793 25.509 5.365 580 HD3 PRO 83 HD3 PRO 83 35.675 25.226 4.019 581 H GLN 84 H GLN 84 36.780 23.452 7.738 582 HA GLN 84 HA GLN 84 37.692 21.105 9.043 583 HB2 GLN 84 HB2 GLN 84 37.871 22.474 11.023 584 HB3 GLN 84 HB3 GLN 84 38.427 23.397 9.632 585 HG2 GLN 84 HG2 GLN 84 36.242 24.529 9.551 586 HG3 GLN 84 HG3 GLN 84 35.751 23.641 10.991 587 HE21 GLN 84 HE22 GLN 84 36.723 24.125 12.963 588 HE22 GLN 84 HE21 GLN 84 37.568 25.606 13.228 589 H SER 85 H SER 85 34.541 22.344 8.536 590 HA SER 85 HA SER 85 33.493 20.484 10.571 591 HB2 SER 85 HB2 SER 85 32.278 23.124 9.722 592 HB3 SER 85 HB3 SER 85 31.608 22.009 10.915 593 HG SER 85 HG SER 85 34.003 22.378 11.747 594 H TYR 86 H TYR 86 34.023 20.540 7.514 595 HA TYR 86 HA TYR 86 31.564 20.434 6.171 596 HB2 TYR 86 HB2 TYR 86 33.713 20.666 5.009 597 HB3 TYR 86 HB3 TYR 86 34.168 19.040 5.503 598 HD1 TYR 86 HD1 TYR 86 32.955 17.083 4.562 599 HD2 TYR 86 HD2 TYR 86 32.315 21.033 3.104 600 HE1 TYR 86 HE1 TYR 86 31.926 16.156 2.536 601 HE2 TYR 86 HE2 TYR 86 31.286 20.115 1.068 602 HH TYR 86 HH TYR 86 31.439 17.919 -0.233 603 H SER 87 H SER 87 33.458 17.906 7.760 604 HA SER 87 HA SER 87 31.960 15.700 6.928 605 HB2 SER 87 HB2 SER 87 33.457 16.009 9.535 606 HB3 SER 87 HB3 SER 87 33.073 14.498 8.708 607 HG SER 87 HG SER 87 35.160 15.014 8.171 608 H ALA 88 H ALA 88 31.404 18.018 9.474 609 HA ALA 88 HA ALA 88 29.407 16.479 10.833 610 HB1 ALA 88 HB1 ALA 88 29.951 19.449 10.939 611 HB2 ALA 88 HB2 ALA 88 30.691 18.231 11.979 612 HB3 ALA 88 HB3 ALA 88 28.956 18.531 12.071 613 H VAL 89 H VAL 89 29.464 18.948 8.348 614 HA VAL 89 HA VAL 89 26.642 19.277 8.145 615 HB VAL 89 HB VAL 89 28.806 19.834 6.103 616 HG11 VAL 89 HG11 VAL 89 25.963 20.851 6.226 617 HG12 VAL 89 HG12 VAL 89 26.581 19.667 5.076 618 HG13 VAL 89 HG13 VAL 89 27.183 21.325 5.045 619 HG21 VAL 89 HG21 VAL 89 27.485 21.640 8.128 620 HG22 VAL 89 HG22 VAL 89 28.606 22.165 6.872 621 HG23 VAL 89 HG23 VAL 89 29.158 21.084 8.152 622 H LEU 90 H LEU 90 29.029 17.216 6.598 623 HA LEU 90 HA LEU 90 27.565 15.985 4.604 624 HB2 LEU 90 HB2 LEU 90 30.031 15.781 5.343 625 HB3 LEU 90 HB3 LEU 90 29.473 14.607 6.505 626 HG LEU 90 HG LEU 90 30.010 13.118 4.989 627 HD11 LEU 90 HD11 LEU 90 27.643 12.878 4.772 628 HD12 LEU 90 HD12 LEU 90 28.418 12.572 3.217 629 HD13 LEU 90 HD13 LEU 90 27.602 14.108 3.511 630 HD21 LEU 90 HD21 LEU 90 30.307 13.692 2.527 631 HD22 LEU 90 HD22 LEU 90 31.415 14.395 3.701 632 HD23 LEU 90 HD23 LEU 90 30.103 15.365 3.044 633 H ASN 91 H ASN 91 27.942 14.946 7.996 634 HA ASN 91 HA ASN 91 26.148 12.769 7.738 635 HB2 ASN 91 HB2 ASN 91 27.413 14.127 10.100 636 HB3 ASN 91 HB3 ASN 91 26.249 12.821 10.306 637 HD21 ASN 91 HD22 ASN 91 29.448 13.669 9.206 638 HD22 ASN 91 HD21 ASN 91 30.033 12.049 9.063 639 H THR 92 H THR 92 25.734 16.058 8.998 640 HA THR 92 HA THR 92 23.201 15.757 10.123 641 HB THR 92 HB THR 92 24.310 18.215 8.746 642 HG1 THR 92 HG1 THR 92 25.694 17.700 10.393 643 HG21 THR 92 HG21 THR 92 22.134 17.955 10.828 644 HG22 THR 92 HG22 THR 92 21.891 18.364 9.130 645 HG23 THR 92 HG23 THR 92 22.773 19.470 10.185 646 H ILE 93 H ILE 93 24.147 16.417 6.781 647 HA ILE 93 HA ILE 93 21.572 16.977 5.780 648 HB ILE 93 HB ILE 93 24.061 15.941 4.426 649 HG12 ILE 93 HG12 ILE 93 24.247 18.198 5.328 650 HG13 ILE 93 HG13 ILE 93 24.220 18.244 3.570 651 HG21 ILE 93 HG21 ILE 93 23.059 16.456 2.290 652 HG22 ILE 93 HG22 ILE 93 21.554 16.932 3.079 653 HG23 ILE 93 HG23 ILE 93 22.090 15.252 3.137 654 HD11 ILE 93 HD11 ILE 93 21.831 18.859 3.659 655 HD12 ILE 93 HD12 ILE 93 22.883 20.035 4.448 656 HD13 ILE 93 HD13 ILE 93 21.941 18.906 5.421 657 H GLY 94 H GLY 94 23.465 13.964 5.711 658 HA2 GLY 94 HA2 GLY 94 21.439 12.455 4.416 659 HA3 GLY 94 HA3 GLY 94 22.848 11.801 5.232 660 H ALA 95 H ALA 95 21.937 13.303 7.708 661 HA ALA 95 HA ALA 95 20.561 11.067 8.837 662 HB1 ALA 95 HB1 ALA 95 22.258 12.260 10.114 663 HB2 ALA 95 HB2 ALA 95 20.702 12.304 10.943 664 HB3 ALA 95 HB3 ALA 95 21.274 13.724 10.070 665 H CYS 96 H CYS 96 19.719 14.515 8.404 666 HA CYS 96 HA CYS 96 17.086 14.141 9.441 667 HB2 CYS 96 HB2 CYS 96 18.263 16.423 7.843 668 HB3 CYS 96 HB3 CYS 96 16.679 16.451 8.607 669 H LEU 97 H LEU 97 18.515 13.998 6.261 670 HA LEU 97 HA LEU 97 16.141 14.413 4.775 671 HB2 LEU 97 HB2 LEU 97 18.520 14.650 3.970 672 HB3 LEU 97 HB3 LEU 97 18.583 12.903 3.873 673 HG LEU 97 HG LEU 97 16.424 14.352 2.391 674 HD11 LEU 97 HD11 LEU 97 17.914 14.609 0.474 675 HD12 LEU 97 HD12 LEU 97 19.273 14.052 1.453 676 HD13 LEU 97 HD13 LEU 97 18.463 15.569 1.848 677 HD21 LEU 97 HD21 LEU 97 18.045 11.877 1.799 678 HD22 LEU 97 HD22 LEU 97 16.704 12.494 0.837 679 HD23 LEU 97 HD23 LEU 97 16.416 11.904 2.473 680 H ARG 98 H ARG 98 17.734 11.482 5.982 681 HA ARG 98 HA ARG 98 16.118 9.703 4.455 682 HB2 ARG 98 HB2 ARG 98 16.988 7.932 5.886 683 HB3 ARG 98 HB3 ARG 98 18.272 8.988 5.329 684 HG2 ARG 98 HG2 ARG 98 18.335 10.078 7.490 685 HG3 ARG 98 HG3 ARG 98 17.000 9.069 8.050 686 HD2 ARG 98 HD2 ARG 98 18.377 7.069 7.683 687 HD3 ARG 98 HD3 ARG 98 19.716 8.096 7.170 688 HE ARG 98 HE ARG 98 18.591 8.008 9.897 689 HH11 ARG 98 HH11 ARG 98 21.228 8.719 7.698 690 HH12 ARG 98 HH12 ARG 98 22.373 9.009 8.966 691 HH21 ARG 98 HH21 ARG 98 20.109 8.382 11.564 692 HH22 ARG 98 HH22 ARG 98 21.746 8.797 11.158 693 H GLU 99 H GLU 99 15.887 10.845 7.795 694 HA GLU 99 HA GLU 99 13.651 9.234 8.426 695 HB2 GLU 99 HB2 GLU 99 13.399 10.680 10.405 696 HB3 GLU 99 HB3 GLU 99 15.037 10.086 10.200 697 HG2 GLU 99 HG2 GLU 99 15.698 12.254 9.277 698 HG3 GLU 99 HG3 GLU 99 14.048 12.839 9.500 699 H SER 100 H SER 100 13.940 12.586 7.306 700 HA SER 100 HA SER 100 11.232 13.254 7.635 701 HB2 SER 100 HB2 SER 100 11.735 15.093 6.019 702 HB3 SER 100 HB3 SER 100 12.894 14.985 7.341 703 HG SER 100 HG SER 100 13.224 14.480 4.634 704 H MET 101 H MET 101 12.953 11.630 5.057 705 HA MET 101 HA MET 101 11.020 11.794 3.037 706 HB2 MET 101 HB2 MET 101 13.392 11.022 2.773 707 HB3 MET 101 HB3 MET 101 12.901 9.486 3.487 708 HG2 MET 101 HG2 MET 101 11.232 9.250 1.733 709 HG3 MET 101 HG3 MET 101 11.819 10.737 0.999 710 HE1 MET 101 HE1 MET 101 12.186 9.731 -1.209 711 HE2 MET 101 HE2 MET 101 11.490 8.231 -0.602 712 HE3 MET 101 HE3 MET 101 12.997 8.197 -1.531 713 H MET 102 H MET 102 11.482 9.397 5.621 714 HA MET 102 HA MET 102 9.283 7.801 4.706 715 HB2 MET 102 HB2 MET 102 10.418 6.287 5.875 716 HB3 MET 102 HB3 MET 102 11.510 7.536 6.448 717 HG2 MET 102 HG2 MET 102 10.765 6.590 8.381 718 HG3 MET 102 HG3 MET 102 9.702 7.980 8.219 719 HE1 MET 102 HE1 MET 102 10.060 4.144 7.527 720 HE2 MET 102 HE2 MET 102 9.322 4.680 6.014 721 HE3 MET 102 HE3 MET 102 8.407 3.672 7.134 722 H GLN 103 H GLN 103 9.836 10.295 7.102 723 HA GLN 103 HA GLN 103 7.334 10.052 8.440 724 HB2 GLN 103 HB2 GLN 103 9.541 12.011 8.398 725 HB3 GLN 103 HB3 GLN 103 7.968 12.655 8.824 726 HG2 GLN 103 HG2 GLN 103 9.305 11.984 10.783 727 HG3 GLN 103 HG3 GLN 103 7.757 11.157 10.668 728 HE21 GLN 103 HE22 GLN 103 11.197 10.825 10.569 729 HE22 GLN 103 HE21 GLN 103 11.237 9.099 10.570 730 H ALA 104 H ALA 104 7.999 10.960 5.326 731 HA ALA 104 HA ALA 104 6.082 13.061 5.043 732 HB1 ALA 104 HB1 ALA 104 7.992 12.843 3.523 733 HB2 ALA 104 HB2 ALA 104 6.455 12.837 2.656 734 HB3 ALA 104 HB3 ALA 104 7.327 11.326 2.918 735 H THR 105 H THR 105 6.097 9.828 3.548 736 HA THR 105 HA THR 105 3.638 8.930 4.441 737 HB THR 105 HB THR 105 2.597 10.847 3.370 738 HG1 THR 105 HG1 THR 105 1.561 8.735 3.195 739 HG21 THR 105 HG21 THR 105 2.743 11.193 0.939 740 HG22 THR 105 HG22 THR 105 3.936 9.896 0.842 741 HG23 THR 105 HG23 THR 105 4.310 11.369 1.733 742 H GLY 106 H GLY 106 5.744 9.190 1.605 743 HA2 GLY 106 HA2 GLY 106 5.021 6.718 0.430 744 HA3 GLY 106 HA3 GLY 106 6.485 7.635 0.094 745 H SER 107 H SER 107 8.180 7.507 1.731 746 HA SER 107 HA SER 107 8.640 5.725 3.701 747 HB2 SER 107 HB2 SER 107 7.887 3.969 1.983 748 HB3 SER 107 HB3 SER 107 9.377 4.331 1.116 749 HG SER 107 HG SER 107 9.716 2.584 2.479 750 H VAL 108 H VAL 108 11.127 4.967 3.579 751 HA VAL 108 HA VAL 108 12.577 7.171 2.304 752 HB VAL 108 HB VAL 108 12.929 7.282 4.663 753 HG11 VAL 108 HG11 VAL 108 12.320 5.030 5.311 754 HG12 VAL 108 HG12 VAL 108 13.895 5.471 5.981 755 HG13 VAL 108 HG13 VAL 108 13.799 4.402 4.579 756 HG21 VAL 108 HG21 VAL 108 15.362 7.018 4.811 757 HG22 VAL 108 HG22 VAL 108 14.859 7.772 3.299 758 HG23 VAL 108 HG23 VAL 108 15.341 6.075 3.319 759 H ASP 109 H ASP 109 13.117 6.484 0.388 760 HA ASP 109 HA ASP 109 13.657 3.747 -0.224 761 HB2 ASP 109 HB2 ASP 109 12.588 5.211 -1.858 762 HB3 ASP 109 HB3 ASP 109 14.010 6.247 -1.889 763 H ASN 110 H ASN 110 15.582 2.769 -0.753 764 HA ASN 110 HA ASN 110 17.840 3.914 0.659 765 HB2 ASN 110 HB2 ASN 110 18.860 1.668 0.375 766 HB3 ASN 110 HB3 ASN 110 17.289 1.619 1.161 767 HD21 ASN 110 HD22 ASN 110 15.545 0.711 0.093 768 HD22 ASN 110 HD21 ASN 110 15.735 -0.265 -1.325 769 H ALA 111 H ALA 111 16.816 3.870 -2.547 770 HA ALA 111 HA ALA 111 19.561 4.005 -3.586 771 HB1 ALA 111 HB1 ALA 111 17.978 2.609 -4.833 772 HB2 ALA 111 HB2 ALA 111 18.530 3.974 -5.805 773 HB3 ALA 111 HB3 ALA 111 16.928 4.007 -5.066 774 H PHE 112 H PHE 112 16.562 5.856 -3.372 775 HA PHE 112 HA PHE 112 17.426 8.242 -4.554 776 HB2 PHE 112 HB2 PHE 112 15.078 7.780 -3.999 777 HB3 PHE 112 HB3 PHE 112 15.462 7.830 -2.283 778 HD1 PHE 112 HD1 PHE 112 15.047 9.824 -5.331 779 HD2 PHE 112 HD2 PHE 112 15.747 9.920 -1.134 780 HE1 PHE 112 HE1 PHE 112 14.573 12.237 -5.309 781 HE2 PHE 112 HE2 PHE 112 15.269 12.333 -1.105 782 HZ PHE 112 HZ PHE 112 14.684 13.494 -3.196 783 H THR 113 H THR 113 17.316 7.415 -1.080 784 HA THR 113 HA THR 113 18.691 9.739 -0.239 785 HB THR 113 HB THR 113 18.986 8.561 1.925 786 HG1 THR 113 HG1 THR 113 17.479 6.399 0.900 787 HG21 THR 113 HG21 THR 113 16.227 8.312 0.718 788 HG22 THR 113 HG22 THR 113 16.911 9.765 1.446 789 HG23 THR 113 HG23 THR 113 16.602 8.342 2.439 790 H ASN 114 H ASN 114 19.791 6.879 -1.688 791 HA ASN 114 HA ASN 114 22.446 6.843 -0.607 792 HB2 ASN 114 HB2 ASN 114 21.301 4.856 -1.587 793 HB3 ASN 114 HB3 ASN 114 21.365 5.632 -3.161 794 HD21 ASN 114 HD22 ASN 114 22.421 3.131 -2.460 795 HD22 ASN 114 HD21 ASN 114 24.129 3.186 -2.706 796 H GLU 115 H GLU 115 21.295 7.434 -3.916 797 HA GLU 115 HA GLU 115 23.565 8.600 -4.901 798 HB2 GLU 115 HB2 GLU 115 21.736 7.747 -6.275 799 HB3 GLU 115 HB3 GLU 115 20.688 9.044 -5.704 800 HG2 GLU 115 HG2 GLU 115 22.088 10.674 -6.709 801 HG3 GLU 115 HG3 GLU 115 23.241 9.442 -7.192 802 H VAL 116 H VAL 116 20.666 10.223 -3.558 803 HA VAL 116 HA VAL 116 21.516 12.822 -4.166 804 HB VAL 116 HB VAL 116 19.191 12.170 -3.466 805 HG11 VAL 116 HG11 VAL 116 20.327 12.334 -0.685 806 HG12 VAL 116 HG12 VAL 116 19.696 10.888 -1.475 807 HG13 VAL 116 HG13 VAL 116 18.615 12.231 -1.097 808 HG21 VAL 116 HG21 VAL 116 19.775 14.502 -3.709 809 HG22 VAL 116 HG22 VAL 116 20.432 14.535 -2.071 810 HG23 VAL 116 HG23 VAL 116 18.703 14.296 -2.325 811 H MET 117 H MET 117 22.125 10.816 -1.347 812 HA MET 117 HA MET 117 23.260 12.690 0.364 813 HB2 MET 117 HB2 MET 117 22.813 9.977 0.402 814 HB3 MET 117 HB3 MET 117 24.564 10.062 0.357 815 HG2 MET 117 HG2 MET 117 22.833 11.439 2.396 816 HG3 MET 117 HG3 MET 117 23.612 9.879 2.631 817 HE1 MET 117 HE1 MET 117 23.750 13.541 3.073 818 HE2 MET 117 HE2 MET 117 24.586 13.640 1.522 819 HE3 MET 117 HE3 MET 117 25.447 14.015 3.017 820 H GLN 118 H GLN 118 24.879 10.551 -1.972 821 HA GLN 118 HA GLN 118 27.463 11.608 -1.448 822 HB2 GLN 118 HB2 GLN 118 27.249 9.368 -2.314 823 HB3 GLN 118 HB3 GLN 118 26.395 9.944 -3.737 824 HG2 GLN 118 HG2 GLN 118 28.726 9.318 -4.198 825 HG3 GLN 118 HG3 GLN 118 28.381 11.005 -4.569 826 HE21 GLN 118 HE22 GLN 118 30.593 11.464 -4.470 827 HE22 GLN 118 HE21 GLN 118 31.417 11.614 -2.959 828 H LEU 119 H LEU 119 25.116 12.188 -4.065 829 HA LEU 119 HA LEU 119 26.774 13.890 -5.545 830 HB2 LEU 119 HB2 LEU 119 23.866 13.325 -5.476 831 HB3 LEU 119 HB3 LEU 119 24.395 14.772 -6.312 832 HG LEU 119 HG LEU 119 25.946 13.304 -7.648 833 HD11 LEU 119 HD11 LEU 119 24.316 11.131 -6.374 834 HD12 LEU 119 HD12 LEU 119 26.062 11.365 -6.248 835 HD13 LEU 119 HD13 LEU 119 25.338 10.924 -7.796 836 HD21 LEU 119 HD21 LEU 119 23.006 12.735 -7.883 837 HD22 LEU 119 HD22 LEU 119 24.210 12.576 -9.163 838 HD23 LEU 119 HD23 LEU 119 23.824 14.166 -8.505 839 H VAL 120 H VAL 120 24.572 14.586 -2.848 840 HA VAL 120 HA VAL 120 24.670 17.392 -3.038 841 HB VAL 120 HB VAL 120 24.288 15.583 -0.645 842 HG11 VAL 120 HG11 VAL 120 23.573 17.547 0.631 843 HG12 VAL 120 HG12 VAL 120 24.051 18.592 -0.705 844 HG13 VAL 120 HG13 VAL 120 25.271 17.670 0.171 845 HG21 VAL 120 HG21 VAL 120 22.428 17.339 -2.234 846 HG22 VAL 120 HG22 VAL 120 21.973 16.446 -0.783 847 HG23 VAL 120 HG23 VAL 120 22.473 15.577 -2.234 848 H LYS 121 H LYS 121 27.074 15.110 -2.101 849 HA LYS 121 HA LYS 121 28.687 17.167 -0.794 850 HB2 LYS 121 HB2 LYS 121 29.603 14.347 -1.248 851 HB3 LYS 121 HB3 LYS 121 30.060 15.458 0.026 852 HG2 LYS 121 HG2 LYS 121 27.672 13.699 -0.202 853 HG3 LYS 121 HG3 LYS 121 28.767 13.938 1.155 854 HD2 LYS 121 HD2 LYS 121 26.691 15.898 0.187 855 HD3 LYS 121 HD3 LYS 121 26.537 14.847 1.590 856 HE2 LYS 121 HE2 LYS 121 28.335 15.992 2.701 857 HE3 LYS 121 HE3 LYS 121 28.673 16.952 1.264 858 HZ1 LYS 121 HZ1 LYS 121 27.413 18.218 2.861 859 HZ2 LYS 121 HZ2 LYS 121 26.199 17.042 2.896 860 HZ3 LYS 121 HZ3 LYS 121 26.470 17.934 1.486 861 H MET 122 H MET 122 28.925 14.827 -3.428 862 HA MET 122 HA MET 122 31.413 15.615 -4.431 863 HB2 MET 122 HB2 MET 122 30.350 13.495 -5.030 864 HB3 MET 122 HB3 MET 122 29.086 14.361 -5.893 865 HG2 MET 122 HG2 MET 122 30.790 15.232 -7.450 866 HG3 MET 122 HG3 MET 122 32.009 14.275 -6.611 867 HE1 MET 122 HE1 MET 122 28.755 14.218 -8.746 868 HE2 MET 122 HE2 MET 122 28.261 13.182 -7.406 869 HE3 MET 122 HE3 MET 122 28.490 12.496 -9.013 870 H LEU 123 H LEU 123 28.155 16.727 -5.295 871 HA LEU 123 HA LEU 123 29.145 18.411 -7.417 872 HB2 LEU 123 HB2 LEU 123 26.416 18.289 -6.129 873 HB3 LEU 123 HB3 LEU 123 26.808 19.177 -7.588 874 HG LEU 123 HG LEU 123 27.016 16.175 -7.318 875 HD11 LEU 123 HD11 LEU 123 24.876 17.858 -8.611 876 HD12 LEU 123 HD12 LEU 123 24.699 16.907 -7.137 877 HD13 LEU 123 HD13 LEU 123 24.990 16.100 -8.679 878 HD21 LEU 123 HD21 LEU 123 27.151 16.247 -9.772 879 HD22 LEU 123 HD22 LEU 123 28.506 17.077 -9.003 880 HD23 LEU 123 HD23 LEU 123 27.181 18.009 -9.705 881 H SER 124 H SER 124 29.413 18.652 -4.217 882 HA SER 124 HA SER 124 28.897 21.527 -4.071 883 HB2 SER 124 HB2 SER 124 27.841 20.000 -2.367 884 HB3 SER 124 HB3 SER 124 29.461 19.564 -1.828 885 HG SER 124 HG SER 124 28.236 22.108 -1.765 886 H ALA 125 H ALA 125 31.182 19.156 -2.763 887 HA ALA 125 HA ALA 125 33.516 20.315 -3.807 888 HB1 ALA 125 HB1 ALA 125 32.958 21.037 -0.934 889 HB2 ALA 125 HB2 ALA 125 32.935 22.161 -2.291 890 HB3 ALA 125 HB3 ALA 125 34.442 21.371 -1.827 891 H ASP 126 H ASP 126 34.561 18.461 -4.020 892 HA ASP 126 HA ASP 126 34.620 16.583 -1.764 893 HB2 ASP 126 HB2 ASP 126 33.989 15.692 -4.008 894 HB3 ASP 126 HB3 ASP 126 35.573 16.165 -4.612 895 H SER 127 H SER 127 36.110 19.204 -2.462 896 HA SER 127 HA SER 127 38.883 18.364 -2.307 897 HB2 SER 127 HB2 SER 127 37.780 21.177 -2.148 898 HB3 SER 127 HB3 SER 127 39.411 20.682 -2.598 899 HG SER 127 HG SER 127 38.539 19.719 -4.470 900 H ALA 128 H ALA 128 36.716 18.069 -0.139 901 HA ALA 128 HA ALA 128 37.603 19.834 1.960 902 HB1 ALA 128 HB1 ALA 128 35.245 19.286 1.788 903 HB2 ALA 128 HB2 ALA 128 35.898 18.717 3.324 904 HB3 ALA 128 HB3 ALA 128 35.605 17.575 2.012 905 H ASN 129 H ASN 129 39.804 19.152 2.057 906 HA ASN 129 HA ASN 129 40.104 16.731 3.704 907 HB2 ASN 129 HB2 ASN 129 42.426 16.552 2.923 908 HB3 ASN 129 HB3 ASN 129 41.300 16.477 1.573 909 HD21 ASN 129 HD22 ASN 129 41.312 18.085 0.042 910 HD22 ASN 129 HD21 ASN 129 42.528 19.314 -0.021 911 H GLU 130 H GLU 130 40.940 16.990 5.696 912 HA GLU 130 HA GLU 130 42.202 19.554 6.349 913 HB2 GLU 130 HB2 GLU 130 39.581 19.010 7.021 914 HB3 GLU 130 HB3 GLU 130 40.457 18.529 8.470 915 HG2 GLU 130 HG2 GLU 130 40.462 21.230 7.139 916 HG3 GLU 130 HG3 GLU 130 39.785 20.807 8.711 917 H VAL 131 H VAL 131 43.636 19.498 8.052 918 HA VAL 131 HA VAL 131 45.431 18.614 9.116 919 HB VAL 131 HB VAL 131 43.593 18.546 10.805 920 HG11 VAL 131 HG11 VAL 131 42.232 16.746 9.870 921 HG12 VAL 131 HG12 VAL 131 42.678 16.424 11.544 922 HG13 VAL 131 HG13 VAL 131 43.511 15.589 10.234 923 HG21 VAL 131 HG21 VAL 131 45.799 16.516 11.095 924 HG22 VAL 131 HG22 VAL 131 44.839 17.164 12.424 925 HG23 VAL 131 HG23 VAL 131 45.879 18.236 11.485 926 H SER 132 H SER 132 45.207 17.522 6.604 927 HA SER 132 HA SER 132 45.536 14.684 6.687 928 HB2 SER 132 HB2 SER 132 46.361 16.606 4.500 929 HB3 SER 132 HB3 SER 132 46.108 14.868 4.337 930 HG SER 132 HG SER 132 44.251 16.939 4.557 931 H THR 133 H THR 133 47.102 14.581 8.386 932 HA THR 133 HA THR 133 49.840 15.203 7.510 933 HB THR 133 HB THR 133 50.388 14.994 9.988 934 HG1 THR 133 HG1 THR 133 48.243 13.976 10.406 935 HG21 THR 133 HG21 THR 133 49.603 17.270 10.505 936 HG22 THR 133 HG22 THR 133 48.526 17.202 9.109 937 HG23 THR 133 HG23 THR 133 50.275 17.159 8.878 Start of MODEL 17 1 HA2 GLY 1 HA2 GLY 1 5.425 -1.074 -0.180 2 HA3 GLY 1 HA3 GLY 1 5.896 -1.292 1.499 3 H SER 2 H SER 2 8.035 -0.942 1.438 4 HA SER 2 HA SER 2 10.223 -1.459 1.276 5 HB2 SER 2 HB2 SER 2 9.286 -3.934 -0.186 6 HB3 SER 2 HB3 SER 2 10.942 -3.639 0.348 7 HG SER 2 HG SER 2 9.358 -3.211 2.426 8 H GLY 3 H GLY 3 8.596 -2.111 -1.856 9 HA2 GLY 3 HA2 GLY 3 10.269 -0.072 -3.072 10 HA3 GLY 3 HA3 GLY 3 10.562 -1.704 -3.653 11 H ASN 4 H ASN 4 9.360 0.847 -4.819 12 HA ASN 4 HA ASN 4 7.321 -0.479 -6.369 13 HB2 ASN 4 HB2 ASN 4 6.078 0.384 -4.358 14 HB3 ASN 4 HB3 ASN 4 6.585 2.010 -4.800 15 HD21 ASN 4 HD22 ASN 4 4.501 2.746 -5.094 16 HD22 ASN 4 HD21 ASN 4 3.516 2.247 -6.426 17 H SER 5 H SER 5 6.736 0.814 -8.280 18 HA SER 5 HA SER 5 8.982 2.313 -9.228 19 HB2 SER 5 HB2 SER 5 6.292 1.911 -10.552 20 HB3 SER 5 HB3 SER 5 7.786 2.422 -11.340 21 HG SER 5 HG SER 5 8.655 0.347 -10.541 22 H GLN 6 H GLN 6 6.353 3.125 -7.413 23 HA GLN 6 HA GLN 6 6.754 5.965 -7.990 24 HB2 GLN 6 HB2 GLN 6 4.211 4.590 -7.094 25 HB3 GLN 6 HB3 GLN 6 4.423 6.334 -7.160 26 HG2 GLN 6 HG2 GLN 6 4.734 4.555 -9.561 27 HG3 GLN 6 HG3 GLN 6 3.200 5.283 -9.089 28 HE21 GLN 6 HE22 GLN 6 6.420 5.891 -10.295 29 HE22 GLN 6 HE21 GLN 6 6.107 7.499 -10.856 30 HA PRO 7 HA PRO 7 8.138 4.889 -3.745 31 HB2 PRO 7 HB2 PRO 7 10.340 6.485 -3.724 32 HB3 PRO 7 HB3 PRO 7 10.322 4.857 -4.408 33 HG2 PRO 7 HG2 PRO 7 10.221 7.492 -5.784 34 HG3 PRO 7 HG3 PRO 7 10.997 5.986 -6.297 35 HD2 PRO 7 HD2 PRO 7 8.578 6.921 -7.250 36 HD3 PRO 7 HD3 PRO 7 9.103 5.228 -7.309 37 H ILE 8 H ILE 8 9.204 8.199 -4.408 38 HA ILE 8 HA ILE 8 7.313 9.091 -2.345 39 HB ILE 8 HB ILE 8 9.629 9.091 -1.525 40 HG12 ILE 8 HG12 ILE 8 9.708 11.527 -0.849 41 HG13 ILE 8 HG13 ILE 8 8.333 11.788 -1.912 42 HG21 ILE 8 HG21 ILE 8 10.157 11.068 -3.736 43 HG22 ILE 8 HG22 ILE 8 10.818 9.439 -3.603 44 HG23 ILE 8 HG23 ILE 8 11.272 10.673 -2.428 45 HD11 ILE 8 HD11 ILE 8 8.392 9.941 0.455 46 HD12 ILE 8 HD12 ILE 8 7.007 10.243 -0.596 47 HD13 ILE 8 HD13 ILE 8 7.657 11.542 0.407 48 H TRP 9 H TRP 9 8.881 9.881 -5.402 49 HA TRP 9 HA TRP 9 7.478 12.391 -5.654 50 HB2 TRP 9 HB2 TRP 9 8.980 10.864 -7.791 51 HB3 TRP 9 HB3 TRP 9 8.475 12.543 -7.866 52 HD1 TRP 9 HD1 TRP 9 11.295 10.351 -6.745 53 HE1 TRP 9 HE1 TRP 9 13.161 11.791 -5.714 54 HE3 TRP 9 HE3 TRP 9 8.781 14.789 -6.369 55 HZ2 TRP 9 HZ2 TRP 9 13.520 14.457 -4.854 56 HZ3 TRP 9 HZ3 TRP 9 9.959 16.735 -5.431 57 HH2 TRP 9 HH2 TRP 9 12.278 16.572 -4.688 58 H THR 10 H THR 10 5.461 11.040 -5.160 59 HA THR 10 HA THR 10 4.263 10.126 -7.685 60 HB THR 10 HB THR 10 3.382 9.301 -4.919 61 HG1 THR 10 HG1 THR 10 4.597 7.366 -5.338 62 HG21 THR 10 HG21 THR 10 1.762 8.999 -6.720 63 HG22 THR 10 HG22 THR 10 2.339 7.445 -6.118 64 HG23 THR 10 HG23 THR 10 2.953 8.083 -7.643 65 H ASN 11 H ASN 11 3.890 11.987 -4.749 66 HA ASN 11 HA ASN 11 1.548 13.333 -5.864 67 HB2 ASN 11 HB2 ASN 11 0.653 11.641 -4.348 68 HB3 ASN 11 HB3 ASN 11 1.732 12.180 -3.068 69 HD21 ASN 11 HD22 ASN 11 -0.008 12.554 -1.694 70 HD22 ASN 11 HD21 ASN 11 -1.055 13.916 -1.892 71 HA PRO 12 HA PRO 12 3.966 16.972 -5.002 72 HB2 PRO 12 HB2 PRO 12 1.165 17.980 -4.671 73 HB3 PRO 12 HB3 PRO 12 2.524 18.711 -5.533 74 HG2 PRO 12 HG2 PRO 12 0.609 17.419 -6.857 75 HG3 PRO 12 HG3 PRO 12 2.308 17.294 -7.350 76 HD2 PRO 12 HD2 PRO 12 0.580 15.290 -6.013 77 HD3 PRO 12 HD3 PRO 12 1.986 15.049 -7.066 78 H ASN 13 H ASN 13 1.132 16.183 -2.987 79 HA ASN 13 HA ASN 13 2.063 17.857 -0.832 80 HB2 ASN 13 HB2 ASN 13 -0.387 17.390 -1.479 81 HB3 ASN 13 HB3 ASN 13 -0.183 15.860 -0.633 82 HD21 ASN 13 HD22 ASN 13 1.341 18.874 0.316 83 HD22 ASN 13 HD21 ASN 13 0.457 19.072 1.787 84 H ALA 14 H ALA 14 3.239 15.070 -1.839 85 HA ALA 14 HA ALA 14 3.746 14.041 0.879 86 HB1 ALA 14 HB1 ALA 14 3.945 12.604 -1.767 87 HB2 ALA 14 HB2 ALA 14 2.667 12.402 -0.569 88 HB3 ALA 14 HB3 ALA 14 4.318 11.909 -0.192 89 H ALA 15 H ALA 15 5.183 14.862 -2.223 90 HA ALA 15 HA ALA 15 7.861 14.260 -1.494 91 HB1 ALA 15 HB1 ALA 15 6.848 16.062 -3.690 92 HB2 ALA 15 HB2 ALA 15 7.114 14.324 -3.826 93 HB3 ALA 15 HB3 ALA 15 8.479 15.406 -3.549 94 H MET 16 H MET 16 5.998 17.276 -1.636 95 HA MET 16 HA MET 16 8.071 19.019 -0.935 96 HB2 MET 16 HB2 MET 16 5.220 19.134 -1.264 97 HB3 MET 16 HB3 MET 16 5.675 20.027 0.180 98 HG2 MET 16 HG2 MET 16 6.870 20.465 -2.541 99 HG3 MET 16 HG3 MET 16 5.522 21.383 -1.888 100 HE1 MET 16 HE1 MET 16 9.298 20.350 -1.157 101 HE2 MET 16 HE2 MET 16 9.953 21.979 -1.059 102 HE3 MET 16 HE3 MET 16 9.171 21.433 -2.538 103 H THR 17 H THR 17 6.051 16.942 0.976 104 HA THR 17 HA THR 17 6.415 17.971 3.523 105 HB THR 17 HB THR 17 6.237 15.058 2.731 106 HG1 THR 17 HG1 THR 17 3.937 16.222 3.593 107 HG21 THR 17 HG21 THR 17 5.614 16.493 5.321 108 HG22 THR 17 HG22 THR 17 6.845 15.254 5.063 109 HG23 THR 17 HG23 THR 17 5.133 14.836 4.972 110 H MET 18 H MET 18 8.364 15.436 1.891 111 HA MET 18 HA MET 18 10.167 15.256 4.082 112 HB2 MET 18 HB2 MET 18 11.547 13.841 2.586 113 HB3 MET 18 HB3 MET 18 9.876 13.324 2.696 114 HG2 MET 18 HG2 MET 18 10.367 13.080 0.460 115 HG3 MET 18 HG3 MET 18 9.540 14.633 0.517 116 HE1 MET 18 HE1 MET 18 11.369 13.461 -1.855 117 HE2 MET 18 HE2 MET 18 12.251 14.908 -2.349 118 HE3 MET 18 HE3 MET 18 10.526 15.008 -1.981 119 H THR 19 H THR 19 10.094 17.178 1.172 120 HA THR 19 HA THR 19 12.767 18.065 1.214 121 HB THR 19 HB THR 19 10.337 19.580 0.260 122 HG1 THR 19 HG1 THR 19 11.585 17.319 -0.694 123 HG21 THR 19 HG21 THR 19 11.912 20.632 -1.295 124 HG22 THR 19 HG22 THR 19 13.238 19.738 -0.552 125 HG23 THR 19 HG23 THR 19 12.350 20.943 0.384 126 H ASN 20 H ASN 20 9.803 19.476 2.595 127 HA ASN 20 HA ASN 20 11.149 21.750 3.658 128 HB2 ASN 20 HB2 ASN 20 8.388 20.616 4.071 129 HB3 ASN 20 HB3 ASN 20 8.940 22.094 4.852 130 HD21 ASN 20 HD22 ASN 20 6.874 21.482 2.769 131 HD22 ASN 20 HD21 ASN 20 7.212 22.581 1.482 132 H ASN 21 H ASN 21 10.211 18.611 4.964 133 HA ASN 21 HA ASN 21 10.752 19.204 7.671 134 HB2 ASN 21 HB2 ASN 21 10.798 16.605 6.129 135 HB3 ASN 21 HB3 ASN 21 11.102 16.689 7.856 136 HD21 ASN 21 HD22 ASN 21 9.008 15.296 6.494 137 HD22 ASN 21 HD21 ASN 21 7.512 15.942 7.073 138 H LEU 22 H LEU 22 12.766 18.277 4.975 139 HA LEU 22 HA LEU 22 15.130 17.666 6.369 140 HB2 LEU 22 HB2 LEU 22 14.883 17.116 4.025 141 HB3 LEU 22 HB3 LEU 22 14.692 18.806 3.605 142 HG LEU 22 HG LEU 22 17.050 19.187 4.366 143 HD11 LEU 22 HD11 LEU 22 17.278 17.262 5.833 144 HD12 LEU 22 HD12 LEU 22 18.517 17.246 4.576 145 HD13 LEU 22 HD13 LEU 22 17.119 16.178 4.452 146 HD21 LEU 22 HD21 LEU 22 16.544 18.980 2.019 147 HD22 LEU 22 HD22 LEU 22 16.583 17.222 2.132 148 HD23 LEU 22 HD23 LEU 22 18.063 18.153 2.364 149 H VAL 23 H VAL 23 13.890 20.681 5.018 150 HA VAL 23 HA VAL 23 16.072 22.319 5.684 151 HB VAL 23 HB VAL 23 13.163 23.116 5.438 152 HG11 VAL 23 HG11 VAL 23 14.071 25.334 4.846 153 HG12 VAL 23 HG12 VAL 23 15.688 24.753 5.238 154 HG13 VAL 23 HG13 VAL 23 14.460 24.857 6.498 155 HG21 VAL 23 HG21 VAL 23 13.702 23.658 3.112 156 HG22 VAL 23 HG22 VAL 23 13.939 21.942 3.448 157 HG23 VAL 23 HG23 VAL 23 15.331 23.020 3.342 158 H GLN 24 H GLN 24 13.057 21.615 7.446 159 HA GLN 24 HA GLN 24 13.667 23.433 9.553 160 HB2 GLN 24 HB2 GLN 24 11.695 22.702 10.608 161 HB3 GLN 24 HB3 GLN 24 11.359 22.599 8.888 162 HG2 GLN 24 HG2 GLN 24 11.766 20.195 8.959 163 HG3 GLN 24 HG3 GLN 24 12.064 20.307 10.693 164 HE21 GLN 24 HE22 GLN 24 9.669 20.572 8.182 165 HE22 GLN 24 HE21 GLN 24 8.291 20.434 9.213 166 H CYS 25 H CYS 25 14.301 20.031 9.016 167 HA CYS 25 HA CYS 25 15.147 19.439 11.662 168 HB2 CYS 25 HB2 CYS 25 14.538 17.662 10.092 169 HB3 CYS 25 HB3 CYS 25 15.877 18.111 9.042 170 H ALA 26 H ALA 26 16.881 20.404 8.705 171 HA ALA 26 HA ALA 26 19.459 20.365 9.884 172 HB1 ALA 26 HB1 ALA 26 19.061 20.286 7.450 173 HB2 ALA 26 HB2 ALA 26 20.183 21.565 7.913 174 HB3 ALA 26 HB3 ALA 26 18.514 21.963 7.507 175 H SER 27 H SER 27 16.874 22.661 9.887 176 HA SER 27 HA SER 27 18.399 24.924 10.722 177 HB2 SER 27 HB2 SER 27 16.089 24.942 9.637 178 HB3 SER 27 HB3 SER 27 15.453 24.455 11.208 179 HG SER 27 HG SER 27 17.155 26.613 11.319 180 H ARG 28 H ARG 28 17.514 22.078 12.251 181 HA ARG 28 HA ARG 28 17.723 23.298 14.917 182 HB2 ARG 28 HB2 ARG 28 16.273 20.873 13.953 183 HB3 ARG 28 HB3 ARG 28 16.654 21.110 15.655 184 HG2 ARG 28 HG2 ARG 28 15.437 23.261 15.576 185 HG3 ARG 28 HG3 ARG 28 14.972 22.888 13.912 186 HD2 ARG 28 HD2 ARG 28 13.973 20.806 14.709 187 HD3 ARG 28 HD3 ARG 28 14.336 21.270 16.362 188 HE ARG 28 HE ARG 28 12.650 23.023 14.721 189 HH11 ARG 28 HH11 ARG 28 13.020 20.855 17.437 190 HH12 ARG 28 HH12 ARG 28 11.500 21.282 18.152 191 HH21 ARG 28 HH21 ARG 28 10.636 23.587 15.665 192 HH22 ARG 28 HH22 ARG 28 10.146 22.832 17.151 193 H SER 29 H SER 29 19.823 22.322 12.962 194 HA SER 29 HA SER 29 20.863 19.915 14.158 195 HB2 SER 29 HB2 SER 29 22.699 20.177 12.525 196 HB3 SER 29 HB3 SER 29 21.118 20.284 11.752 197 HG SER 29 HG SER 29 21.408 22.375 11.365 198 H GLY 30 H GLY 30 21.685 23.342 14.100 199 HA2 GLY 30 HA2 GLY 30 22.880 24.523 15.748 200 HA3 GLY 30 HA3 GLY 30 23.424 22.991 16.424 201 H VAL 31 H VAL 31 23.735 22.621 13.243 202 HA VAL 31 HA VAL 31 26.599 23.249 13.327 203 HB VAL 31 HB VAL 31 25.091 21.481 11.391 204 HG11 VAL 31 HG11 VAL 31 28.047 21.795 11.899 205 HG12 VAL 31 HG12 VAL 31 27.170 22.372 10.482 206 HG13 VAL 31 HG13 VAL 31 27.311 20.640 10.788 207 HG21 VAL 31 HG21 VAL 31 24.970 20.559 13.637 208 HG22 VAL 31 HG22 VAL 31 26.718 20.722 13.816 209 HG23 VAL 31 HG23 VAL 31 26.054 19.594 12.635 210 H LEU 32 H LEU 32 23.731 23.535 11.275 211 HA LEU 32 HA LEU 32 25.051 25.087 9.270 212 HB2 LEU 32 HB2 LEU 32 22.175 24.416 9.825 213 HB3 LEU 32 HB3 LEU 32 22.607 25.577 8.588 214 HG LEU 32 HG LEU 32 23.998 23.765 7.512 215 HD11 LEU 32 HD11 LEU 32 24.254 22.268 9.395 216 HD12 LEU 32 HD12 LEU 32 23.431 21.444 8.070 217 HD13 LEU 32 HD13 LEU 32 22.509 22.015 9.461 218 HD21 LEU 32 HD21 LEU 32 21.025 23.380 7.774 219 HD22 LEU 32 HD22 LEU 32 22.033 22.646 6.525 220 HD23 LEU 32 HD23 LEU 32 21.865 24.401 6.608 221 H THR 33 H THR 33 25.062 27.252 8.957 222 HA THR 33 HA THR 33 24.575 28.877 11.306 223 HB THR 33 HB THR 33 26.632 29.279 10.086 224 HG1 THR 33 HG1 THR 33 25.766 31.628 9.291 225 HG21 THR 33 HG21 THR 33 25.941 28.564 7.863 226 HG22 THR 33 HG22 THR 33 26.652 30.177 7.809 227 HG23 THR 33 HG23 THR 33 24.902 29.981 7.719 228 H ALA 34 H ALA 34 23.516 31.108 10.896 229 HA ALA 34 HA ALA 34 20.829 30.722 10.239 230 HB1 ALA 34 HB1 ALA 34 20.588 33.133 10.390 231 HB2 ALA 34 HB2 ALA 34 22.336 33.330 10.285 232 HB3 ALA 34 HB3 ALA 34 21.621 32.536 11.688 233 H ASP 35 H ASP 35 23.543 31.790 8.325 234 HA ASP 35 HA ASP 35 22.051 32.722 6.080 235 HB2 ASP 35 HB2 ASP 35 24.850 31.654 5.867 236 HB3 ASP 35 HB3 ASP 35 24.120 33.021 5.029 237 H GLN 36 H GLN 36 23.195 29.662 7.183 238 HA GLN 36 HA GLN 36 22.936 28.368 4.590 239 HB2 GLN 36 HB2 GLN 36 24.843 27.969 6.196 240 HB3 GLN 36 HB3 GLN 36 23.698 27.146 7.240 241 HG2 GLN 36 HG2 GLN 36 23.273 25.500 5.520 242 HG3 GLN 36 HG3 GLN 36 24.356 26.352 4.422 243 HE21 GLN 36 HE22 GLN 36 25.659 24.547 4.199 244 HE22 GLN 36 HE21 GLN 36 26.742 24.037 5.453 245 H MET 37 H MET 37 20.928 29.207 7.021 246 HA MET 37 HA MET 37 19.142 26.925 6.509 247 HB2 MET 37 HB2 MET 37 19.090 28.989 8.713 248 HB3 MET 37 HB3 MET 37 17.834 27.785 8.459 249 HG2 MET 37 HG2 MET 37 19.450 26.001 8.833 250 HG3 MET 37 HG3 MET 37 20.725 27.197 9.062 251 HE1 MET 37 HE1 MET 37 19.354 29.457 10.803 252 HE2 MET 37 HE2 MET 37 20.946 28.762 11.111 253 HE3 MET 37 HE3 MET 37 19.768 28.881 12.417 254 H ASP 38 H ASP 38 19.853 29.875 5.389 255 HA ASP 38 HA ASP 38 17.091 30.652 4.804 256 HB2 ASP 38 HB2 ASP 38 18.575 32.434 5.598 257 HB3 ASP 38 HB3 ASP 38 19.697 32.097 4.282 258 H ASP 39 H ASP 39 20.152 29.837 3.232 259 HA ASP 39 HA ASP 39 19.103 29.885 0.594 260 HB2 ASP 39 HB2 ASP 39 21.167 28.536 0.027 261 HB3 ASP 39 HB3 ASP 39 21.460 30.097 0.779 262 H MET 40 H MET 40 19.389 27.406 3.077 263 HA MET 40 HA MET 40 18.447 25.215 1.607 264 HB2 MET 40 HB2 MET 40 18.282 25.978 4.505 265 HB3 MET 40 HB3 MET 40 17.470 24.534 3.923 266 HG2 MET 40 HG2 MET 40 20.386 25.018 3.423 267 HG3 MET 40 HG3 MET 40 19.803 24.276 4.910 268 HE1 MET 40 HE1 MET 40 18.198 20.972 3.698 269 HE2 MET 40 HE2 MET 40 17.382 22.503 4.013 270 HE3 MET 40 HE3 MET 40 18.674 21.956 5.083 271 H GLY 41 H GLY 41 16.743 27.884 3.128 272 HA2 GLY 41 HA2 GLY 41 14.119 26.857 2.864 273 HA3 GLY 41 HA3 GLY 41 14.550 28.552 3.058 274 H MET 42 H MET 42 15.963 29.131 0.827 275 HA MET 42 HA MET 42 13.902 29.324 -1.127 276 HB2 MET 42 HB2 MET 42 15.437 30.621 -2.423 277 HB3 MET 42 HB3 MET 42 15.642 31.068 -0.735 278 HG2 MET 42 HG2 MET 42 17.605 29.580 -0.625 279 HG3 MET 42 HG3 MET 42 17.429 29.268 -2.349 280 HE1 MET 42 HE1 MET 42 18.427 31.836 0.418 281 HE2 MET 42 HE2 MET 42 16.987 32.603 -0.254 282 HE3 MET 42 HE3 MET 42 18.571 33.340 -0.493 283 H MET 43 H MET 43 16.451 27.078 -0.562 284 HA MET 43 HA MET 43 16.583 25.939 -3.153 285 HB2 MET 43 HB2 MET 43 18.320 25.512 -1.504 286 HB3 MET 43 HB3 MET 43 17.160 24.754 -0.427 287 HG2 MET 43 HG2 MET 43 17.643 23.635 -3.156 288 HG3 MET 43 HG3 MET 43 18.757 23.289 -1.837 289 HE1 MET 43 HE1 MET 43 18.081 22.008 0.375 290 HE2 MET 43 HE2 MET 43 16.455 21.425 0.720 291 HE3 MET 43 HE3 MET 43 16.781 23.158 0.683 292 H ALA 44 H ALA 44 14.668 25.157 -0.256 293 HA ALA 44 HA ALA 44 13.201 23.028 -1.370 294 HB1 ALA 44 HB1 ALA 44 13.254 23.464 1.025 295 HB2 ALA 44 HB2 ALA 44 11.593 23.429 0.434 296 HB3 ALA 44 HB3 ALA 44 12.371 24.972 0.787 297 H ASP 45 H ASP 45 12.767 26.491 -1.451 298 HA ASP 45 HA ASP 45 10.211 26.592 -2.661 299 HB2 ASP 45 HB2 ASP 45 11.242 28.531 -1.558 300 HB3 ASP 45 HB3 ASP 45 12.514 28.558 -2.774 301 H SER 46 H SER 46 13.294 25.742 -3.861 302 HA SER 46 HA SER 46 12.542 26.212 -6.629 303 HB2 SER 46 HB2 SER 46 14.840 26.733 -5.911 304 HB3 SER 46 HB3 SER 46 15.074 25.053 -5.443 305 HG SER 46 HG SER 46 15.758 24.830 -7.407 306 H VAL 47 H VAL 47 12.937 23.620 -4.314 307 HA VAL 47 HA VAL 47 12.861 21.435 -6.078 308 HB VAL 47 HB VAL 47 11.844 21.544 -3.229 309 HG11 VAL 47 HG11 VAL 47 12.212 19.122 -3.231 310 HG12 VAL 47 HG12 VAL 47 12.662 19.191 -4.934 311 HG13 VAL 47 HG13 VAL 47 11.018 19.592 -4.441 312 HG21 VAL 47 HG21 VAL 47 14.169 22.240 -3.376 313 HG22 VAL 47 HG22 VAL 47 14.556 20.813 -4.337 314 HG23 VAL 47 HG23 VAL 47 14.061 20.635 -2.653 315 H ASN 48 H ASN 48 10.215 23.060 -4.305 316 HA ASN 48 HA ASN 48 8.215 21.359 -5.368 317 HB2 ASN 48 HB2 ASN 48 6.630 23.170 -4.554 318 HB3 ASN 48 HB3 ASN 48 7.638 22.402 -3.342 319 HD21 ASN 48 HD22 ASN 48 7.586 24.036 -1.904 320 HD22 ASN 48 HD21 ASN 48 8.326 25.576 -2.173 321 H SER 49 H SER 49 9.685 24.309 -6.483 322 HA SER 49 HA SER 49 7.868 25.030 -8.478 323 HB2 SER 49 HB2 SER 49 9.755 26.457 -7.860 324 HB3 SER 49 HB3 SER 49 10.893 25.252 -8.457 325 HG SER 49 HG SER 49 8.938 26.550 -10.062 326 H GLN 50 H GLN 50 10.500 22.684 -8.480 327 HA GLN 50 HA GLN 50 10.072 21.923 -11.228 328 HB2 GLN 50 HB2 GLN 50 11.789 20.746 -9.039 329 HB3 GLN 50 HB3 GLN 50 11.794 20.193 -10.708 330 HG2 GLN 50 HG2 GLN 50 12.751 22.180 -11.486 331 HG3 GLN 50 HG3 GLN 50 12.373 23.046 -9.996 332 HE21 GLN 50 HE22 GLN 50 13.667 22.790 -8.216 333 HE22 GLN 50 HE21 GLN 50 15.236 22.054 -8.285 334 H MET 51 H MET 51 9.243 20.707 -8.044 335 HA MET 51 HA MET 51 8.391 18.137 -8.899 336 HB2 MET 51 HB2 MET 51 9.105 18.534 -6.612 337 HB3 MET 51 HB3 MET 51 7.797 19.677 -6.373 338 HG2 MET 51 HG2 MET 51 7.152 16.869 -7.126 339 HG3 MET 51 HG3 MET 51 7.625 17.236 -5.470 340 HE1 MET 51 HE1 MET 51 6.474 20.058 -4.897 341 HE2 MET 51 HE2 MET 51 6.191 18.712 -3.791 342 HE3 MET 51 HE3 MET 51 4.843 19.717 -4.318 343 H GLN 52 H GLN 52 6.721 21.225 -8.517 344 HA GLN 52 HA GLN 52 4.117 20.098 -8.841 345 HB2 GLN 52 HB2 GLN 52 5.118 22.926 -9.168 346 HB3 GLN 52 HB3 GLN 52 3.427 22.469 -9.314 347 HG2 GLN 52 HG2 GLN 52 3.447 21.651 -7.012 348 HG3 GLN 52 HG3 GLN 52 5.141 22.114 -6.865 349 HE21 GLN 52 HE22 GLN 52 5.678 24.307 -6.798 350 HE22 GLN 52 HE21 GLN 52 4.503 25.519 -6.424 351 H LYS 53 H LYS 53 6.629 21.091 -11.005 352 HA LYS 53 HA LYS 53 4.956 21.006 -13.351 353 HB2 LYS 53 HB2 LYS 53 7.962 21.070 -13.036 354 HB3 LYS 53 HB3 LYS 53 7.118 21.162 -14.577 355 HG2 LYS 53 HG2 LYS 53 6.045 23.235 -13.878 356 HG3 LYS 53 HG3 LYS 53 6.867 23.137 -12.318 357 HD2 LYS 53 HD2 LYS 53 9.029 23.291 -13.436 358 HD3 LYS 53 HD3 LYS 53 8.224 23.351 -15.005 359 HE2 LYS 53 HE2 LYS 53 7.106 25.431 -14.341 360 HE3 LYS 53 HE3 LYS 53 7.933 25.367 -12.784 361 HZ1 LYS 53 HZ1 LYS 53 10.044 25.562 -13.931 362 HZ2 LYS 53 HZ2 LYS 53 9.041 26.861 -14.322 363 HZ3 LYS 53 HZ3 LYS 53 9.261 25.599 -15.430 364 H MET 54 H MET 54 6.181 18.733 -11.299 365 HA MET 54 HA MET 54 6.748 16.664 -13.232 366 HB2 MET 54 HB2 MET 54 7.919 16.683 -11.092 367 HB3 MET 54 HB3 MET 54 6.395 16.576 -10.226 368 HG2 MET 54 HG2 MET 54 6.021 14.373 -11.300 369 HG3 MET 54 HG3 MET 54 7.638 14.485 -11.985 370 HE1 MET 54 HE1 MET 54 9.845 14.595 -10.523 371 HE2 MET 54 HE2 MET 54 9.872 14.493 -8.765 372 HE3 MET 54 HE3 MET 54 9.211 15.927 -9.553 373 H GLY 55 H GLY 55 4.278 17.096 -10.690 374 HA2 GLY 55 HA2 GLY 55 1.943 16.944 -11.110 375 HA3 GLY 55 HA3 GLY 55 2.291 15.982 -12.537 376 HA PRO 56 HA PRO 56 1.351 13.158 -8.865 377 HB2 PRO 56 HB2 PRO 56 -1.289 12.710 -9.186 378 HB3 PRO 56 HB3 PRO 56 -0.673 14.047 -8.208 379 HG2 PRO 56 HG2 PRO 56 -1.790 14.076 -10.973 380 HG3 PRO 56 HG3 PRO 56 -1.974 15.264 -9.674 381 HD2 PRO 56 HD2 PRO 56 -0.227 15.508 -11.802 382 HD3 PRO 56 HD3 PRO 56 -0.063 16.358 -10.254 383 H ASN 57 H ASN 57 1.645 11.042 -9.231 384 HA ASN 57 HA ASN 57 2.097 9.131 -10.385 385 HB2 ASN 57 HB2 ASN 57 -0.437 9.929 -11.835 386 HB3 ASN 57 HB3 ASN 57 0.387 8.397 -12.093 387 HD21 ASN 57 HD22 ASN 57 -1.591 10.268 -9.983 388 HD22 ASN 57 HD21 ASN 57 -1.972 9.005 -8.867 389 HA PRO 58 HA PRO 58 3.764 11.768 -13.843 390 HB2 PRO 58 HB2 PRO 58 6.184 12.346 -12.926 391 HB3 PRO 58 HB3 PRO 58 4.754 13.160 -12.279 392 HG2 PRO 58 HG2 PRO 58 6.360 10.933 -11.105 393 HG3 PRO 58 HG3 PRO 58 5.638 12.338 -10.304 394 HD2 PRO 58 HD2 PRO 58 4.537 9.778 -10.402 395 HD3 PRO 58 HD3 PRO 58 3.657 11.266 -10.005 396 HA PRO 59 HA PRO 59 6.248 8.665 -15.839 397 HB2 PRO 59 HB2 PRO 59 7.884 10.127 -17.429 398 HB3 PRO 59 HB3 PRO 59 6.157 9.938 -17.754 399 HG2 PRO 59 HG2 PRO 59 7.618 12.227 -16.529 400 HG3 PRO 59 HG3 PRO 59 6.255 12.243 -17.661 401 HD2 PRO 59 HD2 PRO 59 6.026 12.645 -14.957 402 HD3 PRO 59 HD3 PRO 59 4.715 12.030 -15.983 403 H GLN 60 H GLN 60 8.048 7.511 -15.405 404 HA GLN 60 HA GLN 60 9.519 8.240 -13.123 405 HB2 GLN 60 HB2 GLN 60 9.835 5.977 -15.077 406 HB3 GLN 60 HB3 GLN 60 10.815 6.136 -13.625 407 HG2 GLN 60 HG2 GLN 60 8.922 5.917 -12.216 408 HG3 GLN 60 HG3 GLN 60 7.813 6.058 -13.578 409 HE21 GLN 60 HE22 GLN 60 7.518 4.318 -14.940 410 HE22 GLN 60 HE21 GLN 60 8.018 2.718 -14.517 411 H HIS 61 H HIS 61 10.146 8.920 -16.438 412 HA HIS 61 HA HIS 61 12.971 9.094 -16.238 413 HB2 HIS 61 HB2 HIS 61 12.960 10.271 -18.322 414 HB3 HIS 61 HB3 HIS 61 11.752 9.005 -18.419 415 HD1 HIS 61 HD1 HIS 61 9.474 9.707 -19.179 416 HD2 HIS 61 HD2 HIS 61 11.792 12.938 -17.965 417 HE1 HIS 61 HE1 HIS 61 8.181 11.756 -19.842 418 H ARG 62 H ARG 62 10.403 11.105 -15.153 419 HA ARG 62 HA ARG 62 12.039 13.447 -14.757 420 HB2 ARG 62 HB2 ARG 62 9.287 12.632 -13.834 421 HB3 ARG 62 HB3 ARG 62 10.059 14.099 -13.246 422 HG2 ARG 62 HG2 ARG 62 9.754 13.566 -16.178 423 HG3 ARG 62 HG3 ARG 62 8.453 14.286 -15.229 424 HD2 ARG 62 HD2 ARG 62 9.876 16.124 -14.590 425 HD3 ARG 62 HD3 ARG 62 11.259 15.379 -15.389 426 HE ARG 62 HE ARG 62 10.480 16.129 -17.408 427 HH11 ARG 62 HH11 ARG 62 7.964 16.529 -15.008 428 HH12 ARG 62 HH12 ARG 62 6.956 17.500 -16.026 429 HH21 ARG 62 HH21 ARG 62 9.164 17.417 -18.760 430 HH22 ARG 62 HH22 ARG 62 7.639 17.995 -18.172 431 H LEU 63 H LEU 63 10.994 10.673 -12.902 432 HA LEU 63 HA LEU 63 11.757 11.508 -10.349 433 HB2 LEU 63 HB2 LEU 63 11.343 8.845 -11.636 434 HB3 LEU 63 HB3 LEU 63 12.084 8.910 -10.051 435 HG LEU 63 HG LEU 63 10.112 10.036 -9.151 436 HD11 LEU 63 HD11 LEU 63 8.088 10.280 -10.463 437 HD12 LEU 63 HD12 LEU 63 8.926 9.698 -11.898 438 HD13 LEU 63 HD13 LEU 63 9.398 11.228 -11.162 439 HD21 LEU 63 HD21 LEU 63 9.482 7.518 -10.678 440 HD22 LEU 63 HD22 LEU 63 8.557 8.153 -9.317 441 HD23 LEU 63 HD23 LEU 63 10.220 7.616 -9.078 442 H ARG 64 H ARG 64 13.578 9.564 -12.720 443 HA ARG 64 HA ARG 64 15.819 9.117 -11.120 444 HB2 ARG 64 HB2 ARG 64 15.357 9.075 -14.067 445 HB3 ARG 64 HB3 ARG 64 17.005 8.985 -13.466 446 HG2 ARG 64 HG2 ARG 64 16.296 6.765 -13.790 447 HG3 ARG 64 HG3 ARG 64 16.266 7.039 -12.049 448 HD2 ARG 64 HD2 ARG 64 13.836 7.460 -12.197 449 HD3 ARG 64 HD3 ARG 64 13.901 7.081 -13.917 450 HE ARG 64 HE ARG 64 14.641 5.122 -11.843 451 HH11 ARG 64 HH11 ARG 64 12.979 5.967 -14.801 452 HH12 ARG 64 HH12 ARG 64 12.308 4.386 -15.027 453 HH21 ARG 64 HH21 ARG 64 13.767 3.019 -12.151 454 HH22 ARG 64 HH22 ARG 64 12.764 2.711 -13.529 455 H ALA 65 H ALA 65 15.061 11.844 -13.216 456 HA ALA 65 HA ALA 65 17.670 12.997 -13.044 457 HB1 ALA 65 HB1 ALA 65 16.169 13.401 -14.946 458 HB2 ALA 65 HB2 ALA 65 16.705 14.903 -14.195 459 HB3 ALA 65 HB3 ALA 65 15.078 14.292 -13.886 460 H MET 66 H MET 66 14.706 13.281 -11.209 461 HA MET 66 HA MET 66 15.293 15.774 -10.002 462 HB2 MET 66 HB2 MET 66 13.383 13.575 -9.267 463 HB3 MET 66 HB3 MET 66 13.544 15.035 -8.300 464 HG2 MET 66 HG2 MET 66 12.770 14.919 -11.207 465 HG3 MET 66 HG3 MET 66 11.678 15.183 -9.852 466 HE1 MET 66 HE1 MET 66 13.295 17.164 -7.957 467 HE2 MET 66 HE2 MET 66 11.597 17.339 -8.397 468 HE3 MET 66 HE3 MET 66 12.694 18.707 -8.569 469 H ASN 67 H ASN 67 16.128 12.469 -9.111 470 HA ASN 67 HA ASN 67 16.930 12.932 -6.466 471 HB2 ASN 67 HB2 ASN 67 18.432 11.115 -8.359 472 HB3 ASN 67 HB3 ASN 67 18.284 10.965 -6.615 473 HD21 ASN 67 HD22 ASN 67 16.965 10.207 -9.644 474 HD22 ASN 67 HD21 ASN 67 15.589 9.317 -9.083 475 H THR 68 H THR 68 18.777 13.083 -9.468 476 HA THR 68 HA THR 68 21.168 14.051 -8.334 477 HB THR 68 HB THR 68 20.145 14.267 -11.173 478 HG1 THR 68 HG1 THR 68 21.165 12.188 -9.662 479 HG21 THR 68 HG21 THR 68 22.966 14.447 -10.109 480 HG22 THR 68 HG22 THR 68 22.019 15.793 -10.737 481 HG23 THR 68 HG23 THR 68 22.496 14.475 -11.808 482 H ALA 69 H ALA 69 18.417 15.660 -9.897 483 HA ALA 69 HA ALA 69 19.515 18.238 -10.022 484 HB1 ALA 69 HB1 ALA 69 17.553 17.548 -11.305 485 HB2 ALA 69 HB2 ALA 69 17.234 19.011 -10.373 486 HB3 ALA 69 HB3 ALA 69 16.612 17.459 -9.817 487 H MET 70 H MET 70 17.422 16.757 -7.527 488 HA MET 70 HA MET 70 17.225 19.147 -6.001 489 HB2 MET 70 HB2 MET 70 15.672 17.107 -5.895 490 HB3 MET 70 HB3 MET 70 16.900 16.367 -4.877 491 HG2 MET 70 HG2 MET 70 16.702 18.264 -3.312 492 HG3 MET 70 HG3 MET 70 15.412 18.923 -4.310 493 HE1 MET 70 HE1 MET 70 16.422 16.530 -1.523 494 HE2 MET 70 HE2 MET 70 16.351 15.337 -2.821 495 HE3 MET 70 HE3 MET 70 15.169 15.291 -1.511 496 H ALA 71 H ALA 71 19.315 16.310 -5.853 497 HA ALA 71 HA ALA 71 20.612 16.978 -3.441 498 HB1 ALA 71 HB1 ALA 71 20.628 14.731 -4.440 499 HB2 ALA 71 HB2 ALA 71 22.250 15.314 -4.062 500 HB3 ALA 71 HB3 ALA 71 21.672 15.329 -5.730 501 H ALA 72 H ALA 72 21.122 17.919 -6.766 502 HA ALA 72 HA ALA 72 23.684 19.043 -6.529 503 HB1 ALA 72 HB1 ALA 72 21.432 19.922 -8.333 504 HB2 ALA 72 HB2 ALA 72 22.575 18.625 -8.681 505 HB3 ALA 72 HB3 ALA 72 23.146 20.288 -8.543 506 H GLU 73 H GLU 73 20.465 20.454 -6.069 507 HA GLU 73 HA GLU 73 21.448 23.064 -5.502 508 HB2 GLU 73 HB2 GLU 73 18.763 21.827 -4.880 509 HB3 GLU 73 HB3 GLU 73 19.141 23.544 -4.788 510 HG2 GLU 73 HG2 GLU 73 19.693 23.510 -7.193 511 HG3 GLU 73 HG3 GLU 73 19.180 21.826 -7.256 512 H VAL 74 H VAL 74 20.684 20.251 -3.550 513 HA VAL 74 HA VAL 74 20.995 21.508 -1.021 514 HB VAL 74 HB VAL 74 21.440 18.602 -1.758 515 HG11 VAL 74 HG11 VAL 74 21.043 19.906 0.934 516 HG12 VAL 74 HG12 VAL 74 22.529 19.162 0.343 517 HG13 VAL 74 HG13 VAL 74 21.102 18.168 0.638 518 HG21 VAL 74 HG21 VAL 74 19.180 19.327 -2.263 519 HG22 VAL 74 HG22 VAL 74 19.021 20.024 -0.651 520 HG23 VAL 74 HG23 VAL 74 19.174 18.278 -0.845 521 H ALA 75 H ALA 75 23.219 19.927 -3.253 522 HA ALA 75 HA ALA 75 25.516 19.937 -1.649 523 HB1 ALA 75 HB1 ALA 75 26.763 19.704 -3.715 524 HB2 ALA 75 HB2 ALA 75 25.362 20.238 -4.644 525 HB3 ALA 75 HB3 ALA 75 25.309 18.708 -3.770 526 H GLU 76 H GLU 76 23.979 22.455 -3.505 527 HA GLU 76 HA GLU 76 26.078 24.287 -3.690 528 HB2 GLU 76 HB2 GLU 76 23.106 24.785 -3.457 529 HB3 GLU 76 HB3 GLU 76 24.287 26.009 -3.898 530 HG2 GLU 76 HG2 GLU 76 23.797 23.473 -5.436 531 HG3 GLU 76 HG3 GLU 76 23.097 25.043 -5.827 532 H VAL 77 H VAL 77 23.678 23.817 -1.107 533 HA VAL 77 HA VAL 77 24.680 26.028 0.430 534 HB VAL 77 HB VAL 77 23.130 25.450 2.132 535 HG11 VAL 77 HG11 VAL 77 21.018 25.273 0.919 536 HG12 VAL 77 HG12 VAL 77 21.890 24.768 -0.527 537 HG13 VAL 77 HG13 VAL 77 22.129 26.389 0.124 538 HG21 VAL 77 HG21 VAL 77 21.869 23.347 2.178 539 HG22 VAL 77 HG22 VAL 77 23.603 23.075 2.342 540 HG23 VAL 77 HG23 VAL 77 22.804 22.762 0.801 541 H VAL 78 H VAL 78 25.488 22.719 0.074 542 HA VAL 78 HA VAL 78 26.907 22.484 2.570 543 HB VAL 78 HB VAL 78 27.035 20.709 0.124 544 HG11 VAL 78 HG11 VAL 78 27.878 20.193 2.971 545 HG12 VAL 78 HG12 VAL 78 28.960 20.436 1.599 546 HG13 VAL 78 HG13 VAL 78 27.910 19.020 1.655 547 HG21 VAL 78 HG21 VAL 78 25.506 19.245 1.404 548 HG22 VAL 78 HG22 VAL 78 24.779 20.791 0.971 549 HG23 VAL 78 HG23 VAL 78 25.351 20.515 2.617 550 H ALA 79 H ALA 79 27.653 23.259 -0.774 551 HA ALA 79 HA ALA 79 30.461 23.261 -0.551 552 HB1 ALA 79 HB1 ALA 79 29.265 23.266 -2.696 553 HB2 ALA 79 HB2 ALA 79 30.450 24.568 -2.597 554 HB3 ALA 79 HB3 ALA 79 28.735 24.919 -2.384 555 H THR 80 H THR 80 28.067 25.427 0.614 556 HA THR 80 HA THR 80 29.734 27.730 0.903 557 HB THR 80 HB THR 80 27.276 27.137 2.553 558 HG1 THR 80 HG1 THR 80 26.028 27.823 0.832 559 HG21 THR 80 HG21 THR 80 28.432 29.699 1.442 560 HG22 THR 80 HG22 THR 80 28.535 29.163 3.118 561 HG23 THR 80 HG23 THR 80 26.968 29.569 2.417 562 H SER 81 H SER 81 29.621 24.755 2.474 563 HA SER 81 HA SER 81 30.325 25.737 5.106 564 HB2 SER 81 HB2 SER 81 30.226 22.898 4.063 565 HB3 SER 81 HB3 SER 81 30.348 23.386 5.754 566 HG SER 81 HG SER 81 28.235 24.379 4.215 567 HA PRO 82 HA PRO 82 34.753 25.632 4.318 568 HB2 PRO 82 HB2 PRO 82 34.877 25.500 7.273 569 HB3 PRO 82 HB3 PRO 82 35.613 26.668 6.170 570 HG2 PRO 82 HG2 PRO 82 33.525 27.338 7.693 571 HG3 PRO 82 HG3 PRO 82 33.692 27.952 6.037 572 HD2 PRO 82 HD2 PRO 82 31.957 25.738 7.071 573 HD3 PRO 82 HD3 PRO 82 31.582 27.001 5.880 574 HA PRO 83 HA PRO 83 35.649 21.318 4.350 575 HB2 PRO 83 HB2 PRO 83 38.355 22.151 5.300 576 HB3 PRO 83 HB3 PRO 83 37.911 21.093 3.955 577 HG2 PRO 83 HG2 PRO 83 38.693 23.585 3.492 578 HG3 PRO 83 HG3 PRO 83 37.360 22.874 2.563 579 HD2 PRO 83 HD2 PRO 83 37.276 24.870 4.779 580 HD3 PRO 83 HD3 PRO 83 36.241 24.727 3.344 581 H GLN 84 H GLN 84 36.682 23.195 7.152 582 HA GLN 84 HA GLN 84 37.210 21.016 8.866 583 HB2 GLN 84 HB2 GLN 84 36.378 23.825 9.600 584 HB3 GLN 84 HB3 GLN 84 37.130 22.657 10.677 585 HG2 GLN 84 HG2 GLN 84 39.148 22.685 9.319 586 HG3 GLN 84 HG3 GLN 84 38.395 23.832 8.212 587 HE21 GLN 84 HE22 GLN 84 39.926 25.406 8.571 588 HE22 GLN 84 HE21 GLN 84 40.022 26.291 10.051 589 H SER 85 H SER 85 34.281 22.870 8.218 590 HA SER 85 HA SER 85 32.864 21.405 10.318 591 HB2 SER 85 HB2 SER 85 31.900 23.744 8.654 592 HB3 SER 85 HB3 SER 85 31.136 23.092 10.105 593 HG SER 85 HG SER 85 32.669 23.971 11.343 594 H TYR 86 H TYR 86 33.507 21.076 7.111 595 HA TYR 86 HA TYR 86 31.091 20.639 5.828 596 HB2 TYR 86 HB2 TYR 86 33.278 20.751 4.688 597 HB3 TYR 86 HB3 TYR 86 33.705 19.183 5.364 598 HD1 TYR 86 HD1 TYR 86 32.511 17.145 4.597 599 HD2 TYR 86 HD2 TYR 86 31.865 20.931 2.769 600 HE1 TYR 86 HE1 TYR 86 31.491 16.026 2.661 601 HE2 TYR 86 HE2 TYR 86 30.840 19.823 0.830 602 HH TYR 86 HH TYR 86 30.713 17.732 -0.255 603 H SER 87 H SER 87 33.085 18.324 7.626 604 HA SER 87 HA SER 87 31.631 16.022 7.039 605 HB2 SER 87 HB2 SER 87 33.114 16.555 9.619 606 HB3 SER 87 HB3 SER 87 32.829 14.995 8.848 607 HG SER 87 HG SER 87 34.874 15.565 8.282 608 H ALA 88 H ALA 88 31.111 18.478 9.485 609 HA ALA 88 HA ALA 88 29.199 16.950 10.979 610 HB1 ALA 88 HB1 ALA 88 28.784 19.054 12.180 611 HB2 ALA 88 HB2 ALA 88 29.792 19.910 11.013 612 HB3 ALA 88 HB3 ALA 88 30.508 18.691 12.068 613 H VAL 89 H VAL 89 29.113 19.293 8.392 614 HA VAL 89 HA VAL 89 26.286 19.707 8.440 615 HB VAL 89 HB VAL 89 28.293 20.189 6.226 616 HG11 VAL 89 HG11 VAL 89 26.598 21.697 5.279 617 HG12 VAL 89 HG12 VAL 89 25.456 21.176 6.518 618 HG13 VAL 89 HG13 VAL 89 26.044 20.023 5.320 619 HG21 VAL 89 HG21 VAL 89 28.747 21.467 8.270 620 HG22 VAL 89 HG22 VAL 89 27.103 22.105 8.226 621 HG23 VAL 89 HG23 VAL 89 28.239 22.511 6.941 622 H LEU 90 H LEU 90 28.489 17.709 6.529 623 HA LEU 90 HA LEU 90 26.679 16.666 4.703 624 HB2 LEU 90 HB2 LEU 90 29.267 16.540 4.891 625 HB3 LEU 90 HB3 LEU 90 28.969 15.084 5.812 626 HG LEU 90 HG LEU 90 29.510 14.801 3.360 627 HD11 LEU 90 HD11 LEU 90 28.572 12.986 4.660 628 HD12 LEU 90 HD12 LEU 90 27.874 12.999 3.040 629 HD13 LEU 90 HD13 LEU 90 26.946 13.619 4.406 630 HD21 LEU 90 HD21 LEU 90 26.675 15.761 3.028 631 HD22 LEU 90 HD22 LEU 90 27.709 15.104 1.765 632 HD23 LEU 90 HD23 LEU 90 28.121 16.637 2.529 633 H ASN 91 H ASN 91 27.722 15.343 7.834 634 HA ASN 91 HA ASN 91 26.167 13.010 7.759 635 HB2 ASN 91 HB2 ASN 91 27.239 14.610 10.081 636 HB3 ASN 91 HB3 ASN 91 26.351 13.107 10.303 637 HD21 ASN 91 HD22 ASN 91 29.080 13.733 11.008 638 HD22 ASN 91 HD21 ASN 91 30.077 12.595 10.176 639 H THR 92 H THR 92 25.387 16.273 8.792 640 HA THR 92 HA THR 92 22.907 15.710 10.016 641 HB THR 92 HB THR 92 23.823 18.266 8.676 642 HG1 THR 92 HG1 THR 92 25.235 17.868 10.325 643 HG21 THR 92 HG21 THR 92 21.675 17.821 10.753 644 HG22 THR 92 HG22 THR 92 21.391 18.196 9.054 645 HG23 THR 92 HG23 THR 92 22.182 19.377 10.097 646 H ILE 93 H ILE 93 23.809 16.552 6.704 647 HA ILE 93 HA ILE 93 21.290 16.896 5.589 648 HB ILE 93 HB ILE 93 23.731 15.701 4.273 649 HG12 ILE 93 HG12 ILE 93 24.177 17.914 5.187 650 HG13 ILE 93 HG13 ILE 93 24.104 17.995 3.432 651 HG21 ILE 93 HG21 ILE 93 21.716 15.223 2.996 652 HG22 ILE 93 HG22 ILE 93 22.714 16.413 2.161 653 HG23 ILE 93 HG23 ILE 93 21.270 16.929 3.033 654 HD11 ILE 93 HD11 ILE 93 21.946 18.843 5.351 655 HD12 ILE 93 HD12 ILE 93 21.813 18.872 3.592 656 HD13 ILE 93 HD13 ILE 93 22.993 19.900 4.404 657 H GLY 94 H GLY 94 23.216 13.891 5.722 658 HA2 GLY 94 HA2 GLY 94 21.233 12.298 4.480 659 HA3 GLY 94 HA3 GLY 94 22.598 11.695 5.403 660 H ALA 95 H ALA 95 21.900 13.035 7.823 661 HA ALA 95 HA ALA 95 20.296 11.024 8.979 662 HB1 ALA 95 HB1 ALA 95 21.107 13.682 10.147 663 HB2 ALA 95 HB2 ALA 95 22.055 12.194 10.217 664 HB3 ALA 95 HB3 ALA 95 20.499 12.293 11.045 665 H CYS 96 H CYS 96 19.652 14.436 8.216 666 HA CYS 96 HA CYS 96 16.956 14.308 9.168 667 HB2 CYS 96 HB2 CYS 96 18.409 16.346 7.476 668 HB3 CYS 96 HB3 CYS 96 16.747 16.538 8.020 669 H LEU 97 H LEU 97 18.543 13.736 6.124 670 HA LEU 97 HA LEU 97 16.318 14.008 4.417 671 HB2 LEU 97 HB2 LEU 97 18.841 13.830 3.874 672 HB3 LEU 97 HB3 LEU 97 18.593 12.100 3.938 673 HG LEU 97 HG LEU 97 18.590 13.081 1.639 674 HD11 LEU 97 HD11 LEU 97 17.542 10.929 2.059 675 HD12 LEU 97 HD12 LEU 97 16.670 11.835 0.825 676 HD13 LEU 97 HD13 LEU 97 16.029 11.736 2.465 677 HD21 LEU 97 HD21 LEU 97 16.671 14.319 0.863 678 HD22 LEU 97 HD22 LEU 97 17.434 15.175 2.203 679 HD23 LEU 97 HD23 LEU 97 15.948 14.263 2.469 680 H ARG 98 H ARG 98 17.739 11.138 5.989 681 HA ARG 98 HA ARG 98 15.992 9.263 4.840 682 HB2 ARG 98 HB2 ARG 98 16.648 7.778 6.735 683 HB3 ARG 98 HB3 ARG 98 17.999 8.484 5.864 684 HG2 ARG 98 HG2 ARG 98 18.238 10.158 7.649 685 HG3 ARG 98 HG3 ARG 98 16.922 9.378 8.528 686 HD2 ARG 98 HD2 ARG 98 18.220 7.311 8.634 687 HD3 ARG 98 HD3 ARG 98 19.532 8.086 7.747 688 HE ARG 98 HE ARG 98 18.793 9.485 10.145 689 HH11 ARG 98 HH11 ARG 98 20.741 6.895 8.833 690 HH12 ARG 98 HH12 ARG 98 21.879 6.911 10.138 691 HH21 ARG 98 HH21 ARG 98 20.293 9.537 11.854 692 HH22 ARG 98 HH22 ARG 98 21.630 8.431 11.869 693 H GLU 99 H GLU 99 15.750 10.966 7.935 694 HA GLU 99 HA GLU 99 13.380 9.807 8.864 695 HB2 GLU 99 HB2 GLU 99 14.481 12.591 9.271 696 HB3 GLU 99 HB3 GLU 99 13.121 11.931 10.168 697 HG2 GLU 99 HG2 GLU 99 15.845 10.679 10.132 698 HG3 GLU 99 HG3 GLU 99 15.321 11.862 11.328 699 H SER 100 H SER 100 13.817 12.900 7.220 700 HA SER 100 HA SER 100 11.196 13.682 6.985 701 HB2 SER 100 HB2 SER 100 13.419 14.139 4.988 702 HB3 SER 100 HB3 SER 100 11.943 15.094 5.122 703 HG SER 100 HG SER 100 14.172 14.993 6.807 704 H MET 101 H MET 101 13.023 11.595 4.782 705 HA MET 101 HA MET 101 11.192 11.386 2.709 706 HB2 MET 101 HB2 MET 101 13.324 9.590 3.777 707 HB3 MET 101 HB3 MET 101 12.225 8.965 2.557 708 HG2 MET 101 HG2 MET 101 13.707 11.536 2.172 709 HG3 MET 101 HG3 MET 101 14.424 9.977 1.772 710 HE1 MET 101 HE1 MET 101 12.214 8.229 0.625 711 HE2 MET 101 HE2 MET 101 13.721 8.483 -0.258 712 HE3 MET 101 HE3 MET 101 12.171 8.657 -1.085 713 H MET 102 H MET 102 11.466 9.276 5.575 714 HA MET 102 HA MET 102 9.209 7.736 4.685 715 HB2 MET 102 HB2 MET 102 9.508 6.415 6.691 716 HB3 MET 102 HB3 MET 102 11.037 6.648 5.863 717 HG2 MET 102 HG2 MET 102 11.600 8.423 7.484 718 HG3 MET 102 HG3 MET 102 10.104 8.057 8.347 719 HE1 MET 102 HE1 MET 102 10.218 4.825 7.561 720 HE2 MET 102 HE2 MET 102 9.566 5.441 9.079 721 HE3 MET 102 HE3 MET 102 10.808 4.189 9.099 722 H GLN 103 H GLN 103 9.753 10.317 6.966 723 HA GLN 103 HA GLN 103 7.254 10.144 8.298 724 HB2 GLN 103 HB2 GLN 103 9.394 12.163 8.091 725 HB3 GLN 103 HB3 GLN 103 7.799 12.794 8.458 726 HG2 GLN 103 HG2 GLN 103 9.150 12.304 10.467 727 HG3 GLN 103 HG3 GLN 103 7.619 11.433 10.412 728 HE21 GLN 103 HE22 GLN 103 11.054 11.187 10.336 729 HE22 GLN 103 HE21 GLN 103 11.152 9.466 10.455 730 H ALA 104 H ALA 104 8.104 11.286 5.168 731 HA ALA 104 HA ALA 104 5.872 12.976 4.737 732 HB1 ALA 104 HB1 ALA 104 6.355 12.659 2.341 733 HB2 ALA 104 HB2 ALA 104 7.514 11.396 2.758 734 HB3 ALA 104 HB3 ALA 104 7.801 13.059 3.268 735 H THR 105 H THR 105 6.488 9.680 3.551 736 HA THR 105 HA THR 105 4.275 8.351 4.380 737 HB THR 105 HB THR 105 2.880 10.096 3.286 738 HG1 THR 105 HG1 THR 105 2.733 7.410 2.849 739 HG21 THR 105 HG21 THR 105 2.767 10.211 0.844 740 HG22 THR 105 HG22 THR 105 4.088 9.047 0.724 741 HG23 THR 105 HG23 THR 105 4.378 10.639 1.428 742 H GLY 106 H GLY 106 6.586 8.981 1.891 743 HA2 GLY 106 HA2 GLY 106 6.074 6.467 0.511 744 HA3 GLY 106 HA3 GLY 106 7.167 7.743 -0.006 745 H SER 107 H SER 107 7.342 6.581 3.267 746 HA SER 107 HA SER 107 9.038 5.743 4.455 747 HB2 SER 107 HB2 SER 107 10.005 3.582 3.615 748 HB3 SER 107 HB3 SER 107 8.251 3.630 3.691 749 HG SER 107 HG SER 107 9.121 4.457 1.266 750 H VAL 108 H VAL 108 11.486 4.753 4.059 751 HA VAL 108 HA VAL 108 12.809 6.933 2.627 752 HB VAL 108 HB VAL 108 13.297 7.210 4.899 753 HG11 VAL 108 HG11 VAL 108 13.843 4.257 5.044 754 HG12 VAL 108 HG12 VAL 108 12.517 5.146 5.801 755 HG13 VAL 108 HG13 VAL 108 14.178 5.403 6.344 756 HG21 VAL 108 HG21 VAL 108 15.265 7.431 3.522 757 HG22 VAL 108 HG22 VAL 108 15.598 5.705 3.675 758 HG23 VAL 108 HG23 VAL 108 15.705 6.753 5.090 759 H ASP 109 H ASP 109 13.214 6.149 0.704 760 HA ASP 109 HA ASP 109 13.914 3.445 0.166 761 HB2 ASP 109 HB2 ASP 109 12.724 4.574 -1.539 762 HB3 ASP 109 HB3 ASP 109 13.824 5.948 -1.504 763 H ASN 110 H ASN 110 15.842 2.620 -0.639 764 HA ASN 110 HA ASN 110 18.177 3.679 0.628 765 HB2 ASN 110 HB2 ASN 110 17.656 1.282 -1.107 766 HB3 ASN 110 HB3 ASN 110 19.291 1.722 -0.631 767 HD21 ASN 110 HD22 ASN 110 17.632 -0.625 0.011 768 HD22 ASN 110 HD21 ASN 110 17.602 -0.702 1.738 769 H ALA 111 H ALA 111 17.084 3.355 -2.734 770 HA ALA 111 HA ALA 111 19.518 4.130 -3.914 771 HB1 ALA 111 HB1 ALA 111 17.688 3.011 -5.142 772 HB2 ALA 111 HB2 ALA 111 18.253 4.475 -5.949 773 HB3 ALA 111 HB3 ALA 111 16.740 4.497 -5.040 774 H PHE 112 H PHE 112 16.607 6.006 -3.134 775 HA PHE 112 HA PHE 112 17.505 8.491 -4.054 776 HB2 PHE 112 HB2 PHE 112 15.158 7.910 -3.373 777 HB3 PHE 112 HB3 PHE 112 15.677 8.010 -1.695 778 HD1 PHE 112 HD1 PHE 112 15.098 9.918 -4.775 779 HD2 PHE 112 HD2 PHE 112 15.978 10.119 -0.620 780 HE1 PHE 112 HE1 PHE 112 14.622 12.329 -4.796 781 HE2 PHE 112 HE2 PHE 112 15.497 12.533 -0.634 782 HZ PHE 112 HZ PHE 112 14.819 13.638 -2.726 783 H THR 113 H THR 113 17.807 7.057 -0.802 784 HA THR 113 HA THR 113 19.108 9.283 0.337 785 HB THR 113 HB THR 113 19.985 7.530 2.017 786 HG1 THR 113 HG1 THR 113 17.962 5.880 0.948 787 HG21 THR 113 HG21 THR 113 18.091 8.968 2.483 788 HG22 THR 113 HG22 THR 113 17.756 7.336 3.057 789 HG23 THR 113 HG23 THR 113 17.027 7.913 1.559 790 H ASN 114 H ASN 114 20.383 6.442 -1.366 791 HA ASN 114 HA ASN 114 23.121 7.037 -0.893 792 HB2 ASN 114 HB2 ASN 114 21.588 5.262 -2.752 793 HB3 ASN 114 HB3 ASN 114 23.285 5.547 -3.050 794 HD21 ASN 114 HD22 ASN 114 20.951 4.200 -0.901 795 HD22 ASN 114 HD21 ASN 114 22.045 3.206 0.002 796 H GLU 115 H GLU 115 20.831 7.804 -3.484 797 HA GLU 115 HA GLU 115 22.527 9.105 -5.245 798 HB2 GLU 115 HB2 GLU 115 19.649 9.287 -4.529 799 HB3 GLU 115 HB3 GLU 115 20.324 10.586 -5.478 800 HG2 GLU 115 HG2 GLU 115 20.443 7.682 -6.232 801 HG3 GLU 115 HG3 GLU 115 19.240 8.827 -6.823 802 H VAL 116 H VAL 116 20.612 10.508 -2.592 803 HA VAL 116 HA VAL 116 21.662 13.091 -2.722 804 HB VAL 116 HB VAL 116 20.631 11.613 -0.291 805 HG11 VAL 116 HG11 VAL 116 20.968 14.581 -0.720 806 HG12 VAL 116 HG12 VAL 116 21.967 13.576 0.332 807 HG13 VAL 116 HG13 VAL 116 20.256 13.806 0.695 808 HG21 VAL 116 HG21 VAL 116 18.530 12.789 -0.764 809 HG22 VAL 116 HG22 VAL 116 19.002 11.738 -2.101 810 HG23 VAL 116 HG23 VAL 116 19.249 13.481 -2.219 811 H MET 117 H MET 117 22.762 10.331 -0.753 812 HA MET 117 HA MET 117 24.822 11.866 0.513 813 HB2 MET 117 HB2 MET 117 24.104 8.953 0.502 814 HB3 MET 117 HB3 MET 117 25.554 9.522 1.301 815 HG2 MET 117 HG2 MET 117 22.853 10.664 1.928 816 HG3 MET 117 HG3 MET 117 23.445 9.200 2.702 817 HE1 MET 117 HE1 MET 117 24.752 13.515 3.476 818 HE2 MET 117 HE2 MET 117 23.674 12.931 2.204 819 HE3 MET 117 HE3 MET 117 25.426 12.833 1.998 820 H GLN 118 H GLN 118 24.687 10.633 -2.554 821 HA GLN 118 HA GLN 118 27.623 10.485 -2.662 822 HB2 GLN 118 HB2 GLN 118 26.501 8.550 -3.649 823 HB3 GLN 118 HB3 GLN 118 25.564 9.605 -4.699 824 HG2 GLN 118 HG2 GLN 118 27.602 10.317 -5.824 825 HG3 GLN 118 HG3 GLN 118 28.558 9.293 -4.754 826 HE21 GLN 118 HE22 GLN 118 28.260 9.268 -7.669 827 HE22 GLN 118 HE21 GLN 118 27.733 7.675 -8.074 828 H LEU 119 H LEU 119 24.809 11.870 -4.317 829 HA LEU 119 HA LEU 119 26.239 13.540 -6.055 830 HB2 LEU 119 HB2 LEU 119 23.430 13.346 -5.107 831 HB3 LEU 119 HB3 LEU 119 23.916 14.801 -5.951 832 HG LEU 119 HG LEU 119 22.834 13.006 -7.348 833 HD11 LEU 119 HD11 LEU 119 24.419 13.300 -9.218 834 HD12 LEU 119 HD12 LEU 119 25.551 14.028 -8.079 835 HD13 LEU 119 HD13 LEU 119 23.994 14.797 -8.385 836 HD21 LEU 119 HD21 LEU 119 23.938 11.064 -6.382 837 HD22 LEU 119 HD22 LEU 119 25.488 11.642 -6.994 838 HD23 LEU 119 HD23 LEU 119 24.217 11.165 -8.120 839 H VAL 120 H VAL 120 24.918 14.145 -2.799 840 HA VAL 120 HA VAL 120 25.288 16.947 -2.887 841 HB VAL 120 HB VAL 120 25.082 15.055 -0.542 842 HG11 VAL 120 HG11 VAL 120 26.373 17.038 0.129 843 HG12 VAL 120 HG12 VAL 120 24.782 16.997 0.891 844 HG13 VAL 120 HG13 VAL 120 25.077 18.071 -0.476 845 HG21 VAL 120 HG21 VAL 120 22.860 16.095 -0.311 846 HG22 VAL 120 HG22 VAL 120 23.062 15.273 -1.859 847 HG23 VAL 120 HG23 VAL 120 23.167 17.033 -1.773 848 H LYS 121 H LYS 121 27.423 14.308 -2.059 849 HA LYS 121 HA LYS 121 29.512 16.016 -1.057 850 HB2 LYS 121 HB2 LYS 121 29.656 13.124 -1.924 851 HB3 LYS 121 HB3 LYS 121 30.838 13.985 -0.948 852 HG2 LYS 121 HG2 LYS 121 29.179 14.241 0.829 853 HG3 LYS 121 HG3 LYS 121 28.001 13.366 -0.150 854 HD2 LYS 121 HD2 LYS 121 28.899 11.804 1.390 855 HD3 LYS 121 HD3 LYS 121 29.624 11.441 -0.178 856 HE2 LYS 121 HE2 LYS 121 31.612 12.786 0.496 857 HE3 LYS 121 HE3 LYS 121 30.894 12.967 2.094 858 HZ1 LYS 121 HZ1 LYS 121 32.508 11.179 2.064 859 HZ2 LYS 121 HZ2 LYS 121 31.672 10.398 0.821 860 HZ3 LYS 121 HZ3 LYS 121 30.961 10.556 2.348 861 H MET 122 H MET 122 28.883 14.163 -3.995 862 HA MET 122 HA MET 122 31.331 14.689 -5.268 863 HB2 MET 122 HB2 MET 122 29.987 12.829 -5.969 864 HB3 MET 122 HB3 MET 122 28.631 13.880 -6.346 865 HG2 MET 122 HG2 MET 122 29.912 14.870 -8.180 866 HG3 MET 122 HG3 MET 122 31.264 13.803 -7.805 867 HE1 MET 122 HE1 MET 122 27.536 14.002 -9.009 868 HE2 MET 122 HE2 MET 122 27.400 12.839 -7.690 869 HE3 MET 122 HE3 MET 122 27.166 12.315 -9.356 870 H LEU 123 H LEU 123 28.304 16.475 -5.254 871 HA LEU 123 HA LEU 123 29.248 18.197 -7.398 872 HB2 LEU 123 HB2 LEU 123 26.657 18.176 -5.857 873 HB3 LEU 123 HB3 LEU 123 27.017 19.260 -7.189 874 HG LEU 123 HG LEU 123 26.915 16.248 -7.410 875 HD11 LEU 123 HD11 LEU 123 24.832 16.644 -8.653 876 HD12 LEU 123 HD12 LEU 123 24.913 18.349 -8.213 877 HD13 LEU 123 HD13 LEU 123 24.714 17.121 -6.961 878 HD21 LEU 123 HD21 LEU 123 27.178 18.411 -9.495 879 HD22 LEU 123 HD22 LEU 123 26.926 16.698 -9.830 880 HD23 LEU 123 HD23 LEU 123 28.409 17.233 -9.039 881 H SER 124 H SER 124 30.091 18.077 -4.346 882 HA SER 124 HA SER 124 30.259 21.014 -4.158 883 HB2 SER 124 HB2 SER 124 30.352 20.710 -1.658 884 HB3 SER 124 HB3 SER 124 28.794 20.309 -2.379 885 HG SER 124 HG SER 124 29.040 18.292 -1.812 886 H ALA 125 H ALA 125 31.687 18.121 -2.708 887 HA ALA 125 HA ALA 125 34.156 18.192 -3.965 888 HB1 ALA 125 HB1 ALA 125 35.632 19.021 -2.207 889 HB2 ALA 125 HB2 ALA 125 34.231 19.509 -1.253 890 HB3 ALA 125 HB3 ALA 125 34.562 20.290 -2.799 891 H ASP 126 H ASP 126 34.086 16.006 -3.940 892 HA ASP 126 HA ASP 126 33.465 14.613 -1.471 893 HB2 ASP 126 HB2 ASP 126 32.532 13.762 -3.599 894 HB3 ASP 126 HB3 ASP 126 34.166 13.445 -4.175 895 H SER 127 H SER 127 35.447 15.850 -0.719 896 HA SER 127 HA SER 127 37.777 14.065 -0.941 897 HB2 SER 127 HB2 SER 127 37.711 16.943 0.005 898 HB3 SER 127 HB3 SER 127 39.149 15.954 -0.255 899 HG SER 127 HG SER 127 37.877 15.831 -2.505 900 H ALA 128 H ALA 128 35.151 14.670 0.851 901 HA ALA 128 HA ALA 128 36.357 14.497 3.475 902 HB1 ALA 128 HB1 ALA 128 33.447 14.407 2.687 903 HB2 ALA 128 HB2 ALA 128 34.340 15.857 3.146 904 HB3 ALA 128 HB3 ALA 128 34.082 14.571 4.325 905 H ASN 129 H ASN 129 37.452 12.531 3.165 906 HA ASN 129 HA ASN 129 35.765 10.129 3.035 907 HB2 ASN 129 HB2 ASN 129 37.607 10.244 1.397 908 HB3 ASN 129 HB3 ASN 129 38.762 10.447 2.708 909 HD21 ASN 129 HD22 ASN 129 36.003 8.251 2.767 910 HD22 ASN 129 HD21 ASN 129 36.946 6.799 2.789 911 H GLU 130 H GLU 130 35.526 8.876 4.782 912 HA GLU 130 HA GLU 130 36.636 9.754 7.284 913 HB2 GLU 130 HB2 GLU 130 35.351 7.769 8.208 914 HB3 GLU 130 HB3 GLU 130 34.397 9.016 7.426 915 HG2 GLU 130 HG2 GLU 130 35.259 6.531 5.980 916 HG3 GLU 130 HG3 GLU 130 33.796 6.588 6.960 917 H VAL 131 H VAL 131 38.852 9.433 6.504 918 HA VAL 131 HA VAL 131 39.743 6.646 6.665 919 HB VAL 131 HB VAL 131 40.452 7.812 4.647 920 HG11 VAL 131 HG11 VAL 131 40.441 10.099 5.406 921 HG12 VAL 131 HG12 VAL 131 42.032 9.705 4.752 922 HG13 VAL 131 HG13 VAL 131 41.788 9.779 6.497 923 HG21 VAL 131 HG21 VAL 131 42.844 7.388 4.763 924 HG22 VAL 131 HG22 VAL 131 41.939 6.126 5.597 925 HG23 VAL 131 HG23 VAL 131 42.768 7.375 6.525 926 H SER 132 H SER 132 40.800 5.946 8.392 927 HA SER 132 HA SER 132 41.357 7.833 10.538 928 HB2 SER 132 HB2 SER 132 41.494 4.809 10.571 929 HB3 SER 132 HB3 SER 132 41.453 5.885 11.968 930 HG SER 132 HG SER 132 39.357 6.243 11.670 931 H THR 133 H THR 133 42.995 6.176 8.085 932 HA THR 133 HA THR 133 45.556 6.237 9.486 933 HB THR 133 HB THR 133 46.417 5.046 7.468 934 HG1 THR 133 HG1 THR 133 44.720 5.904 6.061 935 HG21 THR 133 HG21 THR 133 45.601 3.808 9.442 936 HG22 THR 133 HG22 THR 133 45.342 2.918 7.942 937 HG23 THR 133 HG23 THR 133 43.994 3.747 8.719 Start of MODEL 18 1 HA2 GLY 1 HA2 GLY 1 6.989 -7.505 -0.948 2 HA3 GLY 1 HA3 GLY 1 8.744 -7.503 -0.900 3 H SER 2 H SER 2 9.891 -6.241 -2.345 4 HA SER 2 HA SER 2 8.538 -4.949 -4.539 5 HB2 SER 2 HB2 SER 2 7.914 -3.541 -2.572 6 HB3 SER 2 HB3 SER 2 9.626 -3.248 -2.278 7 HG SER 2 HG SER 2 9.583 -1.775 -3.764 8 H GLY 3 H GLY 3 9.964 -4.107 -6.056 9 HA2 GLY 3 HA2 GLY 3 12.836 -4.500 -5.463 10 HA3 GLY 3 HA3 GLY 3 12.119 -4.811 -7.041 11 H ASN 4 H ASN 4 11.474 -3.053 -8.345 12 HA ASN 4 HA ASN 4 12.924 -0.619 -7.996 13 HB2 ASN 4 HB2 ASN 4 10.721 -1.410 -9.915 14 HB3 ASN 4 HB3 ASN 4 11.466 0.185 -9.927 15 HD21 ASN 4 HD22 ASN 4 12.266 -0.071 -11.986 16 HD22 ASN 4 HD21 ASN 4 13.594 -1.116 -12.346 17 H SER 5 H SER 5 12.409 0.774 -6.439 18 HA SER 5 HA SER 5 9.827 0.631 -5.202 19 HB2 SER 5 HB2 SER 5 10.921 2.437 -3.699 20 HB3 SER 5 HB3 SER 5 11.551 0.790 -3.644 21 HG SER 5 HG SER 5 13.192 2.429 -3.825 22 H GLN 6 H GLN 6 8.329 2.186 -4.948 23 HA GLN 6 HA GLN 6 8.520 4.583 -6.588 24 HB2 GLN 6 HB2 GLN 6 6.444 3.175 -6.662 25 HB3 GLN 6 HB3 GLN 6 6.190 3.539 -4.964 26 HG2 GLN 6 HG2 GLN 6 4.807 4.886 -6.507 27 HG3 GLN 6 HG3 GLN 6 5.828 5.847 -5.440 28 HE21 GLN 6 HE22 GLN 6 7.366 7.148 -6.301 29 HE22 GLN 6 HE21 GLN 6 7.589 7.381 -7.999 30 HA PRO 7 HA PRO 7 10.385 5.501 -2.602 31 HB2 PRO 7 HB2 PRO 7 11.734 7.752 -3.402 32 HB3 PRO 7 HB3 PRO 7 12.316 6.100 -3.614 33 HG2 PRO 7 HG2 PRO 7 11.002 7.917 -5.580 34 HG3 PRO 7 HG3 PRO 7 12.308 6.746 -5.830 35 HD2 PRO 7 HD2 PRO 7 9.724 6.270 -6.541 36 HD3 PRO 7 HD3 PRO 7 10.847 4.977 -6.058 37 H ILE 8 H ILE 8 9.852 8.689 -4.118 38 HA ILE 8 HA ILE 8 8.120 9.388 -1.885 39 HB ILE 8 HB ILE 8 10.395 9.590 -1.004 40 HG12 ILE 8 HG12 ILE 8 10.247 12.030 -0.325 41 HG13 ILE 8 HG13 ILE 8 8.863 12.153 -1.405 42 HG21 ILE 8 HG21 ILE 8 11.908 11.331 -1.864 43 HG22 ILE 8 HG22 ILE 8 10.795 11.604 -3.206 44 HG23 ILE 8 HG23 ILE 8 11.606 10.047 -3.036 45 HD11 ILE 8 HD11 ILE 8 9.081 10.333 0.974 46 HD12 ILE 8 HD12 ILE 8 7.688 10.475 -0.099 47 HD13 ILE 8 HD13 ILE 8 8.180 11.845 0.897 48 H TRP 9 H TRP 9 9.543 10.236 -4.979 49 HA TRP 9 HA TRP 9 8.179 12.751 -5.216 50 HB2 TRP 9 HB2 TRP 9 9.477 11.027 -7.328 51 HB3 TRP 9 HB3 TRP 9 8.894 12.660 -7.589 52 HD1 TRP 9 HD1 TRP 9 11.900 10.763 -6.533 53 HE1 TRP 9 HE1 TRP 9 13.760 12.377 -5.789 54 HE3 TRP 9 HE3 TRP 9 9.169 15.069 -6.258 55 HZ2 TRP 9 HZ2 TRP 9 14.033 15.111 -5.162 56 HZ3 TRP 9 HZ3 TRP 9 10.304 17.142 -5.574 57 HH2 TRP 9 HH2 TRP 9 12.686 17.161 -5.035 58 H THR 10 H THR 10 6.499 10.486 -4.552 59 HA THR 10 HA THR 10 5.110 9.656 -6.922 60 HB THR 10 HB THR 10 4.075 9.252 -4.133 61 HG1 THR 10 HG1 THR 10 5.563 7.590 -3.850 62 HG21 THR 10 HG21 THR 10 3.375 7.101 -5.046 63 HG22 THR 10 HG22 THR 10 4.180 7.469 -6.571 64 HG23 THR 10 HG23 THR 10 2.780 8.417 -6.063 65 H ASN 11 H ASN 11 4.433 11.813 -4.180 66 HA ASN 11 HA ASN 11 2.432 13.169 -5.762 67 HB2 ASN 11 HB2 ASN 11 0.715 13.003 -4.040 68 HB3 ASN 11 HB3 ASN 11 1.174 11.405 -4.594 69 HD21 ASN 11 HD22 ASN 11 0.950 13.533 -1.933 70 HD22 ASN 11 HD21 ASN 11 1.550 12.446 -0.731 71 HA PRO 12 HA PRO 12 3.913 16.967 -4.121 72 HB2 PRO 12 HB2 PRO 12 1.092 17.384 -3.220 73 HB3 PRO 12 HB3 PRO 12 2.161 18.478 -4.102 74 HG2 PRO 12 HG2 PRO 12 0.240 17.117 -5.356 75 HG3 PRO 12 HG3 PRO 12 1.811 17.411 -6.120 76 HD2 PRO 12 HD2 PRO 12 0.699 14.899 -5.007 77 HD3 PRO 12 HD3 PRO 12 1.909 15.135 -6.281 78 H ASN 13 H ASN 13 1.422 15.567 -1.955 79 HA ASN 13 HA ASN 13 2.541 16.840 0.355 80 HB2 ASN 13 HB2 ASN 13 0.076 16.086 -0.129 81 HB3 ASN 13 HB3 ASN 13 0.610 14.550 0.539 82 HD21 ASN 13 HD22 ASN 13 -1.372 16.347 1.592 83 HD22 ASN 13 HD21 ASN 13 -0.834 16.825 3.162 84 H ALA 14 H ALA 14 3.781 14.410 -1.348 85 HA ALA 14 HA ALA 14 4.896 13.082 1.031 86 HB1 ALA 14 HB1 ALA 14 3.886 11.559 -0.595 87 HB2 ALA 14 HB2 ALA 14 5.628 11.310 -0.486 88 HB3 ALA 14 HB3 ALA 14 4.948 12.190 -1.852 89 H ALA 15 H ALA 15 5.828 14.245 -2.181 90 HA ALA 15 HA ALA 15 8.610 14.168 -1.706 91 HB1 ALA 15 HB1 ALA 15 7.553 14.074 -3.936 92 HB2 ALA 15 HB2 ALA 15 8.826 15.290 -3.821 93 HB3 ALA 15 HB3 ALA 15 7.132 15.776 -3.776 94 H MET 16 H MET 16 6.289 16.873 -1.665 95 HA MET 16 HA MET 16 8.235 18.838 -1.142 96 HB2 MET 16 HB2 MET 16 5.413 18.713 -1.464 97 HB3 MET 16 HB3 MET 16 5.751 19.593 0.020 98 HG2 MET 16 HG2 MET 16 6.908 20.230 -2.680 99 HG3 MET 16 HG3 MET 16 5.530 21.036 -1.945 100 HE1 MET 16 HE1 MET 16 9.098 21.224 -2.707 101 HE2 MET 16 HE2 MET 16 9.426 20.218 -1.300 102 HE3 MET 16 HE3 MET 16 9.924 21.905 -1.307 103 H THR 17 H THR 17 6.162 16.905 0.932 104 HA THR 17 HA THR 17 6.596 18.108 3.370 105 HB THR 17 HB THR 17 6.197 15.171 2.779 106 HG1 THR 17 HG1 THR 17 4.088 15.661 2.725 107 HG21 THR 17 HG21 THR 17 7.012 15.471 5.062 108 HG22 THR 17 HG22 THR 17 5.300 15.054 5.078 109 HG23 THR 17 HG23 THR 17 5.800 16.721 5.348 110 H MET 18 H MET 18 8.519 15.449 1.914 111 HA MET 18 HA MET 18 10.316 15.266 4.084 112 HB2 MET 18 HB2 MET 18 11.733 13.947 2.661 113 HB3 MET 18 HB3 MET 18 10.064 13.519 2.310 114 HG2 MET 18 HG2 MET 18 10.083 14.608 0.263 115 HG3 MET 18 HG3 MET 18 11.494 15.575 0.683 116 HE1 MET 18 HE1 MET 18 12.486 15.126 -1.629 117 HE2 MET 18 HE2 MET 18 11.163 14.066 -2.126 118 HE3 MET 18 HE3 MET 18 12.835 13.531 -2.303 119 H THR 19 H THR 19 10.202 17.293 1.240 120 HA THR 19 HA THR 19 12.857 18.182 1.219 121 HB THR 19 HB THR 19 10.403 19.672 0.287 122 HG1 THR 19 HG1 THR 19 10.569 17.607 -0.703 123 HG21 THR 19 HG21 THR 19 11.930 20.786 -1.253 124 HG22 THR 19 HG22 THR 19 13.288 19.894 -0.563 125 HG23 THR 19 HG23 THR 19 12.409 21.069 0.422 126 H ASN 20 H ASN 20 9.952 19.784 2.632 127 HA ASN 20 HA ASN 20 11.583 21.867 3.718 128 HB2 ASN 20 HB2 ASN 20 9.432 22.470 4.976 129 HB3 ASN 20 HB3 ASN 20 9.444 22.627 3.228 130 HD21 ASN 20 HD22 ASN 20 8.007 21.538 2.068 131 HD22 ASN 20 HD21 ASN 20 6.856 20.430 2.713 132 H ASN 21 H ASN 21 10.413 18.800 4.920 133 HA ASN 21 HA ASN 21 10.993 19.271 7.652 134 HB2 ASN 21 HB2 ASN 21 10.701 16.815 5.965 135 HB3 ASN 21 HB3 ASN 21 11.396 16.663 7.573 136 HD21 ASN 21 HD22 ASN 21 8.910 15.618 6.510 137 HD22 ASN 21 HD21 ASN 21 7.652 16.231 7.524 138 H LEU 22 H LEU 22 12.938 18.292 4.908 139 HA LEU 22 HA LEU 22 15.326 17.735 6.304 140 HB2 LEU 22 HB2 LEU 22 15.019 17.069 3.983 141 HB3 LEU 22 HB3 LEU 22 14.867 18.743 3.492 142 HG LEU 22 HG LEU 22 17.228 19.124 4.140 143 HD11 LEU 22 HD11 LEU 22 18.668 17.194 4.576 144 HD12 LEU 22 HD12 LEU 22 17.249 16.145 4.607 145 HD13 LEU 22 HD13 LEU 22 17.448 17.399 5.833 146 HD21 LEU 22 HD21 LEU 22 16.658 18.593 1.834 147 HD22 LEU 22 HD22 LEU 22 16.784 16.870 2.187 148 HD23 LEU 22 HD23 LEU 22 18.217 17.894 2.271 149 H VAL 23 H VAL 23 13.908 20.671 5.002 150 HA VAL 23 HA VAL 23 16.094 22.388 5.528 151 HB VAL 23 HB VAL 23 13.157 23.072 5.286 152 HG11 VAL 23 HG11 VAL 23 15.586 24.851 5.086 153 HG12 VAL 23 HG12 VAL 23 14.411 24.847 6.399 154 HG13 VAL 23 HG13 VAL 23 13.921 25.343 4.780 155 HG21 VAL 23 HG21 VAL 23 13.698 23.653 2.981 156 HG22 VAL 23 HG22 VAL 23 14.049 21.957 3.304 157 HG23 VAL 23 HG23 VAL 23 15.362 23.131 3.230 158 H GLN 24 H GLN 24 13.131 21.641 7.369 159 HA GLN 24 HA GLN 24 13.700 23.481 9.445 160 HB2 GLN 24 HB2 GLN 24 11.901 22.465 10.679 161 HB3 GLN 24 HB3 GLN 24 11.429 22.574 8.994 162 HG2 GLN 24 HG2 GLN 24 10.746 20.476 9.301 163 HG3 GLN 24 HG3 GLN 24 12.444 20.079 9.050 164 HE21 GLN 24 HE22 GLN 24 9.895 20.425 11.380 165 HE22 GLN 24 HE21 GLN 24 10.693 19.601 12.675 166 H CYS 25 H CYS 25 14.557 20.130 8.919 167 HA CYS 25 HA CYS 25 15.628 19.697 11.520 168 HB2 CYS 25 HB2 CYS 25 14.904 17.870 9.989 169 HB3 CYS 25 HB3 CYS 25 16.274 18.241 8.946 170 H ALA 26 H ALA 26 17.036 20.648 8.396 171 HA ALA 26 HA ALA 26 19.709 20.779 9.339 172 HB1 ALA 26 HB1 ALA 26 19.084 20.612 6.945 173 HB2 ALA 26 HB2 ALA 26 20.201 21.934 7.281 174 HB3 ALA 26 HB3 ALA 26 18.491 22.272 7.016 175 H SER 27 H SER 27 17.034 23.018 9.329 176 HA SER 27 HA SER 27 18.484 25.346 10.021 177 HB2 SER 27 HB2 SER 27 16.208 25.435 9.105 178 HB3 SER 27 HB3 SER 27 15.588 24.617 10.537 179 HG SER 27 HG SER 27 17.003 27.062 10.717 180 H ARG 28 H ARG 28 16.920 22.802 11.921 181 HA ARG 28 HA ARG 28 17.753 24.159 14.388 182 HB2 ARG 28 HB2 ARG 28 15.901 21.787 14.114 183 HB3 ARG 28 HB3 ARG 28 16.135 22.795 15.533 184 HG2 ARG 28 HG2 ARG 28 14.889 23.660 12.933 185 HG3 ARG 28 HG3 ARG 28 14.032 23.295 14.432 186 HD2 ARG 28 HD2 ARG 28 16.062 25.495 14.059 187 HD3 ARG 28 HD3 ARG 28 14.315 25.712 14.070 188 HE ARG 28 HE ARG 28 15.985 24.986 16.379 189 HH11 ARG 28 HH11 ARG 28 12.901 26.009 15.070 190 HH12 ARG 28 HH12 ARG 28 12.248 26.454 16.614 191 HH21 ARG 28 HH21 ARG 28 15.122 25.569 18.416 192 HH22 ARG 28 HH22 ARG 28 13.511 26.211 18.514 193 H SER 29 H SER 29 19.491 22.618 12.551 194 HA SER 29 HA SER 29 20.099 20.126 13.788 195 HB2 SER 29 HB2 SER 29 22.102 20.177 12.306 196 HB3 SER 29 HB3 SER 29 20.600 20.485 11.433 197 HG SER 29 HG SER 29 21.254 22.446 10.984 198 H GLY 30 H GLY 30 21.414 23.389 13.952 199 HA2 GLY 30 HA2 GLY 30 22.616 24.278 15.790 200 HA3 GLY 30 HA3 GLY 30 22.985 22.636 16.306 201 H VAL 31 H VAL 31 23.363 22.821 13.036 202 HA VAL 31 HA VAL 31 26.267 23.212 13.301 203 HB VAL 31 HB VAL 31 24.794 21.639 11.179 204 HG11 VAL 31 HG11 VAL 31 27.732 21.846 11.826 205 HG12 VAL 31 HG12 VAL 31 26.921 22.516 10.410 206 HG13 VAL 31 HG13 VAL 31 27.023 20.767 10.626 207 HG21 VAL 31 HG21 VAL 31 25.640 19.630 12.313 208 HG22 VAL 31 HG22 VAL 31 24.548 20.553 13.346 209 HG23 VAL 31 HG23 VAL 31 26.291 20.640 13.605 210 H LEU 32 H LEU 32 23.740 23.431 10.789 211 HA LEU 32 HA LEU 32 25.141 25.246 9.156 212 HB2 LEU 32 HB2 LEU 32 22.199 24.601 9.345 213 HB3 LEU 32 HB3 LEU 32 22.856 25.705 8.156 214 HG LEU 32 HG LEU 32 24.323 23.747 7.392 215 HD11 LEU 32 HD11 LEU 32 23.402 21.514 7.831 216 HD12 LEU 32 HD12 LEU 32 22.278 22.218 8.993 217 HD13 LEU 32 HD13 LEU 32 24.013 22.283 9.295 218 HD21 LEU 32 HD21 LEU 32 22.511 22.843 5.994 219 HD22 LEU 32 HD22 LEU 32 22.482 24.605 6.079 220 HD23 LEU 32 HD23 LEU 32 21.332 23.658 7.023 221 H THR 33 H THR 33 24.808 27.493 8.817 222 HA THR 33 HA THR 33 24.292 28.858 11.337 223 HB THR 33 HB THR 33 25.305 30.805 10.360 224 HG1 THR 33 HG1 THR 33 25.452 31.113 8.256 225 HG21 THR 33 HG21 THR 33 26.837 28.363 9.462 226 HG22 THR 33 HG22 THR 33 26.827 29.018 11.100 227 HG23 THR 33 HG23 THR 33 27.509 29.965 9.779 228 H ALA 34 H ALA 34 23.133 31.001 11.233 229 HA ALA 34 HA ALA 34 20.503 30.728 10.358 230 HB1 ALA 34 HB1 ALA 34 21.250 32.308 12.099 231 HB2 ALA 34 HB2 ALA 34 20.229 33.073 10.881 232 HB3 ALA 34 HB3 ALA 34 21.977 33.311 10.845 233 H ASP 35 H ASP 35 23.333 31.969 8.760 234 HA ASP 35 HA ASP 35 22.017 33.128 6.512 235 HB2 ASP 35 HB2 ASP 35 24.782 31.956 6.367 236 HB3 ASP 35 HB3 ASP 35 24.157 33.407 5.593 237 H GLN 36 H GLN 36 23.694 30.068 7.069 238 HA GLN 36 HA GLN 36 23.414 29.095 4.446 239 HB2 GLN 36 HB2 GLN 36 25.109 28.396 6.183 240 HB3 GLN 36 HB3 GLN 36 23.834 27.455 6.943 241 HG2 GLN 36 HG2 GLN 36 23.604 26.097 4.969 242 HG3 GLN 36 HG3 GLN 36 24.777 27.096 4.119 243 HE21 GLN 36 HE22 GLN 36 26.137 25.387 3.713 244 HE22 GLN 36 HE21 GLN 36 27.085 24.634 4.956 245 H MET 37 H MET 37 21.422 28.735 7.328 246 HA MET 37 HA MET 37 19.822 26.634 6.252 247 HB2 MET 37 HB2 MET 37 18.380 26.948 8.151 248 HB3 MET 37 HB3 MET 37 20.049 27.059 8.684 249 HG2 MET 37 HG2 MET 37 19.879 29.487 8.736 250 HG3 MET 37 HG3 MET 37 18.210 29.386 8.182 251 HE1 MET 37 HE1 MET 37 20.071 27.044 10.777 252 HE2 MET 37 HE2 MET 37 19.674 27.860 12.290 253 HE3 MET 37 HE3 MET 37 20.714 28.655 11.106 254 H ASP 38 H ASP 38 19.848 30.046 5.784 255 HA ASP 38 HA ASP 38 17.083 30.230 5.012 256 HB2 ASP 38 HB2 ASP 38 18.347 32.205 5.850 257 HB3 ASP 38 HB3 ASP 38 19.327 32.161 4.386 258 H ASP 39 H ASP 39 20.159 29.705 3.400 259 HA ASP 39 HA ASP 39 19.219 29.833 0.740 260 HB2 ASP 39 HB2 ASP 39 21.478 28.183 1.906 261 HB3 ASP 39 HB3 ASP 39 21.192 28.414 0.184 262 H MET 40 H MET 40 19.235 27.304 3.157 263 HA MET 40 HA MET 40 18.346 25.149 1.606 264 HB2 MET 40 HB2 MET 40 17.829 25.839 4.504 265 HB3 MET 40 HB3 MET 40 17.378 24.304 3.776 266 HG2 MET 40 HG2 MET 40 20.192 25.352 3.812 267 HG3 MET 40 HG3 MET 40 19.525 24.316 5.072 268 HE1 MET 40 HE1 MET 40 18.792 21.864 4.750 269 HE2 MET 40 HE2 MET 40 18.848 20.982 3.224 270 HE3 MET 40 HE3 MET 40 17.680 22.284 3.448 271 H GLY 41 H GLY 41 16.569 27.744 3.221 272 HA2 GLY 41 HA2 GLY 41 13.964 26.802 2.667 273 HA3 GLY 41 HA3 GLY 41 14.402 28.469 3.016 274 H MET 42 H MET 42 16.152 28.919 0.869 275 HA MET 42 HA MET 42 14.320 29.522 -1.209 276 HB2 MET 42 HB2 MET 42 17.343 29.528 -1.298 277 HB3 MET 42 HB3 MET 42 16.277 30.298 -2.465 278 HG2 MET 42 HG2 MET 42 15.388 31.676 -0.545 279 HG3 MET 42 HG3 MET 42 16.732 31.048 0.404 280 HE1 MET 42 HE1 MET 42 19.825 32.426 -1.584 281 HE2 MET 42 HE2 MET 42 19.048 30.849 -1.734 282 HE3 MET 42 HE3 MET 42 19.300 31.561 -0.139 283 H MET 43 H MET 43 16.719 27.003 -0.732 284 HA MET 43 HA MET 43 16.591 25.811 -3.268 285 HB2 MET 43 HB2 MET 43 18.344 25.270 -1.677 286 HB3 MET 43 HB3 MET 43 17.169 24.621 -0.549 287 HG2 MET 43 HG2 MET 43 17.487 23.433 -3.273 288 HG3 MET 43 HG3 MET 43 18.590 23.007 -1.966 289 HE1 MET 43 HE1 MET 43 17.801 21.932 0.327 290 HE2 MET 43 HE2 MET 43 16.156 21.393 0.657 291 HE3 MET 43 HE3 MET 43 16.516 23.114 0.581 292 H ALA 44 H ALA 44 14.769 25.132 -0.290 293 HA ALA 44 HA ALA 44 13.194 23.047 -1.289 294 HB1 ALA 44 HB1 ALA 44 12.496 25.061 0.843 295 HB2 ALA 44 HB2 ALA 44 13.358 23.542 1.086 296 HB3 ALA 44 HB3 ALA 44 11.674 23.525 0.565 297 H ASP 45 H ASP 45 12.822 26.524 -1.502 298 HA ASP 45 HA ASP 45 10.185 26.627 -2.449 299 HB2 ASP 45 HB2 ASP 45 11.283 28.643 -1.707 300 HB3 ASP 45 HB3 ASP 45 12.515 28.478 -2.956 301 H SER 46 H SER 46 13.252 26.219 -4.092 302 HA SER 46 HA SER 46 12.244 26.371 -6.736 303 HB2 SER 46 HB2 SER 46 14.629 26.709 -6.086 304 HB3 SER 46 HB3 SER 46 14.742 24.990 -5.715 305 HG SER 46 HG SER 46 15.504 25.225 -7.758 306 H VAL 47 H VAL 47 12.797 23.727 -4.468 307 HA VAL 47 HA VAL 47 12.544 21.570 -6.208 308 HB VAL 47 HB VAL 47 11.805 21.676 -3.282 309 HG11 VAL 47 HG11 VAL 47 10.830 19.728 -4.397 310 HG12 VAL 47 HG12 VAL 47 12.128 19.253 -3.299 311 HG13 VAL 47 HG13 VAL 47 12.415 19.300 -5.039 312 HG21 VAL 47 HG21 VAL 47 14.104 22.349 -3.695 313 HG22 VAL 47 HG22 VAL 47 14.371 20.897 -4.666 314 HG23 VAL 47 HG23 VAL 47 14.057 20.757 -2.935 315 H ASN 48 H ASN 48 9.962 23.183 -4.296 316 HA ASN 48 HA ASN 48 8.001 21.306 -5.103 317 HB2 ASN 48 HB2 ASN 48 6.333 22.933 -4.258 318 HB3 ASN 48 HB3 ASN 48 7.576 22.533 -3.093 319 HD21 ASN 48 HD22 ASN 48 8.823 24.105 -2.281 320 HD22 ASN 48 HD21 ASN 48 8.655 25.773 -2.686 321 H SER 49 H SER 49 9.138 24.310 -6.498 322 HA SER 49 HA SER 49 7.010 24.587 -8.351 323 HB2 SER 49 HB2 SER 49 8.711 26.379 -7.728 324 HB3 SER 49 HB3 SER 49 9.851 25.535 -8.775 325 HG SER 49 HG SER 49 7.312 26.523 -9.589 326 H GLN 50 H GLN 50 10.229 23.103 -8.539 327 HA GLN 50 HA GLN 50 10.056 22.202 -11.194 328 HB2 GLN 50 HB2 GLN 50 11.580 20.976 -8.887 329 HB3 GLN 50 HB3 GLN 50 11.861 20.646 -10.590 330 HG2 GLN 50 HG2 GLN 50 12.531 22.955 -10.945 331 HG3 GLN 50 HG3 GLN 50 12.211 23.317 -9.249 332 HE21 GLN 50 HE22 GLN 50 14.307 23.922 -8.807 333 HE22 GLN 50 HE21 GLN 50 15.623 22.788 -8.742 334 H MET 51 H MET 51 9.236 20.609 -8.137 335 HA MET 51 HA MET 51 8.613 18.096 -9.206 336 HB2 MET 51 HB2 MET 51 9.050 18.417 -6.846 337 HB3 MET 51 HB3 MET 51 7.635 19.446 -6.690 338 HG2 MET 51 HG2 MET 51 7.080 16.767 -7.744 339 HG3 MET 51 HG3 MET 51 7.715 16.799 -6.100 340 HE1 MET 51 HE1 MET 51 6.553 19.549 -4.947 341 HE2 MET 51 HE2 MET 51 6.589 18.007 -4.097 342 HE3 MET 51 HE3 MET 51 5.089 18.928 -4.182 343 H GLN 52 H GLN 52 6.487 20.881 -8.521 344 HA GLN 52 HA GLN 52 4.140 19.449 -9.279 345 HB2 GLN 52 HB2 GLN 52 4.586 22.415 -8.949 346 HB3 GLN 52 HB3 GLN 52 3.017 21.660 -9.198 347 HG2 GLN 52 HG2 GLN 52 3.413 20.342 -7.112 348 HG3 GLN 52 HG3 GLN 52 4.856 21.316 -6.841 349 HE21 GLN 52 HE22 GLN 52 4.622 23.513 -6.339 350 HE22 GLN 52 HE21 GLN 52 3.125 24.161 -5.768 351 H LYS 53 H LYS 53 6.434 21.469 -11.007 352 HA LYS 53 HA LYS 53 4.833 21.543 -13.389 353 HB2 LYS 53 HB2 LYS 53 7.759 22.152 -12.937 354 HB3 LYS 53 HB3 LYS 53 6.923 22.387 -14.469 355 HG2 LYS 53 HG2 LYS 53 5.387 23.958 -13.371 356 HG3 LYS 53 HG3 LYS 53 6.274 23.749 -11.863 357 HD2 LYS 53 HD2 LYS 53 8.316 24.571 -13.032 358 HD3 LYS 53 HD3 LYS 53 7.312 24.915 -14.442 359 HE2 LYS 53 HE2 LYS 53 7.025 26.106 -11.690 360 HE3 LYS 53 HE3 LYS 53 7.619 26.928 -13.133 361 HZ1 LYS 53 HZ1 LYS 53 5.313 27.481 -12.684 362 HZ2 LYS 53 HZ2 LYS 53 4.875 25.850 -12.763 363 HZ3 LYS 53 HZ3 LYS 53 5.443 26.641 -14.146 364 H MET 54 H MET 54 7.077 19.351 -11.968 365 HA MET 54 HA MET 54 7.478 17.721 -14.267 366 HB2 MET 54 HB2 MET 54 8.936 17.505 -12.312 367 HB3 MET 54 HB3 MET 54 7.568 17.018 -11.322 368 HG2 MET 54 HG2 MET 54 7.354 14.961 -12.466 369 HG3 MET 54 HG3 MET 54 8.466 15.471 -13.731 370 HE1 MET 54 HE1 MET 54 9.759 14.363 -9.423 371 HE2 MET 54 HE2 MET 54 8.094 14.284 -10.009 372 HE3 MET 54 HE3 MET 54 8.869 15.852 -9.760 373 H GLY 55 H GLY 55 5.022 18.014 -11.806 374 HA2 GLY 55 HA2 GLY 55 2.753 17.693 -12.783 375 HA3 GLY 55 HA3 GLY 55 3.353 16.149 -13.373 376 HA PRO 56 HA PRO 56 1.696 15.739 -8.910 377 HB2 PRO 56 HB2 PRO 56 -0.959 15.467 -9.249 378 HB3 PRO 56 HB3 PRO 56 -0.210 17.051 -9.005 379 HG2 PRO 56 HG2 PRO 56 -1.081 15.740 -11.556 380 HG3 PRO 56 HG3 PRO 56 -1.328 17.413 -11.022 381 HD2 PRO 56 HD2 PRO 56 0.637 16.688 -12.758 382 HD3 PRO 56 HD3 PRO 56 0.795 18.054 -11.635 383 H ASN 57 H ASN 57 2.334 14.227 -11.488 384 HA ASN 57 HA ASN 57 1.850 11.587 -10.586 385 HB2 ASN 57 HB2 ASN 57 -0.212 12.746 -12.128 386 HB3 ASN 57 HB3 ASN 57 0.656 11.667 -13.217 387 HD21 ASN 57 HD22 ASN 57 0.241 11.263 -9.748 388 HD22 ASN 57 HD21 ASN 57 -0.724 9.829 -9.845 389 HA PRO 58 HA PRO 58 5.411 12.911 -13.281 390 HB2 PRO 58 HB2 PRO 58 7.027 11.477 -11.291 391 HB3 PRO 58 HB3 PRO 58 7.144 13.150 -11.835 392 HG2 PRO 58 HG2 PRO 58 6.245 12.534 -9.386 393 HG3 PRO 58 HG3 PRO 58 5.579 13.896 -10.309 394 HD2 PRO 58 HD2 PRO 58 4.459 11.138 -9.938 395 HD3 PRO 58 HD3 PRO 58 3.631 12.707 -9.858 396 HA PRO 59 HA PRO 59 6.036 8.926 -15.264 397 HB2 PRO 59 HB2 PRO 59 7.965 9.808 -17.001 398 HB3 PRO 59 HB3 PRO 59 6.231 9.986 -17.284 399 HG2 PRO 59 HG2 PRO 59 8.210 11.986 -16.310 400 HG3 PRO 59 HG3 PRO 59 6.819 12.212 -17.382 401 HD2 PRO 59 HD2 PRO 59 6.818 12.904 -14.746 402 HD3 PRO 59 HD3 PRO 59 5.356 12.443 -15.636 403 H GLN 60 H GLN 60 7.585 7.336 -15.068 404 HA GLN 60 HA GLN 60 9.068 7.397 -12.741 405 HB2 GLN 60 HB2 GLN 60 9.264 5.543 -15.107 406 HB3 GLN 60 HB3 GLN 60 10.111 5.269 -13.589 407 HG2 GLN 60 HG2 GLN 60 7.123 5.483 -13.914 408 HG3 GLN 60 HG3 GLN 60 8.035 3.983 -13.742 409 HE21 GLN 60 HE22 GLN 60 5.924 5.117 -12.064 410 HE22 GLN 60 HE21 GLN 60 6.592 5.247 -10.472 411 H HIS 61 H HIS 61 10.189 8.053 -16.032 412 HA HIS 61 HA HIS 61 12.956 7.902 -15.367 413 HB2 HIS 61 HB2 HIS 61 13.408 8.790 -17.559 414 HB3 HIS 61 HB3 HIS 61 12.098 7.628 -17.686 415 HD1 HIS 61 HD1 HIS 61 10.046 8.412 -18.882 416 HD2 HIS 61 HD2 HIS 61 12.464 11.572 -17.677 417 HE1 HIS 61 HE1 HIS 61 9.040 10.471 -19.915 418 H ARG 62 H ARG 62 10.597 10.320 -14.873 419 HA ARG 62 HA ARG 62 12.398 12.550 -14.862 420 HB2 ARG 62 HB2 ARG 62 9.548 12.106 -14.105 421 HB3 ARG 62 HB3 ARG 62 10.367 13.537 -13.492 422 HG2 ARG 62 HG2 ARG 62 10.309 12.831 -16.409 423 HG3 ARG 62 HG3 ARG 62 9.066 13.814 -15.635 424 HD2 ARG 62 HD2 ARG 62 10.853 15.370 -14.876 425 HD3 ARG 62 HD3 ARG 62 12.012 14.425 -15.812 426 HE ARG 62 HE ARG 62 10.335 15.003 -17.727 427 HH11 ARG 62 HH11 ARG 62 11.433 17.092 -15.144 428 HH12 ARG 62 HH12 ARG 62 11.229 18.548 -16.061 429 HH21 ARG 62 HH21 ARG 62 10.068 16.917 -18.936 430 HH22 ARG 62 HH22 ARG 62 10.445 18.450 -18.219 431 H LEU 63 H LEU 63 11.207 10.267 -12.491 432 HA LEU 63 HA LEU 63 12.069 11.624 -10.180 433 HB2 LEU 63 HB2 LEU 63 11.615 8.715 -10.782 434 HB3 LEU 63 HB3 LEU 63 12.210 9.236 -9.220 435 HG LEU 63 HG LEU 63 10.145 10.666 -9.019 436 HD11 LEU 63 HD11 LEU 63 9.299 9.070 -11.427 437 HD12 LEU 63 HD12 LEU 63 9.499 10.821 -11.329 438 HD13 LEU 63 HD13 LEU 63 8.220 10.027 -10.412 439 HD21 LEU 63 HD21 LEU 63 8.730 8.814 -8.348 440 HD22 LEU 63 HD22 LEU 63 10.403 8.513 -7.880 441 HD23 LEU 63 HD23 LEU 63 9.720 7.696 -9.285 442 H ARG 64 H ARG 64 13.712 9.602 -12.493 443 HA ARG 64 HA ARG 64 16.117 9.455 -10.881 444 HB2 ARG 64 HB2 ARG 64 15.368 8.330 -13.576 445 HB3 ARG 64 HB3 ARG 64 17.012 8.246 -12.958 446 HG2 ARG 64 HG2 ARG 64 15.957 6.177 -12.470 447 HG3 ARG 64 HG3 ARG 64 16.107 7.058 -10.949 448 HD2 ARG 64 HD2 ARG 64 13.725 7.871 -11.404 449 HD3 ARG 64 HD3 ARG 64 13.655 6.600 -12.622 450 HE ARG 64 HE ARG 64 14.515 5.615 -10.080 451 HH11 ARG 64 HH11 ARG 64 11.715 6.512 -11.964 452 HH12 ARG 64 HH12 ARG 64 10.610 5.534 -11.046 453 HH21 ARG 64 HH21 ARG 64 13.065 4.359 -8.825 454 HH22 ARG 64 HH22 ARG 64 11.386 4.301 -9.258 455 H ALA 65 H ALA 65 14.774 11.798 -12.643 456 HA ALA 65 HA ALA 65 17.387 12.882 -13.464 457 HB1 ALA 65 HB1 ALA 65 15.739 12.713 -15.289 458 HB2 ALA 65 HB2 ALA 65 16.188 14.383 -14.946 459 HB3 ALA 65 HB3 ALA 65 14.645 13.753 -14.375 460 H MET 66 H MET 66 14.920 13.089 -11.156 461 HA MET 66 HA MET 66 15.294 15.931 -10.618 462 HB2 MET 66 HB2 MET 66 13.447 13.838 -9.482 463 HB3 MET 66 HB3 MET 66 13.620 15.420 -8.734 464 HG2 MET 66 HG2 MET 66 12.782 14.940 -11.582 465 HG3 MET 66 HG3 MET 66 11.685 15.263 -10.240 466 HE1 MET 66 HE1 MET 66 12.613 18.930 -9.264 467 HE2 MET 66 HE2 MET 66 13.306 17.467 -8.567 468 HE3 MET 66 HE3 MET 66 11.580 17.541 -8.927 469 H ASN 67 H ASN 67 16.417 12.903 -9.560 470 HA ASN 67 HA ASN 67 17.240 13.389 -6.959 471 HB2 ASN 67 HB2 ASN 67 19.173 11.776 -7.630 472 HB3 ASN 67 HB3 ASN 67 17.518 11.187 -7.652 473 HD21 ASN 67 HD22 ASN 67 17.931 9.591 -9.120 474 HD22 ASN 67 HD21 ASN 67 18.253 9.918 -10.794 475 H THR 68 H THR 68 19.136 13.840 -9.927 476 HA THR 68 HA THR 68 21.339 15.079 -8.692 477 HB THR 68 HB THR 68 20.424 15.387 -11.560 478 HG1 THR 68 HG1 THR 68 20.676 13.170 -10.906 479 HG21 THR 68 HG21 THR 68 22.184 16.968 -10.889 480 HG22 THR 68 HG22 THR 68 22.795 15.775 -12.034 481 HG23 THR 68 HG23 THR 68 23.171 15.623 -10.318 482 H ALA 69 H ALA 69 18.366 16.332 -10.092 483 HA ALA 69 HA ALA 69 18.986 19.034 -10.255 484 HB1 ALA 69 HB1 ALA 69 16.318 17.795 -9.584 485 HB2 ALA 69 HB2 ALA 69 16.958 18.045 -11.208 486 HB3 ALA 69 HB3 ALA 69 16.581 19.432 -10.187 487 H MET 70 H MET 70 17.282 17.375 -7.588 488 HA MET 70 HA MET 70 17.313 19.666 -5.910 489 HB2 MET 70 HB2 MET 70 15.680 17.798 -5.688 490 HB3 MET 70 HB3 MET 70 16.976 16.771 -5.100 491 HG2 MET 70 HG2 MET 70 16.800 19.257 -3.621 492 HG3 MET 70 HG3 MET 70 15.297 18.341 -3.572 493 HE1 MET 70 HE1 MET 70 16.230 15.071 -1.810 494 HE2 MET 70 HE2 MET 70 15.860 15.417 -3.497 495 HE3 MET 70 HE3 MET 70 14.927 16.193 -2.214 496 H ALA 71 H ALA 71 19.277 16.733 -6.056 497 HA ALA 71 HA ALA 71 20.879 17.103 -3.830 498 HB1 ALA 71 HB1 ALA 71 20.869 15.065 -5.166 499 HB2 ALA 71 HB2 ALA 71 22.509 15.667 -4.919 500 HB3 ALA 71 HB3 ALA 71 21.701 15.912 -6.469 501 H ALA 72 H ALA 72 21.284 18.427 -7.096 502 HA ALA 72 HA ALA 72 23.840 19.554 -6.681 503 HB1 ALA 72 HB1 ALA 72 21.697 20.435 -8.611 504 HB2 ALA 72 HB2 ALA 72 22.886 19.164 -8.905 505 HB3 ALA 72 HB3 ALA 72 23.413 20.835 -8.702 506 H GLU 73 H GLU 73 20.580 20.966 -6.461 507 HA GLU 73 HA GLU 73 21.545 23.561 -5.814 508 HB2 GLU 73 HB2 GLU 73 18.813 22.300 -5.636 509 HB3 GLU 73 HB3 GLU 73 19.117 23.972 -5.176 510 HG2 GLU 73 HG2 GLU 73 19.883 24.487 -7.412 511 HG3 GLU 73 HG3 GLU 73 19.701 22.802 -7.889 512 H VAL 74 H VAL 74 20.744 20.743 -3.910 513 HA VAL 74 HA VAL 74 20.862 22.095 -1.383 514 HB VAL 74 HB VAL 74 21.238 19.161 -2.036 515 HG11 VAL 74 HG11 VAL 74 22.330 19.705 0.072 516 HG12 VAL 74 HG12 VAL 74 20.867 18.762 0.359 517 HG13 VAL 74 HG13 VAL 74 20.863 20.503 0.643 518 HG21 VAL 74 HG21 VAL 74 18.861 20.634 -0.911 519 HG22 VAL 74 HG22 VAL 74 18.964 18.899 -1.209 520 HG23 VAL 74 HG23 VAL 74 19.008 20.031 -2.562 521 H ALA 75 H ALA 75 23.138 20.225 -3.342 522 HA ALA 75 HA ALA 75 25.346 20.285 -1.628 523 HB1 ALA 75 HB1 ALA 75 26.678 19.821 -3.613 524 HB2 ALA 75 HB2 ALA 75 25.323 20.287 -4.641 525 HB3 ALA 75 HB3 ALA 75 25.201 18.861 -3.612 526 H GLU 76 H GLU 76 24.081 22.685 -3.823 527 HA GLU 76 HA GLU 76 26.271 24.395 -4.043 528 HB2 GLU 76 HB2 GLU 76 23.737 24.373 -5.005 529 HB3 GLU 76 HB3 GLU 76 23.596 25.641 -3.796 530 HG2 GLU 76 HG2 GLU 76 24.112 26.612 -5.921 531 HG3 GLU 76 HG3 GLU 76 25.494 26.804 -4.842 532 H VAL 77 H VAL 77 23.807 24.078 -1.558 533 HA VAL 77 HA VAL 77 24.601 26.380 -0.056 534 HB VAL 77 HB VAL 77 23.011 23.988 0.895 535 HG11 VAL 77 HG11 VAL 77 22.044 25.567 2.504 536 HG12 VAL 77 HG12 VAL 77 23.126 26.825 1.910 537 HG13 VAL 77 HG13 VAL 77 23.787 25.399 2.708 538 HG21 VAL 77 HG21 VAL 77 21.977 24.877 -1.101 539 HG22 VAL 77 HG22 VAL 77 22.047 26.513 -0.446 540 HG23 VAL 77 HG23 VAL 77 21.009 25.303 0.310 541 H VAL 78 H VAL 78 25.413 22.988 -0.070 542 HA VAL 78 HA VAL 78 26.775 23.048 2.470 543 HB VAL 78 HB VAL 78 26.917 20.881 0.367 544 HG11 VAL 78 HG11 VAL 78 27.236 20.760 3.363 545 HG12 VAL 78 HG12 VAL 78 28.554 20.716 2.194 546 HG13 VAL 78 HG13 VAL 78 27.375 19.407 2.242 547 HG21 VAL 78 HG21 VAL 78 24.581 21.365 0.828 548 HG22 VAL 78 HG22 VAL 78 24.882 21.242 2.560 549 HG23 VAL 78 HG23 VAL 78 25.041 19.816 1.537 550 H ALA 79 H ALA 79 27.587 23.834 -0.743 551 HA ALA 79 HA ALA 79 30.336 23.101 -0.742 552 HB1 ALA 79 HB1 ALA 79 30.492 24.452 -2.757 553 HB2 ALA 79 HB2 ALA 79 28.916 25.170 -2.415 554 HB3 ALA 79 HB3 ALA 79 29.040 23.450 -2.790 555 H THR 80 H THR 80 28.749 25.423 1.018 556 HA THR 80 HA THR 80 31.019 27.276 1.038 557 HB THR 80 HB THR 80 28.392 27.653 2.478 558 HG1 THR 80 HG1 THR 80 29.064 27.990 -0.245 559 HG21 THR 80 HG21 THR 80 30.406 29.627 1.380 560 HG22 THR 80 HG22 THR 80 30.239 29.178 3.076 561 HG23 THR 80 HG23 THR 80 28.930 30.029 2.258 562 H SER 81 H SER 81 30.294 24.495 2.480 563 HA SER 81 HA SER 81 31.040 25.315 5.187 564 HB2 SER 81 HB2 SER 81 29.994 22.679 4.143 565 HB3 SER 81 HB3 SER 81 30.371 23.022 5.833 566 HG SER 81 HG SER 81 28.857 24.966 5.204 567 HA PRO 82 HA PRO 82 35.259 24.042 4.190 568 HB2 PRO 82 HB2 PRO 82 35.564 24.411 7.113 569 HB3 PRO 82 HB3 PRO 82 36.480 25.134 5.788 570 HG2 PRO 82 HG2 PRO 82 34.731 26.577 7.195 571 HG3 PRO 82 HG3 PRO 82 34.919 26.807 5.446 572 HD2 PRO 82 HD2 PRO 82 32.780 25.349 6.945 573 HD3 PRO 82 HD3 PRO 82 32.643 26.409 5.524 574 HA PRO 83 HA PRO 83 35.257 19.710 4.765 575 HB2 PRO 83 HB2 PRO 83 37.994 20.155 5.900 576 HB3 PRO 83 HB3 PRO 83 37.447 18.956 4.720 577 HG2 PRO 83 HG2 PRO 83 38.719 21.162 3.929 578 HG3 PRO 83 HG3 PRO 83 37.372 20.495 2.989 579 HD2 PRO 83 HD2 PRO 83 37.475 22.934 4.664 580 HD3 PRO 83 HD3 PRO 83 36.429 22.551 3.284 581 H GLN 84 H GLN 84 36.789 21.405 7.501 582 HA GLN 84 HA GLN 84 36.509 19.474 9.461 583 HB2 GLN 84 HB2 GLN 84 37.757 21.586 9.737 584 HB3 GLN 84 HB3 GLN 84 36.237 22.465 9.801 585 HG2 GLN 84 HG2 GLN 84 35.629 21.166 11.822 586 HG3 GLN 84 HG3 GLN 84 37.226 20.424 11.779 587 HE21 GLN 84 HE22 GLN 84 36.571 23.784 10.982 588 HE22 GLN 84 HE21 GLN 84 37.403 24.454 12.337 589 H SER 85 H SER 85 34.211 22.045 8.615 590 HA SER 85 HA SER 85 32.257 21.002 10.499 591 HB2 SER 85 HB2 SER 85 31.974 23.351 8.616 592 HB3 SER 85 HB3 SER 85 31.045 23.029 10.082 593 HG SER 85 HG SER 85 33.024 23.290 11.261 594 H TYR 86 H TYR 86 32.996 20.920 7.144 595 HA TYR 86 HA TYR 86 30.563 20.533 5.904 596 HB2 TYR 86 HB2 TYR 86 32.624 20.756 4.648 597 HB3 TYR 86 HB3 TYR 86 33.239 19.252 5.318 598 HD1 TYR 86 HD2 TYR 86 32.445 17.107 4.502 599 HD2 TYR 86 HD1 TYR 86 30.966 20.749 2.882 600 HE1 TYR 86 HE2 TYR 86 31.504 15.869 2.597 601 HE2 TYR 86 HE1 TYR 86 30.025 19.523 0.969 602 HH TYR 86 HH TYR 86 30.217 17.482 -0.186 603 H SER 87 H SER 87 32.614 18.125 7.507 604 HA SER 87 HA SER 87 31.117 15.871 6.828 605 HB2 SER 87 HB2 SER 87 32.767 16.305 9.327 606 HB3 SER 87 HB3 SER 87 32.312 14.748 8.636 607 HG SER 87 HG SER 87 34.318 16.471 7.910 608 H ALA 88 H ALA 88 30.653 18.242 9.350 609 HA ALA 88 HA ALA 88 28.715 16.685 10.796 610 HB1 ALA 88 HB1 ALA 88 28.353 18.703 12.106 611 HB2 ALA 88 HB2 ALA 88 29.298 19.645 10.953 612 HB3 ALA 88 HB3 ALA 88 30.080 18.392 11.921 613 H VAL 89 H VAL 89 28.693 19.188 8.344 614 HA VAL 89 HA VAL 89 25.880 19.634 8.339 615 HB VAL 89 HB VAL 89 27.898 20.106 6.131 616 HG11 VAL 89 HG11 VAL 89 25.118 21.221 6.505 617 HG12 VAL 89 HG12 VAL 89 25.619 20.063 5.275 618 HG13 VAL 89 HG13 VAL 89 26.257 21.705 5.250 619 HG21 VAL 89 HG21 VAL 89 28.437 21.300 8.209 620 HG22 VAL 89 HG22 VAL 89 26.827 22.026 8.200 621 HG23 VAL 89 HG23 VAL 89 27.973 22.402 6.911 622 H LEU 90 H LEU 90 28.068 17.660 6.400 623 HA LEU 90 HA LEU 90 26.244 16.664 4.558 624 HB2 LEU 90 HB2 LEU 90 28.851 16.547 4.759 625 HB3 LEU 90 HB3 LEU 90 28.534 15.035 5.581 626 HG LEU 90 HG LEU 90 29.082 14.830 3.163 627 HD11 LEU 90 HD11 LEU 90 26.380 13.826 4.031 628 HD12 LEU 90 HD12 LEU 90 27.933 13.035 4.306 629 HD13 LEU 90 HD13 LEU 90 27.305 13.203 2.666 630 HD21 LEU 90 HD21 LEU 90 27.885 16.841 2.406 631 HD22 LEU 90 HD22 LEU 90 26.352 16.045 2.766 632 HD23 LEU 90 HD23 LEU 90 27.406 15.400 1.510 633 H ASN 91 H ASN 91 27.334 15.258 7.649 634 HA ASN 91 HA ASN 91 25.753 12.945 7.539 635 HB2 ASN 91 HB2 ASN 91 26.893 14.482 9.869 636 HB3 ASN 91 HB3 ASN 91 25.944 13.016 10.095 637 HD21 ASN 91 HD22 ASN 91 28.691 13.452 10.797 638 HD22 ASN 91 HD21 ASN 91 29.624 12.300 9.912 639 H THR 92 H THR 92 25.041 16.181 8.711 640 HA THR 92 HA THR 92 22.537 15.671 9.869 641 HB THR 92 HB THR 92 23.518 18.189 8.498 642 HG1 THR 92 HG1 THR 92 24.847 17.713 10.231 643 HG21 THR 92 HG21 THR 92 21.082 18.193 8.764 644 HG22 THR 92 HG22 THR 92 21.842 19.360 9.847 645 HG23 THR 92 HG23 THR 92 21.265 17.818 10.477 646 H ILE 93 H ILE 93 23.415 16.656 6.562 647 HA ILE 93 HA ILE 93 20.845 16.870 5.512 648 HB ILE 93 HB ILE 93 23.366 16.017 4.081 649 HG12 ILE 93 HG12 ILE 93 23.597 18.195 5.166 650 HG13 ILE 93 HG13 ILE 93 23.510 18.391 3.422 651 HG21 ILE 93 HG21 ILE 93 20.763 17.058 2.969 652 HG22 ILE 93 HG22 ILE 93 21.418 15.432 2.768 653 HG23 ILE 93 HG23 ILE 93 22.241 16.811 2.039 654 HD11 ILE 93 HD11 ILE 93 21.275 18.873 5.374 655 HD12 ILE 93 HD12 ILE 93 21.151 19.027 3.623 656 HD13 ILE 93 HD13 ILE 93 22.217 20.101 4.529 657 H GLY 94 H GLY 94 23.030 14.055 5.449 658 HA2 GLY 94 HA2 GLY 94 21.243 12.342 4.100 659 HA3 GLY 94 HA3 GLY 94 22.607 11.825 5.072 660 H ALA 95 H ALA 95 21.772 12.897 7.524 661 HA ALA 95 HA ALA 95 20.126 10.775 8.429 662 HB1 ALA 95 HB1 ALA 95 20.271 11.830 10.616 663 HB2 ALA 95 HB2 ALA 95 20.941 13.287 9.883 664 HB3 ALA 95 HB3 ALA 95 21.854 11.778 9.841 665 H CYS 96 H CYS 96 19.561 14.295 8.249 666 HA CYS 96 HA CYS 96 16.914 14.205 9.161 667 HB2 CYS 96 HB2 CYS 96 18.258 16.212 7.346 668 HB3 CYS 96 HB3 CYS 96 16.694 16.449 8.116 669 H LEU 97 H LEU 97 18.260 13.849 5.920 670 HA LEU 97 HA LEU 97 15.836 14.106 4.505 671 HB2 LEU 97 HB2 LEU 97 18.199 14.207 3.590 672 HB3 LEU 97 HB3 LEU 97 18.203 12.456 3.648 673 HG LEU 97 HG LEU 97 16.020 13.841 2.143 674 HD11 LEU 97 HD11 LEU 97 18.076 14.930 1.411 675 HD12 LEU 97 HD12 LEU 97 17.409 13.896 0.149 676 HD13 LEU 97 HD13 LEU 97 18.799 13.355 1.088 677 HD21 LEU 97 HD21 LEU 97 15.953 11.405 2.450 678 HD22 LEU 97 HD22 LEU 97 17.537 11.272 1.687 679 HD23 LEU 97 HD23 LEU 97 16.155 11.845 0.755 680 H ARG 98 H ARG 98 17.541 11.241 5.765 681 HA ARG 98 HA ARG 98 15.802 9.332 4.626 682 HB2 ARG 98 HB2 ARG 98 16.864 7.720 5.992 683 HB3 ARG 98 HB3 ARG 98 18.097 8.918 5.642 684 HG2 ARG 98 HG2 ARG 98 17.771 9.908 7.837 685 HG3 ARG 98 HG3 ARG 98 16.510 8.726 8.186 686 HD2 ARG 98 HD2 ARG 98 18.239 6.936 7.828 687 HD3 ARG 98 HD3 ARG 98 19.449 8.220 7.764 688 HE ARG 98 HE ARG 98 17.768 8.311 10.105 689 HH11 ARG 98 HH11 ARG 98 20.711 6.989 8.716 690 HH12 ARG 98 HH12 ARG 98 21.437 6.647 10.252 691 HH21 ARG 98 HH21 ARG 98 18.733 7.864 12.132 692 HH22 ARG 98 HH22 ARG 98 20.310 7.145 12.198 693 H GLU 99 H GLU 99 15.739 11.040 7.673 694 HA GLU 99 HA GLU 99 13.503 9.708 8.809 695 HB2 GLU 99 HB2 GLU 99 14.319 12.571 9.322 696 HB3 GLU 99 HB3 GLU 99 13.439 11.503 10.402 697 HG2 GLU 99 HG2 GLU 99 16.294 11.094 9.553 698 HG3 GLU 99 HG3 GLU 99 15.792 11.892 11.037 699 H SER 100 H SER 100 13.889 12.731 7.045 700 HA SER 100 HA SER 100 11.301 13.684 7.178 701 HB2 SER 100 HB2 SER 100 13.341 14.037 4.977 702 HB3 SER 100 HB3 SER 100 11.877 15.005 5.150 703 HG SER 100 HG SER 100 14.048 14.817 6.964 704 H MET 101 H MET 101 12.646 11.412 4.775 705 HA MET 101 HA MET 101 10.325 11.501 3.137 706 HB2 MET 101 HB2 MET 101 11.227 9.254 2.244 707 HB3 MET 101 HB3 MET 101 12.141 10.720 1.947 708 HG2 MET 101 HG2 MET 101 13.804 10.144 3.450 709 HG3 MET 101 HG3 MET 101 12.779 8.982 4.292 710 HE1 MET 101 HE1 MET 101 13.995 8.092 -0.050 711 HE2 MET 101 HE2 MET 101 14.025 9.716 0.634 712 HE3 MET 101 HE3 MET 101 12.491 8.865 0.450 713 H MET 102 H MET 102 11.268 9.368 5.812 714 HA MET 102 HA MET 102 8.966 7.696 5.434 715 HB2 MET 102 HB2 MET 102 9.648 6.490 7.333 716 HB3 MET 102 HB3 MET 102 11.128 6.963 6.518 717 HG2 MET 102 HG2 MET 102 11.423 8.781 8.134 718 HG3 MET 102 HG3 MET 102 9.949 8.275 8.957 719 HE1 MET 102 HE1 MET 102 11.071 4.545 9.899 720 HE2 MET 102 HE2 MET 102 10.517 5.018 8.291 721 HE3 MET 102 HE3 MET 102 9.686 5.625 9.725 722 H GLN 103 H GLN 103 9.639 10.603 7.247 723 HA GLN 103 HA GLN 103 7.272 10.490 8.841 724 HB2 GLN 103 HB2 GLN 103 9.374 12.484 8.308 725 HB3 GLN 103 HB3 GLN 103 7.793 13.155 8.675 726 HG2 GLN 103 HG2 GLN 103 9.139 12.945 10.679 727 HG3 GLN 103 HG3 GLN 103 7.713 11.915 10.756 728 HE21 GLN 103 HE22 GLN 103 11.147 12.040 10.663 729 HE22 GLN 103 HE21 GLN 103 11.427 10.357 10.954 730 H ALA 104 H ALA 104 7.969 11.353 5.601 731 HA ALA 104 HA ALA 104 5.530 12.803 5.148 732 HB1 ALA 104 HB1 ALA 104 7.485 13.252 3.771 733 HB2 ALA 104 HB2 ALA 104 6.158 12.655 2.772 734 HB3 ALA 104 HB3 ALA 104 7.490 11.582 3.204 735 H THR 105 H THR 105 6.753 9.666 3.972 736 HA THR 105 HA THR 105 4.699 7.998 4.539 737 HB THR 105 HB THR 105 3.185 9.622 3.374 738 HG1 THR 105 HG1 THR 105 2.326 7.846 1.895 739 HG21 THR 105 HG21 THR 105 3.192 9.697 0.928 740 HG22 THR 105 HG22 THR 105 4.641 8.694 0.899 741 HG23 THR 105 HG23 THR 105 4.707 10.317 1.585 742 H GLY 106 H GLY 106 7.210 8.989 2.449 743 HA2 GLY 106 HA2 GLY 106 7.115 6.780 0.633 744 HA3 GLY 106 HA3 GLY 106 8.386 7.985 0.755 745 H SER 107 H SER 107 7.942 6.767 3.802 746 HA SER 107 HA SER 107 9.170 5.446 5.156 747 HB2 SER 107 HB2 SER 107 9.417 3.753 2.661 748 HB3 SER 107 HB3 SER 107 9.823 3.220 4.290 749 HG SER 107 HG SER 107 7.548 2.910 3.207 750 H VAL 108 H VAL 108 11.547 3.992 4.711 751 HA VAL 108 HA VAL 108 13.324 6.130 3.764 752 HB VAL 108 HB VAL 108 14.128 3.820 5.535 753 HG11 VAL 108 HG11 VAL 108 16.092 5.214 5.999 754 HG12 VAL 108 HG12 VAL 108 15.480 6.442 4.889 755 HG13 VAL 108 HG13 VAL 108 15.945 4.853 4.279 756 HG21 VAL 108 HG21 VAL 108 14.042 5.345 7.424 757 HG22 VAL 108 HG22 VAL 108 12.451 5.201 6.678 758 HG23 VAL 108 HG23 VAL 108 13.438 6.632 6.381 759 H ASP 109 H ASP 109 13.617 5.701 1.662 760 HA ASP 109 HA ASP 109 14.124 2.985 0.769 761 HB2 ASP 109 HB2 ASP 109 12.754 4.447 -0.647 762 HB3 ASP 109 HB3 ASP 109 14.089 5.588 -0.780 763 H ASN 110 H ASN 110 16.086 2.130 0.504 764 HA ASN 110 HA ASN 110 18.334 3.684 1.440 765 HB2 ASN 110 HB2 ASN 110 17.863 0.783 0.895 766 HB3 ASN 110 HB3 ASN 110 19.513 1.379 1.021 767 HD21 ASN 110 HD22 ASN 110 16.545 0.764 2.727 768 HD22 ASN 110 HD21 ASN 110 17.190 0.985 4.318 769 H ALA 111 H ALA 111 17.004 3.324 -1.553 770 HA ALA 111 HA ALA 111 19.596 3.340 -2.932 771 HB1 ALA 111 HB1 ALA 111 16.811 3.307 -4.096 772 HB2 ALA 111 HB2 ALA 111 17.826 1.888 -3.841 773 HB3 ALA 111 HB3 ALA 111 18.321 3.133 -4.987 774 H PHE 112 H PHE 112 16.606 5.247 -2.694 775 HA PHE 112 HA PHE 112 17.494 7.460 -4.178 776 HB2 PHE 112 HB2 PHE 112 15.133 7.080 -3.630 777 HB3 PHE 112 HB3 PHE 112 15.471 7.380 -1.928 778 HD1 PHE 112 HD2 PHE 112 15.678 8.984 -5.270 779 HD2 PHE 112 HD1 PHE 112 15.260 9.525 -1.067 780 HE1 PHE 112 HE2 PHE 112 15.257 11.380 -5.624 781 HE2 PHE 112 HE1 PHE 112 14.841 11.923 -1.416 782 HZ PHE 112 HZ PHE 112 14.839 12.853 -3.695 783 H THR 113 H THR 113 17.525 6.912 -0.658 784 HA THR 113 HA THR 113 18.640 9.365 0.090 785 HB THR 113 HB THR 113 19.459 8.095 2.139 786 HG1 THR 113 HG1 THR 113 17.934 5.900 1.295 787 HG21 THR 113 HG21 THR 113 16.567 7.701 1.369 788 HG22 THR 113 HG22 THR 113 17.253 9.177 2.048 789 HG23 THR 113 HG23 THR 113 17.220 7.698 3.007 790 H ASN 114 H ASN 114 20.160 6.308 -0.749 791 HA ASN 114 HA ASN 114 22.835 7.096 -0.346 792 HB2 ASN 114 HB2 ASN 114 22.434 4.790 -0.367 793 HB3 ASN 114 HB3 ASN 114 21.486 4.871 -1.845 794 HD21 ASN 114 HD22 ASN 114 22.466 4.626 -3.758 795 HD22 ASN 114 HD21 ASN 114 24.153 4.326 -3.955 796 H GLU 115 H GLU 115 20.724 7.238 -3.174 797 HA GLU 115 HA GLU 115 22.663 7.883 -5.072 798 HB2 GLU 115 HB2 GLU 115 20.435 6.953 -5.537 799 HB3 GLU 115 HB3 GLU 115 19.696 8.440 -4.959 800 HG2 GLU 115 HG2 GLU 115 20.622 9.665 -6.743 801 HG3 GLU 115 HG3 GLU 115 21.576 8.282 -7.264 802 H VAL 116 H VAL 116 20.320 9.899 -3.298 803 HA VAL 116 HA VAL 116 21.188 12.380 -4.303 804 HB VAL 116 HB VAL 116 19.859 11.778 -1.652 805 HG11 VAL 116 HG11 VAL 116 19.144 14.117 -1.694 806 HG12 VAL 116 HG12 VAL 116 20.082 14.382 -3.163 807 HG13 VAL 116 HG13 VAL 116 20.902 13.986 -1.653 808 HG21 VAL 116 HG21 VAL 116 17.789 12.387 -2.809 809 HG22 VAL 116 HG22 VAL 116 18.564 10.990 -3.560 810 HG23 VAL 116 HG23 VAL 116 18.688 12.581 -4.313 811 H MET 117 H MET 117 22.198 10.537 -1.438 812 HA MET 117 HA MET 117 23.747 12.435 -0.170 813 HB2 MET 117 HB2 MET 117 23.060 10.255 0.751 814 HB3 MET 117 HB3 MET 117 24.163 9.453 -0.356 815 HG2 MET 117 HG2 MET 117 25.463 9.492 1.450 816 HG3 MET 117 HG3 MET 117 25.890 11.060 0.786 817 HE1 MET 117 HE1 MET 117 23.216 12.826 1.628 818 HE2 MET 117 HE2 MET 117 24.899 13.351 1.662 819 HE3 MET 117 HE3 MET 117 23.890 13.525 3.101 820 H GLN 118 H GLN 118 24.773 9.988 -2.553 821 HA GLN 118 HA GLN 118 27.467 10.698 -2.672 822 HB2 GLN 118 HB2 GLN 118 26.698 8.660 -3.692 823 HB3 GLN 118 HB3 GLN 118 25.652 9.547 -4.792 824 HG2 GLN 118 HG2 GLN 118 27.684 10.564 -5.803 825 HG3 GLN 118 HG3 GLN 118 28.661 9.506 -4.786 826 HE21 GLN 118 HE22 GLN 118 29.567 8.518 -6.580 827 HE22 GLN 118 HE21 GLN 118 28.689 7.390 -7.551 828 H LEU 119 H LEU 119 24.754 11.837 -4.648 829 HA LEU 119 HA LEU 119 26.253 13.506 -6.327 830 HB2 LEU 119 HB2 LEU 119 23.356 13.503 -5.534 831 HB3 LEU 119 HB3 LEU 119 24.009 14.633 -6.705 832 HG LEU 119 HG LEU 119 24.465 11.713 -7.130 833 HD11 LEU 119 HD11 LEU 119 22.094 11.806 -6.649 834 HD12 LEU 119 HD12 LEU 119 22.334 11.600 -8.385 835 HD13 LEU 119 HD13 LEU 119 21.895 13.179 -7.736 836 HD21 LEU 119 HD21 LEU 119 24.319 12.416 -9.482 837 HD22 LEU 119 HD22 LEU 119 25.565 13.290 -8.594 838 HD23 LEU 119 HD23 LEU 119 24.028 14.072 -8.954 839 H VAL 120 H VAL 120 24.503 14.229 -3.309 840 HA VAL 120 HA VAL 120 25.002 16.987 -3.280 841 HB VAL 120 HB VAL 120 24.650 15.098 -0.941 842 HG11 VAL 120 HG11 VAL 120 24.133 17.104 0.385 843 HG12 VAL 120 HG12 VAL 120 24.576 18.117 -0.989 844 HG13 VAL 120 HG13 VAL 120 25.797 17.115 -0.202 845 HG21 VAL 120 HG21 VAL 120 22.710 16.983 -2.281 846 HG22 VAL 120 HG22 VAL 120 22.366 15.945 -0.898 847 HG23 VAL 120 HG23 VAL 120 22.734 15.230 -2.466 848 H LYS 121 H LYS 121 26.879 14.302 -1.930 849 HA LYS 121 HA LYS 121 28.896 15.859 -0.728 850 HB2 LYS 121 HB2 LYS 121 28.957 13.027 -1.781 851 HB3 LYS 121 HB3 LYS 121 30.202 13.737 -0.761 852 HG2 LYS 121 HG2 LYS 121 28.770 13.883 1.080 853 HG3 LYS 121 HG3 LYS 121 27.330 13.648 0.086 854 HD2 LYS 121 HD2 LYS 121 27.747 11.634 1.312 855 HD3 LYS 121 HD3 LYS 121 28.108 11.334 -0.385 856 HE2 LYS 121 HE2 LYS 121 30.494 11.626 0.071 857 HE3 LYS 121 HE3 LYS 121 30.134 11.950 1.766 858 HZ1 LYS 121 HZ1 LYS 121 29.240 9.722 1.973 859 HZ2 LYS 121 HZ2 LYS 121 30.833 9.663 1.415 860 HZ3 LYS 121 HZ3 LYS 121 29.553 9.412 0.340 861 H MET 122 H MET 122 28.592 14.467 -3.933 862 HA MET 122 HA MET 122 31.254 15.096 -4.740 863 HB2 MET 122 HB2 MET 122 30.221 13.216 -5.749 864 HB3 MET 122 HB3 MET 122 28.796 14.143 -6.188 865 HG2 MET 122 HG2 MET 122 30.118 15.403 -7.809 866 HG3 MET 122 HG3 MET 122 31.542 14.456 -7.375 867 HE1 MET 122 HE1 MET 122 27.867 14.258 -8.725 868 HE2 MET 122 HE2 MET 122 27.885 12.925 -7.568 869 HE3 MET 122 HE3 MET 122 27.772 12.593 -9.293 870 H LEU 123 H LEU 123 28.125 16.648 -5.170 871 HA LEU 123 HA LEU 123 29.241 18.538 -7.068 872 HB2 LEU 123 HB2 LEU 123 26.464 18.318 -5.901 873 HB3 LEU 123 HB3 LEU 123 26.938 19.428 -7.174 874 HG LEU 123 HG LEU 123 27.061 16.420 -7.411 875 HD11 LEU 123 HD11 LEU 123 25.008 18.352 -8.482 876 HD12 LEU 123 HD12 LEU 123 24.754 17.177 -7.190 877 HD13 LEU 123 HD13 LEU 123 25.087 16.624 -8.831 878 HD21 LEU 123 HD21 LEU 123 27.335 16.885 -9.802 879 HD22 LEU 123 HD22 LEU 123 28.648 17.572 -8.847 880 HD23 LEU 123 HD23 LEU 123 27.363 18.614 -9.459 881 H SER 124 H SER 124 29.561 18.330 -3.883 882 HA SER 124 HA SER 124 29.161 21.217 -3.442 883 HB2 SER 124 HB2 SER 124 29.260 20.629 -0.990 884 HB3 SER 124 HB3 SER 124 27.867 19.976 -1.849 885 HG SER 124 HG SER 124 28.584 18.010 -1.562 886 H ALA 125 H ALA 125 31.307 18.591 -2.388 887 HA ALA 125 HA ALA 125 33.340 20.509 -1.698 888 HB1 ALA 125 HB1 ALA 125 34.584 18.628 -0.837 889 HB2 ALA 125 HB2 ALA 125 33.415 17.510 -1.536 890 HB3 ALA 125 HB3 ALA 125 32.925 18.601 -0.241 891 H ASP 126 H ASP 126 33.961 21.371 -3.549 892 HA ASP 126 HA ASP 126 35.855 19.771 -5.086 893 HB2 ASP 126 HB2 ASP 126 33.768 20.072 -6.437 894 HB3 ASP 126 HB3 ASP 126 34.016 21.814 -6.351 895 H SER 127 H SER 127 37.489 20.629 -3.947 896 HA SER 127 HA SER 127 39.187 22.041 -3.445 897 HB2 SER 127 HB2 SER 127 38.794 22.770 -5.871 898 HB3 SER 127 HB3 SER 127 37.914 24.139 -5.190 899 HG SER 127 HG SER 127 39.734 24.954 -4.392 900 H ALA 128 H ALA 128 36.176 22.300 -2.458 901 HA ALA 128 HA ALA 128 36.103 24.924 -1.344 902 HB1 ALA 128 HB1 ALA 128 34.083 24.179 -0.202 903 HB2 ALA 128 HB2 ALA 128 34.426 22.511 -0.656 904 HB3 ALA 128 HB3 ALA 128 34.048 23.704 -1.899 905 H ASN 129 H ASN 129 37.891 25.238 -0.083 906 HA ASN 129 HA ASN 129 38.095 23.554 2.331 907 HB2 ASN 129 HB2 ASN 129 40.492 23.813 2.296 908 HB3 ASN 129 HB3 ASN 129 39.982 23.211 0.723 909 HD21 ASN 129 HD22 ASN 129 40.085 24.580 -1.072 910 HD22 ASN 129 HD21 ASN 129 41.024 26.035 -1.054 911 H GLU 130 H GLU 130 37.559 26.618 1.097 912 HA GLU 130 HA GLU 130 39.013 28.106 3.066 913 HB2 GLU 130 HB2 GLU 130 38.504 28.824 0.658 914 HB3 GLU 130 HB3 GLU 130 36.900 29.240 1.253 915 HG2 GLU 130 HG2 GLU 130 38.473 31.148 1.182 916 HG3 GLU 130 HG3 GLU 130 37.811 30.830 2.788 917 H VAL 131 H VAL 131 38.133 29.525 4.607 918 HA VAL 131 HA VAL 131 35.852 28.395 5.990 919 HB VAL 131 HB VAL 131 37.381 30.831 6.876 920 HG11 VAL 131 HG11 VAL 131 35.404 30.233 8.166 921 HG12 VAL 131 HG12 VAL 131 36.867 29.984 9.116 922 HG13 VAL 131 HG13 VAL 131 36.034 28.603 8.402 923 HG21 VAL 131 HG21 VAL 131 38.976 29.356 8.021 924 HG22 VAL 131 HG22 VAL 131 39.064 29.185 6.268 925 HG23 VAL 131 HG23 VAL 131 38.240 27.962 7.234 926 H SER 132 H SER 132 35.354 29.726 3.470 927 HA SER 132 HA SER 132 33.830 31.085 2.497 928 HB2 SER 132 HB2 SER 132 32.318 30.098 4.205 929 HB3 SER 132 HB3 SER 132 32.725 31.415 5.301 930 HG SER 132 HG SER 132 31.927 32.835 3.587 931 H THR 133 H THR 133 36.355 32.157 3.704 932 HA THR 133 HA THR 133 35.687 34.870 4.458 933 HB THR 133 HB THR 133 38.174 35.158 4.587 934 HG1 THR 133 HG1 THR 133 38.565 33.424 3.001 935 HG21 THR 133 HG21 THR 133 37.035 32.806 6.100 936 HG22 THR 133 HG22 THR 133 36.911 34.500 6.569 937 HG23 THR 133 HG23 THR 133 38.484 33.704 6.546 Start of MODEL 19 1 HA2 GLY 1 HA2 GLY 1 8.445 -2.008 0.981 2 HA3 GLY 1 HA3 GLY 1 8.400 -0.270 0.725 3 H SER 2 H SER 2 9.651 0.530 -0.821 4 HA SER 2 HA SER 2 11.236 0.749 -2.419 5 HB2 SER 2 HB2 SER 2 12.808 -1.104 -0.612 6 HB3 SER 2 HB3 SER 2 13.483 -0.244 -1.997 7 HG SER 2 HG SER 2 13.060 1.706 -0.983 8 H GLY 3 H GLY 3 9.241 -1.488 -2.449 9 HA2 GLY 3 HA2 GLY 3 10.621 -3.332 -4.282 10 HA3 GLY 3 HA3 GLY 3 9.073 -3.638 -3.504 11 H ASN 4 H ASN 4 7.843 -1.178 -4.025 12 HA ASN 4 HA ASN 4 7.112 -1.533 -6.786 13 HB2 ASN 4 HB2 ASN 4 6.156 0.319 -4.610 14 HB3 ASN 4 HB3 ASN 4 5.608 0.489 -6.274 15 HD21 ASN 4 HD22 ASN 4 4.068 -0.136 -3.920 16 HD22 ASN 4 HD21 ASN 4 3.317 -1.663 -4.222 17 H SER 5 H SER 5 6.982 0.324 -8.276 18 HA SER 5 HA SER 5 9.555 1.647 -8.339 19 HB2 SER 5 HB2 SER 5 7.310 1.780 -10.362 20 HB3 SER 5 HB3 SER 5 8.999 2.210 -10.625 21 HG SER 5 HG SER 5 9.471 -0.045 -10.105 22 H GLN 6 H GLN 6 6.689 2.359 -6.960 23 HA GLN 6 HA GLN 6 6.905 5.235 -7.453 24 HB2 GLN 6 HB2 GLN 6 4.727 3.836 -7.873 25 HB3 GLN 6 HB3 GLN 6 4.548 3.953 -6.128 26 HG2 GLN 6 HG2 GLN 6 3.284 5.692 -7.147 27 HG3 GLN 6 HG3 GLN 6 4.668 6.409 -6.324 28 HE21 GLN 6 HE22 GLN 6 4.879 4.742 -9.392 29 HE22 GLN 6 HE21 GLN 6 5.250 6.134 -10.342 30 HA PRO 7 HA PRO 7 8.383 4.685 -3.212 31 HB2 PRO 7 HB2 PRO 7 10.496 6.397 -3.426 32 HB3 PRO 7 HB3 PRO 7 10.526 4.713 -3.955 33 HG2 PRO 7 HG2 PRO 7 10.580 7.128 -5.566 34 HG3 PRO 7 HG3 PRO 7 10.836 5.453 -6.068 35 HD2 PRO 7 HD2 PRO 7 8.434 7.106 -6.303 36 HD3 PRO 7 HD3 PRO 7 8.813 5.556 -7.082 37 H ILE 8 H ILE 8 9.065 8.039 -4.267 38 HA ILE 8 HA ILE 8 7.481 8.956 -1.970 39 HB ILE 8 HB ILE 8 9.792 8.870 -1.244 40 HG12 ILE 8 HG12 ILE 8 10.118 11.270 -0.631 41 HG13 ILE 8 HG13 ILE 8 8.803 11.683 -1.725 42 HG21 ILE 8 HG21 ILE 8 10.933 9.008 -3.356 43 HG22 ILE 8 HG22 ILE 8 11.518 10.286 -2.289 44 HG23 ILE 8 HG23 ILE 8 10.382 10.668 -3.585 45 HD11 ILE 8 HD11 ILE 8 7.277 10.318 -0.378 46 HD12 ILE 8 HD12 ILE 8 8.023 11.613 0.558 47 HD13 ILE 8 HD13 ILE 8 8.600 9.955 0.728 48 H TRP 9 H TRP 9 8.761 9.684 -5.164 49 HA TRP 9 HA TRP 9 7.634 12.344 -5.192 50 HB2 TRP 9 HB2 TRP 9 8.854 10.714 -7.435 51 HB3 TRP 9 HB3 TRP 9 8.382 12.402 -7.552 52 HD1 TRP 9 HD1 TRP 9 11.190 10.170 -6.354 53 HE1 TRP 9 HE1 TRP 9 13.147 11.626 -5.529 54 HE3 TRP 9 HE3 TRP 9 8.883 14.740 -6.381 55 HZ2 TRP 9 HZ2 TRP 9 13.650 14.340 -4.972 56 HZ3 TRP 9 HZ3 TRP 9 10.178 16.715 -5.687 57 HH2 TRP 9 HH2 TRP 9 12.512 16.521 -4.992 58 H THR 10 H THR 10 5.931 9.999 -4.741 59 HA THR 10 HA THR 10 4.377 9.309 -6.963 60 HB THR 10 HB THR 10 3.450 9.443 -4.090 61 HG1 THR 10 HG1 THR 10 4.330 7.297 -3.963 62 HG21 THR 10 HG21 THR 10 1.691 8.935 -5.709 63 HG22 THR 10 HG22 THR 10 2.062 7.519 -4.727 64 HG23 THR 10 HG23 THR 10 2.671 7.632 -6.379 65 H ASN 11 H ASN 11 3.854 11.770 -4.443 66 HA ASN 11 HA ASN 11 2.182 13.268 -6.281 67 HB2 ASN 11 HB2 ASN 11 0.486 13.644 -4.494 68 HB3 ASN 11 HB3 ASN 11 0.538 11.987 -5.069 69 HD21 ASN 11 HD22 ASN 11 -0.302 13.357 -2.520 70 HD22 ASN 11 HD21 ASN 11 0.476 12.439 -1.278 71 HA PRO 12 HA PRO 12 4.204 16.938 -5.033 72 HB2 PRO 12 HB2 PRO 12 1.460 17.897 -4.337 73 HB3 PRO 12 HB3 PRO 12 2.721 18.697 -5.281 74 HG2 PRO 12 HG2 PRO 12 0.648 17.495 -6.471 75 HG3 PRO 12 HG3 PRO 12 2.272 17.460 -7.180 76 HD2 PRO 12 HD2 PRO 12 0.746 15.291 -5.862 77 HD3 PRO 12 HD3 PRO 12 2.040 15.194 -7.068 78 H ASN 13 H ASN 13 1.485 16.191 -2.837 79 HA ASN 13 HA ASN 13 2.427 17.632 -0.644 80 HB2 ASN 13 HB2 ASN 13 0.122 16.644 -0.931 81 HB3 ASN 13 HB3 ASN 13 0.807 15.080 -0.505 82 HD21 ASN 13 HD22 ASN 13 -1.257 16.674 0.824 83 HD22 ASN 13 HD21 ASN 13 -0.697 16.922 2.442 84 H ALA 14 H ALA 14 3.028 14.298 -1.615 85 HA ALA 14 HA ALA 14 4.280 13.468 0.789 86 HB1 ALA 14 HB1 ALA 14 4.523 12.344 -1.999 87 HB2 ALA 14 HB2 ALA 14 3.308 11.894 -0.801 88 HB3 ALA 14 HB3 ALA 14 5.012 11.528 -0.513 89 H ALA 15 H ALA 15 5.546 14.575 -2.312 90 HA ALA 15 HA ALA 15 8.276 14.232 -1.621 91 HB1 ALA 15 HB1 ALA 15 8.760 15.380 -3.680 92 HB2 ALA 15 HB2 ALA 15 7.106 15.986 -3.774 93 HB3 ALA 15 HB3 ALA 15 7.424 14.260 -3.941 94 H MET 16 H MET 16 6.118 17.045 -1.653 95 HA MET 16 HA MET 16 8.111 18.933 -1.020 96 HB2 MET 16 HB2 MET 16 5.291 18.906 -1.473 97 HB3 MET 16 HB3 MET 16 5.620 19.829 -0.009 98 HG2 MET 16 HG2 MET 16 6.928 20.302 -2.673 99 HG3 MET 16 HG3 MET 16 5.527 21.176 -2.074 100 HE1 MET 16 HE1 MET 16 9.191 21.364 -2.595 101 HE2 MET 16 HE2 MET 16 9.320 20.285 -1.210 102 HE3 MET 16 HE3 MET 16 9.902 21.942 -1.091 103 H THR 17 H THR 17 6.147 16.811 0.928 104 HA THR 17 HA THR 17 6.477 18.031 3.421 105 HB THR 17 HB THR 17 6.153 15.108 2.716 106 HG1 THR 17 HG1 THR 17 4.342 16.342 2.199 107 HG21 THR 17 HG21 THR 17 7.179 15.289 4.931 108 HG22 THR 17 HG22 THR 17 5.496 14.784 5.074 109 HG23 THR 17 HG23 THR 17 5.948 16.451 5.423 110 H MET 18 H MET 18 8.479 15.504 1.861 111 HA MET 18 HA MET 18 10.291 15.306 4.021 112 HB2 MET 18 HB2 MET 18 11.695 13.992 2.570 113 HB3 MET 18 HB3 MET 18 10.019 13.550 2.277 114 HG2 MET 18 HG2 MET 18 9.980 14.856 0.259 115 HG3 MET 18 HG3 MET 18 11.604 15.453 0.578 116 HE1 MET 18 HE1 MET 18 10.691 14.135 -2.195 117 HE2 MET 18 HE2 MET 18 12.163 13.218 -2.532 118 HE3 MET 18 HE3 MET 18 12.268 14.834 -1.829 119 H THR 19 H THR 19 10.235 17.311 1.122 120 HA THR 19 HA THR 19 12.858 18.310 1.273 121 HB THR 19 HB THR 19 10.539 19.963 0.307 122 HG1 THR 19 HG1 THR 19 11.678 17.644 -0.883 123 HG21 THR 19 HG21 THR 19 12.105 20.718 -1.363 124 HG22 THR 19 HG22 THR 19 13.303 19.536 -0.832 125 HG23 THR 19 HG23 THR 19 12.856 20.879 0.227 126 H ASN 20 H ASN 20 9.812 19.508 2.668 127 HA ASN 20 HA ASN 20 10.912 21.865 3.798 128 HB2 ASN 20 HB2 ASN 20 8.357 20.346 4.194 129 HB3 ASN 20 HB3 ASN 20 8.783 21.638 5.308 130 HD21 ASN 20 HD22 ASN 20 7.903 20.842 2.045 131 HD22 ASN 20 HD21 ASN 20 7.543 22.458 1.541 132 H ASN 21 H ASN 21 10.189 18.661 5.140 133 HA ASN 21 HA ASN 21 10.956 19.250 7.768 134 HB2 ASN 21 HB2 ASN 21 10.823 16.646 6.256 135 HB3 ASN 21 HB3 ASN 21 11.214 16.740 7.966 136 HD21 ASN 21 HD22 ASN 21 9.425 15.634 8.632 137 HD22 ASN 21 HD21 ASN 21 7.824 16.276 8.525 138 H LEU 22 H LEU 22 12.812 18.326 4.959 139 HA LEU 22 HA LEU 22 15.237 17.676 6.231 140 HB2 LEU 22 HB2 LEU 22 14.866 17.186 3.886 141 HB3 LEU 22 HB3 LEU 22 14.688 18.890 3.517 142 HG LEU 22 HG LEU 22 17.076 19.230 4.156 143 HD11 LEU 22 HD11 LEU 22 17.368 17.332 5.630 144 HD12 LEU 22 HD12 LEU 22 18.529 17.262 4.305 145 HD13 LEU 22 HD13 LEU 22 17.107 16.219 4.287 146 HD21 LEU 22 HD21 LEU 22 16.444 18.985 1.829 147 HD22 LEU 22 HD22 LEU 22 16.538 17.231 1.964 148 HD23 LEU 22 HD23 LEU 22 17.996 18.206 2.126 149 H VAL 23 H VAL 23 13.928 20.732 5.041 150 HA VAL 23 HA VAL 23 16.155 22.340 5.664 151 HB VAL 23 HB VAL 23 13.249 23.166 5.525 152 HG11 VAL 23 HG11 VAL 23 14.118 25.392 5.014 153 HG12 VAL 23 HG12 VAL 23 15.765 24.802 5.225 154 HG13 VAL 23 HG13 VAL 23 14.660 24.839 6.597 155 HG21 VAL 23 HG21 VAL 23 13.942 22.036 3.484 156 HG22 VAL 23 HG22 VAL 23 15.346 23.092 3.358 157 HG23 VAL 23 HG23 VAL 23 13.724 23.760 3.194 158 H GLN 24 H GLN 24 13.183 21.606 7.486 159 HA GLN 24 HA GLN 24 13.797 23.359 9.629 160 HB2 GLN 24 HB2 GLN 24 11.936 22.365 10.800 161 HB3 GLN 24 HB3 GLN 24 11.499 22.576 9.115 162 HG2 GLN 24 HG2 GLN 24 10.652 20.506 9.543 163 HG3 GLN 24 HG3 GLN 24 12.240 20.100 8.894 164 HE21 GLN 24 HE22 GLN 24 12.310 18.123 9.916 165 HE22 GLN 24 HE21 GLN 24 12.514 17.959 11.626 166 H CYS 25 H CYS 25 14.561 20.007 8.983 167 HA CYS 25 HA CYS 25 15.516 19.413 11.598 168 HB2 CYS 25 HB2 CYS 25 14.839 17.638 10.039 169 HB3 CYS 25 HB3 CYS 25 16.153 18.083 8.955 170 H ALA 26 H ALA 26 17.102 20.376 8.557 171 HA ALA 26 HA ALA 26 19.725 20.369 9.630 172 HB1 ALA 26 HB1 ALA 26 19.164 20.282 7.205 173 HB2 ALA 26 HB2 ALA 26 20.391 21.478 7.619 174 HB3 ALA 26 HB3 ALA 26 18.733 21.990 7.293 175 H SER 27 H SER 27 17.116 22.618 9.798 176 HA SER 27 HA SER 27 18.622 24.930 10.484 177 HB2 SER 27 HB2 SER 27 16.245 24.963 9.693 178 HB3 SER 27 HB3 SER 27 15.767 24.253 11.237 179 HG SER 27 HG SER 27 17.282 26.630 11.168 180 H ARG 28 H ARG 28 17.425 22.171 12.252 181 HA ARG 28 HA ARG 28 18.006 23.467 14.813 182 HB2 ARG 28 HB2 ARG 28 16.667 20.819 14.247 183 HB3 ARG 28 HB3 ARG 28 16.812 21.584 15.822 184 HG2 ARG 28 HG2 ARG 28 15.245 22.629 13.475 185 HG3 ARG 28 HG3 ARG 28 14.583 21.859 14.916 186 HD2 ARG 28 HD2 ARG 28 15.551 23.694 16.279 187 HD3 ARG 28 HD3 ARG 28 16.068 24.477 14.785 188 HE ARG 28 HE ARG 28 13.254 23.849 14.901 189 HH11 ARG 28 HH11 ARG 28 15.701 26.243 15.621 190 HH12 ARG 28 HH12 ARG 28 14.588 27.573 15.572 191 HH21 ARG 28 HH21 ARG 28 11.794 25.582 14.827 192 HH22 ARG 28 HH22 ARG 28 12.356 27.196 15.128 193 H SER 29 H SER 29 19.853 22.150 12.687 194 HA SER 29 HA SER 29 20.997 19.879 13.933 195 HB2 SER 29 HB2 SER 29 22.827 20.179 12.296 196 HB3 SER 29 HB3 SER 29 21.242 20.285 11.531 197 HG SER 29 HG SER 29 21.605 22.308 11.038 198 H GLY 30 H GLY 30 21.779 23.313 13.921 199 HA2 GLY 30 HA2 GLY 30 23.051 24.519 15.457 200 HA3 GLY 30 HA3 GLY 30 23.482 23.007 16.250 201 H VAL 31 H VAL 31 23.848 22.624 13.014 202 HA VAL 31 HA VAL 31 26.755 22.983 13.206 203 HB VAL 31 HB VAL 31 25.148 21.282 11.285 204 HG11 VAL 31 HG11 VAL 31 28.125 21.374 11.766 205 HG12 VAL 31 HG12 VAL 31 27.294 22.039 10.361 206 HG13 VAL 31 HG13 VAL 31 27.281 20.301 10.651 207 HG21 VAL 31 HG21 VAL 31 25.013 20.451 13.578 208 HG22 VAL 31 HG22 VAL 31 26.770 20.471 13.696 209 HG23 VAL 31 HG23 VAL 31 25.975 19.374 12.568 210 H LEU 32 H LEU 32 23.941 23.658 11.192 211 HA LEU 32 HA LEU 32 25.539 24.960 9.168 212 HB2 LEU 32 HB2 LEU 32 22.536 24.880 9.458 213 HB3 LEU 32 HB3 LEU 32 23.426 25.412 8.046 214 HG LEU 32 HG LEU 32 23.278 22.613 9.126 215 HD11 LEU 32 HD11 LEU 32 22.265 23.851 6.576 216 HD12 LEU 32 HD12 LEU 32 21.284 23.317 7.941 217 HD13 LEU 32 HD13 LEU 32 22.186 22.138 6.985 218 HD21 LEU 32 HD21 LEU 32 24.840 23.687 6.791 219 HD22 LEU 32 HD22 LEU 32 24.566 21.979 7.129 220 HD23 LEU 32 HD23 LEU 32 25.496 22.963 8.260 221 H THR 33 H THR 33 24.859 27.127 8.405 222 HA THR 33 HA THR 33 24.699 28.959 10.678 223 HB THR 33 HB THR 33 25.540 30.660 9.262 224 HG1 THR 33 HG1 THR 33 25.659 30.355 6.961 225 HG21 THR 33 HG21 THR 33 27.539 29.703 8.250 226 HG22 THR 33 HG22 THR 33 26.820 28.096 8.329 227 HG23 THR 33 HG23 THR 33 27.219 28.958 9.816 228 H ALA 34 H ALA 34 23.339 30.974 10.300 229 HA ALA 34 HA ALA 34 20.654 30.232 9.843 230 HB1 ALA 34 HB1 ALA 34 21.328 32.073 11.343 231 HB2 ALA 34 HB2 ALA 34 20.118 32.574 10.161 232 HB3 ALA 34 HB3 ALA 34 21.810 33.020 9.937 233 H ASP 35 H ASP 35 23.144 31.599 7.829 234 HA ASP 35 HA ASP 35 21.385 32.391 5.705 235 HB2 ASP 35 HB2 ASP 35 24.373 32.056 5.886 236 HB3 ASP 35 HB3 ASP 35 23.569 32.472 4.376 237 H GLN 36 H GLN 36 23.443 29.603 6.386 238 HA GLN 36 HA GLN 36 22.965 28.206 3.999 239 HB2 GLN 36 HB2 GLN 36 23.706 27.325 6.782 240 HB3 GLN 36 HB3 GLN 36 23.447 26.155 5.491 241 HG2 GLN 36 HG2 GLN 36 25.222 27.166 4.186 242 HG3 GLN 36 HG3 GLN 36 25.443 28.407 5.420 243 HE21 GLN 36 HE22 GLN 36 27.303 26.373 4.368 244 HE22 GLN 36 HE21 GLN 36 27.838 25.476 5.744 245 H MET 37 H MET 37 21.159 28.357 7.030 246 HA MET 37 HA MET 37 19.186 26.442 6.333 247 HB2 MET 37 HB2 MET 37 18.957 28.827 8.187 248 HB3 MET 37 HB3 MET 37 17.837 27.474 8.121 249 HG2 MET 37 HG2 MET 37 19.583 25.977 8.870 250 HG3 MET 37 HG3 MET 37 20.736 27.314 8.883 251 HE1 MET 37 HE1 MET 37 20.912 26.011 11.468 252 HE2 MET 37 HE2 MET 37 20.608 27.328 12.601 253 HE3 MET 37 HE3 MET 37 21.522 27.626 11.122 254 H ASP 38 H ASP 38 19.511 29.897 5.822 255 HA ASP 38 HA ASP 38 16.950 30.425 4.777 256 HB2 ASP 38 HB2 ASP 38 18.642 32.126 5.530 257 HB3 ASP 38 HB3 ASP 38 19.547 31.802 4.058 258 H ASP 39 H ASP 39 20.026 29.611 3.191 259 HA ASP 39 HA ASP 39 19.090 29.623 0.549 260 HB2 ASP 39 HB2 ASP 39 21.305 27.971 1.774 261 HB3 ASP 39 HB3 ASP 39 21.039 28.166 0.047 262 H MET 40 H MET 40 19.151 27.073 2.982 263 HA MET 40 HA MET 40 18.148 24.958 1.448 264 HB2 MET 40 HB2 MET 40 17.822 25.620 4.377 265 HB3 MET 40 HB3 MET 40 17.223 24.129 3.666 266 HG2 MET 40 HG2 MET 40 20.093 24.958 3.454 267 HG3 MET 40 HG3 MET 40 19.473 24.057 4.836 268 HE1 MET 40 HE1 MET 40 18.391 20.675 3.293 269 HE2 MET 40 HE2 MET 40 17.379 22.073 3.658 270 HE3 MET 40 HE3 MET 40 18.657 21.593 4.775 271 H GLY 41 H GLY 41 16.537 27.652 3.015 272 HA2 GLY 41 HA2 GLY 41 13.885 26.667 2.683 273 HA3 GLY 41 HA3 GLY 41 14.340 28.324 3.053 274 H MET 42 H MET 42 15.942 28.809 0.746 275 HA MET 42 HA MET 42 13.805 29.508 -1.023 276 HB2 MET 42 HB2 MET 42 15.400 30.753 -2.276 277 HB3 MET 42 HB3 MET 42 15.784 30.977 -0.577 278 HG2 MET 42 HG2 MET 42 17.585 29.380 -0.747 279 HG3 MET 42 HG3 MET 42 17.180 29.062 -2.429 280 HE1 MET 42 HE1 MET 42 18.686 31.607 0.129 281 HE2 MET 42 HE2 MET 42 17.269 32.471 -0.463 282 HE3 MET 42 HE3 MET 42 18.886 33.052 -0.862 283 H MET 43 H MET 43 16.229 26.967 -0.992 284 HA MET 43 HA MET 43 15.993 26.439 -3.794 285 HB2 MET 43 HB2 MET 43 17.365 24.496 -3.372 286 HB3 MET 43 HB3 MET 43 18.046 25.890 -2.561 287 HG2 MET 43 HG2 MET 43 18.282 24.228 -0.993 288 HG3 MET 43 HG3 MET 43 16.778 25.000 -0.498 289 HE1 MET 43 HE1 MET 43 15.981 23.124 0.939 290 HE2 MET 43 HE2 MET 43 17.440 22.171 0.662 291 HE3 MET 43 HE3 MET 43 15.852 21.426 0.469 292 H ALA 44 H ALA 44 14.354 25.467 -0.929 293 HA ALA 44 HA ALA 44 13.045 23.164 -1.837 294 HB1 ALA 44 HB1 ALA 44 12.005 25.258 0.071 295 HB2 ALA 44 HB2 ALA 44 13.030 23.889 0.506 296 HB3 ALA 44 HB3 ALA 44 11.397 23.612 -0.098 297 H ASP 45 H ASP 45 12.468 26.554 -2.423 298 HA ASP 45 HA ASP 45 9.877 26.296 -3.573 299 HB2 ASP 45 HB2 ASP 45 10.787 28.434 -2.682 300 HB3 ASP 45 HB3 ASP 45 11.940 28.470 -4.010 301 H SER 46 H SER 46 13.115 25.892 -4.753 302 HA SER 46 HA SER 46 12.371 25.847 -7.528 303 HB2 SER 46 HB2 SER 46 14.671 26.428 -6.789 304 HB3 SER 46 HB3 SER 46 14.872 24.786 -6.180 305 HG SER 46 HG SER 46 15.742 24.780 -8.191 306 H VAL 47 H VAL 47 12.753 23.555 -4.909 307 HA VAL 47 HA VAL 47 12.644 21.176 -6.414 308 HB VAL 47 HB VAL 47 11.683 21.594 -3.572 309 HG11 VAL 47 HG11 VAL 47 10.871 19.504 -4.469 310 HG12 VAL 47 HG12 VAL 47 12.176 19.177 -3.330 311 HG13 VAL 47 HG13 VAL 47 12.477 19.093 -5.065 312 HG21 VAL 47 HG21 VAL 47 14.402 20.759 -4.591 313 HG22 VAL 47 HG22 VAL 47 13.913 20.856 -2.899 314 HG23 VAL 47 HG23 VAL 47 14.002 22.321 -3.877 315 H ASN 48 H ASN 48 10.043 22.836 -4.599 316 HA ASN 48 HA ASN 48 8.063 21.032 -5.505 317 HB2 ASN 48 HB2 ASN 48 6.455 22.782 -4.618 318 HB3 ASN 48 HB3 ASN 48 7.581 22.089 -3.469 319 HD21 ASN 48 HD22 ASN 48 7.577 23.741 -2.044 320 HD22 ASN 48 HD21 ASN 48 8.208 25.312 -2.396 321 H SER 49 H SER 49 9.308 24.007 -6.810 322 HA SER 49 HA SER 49 7.247 24.549 -8.635 323 HB2 SER 49 HB2 SER 49 9.097 26.125 -8.144 324 HB3 SER 49 HB3 SER 49 10.218 25.048 -8.976 325 HG SER 49 HG SER 49 7.914 26.107 -10.233 326 H GLN 50 H GLN 50 10.286 22.745 -9.101 327 HA GLN 50 HA GLN 50 9.610 21.895 -11.734 328 HB2 GLN 50 HB2 GLN 50 11.713 20.901 -9.801 329 HB3 GLN 50 HB3 GLN 50 11.601 20.416 -11.489 330 HG2 GLN 50 HG2 GLN 50 12.046 22.650 -12.223 331 HG3 GLN 50 HG3 GLN 50 11.963 23.258 -10.571 332 HE21 GLN 50 HE22 GLN 50 13.680 22.920 -9.186 333 HE22 GLN 50 HE21 GLN 50 15.232 22.393 -9.741 334 H MET 51 H MET 51 9.131 20.562 -8.548 335 HA MET 51 HA MET 51 8.541 17.914 -9.351 336 HB2 MET 51 HB2 MET 51 9.154 18.403 -7.062 337 HB3 MET 51 HB3 MET 51 7.763 19.458 -6.875 338 HG2 MET 51 HG2 MET 51 7.159 16.691 -7.663 339 HG3 MET 51 HG3 MET 51 7.842 16.900 -6.051 340 HE1 MET 51 HE1 MET 51 5.268 19.080 -4.203 341 HE2 MET 51 HE2 MET 51 6.643 19.747 -5.079 342 HE3 MET 51 HE3 MET 51 6.823 18.250 -4.169 343 H GLN 52 H GLN 52 6.587 20.830 -9.058 344 HA GLN 52 HA GLN 52 4.110 19.469 -9.541 345 HB2 GLN 52 HB2 GLN 52 4.869 22.388 -9.672 346 HB3 GLN 52 HB3 GLN 52 3.238 21.799 -9.961 347 HG2 GLN 52 HG2 GLN 52 3.122 20.907 -7.718 348 HG3 GLN 52 HG3 GLN 52 4.793 21.383 -7.418 349 HE21 GLN 52 HE22 GLN 52 5.284 23.555 -7.137 350 HE22 GLN 52 HE21 GLN 52 4.067 24.728 -6.766 351 H LYS 53 H LYS 53 6.674 20.678 -11.501 352 HA LYS 53 HA LYS 53 5.162 20.677 -13.958 353 HB2 LYS 53 HB2 LYS 53 8.170 20.621 -13.607 354 HB3 LYS 53 HB3 LYS 53 7.286 21.074 -15.055 355 HG2 LYS 53 HG2 LYS 53 7.305 22.578 -12.446 356 HG3 LYS 53 HG3 LYS 53 8.156 23.033 -13.922 357 HD2 LYS 53 HD2 LYS 53 6.076 23.375 -15.078 358 HD3 LYS 53 HD3 LYS 53 5.167 22.736 -13.708 359 HE2 LYS 53 HE2 LYS 53 5.952 24.606 -12.328 360 HE3 LYS 53 HE3 LYS 53 6.834 25.249 -13.713 361 HZ1 LYS 53 HZ1 LYS 53 4.637 26.301 -13.312 362 HZ2 LYS 53 HZ2 LYS 53 3.895 24.826 -13.674 363 HZ3 LYS 53 HZ3 LYS 53 4.793 25.634 -14.859 364 H MET 54 H MET 54 6.628 18.392 -11.955 365 HA MET 54 HA MET 54 7.288 16.392 -13.866 366 HB2 MET 54 HB2 MET 54 8.228 16.390 -11.606 367 HB3 MET 54 HB3 MET 54 6.621 16.186 -10.920 368 HG2 MET 54 HG2 MET 54 6.498 14.022 -12.220 369 HG3 MET 54 HG3 MET 54 8.221 14.216 -12.516 370 HE1 MET 54 HE1 MET 54 8.997 15.638 -9.630 371 HE2 MET 54 HE2 MET 54 9.997 14.469 -10.490 372 HE3 MET 54 HE3 MET 54 9.587 14.199 -8.796 373 H GLY 55 H GLY 55 4.576 16.712 -11.589 374 HA2 GLY 55 HA2 GLY 55 2.298 16.379 -12.178 375 HA3 GLY 55 HA3 GLY 55 2.825 15.430 -13.562 376 HA PRO 56 HA PRO 56 1.956 12.889 -9.483 377 HB2 PRO 56 HB2 PRO 56 -0.677 12.242 -9.976 378 HB3 PRO 56 HB3 PRO 56 -0.149 13.522 -8.878 379 HG2 PRO 56 HG2 PRO 56 -1.093 13.719 -11.706 380 HG3 PRO 56 HG3 PRO 56 -1.448 14.780 -10.331 381 HD2 PRO 56 HD2 PRO 56 0.346 15.465 -12.209 382 HD3 PRO 56 HD3 PRO 56 0.583 15.889 -10.500 383 H ASN 57 H ASN 57 2.214 10.725 -9.597 384 HA ASN 57 HA ASN 57 2.736 8.716 -10.518 385 HB2 ASN 57 HB2 ASN 57 0.268 9.361 -12.136 386 HB3 ASN 57 HB3 ASN 57 1.097 7.809 -12.218 387 HD21 ASN 57 HD22 ASN 57 -0.927 9.882 -10.338 388 HD22 ASN 57 HD21 ASN 57 -1.325 8.732 -9.110 389 HA PRO 58 HA PRO 58 4.722 10.666 -14.186 390 HB2 PRO 58 HB2 PRO 58 7.026 11.445 -13.160 391 HB3 PRO 58 HB3 PRO 58 5.538 12.308 -12.751 392 HG2 PRO 58 HG2 PRO 58 7.102 10.358 -11.127 393 HG3 PRO 58 HG3 PRO 58 6.216 11.798 -10.601 394 HD2 PRO 58 HD2 PRO 58 5.301 9.117 -10.551 395 HD3 PRO 58 HD3 PRO 58 4.341 10.577 -10.239 396 HA PRO 59 HA PRO 59 7.585 7.353 -15.263 397 HB2 PRO 59 HB2 PRO 59 9.282 9.133 -16.785 398 HB3 PRO 59 HB3 PRO 59 8.134 7.935 -17.378 399 HG2 PRO 59 HG2 PRO 59 7.796 10.633 -17.656 400 HG3 PRO 59 HG3 PRO 59 6.462 9.467 -17.614 401 HD2 PRO 59 HD2 PRO 59 7.482 11.262 -15.453 402 HD3 PRO 59 HD3 PRO 59 5.811 10.806 -15.853 403 H GLN 60 H GLN 60 9.699 6.582 -14.797 404 HA GLN 60 HA GLN 60 10.695 7.677 -12.393 405 HB2 GLN 60 HB2 GLN 60 12.358 5.893 -12.453 406 HB3 GLN 60 HB3 GLN 60 10.746 5.288 -12.800 407 HG2 GLN 60 HG2 GLN 60 11.272 5.207 -15.175 408 HG3 GLN 60 HG3 GLN 60 12.883 5.848 -14.845 409 HE21 GLN 60 HE22 GLN 60 13.925 4.048 -15.663 410 HE22 GLN 60 HE21 GLN 60 13.925 2.524 -14.847 411 H HIS 61 H HIS 61 11.563 8.281 -15.690 412 HA HIS 61 HA HIS 61 14.235 9.066 -15.229 413 HB2 HIS 61 HB2 HIS 61 14.200 10.163 -17.378 414 HB3 HIS 61 HB3 HIS 61 13.367 8.624 -17.502 415 HD1 HIS 61 HD1 HIS 61 11.279 8.730 -18.805 416 HD2 HIS 61 HD2 HIS 61 12.193 12.402 -17.080 417 HE1 HIS 61 HE1 HIS 61 9.531 10.330 -19.642 418 H ARG 62 H ARG 62 11.226 10.648 -14.589 419 HA ARG 62 HA ARG 62 12.343 13.260 -14.246 420 HB2 ARG 62 HB2 ARG 62 9.748 11.958 -13.552 421 HB3 ARG 62 HB3 ARG 62 10.171 13.465 -12.755 422 HG2 ARG 62 HG2 ARG 62 10.092 13.101 -15.742 423 HG3 ARG 62 HG3 ARG 62 8.762 13.746 -14.776 424 HD2 ARG 62 HD2 ARG 62 10.198 15.569 -14.003 425 HD3 ARG 62 HD3 ARG 62 11.535 14.921 -14.949 426 HE ARG 62 HE ARG 62 9.229 15.447 -16.553 427 HH11 ARG 62 HH11 ARG 62 12.001 16.944 -15.032 428 HH12 ARG 62 HH12 ARG 62 12.063 18.272 -16.142 429 HH21 ARG 62 HH21 ARG 62 9.313 17.194 -18.034 430 HH22 ARG 62 HH22 ARG 62 10.539 18.410 -17.854 431 H LEU 63 H LEU 63 11.647 10.531 -12.133 432 HA LEU 63 HA LEU 63 12.386 11.746 -9.703 433 HB2 LEU 63 HB2 LEU 63 12.309 8.879 -10.613 434 HB3 LEU 63 HB3 LEU 63 12.869 9.309 -9.012 435 HG LEU 63 HG LEU 63 10.650 10.347 -8.558 436 HD11 LEU 63 HD11 LEU 63 9.978 10.821 -10.854 437 HD12 LEU 63 HD12 LEU 63 8.776 9.836 -10.022 438 HD13 LEU 63 HD13 LEU 63 9.873 9.092 -11.185 439 HD21 LEU 63 HD21 LEU 63 11.135 8.096 -7.809 440 HD22 LEU 63 HD22 LEU 63 10.635 7.444 -9.369 441 HD23 LEU 63 HD23 LEU 63 9.451 8.219 -8.317 442 H ARG 64 H ARG 64 14.212 9.960 -12.132 443 HA ARG 64 HA ARG 64 16.669 10.009 -10.670 444 HB2 ARG 64 HB2 ARG 64 15.850 9.188 -13.418 445 HB3 ARG 64 HB3 ARG 64 17.557 9.456 -13.098 446 HG2 ARG 64 HG2 ARG 64 16.979 7.109 -12.859 447 HG3 ARG 64 HG3 ARG 64 17.500 7.787 -11.317 448 HD2 ARG 64 HD2 ARG 64 15.220 7.950 -10.566 449 HD3 ARG 64 HD3 ARG 64 14.622 7.457 -12.148 450 HE ARG 64 HE ARG 64 16.242 5.403 -11.302 451 HH11 ARG 64 HH11 ARG 64 13.400 7.022 -10.080 452 HH12 ARG 64 HH12 ARG 64 12.747 5.603 -9.327 453 HH21 ARG 64 HH21 ARG 64 15.401 3.522 -10.313 454 HH22 ARG 64 HH22 ARG 64 13.903 3.607 -9.441 455 H ALA 65 H ALA 65 15.027 12.459 -12.092 456 HA ALA 65 HA ALA 65 17.501 13.915 -12.738 457 HB1 ALA 65 HB1 ALA 65 15.854 13.782 -14.569 458 HB2 ALA 65 HB2 ALA 65 16.147 15.437 -14.045 459 HB3 ALA 65 HB3 ALA 65 14.675 14.603 -13.548 460 H MET 66 H MET 66 14.971 13.605 -10.489 461 HA MET 66 HA MET 66 15.045 16.394 -9.653 462 HB2 MET 66 HB2 MET 66 13.426 14.041 -8.688 463 HB3 MET 66 HB3 MET 66 13.384 15.615 -7.907 464 HG2 MET 66 HG2 MET 66 12.612 15.019 -10.754 465 HG3 MET 66 HG3 MET 66 11.516 15.346 -9.415 466 HE1 MET 66 HE1 MET 66 12.952 17.727 -7.870 467 HE2 MET 66 HE2 MET 66 11.230 17.683 -8.261 468 HE3 MET 66 HE3 MET 66 12.188 19.110 -8.656 469 H ASN 67 H ASN 67 16.215 13.281 -8.688 470 HA ASN 67 HA ASN 67 17.170 13.749 -6.150 471 HB2 ASN 67 HB2 ASN 67 19.098 12.209 -6.863 472 HB3 ASN 67 HB3 ASN 67 17.467 11.572 -7.017 473 HD21 ASN 67 HD22 ASN 67 17.962 10.093 -8.584 474 HD22 ASN 67 HD21 ASN 67 18.402 10.551 -10.200 475 H THR 68 H THR 68 18.650 14.611 -9.232 476 HA THR 68 HA THR 68 20.929 15.870 -8.057 477 HB THR 68 HB THR 68 19.886 16.182 -10.880 478 HG1 THR 68 HG1 THR 68 20.219 13.931 -10.148 479 HG21 THR 68 HG21 THR 68 22.255 16.564 -11.418 480 HG22 THR 68 HG22 THR 68 22.662 16.431 -9.709 481 HG23 THR 68 HG23 THR 68 21.652 17.759 -10.275 482 H ALA 69 H ALA 69 17.809 16.918 -9.285 483 HA ALA 69 HA ALA 69 18.255 19.659 -9.465 484 HB1 ALA 69 HB1 ALA 69 15.852 19.922 -9.343 485 HB2 ALA 69 HB2 ALA 69 15.682 18.299 -8.679 486 HB3 ALA 69 HB3 ALA 69 16.253 18.520 -10.332 487 H MET 70 H MET 70 17.370 17.680 -6.669 488 HA MET 70 HA MET 70 17.306 20.018 -4.947 489 HB2 MET 70 HB2 MET 70 15.765 18.053 -4.627 490 HB3 MET 70 HB3 MET 70 17.165 17.106 -4.146 491 HG2 MET 70 HG2 MET 70 17.532 18.476 -2.227 492 HG3 MET 70 HG3 MET 70 16.319 19.638 -2.759 493 HE1 MET 70 HE1 MET 70 16.982 16.069 -1.298 494 HE2 MET 70 HE2 MET 70 16.127 15.673 -2.790 495 HE3 MET 70 HE3 MET 70 15.358 15.383 -1.230 496 H ALA 71 H ALA 71 19.316 17.149 -5.456 497 HA ALA 71 HA ALA 71 21.218 17.441 -3.502 498 HB1 ALA 71 HB1 ALA 71 21.798 16.609 -6.333 499 HB2 ALA 71 HB2 ALA 71 21.100 15.561 -5.099 500 HB3 ALA 71 HB3 ALA 71 22.731 16.201 -4.895 501 H ALA 72 H ALA 72 21.202 18.994 -6.700 502 HA ALA 72 HA ALA 72 23.736 20.196 -6.500 503 HB1 ALA 72 HB1 ALA 72 21.369 21.085 -8.143 504 HB2 ALA 72 HB2 ALA 72 22.571 19.885 -8.625 505 HB3 ALA 72 HB3 ALA 72 23.047 21.566 -8.390 506 H GLU 73 H GLU 73 20.547 21.300 -5.493 507 HA GLU 73 HA GLU 73 21.355 23.986 -4.957 508 HB2 GLU 73 HB2 GLU 73 18.979 22.453 -3.889 509 HB3 GLU 73 HB3 GLU 73 19.203 24.195 -3.812 510 HG2 GLU 73 HG2 GLU 73 18.844 22.531 -6.289 511 HG3 GLU 73 HG3 GLU 73 17.675 23.642 -5.580 512 H VAL 74 H VAL 74 20.869 21.093 -2.973 513 HA VAL 74 HA VAL 74 21.526 22.300 -0.499 514 HB VAL 74 HB VAL 74 21.800 19.392 -1.297 515 HG11 VAL 74 HG11 VAL 74 23.056 19.904 0.729 516 HG12 VAL 74 HG12 VAL 74 21.636 18.929 1.105 517 HG13 VAL 74 HG13 VAL 74 21.628 20.659 1.437 518 HG21 VAL 74 HG21 VAL 74 19.600 19.109 -0.246 519 HG22 VAL 74 HG22 VAL 74 19.532 20.204 -1.627 520 HG23 VAL 74 HG23 VAL 74 19.508 20.853 0.012 521 H ALA 75 H ALA 75 23.419 20.893 -3.070 522 HA ALA 75 HA ALA 75 25.871 20.545 -1.792 523 HB1 ALA 75 HB1 ALA 75 25.333 19.749 -4.067 524 HB2 ALA 75 HB2 ALA 75 26.863 20.619 -3.987 525 HB3 ALA 75 HB3 ALA 75 25.433 21.410 -4.646 526 H GLU 76 H GLU 76 24.291 23.458 -2.876 527 HA GLU 76 HA GLU 76 26.511 25.162 -3.034 528 HB2 GLU 76 HB2 GLU 76 23.627 25.735 -2.349 529 HB3 GLU 76 HB3 GLU 76 24.832 26.988 -2.606 530 HG2 GLU 76 HG2 GLU 76 24.071 24.912 -4.645 531 HG3 GLU 76 HG3 GLU 76 23.419 26.549 -4.583 532 H VAL 77 H VAL 77 24.348 24.471 -0.280 533 HA VAL 77 HA VAL 77 25.734 26.260 1.452 534 HB VAL 77 HB VAL 77 24.423 25.347 3.277 535 HG11 VAL 77 HG11 VAL 77 22.794 25.675 0.762 536 HG12 VAL 77 HG12 VAL 77 23.360 26.966 1.822 537 HG13 VAL 77 HG13 VAL 77 22.178 25.797 2.411 538 HG21 VAL 77 HG21 VAL 77 23.493 23.248 1.319 539 HG22 VAL 77 HG22 VAL 77 22.827 23.518 2.930 540 HG23 VAL 77 HG23 VAL 77 24.497 22.983 2.746 541 H VAL 78 H VAL 78 26.046 22.875 0.659 542 HA VAL 78 HA VAL 78 27.796 22.236 2.827 543 HB VAL 78 HB VAL 78 27.518 20.781 0.191 544 HG11 VAL 78 HG11 VAL 78 29.501 20.144 1.466 545 HG12 VAL 78 HG12 VAL 78 28.313 18.838 1.447 546 HG13 VAL 78 HG13 VAL 78 28.498 19.842 2.886 547 HG21 VAL 78 HG21 VAL 78 25.341 20.993 1.245 548 HG22 VAL 78 HG22 VAL 78 25.999 20.400 2.769 549 HG23 VAL 78 HG23 VAL 78 25.915 19.331 1.369 550 H ALA 79 H ALA 79 28.235 23.207 -0.545 551 HA ALA 79 HA ALA 79 31.045 22.978 -0.625 552 HB1 ALA 79 HB1 ALA 79 29.243 24.815 -2.198 553 HB2 ALA 79 HB2 ALA 79 29.681 23.164 -2.635 554 HB3 ALA 79 HB3 ALA 79 30.917 24.422 -2.592 555 H THR 80 H THR 80 28.972 25.317 0.813 556 HA THR 80 HA THR 80 31.062 27.337 0.983 557 HB THR 80 HB THR 80 28.295 27.465 2.198 558 HG1 THR 80 HG1 THR 80 28.125 27.088 -0.066 559 HG21 THR 80 HG21 THR 80 30.209 29.631 1.303 560 HG22 THR 80 HG22 THR 80 29.883 29.176 2.976 561 HG23 THR 80 HG23 THR 80 28.605 29.888 1.991 562 H SER 81 H SER 81 30.495 24.564 2.547 563 HA SER 81 HA SER 81 30.973 25.572 5.244 564 HB2 SER 81 HB2 SER 81 30.518 22.748 4.250 565 HB3 SER 81 HB3 SER 81 30.673 23.223 5.941 566 HG SER 81 HG SER 81 28.628 23.921 4.107 567 HA PRO 82 HA PRO 82 35.343 25.065 4.503 568 HB2 PRO 82 HB2 PRO 82 36.165 25.740 7.004 569 HB3 PRO 82 HB3 PRO 82 35.646 26.930 5.806 570 HG2 PRO 82 HG2 PRO 82 34.117 25.753 8.093 571 HG3 PRO 82 HG3 PRO 82 34.178 27.435 7.534 572 HD2 PRO 82 HD2 PRO 82 32.128 25.770 6.937 573 HD3 PRO 82 HD3 PRO 82 32.663 27.059 5.839 574 HA PRO 83 HA PRO 83 36.222 20.967 5.972 575 HB2 PRO 83 HB2 PRO 83 39.069 21.692 5.966 576 HB3 PRO 83 HB3 PRO 83 38.217 20.475 5.012 577 HG2 PRO 83 HG2 PRO 83 39.137 22.747 3.909 578 HG3 PRO 83 HG3 PRO 83 37.632 21.984 3.367 579 HD2 PRO 83 HD2 PRO 83 38.017 24.354 5.157 580 HD3 PRO 83 HD3 PRO 83 36.822 24.094 3.870 581 H GLN 84 H GLN 84 35.374 21.407 8.062 582 HA GLN 84 HA GLN 84 37.233 20.863 10.134 583 HB2 GLN 84 HB2 GLN 84 37.403 23.303 10.103 584 HB3 GLN 84 HB3 GLN 84 35.651 23.444 10.211 585 HG2 GLN 84 HG2 GLN 84 35.664 22.426 12.387 586 HG3 GLN 84 HG3 GLN 84 37.396 22.155 12.268 587 HE21 GLN 84 HE22 GLN 84 37.865 24.770 11.027 588 HE22 GLN 84 HE21 GLN 84 37.708 25.933 12.294 589 H SER 85 H SER 85 33.994 21.751 9.133 590 HA SER 85 HA SER 85 32.920 19.611 10.825 591 HB2 SER 85 HB2 SER 85 32.467 21.819 11.895 592 HB3 SER 85 HB3 SER 85 31.636 22.333 10.428 593 HG SER 85 HG SER 85 30.156 20.606 10.775 594 H TYR 86 H TYR 86 33.710 19.801 8.018 595 HA TYR 86 HA TYR 86 31.446 20.322 6.368 596 HB2 TYR 86 HB2 TYR 86 33.752 20.544 5.549 597 HB3 TYR 86 HB3 TYR 86 34.012 18.822 5.785 598 HD1 TYR 86 HD1 TYR 86 32.768 17.193 4.342 599 HD2 TYR 86 HD2 TYR 86 32.747 21.373 3.578 600 HE1 TYR 86 HE1 TYR 86 32.006 16.758 2.051 601 HE2 TYR 86 HE2 TYR 86 31.986 20.958 1.278 602 HH TYR 86 HH TYR 86 31.979 19.185 -0.367 603 H SER 87 H SER 87 33.074 17.328 7.403 604 HA SER 87 HA SER 87 31.253 15.557 6.205 605 HB2 SER 87 HB2 SER 87 32.999 15.168 8.649 606 HB3 SER 87 HB3 SER 87 32.171 13.870 7.785 607 HG SER 87 HG SER 87 34.225 15.588 6.815 608 H ALA 88 H ALA 88 31.114 17.328 9.207 609 HA ALA 88 HA ALA 88 28.942 15.891 10.347 610 HB1 ALA 88 HB1 ALA 88 28.704 17.809 11.841 611 HB2 ALA 88 HB2 ALA 88 29.809 18.740 10.830 612 HB3 ALA 88 HB3 ALA 88 30.393 17.320 11.698 613 H VAL 89 H VAL 89 29.201 18.734 8.274 614 HA VAL 89 HA VAL 89 26.493 19.435 8.140 615 HB VAL 89 HB VAL 89 28.689 19.723 6.080 616 HG11 VAL 89 HG11 VAL 89 25.939 20.962 6.098 617 HG12 VAL 89 HG12 VAL 89 26.560 19.802 4.927 618 HG13 VAL 89 HG13 VAL 89 27.249 21.423 5.014 619 HG21 VAL 89 HG21 VAL 89 27.502 21.675 8.049 620 HG22 VAL 89 HG22 VAL 89 28.711 22.070 6.829 621 HG23 VAL 89 HG23 VAL 89 29.106 20.948 8.131 622 H LEU 90 H LEU 90 28.418 17.273 6.076 623 HA LEU 90 HA LEU 90 26.357 16.547 4.342 624 HB2 LEU 90 HB2 LEU 90 29.046 15.535 5.046 625 HB3 LEU 90 HB3 LEU 90 27.975 14.424 4.232 626 HG LEU 90 HG LEU 90 28.820 17.124 3.201 627 HD11 LEU 90 HD11 LEU 90 29.590 14.328 2.384 628 HD12 LEU 90 HD12 LEU 90 30.636 15.542 3.123 629 HD13 LEU 90 HD13 LEU 90 30.006 15.793 1.493 630 HD21 LEU 90 HD21 LEU 90 26.608 16.669 2.415 631 HD22 LEU 90 HD22 LEU 90 27.032 15.004 2.025 632 HD23 LEU 90 HD23 LEU 90 27.727 16.332 1.095 633 H ASN 91 H ASN 91 27.477 15.067 7.368 634 HA ASN 91 HA ASN 91 25.753 12.828 7.240 635 HB2 ASN 91 HB2 ASN 91 27.361 14.117 9.389 636 HB3 ASN 91 HB3 ASN 91 26.092 12.997 9.874 637 HD21 ASN 91 HD22 ASN 91 29.144 13.346 8.250 638 HD22 ASN 91 HD21 ASN 91 29.509 11.657 8.156 639 H THR 92 H THR 92 25.334 16.083 8.487 640 HA THR 92 HA THR 92 22.878 15.724 9.794 641 HB THR 92 HB THR 92 23.880 18.178 8.324 642 HG1 THR 92 HG1 THR 92 25.276 17.500 10.025 643 HG21 THR 92 HG21 THR 92 21.762 17.918 10.462 644 HG22 THR 92 HG22 THR 92 21.472 18.276 8.760 645 HG23 THR 92 HG23 THR 92 22.349 19.428 9.768 646 H ILE 93 H ILE 93 23.551 16.813 6.467 647 HA ILE 93 HA ILE 93 20.906 16.911 5.562 648 HB ILE 93 HB ILE 93 23.378 16.237 3.957 649 HG12 ILE 93 HG12 ILE 93 23.629 18.350 5.151 650 HG13 ILE 93 HG13 ILE 93 23.444 18.639 3.427 651 HG21 ILE 93 HG21 ILE 93 22.124 17.076 2.032 652 HG22 ILE 93 HG22 ILE 93 20.705 17.301 3.053 653 HG23 ILE 93 HG23 ILE 93 21.335 15.681 2.762 654 HD11 ILE 93 HD11 ILE 93 22.187 20.264 4.683 655 HD12 ILE 93 HD12 ILE 93 21.331 18.983 5.541 656 HD13 ILE 93 HD13 ILE 93 21.078 19.207 3.810 657 H GLY 94 H GLY 94 23.273 14.285 5.480 658 HA2 GLY 94 HA2 GLY 94 21.744 12.466 3.989 659 HA3 GLY 94 HA3 GLY 94 23.080 12.048 5.043 660 H ALA 95 H ALA 95 21.690 13.202 7.390 661 HA ALA 95 HA ALA 95 20.186 10.805 8.033 662 HB1 ALA 95 HB1 ALA 95 20.977 13.128 9.788 663 HB2 ALA 95 HB2 ALA 95 21.861 11.612 9.614 664 HB3 ALA 95 HB3 ALA 95 20.252 11.618 10.336 665 H CYS 96 H CYS 96 19.669 14.318 8.085 666 HA CYS 96 HA CYS 96 17.031 14.286 8.993 667 HB2 CYS 96 HB2 CYS 96 18.497 16.275 7.262 668 HB3 CYS 96 HB3 CYS 96 16.882 16.557 7.897 669 H LEU 97 H LEU 97 18.319 13.964 5.733 670 HA LEU 97 HA LEU 97 15.907 14.276 4.330 671 HB2 LEU 97 HB2 LEU 97 18.240 14.270 3.389 672 HB3 LEU 97 HB3 LEU 97 18.255 12.531 3.571 673 HG LEU 97 HG LEU 97 17.776 13.511 1.244 674 HD11 LEU 97 HD11 LEU 97 16.212 11.714 0.700 675 HD12 LEU 97 HD12 LEU 97 15.894 11.476 2.418 676 HD13 LEU 97 HD13 LEU 97 17.501 11.156 1.767 677 HD21 LEU 97 HD21 LEU 97 15.461 14.069 0.774 678 HD22 LEU 97 HD22 LEU 97 16.125 15.176 1.976 679 HD23 LEU 97 HD23 LEU 97 15.049 13.874 2.475 680 H ARG 98 H ARG 98 17.363 11.511 5.930 681 HA ARG 98 HA ARG 98 15.721 9.521 4.764 682 HB2 ARG 98 HB2 ARG 98 17.235 9.473 7.376 683 HB3 ARG 98 HB3 ARG 98 16.554 8.067 6.566 684 HG2 ARG 98 HG2 ARG 98 18.014 8.394 4.678 685 HG3 ARG 98 HG3 ARG 98 18.646 9.877 5.390 686 HD2 ARG 98 HD2 ARG 98 19.458 8.538 7.314 687 HD3 ARG 98 HD3 ARG 98 18.942 7.082 6.463 688 HE ARG 98 HE ARG 98 20.805 8.878 5.106 689 HH11 ARG 98 HH11 ARG 98 20.281 5.873 6.818 690 HH12 ARG 98 HH12 ARG 98 21.755 5.148 6.266 691 HH21 ARG 98 HH21 ARG 98 22.749 7.923 4.355 692 HH22 ARG 98 HH22 ARG 98 23.165 6.318 4.860 693 H GLU 99 H GLU 99 15.572 11.046 7.994 694 HA GLU 99 HA GLU 99 13.220 9.734 8.788 695 HB2 GLU 99 HB2 GLU 99 12.961 11.524 10.469 696 HB3 GLU 99 HB3 GLU 99 14.581 10.847 10.445 697 HG2 GLU 99 HG2 GLU 99 15.492 12.771 9.483 698 HG3 GLU 99 HG3 GLU 99 13.917 13.357 8.952 699 H SER 100 H SER 100 13.721 12.777 7.109 700 HA SER 100 HA SER 100 11.131 13.772 7.185 701 HB2 SER 100 HB2 SER 100 13.209 14.079 5.009 702 HB3 SER 100 HB3 SER 100 11.782 15.095 5.205 703 HG SER 100 HG SER 100 14.056 14.886 6.863 704 H MET 101 H MET 101 12.576 11.400 5.019 705 HA MET 101 HA MET 101 10.445 11.347 3.148 706 HB2 MET 101 HB2 MET 101 12.584 9.333 3.811 707 HB3 MET 101 HB3 MET 101 11.401 9.082 2.539 708 HG2 MET 101 HG2 MET 101 12.201 11.145 1.443 709 HG3 MET 101 HG3 MET 101 13.443 11.285 2.686 710 HE1 MET 101 HE1 MET 101 12.032 9.126 -0.252 711 HE2 MET 101 HE2 MET 101 12.127 7.928 1.036 712 HE3 MET 101 HE3 MET 101 13.206 7.815 -0.354 713 H MET 102 H MET 102 11.179 9.377 6.014 714 HA MET 102 HA MET 102 8.862 7.725 5.574 715 HB2 MET 102 HB2 MET 102 9.509 6.485 7.465 716 HB3 MET 102 HB3 MET 102 10.992 6.916 6.631 717 HG2 MET 102 HG2 MET 102 11.379 8.704 8.247 718 HG3 MET 102 HG3 MET 102 9.888 8.264 9.084 719 HE1 MET 102 HE1 MET 102 10.823 4.491 10.020 720 HE2 MET 102 HE2 MET 102 10.269 4.993 8.422 721 HE3 MET 102 HE3 MET 102 9.499 5.646 9.869 722 H GLN 103 H GLN 103 9.406 10.726 7.069 723 HA GLN 103 HA GLN 103 7.059 10.583 8.741 724 HB2 GLN 103 HB2 GLN 103 9.149 12.567 8.172 725 HB3 GLN 103 HB3 GLN 103 7.551 13.261 8.405 726 HG2 GLN 103 HG2 GLN 103 8.710 13.244 10.499 727 HG3 GLN 103 HG3 GLN 103 7.387 12.084 10.565 728 HE21 GLN 103 HE22 GLN 103 7.857 9.882 10.652 729 HE22 GLN 103 HE21 GLN 103 9.432 9.298 11.055 730 H ALA 104 H ALA 104 7.780 11.159 5.460 731 HA ALA 104 HA ALA 104 5.356 12.627 4.894 732 HB1 ALA 104 HB1 ALA 104 7.398 13.055 3.596 733 HB2 ALA 104 HB2 ALA 104 6.063 12.532 2.567 734 HB3 ALA 104 HB3 ALA 104 7.348 11.398 2.986 735 H THR 105 H THR 105 6.633 9.515 3.684 736 HA THR 105 HA THR 105 4.480 7.887 4.206 737 HB THR 105 HB THR 105 3.146 9.525 2.860 738 HG1 THR 105 HG1 THR 105 2.278 7.498 2.928 739 HG21 THR 105 HG21 THR 105 4.831 10.137 1.209 740 HG22 THR 105 HG22 THR 105 3.390 9.506 0.412 741 HG23 THR 105 HG23 THR 105 4.827 8.493 0.571 742 H GLY 106 H GLY 106 7.230 8.680 2.304 743 HA2 GLY 106 HA2 GLY 106 7.135 6.238 0.742 744 HA3 GLY 106 HA3 GLY 106 8.328 7.519 0.604 745 H SER 107 H SER 107 7.926 6.652 3.832 746 HA SER 107 HA SER 107 9.317 5.692 5.334 747 HB2 SER 107 HB2 SER 107 9.669 3.658 3.131 748 HB3 SER 107 HB3 SER 107 10.047 3.405 4.834 749 HG SER 107 HG SER 107 7.513 4.322 4.488 750 H VAL 108 H VAL 108 11.722 4.387 5.209 751 HA VAL 108 HA VAL 108 13.446 6.414 3.996 752 HB VAL 108 HB VAL 108 14.296 4.195 5.861 753 HG11 VAL 108 HG11 VAL 108 15.627 6.780 5.051 754 HG12 VAL 108 HG12 VAL 108 16.091 5.161 4.527 755 HG13 VAL 108 HG13 VAL 108 16.260 5.621 6.221 756 HG21 VAL 108 HG21 VAL 108 12.646 5.613 6.971 757 HG22 VAL 108 HG22 VAL 108 13.582 7.044 6.540 758 HG23 VAL 108 HG23 VAL 108 14.256 5.851 7.651 759 H ASP 109 H ASP 109 13.450 5.829 1.880 760 HA ASP 109 HA ASP 109 13.728 3.175 0.941 761 HB2 ASP 109 HB2 ASP 109 12.725 4.932 -0.438 762 HB3 ASP 109 HB3 ASP 109 14.258 5.800 -0.471 763 H ASN 110 H ASN 110 15.538 2.261 -0.193 764 HA ASN 110 HA ASN 110 17.981 2.768 1.295 765 HB2 ASN 110 HB2 ASN 110 18.754 0.630 0.403 766 HB3 ASN 110 HB3 ASN 110 17.142 0.458 1.087 767 HD21 ASN 110 HD22 ASN 110 15.386 0.112 -0.293 768 HD22 ASN 110 HD21 ASN 110 15.599 -0.394 -1.932 769 H ALA 111 H ALA 111 16.704 3.575 -1.753 770 HA ALA 111 HA ALA 111 19.384 3.757 -2.953 771 HB1 ALA 111 HB1 ALA 111 18.280 3.897 -5.096 772 HB2 ALA 111 HB2 ALA 111 16.701 3.979 -4.317 773 HB3 ALA 111 HB3 ALA 111 17.661 2.504 -4.209 774 H PHE 112 H PHE 112 16.389 5.682 -2.570 775 HA PHE 112 HA PHE 112 17.440 7.991 -3.797 776 HB2 PHE 112 HB2 PHE 112 15.018 7.599 -3.467 777 HB3 PHE 112 HB3 PHE 112 15.230 7.866 -1.738 778 HD1 PHE 112 HD1 PHE 112 15.680 9.509 -5.040 779 HD2 PHE 112 HD2 PHE 112 15.088 10.016 -0.857 780 HE1 PHE 112 HE1 PHE 112 15.379 11.926 -5.379 781 HE2 PHE 112 HE2 PHE 112 14.786 12.433 -1.188 782 HZ PHE 112 HZ PHE 112 14.932 13.393 -3.451 783 H THR 113 H THR 113 17.451 6.963 -0.419 784 HA THR 113 HA THR 113 18.410 9.431 0.636 785 HB THR 113 HB THR 113 18.947 8.097 2.667 786 HG1 THR 113 HG1 THR 113 17.720 5.806 1.783 787 HG21 THR 113 HG21 THR 113 16.231 7.589 1.447 788 HG22 THR 113 HG22 THR 113 16.704 8.989 2.409 789 HG23 THR 113 HG23 THR 113 16.627 7.392 3.154 790 H ASN 114 H ASN 114 19.837 7.113 -1.241 791 HA ASN 114 HA ASN 114 22.568 7.682 -0.301 792 HB2 ASN 114 HB2 ASN 114 22.181 5.339 -0.386 793 HB3 ASN 114 HB3 ASN 114 21.306 5.453 -1.904 794 HD21 ASN 114 HD22 ASN 114 22.468 4.027 -3.021 795 HD22 ASN 114 HD21 ASN 114 24.123 4.233 -3.449 796 H GLU 115 H GLU 115 20.484 7.593 -3.144 797 HA GLU 115 HA GLU 115 22.301 8.305 -5.087 798 HB2 GLU 115 HB2 GLU 115 20.061 7.290 -5.372 799 HB3 GLU 115 HB3 GLU 115 19.335 8.828 -4.925 800 HG2 GLU 115 HG2 GLU 115 20.203 9.874 -6.839 801 HG3 GLU 115 HG3 GLU 115 21.181 8.467 -7.239 802 H VAL 116 H VAL 116 19.946 10.388 -3.357 803 HA VAL 116 HA VAL 116 20.828 12.790 -4.564 804 HB VAL 116 HB VAL 116 18.639 12.482 -3.366 805 HG11 VAL 116 HG11 VAL 116 19.402 11.422 -1.336 806 HG12 VAL 116 HG12 VAL 116 18.552 12.922 -0.964 807 HG13 VAL 116 HG13 VAL 116 20.313 12.868 -0.901 808 HG21 VAL 116 HG21 VAL 116 20.328 14.854 -2.602 809 HG22 VAL 116 HG22 VAL 116 18.568 14.783 -2.492 810 HG23 VAL 116 HG23 VAL 116 19.358 14.672 -4.065 811 H MET 117 H MET 117 21.819 11.089 -1.655 812 HA MET 117 HA MET 117 23.520 13.087 -0.627 813 HB2 MET 117 HB2 MET 117 23.436 10.106 -0.243 814 HB3 MET 117 HB3 MET 117 24.594 11.128 0.589 815 HG2 MET 117 HG2 MET 117 21.612 11.075 0.855 816 HG3 MET 117 HG3 MET 117 22.838 10.841 2.102 817 HE1 MET 117 HE1 MET 117 24.836 13.324 1.312 818 HE2 MET 117 HE2 MET 117 24.435 12.829 2.955 819 HE3 MET 117 HE3 MET 117 24.247 14.514 2.476 820 H GLN 118 H GLN 118 24.214 10.244 -2.644 821 HA GLN 118 HA GLN 118 26.941 10.596 -2.981 822 HB2 GLN 118 HB2 GLN 118 25.658 8.660 -3.822 823 HB3 GLN 118 HB3 GLN 118 24.931 9.684 -5.052 824 HG2 GLN 118 HG2 GLN 118 27.248 10.116 -5.915 825 HG3 GLN 118 HG3 GLN 118 27.810 8.859 -4.812 826 HE21 GLN 118 HE22 GLN 118 27.195 6.711 -5.183 827 HE22 GLN 118 HE21 GLN 118 26.598 6.192 -6.720 828 H LEU 119 H LEU 119 24.259 12.066 -4.730 829 HA LEU 119 HA LEU 119 25.872 13.545 -6.528 830 HB2 LEU 119 HB2 LEU 119 22.994 13.724 -5.694 831 HB3 LEU 119 HB3 LEU 119 23.699 14.860 -6.832 832 HG LEU 119 HG LEU 119 24.043 11.958 -7.392 833 HD11 LEU 119 HD11 LEU 119 21.695 12.068 -6.779 834 HD12 LEU 119 HD12 LEU 119 21.858 11.890 -8.527 835 HD13 LEU 119 HD13 LEU 119 21.462 13.464 -7.835 836 HD21 LEU 119 HD21 LEU 119 25.068 13.671 -8.812 837 HD22 LEU 119 HD22 LEU 119 23.473 14.352 -9.132 838 HD23 LEU 119 HD23 LEU 119 23.864 12.726 -9.687 839 H VAL 120 H VAL 120 24.183 14.478 -3.510 840 HA VAL 120 HA VAL 120 24.917 17.162 -3.457 841 HB VAL 120 HB VAL 120 24.588 15.253 -1.129 842 HG11 VAL 120 HG11 VAL 120 24.849 18.261 -1.085 843 HG12 VAL 120 HG12 VAL 120 25.983 17.096 -0.400 844 HG13 VAL 120 HG13 VAL 120 24.366 17.262 0.285 845 HG21 VAL 120 HG21 VAL 120 22.560 15.604 -2.424 846 HG22 VAL 120 HG22 VAL 120 22.755 17.351 -2.279 847 HG23 VAL 120 HG23 VAL 120 22.430 16.378 -0.846 848 H LYS 121 H LYS 121 26.602 14.431 -1.947 849 HA LYS 121 HA LYS 121 28.763 15.788 -0.872 850 HB2 LYS 121 HB2 LYS 121 28.685 12.987 -2.012 851 HB3 LYS 121 HB3 LYS 121 29.909 13.603 -0.910 852 HG2 LYS 121 HG2 LYS 121 28.405 13.727 0.875 853 HG3 LYS 121 HG3 LYS 121 27.003 13.613 -0.185 854 HD2 LYS 121 HD2 LYS 121 27.296 11.525 0.985 855 HD3 LYS 121 HD3 LYS 121 27.646 11.290 -0.727 856 HE2 LYS 121 HE2 LYS 121 30.044 11.441 -0.261 857 HE3 LYS 121 HE3 LYS 121 29.703 11.692 1.449 858 HZ1 LYS 121 HZ1 LYS 121 30.289 9.410 1.042 859 HZ2 LYS 121 HZ2 LYS 121 29.075 9.252 -0.123 860 HZ3 LYS 121 HZ3 LYS 121 28.664 9.490 1.499 861 H MET 122 H MET 122 28.354 14.450 -4.096 862 HA MET 122 HA MET 122 31.068 15.023 -4.843 863 HB2 MET 122 HB2 MET 122 30.219 13.026 -5.730 864 HB3 MET 122 HB3 MET 122 28.709 13.775 -6.213 865 HG2 MET 122 HG2 MET 122 31.143 14.794 -7.518 866 HG3 MET 122 HG3 MET 122 30.674 13.141 -7.910 867 HE1 MET 122 HE1 MET 122 28.343 12.468 -8.961 868 HE2 MET 122 HE2 MET 122 27.071 13.620 -9.367 869 HE3 MET 122 HE3 MET 122 27.459 13.297 -7.681 870 H LEU 123 H LEU 123 27.961 16.559 -5.287 871 HA LEU 123 HA LEU 123 29.005 18.370 -7.294 872 HB2 LEU 123 HB2 LEU 123 26.349 18.238 -5.880 873 HB3 LEU 123 HB3 LEU 123 26.753 19.470 -7.059 874 HG LEU 123 HG LEU 123 26.695 16.507 -7.637 875 HD11 LEU 123 HD11 LEU 123 24.630 17.000 -8.869 876 HD12 LEU 123 HD12 LEU 123 24.673 18.654 -8.257 877 HD13 LEU 123 HD13 LEU 123 24.462 17.306 -7.139 878 HD21 LEU 123 HD21 LEU 123 26.774 17.232 -9.981 879 HD22 LEU 123 HD22 LEU 123 28.215 17.719 -9.088 880 HD23 LEU 123 HD23 LEU 123 26.956 18.905 -9.448 881 H SER 124 H SER 124 29.269 18.186 -3.987 882 HA SER 124 HA SER 124 29.065 21.073 -3.556 883 HB2 SER 124 HB2 SER 124 29.727 18.868 -1.588 884 HB3 SER 124 HB3 SER 124 29.459 20.562 -1.186 885 HG SER 124 HG SER 124 27.583 18.738 -2.276 886 H ALA 125 H ALA 125 31.471 18.476 -3.342 887 HA ALA 125 HA ALA 125 33.587 20.314 -3.912 888 HB1 ALA 125 HB1 ALA 125 34.865 19.887 -1.898 889 HB2 ALA 125 HB2 ALA 125 33.580 18.855 -1.271 890 HB3 ALA 125 HB3 ALA 125 33.302 20.585 -1.470 891 H ASP 126 H ASP 126 35.366 19.272 -4.626 892 HA ASP 126 HA ASP 126 34.990 16.605 -5.581 893 HB2 ASP 126 HB2 ASP 126 36.135 18.465 -6.877 894 HB3 ASP 126 HB3 ASP 126 37.511 18.259 -5.800 895 H SER 127 H SER 127 34.767 15.888 -3.335 896 HA SER 127 HA SER 127 35.453 14.369 -1.785 897 HB2 SER 127 HB2 SER 127 36.817 13.532 -3.764 898 HB3 SER 127 HB3 SER 127 38.172 14.424 -3.062 899 HG SER 127 HG SER 127 37.739 13.182 -1.098 900 H ALA 128 H ALA 128 35.885 17.305 -1.479 901 HA ALA 128 HA ALA 128 38.314 17.524 0.049 902 HB1 ALA 128 HB1 ALA 128 37.491 19.408 -1.299 903 HB2 ALA 128 HB2 ALA 128 37.680 19.837 0.403 904 HB3 ALA 128 HB3 ALA 128 36.074 19.519 -0.251 905 H ASN 129 H ASN 129 36.664 15.553 1.141 906 HA ASN 129 HA ASN 129 35.352 16.775 3.438 907 HB2 ASN 129 HB2 ASN 129 34.530 14.525 3.960 908 HB3 ASN 129 HB3 ASN 129 34.147 14.966 2.301 909 HD21 ASN 129 HD22 ASN 129 34.458 12.351 3.689 910 HD22 ASN 129 HD21 ASN 129 35.583 11.465 2.721 911 H GLU 130 H GLU 130 36.095 16.735 5.445 912 HA GLU 130 HA GLU 130 38.773 15.697 5.900 913 HB2 GLU 130 HB2 GLU 130 37.911 16.866 8.271 914 HB3 GLU 130 HB3 GLU 130 38.951 17.595 7.059 915 HG2 GLU 130 HG2 GLU 130 37.232 19.144 7.529 916 HG3 GLU 130 HG3 GLU 130 36.895 18.471 5.938 917 H VAL 131 H VAL 131 38.207 13.502 5.839 918 HA VAL 131 HA VAL 131 36.612 12.525 8.096 919 HB VAL 131 HB VAL 131 35.848 11.817 5.856 920 HG11 VAL 131 HG11 VAL 131 38.530 10.460 5.651 921 HG12 VAL 131 HG12 VAL 131 37.987 11.845 4.702 922 HG13 VAL 131 HG13 VAL 131 37.191 10.280 4.517 923 HG21 VAL 131 HG21 VAL 131 35.736 9.404 6.290 924 HG22 VAL 131 HG22 VAL 131 35.418 10.356 7.740 925 HG23 VAL 131 HG23 VAL 131 36.985 9.579 7.523 926 H SER 132 H SER 132 37.446 10.993 9.480 927 HA SER 132 HA SER 132 38.989 9.882 10.717 928 HB2 SER 132 HB2 SER 132 40.578 9.753 8.139 929 HB3 SER 132 HB3 SER 132 40.816 8.741 9.565 930 HG SER 132 HG SER 132 38.302 8.465 9.008 931 H THR 133 H THR 133 39.001 12.724 10.557 932 HA THR 133 HA THR 133 41.774 13.547 10.589 933 HB THR 133 HB THR 133 40.682 15.796 11.234 934 HG1 THR 133 HG1 THR 133 38.403 15.787 10.439 935 HG21 THR 133 HG21 THR 133 41.555 15.276 9.000 936 HG22 THR 133 HG22 THR 133 40.083 16.240 8.900 937 HG23 THR 133 HG23 THR 133 40.025 14.505 8.581 Start of MODEL 20 1 HA2 GLY 1 HA2 GLY 1 8.300 -4.470 -7.533 2 HA3 GLY 1 HA3 GLY 1 7.641 -2.924 -7.013 3 H SER 2 H SER 2 10.290 -4.836 -6.861 4 HA SER 2 HA SER 2 11.026 -4.275 -4.115 5 HB2 SER 2 HB2 SER 2 12.614 -5.596 -6.329 6 HB3 SER 2 HB3 SER 2 13.049 -5.563 -4.621 7 HG SER 2 HG SER 2 11.154 -6.754 -4.180 8 H GLY 3 H GLY 3 11.909 -3.249 -7.377 9 HA2 GLY 3 HA2 GLY 3 13.057 -0.815 -6.273 10 HA3 GLY 3 HA3 GLY 3 14.177 -1.855 -7.141 11 H ASN 4 H ASN 4 10.782 -1.321 -7.885 12 HA ASN 4 HA ASN 4 11.408 -0.737 -10.622 13 HB2 ASN 4 HB2 ASN 4 9.005 -0.601 -10.951 14 HB3 ASN 4 HB3 ASN 4 9.383 -2.014 -9.973 15 HD21 ASN 4 HD22 ASN 4 7.715 0.969 -10.136 16 HD22 ASN 4 HD21 ASN 4 6.993 0.899 -8.566 17 H SER 5 H SER 5 10.385 1.215 -11.695 18 HA SER 5 HA SER 5 11.527 3.502 -10.383 19 HB2 SER 5 HB2 SER 5 10.111 3.334 -13.052 20 HB3 SER 5 HB3 SER 5 11.133 4.659 -12.489 21 HG SER 5 HG SER 5 12.056 1.985 -12.712 22 H GLN 6 H GLN 6 10.062 3.670 -8.593 23 HA GLN 6 HA GLN 6 7.991 5.574 -9.212 24 HB2 GLN 6 HB2 GLN 6 6.953 3.223 -9.117 25 HB3 GLN 6 HB3 GLN 6 7.326 3.262 -7.399 26 HG2 GLN 6 HG2 GLN 6 5.172 3.992 -7.390 27 HG3 GLN 6 HG3 GLN 6 6.050 5.519 -7.454 28 HE21 GLN 6 HE22 GLN 6 6.750 5.033 -10.313 29 HE22 GLN 6 HE21 GLN 6 5.310 5.396 -11.191 30 HA PRO 7 HA PRO 7 10.443 6.570 -5.493 31 HB2 PRO 7 HB2 PRO 7 11.233 9.016 -6.196 32 HB3 PRO 7 HB3 PRO 7 11.963 7.578 -6.920 33 HG2 PRO 7 HG2 PRO 7 9.931 9.446 -8.051 34 HG3 PRO 7 HG3 PRO 7 11.280 8.630 -8.859 35 HD2 PRO 7 HD2 PRO 7 8.607 7.794 -8.880 36 HD3 PRO 7 HD3 PRO 7 10.010 6.806 -9.329 37 H ILE 8 H ILE 8 10.461 8.902 -4.313 38 HA ILE 8 HA ILE 8 7.800 9.160 -3.304 39 HB ILE 8 HB ILE 8 9.724 9.247 -1.816 40 HG12 ILE 8 HG12 ILE 8 8.369 11.949 -1.848 41 HG13 ILE 8 HG13 ILE 8 7.625 10.477 -1.227 42 HG21 ILE 8 HG21 ILE 8 11.346 10.250 -3.273 43 HG22 ILE 8 HG22 ILE 8 11.216 11.199 -1.791 44 HG23 ILE 8 HG23 ILE 8 10.455 11.772 -3.277 45 HD11 ILE 8 HD11 ILE 8 9.396 10.305 0.448 46 HD12 ILE 8 HD12 ILE 8 8.508 11.825 0.571 47 HD13 ILE 8 HD13 ILE 8 10.112 11.794 -0.165 48 H TRP 9 H TRP 9 9.498 10.669 -5.821 49 HA TRP 9 HA TRP 9 8.300 13.257 -5.710 50 HB2 TRP 9 HB2 TRP 9 9.589 11.791 -8.020 51 HB3 TRP 9 HB3 TRP 9 9.122 13.487 -8.043 52 HD1 TRP 9 HD1 TRP 9 11.882 11.183 -6.976 53 HE1 TRP 9 HE1 TRP 9 13.810 12.552 -5.957 54 HE3 TRP 9 HE3 TRP 9 9.543 15.707 -6.588 55 HZ2 TRP 9 HZ2 TRP 9 14.275 15.207 -5.113 56 HZ3 TRP 9 HZ3 TRP 9 10.797 17.612 -5.667 57 HH2 TRP 9 HH2 TRP 9 13.114 17.364 -4.944 58 H THR 10 H THR 10 7.039 10.250 -6.414 59 HA THR 10 HA THR 10 5.307 10.918 -8.581 60 HB THR 10 HB THR 10 5.135 8.606 -6.628 61 HG1 THR 10 HG1 THR 10 6.864 9.200 -8.666 62 HG21 THR 10 HG21 THR 10 3.945 7.458 -8.433 63 HG22 THR 10 HG22 THR 10 4.036 8.911 -9.429 64 HG23 THR 10 HG23 THR 10 3.085 8.919 -7.944 65 H ASN 11 H ASN 11 5.237 11.591 -5.255 66 HA ASN 11 HA ASN 11 2.428 12.388 -5.469 67 HB2 ASN 11 HB2 ASN 11 2.404 10.360 -4.142 68 HB3 ASN 11 HB3 ASN 11 3.685 10.978 -3.105 69 HD21 ASN 11 HD22 ASN 11 2.298 10.594 -1.335 70 HD22 ASN 11 HD21 ASN 11 1.033 11.702 -0.940 71 HA PRO 12 HA PRO 12 4.346 16.329 -4.600 72 HB2 PRO 12 HB2 PRO 12 1.461 16.944 -4.175 73 HB3 PRO 12 HB3 PRO 12 2.669 17.811 -5.131 74 HG2 PRO 12 HG2 PRO 12 0.828 16.274 -6.303 75 HG3 PRO 12 HG3 PRO 12 2.487 16.357 -6.923 76 HD2 PRO 12 HD2 PRO 12 1.143 14.189 -5.389 77 HD3 PRO 12 HD3 PRO 12 2.410 14.086 -6.627 78 H ASN 13 H ASN 13 1.741 14.932 -2.626 79 HA ASN 13 HA ASN 13 2.421 16.595 -0.350 80 HB2 ASN 13 HB2 ASN 13 0.059 15.817 -1.052 81 HB3 ASN 13 HB3 ASN 13 0.495 14.287 -0.298 82 HD21 ASN 13 HD22 ASN 13 0.540 14.139 1.917 83 HD22 ASN 13 HD21 ASN 13 0.053 15.421 2.969 84 H ALA 14 H ALA 14 4.107 14.311 -1.564 85 HA ALA 14 HA ALA 14 4.916 13.277 1.075 86 HB1 ALA 14 HB1 ALA 14 4.071 11.448 -0.296 87 HB2 ALA 14 HB2 ALA 14 5.812 11.288 -0.053 88 HB3 ALA 14 HB3 ALA 14 5.186 11.887 -1.592 89 H ALA 15 H ALA 15 5.981 14.119 -2.186 90 HA ALA 15 HA ALA 15 8.734 14.179 -1.710 91 HB1 ALA 15 HB1 ALA 15 7.779 14.134 -3.949 92 HB2 ALA 15 HB2 ALA 15 8.884 15.495 -3.765 93 HB3 ALA 15 HB3 ALA 15 7.141 15.760 -3.721 94 H MET 16 H MET 16 6.317 16.809 -1.543 95 HA MET 16 HA MET 16 8.225 18.752 -0.763 96 HB2 MET 16 HB2 MET 16 5.324 18.619 -1.102 97 HB3 MET 16 HB3 MET 16 5.848 19.728 0.165 98 HG2 MET 16 HG2 MET 16 6.444 19.778 -2.760 99 HG3 MET 16 HG3 MET 16 5.730 21.023 -1.754 100 HE1 MET 16 HE1 MET 16 8.805 20.129 -3.683 101 HE2 MET 16 HE2 MET 16 8.967 18.932 -2.404 102 HE3 MET 16 HE3 MET 16 10.144 20.234 -2.544 103 H THR 17 H THR 17 6.346 16.419 0.992 104 HA THR 17 HA THR 17 6.488 17.577 3.536 105 HB THR 17 HB THR 17 6.467 14.632 2.843 106 HG1 THR 17 HG1 THR 17 4.316 16.454 3.298 107 HG21 THR 17 HG21 THR 17 6.989 14.980 5.184 108 HG22 THR 17 HG22 THR 17 5.318 14.429 5.046 109 HG23 THR 17 HG23 THR 17 5.663 16.133 5.343 110 H MET 18 H MET 18 8.649 15.186 1.981 111 HA MET 18 HA MET 18 10.503 15.086 4.106 112 HB2 MET 18 HB2 MET 18 12.003 13.970 2.587 113 HB3 MET 18 HB3 MET 18 10.373 13.389 2.275 114 HG2 MET 18 HG2 MET 18 10.199 14.738 0.313 115 HG3 MET 18 HG3 MET 18 11.719 15.545 0.670 116 HE1 MET 18 HE1 MET 18 11.141 14.369 -2.176 117 HE2 MET 18 HE2 MET 18 12.690 13.594 -2.506 118 HE3 MET 18 HE3 MET 18 12.646 15.157 -1.688 119 H THR 19 H THR 19 10.212 17.169 1.304 120 HA THR 19 HA THR 19 12.772 18.324 1.398 121 HB THR 19 HB THR 19 10.217 19.495 0.280 122 HG1 THR 19 HG1 THR 19 10.605 17.537 -0.736 123 HG21 THR 19 HG21 THR 19 11.546 20.922 -1.028 124 HG22 THR 19 HG22 THR 19 13.022 20.036 -0.646 125 HG23 THR 19 HG23 THR 19 12.242 21.024 0.590 126 H ASN 20 H ASN 20 9.632 19.481 2.648 127 HA ASN 20 HA ASN 20 10.684 21.878 3.718 128 HB2 ASN 20 HB2 ASN 20 8.126 20.364 4.175 129 HB3 ASN 20 HB3 ASN 20 8.510 21.803 5.107 130 HD21 ASN 20 HD22 ASN 20 7.674 20.547 1.986 131 HD22 ASN 20 HD21 ASN 20 7.331 22.071 1.237 132 H ASN 21 H ASN 21 10.211 18.650 5.070 133 HA ASN 21 HA ASN 21 10.843 19.395 7.733 134 HB2 ASN 21 HB2 ASN 21 10.772 16.742 6.312 135 HB3 ASN 21 HB3 ASN 21 11.266 16.883 7.992 136 HD21 ASN 21 HD22 ASN 21 9.005 15.482 6.884 137 HD22 ASN 21 HD21 ASN 21 7.596 16.164 7.612 138 H LEU 22 H LEU 22 12.725 18.381 4.976 139 HA LEU 22 HA LEU 22 15.204 17.955 6.187 140 HB2 LEU 22 HB2 LEU 22 14.855 17.406 3.870 141 HB3 LEU 22 HB3 LEU 22 14.475 19.068 3.476 142 HG LEU 22 HG LEU 22 16.845 19.671 4.024 143 HD11 LEU 22 HD11 LEU 22 18.499 17.881 4.119 144 HD12 LEU 22 HD12 LEU 22 17.210 16.678 4.105 145 HD13 LEU 22 HD13 LEU 22 17.373 17.781 5.472 146 HD21 LEU 22 HD21 LEU 22 16.114 19.353 1.726 147 HD22 LEU 22 HD22 LEU 22 16.419 17.620 1.854 148 HD23 LEU 22 HD23 LEU 22 17.761 18.761 1.942 149 H VAL 23 H VAL 23 13.612 20.900 5.114 150 HA VAL 23 HA VAL 23 15.777 22.644 5.650 151 HB VAL 23 HB VAL 23 12.828 23.292 5.533 152 HG11 VAL 23 HG11 VAL 23 15.244 25.077 5.237 153 HG12 VAL 23 HG12 VAL 23 14.116 25.066 6.593 154 HG13 VAL 23 HG13 VAL 23 13.566 25.568 4.994 155 HG21 VAL 23 HG21 VAL 23 14.928 23.342 3.371 156 HG22 VAL 23 HG22 VAL 23 13.272 23.920 3.203 157 HG23 VAL 23 HG23 VAL 23 13.582 22.210 3.493 158 H GLN 24 H GLN 24 12.948 21.635 7.564 159 HA GLN 24 HA GLN 24 13.488 23.475 9.673 160 HB2 GLN 24 HB2 GLN 24 11.765 22.341 10.943 161 HB3 GLN 24 HB3 GLN 24 11.226 22.572 9.290 162 HG2 GLN 24 HG2 GLN 24 10.515 20.446 9.680 163 HG3 GLN 24 HG3 GLN 24 12.099 20.131 8.979 164 HE21 GLN 24 HE22 GLN 24 12.298 18.142 9.952 165 HE22 GLN 24 HE21 GLN 24 12.566 17.954 11.650 166 H CYS 25 H CYS 25 14.364 20.117 9.092 167 HA CYS 25 HA CYS 25 15.456 19.629 11.657 168 HB2 CYS 25 HB2 CYS 25 14.858 17.788 10.187 169 HB3 CYS 25 HB3 CYS 25 16.028 18.325 8.989 170 H ALA 26 H ALA 26 16.922 20.657 8.578 171 HA ALA 26 HA ALA 26 19.562 20.799 9.589 172 HB1 ALA 26 HB1 ALA 26 18.457 22.354 7.260 173 HB2 ALA 26 HB2 ALA 26 18.945 20.662 7.176 174 HB3 ALA 26 HB3 ALA 26 20.138 21.905 7.557 175 H SER 27 H SER 27 16.873 23.009 9.654 176 HA SER 27 HA SER 27 18.319 25.361 10.293 177 HB2 SER 27 HB2 SER 27 15.985 25.376 9.459 178 HB3 SER 27 HB3 SER 27 15.454 24.638 10.971 179 HG SER 27 HG SER 27 16.788 27.142 10.755 180 H ARG 28 H ARG 28 17.188 22.644 12.164 181 HA ARG 28 HA ARG 28 17.917 24.042 14.650 182 HB2 ARG 28 HB2 ARG 28 16.210 21.570 14.306 183 HB3 ARG 28 HB3 ARG 28 16.520 22.415 15.817 184 HG2 ARG 28 HG2 ARG 28 14.978 23.432 13.445 185 HG3 ARG 28 HG3 ARG 28 14.343 23.013 15.037 186 HD2 ARG 28 HD2 ARG 28 16.205 25.288 14.362 187 HD3 ARG 28 HD3 ARG 28 14.513 25.415 14.837 188 HE ARG 28 HE ARG 28 15.344 24.342 17.011 189 HH11 ARG 28 HH11 ARG 28 17.243 26.533 15.040 190 HH12 ARG 28 HH12 ARG 28 18.187 27.114 16.375 191 HH21 ARG 28 HH21 ARG 28 16.581 25.120 18.768 192 HH22 ARG 28 HH22 ARG 28 17.805 26.324 18.492 193 H SER 29 H SER 29 19.592 22.540 12.620 194 HA SER 29 HA SER 29 20.540 20.174 13.883 195 HB2 SER 29 HB2 SER 29 22.395 20.330 12.247 196 HB3 SER 29 HB3 SER 29 20.820 20.537 11.481 197 HG SER 29 HG SER 29 21.315 22.532 10.974 198 H GLY 30 H GLY 30 21.572 23.536 13.861 199 HA2 GLY 30 HA2 GLY 30 22.851 24.661 15.448 200 HA3 GLY 30 HA3 GLY 30 23.157 23.126 16.253 201 H VAL 31 H VAL 31 23.639 22.880 12.968 202 HA VAL 31 HA VAL 31 26.550 23.097 13.307 203 HB VAL 31 HB VAL 31 24.978 21.455 11.311 204 HG11 VAL 31 HG11 VAL 31 27.942 21.544 11.855 205 HG12 VAL 31 HG12 VAL 31 27.128 22.170 10.422 206 HG13 VAL 31 HG13 VAL 31 27.129 20.438 10.749 207 HG21 VAL 31 HG21 VAL 31 26.522 20.588 13.753 208 HG22 VAL 31 HG22 VAL 31 25.761 19.515 12.579 209 HG23 VAL 31 HG23 VAL 31 24.767 20.577 13.575 210 H LEU 32 H LEU 32 23.880 23.726 11.058 211 HA LEU 32 HA LEU 32 25.542 25.176 9.207 212 HB2 LEU 32 HB2 LEU 32 22.530 25.221 9.373 213 HB3 LEU 32 HB3 LEU 32 23.524 25.637 7.993 214 HG LEU 32 HG LEU 32 23.153 22.880 9.145 215 HD11 LEU 32 HD11 LEU 32 22.184 24.131 6.588 216 HD12 LEU 32 HD12 LEU 32 21.192 23.676 7.974 217 HD13 LEU 32 HD13 LEU 32 22.010 22.432 7.024 218 HD21 LEU 32 HD21 LEU 32 25.389 23.109 8.231 219 HD22 LEU 32 HD22 LEU 32 24.724 23.771 6.735 220 HD23 LEU 32 HD23 LEU 32 24.390 22.097 7.187 221 H THR 33 H THR 33 24.556 27.427 8.528 222 HA THR 33 HA THR 33 24.264 28.992 11.011 223 HB THR 33 HB THR 33 26.350 29.500 9.784 224 HG1 THR 33 HG1 THR 33 26.135 31.647 10.083 225 HG21 THR 33 HG21 THR 33 26.323 30.600 7.645 226 HG22 THR 33 HG22 THR 33 24.561 30.563 7.607 227 HG23 THR 33 HG23 THR 33 25.476 29.058 7.500 228 H ALA 34 H ALA 34 23.113 31.150 10.572 229 HA ALA 34 HA ALA 34 20.461 30.503 9.837 230 HB1 ALA 34 HB1 ALA 34 21.008 32.200 11.528 231 HB2 ALA 34 HB2 ALA 34 19.955 32.841 10.268 232 HB3 ALA 34 HB3 ALA 34 21.671 33.234 10.265 233 H ASP 35 H ASP 35 23.121 31.956 8.114 234 HA ASP 35 HA ASP 35 21.534 33.036 5.988 235 HB2 ASP 35 HB2 ASP 35 23.727 33.972 6.515 236 HB3 ASP 35 HB3 ASP 35 24.496 32.437 6.131 237 H GLN 36 H GLN 36 23.178 30.004 6.582 238 HA GLN 36 HA GLN 36 22.943 28.973 3.944 239 HB2 GLN 36 HB2 GLN 36 23.494 27.725 6.616 240 HB3 GLN 36 HB3 GLN 36 23.271 26.735 5.181 241 HG2 GLN 36 HG2 GLN 36 25.158 27.769 4.109 242 HG3 GLN 36 HG3 GLN 36 25.330 28.914 5.439 243 HE21 GLN 36 HE22 GLN 36 27.195 26.905 4.353 244 HE22 GLN 36 HE21 GLN 36 27.635 25.907 5.694 245 H MET 37 H MET 37 20.804 29.239 6.618 246 HA MET 37 HA MET 37 19.017 27.139 5.890 247 HB2 MET 37 HB2 MET 37 18.524 29.599 7.583 248 HB3 MET 37 HB3 MET 37 17.456 28.209 7.474 249 HG2 MET 37 HG2 MET 37 19.213 26.805 8.419 250 HG3 MET 37 HG3 MET 37 20.257 28.221 8.547 251 HE1 MET 37 HE1 MET 37 20.748 28.371 10.926 252 HE2 MET 37 HE2 MET 37 20.070 26.753 11.116 253 HE3 MET 37 HE3 MET 37 19.625 28.034 12.244 254 H ASP 38 H ASP 38 19.496 30.401 4.839 255 HA ASP 38 HA ASP 38 16.913 30.730 3.654 256 HB2 ASP 38 HB2 ASP 38 18.387 32.649 4.270 257 HB3 ASP 38 HB3 ASP 38 19.479 32.182 2.967 258 H ASP 39 H ASP 39 20.090 29.665 2.530 259 HA ASP 39 HA ASP 39 19.494 29.239 -0.165 260 HB2 ASP 39 HB2 ASP 39 21.274 27.585 1.641 261 HB3 ASP 39 HB3 ASP 39 21.256 27.490 -0.114 262 H MET 40 H MET 40 19.179 27.097 2.616 263 HA MET 40 HA MET 40 18.019 24.881 1.402 264 HB2 MET 40 HB2 MET 40 17.482 26.012 4.160 265 HB3 MET 40 HB3 MET 40 17.071 24.385 3.638 266 HG2 MET 40 HG2 MET 40 19.877 25.466 3.678 267 HG3 MET 40 HG3 MET 40 19.147 24.582 5.016 268 HE1 MET 40 HE1 MET 40 18.567 21.052 3.511 269 HE2 MET 40 HE2 MET 40 17.411 22.381 3.564 270 HE3 MET 40 HE3 MET 40 18.465 22.076 4.944 271 H GLY 41 H GLY 41 16.546 27.869 2.572 272 HA2 GLY 41 HA2 GLY 41 13.854 27.017 2.172 273 HA3 GLY 41 HA3 GLY 41 14.392 28.664 2.447 274 H MET 42 H MET 42 16.129 28.894 0.200 275 HA MET 42 HA MET 42 14.165 29.726 -1.667 276 HB2 MET 42 HB2 MET 42 15.961 30.571 -3.010 277 HB3 MET 42 HB3 MET 42 16.318 30.918 -1.328 278 HG2 MET 42 HG2 MET 42 17.871 29.068 -1.256 279 HG3 MET 42 HG3 MET 42 17.482 28.647 -2.920 280 HE1 MET 42 HE1 MET 42 19.257 31.206 -0.541 281 HE2 MET 42 HE2 MET 42 18.022 32.213 -1.290 282 HE3 MET 42 HE3 MET 42 19.726 32.484 -1.662 283 H MET 43 H MET 43 16.253 26.886 -1.503 284 HA MET 43 HA MET 43 15.730 26.171 -4.238 285 HB2 MET 43 HB2 MET 43 16.990 24.166 -3.772 286 HB3 MET 43 HB3 MET 43 17.841 25.551 -3.126 287 HG2 MET 43 HG2 MET 43 18.087 24.002 -1.456 288 HG3 MET 43 HG3 MET 43 16.686 24.918 -0.903 289 HE1 MET 43 HE1 MET 43 17.227 22.193 0.443 290 HE2 MET 43 HE2 MET 43 15.603 21.505 0.410 291 HE3 MET 43 HE3 MET 43 15.828 23.227 0.721 292 H ALA 44 H ALA 44 14.393 25.495 -1.106 293 HA ALA 44 HA ALA 44 12.769 23.284 -1.939 294 HB1 ALA 44 HB1 ALA 44 13.478 23.577 0.401 295 HB2 ALA 44 HB2 ALA 44 11.722 23.491 0.248 296 HB3 ALA 44 HB3 ALA 44 12.510 25.047 0.503 297 H ASP 45 H ASP 45 12.607 26.545 -2.579 298 HA ASP 45 HA ASP 45 9.713 26.671 -2.752 299 HB2 ASP 45 HB2 ASP 45 10.999 28.697 -2.165 300 HB3 ASP 45 HB3 ASP 45 11.821 28.621 -3.718 301 H SER 46 H SER 46 12.515 26.465 -4.885 302 HA SER 46 HA SER 46 11.006 26.539 -7.300 303 HB2 SER 46 HB2 SER 46 13.400 27.210 -7.148 304 HB3 SER 46 HB3 SER 46 13.827 25.523 -6.862 305 HG SER 46 HG SER 46 12.908 26.773 -9.198 306 H VAL 47 H VAL 47 12.119 24.000 -5.170 307 HA VAL 47 HA VAL 47 11.944 21.823 -6.907 308 HB VAL 47 HB VAL 47 11.592 20.453 -4.799 309 HG11 VAL 47 HG11 VAL 47 13.804 20.806 -5.685 310 HG12 VAL 47 HG12 VAL 47 13.846 20.935 -3.924 311 HG13 VAL 47 HG13 VAL 47 13.884 22.394 -4.917 312 HG21 VAL 47 HG21 VAL 47 11.749 23.165 -3.559 313 HG22 VAL 47 HG22 VAL 47 11.980 21.647 -2.689 314 HG23 VAL 47 HG23 VAL 47 10.428 22.003 -3.446 315 H ASN 48 H ASN 48 9.409 23.116 -4.712 316 HA ASN 48 HA ASN 48 7.527 21.141 -5.493 317 HB2 ASN 48 HB2 ASN 48 5.858 22.528 -4.329 318 HB3 ASN 48 HB3 ASN 48 7.278 22.231 -3.345 319 HD21 ASN 48 HD22 ASN 48 8.502 23.915 -2.673 320 HD22 ASN 48 HD21 ASN 48 8.112 25.566 -2.982 321 H SER 49 H SER 49 8.331 24.324 -6.675 322 HA SER 49 HA SER 49 6.073 24.743 -8.290 323 HB2 SER 49 HB2 SER 49 7.798 26.470 -7.705 324 HB3 SER 49 HB3 SER 49 8.902 25.685 -8.834 325 HG SER 49 HG SER 49 6.524 27.105 -9.350 326 H GLN 50 H GLN 50 9.149 23.109 -8.898 327 HA GLN 50 HA GLN 50 8.454 22.474 -11.618 328 HB2 GLN 50 HB2 GLN 50 10.752 21.622 -9.854 329 HB3 GLN 50 HB3 GLN 50 10.573 21.112 -11.528 330 HG2 GLN 50 HG2 GLN 50 10.697 23.418 -12.271 331 HG3 GLN 50 HG3 GLN 50 10.802 23.969 -10.600 332 HE21 GLN 50 HE22 GLN 50 12.725 23.758 -9.492 333 HE22 GLN 50 HE21 GLN 50 14.207 23.328 -10.269 334 H MET 51 H MET 51 8.480 20.798 -8.525 335 HA MET 51 HA MET 51 8.034 18.211 -9.544 336 HB2 MET 51 HB2 MET 51 8.883 18.519 -7.308 337 HB3 MET 51 HB3 MET 51 7.438 19.396 -6.833 338 HG2 MET 51 HG2 MET 51 6.937 16.700 -7.857 339 HG3 MET 51 HG3 MET 51 7.886 16.763 -6.373 340 HE1 MET 51 HE1 MET 51 5.563 18.381 -3.800 341 HE2 MET 51 HE2 MET 51 6.632 19.359 -4.813 342 HE3 MET 51 HE3 MET 51 7.178 17.796 -4.210 343 H GLN 52 H GLN 52 5.773 20.766 -8.548 344 HA GLN 52 HA GLN 52 3.492 19.072 -8.739 345 HB2 GLN 52 HB2 GLN 52 3.734 22.076 -8.710 346 HB3 GLN 52 HB3 GLN 52 2.194 21.232 -8.770 347 HG2 GLN 52 HG2 GLN 52 2.845 20.067 -6.656 348 HG3 GLN 52 HG3 GLN 52 4.240 21.142 -6.572 349 HE21 GLN 52 HE22 GLN 52 3.906 23.345 -6.179 350 HE22 GLN 52 HE21 GLN 52 2.423 23.933 -5.514 351 H LYS 53 H LYS 53 5.257 21.007 -11.068 352 HA LYS 53 HA LYS 53 3.165 20.653 -13.040 353 HB2 LYS 53 HB2 LYS 53 4.478 21.987 -14.518 354 HB3 LYS 53 HB3 LYS 53 4.442 22.766 -12.950 355 HG2 LYS 53 HG2 LYS 53 6.689 22.005 -12.490 356 HG3 LYS 53 HG3 LYS 53 6.728 21.138 -14.029 357 HD2 LYS 53 HD2 LYS 53 6.401 23.250 -15.219 358 HD3 LYS 53 HD3 LYS 53 6.381 24.112 -13.684 359 HE2 LYS 53 HE2 LYS 53 8.679 23.429 -13.253 360 HE3 LYS 53 HE3 LYS 53 8.702 22.511 -14.757 361 HZ1 LYS 53 HZ1 LYS 53 8.322 25.450 -14.551 362 HZ2 LYS 53 HZ2 LYS 53 8.413 24.554 -15.983 363 HZ3 LYS 53 HZ3 LYS 53 9.766 24.681 -14.981 364 H MET 54 H MET 54 5.532 18.746 -11.799 365 HA MET 54 HA MET 54 6.374 17.346 -14.136 366 HB2 MET 54 HB2 MET 54 7.579 17.090 -12.000 367 HB3 MET 54 HB3 MET 54 6.148 16.381 -11.269 368 HG2 MET 54 HG2 MET 54 6.312 14.580 -13.048 369 HG3 MET 54 HG3 MET 54 7.915 15.217 -13.394 370 HE1 MET 54 HE1 MET 54 9.723 14.633 -9.926 371 HE2 MET 54 HE2 MET 54 8.788 16.073 -10.333 372 HE3 MET 54 HE3 MET 54 9.859 15.349 -11.533 373 H GLY 55 H GLY 55 3.694 17.120 -11.898 374 HA2 GLY 55 HA2 GLY 55 1.523 16.429 -12.651 375 HA3 GLY 55 HA3 GLY 55 2.311 15.351 -13.798 376 HA PRO 56 HA PRO 56 1.482 13.194 -9.612 377 HB2 PRO 56 HB2 PRO 56 -1.028 12.267 -9.863 378 HB3 PRO 56 HB3 PRO 56 -0.691 13.877 -9.218 379 HG2 PRO 56 HG2 PRO 56 -1.549 13.083 -11.974 380 HG3 PRO 56 HG3 PRO 56 -2.124 14.425 -10.968 381 HD2 PRO 56 HD2 PRO 56 -0.295 14.729 -12.969 382 HD3 PRO 56 HD3 PRO 56 -0.353 15.772 -11.536 383 H ASN 57 H ASN 57 2.368 12.580 -12.398 384 HA ASN 57 HA ASN 57 2.437 9.737 -12.222 385 HB2 ASN 57 HB2 ASN 57 0.216 10.740 -13.516 386 HB3 ASN 57 HB3 ASN 57 1.337 10.456 -14.844 387 HD21 ASN 57 HD22 ASN 57 -0.424 8.999 -12.219 388 HD22 ASN 57 HD21 ASN 57 -0.313 7.371 -12.785 389 HA PRO 58 HA PRO 58 6.001 12.049 -13.941 390 HB2 PRO 58 HB2 PRO 58 7.897 10.354 -12.969 391 HB3 PRO 58 HB3 PRO 58 7.173 11.660 -12.025 392 HG2 PRO 58 HG2 PRO 58 6.514 8.742 -12.040 393 HG3 PRO 58 HG3 PRO 58 6.666 9.847 -10.660 394 HD2 PRO 58 HD2 PRO 58 4.270 9.130 -11.661 395 HD3 PRO 58 HD3 PRO 58 4.564 10.746 -10.987 396 HA PRO 59 HA PRO 59 6.364 9.328 -17.489 397 HB2 PRO 59 HB2 PRO 59 7.384 11.161 -19.172 398 HB3 PRO 59 HB3 PRO 59 5.681 11.178 -18.698 399 HG2 PRO 59 HG2 PRO 59 7.945 12.858 -17.709 400 HG3 PRO 59 HG3 PRO 59 6.268 13.320 -18.053 401 HD2 PRO 59 HD2 PRO 59 7.261 12.798 -15.536 402 HD3 PRO 59 HD3 PRO 59 5.549 12.679 -15.985 403 H GLN 60 H GLN 60 8.288 9.021 -15.489 404 HA GLN 60 HA GLN 60 10.318 8.096 -15.169 405 HB2 GLN 60 HB2 GLN 60 10.264 7.938 -18.177 406 HB3 GLN 60 HB3 GLN 60 11.554 7.250 -17.201 407 HG2 GLN 60 HG2 GLN 60 9.899 5.846 -16.042 408 HG3 GLN 60 HG3 GLN 60 8.640 6.501 -17.089 409 HE21 GLN 60 HE22 GLN 60 9.610 3.749 -16.757 410 HE22 GLN 60 HE21 GLN 60 10.090 3.228 -18.331 411 H HIS 61 H HIS 61 11.015 9.990 -18.126 412 HA HIS 61 HA HIS 61 13.659 10.480 -17.395 413 HB2 HIS 61 HB2 HIS 61 13.776 12.020 -19.248 414 HB3 HIS 61 HB3 HIS 61 12.801 10.634 -19.708 415 HD1 HIS 61 HD1 HIS 61 10.281 11.055 -20.166 416 HD2 HIS 61 HD2 HIS 61 12.435 14.469 -19.160 417 HE1 HIS 61 HE1 HIS 61 8.778 12.996 -20.717 418 H ARG 62 H ARG 62 10.830 12.171 -16.357 419 HA ARG 62 HA ARG 62 12.155 14.615 -15.693 420 HB2 ARG 62 HB2 ARG 62 9.470 13.539 -15.405 421 HB3 ARG 62 HB3 ARG 62 9.967 14.699 -14.169 422 HG2 ARG 62 HG2 ARG 62 10.676 16.246 -15.965 423 HG3 ARG 62 HG3 ARG 62 10.042 15.106 -17.152 424 HD2 ARG 62 HD2 ARG 62 7.861 15.316 -16.229 425 HD3 ARG 62 HD3 ARG 62 8.455 16.372 -14.958 426 HE ARG 62 HE ARG 62 9.176 17.594 -17.304 427 HH11 ARG 62 HH11 ARG 62 6.129 16.552 -15.922 428 HH12 ARG 62 HH12 ARG 62 5.226 17.854 -16.621 429 HH21 ARG 62 HH21 ARG 62 7.992 19.295 -18.232 430 HH22 ARG 62 HH22 ARG 62 6.283 19.410 -17.957 431 H LEU 63 H LEU 63 11.918 11.550 -14.205 432 HA LEU 63 HA LEU 63 12.188 12.454 -11.492 433 HB2 LEU 63 HB2 LEU 63 12.629 9.716 -12.684 434 HB3 LEU 63 HB3 LEU 63 12.497 10.082 -10.973 435 HG LEU 63 HG LEU 63 10.300 10.465 -13.007 436 HD11 LEU 63 HD11 LEU 63 10.758 8.109 -12.596 437 HD12 LEU 63 HD12 LEU 63 9.219 8.589 -11.883 438 HD13 LEU 63 HD13 LEU 63 10.635 8.381 -10.858 439 HD21 LEU 63 HD21 LEU 63 8.904 10.823 -10.983 440 HD22 LEU 63 HD22 LEU 63 10.099 12.088 -11.261 441 HD23 LEU 63 HD23 LEU 63 10.381 10.863 -10.022 442 H ARG 64 H ARG 64 14.346 11.141 -13.965 443 HA ARG 64 HA ARG 64 16.621 11.008 -12.276 444 HB2 ARG 64 HB2 ARG 64 17.893 10.551 -14.231 445 HB3 ARG 64 HB3 ARG 64 16.381 9.669 -14.311 446 HG2 ARG 64 HG2 ARG 64 15.500 11.280 -15.891 447 HG3 ARG 64 HG3 ARG 64 16.997 12.219 -15.781 448 HD2 ARG 64 HD2 ARG 64 18.242 10.235 -16.524 449 HD3 ARG 64 HD3 ARG 64 16.721 9.382 -16.730 450 HE ARG 64 HE ARG 64 17.617 11.689 -18.330 451 HH11 ARG 64 HH11 ARG 64 15.505 8.933 -17.886 452 HH12 ARG 64 HH12 ARG 64 14.980 8.893 -19.540 453 HH21 ARG 64 HH21 ARG 64 16.925 11.662 -20.509 454 HH22 ARG 64 HH22 ARG 64 15.794 10.456 -21.034 455 H ALA 65 H ALA 65 15.045 13.572 -13.771 456 HA ALA 65 HA ALA 65 17.391 15.274 -13.883 457 HB1 ALA 65 HB1 ALA 65 15.674 15.466 -15.619 458 HB2 ALA 65 HB2 ALA 65 15.881 16.979 -14.735 459 HB3 ALA 65 HB3 ALA 65 14.496 15.941 -14.394 460 H MET 66 H MET 66 14.323 15.151 -12.047 461 HA MET 66 HA MET 66 14.925 17.538 -10.627 462 HB2 MET 66 HB2 MET 66 12.790 15.464 -10.307 463 HB3 MET 66 HB3 MET 66 12.967 16.783 -9.159 464 HG2 MET 66 HG2 MET 66 12.953 18.236 -11.359 465 HG3 MET 66 HG3 MET 66 12.091 16.838 -11.994 466 HE1 MET 66 HE1 MET 66 10.660 19.358 -8.402 467 HE2 MET 66 HE2 MET 66 12.187 19.603 -9.251 468 HE3 MET 66 HE3 MET 66 11.953 18.172 -8.246 469 H ASN 67 H ASN 67 15.588 14.157 -9.913 470 HA ASN 67 HA ASN 67 15.980 14.488 -7.136 471 HB2 ASN 67 HB2 ASN 67 17.173 12.408 -7.142 472 HB3 ASN 67 HB3 ASN 67 15.854 12.257 -8.291 473 HD21 ASN 67 HD22 ASN 67 16.299 11.837 -10.387 474 HD22 ASN 67 HD21 ASN 67 17.900 11.611 -11.012 475 H THR 68 H THR 68 18.063 14.996 -9.909 476 HA THR 68 HA THR 68 20.403 15.537 -8.358 477 HB THR 68 HB THR 68 19.846 16.211 -11.255 478 HG1 THR 68 HG1 THR 68 20.183 13.827 -9.998 479 HG21 THR 68 HG21 THR 68 22.280 16.148 -11.500 480 HG22 THR 68 HG22 THR 68 22.453 15.827 -9.775 481 HG23 THR 68 HG23 THR 68 21.800 17.371 -10.323 482 H ALA 69 H ALA 69 17.749 17.389 -9.649 483 HA ALA 69 HA ALA 69 18.843 19.952 -9.577 484 HB1 ALA 69 HB1 ALA 69 16.553 20.765 -9.472 485 HB2 ALA 69 HB2 ALA 69 15.985 19.158 -9.015 486 HB3 ALA 69 HB3 ALA 69 16.684 19.427 -10.614 487 H MET 70 H MET 70 16.971 18.267 -7.043 488 HA MET 70 HA MET 70 17.290 20.351 -5.143 489 HB2 MET 70 HB2 MET 70 15.473 18.645 -5.100 490 HB3 MET 70 HB3 MET 70 16.656 17.434 -4.638 491 HG2 MET 70 HG2 MET 70 16.497 19.876 -2.974 492 HG3 MET 70 HG3 MET 70 15.158 18.739 -2.868 493 HE1 MET 70 HE1 MET 70 16.282 15.895 -3.060 494 HE2 MET 70 HE2 MET 70 15.244 16.449 -1.744 495 HE3 MET 70 HE3 MET 70 16.725 15.564 -1.383 496 H ALA 71 H ALA 71 18.943 17.296 -5.708 497 HA ALA 71 HA ALA 71 20.641 17.277 -3.495 498 HB1 ALA 71 HB1 ALA 71 20.276 15.370 -4.996 499 HB2 ALA 71 HB2 ALA 71 21.989 15.700 -4.735 500 HB3 ALA 71 HB3 ALA 71 21.216 16.188 -6.245 501 H ALA 72 H ALA 72 20.958 18.911 -6.604 502 HA ALA 72 HA ALA 72 23.702 19.626 -6.239 503 HB1 ALA 72 HB1 ALA 72 22.691 19.421 -8.466 504 HB2 ALA 72 HB2 ALA 72 23.423 21.005 -8.213 505 HB3 ALA 72 HB3 ALA 72 21.671 20.818 -8.120 506 H GLU 73 H GLU 73 20.630 21.148 -5.492 507 HA GLU 73 HA GLU 73 21.783 23.739 -5.086 508 HB2 GLU 73 HB2 GLU 73 19.083 22.676 -4.260 509 HB3 GLU 73 HB3 GLU 73 19.570 24.366 -4.220 510 HG2 GLU 73 HG2 GLU 73 19.189 22.612 -6.626 511 HG3 GLU 73 HG3 GLU 73 18.268 24.044 -6.172 512 H VAL 74 H VAL 74 20.891 21.030 -3.011 513 HA VAL 74 HA VAL 74 21.526 22.461 -0.596 514 HB VAL 74 HB VAL 74 21.359 20.250 0.518 515 HG11 VAL 74 HG11 VAL 74 19.392 21.650 0.284 516 HG12 VAL 74 HG12 VAL 74 18.950 19.951 0.122 517 HG13 VAL 74 HG13 VAL 74 19.077 20.970 -1.310 518 HG21 VAL 74 HG21 VAL 74 20.542 18.326 -0.761 519 HG22 VAL 74 HG22 VAL 74 22.151 18.831 -1.281 520 HG23 VAL 74 HG23 VAL 74 20.738 19.250 -2.251 521 H ALA 75 H ALA 75 23.291 20.777 -2.959 522 HA ALA 75 HA ALA 75 25.522 19.973 -1.417 523 HB1 ALA 75 HB1 ALA 75 25.070 19.105 -3.670 524 HB2 ALA 75 HB2 ALA 75 26.696 19.774 -3.530 525 HB3 ALA 75 HB3 ALA 75 25.430 20.696 -4.342 526 H GLU 76 H GLU 76 24.559 23.000 -2.824 527 HA GLU 76 HA GLU 76 27.036 24.269 -2.980 528 HB2 GLU 76 HB2 GLU 76 24.331 25.499 -2.436 529 HB3 GLU 76 HB3 GLU 76 25.764 26.375 -2.957 530 HG2 GLU 76 HG2 GLU 76 24.234 24.301 -4.506 531 HG3 GLU 76 HG3 GLU 76 24.366 26.026 -4.852 532 H VAL 77 H VAL 77 24.701 24.213 -0.275 533 HA VAL 77 HA VAL 77 26.233 25.924 1.388 534 HB VAL 77 HB VAL 77 24.832 25.203 3.241 535 HG11 VAL 77 HG11 VAL 77 23.288 25.587 0.688 536 HG12 VAL 77 HG12 VAL 77 23.921 26.854 1.738 537 HG13 VAL 77 HG13 VAL 77 22.634 25.793 2.313 538 HG21 VAL 77 HG21 VAL 77 23.740 23.126 1.345 539 HG22 VAL 77 HG22 VAL 77 23.090 23.503 2.941 540 HG23 VAL 77 HG23 VAL 77 24.708 22.819 2.789 541 H VAL 78 H VAL 78 26.356 22.526 0.723 542 HA VAL 78 HA VAL 78 27.914 21.782 2.995 543 HB VAL 78 HB VAL 78 27.726 20.359 0.328 544 HG11 VAL 78 HG11 VAL 78 28.294 18.362 1.640 545 HG12 VAL 78 HG12 VAL 78 28.483 19.370 3.076 546 HG13 VAL 78 HG13 VAL 78 29.569 19.578 1.700 547 HG21 VAL 78 HG21 VAL 78 26.020 20.032 2.798 548 HG22 VAL 78 HG22 VAL 78 25.951 19.018 1.354 549 HG23 VAL 78 HG23 VAL 78 25.500 20.722 1.259 550 H ALA 79 H ALA 79 28.641 22.711 -0.340 551 HA ALA 79 HA ALA 79 31.449 22.355 -0.160 552 HB1 ALA 79 HB1 ALA 79 30.264 22.480 -2.301 553 HB2 ALA 79 HB2 ALA 79 31.568 23.664 -2.207 554 HB3 ALA 79 HB3 ALA 79 29.894 24.176 -1.992 555 H THR 80 H THR 80 29.291 24.984 0.650 556 HA THR 80 HA THR 80 31.223 27.016 1.001 557 HB THR 80 HB THR 80 28.563 26.722 2.422 558 HG1 THR 80 HG1 THR 80 27.759 27.954 0.647 559 HG21 THR 80 HG21 THR 80 28.615 29.173 2.530 560 HG22 THR 80 HG22 THR 80 30.212 29.172 1.781 561 HG23 THR 80 HG23 THR 80 29.988 28.465 3.380 562 H SER 81 H SER 81 30.452 24.241 2.835 563 HA SER 81 HA SER 81 31.353 25.301 5.363 564 HB2 SER 81 HB2 SER 81 30.626 22.474 4.567 565 HB3 SER 81 HB3 SER 81 30.875 23.055 6.217 566 HG SER 81 HG SER 81 28.813 23.741 4.396 567 HA PRO 82 HA PRO 82 35.644 24.271 4.684 568 HB2 PRO 82 HB2 PRO 82 35.895 24.289 7.613 569 HB3 PRO 82 HB3 PRO 82 36.668 25.333 6.419 570 HG2 PRO 82 HG2 PRO 82 34.735 26.236 8.058 571 HG3 PRO 82 HG3 PRO 82 34.916 26.833 6.397 572 HD2 PRO 82 HD2 PRO 82 32.966 24.842 7.493 573 HD3 PRO 82 HD3 PRO 82 32.711 26.139 6.308 574 HA PRO 83 HA PRO 83 35.924 19.878 5.467 575 HB2 PRO 83 HB2 PRO 83 38.843 20.179 5.522 576 HB3 PRO 83 HB3 PRO 83 37.830 19.300 4.374 577 HG2 PRO 83 HG2 PRO 83 39.087 21.569 3.690 578 HG3 PRO 83 HG3 PRO 83 37.482 21.163 3.054 579 HD2 PRO 83 HD2 PRO 83 38.220 23.039 5.272 580 HD3 PRO 83 HD3 PRO 83 37.043 23.252 3.959 581 H GLN 84 H GLN 84 36.072 21.865 7.793 582 HA GLN 84 HA GLN 84 37.264 19.978 9.710 583 HB2 GLN 84 HB2 GLN 84 37.043 22.990 9.911 584 HB3 GLN 84 HB3 GLN 84 37.561 21.944 11.227 585 HG2 GLN 84 HG2 GLN 84 39.499 21.253 9.978 586 HG3 GLN 84 HG3 GLN 84 38.952 22.153 8.566 587 HE21 GLN 84 HE22 GLN 84 40.858 23.355 8.526 588 HE22 GLN 84 HE21 GLN 84 41.174 24.617 9.670 589 H SER 85 H SER 85 34.503 21.271 8.467 590 HA SER 85 HA SER 85 32.932 20.362 10.769 591 HB2 SER 85 HB2 SER 85 32.279 22.872 9.193 592 HB3 SER 85 HB3 SER 85 31.445 22.265 10.624 593 HG SER 85 HG SER 85 33.489 22.573 11.746 594 H TYR 86 H TYR 86 33.776 19.446 8.013 595 HA TYR 86 HA TYR 86 31.520 19.826 6.278 596 HB2 TYR 86 HB2 TYR 86 33.841 19.696 5.434 597 HB3 TYR 86 HB3 TYR 86 33.932 18.022 5.970 598 HD1 TYR 86 HD1 TYR 86 32.704 16.272 4.789 599 HD2 TYR 86 HD2 TYR 86 32.604 20.308 3.453 600 HE1 TYR 86 HE1 TYR 86 31.794 15.530 2.625 601 HE2 TYR 86 HE2 TYR 86 31.685 19.579 1.293 602 HH TYR 86 HH TYR 86 31.706 17.392 -0.092 603 H SER 87 H SER 87 32.930 17.045 8.022 604 HA SER 87 HA SER 87 31.018 15.184 7.074 605 HB2 SER 87 HB2 SER 87 32.585 15.034 9.658 606 HB3 SER 87 HB3 SER 87 31.855 13.690 8.782 607 HG SER 87 HG SER 87 34.245 14.918 8.393 608 H ALA 88 H ALA 88 31.021 17.467 9.686 609 HA ALA 88 HA ALA 88 28.813 16.424 11.134 610 HB1 ALA 88 HB1 ALA 88 30.326 18.052 12.133 611 HB2 ALA 88 HB2 ALA 88 28.673 18.666 12.139 612 HB3 ALA 88 HB3 ALA 88 29.830 19.263 10.952 613 H VAL 89 H VAL 89 29.138 18.802 8.551 614 HA VAL 89 HA VAL 89 26.380 19.406 8.303 615 HB VAL 89 HB VAL 89 28.657 19.666 6.329 616 HG11 VAL 89 HG11 VAL 89 26.548 19.538 5.116 617 HG12 VAL 89 HG12 VAL 89 27.189 21.181 5.064 618 HG13 VAL 89 HG13 VAL 89 25.858 20.786 6.154 619 HG21 VAL 89 HG21 VAL 89 27.280 21.701 8.079 620 HG22 VAL 89 HG22 VAL 89 28.558 22.045 6.913 621 HG23 VAL 89 HG23 VAL 89 28.897 21.040 8.322 622 H LEU 90 H LEU 90 28.540 17.116 6.727 623 HA LEU 90 HA LEU 90 26.814 16.113 4.780 624 HB2 LEU 90 HB2 LEU 90 29.362 15.691 5.306 625 HB3 LEU 90 HB3 LEU 90 28.746 14.312 6.193 626 HG LEU 90 HG LEU 90 28.124 14.786 3.282 627 HD11 LEU 90 HD11 LEU 90 30.562 14.599 3.682 628 HD12 LEU 90 HD12 LEU 90 29.891 13.300 2.700 629 HD13 LEU 90 HD13 LEU 90 30.280 13.013 4.397 630 HD21 LEU 90 HD21 LEU 90 27.691 12.355 3.296 631 HD22 LEU 90 HD22 LEU 90 26.592 13.259 4.341 632 HD23 LEU 90 HD23 LEU 90 27.930 12.348 5.045 633 H ASN 91 H ASN 91 27.432 14.917 8.074 634 HA ASN 91 HA ASN 91 25.564 12.813 7.975 635 HB2 ASN 91 HB2 ASN 91 26.726 14.316 10.326 636 HB3 ASN 91 HB3 ASN 91 25.691 12.902 10.493 637 HD21 ASN 91 HD22 ASN 91 28.434 13.266 11.334 638 HD22 ASN 91 HD21 ASN 91 29.357 12.044 10.537 639 H THR 92 H THR 92 25.271 16.189 8.947 640 HA THR 92 HA THR 92 22.692 16.103 10.026 641 HB THR 92 HB THR 92 24.035 18.356 8.512 642 HG1 THR 92 HG1 THR 92 25.191 17.839 10.372 643 HG21 THR 92 HG21 THR 92 22.451 19.833 9.655 644 HG22 THR 92 HG22 THR 92 21.646 18.428 10.359 645 HG23 THR 92 HG23 THR 92 21.614 18.680 8.612 646 H ILE 93 H ILE 93 23.685 16.975 6.710 647 HA ILE 93 HA ILE 93 21.148 17.237 5.597 648 HB ILE 93 HB ILE 93 23.630 16.200 4.219 649 HG12 ILE 93 HG12 ILE 93 24.023 18.346 5.340 650 HG13 ILE 93 HG13 ILE 93 24.039 18.528 3.591 651 HG21 ILE 93 HG21 ILE 93 21.555 15.840 2.937 652 HG22 ILE 93 HG22 ILE 93 22.630 17.002 2.160 653 HG23 ILE 93 HG23 ILE 93 21.209 17.567 3.039 654 HD11 ILE 93 HD11 ILE 93 22.878 20.374 4.641 655 HD12 ILE 93 HD12 ILE 93 21.768 19.255 5.433 656 HD13 ILE 93 HD13 ILE 93 21.755 19.414 3.676 657 H GLY 94 H GLY 94 23.167 14.368 5.964 658 HA2 GLY 94 HA2 GLY 94 21.503 12.591 4.530 659 HA3 GLY 94 HA3 GLY 94 22.714 12.127 5.706 660 H ALA 95 H ALA 95 21.739 13.275 7.980 661 HA ALA 95 HA ALA 95 19.820 11.363 8.786 662 HB1 ALA 95 HB1 ALA 95 19.820 12.528 10.932 663 HB2 ALA 95 HB2 ALA 95 20.687 13.879 10.202 664 HB3 ALA 95 HB3 ALA 95 21.464 12.302 10.332 665 H CYS 96 H CYS 96 19.611 14.792 8.005 666 HA CYS 96 HA CYS 96 16.857 15.027 8.749 667 HB2 CYS 96 HB2 CYS 96 18.640 16.879 7.161 668 HB3 CYS 96 HB3 CYS 96 17.033 17.283 7.744 669 H LEU 97 H LEU 97 18.252 13.553 6.139 670 HA LEU 97 HA LEU 97 15.980 14.134 4.388 671 HB2 LEU 97 HB2 LEU 97 18.473 14.065 3.654 672 HB3 LEU 97 HB3 LEU 97 18.303 12.326 3.759 673 HG LEU 97 HG LEU 97 18.091 13.324 1.464 674 HD11 LEU 97 HD11 LEU 97 16.197 11.926 0.789 675 HD12 LEU 97 HD12 LEU 97 15.751 11.729 2.485 676 HD13 LEU 97 HD13 LEU 97 17.286 11.088 1.894 677 HD21 LEU 97 HD21 LEU 97 15.429 14.274 2.498 678 HD22 LEU 97 HD22 LEU 97 15.999 14.363 0.833 679 HD23 LEU 97 HD23 LEU 97 16.802 15.304 2.091 680 H ARG 98 H ARG 98 17.511 11.694 6.327 681 HA ARG 98 HA ARG 98 16.150 9.416 5.450 682 HB2 ARG 98 HB2 ARG 98 18.229 9.467 6.753 683 HB3 ARG 98 HB3 ARG 98 17.336 10.067 8.141 684 HG2 ARG 98 HG2 ARG 98 16.105 8.001 8.284 685 HG3 ARG 98 HG3 ARG 98 16.902 7.402 6.822 686 HD2 ARG 98 HD2 ARG 98 18.169 6.460 8.522 687 HD3 ARG 98 HD3 ARG 98 19.073 7.906 8.066 688 HE ARG 98 HE ARG 98 17.246 8.344 10.235 689 HH11 ARG 98 HH11 ARG 98 20.446 7.245 9.366 690 HH12 ARG 98 HH12 ARG 98 21.131 7.573 10.926 691 HH21 ARG 98 HH21 ARG 98 18.138 8.801 12.301 692 HH22 ARG 98 HH22 ARG 98 19.816 8.470 12.599 693 H GLU 99 H GLU 99 15.655 11.170 8.513 694 HA GLU 99 HA GLU 99 13.285 9.778 9.129 695 HB2 GLU 99 HB2 GLU 99 12.958 11.736 10.796 696 HB3 GLU 99 HB3 GLU 99 14.283 10.617 11.008 697 HG2 GLU 99 HG2 GLU 99 15.109 12.776 11.457 698 HG3 GLU 99 HG3 GLU 99 15.774 12.285 9.904 699 H SER 100 H SER 100 13.828 12.849 7.561 700 HA SER 100 HA SER 100 11.167 13.681 7.361 701 HB2 SER 100 HB2 SER 100 13.530 14.184 5.550 702 HB3 SER 100 HB3 SER 100 11.985 15.019 5.405 703 HG SER 100 HG SER 100 13.744 15.031 7.648 704 H MET 101 H MET 101 13.019 11.434 5.361 705 HA MET 101 HA MET 101 11.212 11.241 3.218 706 HB2 MET 101 HB2 MET 101 13.560 10.415 3.205 707 HB3 MET 101 HB3 MET 101 13.058 9.088 4.246 708 HG2 MET 101 HG2 MET 101 11.538 8.317 2.566 709 HG3 MET 101 HG3 MET 101 11.951 9.680 1.534 710 HE1 MET 101 HE1 MET 101 12.547 8.588 -0.432 711 HE2 MET 101 HE2 MET 101 12.019 7.031 0.206 712 HE3 MET 101 HE3 MET 101 13.568 7.163 -0.631 713 H MET 102 H MET 102 11.591 9.172 6.114 714 HA MET 102 HA MET 102 9.266 7.634 5.514 715 HB2 MET 102 HB2 MET 102 9.452 6.760 7.807 716 HB3 MET 102 HB3 MET 102 10.963 6.663 6.920 717 HG2 MET 102 HG2 MET 102 11.973 8.297 8.198 718 HG3 MET 102 HG3 MET 102 10.434 8.977 8.727 719 HE1 MET 102 HE1 MET 102 10.884 5.220 8.523 720 HE2 MET 102 HE2 MET 102 11.490 4.733 10.111 721 HE3 MET 102 HE3 MET 102 12.558 5.557 8.975 722 H GLN 103 H GLN 103 9.801 10.659 7.084 723 HA GLN 103 HA GLN 103 7.391 10.821 8.564 724 HB2 GLN 103 HB2 GLN 103 9.608 12.393 8.327 725 HB3 GLN 103 HB3 GLN 103 8.442 13.323 7.398 726 HG2 GLN 103 HG2 GLN 103 8.419 14.121 9.641 727 HG3 GLN 103 HG3 GLN 103 6.912 13.253 9.352 728 HE21 GLN 103 HE22 GLN 103 10.004 11.689 9.885 729 HE22 GLN 103 HE21 GLN 103 9.604 11.011 11.426 730 H ALA 104 H ALA 104 8.198 11.206 5.231 731 HA ALA 104 HA ALA 104 5.767 12.525 4.473 732 HB1 ALA 104 HB1 ALA 104 7.818 12.811 3.177 733 HB2 ALA 104 HB2 ALA 104 6.527 12.133 2.183 734 HB3 ALA 104 HB3 ALA 104 7.817 11.091 2.787 735 H THR 105 H THR 105 7.064 9.290 3.717 736 HA THR 105 HA THR 105 4.932 7.738 4.435 737 HB THR 105 HB THR 105 3.517 9.076 2.926 738 HG1 THR 105 HG1 THR 105 2.726 7.057 3.025 739 HG21 THR 105 HG21 THR 105 5.319 8.041 0.737 740 HG22 THR 105 HG22 THR 105 5.194 9.716 1.273 741 HG23 THR 105 HG23 THR 105 3.819 8.934 0.495 742 H GLY 106 H GLY 106 7.599 8.340 2.321 743 HA2 GLY 106 HA2 GLY 106 7.542 5.693 1.139 744 HA3 GLY 106 HA3 GLY 106 8.683 6.973 0.771 745 H SER 107 H SER 107 8.143 6.067 4.085 746 HA SER 107 HA SER 107 9.599 5.358 5.681 747 HB2 SER 107 HB2 SER 107 10.483 3.087 5.314 748 HB3 SER 107 HB3 SER 107 8.805 3.216 4.798 749 HG SER 107 HG SER 107 10.309 3.804 2.703 750 H VAL 108 H VAL 108 12.097 3.847 5.105 751 HA VAL 108 HA VAL 108 13.702 6.066 4.035 752 HB VAL 108 HB VAL 108 14.614 4.001 6.048 753 HG11 VAL 108 HG11 VAL 108 16.611 5.354 6.235 754 HG12 VAL 108 HG12 VAL 108 15.969 6.511 5.069 755 HG13 VAL 108 HG13 VAL 108 16.372 4.872 4.554 756 HG21 VAL 108 HG21 VAL 108 12.974 5.549 7.010 757 HG22 VAL 108 HG22 VAL 108 13.949 6.915 6.464 758 HG23 VAL 108 HG23 VAL 108 14.585 5.805 7.679 759 H ASP 109 H ASP 109 14.004 5.481 1.965 760 HA ASP 109 HA ASP 109 14.394 2.733 1.205 761 HB2 ASP 109 HB2 ASP 109 13.199 4.225 -0.306 762 HB3 ASP 109 HB3 ASP 109 14.606 5.277 -0.419 763 H ASN 110 H ASN 110 16.261 1.813 0.329 764 HA ASN 110 HA ASN 110 18.629 2.723 1.717 765 HB2 ASN 110 HB2 ASN 110 18.272 0.296 -0.054 766 HB3 ASN 110 HB3 ASN 110 19.609 0.597 1.050 767 HD21 ASN 110 HD22 ASN 110 16.296 -0.354 0.746 768 HD22 ASN 110 HD21 ASN 110 16.089 -0.885 2.378 769 H ALA 111 H ALA 111 17.373 3.007 -1.452 770 HA ALA 111 HA ALA 111 20.053 3.375 -2.601 771 HB1 ALA 111 HB1 ALA 111 18.941 3.279 -4.773 772 HB2 ALA 111 HB2 ALA 111 17.372 3.163 -3.973 773 HB3 ALA 111 HB3 ALA 111 18.552 1.861 -3.796 774 H PHE 112 H PHE 112 16.897 5.005 -2.357 775 HA PHE 112 HA PHE 112 17.614 7.323 -3.761 776 HB2 PHE 112 HB2 PHE 112 15.286 6.688 -3.223 777 HB3 PHE 112 HB3 PHE 112 15.585 7.083 -1.535 778 HD1 PHE 112 HD2 PHE 112 15.575 8.557 -4.941 779 HD2 PHE 112 HD1 PHE 112 15.243 9.257 -0.757 780 HE1 PHE 112 HE2 PHE 112 14.929 10.886 -5.389 781 HE2 PHE 112 HE1 PHE 112 14.594 11.591 -1.195 782 HZ PHE 112 HZ PHE 112 14.436 12.409 -3.516 783 H THR 113 H THR 113 17.654 6.738 -0.232 784 HA THR 113 HA THR 113 18.545 9.301 0.491 785 HB THR 113 HB THR 113 19.348 8.217 2.601 786 HG1 THR 113 HG1 THR 113 18.189 5.785 1.906 787 HG21 THR 113 HG21 THR 113 16.584 7.396 1.689 788 HG22 THR 113 HG22 THR 113 17.022 8.960 2.373 789 HG23 THR 113 HG23 THR 113 17.129 7.506 3.363 790 H ASN 114 H ASN 114 20.301 6.359 -0.299 791 HA ASN 114 HA ASN 114 22.908 7.354 0.135 792 HB2 ASN 114 HB2 ASN 114 22.697 5.015 0.080 793 HB3 ASN 114 HB3 ASN 114 21.763 5.044 -1.410 794 HD21 ASN 114 HD22 ASN 114 22.793 5.049 -3.345 795 HD22 ASN 114 HD21 ASN 114 24.499 4.842 -3.515 796 H GLU 115 H GLU 115 20.809 7.277 -2.707 797 HA GLU 115 HA GLU 115 22.631 8.169 -4.606 798 HB2 GLU 115 HB2 GLU 115 20.535 7.085 -5.145 799 HB3 GLU 115 HB3 GLU 115 19.629 8.383 -4.381 800 HG2 GLU 115 HG2 GLU 115 20.233 9.904 -6.049 801 HG3 GLU 115 HG3 GLU 115 21.421 8.794 -6.721 802 H VAL 116 H VAL 116 20.230 9.934 -2.647 803 HA VAL 116 HA VAL 116 20.849 12.524 -3.502 804 HB VAL 116 HB VAL 116 19.933 11.628 -0.756 805 HG11 VAL 116 HG11 VAL 116 19.929 14.372 -2.013 806 HG12 VAL 116 HG12 VAL 116 20.885 13.852 -0.626 807 HG13 VAL 116 HG13 VAL 116 19.130 13.951 -0.500 808 HG21 VAL 116 HG21 VAL 116 18.393 10.977 -2.514 809 HG22 VAL 116 HG22 VAL 116 18.394 12.621 -3.152 810 HG23 VAL 116 HG23 VAL 116 17.704 12.292 -1.561 811 H MET 117 H MET 117 22.194 10.633 -0.802 812 HA MET 117 HA MET 117 24.010 12.523 0.134 813 HB2 MET 117 HB2 MET 117 24.026 9.524 0.170 814 HB3 MET 117 HB3 MET 117 25.363 10.443 0.844 815 HG2 MET 117 HG2 MET 117 22.499 10.765 1.703 816 HG3 MET 117 HG3 MET 117 23.652 9.694 2.493 817 HE1 MET 117 HE1 MET 117 23.813 13.799 1.431 818 HE2 MET 117 HE2 MET 117 23.087 14.136 3.000 819 HE3 MET 117 HE3 MET 117 22.277 13.052 1.875 820 H GLN 118 H GLN 118 24.566 9.924 -2.214 821 HA GLN 118 HA GLN 118 27.223 10.455 -2.802 822 HB2 GLN 118 HB2 GLN 118 26.058 8.453 -3.574 823 HB3 GLN 118 HB3 GLN 118 25.037 9.425 -4.623 824 HG2 GLN 118 HG2 GLN 118 27.066 10.096 -5.885 825 HG3 GLN 118 HG3 GLN 118 28.004 8.989 -4.884 826 HE21 GLN 118 HE22 GLN 118 27.567 8.976 -7.758 827 HE22 GLN 118 HE21 GLN 118 26.860 7.444 -8.133 828 H LEU 119 H LEU 119 24.322 11.678 -4.455 829 HA LEU 119 HA LEU 119 25.670 13.229 -6.353 830 HB2 LEU 119 HB2 LEU 119 22.903 13.306 -5.218 831 HB3 LEU 119 HB3 LEU 119 23.432 14.525 -6.363 832 HG LEU 119 HG LEU 119 23.751 11.634 -7.055 833 HD11 LEU 119 HD11 LEU 119 21.521 11.638 -8.046 834 HD12 LEU 119 HD12 LEU 119 21.216 13.241 -7.378 835 HD13 LEU 119 HD13 LEU 119 21.435 11.861 -6.300 836 HD21 LEU 119 HD21 LEU 119 23.448 12.503 -9.319 837 HD22 LEU 119 HD22 LEU 119 24.768 13.324 -8.484 838 HD23 LEU 119 HD23 LEU 119 23.208 14.123 -8.664 839 H VAL 120 H VAL 120 24.294 14.195 -3.203 840 HA VAL 120 HA VAL 120 24.931 16.915 -3.434 841 HB VAL 120 HB VAL 120 24.737 15.286 -0.890 842 HG11 VAL 120 HG11 VAL 120 24.306 17.413 0.222 843 HG12 VAL 120 HG12 VAL 120 24.537 18.266 -1.302 844 HG13 VAL 120 HG13 VAL 120 25.890 17.423 -0.551 845 HG21 VAL 120 HG21 VAL 120 22.698 15.152 -2.194 846 HG22 VAL 120 HG22 VAL 120 22.669 16.906 -2.375 847 HG23 VAL 120 HG23 VAL 120 22.441 16.181 -0.782 848 H LYS 121 H LYS 121 26.810 14.275 -1.915 849 HA LYS 121 HA LYS 121 29.008 15.856 -1.152 850 HB2 LYS 121 HB2 LYS 121 28.574 12.938 -1.639 851 HB3 LYS 121 HB3 LYS 121 30.210 13.527 -1.418 852 HG2 LYS 121 HG2 LYS 121 29.279 12.662 0.648 853 HG3 LYS 121 HG3 LYS 121 29.648 14.378 0.771 854 HD2 LYS 121 HD2 LYS 121 26.888 13.577 0.004 855 HD3 LYS 121 HD3 LYS 121 27.388 13.367 1.682 856 HE2 LYS 121 HE2 LYS 121 28.131 15.782 1.639 857 HE3 LYS 121 HE3 LYS 121 27.311 15.914 0.084 858 HZ1 LYS 121 HZ1 LYS 121 25.881 16.639 1.872 859 HZ2 LYS 121 HZ2 LYS 121 26.043 15.148 2.653 860 HZ3 LYS 121 HZ3 LYS 121 25.254 15.238 1.162 861 H MET 122 H MET 122 28.439 13.928 -4.076 862 HA MET 122 HA MET 122 30.971 14.403 -5.226 863 HB2 MET 122 HB2 MET 122 29.705 12.505 -5.920 864 HB3 MET 122 HB3 MET 122 28.334 13.501 -6.374 865 HG2 MET 122 HG2 MET 122 30.850 14.058 -7.790 866 HG3 MET 122 HG3 MET 122 30.108 12.495 -8.115 867 HE1 MET 122 HE1 MET 122 26.609 13.465 -9.509 868 HE2 MET 122 HE2 MET 122 26.961 13.172 -7.806 869 HE3 MET 122 HE3 MET 122 27.700 12.161 -9.046 870 H LEU 123 H LEU 123 28.008 16.245 -5.266 871 HA LEU 123 HA LEU 123 28.981 17.954 -7.413 872 HB2 LEU 123 HB2 LEU 123 26.421 18.002 -5.817 873 HB3 LEU 123 HB3 LEU 123 26.804 19.134 -7.100 874 HG LEU 123 HG LEU 123 26.619 16.151 -7.513 875 HD11 LEU 123 HD11 LEU 123 24.548 18.265 -8.083 876 HD12 LEU 123 HD12 LEU 123 24.462 17.065 -6.792 877 HD13 LEU 123 HD13 LEU 123 24.431 16.550 -8.479 878 HD21 LEU 123 HD21 LEU 123 26.673 18.470 -9.442 879 HD22 LEU 123 HD22 LEU 123 26.476 16.773 -9.876 880 HD23 LEU 123 HD23 LEU 123 27.984 17.327 -9.154 881 H SER 124 H SER 124 29.898 17.788 -4.360 882 HA SER 124 HA SER 124 30.180 20.708 -4.179 883 HB2 SER 124 HB2 SER 124 30.065 20.438 -1.656 884 HB3 SER 124 HB3 SER 124 28.545 20.226 -2.519 885 HG SER 124 HG SER 124 28.667 18.053 -2.229 886 H ALA 125 H ALA 125 31.344 17.746 -2.596 887 HA ALA 125 HA ALA 125 34.045 18.192 -3.419 888 HB1 ALA 125 HB1 ALA 125 35.011 18.493 -1.198 889 HB2 ALA 125 HB2 ALA 125 33.393 18.571 -0.500 890 HB3 ALA 125 HB3 ALA 125 33.937 19.828 -1.610 891 H ASP 126 H ASP 126 34.467 16.156 -3.977 892 HA ASP 126 HA ASP 126 33.306 13.950 -2.512 893 HB2 ASP 126 HB2 ASP 126 33.448 13.908 -4.988 894 HB3 ASP 126 HB3 ASP 126 35.203 13.899 -4.870 895 H SER 127 H SER 127 35.911 15.840 -2.144 896 HA SER 127 HA SER 127 37.879 13.941 -1.252 897 HB2 SER 127 HB2 SER 127 37.732 16.914 -0.745 898 HB3 SER 127 HB3 SER 127 39.161 15.892 -0.621 899 HG SER 127 HG SER 127 38.766 17.198 -2.647 900 H ALA 128 H ALA 128 35.357 13.641 0.057 901 HA ALA 128 HA ALA 128 35.350 14.969 2.566 902 HB1 ALA 128 HB1 ALA 128 33.851 12.465 1.810 903 HB2 ALA 128 HB2 ALA 128 33.303 14.105 1.465 904 HB3 ALA 128 HB3 ALA 128 33.478 13.566 3.138 905 H ASN 129 H ASN 129 37.448 14.578 3.343 906 HA ASN 129 HA ASN 129 37.800 11.915 4.546 907 HB2 ASN 129 HB2 ASN 129 39.606 12.530 2.966 908 HB3 ASN 129 HB3 ASN 129 39.916 13.983 3.906 909 HD21 ASN 129 HD22 ASN 129 40.318 10.561 3.714 910 HD22 ASN 129 HD21 ASN 129 41.389 10.400 5.063 911 H GLU 130 H GLU 130 38.686 15.284 5.045 912 HA GLU 130 HA GLU 130 38.615 16.684 6.806 913 HB2 GLU 130 HB2 GLU 130 36.227 16.112 6.804 914 HB3 GLU 130 HB3 GLU 130 36.552 14.768 7.891 915 HG2 GLU 130 HG2 GLU 130 37.239 16.275 9.626 916 HG3 GLU 130 HG3 GLU 130 37.081 17.654 8.538 917 H VAL 131 H VAL 131 40.706 16.339 7.442 918 HA VAL 131 HA VAL 131 40.959 14.720 9.880 919 HB VAL 131 HB VAL 131 42.147 13.664 7.970 920 HG11 VAL 131 HG11 VAL 131 42.787 15.633 6.720 921 HG12 VAL 131 HG12 VAL 131 44.214 14.677 7.122 922 HG13 VAL 131 HG13 VAL 131 43.852 16.147 8.027 923 HG21 VAL 131 HG21 VAL 131 44.261 13.284 9.141 924 HG22 VAL 131 HG22 VAL 131 42.891 13.258 10.248 925 HG23 VAL 131 HG23 VAL 131 43.939 14.674 10.175 926 H SER 132 H SER 132 42.059 15.645 11.574 927 HA SER 132 HA SER 132 42.155 18.539 11.436 928 HB2 SER 132 HB2 SER 132 42.571 18.165 13.989 929 HB3 SER 132 HB3 SER 132 40.973 17.840 13.308 930 HG SER 132 HG SER 132 42.555 16.171 14.613 931 H THR 133 H THR 133 44.353 16.518 10.484 932 HA THR 133 HA THR 133 46.608 17.552 11.994 933 HB THR 133 HB THR 133 47.965 16.081 10.458 934 HG1 THR 133 HG1 THR 133 46.371 16.002 8.760 935 HG21 THR 133 HG21 THR 133 47.320 14.008 11.542 936 HG22 THR 133 HG22 THR 133 45.749 14.688 11.962 937 HG23 THR 133 HG23 THR 133 47.215 15.341 12.693
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